#include "/global/u2/j/jkretchm/gromos53a6.ff/forcefield.itp" [ moleculetype ] Azurin2state 3 [ atoms ] 1 NL 1 ALA N 1 +0.129 14.0067 NL +0.129 14.0067 2 H 1 ALA H1 1 +0.248 1.0080 H +0.248 1.0080 3 H 1 ALA H2 1 +0.248 1.0080 H +0.248 1.0080 4 H 1 ALA H3 1 +0.248 1.0080 H +0.248 1.0080 5 CH1 1 ALA CA 2 +0.127 13.0190 CH1 +0.127 13.0190 6 CH3 1 ALA CB 2 +0.000 15.0350 CH3 +0.000 15.0350 7 C 1 ALA C 3 +0.450 12.0110 C +0.450 12.0110 8 O 1 ALA O 3 -0.450 15.9994 O -0.450 15.9994 9 N 2 GLU N 4 -0.310 14.0067 N -0.310 14.0067 10 H 2 GLU H 4 +0.310 1.0080 H +0.310 1.0080 11 CH1 2 GLU CA 5 +0.000 13.0190 CH1 +0.000 13.0190 12 CH2 2 GLU CB 5 +0.000 14.0270 CH2 +0.000 14.0270 13 CH2 2 GLU CG 5 +0.000 14.0270 CH2 +0.000 14.0270 14 C 2 GLU CD 6 +0.270 12.0110 C +0.270 12.0110 15 OM 2 GLU OE1 6 -0.635 15.9994 OM -0.635 15.9994 16 OM 2 GLU OE2 6 -0.635 15.9994 OM -0.635 15.9994 17 C 2 GLU C 7 +0.450 12.0110 C +0.450 12.0110 18 O 2 GLU O 7 -0.450 15.9994 O -0.450 15.9994 19 N 3 CYS N 8 -0.310 14.0067 N -0.310 14.0067 20 H 3 CYS H 8 +0.310 1.0080 H +0.310 1.0080 21 CH1 3 CYS CA 9 +0.000 13.0190 CH1 +0.000 13.0190 22 CH2 3 CYS CB 9 +0.000 14.0270 CH2 +0.000 14.0270 23 S 3 CYS SG 9 +0.000 32.0600 S +0.000 32.0600 24 C 3 CYS C 10 +0.450 12.0110 C +0.450 12.0110 25 O 3 CYS O 10 -0.450 15.9994 O -0.450 15.9994 26 N 4 SER N 11 -0.310 14.0067 N -0.310 14.0067 27 H 4 SER H 11 +0.310 1.0080 H +0.310 1.0080 28 CH1 4 SER CA 12 +0.000 13.0190 CH1 +0.000 13.0190 29 CH2 4 SER CB 13 +0.266 14.0270 CH2 +0.266 14.0270 30 OA 4 SER OG 13 -0.674 15.9994 OA -0.674 15.9994 31 H 4 SER HG 13 +0.408 1.0080 H +0.408 1.0080 32 C 4 SER C 14 +0.450 12.0110 C +0.450 12.0110 33 O 4 SER O 14 -0.450 15.9994 O -0.450 15.9994 34 N 5 VAL N 15 -0.310 14.0067 N -0.310 14.0067 35 H 5 VAL H 15 +0.310 1.0080 H +0.310 1.0080 36 CH1 5 VAL CA 16 +0.000 13.0190 CH1 +0.000 13.0190 37 CH1 5 VAL CB 16 +0.000 13.0190 CH1 +0.000 13.0190 38 CH3 5 VAL CG1 16 +0.000 15.0350 CH3 +0.000 15.0350 39 CH3 5 VAL CG2 16 +0.000 15.0350 CH3 +0.000 15.0350 40 C 5 VAL C 17 +0.450 12.0110 C +0.450 12.0110 41 O 5 VAL O 17 -0.450 15.9994 O -0.450 15.9994 42 N 6 ASP N 18 -0.310 14.0067 N -0.310 14.0067 43 H 6 ASP H 18 +0.310 1.0080 H +0.310 1.0080 44 CH1 6 ASP CA 19 +0.000 13.0190 CH1 +0.000 13.0190 45 CH2 6 ASP CB 19 +0.000 14.0270 CH2 +0.000 14.0270 46 C 6 ASP CG 20 +0.270 12.0110 C +0.270 12.0110 47 OM 6 ASP OD1 20 -0.635 15.9994 OM -0.635 15.9994 48 OM 6 ASP OD2 20 -0.635 15.9994 OM -0.635 15.9994 49 C 6 ASP C 21 +0.450 12.0110 C +0.450 12.0110 50 O 6 ASP O 21 -0.450 15.9994 O -0.450 15.9994 51 N 7 ILE N 22 -0.310 14.0067 N -0.310 14.0067 52 H 7 ILE H 22 +0.310 1.0080 H +0.310 1.0080 53 CH1 7 ILE CA 23 +0.000 13.0190 CH1 +0.000 13.0190 54 CH1 7 ILE CB 24 +0.000 13.0190 CH1 +0.000 13.0190 55 CH2 7 ILE CG1 24 +0.000 14.0270 CH2 +0.000 14.0270 56 CH3 7 ILE CG2 24 +0.000 15.0350 CH3 +0.000 15.0350 57 CH3 7 ILE CD 24 +0.000 15.0350 CH3 +0.000 15.0350 58 C 7 ILE C 25 +0.450 12.0110 C +0.450 12.0110 59 O 7 ILE O 25 -0.450 15.9994 O -0.450 15.9994 60 N 8 GLN N 26 -0.310 14.0067 N -0.310 14.0067 61 H 8 GLN H 26 +0.310 1.0080 H +0.310 1.0080 62 CH1 8 GLN CA 27 +0.000 13.0190 CH1 +0.000 13.0190 63 CH2 8 GLN CB 27 +0.000 14.0270 CH2 +0.000 14.0270 64 CH2 8 GLN CG 27 +0.000 14.0270 CH2 +0.000 14.0270 65 C 8 GLN CD 28 +0.290 12.0110 C +0.290 12.0110 66 O 8 GLN OE1 28 -0.450 15.9994 O -0.450 15.9994 67 NT 8 GLN NE2 28 -0.720 14.0067 NT -0.720 14.0067 68 H 8 GLN HE21 28 +0.440 1.0080 H +0.440 1.0080 69 H 8 GLN HE22 28 +0.440 1.0080 H +0.440 1.0080 70 C 8 GLN C 29 +0.450 12.0110 C +0.450 12.0110 71 O 8 GLN O 29 -0.450 15.9994 O -0.450 15.9994 72 N 9 GLY N 30 -0.310 14.0067 N -0.310 14.0067 73 H 9 GLY H 30 +0.310 1.0080 H +0.310 1.0080 74 CH2 9 GLY CA 31 +0.000 14.0270 CH2 +0.000 14.0270 75 C 9 GLY C 32 +0.450 12.0110 C +0.450 12.0110 76 O 9 GLY O 32 -0.450 15.9994 O -0.450 15.9994 77 N 10 ASN N 33 -0.310 14.0067 N -0.310 14.0067 78 H 10 ASN H 33 +0.310 1.0080 H +0.310 1.0080 79 CH1 10 ASN CA 34 +0.000 13.0190 CH1 +0.000 13.0190 80 CH2 10 ASN CB 34 +0.000 14.0270 CH2 +0.000 14.0270 81 C 10 ASN CG 35 +0.290 12.0110 C +0.290 12.0110 82 O 10 ASN OD1 35 -0.450 15.9994 O -0.450 15.9994 83 NT 10 ASN ND2 35 -0.720 14.0067 NT -0.720 14.0067 84 H 10 ASN HD21 35 +0.440 1.0080 H +0.440 1.0080 85 H 10 ASN HD22 35 +0.440 1.0080 H +0.440 1.0080 86 C 10 ASN C 36 +0.450 12.0110 C +0.450 12.0110 87 O 10 ASN O 36 -0.450 15.9994 O -0.450 15.9994 88 N 11 ASP N 37 -0.310 14.0067 N -0.310 14.0067 89 H 11 ASP H 37 +0.310 1.0080 H +0.310 1.0080 90 CH1 11 ASP CA 38 +0.000 13.0190 CH1 +0.000 13.0190 91 CH2 11 ASP CB 38 +0.000 14.0270 CH2 +0.000 14.0270 92 C 11 ASP CG 39 +0.270 12.0110 C +0.270 12.0110 93 OM 11 ASP OD1 39 -0.635 15.9994 OM -0.635 15.9994 94 OM 11 ASP OD2 39 -0.635 15.9994 OM -0.635 15.9994 95 C 11 ASP C 40 +0.450 12.0110 C +0.450 12.0110 96 O 11 ASP O 40 -0.450 15.9994 O -0.450 15.9994 97 N 12 GLN N 41 -0.310 14.0067 N -0.310 14.0067 98 H 12 GLN H 41 +0.310 1.0080 H +0.310 1.0080 99 CH1 12 GLN CA 42 +0.000 13.0190 CH1 +0.000 13.0190 100 CH2 12 GLN CB 42 +0.000 14.0270 CH2 +0.000 14.0270 101 CH2 12 GLN CG 42 +0.000 14.0270 CH2 +0.000 14.0270 102 C 12 GLN CD 43 +0.290 12.0110 C +0.290 12.0110 103 O 12 GLN OE1 43 -0.450 15.9994 O -0.450 15.9994 104 NT 12 GLN NE2 43 -0.720 14.0067 NT -0.720 14.0067 105 H 12 GLN HE21 43 +0.440 1.0080 H +0.440 1.0080 106 H 12 GLN HE22 43 +0.440 1.0080 H +0.440 1.0080 107 C 12 GLN C 44 +0.450 12.0110 C +0.450 12.0110 108 O 12 GLN O 44 -0.450 15.9994 O -0.450 15.9994 109 N 13 MET N 45 -0.310 14.0067 N -0.310 14.0067 110 H 13 MET H 45 +0.310 1.0080 H +0.310 1.0080 111 CH1 13 MET CA 46 +0.000 13.0190 CH1 +0.000 13.0190 112 CH2 13 MET CB 46 +0.000 14.0270 CH2 +0.000 14.0270 113 CH2 13 MET CG 47 +0.241 14.0270 CH2 +0.241 14.0270 114 S 13 MET SD 47 -0.482 32.0600 S -0.482 32.0600 115 CH3 13 MET CE 47 +0.241 15.0350 CH3 +0.241 15.0350 116 C 13 MET C 48 +0.450 12.0110 C +0.450 12.0110 117 O 13 MET O 48 -0.450 15.9994 O -0.450 15.9994 118 N 14 GLN N 49 -0.310 14.0067 N -0.310 14.0067 119 H 14 GLN H 49 +0.310 1.0080 H +0.310 1.0080 120 CH1 14 GLN CA 50 +0.000 13.0190 CH1 +0.000 13.0190 121 CH2 14 GLN CB 50 +0.000 14.0270 CH2 +0.000 14.0270 122 CH2 14 GLN CG 50 +0.000 14.0270 CH2 +0.000 14.0270 123 C 14 GLN CD 51 +0.290 12.0110 C +0.290 12.0110 124 O 14 GLN OE1 51 -0.450 15.9994 O -0.450 15.9994 125 NT 14 GLN NE2 51 -0.720 14.0067 NT -0.720 14.0067 126 H 14 GLN HE21 51 +0.440 1.0080 H +0.440 1.0080 127 H 14 GLN HE22 51 +0.440 1.0080 H +0.440 1.0080 128 C 14 GLN C 52 +0.450 12.0110 C +0.450 12.0110 129 O 14 GLN O 52 -0.450 15.9994 O -0.450 15.9994 130 N 15 PHE N 53 -0.310 14.0067 N -0.310 14.0067 131 H 15 PHE H 53 +0.310 1.0080 H +0.310 1.0080 132 CH1 15 PHE CA 54 +0.000 13.0190 CH1 +0.000 13.0190 133 CH2 15 PHE CB 54 +0.000 14.0270 CH2 +0.000 14.0270 134 C 15 PHE CG 54 +0.000 12.0110 C +0.000 12.0110 135 C 15 PHE CD1 55 -0.140 12.0110 C -0.140 12.0110 136 HC 15 PHE HD1 55 +0.140 1.0080 HC +0.140 1.0080 137 C 15 PHE CD2 56 -0.140 12.0110 C -0.140 12.0110 138 HC 15 PHE HD2 56 +0.140 1.0080 HC +0.140 1.0080 139 C 15 PHE CE1 57 -0.140 12.0110 C -0.140 12.0110 140 HC 15 PHE HE1 57 +0.140 1.0080 HC +0.140 1.0080 141 C 15 PHE CE2 58 -0.140 12.0110 C -0.140 12.0110 142 HC 15 PHE HE2 58 +0.140 1.0080 HC +0.140 1.0080 143 C 15 PHE CZ 59 -0.140 12.0110 C -0.140 12.0110 144 HC 15 PHE HZ 59 +0.140 1.0080 HC +0.140 1.0080 145 C 15 PHE C 60 +0.450 12.0110 C +0.450 12.0110 146 O 15 PHE O 60 -0.450 15.9994 O -0.450 15.9994 147 N 16 ASN N 61 -0.310 14.0067 N -0.310 14.0067 148 H 16 ASN H 61 +0.310 1.0080 H +0.310 1.0080 149 CH1 16 ASN CA 62 +0.000 13.0190 CH1 +0.000 13.0190 150 CH2 16 ASN CB 62 +0.000 14.0270 CH2 +0.000 14.0270 151 C 16 ASN CG 63 +0.290 12.0110 C +0.290 12.0110 152 O 16 ASN OD1 63 -0.450 15.9994 O -0.450 15.9994 153 NT 16 ASN ND2 63 -0.720 14.0067 NT -0.720 14.0067 154 H 16 ASN HD21 63 +0.440 1.0080 H +0.440 1.0080 155 H 16 ASN HD22 63 +0.440 1.0080 H +0.440 1.0080 156 C 16 ASN C 64 +0.450 12.0110 C +0.450 12.0110 157 O 16 ASN O 64 -0.450 15.9994 O -0.450 15.9994 158 N 17 THR N 65 -0.310 14.0067 N -0.310 14.0067 159 H 17 THR H 65 +0.310 1.0080 H +0.310 1.0080 160 CH1 17 THR CA 66 +0.000 13.0190 CH1 +0.000 13.0190 161 CH1 17 THR CB 67 +0.266 13.0190 CH1 +0.266 13.0190 162 OA 17 THR OG1 67 -0.674 15.9994 OA -0.674 15.9994 163 H 17 THR HG1 67 +0.408 1.0080 H +0.408 1.0080 164 CH3 17 THR CG2 68 +0.000 15.0350 CH3 +0.000 15.0350 165 C 17 THR C 69 +0.450 12.0110 C +0.450 12.0110 166 O 17 THR O 69 -0.450 15.9994 O -0.450 15.9994 167 N 18 ASN N 70 -0.310 14.0067 N -0.310 14.0067 168 H 18 ASN H 70 +0.310 1.0080 H +0.310 1.0080 169 CH1 18 ASN CA 71 +0.000 13.0190 CH1 +0.000 13.0190 170 CH2 18 ASN CB 71 +0.000 14.0270 CH2 +0.000 14.0270 171 C 18 ASN CG 72 +0.290 12.0110 C +0.290 12.0110 172 O 18 ASN OD1 72 -0.450 15.9994 O -0.450 15.9994 173 NT 18 ASN ND2 72 -0.720 14.0067 NT -0.720 14.0067 174 H 18 ASN HD21 72 +0.440 1.0080 H +0.440 1.0080 175 H 18 ASN HD22 72 +0.440 1.0080 H +0.440 1.0080 176 C 18 ASN C 73 +0.450 12.0110 C +0.450 12.0110 177 O 18 ASN O 73 -0.450 15.9994 O -0.450 15.9994 178 N 19 ALA N 74 -0.310 14.0067 N -0.310 14.0067 179 H 19 ALA H 74 +0.310 1.0080 H +0.310 1.0080 180 CH1 19 ALA CA 75 +0.000 13.0190 CH1 +0.000 13.0190 181 CH3 19 ALA CB 75 +0.000 15.0350 CH3 +0.000 15.0350 182 C 19 ALA C 76 +0.450 12.0110 C +0.450 12.0110 183 O 19 ALA O 76 -0.450 15.9994 O -0.450 15.9994 184 N 20 ILE N 77 -0.310 14.0067 N -0.310 14.0067 185 H 20 ILE H 77 +0.310 1.0080 H +0.310 1.0080 186 CH1 20 ILE CA 78 +0.000 13.0190 CH1 +0.000 13.0190 187 CH1 20 ILE CB 79 +0.000 13.0190 CH1 +0.000 13.0190 188 CH2 20 ILE CG1 79 +0.000 14.0270 CH2 +0.000 14.0270 189 CH3 20 ILE CG2 79 +0.000 15.0350 CH3 +0.000 15.0350 190 CH3 20 ILE CD 79 +0.000 15.0350 CH3 +0.000 15.0350 191 C 20 ILE C 80 +0.450 12.0110 C +0.450 12.0110 192 O 20 ILE O 80 -0.450 15.9994 O -0.450 15.9994 193 N 21 THR N 81 -0.310 14.0067 N -0.310 14.0067 194 H 21 THR H 81 +0.310 1.0080 H +0.310 1.0080 195 CH1 21 THR CA 82 +0.000 13.0190 CH1 +0.000 13.0190 196 CH1 21 THR CB 83 +0.266 13.0190 CH1 +0.266 13.0190 197 OA 21 THR OG1 83 -0.674 15.9994 OA -0.674 15.9994 198 H 21 THR HG1 83 +0.408 1.0080 H +0.408 1.0080 199 CH3 21 THR CG2 84 +0.000 15.0350 CH3 +0.000 15.0350 200 C 21 THR C 85 +0.450 12.0110 C +0.450 12.0110 201 O 21 THR O 85 -0.450 15.9994 O -0.450 15.9994 202 N 22 VAL N 86 -0.310 14.0067 N -0.310 14.0067 203 H 22 VAL H 86 +0.310 1.0080 H +0.310 1.0080 204 CH1 22 VAL CA 87 +0.000 13.0190 CH1 +0.000 13.0190 205 CH1 22 VAL CB 87 +0.000 13.0190 CH1 +0.000 13.0190 206 CH3 22 VAL CG1 87 +0.000 15.0350 CH3 +0.000 15.0350 207 CH3 22 VAL CG2 87 +0.000 15.0350 CH3 +0.000 15.0350 208 C 22 VAL C 88 +0.450 12.0110 C +0.450 12.0110 209 O 22 VAL O 88 -0.450 15.9994 O -0.450 15.9994 210 N 23 ASP N 89 -0.310 14.0067 N -0.310 14.0067 211 H 23 ASP H 89 +0.310 1.0080 H +0.310 1.0080 212 CH1 23 ASP CA 90 +0.000 13.0190 CH1 +0.000 13.0190 213 CH2 23 ASP CB 90 +0.000 14.0270 CH2 +0.000 14.0270 214 C 23 ASP CG 91 +0.270 12.0110 C +0.270 12.0110 215 OM 23 ASP OD1 91 -0.635 15.9994 OM -0.635 15.9994 216 OM 23 ASP OD2 91 -0.635 15.9994 OM -0.635 15.9994 217 C 23 ASP C 92 +0.450 12.0110 C +0.450 12.0110 218 O 23 ASP O 92 -0.450 15.9994 O -0.450 15.9994 219 N 24 LYS N 93 -0.310 14.0067 N -0.310 14.0067 220 H 24 LYS H 93 +0.310 1.0080 H +0.310 1.0080 221 CH1 24 LYS CA 94 +0.000 13.0190 CH1 +0.000 13.0190 222 CH2 24 LYS CB 94 +0.000 14.0270 CH2 +0.000 14.0270 223 CH2 24 LYS CG 95 +0.000 14.0270 CH2 +0.000 14.0270 224 CH2 24 LYS CD 95 +0.000 14.0270 CH2 +0.000 14.0270 225 CH2 24 LYS CE 96 +0.127 14.0270 CH2 +0.127 14.0270 226 NL 24 LYS NZ 96 +0.129 14.0067 NL +0.129 14.0067 227 H 24 LYS HZ1 96 +0.248 1.0080 H +0.248 1.0080 228 H 24 LYS HZ2 96 +0.248 1.0080 H +0.248 1.0080 229 H 24 LYS HZ3 96 +0.248 1.0080 H +0.248 1.0080 230 C 24 LYS C 97 +0.450 12.0110 C +0.450 12.0110 231 O 24 LYS O 97 -0.450 15.9994 O -0.450 15.9994 232 N 25 SER N 98 -0.310 14.0067 N -0.310 14.0067 233 H 25 SER H 98 +0.310 1.0080 H +0.310 1.0080 234 CH1 25 SER CA 99 +0.000 13.0190 CH1 +0.000 13.0190 235 CH2 25 SER CB 100 +0.266 14.0270 CH2 +0.266 14.0270 236 OA 25 SER OG 100 -0.674 15.9994 OA -0.674 15.9994 237 H 25 SER HG 100 +0.408 1.0080 H +0.408 1.0080 238 C 25 SER C 101 +0.450 12.0110 C +0.450 12.0110 239 O 25 SER O 101 -0.450 15.9994 O -0.450 15.9994 240 N 26 CYS N 102 -0.310 14.0067 N -0.310 14.0067 241 H 26 CYS H 102 +0.310 1.0080 H +0.310 1.0080 242 CH1 26 CYS CA 103 +0.000 13.0190 CH1 +0.000 13.0190 243 CH2 26 CYS CB 103 +0.000 14.0270 CH2 +0.000 14.0270 244 S 26 CYS SG 103 +0.000 32.0600 S +0.000 32.0600 245 C 26 CYS C 104 +0.450 12.0110 C +0.450 12.0110 246 O 26 CYS O 104 -0.450 15.9994 O -0.450 15.9994 247 N 27 LYS N 105 -0.310 14.0067 N -0.310 14.0067 248 H 27 LYS H 105 +0.310 1.0080 H +0.310 1.0080 249 CH1 27 LYS CA 106 +0.000 13.0190 CH1 +0.000 13.0190 250 CH2 27 LYS CB 106 +0.000 14.0270 CH2 +0.000 14.0270 251 CH2 27 LYS CG 107 +0.000 14.0270 CH2 +0.000 14.0270 252 CH2 27 LYS CD 107 +0.000 14.0270 CH2 +0.000 14.0270 253 CH2 27 LYS CE 108 +0.127 14.0270 CH2 +0.127 14.0270 254 NL 27 LYS NZ 108 +0.129 14.0067 NL +0.129 14.0067 255 H 27 LYS HZ1 108 +0.248 1.0080 H +0.248 1.0080 256 H 27 LYS HZ2 108 +0.248 1.0080 H +0.248 1.0080 257 H 27 LYS HZ3 108 +0.248 1.0080 H +0.248 1.0080 258 C 27 LYS C 109 +0.450 12.0110 C +0.450 12.0110 259 O 27 LYS O 109 -0.450 15.9994 O -0.450 15.9994 260 N 28 GLN N 110 -0.310 14.0067 N -0.310 14.0067 261 H 28 GLN H 110 +0.310 1.0080 H +0.310 1.0080 262 CH1 28 GLN CA 111 +0.000 13.0190 CH1 +0.000 13.0190 263 CH2 28 GLN CB 111 +0.000 14.0270 CH2 +0.000 14.0270 264 CH2 28 GLN CG 111 +0.000 14.0270 CH2 +0.000 14.0270 265 C 28 GLN CD 112 +0.290 12.0110 C +0.290 12.0110 266 O 28 GLN OE1 112 -0.450 15.9994 O -0.450 15.9994 267 NT 28 GLN NE2 112 -0.720 14.0067 NT -0.720 14.0067 268 H 28 GLN HE21 112 +0.440 1.0080 H +0.440 1.0080 269 H 28 GLN HE22 112 +0.440 1.0080 H +0.440 1.0080 270 C 28 GLN C 113 +0.450 12.0110 C +0.450 12.0110 271 O 28 GLN O 113 -0.450 15.9994 O -0.450 15.9994 272 N 29 PHE N 114 -0.310 14.0067 N -0.310 14.0067 273 H 29 PHE H 114 +0.310 1.0080 H +0.310 1.0080 274 CH1 29 PHE CA 115 +0.000 13.0190 CH1 +0.000 13.0190 275 CH2 29 PHE CB 115 +0.000 14.0270 CH2 +0.000 14.0270 276 C 29 PHE CG 115 +0.000 12.0110 C +0.000 12.0110 277 C 29 PHE CD1 116 -0.140 12.0110 C -0.140 12.0110 278 HC 29 PHE HD1 116 +0.140 1.0080 HC +0.140 1.0080 279 C 29 PHE CD2 117 -0.140 12.0110 C -0.140 12.0110 280 HC 29 PHE HD2 117 +0.140 1.0080 HC +0.140 1.0080 281 C 29 PHE CE1 118 -0.140 12.0110 C -0.140 12.0110 282 HC 29 PHE HE1 118 +0.140 1.0080 HC +0.140 1.0080 283 C 29 PHE CE2 119 -0.140 12.0110 C -0.140 12.0110 284 HC 29 PHE HE2 119 +0.140 1.0080 HC +0.140 1.0080 285 C 29 PHE CZ 120 -0.140 12.0110 C -0.140 12.0110 286 HC 29 PHE HZ 120 +0.140 1.0080 HC +0.140 1.0080 287 C 29 PHE C 121 +0.450 12.0110 C +0.450 12.0110 288 O 29 PHE O 121 -0.450 15.9994 O -0.450 15.9994 289 N 30 THR N 122 -0.310 14.0067 N -0.310 14.0067 290 H 30 THR H 122 +0.310 1.0080 H +0.310 1.0080 291 CH1 30 THR CA 123 +0.000 13.0190 CH1 +0.000 13.0190 292 CH1 30 THR CB 124 +0.266 13.0190 CH1 +0.266 13.0190 293 OA 30 THR OG1 124 -0.674 15.9994 OA -0.674 15.9994 294 H 30 THR HG1 124 +0.408 1.0080 H +0.408 1.0080 295 CH3 30 THR CG2 125 +0.000 15.0350 CH3 +0.000 15.0350 296 C 30 THR C 126 +0.450 12.0110 C +0.450 12.0110 297 O 30 THR O 126 -0.450 15.9994 O -0.450 15.9994 298 N 31 VAL N 127 -0.310 14.0067 N -0.310 14.0067 299 H 31 VAL H 127 +0.310 1.0080 H +0.310 1.0080 300 CH1 31 VAL CA 128 +0.000 13.0190 CH1 +0.000 13.0190 301 CH1 31 VAL CB 128 +0.000 13.0190 CH1 +0.000 13.0190 302 CH3 31 VAL CG1 128 +0.000 15.0350 CH3 +0.000 15.0350 303 CH3 31 VAL CG2 128 +0.000 15.0350 CH3 +0.000 15.0350 304 C 31 VAL C 129 +0.450 12.0110 C +0.450 12.0110 305 O 31 VAL O 129 -0.450 15.9994 O -0.450 15.9994 306 N 32 ASN N 130 -0.310 14.0067 N -0.310 14.0067 307 H 32 ASN H 130 +0.310 1.0080 H +0.310 1.0080 308 CH1 32 ASN CA 131 +0.000 13.0190 CH1 +0.000 13.0190 309 CH2 32 ASN CB 131 +0.000 14.0270 CH2 +0.000 14.0270 310 C 32 ASN CG 132 +0.290 12.0110 C +0.290 12.0110 311 O 32 ASN OD1 132 -0.450 15.9994 O -0.450 15.9994 312 NT 32 ASN ND2 132 -0.720 14.0067 NT -0.720 14.0067 313 H 32 ASN HD21 132 +0.440 1.0080 H +0.440 1.0080 314 H 32 ASN HD22 132 +0.440 1.0080 H +0.440 1.0080 315 C 32 ASN C 133 +0.450 12.0110 C +0.450 12.0110 316 O 32 ASN O 133 -0.450 15.9994 O -0.450 15.9994 317 N 33 LEU N 134 -0.310 14.0067 N -0.310 14.0067 318 H 33 LEU H 134 +0.310 1.0080 H +0.310 1.0080 319 CH1 33 LEU CA 135 +0.000 13.0190 CH1 +0.000 13.0190 320 CH2 33 LEU CB 135 +0.000 14.0270 CH2 +0.000 14.0270 321 CH1 33 LEU CG 136 +0.000 13.0190 CH1 +0.000 13.0190 322 CH3 33 LEU CD1 136 +0.000 15.0350 CH3 +0.000 15.0350 323 CH3 33 LEU CD2 136 +0.000 15.0350 CH3 +0.000 15.0350 324 C 33 LEU C 137 +0.450 12.0110 C +0.450 12.0110 325 O 33 LEU O 137 -0.450 15.9994 O -0.450 15.9994 326 N 34 SER N 138 -0.310 14.0067 N -0.310 14.0067 327 H 34 SER H 138 +0.310 1.0080 H +0.310 1.0080 328 CH1 34 SER CA 139 +0.000 13.0190 CH1 +0.000 13.0190 329 CH2 34 SER CB 140 +0.266 14.0270 CH2 +0.266 14.0270 330 OA 34 SER OG 140 -0.674 15.9994 OA -0.674 15.9994 331 H 34 SER HG 140 +0.408 1.0080 H +0.408 1.0080 332 C 34 SER C 141 +0.450 12.0110 C +0.450 12.0110 333 O 34 SER O 141 -0.450 15.9994 O -0.450 15.9994 334 N 35 HIS N 142 -0.310 14.0067 N -0.310 14.0067 335 H 35 HIS H 142 +0.310 1.0080 H +0.310 1.0080 336 CH1 35 HIS CA 143 +0.000 13.0190 CH1 +0.000 13.0190 337 CH2 35 HIS CB 143 +0.000 14.0270 CH2 +0.000 14.0270 338 C 35 HIS CG 144 +0.000 12.0110 C +0.000 12.0110 339 NR 35 HIS ND1 144 -0.540 14.0067 NR -0.540 14.0067 340 C 35 HIS CD2 144 +0.000 12.0110 C +0.000 12.0110 341 HC 35 HIS HD2 144 +0.140 1.0080 HC +0.140 1.0080 342 C 35 HIS CE1 144 +0.000 12.0110 C +0.000 12.0110 343 HC 35 HIS HE1 144 +0.140 1.0080 HC +0.140 1.0080 344 NR 35 HIS NE2 144 -0.050 14.0067 NR -0.050 14.0067 345 H 35 HIS HE2 144 +0.310 1.0080 H +0.310 1.0080 346 C 35 HIS C 145 +0.450 12.0110 C +0.450 12.0110 347 O 35 HIS O 145 -0.450 15.9994 O -0.450 15.9994 348 N 36 PRO N 146 +0.000 14.0067 N +0.000 14.0067 349 CH1 36 PRO CA 147 +0.000 13.0190 CH1 +0.000 13.0190 350 CH2r 36 PRO CB 147 +0.000 14.0270 CH2r +0.000 14.0270 351 CH2r 36 PRO CG 148 +0.000 14.0270 CH2r +0.000 14.0270 352 CH2r 36 PRO CD 148 +0.000 14.0270 CH2r +0.000 14.0270 353 C 36 PRO C 149 +0.450 12.0110 C +0.450 12.0110 354 O 36 PRO O 149 -0.450 15.9994 O -0.450 15.9994 355 N 37 GLY N 150 -0.310 14.0067 N -0.310 14.0067 356 H 37 GLY H 150 +0.310 1.0080 H +0.310 1.0080 357 CH2 37 GLY CA 151 +0.000 14.0270 CH2 +0.000 14.0270 358 C 37 GLY C 152 +0.450 12.0110 C +0.450 12.0110 359 O 37 GLY O 152 -0.450 15.9994 O -0.450 15.9994 360 N 38 ASN N 153 -0.310 14.0067 N -0.310 14.0067 361 H 38 ASN H 153 +0.310 1.0080 H +0.310 1.0080 362 CH1 38 ASN CA 154 +0.000 13.0190 CH1 +0.000 13.0190 363 CH2 38 ASN CB 154 +0.000 14.0270 CH2 +0.000 14.0270 364 C 38 ASN CG 155 +0.290 12.0110 C +0.290 12.0110 365 O 38 ASN OD1 155 -0.450 15.9994 O -0.450 15.9994 366 NT 38 ASN ND2 155 -0.720 14.0067 NT -0.720 14.0067 367 H 38 ASN HD21 155 +0.440 1.0080 H +0.440 1.0080 368 H 38 ASN HD22 155 +0.440 1.0080 H +0.440 1.0080 369 C 38 ASN C 156 +0.450 12.0110 C +0.450 12.0110 370 O 38 ASN O 156 -0.450 15.9994 O -0.450 15.9994 371 N 39 LEU N 157 -0.310 14.0067 N -0.310 14.0067 372 H 39 LEU H 157 +0.310 1.0080 H +0.310 1.0080 373 CH1 39 LEU CA 158 +0.000 13.0190 CH1 +0.000 13.0190 374 CH2 39 LEU CB 158 +0.000 14.0270 CH2 +0.000 14.0270 375 CH1 39 LEU CG 159 +0.000 13.0190 CH1 +0.000 13.0190 376 CH3 39 LEU CD1 159 +0.000 15.0350 CH3 +0.000 15.0350 377 CH3 39 LEU CD2 159 +0.000 15.0350 CH3 +0.000 15.0350 378 C 39 LEU C 160 +0.450 12.0110 C +0.450 12.0110 379 O 39 LEU O 160 -0.450 15.9994 O -0.450 15.9994 380 N 40 PRO N 161 +0.000 14.0067 N +0.000 14.0067 381 CH1 40 PRO CA 162 +0.000 13.0190 CH1 +0.000 13.0190 382 CH2r 40 PRO CB 162 +0.000 14.0270 CH2r +0.000 14.0270 383 CH2r 40 PRO CG 163 +0.000 14.0270 CH2r +0.000 14.0270 384 CH2r 40 PRO CD 163 +0.000 14.0270 CH2r +0.000 14.0270 385 C 40 PRO C 164 +0.450 12.0110 C +0.450 12.0110 386 O 40 PRO O 164 -0.450 15.9994 O -0.450 15.9994 387 N 41 LYS N 165 -0.310 14.0067 N -0.310 14.0067 388 H 41 LYS H 165 +0.310 1.0080 H +0.310 1.0080 389 CH1 41 LYS CA 166 +0.000 13.0190 CH1 +0.000 13.0190 390 CH2 41 LYS CB 166 +0.000 14.0270 CH2 +0.000 14.0270 391 CH2 41 LYS CG 167 +0.000 14.0270 CH2 +0.000 14.0270 392 CH2 41 LYS CD 167 +0.000 14.0270 CH2 +0.000 14.0270 393 CH2 41 LYS CE 168 +0.127 14.0270 CH2 +0.127 14.0270 394 NL 41 LYS NZ 168 +0.129 14.0067 NL +0.129 14.0067 395 H 41 LYS HZ1 168 +0.248 1.0080 H +0.248 1.0080 396 H 41 LYS HZ2 168 +0.248 1.0080 H +0.248 1.0080 397 H 41 LYS HZ3 168 +0.248 1.0080 H +0.248 1.0080 398 C 41 LYS C 169 +0.450 12.0110 C +0.450 12.0110 399 O 41 LYS O 169 -0.450 15.9994 O -0.450 15.9994 400 N 42 ASN N 170 -0.310 14.0067 N -0.310 14.0067 401 H 42 ASN H 170 +0.310 1.0080 H +0.310 1.0080 402 CH1 42 ASN CA 171 +0.000 13.0190 CH1 +0.000 13.0190 403 CH2 42 ASN CB 171 +0.000 14.0270 CH2 +0.000 14.0270 404 C 42 ASN CG 172 +0.290 12.0110 C +0.290 12.0110 405 O 42 ASN OD1 172 -0.450 15.9994 O -0.450 15.9994 406 NT 42 ASN ND2 172 -0.720 14.0067 NT -0.720 14.0067 407 H 42 ASN HD21 172 +0.440 1.0080 H +0.440 1.0080 408 H 42 ASN HD22 172 +0.440 1.0080 H +0.440 1.0080 409 C 42 ASN C 173 +0.450 12.0110 C +0.450 12.0110 410 O 42 ASN O 173 -0.450 15.9994 O -0.450 15.9994 411 N 43 VAL N 174 -0.310 14.0067 N -0.310 14.0067 412 H 43 VAL H 174 +0.310 1.0080 H +0.310 1.0080 413 CH1 43 VAL CA 175 +0.000 13.0190 CH1 +0.000 13.0190 414 CH1 43 VAL CB 175 +0.000 13.0190 CH1 +0.000 13.0190 415 CH3 43 VAL CG1 175 +0.000 15.0350 CH3 +0.000 15.0350 416 CH3 43 VAL CG2 175 +0.000 15.0350 CH3 +0.000 15.0350 417 C 43 VAL C 176 +0.450 12.0110 C +0.450 12.0110 418 O 43 VAL O 176 -0.450 15.9994 O -0.450 15.9994 419 N 44 MET N 177 -0.310 14.0067 N -0.310 14.0067 420 H 44 MET H 177 +0.310 1.0080 H +0.310 1.0080 421 CH1 44 MET CA 178 +0.000 13.0190 CH1 +0.000 13.0190 422 CH2 44 MET CB 178 +0.000 14.0270 CH2 +0.000 14.0270 423 CH2 44 MET CG 179 +0.241 14.0270 CH2 +0.241 14.0270 424 S 44 MET SD 179 -0.482 32.0600 S -0.482 32.0600 425 CH3 44 MET CE 179 +0.241 15.0350 CH3 +0.241 15.0350 426 C 44 MET C 180 +0.450 12.0110 C +0.450 12.0110 427 O 44 MET O 180 -0.450 15.9994 O -0.450 15.9994 428 N 45 GLY N 181 -0.310 14.0067 N -0.310 14.0067 429 H 45 GLY H 181 +0.310 1.0080 H +0.310 1.0080 430 CH2 45 GLY CA 182 +0.000 14.0270 CH2 +0.000 14.0270 431 C 45 GLY C 183 +0.450 12.0110 C +0.450 12.0110 432 O 45 GLY O 183 -0.45069 15.9994 O -0.42931 15.9994 433 N 46 HIS N 184 -0.310 14.0067 N -0.310 14.0067 434 H 46 HIS H 184 +0.310 1.0080 H +0.310 1.0080 435 CH1 46 HIS CA 185 +0.000 13.0190 CH1 +0.000 13.0190 436 CH2 46 HIS CB 185 +0.000 14.0270 CH2 +0.000 14.0270 437 C 46 HIS CG 186 -0.01806 12.0110 C -0.02194 12.0110 438 NR 46 HIS ND1 186 -0.21380 14.0067 NR -0.13220 14.0067 439 C 46 HIS CD2 186 -0.03513 12.0110 C -0.04387 12.0110 440 HC 46 HIS HD2 186 +0.12594 1.0080 HC +0.12206 1.0080 441 C 46 HIS CE1 186 -0.12044 12.0110 C -0.15056 12.0110 442 HC 46 HIS HE1 186 +0.12594 1.0080 HC +0.12206 1.0080 443 NR 46 HIS NE2 186 +0.07747 14.0067 NR +0.10953 14.0067 444 H 46 HIS HE2 186 +0.306 1.0080 H +0.306 1.0080 445 C 46 HIS C 187 +0.450 12.0110 C +0.450 12.0110 446 O 46 HIS O 187 -0.450 15.9994 O -0.450 15.9994 447 N 47 ASN N 188 -0.310 14.0067 N -0.310 14.0067 448 H 47 ASN H 188 +0.310 1.0080 H +0.310 1.0080 449 CH1 47 ASN CA 189 +0.000 13.0190 CH1 +0.000 13.0190 450 CH2 47 ASN CB 189 +0.000 14.0270 CH2 +0.000 14.0270 451 C 47 ASN CG 190 +0.290 12.0110 C +0.290 12.0110 452 O 47 ASN OD1 190 -0.450 15.9994 O -0.450 15.9994 453 NT 47 ASN ND2 190 -0.720 14.0067 NT -0.720 14.0067 454 H 47 ASN HD21 190 +0.440 1.0080 H +0.440 1.0080 455 H 47 ASN HD22 190 +0.440 1.0080 H +0.440 1.0080 456 C 47 ASN C 191 +0.450 12.0110 C +0.450 12.0110 457 O 47 ASN O 191 -0.450 15.9994 O -0.450 15.9994 458 N 48 TRP N 192 -0.310 14.0067 N -0.310 14.0067 459 H 48 TRP H 192 +0.310 1.0080 H +0.310 1.0080 460 CH1 48 TRP CA 193 +0.000 13.0190 CH1 +0.000 13.0190 461 CH2 48 TRP CB 193 +0.000 14.0270 CH2 +0.000 14.0270 462 C 48 TRP CG 194 -0.210 12.0110 C -0.210 12.0110 463 C 48 TRP CD1 194 -0.140 12.0110 C -0.140 12.0110 464 HC 48 TRP HD1 194 +0.140 1.0080 HC +0.140 1.0080 465 C 48 TRP CD2 194 +0.000 12.0110 C +0.000 12.0110 466 NR 48 TRP NE1 194 -0.100 14.0067 NR -0.100 14.0067 467 H 48 TRP HE1 194 +0.310 1.0080 H +0.310 1.0080 468 C 48 TRP CE2 194 +0.000 12.0110 C +0.000 12.0110 469 C 48 TRP CE3 195 -0.140 12.0110 C -0.140 12.0110 470 HC 48 TRP HE3 195 +0.140 1.0080 HC +0.140 1.0080 471 C 48 TRP CZ2 196 -0.140 12.0110 C -0.140 12.0110 472 HC 48 TRP HZ2 196 +0.140 1.0080 HC +0.140 1.0080 473 C 48 TRP CZ3 197 -0.140 12.0110 C -0.140 12.0110 474 HC 48 TRP HZ3 197 +0.140 1.0080 HC +0.140 1.0080 475 C 48 TRP CH2 198 -0.140 12.0110 C -0.140 12.0110 476 HC 48 TRP HH2 198 +0.140 1.0080 HC +0.140 1.0080 477 C 48 TRP C 199 +0.450 12.0110 C +0.450 12.0110 478 O 48 TRP O 199 -0.450 15.9994 O -0.450 15.9994 479 N 49 VAL N 200 -0.310 14.0067 N -0.310 14.0067 480 H 49 VAL H 200 +0.310 1.0080 H +0.310 1.0080 481 CH1 49 VAL CA 201 +0.000 13.0190 CH1 +0.000 13.0190 482 CH1 49 VAL CB 201 +0.000 13.0190 CH1 +0.000 13.0190 483 CH3 49 VAL CG1 201 +0.000 15.0350 CH3 +0.000 15.0350 484 CH3 49 VAL CG2 201 +0.000 15.0350 CH3 +0.000 15.0350 485 C 49 VAL C 202 +0.450 12.0110 C +0.450 12.0110 486 O 49 VAL O 202 -0.450 15.9994 O -0.450 15.9994 487 N 50 LEU N 203 -0.310 14.0067 N -0.310 14.0067 488 H 50 LEU H 203 +0.310 1.0080 H +0.310 1.0080 489 CH1 50 LEU CA 204 +0.000 13.0190 CH1 +0.000 13.0190 490 CH2 50 LEU CB 204 +0.000 14.0270 CH2 +0.000 14.0270 491 CH1 50 LEU CG 205 +0.000 13.0190 CH1 +0.000 13.0190 492 CH3 50 LEU CD1 205 +0.000 15.0350 CH3 +0.000 15.0350 493 CH3 50 LEU CD2 205 +0.000 15.0350 CH3 +0.000 15.0350 494 C 50 LEU C 206 +0.450 12.0110 C +0.450 12.0110 495 O 50 LEU O 206 -0.450 15.9994 O -0.450 15.9994 496 N 51 SER N 207 -0.310 14.0067 N -0.310 14.0067 497 H 51 SER H 207 +0.310 1.0080 H +0.310 1.0080 498 CH1 51 SER CA 208 +0.000 13.0190 CH1 +0.000 13.0190 499 CH2 51 SER CB 209 +0.266 14.0270 CH2 +0.266 14.0270 500 OA 51 SER OG 209 -0.674 15.9994 OA -0.674 15.9994 501 H 51 SER HG 209 +0.408 1.0080 H +0.408 1.0080 502 C 51 SER C 210 +0.450 12.0110 C +0.450 12.0110 503 O 51 SER O 210 -0.450 15.9994 O -0.450 15.9994 504 N 52 THR N 211 -0.310 14.0067 N -0.310 14.0067 505 H 52 THR H 211 +0.310 1.0080 H +0.310 1.0080 506 CH1 52 THR CA 212 +0.000 13.0190 CH1 +0.000 13.0190 507 CH1 52 THR CB 213 +0.266 13.0190 CH1 +0.266 13.0190 508 OA 52 THR OG1 213 -0.674 15.9994 OA -0.674 15.9994 509 H 52 THR HG1 213 +0.408 1.0080 H +0.408 1.0080 510 CH3 52 THR CG2 214 +0.000 15.0350 CH3 +0.000 15.0350 511 C 52 THR C 215 +0.450 12.0110 C +0.450 12.0110 512 O 52 THR O 215 -0.450 15.9994 O -0.450 15.9994 513 N 53 ALA N 216 -0.310 14.0067 N -0.310 14.0067 514 H 53 ALA H 216 +0.310 1.0080 H +0.310 1.0080 515 CH1 53 ALA CA 217 +0.000 13.0190 CH1 +0.000 13.0190 516 CH3 53 ALA CB 217 +0.000 15.0350 CH3 +0.000 15.0350 517 C 53 ALA C 218 +0.450 12.0110 C +0.450 12.0110 518 O 53 ALA O 218 -0.450 15.9994 O -0.450 15.9994 519 N 54 ALA N 219 -0.310 14.0067 N -0.310 14.0067 520 H 54 ALA H 219 +0.310 1.0080 H +0.310 1.0080 521 CH1 54 ALA CA 220 +0.000 13.0190 CH1 +0.000 13.0190 522 CH3 54 ALA CB 220 +0.000 15.0350 CH3 +0.000 15.0350 523 C 54 ALA C 221 +0.450 12.0110 C +0.450 12.0110 524 O 54 ALA O 221 -0.450 15.9994 O -0.450 15.9994 525 N 55 ASP N 222 -0.310 14.0067 N -0.310 14.0067 526 H 55 ASP H 222 +0.310 1.0080 H +0.310 1.0080 527 CH1 55 ASP CA 223 +0.000 13.0190 CH1 +0.000 13.0190 528 CH2 55 ASP CB 223 +0.000 14.0270 CH2 +0.000 14.0270 529 C 55 ASP CG 224 +0.270 12.0110 C +0.270 12.0110 530 OM 55 ASP OD1 224 -0.635 15.9994 OM -0.635 15.9994 531 OM 55 ASP OD2 224 -0.635 15.9994 OM -0.635 15.9994 532 C 55 ASP C 225 +0.450 12.0110 C +0.450 12.0110 533 O 55 ASP O 225 -0.450 15.9994 O -0.450 15.9994 534 N 56 MET N 226 -0.310 14.0067 N -0.310 14.0067 535 H 56 MET H 226 +0.310 1.0080 H +0.310 1.0080 536 CH1 56 MET CA 227 +0.000 13.0190 CH1 +0.000 13.0190 537 CH2 56 MET CB 227 +0.000 14.0270 CH2 +0.000 14.0270 538 CH2 56 MET CG 228 +0.241 14.0270 CH2 +0.241 14.0270 539 S 56 MET SD 228 -0.482 32.0600 S -0.482 32.0600 540 CH3 56 MET CE 228 +0.241 15.0350 CH3 +0.241 15.0350 541 C 56 MET C 229 +0.450 12.0110 C +0.450 12.0110 542 O 56 MET O 229 -0.450 15.9994 O -0.450 15.9994 543 N 57 GLN N 230 -0.310 14.0067 N -0.310 14.0067 544 H 57 GLN H 230 +0.310 1.0080 H +0.310 1.0080 545 CH1 57 GLN CA 231 +0.000 13.0190 CH1 +0.000 13.0190 546 CH2 57 GLN CB 231 +0.000 14.0270 CH2 +0.000 14.0270 547 CH2 57 GLN CG 231 +0.000 14.0270 CH2 +0.000 14.0270 548 C 57 GLN CD 232 +0.290 12.0110 C +0.290 12.0110 549 O 57 GLN OE1 232 -0.450 15.9994 O -0.450 15.9994 550 NT 57 GLN NE2 232 -0.720 14.0067 NT -0.720 14.0067 551 H 57 GLN HE21 232 +0.440 1.0080 H +0.440 1.0080 552 H 57 GLN HE22 232 +0.440 1.0080 H +0.440 1.0080 553 C 57 GLN C 233 +0.450 12.0110 C +0.450 12.0110 554 O 57 GLN O 233 -0.450 15.9994 O -0.450 15.9994 555 N 58 GLY N 234 -0.310 14.0067 N -0.310 14.0067 556 H 58 GLY H 234 +0.310 1.0080 H +0.310 1.0080 557 CH2 58 GLY CA 235 +0.000 14.0270 CH2 +0.000 14.0270 558 C 58 GLY C 236 +0.450 12.0110 C +0.450 12.0110 559 O 58 GLY O 236 -0.450 15.9994 O -0.450 15.9994 560 N 59 VAL N 237 -0.310 14.0067 N -0.310 14.0067 561 H 59 VAL H 237 +0.310 1.0080 H +0.310 1.0080 562 CH1 59 VAL CA 238 +0.000 13.0190 CH1 +0.000 13.0190 563 CH1 59 VAL CB 238 +0.000 13.0190 CH1 +0.000 13.0190 564 CH3 59 VAL CG1 238 +0.000 15.0350 CH3 +0.000 15.0350 565 CH3 59 VAL CG2 238 +0.000 15.0350 CH3 +0.000 15.0350 566 C 59 VAL C 239 +0.450 12.0110 C +0.450 12.0110 567 O 59 VAL O 239 -0.450 15.9994 O -0.450 15.9994 568 N 60 VAL N 240 -0.310 14.0067 N -0.310 14.0067 569 H 60 VAL H 240 +0.310 1.0080 H +0.310 1.0080 570 CH1 60 VAL CA 241 +0.000 13.0190 CH1 +0.000 13.0190 571 CH1 60 VAL CB 241 +0.000 13.0190 CH1 +0.000 13.0190 572 CH3 60 VAL CG1 241 +0.000 15.0350 CH3 +0.000 15.0350 573 CH3 60 VAL CG2 241 +0.000 15.0350 CH3 +0.000 15.0350 574 C 60 VAL C 242 +0.450 12.0110 C +0.450 12.0110 575 O 60 VAL O 242 -0.450 15.9994 O -0.450 15.9994 576 N 61 THR N 243 -0.310 14.0067 N -0.310 14.0067 577 H 61 THR H 243 +0.310 1.0080 H +0.310 1.0080 578 CH1 61 THR CA 244 +0.000 13.0190 CH1 +0.000 13.0190 579 CH1 61 THR CB 245 +0.266 13.0190 CH1 +0.266 13.0190 580 OA 61 THR OG1 245 -0.674 15.9994 OA -0.674 15.9994 581 H 61 THR HG1 245 +0.408 1.0080 H +0.408 1.0080 582 CH3 61 THR CG2 246 +0.000 15.0350 CH3 +0.000 15.0350 583 C 61 THR C 247 +0.450 12.0110 C +0.450 12.0110 584 O 61 THR O 247 -0.450 15.9994 O -0.450 15.9994 585 N 62 ASP N 248 -0.310 14.0067 N -0.310 14.0067 586 H 62 ASP H 248 +0.310 1.0080 H +0.310 1.0080 587 CH1 62 ASP CA 249 +0.000 13.0190 CH1 +0.000 13.0190 588 CH2 62 ASP CB 249 +0.000 14.0270 CH2 +0.000 14.0270 589 C 62 ASP CG 250 +0.270 12.0110 C +0.270 12.0110 590 OM 62 ASP OD1 250 -0.635 15.9994 OM -0.635 15.9994 591 OM 62 ASP OD2 250 -0.635 15.9994 OM -0.635 15.9994 592 C 62 ASP C 251 +0.450 12.0110 C +0.450 12.0110 593 O 62 ASP O 251 -0.450 15.9994 O -0.450 15.9994 594 N 63 GLY N 252 -0.310 14.0067 N -0.310 14.0067 595 H 63 GLY H 252 +0.310 1.0080 H +0.310 1.0080 596 CH2 63 GLY CA 253 +0.000 14.0270 CH2 +0.000 14.0270 597 C 63 GLY C 254 +0.450 12.0110 C +0.450 12.0110 598 O 63 GLY O 254 -0.450 15.9994 O -0.450 15.9994 599 N 64 MET N 255 -0.310 14.0067 N -0.310 14.0067 600 H 64 MET H 255 +0.310 1.0080 H +0.310 1.0080 601 CH1 64 MET CA 256 +0.000 13.0190 CH1 +0.000 13.0190 602 CH2 64 MET CB 256 +0.000 14.0270 CH2 +0.000 14.0270 603 CH2 64 MET CG 257 +0.241 14.0270 CH2 +0.241 14.0270 604 S 64 MET SD 257 -0.482 32.0600 S -0.482 32.0600 605 CH3 64 MET CE 257 +0.241 15.0350 CH3 +0.241 15.0350 606 C 64 MET C 258 +0.450 12.0110 C +0.450 12.0110 607 O 64 MET O 258 -0.450 15.9994 O -0.450 15.9994 608 N 65 ALA N 259 -0.310 14.0067 N -0.310 14.0067 609 H 65 ALA H 259 +0.310 1.0080 H +0.310 1.0080 610 CH1 65 ALA CA 260 +0.000 13.0190 CH1 +0.000 13.0190 611 CH3 65 ALA CB 260 +0.000 15.0350 CH3 +0.000 15.0350 612 C 65 ALA C 261 +0.450 12.0110 C +0.450 12.0110 613 O 65 ALA O 261 -0.450 15.9994 O -0.450 15.9994 614 N 66 SER N 262 -0.310 14.0067 N -0.310 14.0067 615 H 66 SER H 262 +0.310 1.0080 H +0.310 1.0080 616 CH1 66 SER CA 263 +0.000 13.0190 CH1 +0.000 13.0190 617 CH2 66 SER CB 264 +0.266 14.0270 CH2 +0.266 14.0270 618 OA 66 SER OG 264 -0.674 15.9994 OA -0.674 15.9994 619 H 66 SER HG 264 +0.408 1.0080 H +0.408 1.0080 620 C 66 SER C 265 +0.450 12.0110 C +0.450 12.0110 621 O 66 SER O 265 -0.450 15.9994 O -0.450 15.9994 622 N 67 GLY N 266 -0.310 14.0067 N -0.310 14.0067 623 H 67 GLY H 266 +0.310 1.0080 H +0.310 1.0080 624 CH2 67 GLY CA 267 +0.000 14.0270 CH2 +0.000 14.0270 625 C 67 GLY C 268 +0.450 12.0110 C +0.450 12.0110 626 O 67 GLY O 268 -0.450 15.9994 O -0.450 15.9994 627 N 68 LEU N 269 -0.310 14.0067 N -0.310 14.0067 628 H 68 LEU H 269 +0.310 1.0080 H +0.310 1.0080 629 CH1 68 LEU CA 270 +0.000 13.0190 CH1 +0.000 13.0190 630 CH2 68 LEU CB 270 +0.000 14.0270 CH2 +0.000 14.0270 631 CH1 68 LEU CG 271 +0.000 13.0190 CH1 +0.000 13.0190 632 CH3 68 LEU CD1 271 +0.000 15.0350 CH3 +0.000 15.0350 633 CH3 68 LEU CD2 271 +0.000 15.0350 CH3 +0.000 15.0350 634 C 68 LEU C 272 +0.450 12.0110 C +0.450 12.0110 635 O 68 LEU O 272 -0.450 15.9994 O -0.450 15.9994 636 N 69 ASP N 273 -0.310 14.0067 N -0.310 14.0067 637 H 69 ASP H 273 +0.310 1.0080 H +0.310 1.0080 638 CH1 69 ASP CA 274 +0.000 13.0190 CH1 +0.000 13.0190 639 CH2 69 ASP CB 274 +0.000 14.0270 CH2 +0.000 14.0270 640 C 69 ASP CG 275 +0.270 12.0110 C +0.270 12.0110 641 OM 69 ASP OD1 275 -0.635 15.9994 OM -0.635 15.9994 642 OM 69 ASP OD2 275 -0.635 15.9994 OM -0.635 15.9994 643 C 69 ASP C 276 +0.450 12.0110 C +0.450 12.0110 644 O 69 ASP O 276 -0.450 15.9994 O -0.450 15.9994 645 N 70 LYS N 277 -0.310 14.0067 N -0.310 14.0067 646 H 70 LYS H 277 +0.310 1.0080 H +0.310 1.0080 647 CH1 70 LYS CA 278 +0.000 13.0190 CH1 +0.000 13.0190 648 CH2 70 LYS CB 278 +0.000 14.0270 CH2 +0.000 14.0270 649 CH2 70 LYS CG 279 +0.000 14.0270 CH2 +0.000 14.0270 650 CH2 70 LYS CD 279 +0.000 14.0270 CH2 +0.000 14.0270 651 CH2 70 LYS CE 280 +0.127 14.0270 CH2 +0.127 14.0270 652 NL 70 LYS NZ 280 +0.129 14.0067 NL +0.129 14.0067 653 H 70 LYS HZ1 280 +0.248 1.0080 H +0.248 1.0080 654 H 70 LYS HZ2 280 +0.248 1.0080 H +0.248 1.0080 655 H 70 LYS HZ3 280 +0.248 1.0080 H +0.248 1.0080 656 C 70 LYS C 281 +0.450 12.0110 C +0.450 12.0110 657 O 70 LYS O 281 -0.450 15.9994 O -0.450 15.9994 658 N 71 ASP N 282 -0.310 14.0067 N -0.310 14.0067 659 H 71 ASP H 282 +0.310 1.0080 H +0.310 1.0080 660 CH1 71 ASP CA 283 +0.000 13.0190 CH1 +0.000 13.0190 661 CH2 71 ASP CB 283 +0.000 14.0270 CH2 +0.000 14.0270 662 C 71 ASP CG 284 +0.270 12.0110 C +0.270 12.0110 663 OM 71 ASP OD1 284 -0.635 15.9994 OM -0.635 15.9994 664 OM 71 ASP OD2 284 -0.635 15.9994 OM -0.635 15.9994 665 C 71 ASP C 285 +0.450 12.0110 C +0.450 12.0110 666 O 71 ASP O 285 -0.450 15.9994 O -0.450 15.9994 667 N 72 TYR N 286 -0.310 14.0067 N -0.310 14.0067 668 H 72 TYR H 286 +0.310 1.0080 H +0.310 1.0080 669 CH1 72 TYR CA 287 +0.000 13.0190 CH1 +0.000 13.0190 670 CH2 72 TYR CB 287 +0.000 14.0270 CH2 +0.000 14.0270 671 C 72 TYR CG 287 +0.000 12.0110 C +0.000 12.0110 672 C 72 TYR CD1 288 -0.140 12.0110 C -0.140 12.0110 673 HC 72 TYR HD1 288 +0.140 1.0080 HC +0.140 1.0080 674 C 72 TYR CD2 289 -0.140 12.0110 C -0.140 12.0110 675 HC 72 TYR HD2 289 +0.140 1.0080 HC +0.140 1.0080 676 C 72 TYR CE1 290 -0.140 12.0110 C -0.140 12.0110 677 HC 72 TYR HE1 290 +0.140 1.0080 HC +0.140 1.0080 678 C 72 TYR CE2 291 -0.140 12.0110 C -0.140 12.0110 679 HC 72 TYR HE2 291 +0.140 1.0080 HC +0.140 1.0080 680 C 72 TYR CZ 292 +0.203 12.0110 C +0.203 12.0110 681 OA 72 TYR OH 292 -0.611 15.9994 OA -0.611 15.9994 682 H 72 TYR HH 292 +0.408 1.0080 H +0.408 1.0080 683 C 72 TYR C 293 +0.450 12.0110 C +0.450 12.0110 684 O 72 TYR O 293 -0.450 15.9994 O -0.450 15.9994 685 N 73 LEU N 294 -0.310 14.0067 N -0.310 14.0067 686 H 73 LEU H 294 +0.310 1.0080 H +0.310 1.0080 687 CH1 73 LEU CA 295 +0.000 13.0190 CH1 +0.000 13.0190 688 CH2 73 LEU CB 295 +0.000 14.0270 CH2 +0.000 14.0270 689 CH1 73 LEU CG 296 +0.000 13.0190 CH1 +0.000 13.0190 690 CH3 73 LEU CD1 296 +0.000 15.0350 CH3 +0.000 15.0350 691 CH3 73 LEU CD2 296 +0.000 15.0350 CH3 +0.000 15.0350 692 C 73 LEU C 297 +0.450 12.0110 C +0.450 12.0110 693 O 73 LEU O 297 -0.450 15.9994 O -0.450 15.9994 694 N 74 LYS N 298 -0.310 14.0067 N -0.310 14.0067 695 H 74 LYS H 298 +0.310 1.0080 H +0.310 1.0080 696 CH1 74 LYS CA 299 +0.000 13.0190 CH1 +0.000 13.0190 697 CH2 74 LYS CB 299 +0.000 14.0270 CH2 +0.000 14.0270 698 CH2 74 LYS CG 300 +0.000 14.0270 CH2 +0.000 14.0270 699 CH2 74 LYS CD 300 +0.000 14.0270 CH2 +0.000 14.0270 700 CH2 74 LYS CE 301 +0.127 14.0270 CH2 +0.127 14.0270 701 NL 74 LYS NZ 301 +0.129 14.0067 NL +0.129 14.0067 702 H 74 LYS HZ1 301 +0.248 1.0080 H +0.248 1.0080 703 H 74 LYS HZ2 301 +0.248 1.0080 H +0.248 1.0080 704 H 74 LYS HZ3 301 +0.248 1.0080 H +0.248 1.0080 705 C 74 LYS C 302 +0.450 12.0110 C +0.450 12.0110 706 O 74 LYS O 302 -0.450 15.9994 O -0.450 15.9994 707 N 75 PRO N 303 +0.000 14.0067 N +0.000 14.0067 708 CH1 75 PRO CA 304 +0.000 13.0190 CH1 +0.000 13.0190 709 CH2r 75 PRO CB 304 +0.000 14.0270 CH2r +0.000 14.0270 710 CH2r 75 PRO CG 305 +0.000 14.0270 CH2r +0.000 14.0270 711 CH2r 75 PRO CD 305 +0.000 14.0270 CH2r +0.000 14.0270 712 C 75 PRO C 306 +0.450 12.0110 C +0.450 12.0110 713 O 75 PRO O 306 -0.450 15.9994 O -0.450 15.9994 714 N 76 ASP N 307 -0.310 14.0067 N -0.310 14.0067 715 H 76 ASP H 307 +0.310 1.0080 H +0.310 1.0080 716 CH1 76 ASP CA 308 +0.000 13.0190 CH1 +0.000 13.0190 717 CH2 76 ASP CB 308 +0.000 14.0270 CH2 +0.000 14.0270 718 C 76 ASP CG 309 +0.270 12.0110 C +0.270 12.0110 719 OM 76 ASP OD1 309 -0.635 15.9994 OM -0.635 15.9994 720 OM 76 ASP OD2 309 -0.635 15.9994 OM -0.635 15.9994 721 C 76 ASP C 310 +0.450 12.0110 C +0.450 12.0110 722 O 76 ASP O 310 -0.450 15.9994 O -0.450 15.9994 723 N 77 ASP N 311 -0.310 14.0067 N -0.310 14.0067 724 H 77 ASP H 311 +0.310 1.0080 H +0.310 1.0080 725 CH1 77 ASP CA 312 +0.000 13.0190 CH1 +0.000 13.0190 726 CH2 77 ASP CB 312 +0.000 14.0270 CH2 +0.000 14.0270 727 C 77 ASP CG 313 +0.270 12.0110 C +0.270 12.0110 728 OM 77 ASP OD1 313 -0.635 15.9994 OM -0.635 15.9994 729 OM 77 ASP OD2 313 -0.635 15.9994 OM -0.635 15.9994 730 C 77 ASP C 314 +0.450 12.0110 C +0.450 12.0110 731 O 77 ASP O 314 -0.450 15.9994 O -0.450 15.9994 732 N 78 SER N 315 -0.310 14.0067 N -0.310 14.0067 733 H 78 SER H 315 +0.310 1.0080 H +0.310 1.0080 734 CH1 78 SER CA 316 +0.000 13.0190 CH1 +0.000 13.0190 735 CH2 78 SER CB 317 +0.266 14.0270 CH2 +0.266 14.0270 736 OA 78 SER OG 317 -0.674 15.9994 OA -0.674 15.9994 737 H 78 SER HG 317 +0.408 1.0080 H +0.408 1.0080 738 C 78 SER C 318 +0.450 12.0110 C +0.450 12.0110 739 O 78 SER O 318 -0.450 15.9994 O -0.450 15.9994 740 N 79 ARG N 319 -0.310 14.0067 N -0.310 14.0067 741 H 79 ARG H 319 +0.310 1.0080 H +0.310 1.0080 742 CH1 79 ARG CA 320 +0.000 13.0190 CH1 +0.000 13.0190 743 CH2 79 ARG CB 320 +0.000 14.0270 CH2 +0.000 14.0270 744 CH2 79 ARG CG 320 +0.000 14.0270 CH2 +0.000 14.0270 745 CH2 79 ARG CD 321 +0.090 14.0270 CH2 +0.090 14.0270 746 NE 79 ARG NE 321 -0.110 14.0067 NE -0.110 14.0067 747 H 79 ARG HE 321 +0.240 1.0080 H +0.240 1.0080 748 C 79 ARG CZ 321 +0.340 12.0110 C +0.340 12.0110 749 NZ 79 ARG NH1 321 -0.260 14.0067 NZ -0.260 14.0067 750 H 79 ARG HH11 321 +0.240 1.0080 H +0.240 1.0080 751 H 79 ARG HH12 321 +0.240 1.0080 H +0.240 1.0080 752 NZ 79 ARG NH2 321 -0.260 14.0067 NZ -0.260 14.0067 753 H 79 ARG HH21 321 +0.240 1.0080 H +0.240 1.0080 754 H 79 ARG HH22 321 +0.240 1.0080 H +0.240 1.0080 755 C 79 ARG C 322 +0.450 12.0110 C +0.450 12.0110 756 O 79 ARG O 322 -0.450 15.9994 O -0.450 15.9994 757 N 80 VAL N 323 -0.310 14.0067 N -0.310 14.0067 758 H 80 VAL H 323 +0.310 1.0080 H +0.310 1.0080 759 CH1 80 VAL CA 324 +0.000 13.0190 CH1 +0.000 13.0190 760 CH1 80 VAL CB 324 +0.000 13.0190 CH1 +0.000 13.0190 761 CH3 80 VAL CG1 324 +0.000 15.0350 CH3 +0.000 15.0350 762 CH3 80 VAL CG2 324 +0.000 15.0350 CH3 +0.000 15.0350 763 C 80 VAL C 325 +0.450 12.0110 C +0.450 12.0110 764 O 80 VAL O 325 -0.450 15.9994 O -0.450 15.9994 765 N 81 ILE N 326 -0.310 14.0067 N -0.310 14.0067 766 H 81 ILE H 326 +0.310 1.0080 H +0.310 1.0080 767 CH1 81 ILE CA 327 +0.000 13.0190 CH1 +0.000 13.0190 768 CH1 81 ILE CB 328 +0.000 13.0190 CH1 +0.000 13.0190 769 CH2 81 ILE CG1 328 +0.000 14.0270 CH2 +0.000 14.0270 770 CH3 81 ILE CG2 328 +0.000 15.0350 CH3 +0.000 15.0350 771 CH3 81 ILE CD 328 +0.000 15.0350 CH3 +0.000 15.0350 772 C 81 ILE C 329 +0.450 12.0110 C +0.450 12.0110 773 O 81 ILE O 329 -0.450 15.9994 O -0.450 15.9994 774 N 82 ALA N 330 -0.310 14.0067 N -0.310 14.0067 775 H 82 ALA H 330 +0.310 1.0080 H +0.310 1.0080 776 CH1 82 ALA CA 331 +0.000 13.0190 CH1 +0.000 13.0190 777 CH3 82 ALA CB 331 +0.000 15.0350 CH3 +0.000 15.0350 778 C 82 ALA C 332 +0.450 12.0110 C +0.450 12.0110 779 O 82 ALA O 332 -0.450 15.9994 O -0.450 15.9994 780 N 83 HIS N 333 -0.310 14.0067 N -0.310 14.0067 781 H 83 HIS H 333 +0.310 1.0080 H +0.310 1.0080 782 CH1 83 HIS CA 334 +0.000 13.0190 CH1 +0.000 13.0190 783 CH2 83 HIS CB 334 +0.000 14.0270 CH2 +0.000 14.0270 784 C 83 HIS CG 335 -0.02489 12.0110 C -0.01711 12.0110 785 NR 83 HIS ND1 335 +0.16797 14.0067 NR +0.09803 14.0067 786 H 83 HIS HD1 335 +0.30503 1.0080 H +0.30697 1.0080 787 C 83 HIS CD2 335 -0.05076 12.0110 C -0.03424 12.0110 788 HC 83 HIS HD2 335 +0.12009 1.0080 HC +0.12591 1.0080 789 C 83 HIS CE1 335 -0.17220 12.0110 C -0.11780 12.0110 790 HC 83 HIS HE1 335 +0.12009 1.0080 HC +0.12591 1.0080 791 NR 83 HIS NE2 335 -0.10900 14.0067 NR -0.24600 14.0067 792 C 83 HIS C 336 +0.450 12.0110 C +0.450 12.0110 793 O 83 HIS O 336 -0.450 15.9994 O -0.450 15.9994 794 N 84 THR N 337 -0.310 14.0067 N -0.310 14.0067 795 H 84 THR H 337 +0.310 1.0080 H +0.310 1.0080 796 CH1 84 THR CA 338 +0.000 13.0190 CH1 +0.000 13.0190 797 CH1 84 THR CB 339 +0.266 13.0190 CH1 +0.266 13.0190 798 OA 84 THR OG1 339 -0.674 15.9994 OA -0.674 15.9994 799 H 84 THR HG1 339 +0.408 1.0080 H +0.408 1.0080 800 CH3 84 THR CG2 340 +0.000 15.0350 CH3 +0.000 15.0350 801 C 84 THR C 341 +0.450 12.0110 C +0.450 12.0110 802 O 84 THR O 341 -0.450 15.9994 O -0.450 15.9994 803 N 85 LYS N 342 -0.310 14.0067 N -0.310 14.0067 804 H 85 LYS H 342 +0.310 1.0080 H +0.310 1.0080 805 CH1 85 LYS CA 343 +0.000 13.0190 CH1 +0.000 13.0190 806 CH2 85 LYS CB 343 +0.000 14.0270 CH2 +0.000 14.0270 807 CH2 85 LYS CG 344 +0.000 14.0270 CH2 +0.000 14.0270 808 CH2 85 LYS CD 344 +0.000 14.0270 CH2 +0.000 14.0270 809 CH2 85 LYS CE 345 +0.127 14.0270 CH2 +0.127 14.0270 810 NL 85 LYS NZ 345 +0.129 14.0067 NL +0.129 14.0067 811 H 85 LYS HZ1 345 +0.248 1.0080 H +0.248 1.0080 812 H 85 LYS HZ2 345 +0.248 1.0080 H +0.248 1.0080 813 H 85 LYS HZ3 345 +0.248 1.0080 H +0.248 1.0080 814 C 85 LYS C 346 +0.450 12.0110 C +0.450 12.0110 815 O 85 LYS O 346 -0.450 15.9994 O -0.450 15.9994 816 N 86 LEU N 347 -0.310 14.0067 N -0.310 14.0067 817 H 86 LEU H 347 +0.310 1.0080 H +0.310 1.0080 818 CH1 86 LEU CA 348 +0.000 13.0190 CH1 +0.000 13.0190 819 CH2 86 LEU CB 348 +0.000 14.0270 CH2 +0.000 14.0270 820 CH1 86 LEU CG 349 +0.000 13.0190 CH1 +0.000 13.0190 821 CH3 86 LEU CD1 349 +0.000 15.0350 CH3 +0.000 15.0350 822 CH3 86 LEU CD2 349 +0.000 15.0350 CH3 +0.000 15.0350 823 C 86 LEU C 350 +0.450 12.0110 C +0.450 12.0110 824 O 86 LEU O 350 -0.450 15.9994 O -0.450 15.9994 825 N 87 ILE N 351 -0.310 14.0067 N -0.310 14.0067 826 H 87 ILE H 351 +0.310 1.0080 H +0.310 1.0080 827 CH1 87 ILE CA 352 +0.000 13.0190 CH1 +0.000 13.0190 828 CH1 87 ILE CB 353 +0.000 13.0190 CH1 +0.000 13.0190 829 CH2 87 ILE CG1 353 +0.000 14.0270 CH2 +0.000 14.0270 830 CH3 87 ILE CG2 353 +0.000 15.0350 CH3 +0.000 15.0350 831 CH3 87 ILE CD 353 +0.000 15.0350 CH3 +0.000 15.0350 832 C 87 ILE C 354 +0.450 12.0110 C +0.450 12.0110 833 O 87 ILE O 354 -0.450 15.9994 O -0.450 15.9994 834 N 88 GLY N 355 -0.310 14.0067 N -0.310 14.0067 835 H 88 GLY H 355 +0.310 1.0080 H +0.310 1.0080 836 CH2 88 GLY CA 356 +0.000 14.0270 CH2 +0.000 14.0270 837 C 88 GLY C 357 +0.450 12.0110 C +0.450 12.0110 838 O 88 GLY O 357 -0.450 15.9994 O -0.450 15.9994 839 N 89 SER N 358 -0.310 14.0067 N -0.310 14.0067 840 H 89 SER H 358 +0.310 1.0080 H +0.310 1.0080 841 CH1 89 SER CA 359 +0.000 13.0190 CH1 +0.000 13.0190 842 CH2 89 SER CB 360 +0.266 14.0270 CH2 +0.266 14.0270 843 OA 89 SER OG 360 -0.674 15.9994 OA -0.674 15.9994 844 H 89 SER HG 360 +0.408 1.0080 H +0.408 1.0080 845 C 89 SER C 361 +0.450 12.0110 C +0.450 12.0110 846 O 89 SER O 361 -0.450 15.9994 O -0.450 15.9994 847 N 90 GLY N 362 -0.310 14.0067 N -0.310 14.0067 848 H 90 GLY H 362 +0.310 1.0080 H +0.310 1.0080 849 CH2 90 GLY CA 363 +0.000 14.0270 CH2 +0.000 14.0270 850 C 90 GLY C 364 +0.450 12.0110 C +0.450 12.0110 851 O 90 GLY O 364 -0.450 15.9994 O -0.450 15.9994 852 N 91 GLU N 365 -0.310 14.0067 N -0.310 14.0067 853 H 91 GLU H 365 +0.310 1.0080 H +0.310 1.0080 854 CH1 91 GLU CA 366 +0.000 13.0190 CH1 +0.000 13.0190 855 CH2 91 GLU CB 366 +0.000 14.0270 CH2 +0.000 14.0270 856 CH2 91 GLU CG 366 +0.000 14.0270 CH2 +0.000 14.0270 857 C 91 GLU CD 367 +0.270 12.0110 C +0.270 12.0110 858 OM 91 GLU OE1 367 -0.635 15.9994 OM -0.635 15.9994 859 OM 91 GLU OE2 367 -0.635 15.9994 OM -0.635 15.9994 860 C 91 GLU C 368 +0.450 12.0110 C +0.450 12.0110 861 O 91 GLU O 368 -0.450 15.9994 O -0.450 15.9994 862 N 92 LYS N 369 -0.310 14.0067 N -0.310 14.0067 863 H 92 LYS H 369 +0.310 1.0080 H +0.310 1.0080 864 CH1 92 LYS CA 370 +0.000 13.0190 CH1 +0.000 13.0190 865 CH2 92 LYS CB 370 +0.000 14.0270 CH2 +0.000 14.0270 866 CH2 92 LYS CG 371 +0.000 14.0270 CH2 +0.000 14.0270 867 CH2 92 LYS CD 371 +0.000 14.0270 CH2 +0.000 14.0270 868 CH2 92 LYS CE 372 +0.127 14.0270 CH2 +0.127 14.0270 869 NL 92 LYS NZ 372 +0.129 14.0067 NL +0.129 14.0067 870 H 92 LYS HZ1 372 +0.248 1.0080 H +0.248 1.0080 871 H 92 LYS HZ2 372 +0.248 1.0080 H +0.248 1.0080 872 H 92 LYS HZ3 372 +0.248 1.0080 H +0.248 1.0080 873 C 92 LYS C 373 +0.450 12.0110 C +0.450 12.0110 874 O 92 LYS O 373 -0.450 15.9994 O -0.450 15.9994 875 N 93 ASP N 374 -0.310 14.0067 N -0.310 14.0067 876 H 93 ASP H 374 +0.310 1.0080 H +0.310 1.0080 877 CH1 93 ASP CA 375 +0.000 13.0190 CH1 +0.000 13.0190 878 CH2 93 ASP CB 375 +0.000 14.0270 CH2 +0.000 14.0270 879 C 93 ASP CG 376 +0.270 12.0110 C +0.270 12.0110 880 OM 93 ASP OD1 376 -0.635 15.9994 OM -0.635 15.9994 881 OM 93 ASP OD2 376 -0.635 15.9994 OM -0.635 15.9994 882 C 93 ASP C 377 +0.450 12.0110 C +0.450 12.0110 883 O 93 ASP O 377 -0.450 15.9994 O -0.450 15.9994 884 N 94 SER N 378 -0.310 14.0067 N -0.310 14.0067 885 H 94 SER H 378 +0.310 1.0080 H +0.310 1.0080 886 CH1 94 SER CA 379 +0.000 13.0190 CH1 +0.000 13.0190 887 CH2 94 SER CB 380 +0.266 14.0270 CH2 +0.266 14.0270 888 OA 94 SER OG 380 -0.674 15.9994 OA -0.674 15.9994 889 H 94 SER HG 380 +0.408 1.0080 H +0.408 1.0080 890 C 94 SER C 381 +0.450 12.0110 C +0.450 12.0110 891 O 94 SER O 381 -0.450 15.9994 O -0.450 15.9994 892 N 95 VAL N 382 -0.310 14.0067 N -0.310 14.0067 893 H 95 VAL H 382 +0.310 1.0080 H +0.310 1.0080 894 CH1 95 VAL CA 383 +0.000 13.0190 CH1 +0.000 13.0190 895 CH1 95 VAL CB 383 +0.000 13.0190 CH1 +0.000 13.0190 896 CH3 95 VAL CG1 383 +0.000 15.0350 CH3 +0.000 15.0350 897 CH3 95 VAL CG2 383 +0.000 15.0350 CH3 +0.000 15.0350 898 C 95 VAL C 384 +0.450 12.0110 C +0.450 12.0110 899 O 95 VAL O 384 -0.450 15.9994 O -0.450 15.9994 900 N 96 THR N 385 -0.310 14.0067 N -0.310 14.0067 901 H 96 THR H 385 +0.310 1.0080 H +0.310 1.0080 902 CH1 96 THR CA 386 +0.000 13.0190 CH1 +0.000 13.0190 903 CH1 96 THR CB 387 +0.266 13.0190 CH1 +0.266 13.0190 904 OA 96 THR OG1 387 -0.674 15.9994 OA -0.674 15.9994 905 H 96 THR HG1 387 +0.408 1.0080 H +0.408 1.0080 906 CH3 96 THR CG2 388 +0.000 15.0350 CH3 +0.000 15.0350 907 C 96 THR C 389 +0.450 12.0110 C +0.450 12.0110 908 O 96 THR O 389 -0.450 15.9994 O -0.450 15.9994 909 N 97 PHE N 390 -0.310 14.0067 N -0.310 14.0067 910 H 97 PHE H 390 +0.310 1.0080 H +0.310 1.0080 911 CH1 97 PHE CA 391 +0.000 13.0190 CH1 +0.000 13.0190 912 CH2 97 PHE CB 391 +0.000 14.0270 CH2 +0.000 14.0270 913 C 97 PHE CG 391 +0.000 12.0110 C +0.000 12.0110 914 C 97 PHE CD1 392 -0.140 12.0110 C -0.140 12.0110 915 HC 97 PHE HD1 392 +0.140 1.0080 HC +0.140 1.0080 916 C 97 PHE CD2 393 -0.140 12.0110 C -0.140 12.0110 917 HC 97 PHE HD2 393 +0.140 1.0080 HC +0.140 1.0080 918 C 97 PHE CE1 394 -0.140 12.0110 C -0.140 12.0110 919 HC 97 PHE HE1 394 +0.140 1.0080 HC +0.140 1.0080 920 C 97 PHE CE2 395 -0.140 12.0110 C -0.140 12.0110 921 HC 97 PHE HE2 395 +0.140 1.0080 HC +0.140 1.0080 922 C 97 PHE CZ 396 -0.140 12.0110 C -0.140 12.0110 923 HC 97 PHE HZ 396 +0.140 1.0080 HC +0.140 1.0080 924 C 97 PHE C 397 +0.450 12.0110 C +0.450 12.0110 925 O 97 PHE O 397 -0.450 15.9994 O -0.450 15.9994 926 N 98 ASP N 398 -0.310 14.0067 N -0.310 14.0067 927 H 98 ASP H 398 +0.310 1.0080 H +0.310 1.0080 928 CH1 98 ASP CA 399 +0.000 13.0190 CH1 +0.000 13.0190 929 CH2 98 ASP CB 399 +0.000 14.0270 CH2 +0.000 14.0270 930 C 98 ASP CG 400 +0.270 12.0110 C +0.270 12.0110 931 OM 98 ASP OD1 400 -0.635 15.9994 OM -0.635 15.9994 932 OM 98 ASP OD2 400 -0.635 15.9994 OM -0.635 15.9994 933 C 98 ASP C 401 +0.450 12.0110 C +0.450 12.0110 934 O 98 ASP O 401 -0.450 15.9994 O -0.450 15.9994 935 N 99 VAL N 402 -0.310 14.0067 N -0.310 14.0067 936 H 99 VAL H 402 +0.310 1.0080 H +0.310 1.0080 937 CH1 99 VAL CA 403 +0.000 13.0190 CH1 +0.000 13.0190 938 CH1 99 VAL CB 403 +0.000 13.0190 CH1 +0.000 13.0190 939 CH3 99 VAL CG1 403 +0.000 15.0350 CH3 +0.000 15.0350 940 CH3 99 VAL CG2 403 +0.000 15.0350 CH3 +0.000 15.0350 941 C 99 VAL C 404 +0.450 12.0110 C +0.450 12.0110 942 O 99 VAL O 404 -0.450 15.9994 O -0.450 15.9994 943 N 100 SER N 405 -0.310 14.0067 N -0.310 14.0067 944 H 100 SER H 405 +0.310 1.0080 H +0.310 1.0080 945 CH1 100 SER CA 406 +0.000 13.0190 CH1 +0.000 13.0190 946 CH2 100 SER CB 407 +0.266 14.0270 CH2 +0.266 14.0270 947 OA 100 SER OG 407 -0.674 15.9994 OA -0.674 15.9994 948 H 100 SER HG 407 +0.408 1.0080 H +0.408 1.0080 949 C 100 SER C 408 +0.450 12.0110 C +0.450 12.0110 950 O 100 SER O 408 -0.450 15.9994 O -0.450 15.9994 951 N 101 LYS N 409 -0.310 14.0067 N -0.310 14.0067 952 H 101 LYS H 409 +0.310 1.0080 H +0.310 1.0080 953 CH1 101 LYS CA 410 +0.000 13.0190 CH1 +0.000 13.0190 954 CH2 101 LYS CB 410 +0.000 14.0270 CH2 +0.000 14.0270 955 CH2 101 LYS CG 411 +0.000 14.0270 CH2 +0.000 14.0270 956 CH2 101 LYS CD 411 +0.000 14.0270 CH2 +0.000 14.0270 957 CH2 101 LYS CE 412 +0.127 14.0270 CH2 +0.127 14.0270 958 NL 101 LYS NZ 412 +0.129 14.0067 NL +0.129 14.0067 959 H 101 LYS HZ1 412 +0.248 1.0080 H +0.248 1.0080 960 H 101 LYS HZ2 412 +0.248 1.0080 H +0.248 1.0080 961 H 101 LYS HZ3 412 +0.248 1.0080 H +0.248 1.0080 962 C 101 LYS C 413 +0.450 12.0110 C +0.450 12.0110 963 O 101 LYS O 413 -0.450 15.9994 O -0.450 15.9994 964 N 102 LEU N 414 -0.310 14.0067 N -0.310 14.0067 965 H 102 LEU H 414 +0.310 1.0080 H +0.310 1.0080 966 CH1 102 LEU CA 415 +0.000 13.0190 CH1 +0.000 13.0190 967 CH2 102 LEU CB 415 +0.000 14.0270 CH2 +0.000 14.0270 968 CH1 102 LEU CG 416 +0.000 13.0190 CH1 +0.000 13.0190 969 CH3 102 LEU CD1 416 +0.000 15.0350 CH3 +0.000 15.0350 970 CH3 102 LEU CD2 416 +0.000 15.0350 CH3 +0.000 15.0350 971 C 102 LEU C 417 +0.450 12.0110 C +0.450 12.0110 972 O 102 LEU O 417 -0.450 15.9994 O -0.450 15.9994 973 N 103 LYS N 418 -0.310 14.0067 N -0.310 14.0067 974 H 103 LYS H 418 +0.310 1.0080 H +0.310 1.0080 975 CH1 103 LYS CA 419 +0.000 13.0190 CH1 +0.000 13.0190 976 CH2 103 LYS CB 419 +0.000 14.0270 CH2 +0.000 14.0270 977 CH2 103 LYS CG 420 +0.000 14.0270 CH2 +0.000 14.0270 978 CH2 103 LYS CD 420 +0.000 14.0270 CH2 +0.000 14.0270 979 CH2 103 LYS CE 421 +0.127 14.0270 CH2 +0.127 14.0270 980 NL 103 LYS NZ 421 +0.129 14.0067 NL +0.129 14.0067 981 H 103 LYS HZ1 421 +0.248 1.0080 H +0.248 1.0080 982 H 103 LYS HZ2 421 +0.248 1.0080 H +0.248 1.0080 983 H 103 LYS HZ3 421 +0.248 1.0080 H +0.248 1.0080 984 C 103 LYS C 422 +0.450 12.0110 C +0.450 12.0110 985 O 103 LYS O 422 -0.450 15.9994 O -0.450 15.9994 986 N 104 GLU N 423 -0.310 14.0067 N -0.310 14.0067 987 H 104 GLU H 423 +0.310 1.0080 H +0.310 1.0080 988 CH1 104 GLU CA 424 +0.000 13.0190 CH1 +0.000 13.0190 989 CH2 104 GLU CB 424 +0.000 14.0270 CH2 +0.000 14.0270 990 CH2 104 GLU CG 424 +0.000 14.0270 CH2 +0.000 14.0270 991 C 104 GLU CD 425 +0.270 12.0110 C +0.270 12.0110 992 OM 104 GLU OE1 425 -0.635 15.9994 OM -0.635 15.9994 993 OM 104 GLU OE2 425 -0.635 15.9994 OM -0.635 15.9994 994 C 104 GLU C 426 +0.450 12.0110 C +0.450 12.0110 995 O 104 GLU O 426 -0.450 15.9994 O -0.450 15.9994 996 N 105 GLY N 427 -0.310 14.0067 N -0.310 14.0067 997 H 105 GLY H 427 +0.310 1.0080 H +0.310 1.0080 998 CH2 105 GLY CA 428 +0.000 14.0270 CH2 +0.000 14.0270 999 C 105 GLY C 429 +0.450 12.0110 C +0.450 12.0110 1000 O 105 GLY O 429 -0.450 15.9994 O -0.450 15.9994 1001 N 106 GLU N 430 -0.310 14.0067 N -0.310 14.0067 1002 H 106 GLU H 430 +0.310 1.0080 H +0.310 1.0080 1003 CH1 106 GLU CA 431 +0.000 13.0190 CH1 +0.000 13.0190 1004 CH2 106 GLU CB 431 +0.000 14.0270 CH2 +0.000 14.0270 1005 CH2 106 GLU CG 431 +0.000 14.0270 CH2 +0.000 14.0270 1006 C 106 GLU CD 432 +0.270 12.0110 C +0.270 12.0110 1007 OM 106 GLU OE1 432 -0.635 15.9994 OM -0.635 15.9994 1008 OM 106 GLU OE2 432 -0.635 15.9994 OM -0.635 15.9994 1009 C 106 GLU C 433 +0.450 12.0110 C +0.450 12.0110 1010 O 106 GLU O 433 -0.450 15.9994 O -0.450 15.9994 1011 N 107 GLN N 434 -0.310 14.0067 N -0.310 14.0067 1012 H 107 GLN H 434 +0.310 1.0080 H +0.310 1.0080 1013 CH1 107 GLN CA 435 +0.000 13.0190 CH1 +0.000 13.0190 1014 CH2 107 GLN CB 435 +0.000 14.0270 CH2 +0.000 14.0270 1015 CH2 107 GLN CG 435 +0.000 14.0270 CH2 +0.000 14.0270 1016 C 107 GLN CD 436 +0.290 12.0110 C +0.290 12.0110 1017 O 107 GLN OE1 436 -0.450 15.9994 O -0.450 15.9994 1018 NT 107 GLN NE2 436 -0.720 14.0067 NT -0.720 14.0067 1019 H 107 GLN HE21 436 +0.440 1.0080 H +0.440 1.0080 1020 H 107 GLN HE22 436 +0.440 1.0080 H +0.440 1.0080 1021 C 107 GLN C 437 +0.450 12.0110 C +0.450 12.0110 1022 O 107 GLN O 437 -0.450 15.9994 O -0.450 15.9994 1023 N 108 TYR N 438 -0.310 14.0067 N -0.310 14.0067 1024 H 108 TYR H 438 +0.310 1.0080 H +0.310 1.0080 1025 CH1 108 TYR CA 439 +0.000 13.0190 CH1 +0.000 13.0190 1026 CH2 108 TYR CB 439 +0.000 14.0270 CH2 +0.000 14.0270 1027 C 108 TYR CG 439 +0.000 12.0110 C +0.000 12.0110 1028 C 108 TYR CD1 440 -0.140 12.0110 C -0.140 12.0110 1029 HC 108 TYR HD1 440 +0.140 1.0080 HC +0.140 1.0080 1030 C 108 TYR CD2 441 -0.140 12.0110 C -0.140 12.0110 1031 HC 108 TYR HD2 441 +0.140 1.0080 HC +0.140 1.0080 1032 C 108 TYR CE1 442 -0.140 12.0110 C -0.140 12.0110 1033 HC 108 TYR HE1 442 +0.140 1.0080 HC +0.140 1.0080 1034 C 108 TYR CE2 443 -0.140 12.0110 C -0.140 12.0110 1035 HC 108 TYR HE2 443 +0.140 1.0080 HC +0.140 1.0080 1036 C 108 TYR CZ 444 +0.203 12.0110 C +0.203 12.0110 1037 OA 108 TYR OH 444 -0.611 15.9994 OA -0.611 15.9994 1038 H 108 TYR HH 444 +0.408 1.0080 H +0.408 1.0080 1039 C 108 TYR C 445 +0.450 12.0110 C +0.450 12.0110 1040 O 108 TYR O 445 -0.450 15.9994 O -0.450 15.9994 1041 N 109 MET N 446 -0.310 14.0067 N -0.310 14.0067 1042 H 109 MET H 446 +0.310 1.0080 H +0.310 1.0080 1043 CH1 109 MET CA 447 +0.000 13.0190 CH1 +0.000 13.0190 1044 CH2 109 MET CB 447 +0.000 14.0270 CH2 +0.000 14.0270 1045 CH2 109 MET CG 448 +0.241 14.0270 CH2 +0.241 14.0270 1046 S 109 MET SD 448 -0.482 32.0600 S -0.482 32.0600 1047 CH3 109 MET CE 448 +0.241 15.0350 CH3 +0.241 15.0350 1048 C 109 MET C 449 +0.450 12.0110 C +0.450 12.0110 1049 O 109 MET O 449 -0.450 15.9994 O -0.450 15.9994 1050 N 110 PHE N 450 -0.310 14.0067 N -0.310 14.0067 1051 H 110 PHE H 450 +0.310 1.0080 H +0.310 1.0080 1052 CH1 110 PHE CA 451 +0.000 13.0190 CH1 +0.000 13.0190 1053 CH2 110 PHE CB 451 +0.000 14.0270 CH2 +0.000 14.0270 1054 C 110 PHE CG 451 +0.000 12.0110 C +0.000 12.0110 1055 C 110 PHE CD1 452 -0.140 12.0110 C -0.140 12.0110 1056 HC 110 PHE HD1 452 +0.140 1.0080 HC +0.140 1.0080 1057 C 110 PHE CD2 453 -0.140 12.0110 C -0.140 12.0110 1058 HC 110 PHE HD2 453 +0.140 1.0080 HC +0.140 1.0080 1059 C 110 PHE CE1 454 -0.140 12.0110 C -0.140 12.0110 1060 HC 110 PHE HE1 454 +0.140 1.0080 HC +0.140 1.0080 1061 C 110 PHE CE2 455 -0.140 12.0110 C -0.140 12.0110 1062 HC 110 PHE HE2 455 +0.140 1.0080 HC +0.140 1.0080 1063 C 110 PHE CZ 456 -0.140 12.0110 C -0.140 12.0110 1064 HC 110 PHE HZ 456 +0.140 1.0080 HC +0.140 1.0080 1065 C 110 PHE C 457 +0.450 12.0110 C +0.450 12.0110 1066 O 110 PHE O 457 -0.450 15.9994 O -0.450 15.9994 1067 N 111 PHE N 458 -0.310 14.0067 N -0.310 14.0067 1068 H 111 PHE H 458 +0.310 1.0080 H +0.310 1.0080 1069 CH1 111 PHE CA 459 +0.000 13.0190 CH1 +0.000 13.0190 1070 CH2 111 PHE CB 459 +0.000 14.0270 CH2 +0.000 14.0270 1071 C 111 PHE CG 459 +0.000 12.0110 C +0.000 12.0110 1072 C 111 PHE CD1 460 -0.140 12.0110 C -0.140 12.0110 1073 HC 111 PHE HD1 460 +0.140 1.0080 HC +0.140 1.0080 1074 C 111 PHE CD2 461 -0.140 12.0110 C -0.140 12.0110 1075 HC 111 PHE HD2 461 +0.140 1.0080 HC +0.140 1.0080 1076 C 111 PHE CE1 462 -0.140 12.0110 C -0.140 12.0110 1077 HC 111 PHE HE1 462 +0.140 1.0080 HC +0.140 1.0080 1078 C 111 PHE CE2 463 -0.140 12.0110 C -0.140 12.0110 1079 HC 111 PHE HE2 463 +0.140 1.0080 HC +0.140 1.0080 1080 C 111 PHE CZ 464 -0.140 12.0110 C -0.140 12.0110 1081 HC 111 PHE HZ 464 +0.140 1.0080 HC +0.140 1.0080 1082 C 111 PHE C 465 +0.450 12.0110 C +0.450 12.0110 1083 O 111 PHE O 465 -0.450 15.9994 O -0.450 15.9994 1084 N 112 CYS2 N 466 -0.310 14.0067 N -0.310 14.0067 1085 H 112 CYS2 H 466 +0.310 1.0080 H +0.310 1.0080 1086 CH1 112 CYS2 CA 467 +0.000 13.0190 CH1 +0.000 13.0190 1087 CH2 112 CYS2 CB 467 -0.08894 14.0270 CH2 -0.01706 14.0270 1088 S 112 CYS2 SG 467 -0.35777 32.0600 S -0.07023 32.0600 1089 C 112 CYS2 C 468 +0.450 12.0110 C +0.450 12.0110 1090 O 112 CYS2 O 468 -0.450 15.9994 O -0.450 15.9994 1091 N 113 THR N 469 -0.310 14.0067 N -0.310 14.0067 1092 H 113 THR H 469 +0.310 1.0080 H +0.310 1.0080 1093 CH1 113 THR CA 470 +0.000 13.0190 CH1 +0.000 13.0190 1094 CH1 113 THR CB 471 +0.266 13.0190 CH1 +0.266 13.0190 1095 OA 113 THR OG1 471 -0.674 15.9994 OA -0.674 15.9994 1096 H 113 THR HG1 471 +0.408 1.0080 H +0.408 1.0080 1097 CH3 113 THR CG2 472 +0.000 15.0350 CH3 +0.000 15.0350 1098 C 113 THR C 473 +0.450 12.0110 C +0.450 12.0110 1099 O 113 THR O 473 -0.450 15.9994 O -0.450 15.9994 1100 N 114 PHE N 474 -0.310 14.0067 N -0.310 14.0067 1101 H 114 PHE H 474 +0.310 1.0080 H +0.310 1.0080 1102 CH1 114 PHE CA 475 +0.000 13.0190 CH1 +0.000 13.0190 1103 CH2 114 PHE CB 475 +0.000 14.0270 CH2 +0.000 14.0270 1104 C 114 PHE CG 475 +0.000 12.0110 C +0.000 12.0110 1105 C 114 PHE CD1 476 -0.140 12.0110 C -0.140 12.0110 1106 HC 114 PHE HD1 476 +0.140 1.0080 HC +0.140 1.0080 1107 C 114 PHE CD2 477 -0.140 12.0110 C -0.140 12.0110 1108 HC 114 PHE HD2 477 +0.140 1.0080 HC +0.140 1.0080 1109 C 114 PHE CE1 478 -0.140 12.0110 C -0.140 12.0110 1110 HC 114 PHE HE1 478 +0.140 1.0080 HC +0.140 1.0080 1111 C 114 PHE CE2 479 -0.140 12.0110 C -0.140 12.0110 1112 HC 114 PHE HE2 479 +0.140 1.0080 HC +0.140 1.0080 1113 C 114 PHE CZ 480 -0.140 12.0110 C -0.140 12.0110 1114 HC 114 PHE HZ 480 +0.140 1.0080 HC +0.140 1.0080 1115 C 114 PHE C 481 +0.450 12.0110 C +0.450 12.0110 1116 O 114 PHE O 481 -0.450 15.9994 O -0.450 15.9994 1117 N 115 PRO N 482 +0.000 14.0067 N +0.000 14.0067 1118 CH1 115 PRO CA 483 +0.000 13.0190 CH1 +0.000 13.0190 1119 CH2r 115 PRO CB 483 +0.000 14.0270 CH2r +0.000 14.0270 1120 CH2r 115 PRO CG 484 +0.000 14.0270 CH2r +0.000 14.0270 1121 CH2r 115 PRO CD 484 +0.000 14.0270 CH2r +0.000 14.0270 1122 C 115 PRO C 485 +0.450 12.0110 C +0.450 12.0110 1123 O 115 PRO O 485 -0.450 15.9994 O -0.450 15.9994 1124 N 116 GLY N 486 -0.310 14.0067 N -0.310 14.0067 1125 H 116 GLY H 486 +0.310 1.0080 H +0.310 1.0080 1126 CH2 116 GLY CA 487 +0.000 14.0270 CH2 +0.000 14.0270 1127 C 116 GLY C 488 +0.450 12.0110 C +0.450 12.0110 1128 O 116 GLY O 488 -0.450 15.9994 O -0.450 15.9994 1129 N 117 HIS N 489 -0.310 14.0067 N -0.310 14.0067 1130 H 117 HIS H 489 +0.310 1.0080 H +0.310 1.0080 1131 CH1 117 HIS CA 490 +0.000 13.0190 CH1 +0.000 13.0190 1132 CH2 117 HIS CB 490 +0.000 14.0270 CH2 +0.000 14.0270 1133 C 117 HIS CG 491 -0.01710 12.0110 C -0.02390 12.0110 1134 NR 117 HIS ND1 491 -0.22609 14.0067 NR -0.09591 14.0067 1135 C 117 HIS CD2 491 -0.03420 12.0110 C -0.04780 12.0110 1136 HC 117 HIS HD2 491 +0.12593 1.0080 HC +0.12107 1.0080 1137 C 117 HIS CE1 491 -0.11571 12.0110 C -0.16429 12.0110 1138 HC 117 HIS HE1 491 +0.12593 1.0080 HC +0.12107 1.0080 1139 NR 117 HIS NE2 491 +0.07274 14.0067 NR +0.12326 14.0067 1140 H 117 HIS HE2 491 +0.30697 1.0080 H +0.30503 1.0080 1141 C 117 HIS C 492 +0.450 12.0110 C +0.450 12.0110 1142 O 117 HIS O 492 -0.450 15.9994 O -0.450 15.9994 1143 N 118 SER N 493 -0.310 14.0067 N -0.310 14.0067 1144 H 118 SER H 493 +0.310 1.0080 H +0.310 1.0080 1145 CH1 118 SER CA 494 +0.000 13.0190 CH1 +0.000 13.0190 1146 CH2 118 SER CB 495 +0.266 14.0270 CH2 +0.266 14.0270 1147 OA 118 SER OG 495 -0.674 15.9994 OA -0.674 15.9994 1148 H 118 SER HG 495 +0.408 1.0080 H +0.408 1.0080 1149 C 118 SER C 496 +0.450 12.0110 C +0.450 12.0110 1150 O 118 SER O 496 -0.450 15.9994 O -0.450 15.9994 1151 N 119 ALA N 497 -0.310 14.0067 N -0.310 14.0067 1152 H 119 ALA H 497 +0.310 1.0080 H +0.310 1.0080 1153 CH1 119 ALA CA 498 +0.000 13.0190 CH1 +0.000 13.0190 1154 CH3 119 ALA CB 498 +0.000 15.0350 CH3 +0.000 15.0350 1155 C 119 ALA C 499 +0.450 12.0110 C +0.450 12.0110 1156 O 119 ALA O 499 -0.450 15.9994 O -0.450 15.9994 1157 N 120 LEU N 500 -0.310 14.0067 N -0.310 14.0067 1158 H 120 LEU H 500 +0.310 1.0080 H +0.310 1.0080 1159 CH1 120 LEU CA 501 +0.000 13.0190 CH1 +0.000 13.0190 1160 CH2 120 LEU CB 501 +0.000 14.0270 CH2 +0.000 14.0270 1161 CH1 120 LEU CG 502 +0.000 13.0190 CH1 +0.000 13.0190 1162 CH3 120 LEU CD1 502 +0.000 15.0350 CH3 +0.000 15.0350 1163 CH3 120 LEU CD2 502 +0.000 15.0350 CH3 +0.000 15.0350 1164 C 120 LEU C 503 +0.450 12.0110 C +0.450 12.0110 1165 O 120 LEU O 503 -0.450 15.9994 O -0.450 15.9994 1166 N 121 MET N 504 -0.310 14.0067 N -0.310 14.0067 1167 H 121 MET H 504 +0.310 1.0080 H +0.310 1.0080 1168 CH1 121 MET CA 505 +0.000 13.0190 CH1 +0.000 13.0190 1169 CH2 121 MET CB 505 +0.000 14.0270 CH2 +0.000 14.0270 1170 CH2 121 MET CG 506 +0.241 14.0270 CH2 +0.241 14.0270 1171 S 121 MET SD 506 -0.46219 32.0600 S -0.40681 32.0600 1172 CH3 121 MET CE 506 +0.241 15.0350 CH3 +0.241 15.0350 1173 C 121 MET C 507 +0.450 12.0110 C +0.450 12.0110 1174 O 121 MET O 507 -0.450 15.9994 O -0.450 15.9994 1175 N 122 LYS N 508 -0.310 14.0067 N -0.310 14.0067 1176 H 122 LYS H 508 +0.310 1.0080 H +0.310 1.0080 1177 CH1 122 LYS CA 509 +0.000 13.0190 CH1 +0.000 13.0190 1178 CH2 122 LYS CB 509 +0.000 14.0270 CH2 +0.000 14.0270 1179 CH2 122 LYS CG 510 +0.000 14.0270 CH2 +0.000 14.0270 1180 CH2 122 LYS CD 510 +0.000 14.0270 CH2 +0.000 14.0270 1181 CH2 122 LYS CE 511 +0.127 14.0270 CH2 +0.127 14.0270 1182 NL 122 LYS NZ 511 +0.129 14.0067 NL +0.129 14.0067 1183 H 122 LYS HZ1 511 +0.248 1.0080 H +0.248 1.0080 1184 H 122 LYS HZ2 511 +0.248 1.0080 H +0.248 1.0080 1185 H 122 LYS HZ3 511 +0.248 1.0080 H +0.248 1.0080 1186 C 122 LYS C 512 +0.450 12.0110 C +0.450 12.0110 1187 O 122 LYS O 512 -0.450 15.9994 O -0.450 15.9994 1188 N 123 GLY N 513 -0.310 14.0067 N -0.310 14.0067 1189 H 123 GLY H 513 +0.310 1.0080 H +0.310 1.0080 1190 CH2 123 GLY CA 514 +0.000 14.0270 CH2 +0.000 14.0270 1191 C 123 GLY C 515 +0.450 12.0110 C +0.450 12.0110 1192 O 123 GLY O 515 -0.450 15.9994 O -0.450 15.9994 1193 N 124 THR N 516 -0.310 14.0067 N -0.310 14.0067 1194 H 124 THR H 516 +0.310 1.0080 H +0.310 1.0080 1195 CH1 124 THR CA 517 +0.000 13.0190 CH1 +0.000 13.0190 1196 CH1 124 THR CB 518 +0.266 13.0190 CH1 +0.266 13.0190 1197 OA 124 THR OG1 518 -0.674 15.9994 OA -0.674 15.9994 1198 H 124 THR HG1 518 +0.408 1.0080 H +0.408 1.0080 1199 CH3 124 THR CG2 519 +0.000 15.0350 CH3 +0.000 15.0350 1200 C 124 THR C 520 +0.450 12.0110 C +0.450 12.0110 1201 O 124 THR O 520 -0.450 15.9994 O -0.450 15.9994 1202 N 125 LEU N 521 -0.310 14.0067 N -0.310 14.0067 1203 H 125 LEU H 521 +0.310 1.0080 H +0.310 1.0080 1204 CH1 125 LEU CA 522 +0.000 13.0190 CH1 +0.000 13.0190 1205 CH2 125 LEU CB 522 +0.000 14.0270 CH2 +0.000 14.0270 1206 CH1 125 LEU CG 523 +0.000 13.0190 CH1 +0.000 13.0190 1207 CH3 125 LEU CD1 523 +0.000 15.0350 CH3 +0.000 15.0350 1208 CH3 125 LEU CD2 523 +0.000 15.0350 CH3 +0.000 15.0350 1209 C 125 LEU C 524 +0.450 12.0110 C +0.450 12.0110 1210 O 125 LEU O 524 -0.450 15.9994 O -0.450 15.9994 1211 N 126 THR N 525 -0.310 14.0067 N -0.310 14.0067 1212 H 126 THR H 525 +0.310 1.0080 H +0.310 1.0080 1213 CH1 126 THR CA 526 +0.000 13.0190 CH1 +0.000 13.0190 1214 CH1 126 THR CB 527 +0.266 13.0190 CH1 +0.266 13.0190 1215 OA 126 THR OG1 527 -0.674 15.9994 OA -0.674 15.9994 1216 H 126 THR HG1 527 +0.408 1.0080 H +0.408 1.0080 1217 CH3 126 THR CG2 528 +0.000 15.0350 CH3 +0.000 15.0350 1218 C 126 THR C 529 +0.450 12.0110 C +0.450 12.0110 1219 O 126 THR O 529 -0.450 15.9994 O -0.450 15.9994 1220 N 127 LEU N 530 -0.310 14.0067 N -0.310 14.0067 1221 H 127 LEU H 530 +0.310 1.0080 H +0.310 1.0080 1222 CH1 127 LEU CA 531 +0.000 13.0190 CH1 +0.000 13.0190 1223 CH2 127 LEU CB 531 +0.000 14.0270 CH2 +0.000 14.0270 1224 CH1 127 LEU CG 532 +0.000 13.0190 CH1 +0.000 13.0190 1225 CH3 127 LEU CD1 532 +0.000 15.0350 CH3 +0.000 15.0350 1226 CH3 127 LEU CD2 532 +0.000 15.0350 CH3 +0.000 15.0350 1227 C 127 LEU C 533 +0.450 12.0110 C +0.450 12.0110 1228 O 127 LEU O 533 -0.450 15.9994 O -0.450 15.9994 1229 N 128 LYS N 534 -0.310 14.0067 N -0.310 14.0067 1230 H 128 LYS H 534 +0.310 1.0080 H +0.310 1.0080 1231 CH1 128 LYS CA 535 +0.000 13.0190 CH1 +0.000 13.0190 1232 CH2 128 LYS CB 535 +0.000 14.0270 CH2 +0.000 14.0270 1233 CH2 128 LYS CG 536 +0.000 14.0270 CH2 +0.000 14.0270 1234 CH2 128 LYS CD 536 +0.000 14.0270 CH2 +0.000 14.0270 1235 CH2 128 LYS CE 537 +0.127 14.0270 CH2 +0.127 14.0270 1236 NL 128 LYS NZ 537 +0.129 14.0067 NL +0.129 14.0067 1237 H 128 LYS HZ1 537 +0.248 1.0080 H +0.248 1.0080 1238 H 128 LYS HZ2 537 +0.248 1.0080 H +0.248 1.0080 1239 H 128 LYS HZ3 537 +0.248 1.0080 H +0.248 1.0080 1240 C 128 LYS C 538 +0.270 12.0110 C +0.270 12.0110 1241 OM 128 LYS O1 538 -0.635 15.9994 OM -0.635 15.9994 1242 OM 128 LYS O2 538 -0.635 15.9994 OM -0.635 15.9994 1243 CU1+ 129 CU CU 539 +0.25119 63.5460 CU1+ +0.33181 63.5460 1244 CU1+ 130 RBU RU 540 +0.560 101.0700 CU1+ +0.560 101.0700 1245 NR 130 RBU NI 541 -0.23825 14.0067 NR -0.39175 14.0067 1246 C 130 RBU C2I 541 +0.42047 12.0110 C +0.45253 12.0110 1247 C 130 RBU C3I 541 -0.51313 12.0110 C -0.52187 12.0110 1248 H 130 RBU H3I 541 +0.197 1.0080 H +0.197 1.0080 1249 C 130 RBU C4I 541 +0.32084 12.0110 C +0.31016 12.0110 1250 H 130 RBU H4I 541 +0.060 1.0080 H +0.060 1.0080 1251 C 130 RBU C5I 541 -0.48416 12.0110 C -0.49484 12.0110 1252 H 130 RBU H5I 541 +0.192 1.0080 H +0.192 1.0080 1253 C 130 RBU C6I 541 +0.41547 12.0110 C +0.44753 12.0110 1254 H 130 RBU H6I 541 -0.01590 1.0080 H -0.00910 1.0080 1255 NR 130 RBU NJ 542 -0.23825 14.0067 NR -0.39175 14.0067 1256 C 130 RBU C2J 542 +0.42047 12.0110 C +0.45253 12.0110 1257 C 130 RBU C3J 542 -0.51313 12.0110 C -0.52187 12.0110 1258 H 130 RBU H3J 542 +0.197 1.0080 H +0.197 1.0080 1259 C 130 RBU C4J 542 +0.32084 12.0110 C +0.31016 12.0110 1260 H 130 RBU H4J 542 +0.060 1.0080 H +0.060 1.0080 1261 C 130 RBU C5J 542 -0.48416 12.0110 C -0.49484 12.0110 1262 H 130 RBU H5J 542 +0.192 1.0080 H +0.192 1.0080 1263 C 130 RBU C6J 542 +0.41547 12.0110 C +0.44753 12.0110 1264 H 130 RBU H6J 542 -0.01590 1.0080 H -0.00910 1.0080 1265 NR 130 RBU NK 543 -0.23825 14.0067 NR -0.39175 14.0067 1266 C 130 RBU C2K 543 +0.42047 12.0110 C +0.45253 12.0110 1267 C 130 RBU C3K 543 -0.51313 12.0110 C -0.52187 12.0110 1268 H 130 RBU H3K 543 +0.197 1.0080 H +0.197 1.0080 1269 C 130 RBU C4K 543 +0.32084 12.0110 C +0.31016 12.0110 1270 H 130 RBU H4K 543 +0.060 1.0080 H +0.060 1.0080 1271 C 130 RBU C5K 543 -0.48416 12.0110 C -0.49484 12.0110 1272 H 130 RBU H5K 543 +0.192 1.0080 H +0.192 1.0080 1273 C 130 RBU C6K 543 +0.41547 12.0110 C +0.44753 12.0110 1274 H 130 RBU H6K 543 -0.01590 1.0080 H -0.00910 1.0080 1275 NR 130 RBU NL 544 -0.23825 14.0067 NR -0.39175 14.0067 1276 C 130 RBU C2L 544 +0.42047 12.0110 C +0.45253 12.0110 1277 C 130 RBU C3L 544 -0.51313 12.0110 C -0.52187 12.0110 1278 H 130 RBU H3L 544 +0.197 1.0080 H +0.197 1.0080 1279 C 130 RBU C4L 544 +0.32084 12.0110 C +0.31016 12.0110 1280 H 130 RBU H4L 544 +0.060 1.0080 H +0.060 1.0080 1281 C 130 RBU C5L 544 -0.48416 12.0110 C -0.49484 12.0110 1282 H 130 RBU H5L 544 +0.192 1.0080 H +0.192 1.0080 1283 C 130 RBU C6L 544 +0.41547 12.0110 C +0.44753 12.0110 1284 H 130 RBU H6L 544 -0.01590 1.0080 H -0.00910 1.0080 1285 NR 130 RBU NR1 545 +0.16797 14.0067 NR +0.09803 14.0067 1286 H 130 RBU H1 545 +0.30503 1.0080 H +0.30697 1.0080 1287 C 130 RBU C1 545 -0.08783 12.0110 C -0.07617 12.0110 1288 HC 130 RBU HC1 545 +0.11004 1.0080 HC +0.11296 1.0080 1289 NR 130 RBU NR2 545 -0.10899 14.0067 NR -0.24501 14.0067 1290 C 130 RBU C2 545 -0.08783 12.0110 C -0.07617 12.0110 1291 HC 130 RBU HC2 545 +0.11004 1.0080 HC +0.11296 1.0080 1292 C 130 RBU C3 545 -0.17220 12.0110 C -0.11780 12.0110 1293 HC 130 RBU HC3 545 +0.12009 1.0080 HC +0.12591 1.0080 1294 OW 131 SOL OW 546 -0.8476 15.9994 OW -0.8476 15.9994 1295 H 131 SOL HW1 546 +0.4238 1.0080 H +0.4238 1.0080 1296 H 131 SOL HW2 546 +0.4238 1.0080 H +0.4238 1.0080 1297 OW 132 SOL OW 547 -0.8476 15.9994 OW -0.8476 15.9994 1298 H 132 SOL HW1 547 +0.4238 1.0080 H +0.4238 1.0080 1299 H 132 SOL HW2 547 +0.4238 1.0080 H +0.4238 1.0080 1300 OW 133 SOL OW 548 -0.8476 15.9994 OW -0.8476 15.9994 1301 H 133 SOL HW1 548 +0.4238 1.0080 H +0.4238 1.0080 1302 H 133 SOL HW2 548 +0.4238 1.0080 H +0.4238 1.0080 1303 OW 134 SOL OW 549 -0.8476 15.9994 OW -0.8476 15.9994 1304 H 134 SOL HW1 549 +0.4238 1.0080 H +0.4238 1.0080 1305 H 134 SOL HW2 549 +0.4238 1.0080 H +0.4238 1.0080 1306 OW 135 SOL OW 550 -0.8476 15.9994 OW -0.8476 15.9994 1307 H 135 SOL HW1 550 +0.4238 1.0080 H +0.4238 1.0080 1308 H 135 SOL HW2 550 +0.4238 1.0080 H +0.4238 1.0080 1309 OW 136 SOL OW 551 -0.8476 15.9994 OW -0.8476 15.9994 1310 H 136 SOL HW1 551 +0.4238 1.0080 H +0.4238 1.0080 1311 H 136 SOL HW2 551 +0.4238 1.0080 H +0.4238 1.0080 1312 OW 137 SOL OW 552 -0.8476 15.9994 OW -0.8476 15.9994 1313 H 137 SOL HW1 552 +0.4238 1.0080 H +0.4238 1.0080 1314 H 137 SOL HW2 552 +0.4238 1.0080 H +0.4238 1.0080 1315 OW 138 SOL OW 553 -0.8476 15.9994 OW -0.8476 15.9994 1316 H 138 SOL HW1 553 +0.4238 1.0080 H +0.4238 1.0080 1317 H 138 SOL HW2 553 +0.4238 1.0080 H +0.4238 1.0080 1318 OW 139 SOL OW 554 -0.8476 15.9994 OW -0.8476 15.9994 1319 H 139 SOL HW1 554 +0.4238 1.0080 H +0.4238 1.0080 1320 H 139 SOL HW2 554 +0.4238 1.0080 H +0.4238 1.0080 1321 OW 140 SOL OW 555 -0.8476 15.9994 OW -0.8476 15.9994 1322 H 140 SOL HW1 555 +0.4238 1.0080 H +0.4238 1.0080 1323 H 140 SOL HW2 555 +0.4238 1.0080 H +0.4238 1.0080 1324 OW 141 SOL OW 556 -0.8476 15.9994 OW -0.8476 15.9994 1325 H 141 SOL HW1 556 +0.4238 1.0080 H +0.4238 1.0080 1326 H 141 SOL HW2 556 +0.4238 1.0080 H +0.4238 1.0080 1327 OW 142 SOL OW 557 -0.8476 15.9994 OW -0.8476 15.9994 1328 H 142 SOL HW1 557 +0.4238 1.0080 H +0.4238 1.0080 1329 H 142 SOL HW2 557 +0.4238 1.0080 H +0.4238 1.0080 1330 OW 143 SOL OW 558 -0.8476 15.9994 OW -0.8476 15.9994 1331 H 143 SOL HW1 558 +0.4238 1.0080 H +0.4238 1.0080 1332 H 143 SOL HW2 558 +0.4238 1.0080 H +0.4238 1.0080 1333 OW 144 SOL OW 559 -0.8476 15.9994 OW -0.8476 15.9994 1334 H 144 SOL HW1 559 +0.4238 1.0080 H +0.4238 1.0080 1335 H 144 SOL HW2 559 +0.4238 1.0080 H +0.4238 1.0080 1336 OW 145 SOL OW 560 -0.8476 15.9994 OW -0.8476 15.9994 1337 H 145 SOL HW1 560 +0.4238 1.0080 H +0.4238 1.0080 1338 H 145 SOL HW2 560 +0.4238 1.0080 H +0.4238 1.0080 1339 OW 146 SOL OW 561 -0.8476 15.9994 OW -0.8476 15.9994 1340 H 146 SOL HW1 561 +0.4238 1.0080 H +0.4238 1.0080 1341 H 146 SOL HW2 561 +0.4238 1.0080 H +0.4238 1.0080 1342 OW 147 SOL OW 562 -0.8476 15.9994 OW -0.8476 15.9994 1343 H 147 SOL HW1 562 +0.4238 1.0080 H +0.4238 1.0080 1344 H 147 SOL HW2 562 +0.4238 1.0080 H +0.4238 1.0080 1345 OW 148 SOL OW 563 -0.8476 15.9994 OW -0.8476 15.9994 1346 H 148 SOL HW1 563 +0.4238 1.0080 H +0.4238 1.0080 1347 H 148 SOL HW2 563 +0.4238 1.0080 H +0.4238 1.0080 1348 OW 149 SOL OW 564 -0.8476 15.9994 OW -0.8476 15.9994 1349 H 149 SOL HW1 564 +0.4238 1.0080 H +0.4238 1.0080 1350 H 149 SOL HW2 564 +0.4238 1.0080 H +0.4238 1.0080 1351 OW 150 SOL OW 565 -0.8476 15.9994 OW -0.8476 15.9994 1352 H 150 SOL HW1 565 +0.4238 1.0080 H +0.4238 1.0080 1353 H 150 SOL HW2 565 +0.4238 1.0080 H +0.4238 1.0080 1354 OW 151 SOL OW 566 -0.8476 15.9994 OW -0.8476 15.9994 1355 H 151 SOL HW1 566 +0.4238 1.0080 H +0.4238 1.0080 1356 H 151 SOL HW2 566 +0.4238 1.0080 H +0.4238 1.0080 1357 OW 152 SOL OW 567 -0.8476 15.9994 OW -0.8476 15.9994 1358 H 152 SOL HW1 567 +0.4238 1.0080 H +0.4238 1.0080 1359 H 152 SOL HW2 567 +0.4238 1.0080 H +0.4238 1.0080 1360 OW 153 SOL OW 568 -0.8476 15.9994 OW -0.8476 15.9994 1361 H 153 SOL HW1 568 +0.4238 1.0080 H +0.4238 1.0080 1362 H 153 SOL HW2 568 +0.4238 1.0080 H +0.4238 1.0080 1363 OW 154 SOL OW 569 -0.8476 15.9994 OW -0.8476 15.9994 1364 H 154 SOL HW1 569 +0.4238 1.0080 H +0.4238 1.0080 1365 H 154 SOL HW2 569 +0.4238 1.0080 H +0.4238 1.0080 1366 OW 155 SOL OW 570 -0.8476 15.9994 OW -0.8476 15.9994 1367 H 155 SOL HW1 570 +0.4238 1.0080 H +0.4238 1.0080 1368 H 155 SOL HW2 570 +0.4238 1.0080 H +0.4238 1.0080 1369 OW 156 SOL OW 571 -0.8476 15.9994 OW -0.8476 15.9994 1370 H 156 SOL HW1 571 +0.4238 1.0080 H +0.4238 1.0080 1371 H 156 SOL HW2 571 +0.4238 1.0080 H +0.4238 1.0080 1372 OW 157 SOL OW 572 -0.8476 15.9994 OW -0.8476 15.9994 1373 H 157 SOL HW1 572 +0.4238 1.0080 H +0.4238 1.0080 1374 H 157 SOL HW2 572 +0.4238 1.0080 H +0.4238 1.0080 1375 OW 158 SOL OW 573 -0.8476 15.9994 OW -0.8476 15.9994 1376 H 158 SOL HW1 573 +0.4238 1.0080 H +0.4238 1.0080 1377 H 158 SOL HW2 573 +0.4238 1.0080 H +0.4238 1.0080 1378 OW 159 SOL OW 574 -0.8476 15.9994 OW -0.8476 15.9994 1379 H 159 SOL HW1 574 +0.4238 1.0080 H +0.4238 1.0080 1380 H 159 SOL HW2 574 +0.4238 1.0080 H +0.4238 1.0080 1381 OW 160 SOL OW 575 -0.8476 15.9994 OW -0.8476 15.9994 1382 H 160 SOL HW1 575 +0.4238 1.0080 H +0.4238 1.0080 1383 H 160 SOL HW2 575 +0.4238 1.0080 H +0.4238 1.0080 1384 OW 161 SOL OW 576 -0.8476 15.9994 OW -0.8476 15.9994 1385 H 161 SOL HW1 576 +0.4238 1.0080 H +0.4238 1.0080 1386 H 161 SOL HW2 576 +0.4238 1.0080 H +0.4238 1.0080 1387 OW 162 SOL OW 577 -0.8476 15.9994 OW -0.8476 15.9994 1388 H 162 SOL HW1 577 +0.4238 1.0080 H +0.4238 1.0080 1389 H 162 SOL HW2 577 +0.4238 1.0080 H +0.4238 1.0080 1390 OW 163 SOL OW 578 -0.8476 15.9994 OW -0.8476 15.9994 1391 H 163 SOL HW1 578 +0.4238 1.0080 H +0.4238 1.0080 1392 H 163 SOL HW2 578 +0.4238 1.0080 H +0.4238 1.0080 1393 OW 164 SOL OW 579 -0.8476 15.9994 OW -0.8476 15.9994 1394 H 164 SOL HW1 579 +0.4238 1.0080 H +0.4238 1.0080 1395 H 164 SOL HW2 579 +0.4238 1.0080 H +0.4238 1.0080 1396 OW 165 SOL OW 580 -0.8476 15.9994 OW -0.8476 15.9994 1397 H 165 SOL HW1 580 +0.4238 1.0080 H +0.4238 1.0080 1398 H 165 SOL HW2 580 +0.4238 1.0080 H +0.4238 1.0080 1399 OW 166 SOL OW 581 -0.8476 15.9994 OW -0.8476 15.9994 1400 H 166 SOL HW1 581 +0.4238 1.0080 H +0.4238 1.0080 1401 H 166 SOL HW2 581 +0.4238 1.0080 H +0.4238 1.0080 1402 OW 167 SOL OW 582 -0.8476 15.9994 OW -0.8476 15.9994 1403 H 167 SOL HW1 582 +0.4238 1.0080 H +0.4238 1.0080 1404 H 167 SOL HW2 582 +0.4238 1.0080 H +0.4238 1.0080 1405 OW 168 SOL OW 583 -0.8476 15.9994 OW -0.8476 15.9994 1406 H 168 SOL HW1 583 +0.4238 1.0080 H +0.4238 1.0080 1407 H 168 SOL HW2 583 +0.4238 1.0080 H +0.4238 1.0080 1408 OW 169 SOL OW 584 -0.8476 15.9994 OW -0.8476 15.9994 1409 H 169 SOL HW1 584 +0.4238 1.0080 H +0.4238 1.0080 1410 H 169 SOL HW2 584 +0.4238 1.0080 H +0.4238 1.0080 1411 OW 170 SOL OW 585 -0.8476 15.9994 OW -0.8476 15.9994 1412 H 170 SOL HW1 585 +0.4238 1.0080 H +0.4238 1.0080 1413 H 170 SOL HW2 585 +0.4238 1.0080 H +0.4238 1.0080 1414 OW 171 SOL OW 586 -0.8476 15.9994 OW -0.8476 15.9994 1415 H 171 SOL HW1 586 +0.4238 1.0080 H +0.4238 1.0080 1416 H 171 SOL HW2 586 +0.4238 1.0080 H +0.4238 1.0080 1417 OW 172 SOL OW 587 -0.8476 15.9994 OW -0.8476 15.9994 1418 H 172 SOL HW1 587 +0.4238 1.0080 H +0.4238 1.0080 1419 H 172 SOL HW2 587 +0.4238 1.0080 H +0.4238 1.0080 1420 OW 173 SOL OW 588 -0.8476 15.9994 OW -0.8476 15.9994 1421 H 173 SOL HW1 588 +0.4238 1.0080 H +0.4238 1.0080 1422 H 173 SOL HW2 588 +0.4238 1.0080 H +0.4238 1.0080 1423 OW 174 SOL OW 589 -0.8476 15.9994 OW -0.8476 15.9994 1424 H 174 SOL HW1 589 +0.4238 1.0080 H +0.4238 1.0080 1425 H 174 SOL HW2 589 +0.4238 1.0080 H +0.4238 1.0080 1426 OW 175 SOL OW 590 -0.8476 15.9994 OW -0.8476 15.9994 1427 H 175 SOL HW1 590 +0.4238 1.0080 H +0.4238 1.0080 1428 H 175 SOL HW2 590 +0.4238 1.0080 H +0.4238 1.0080 1429 OW 176 SOL OW 591 -0.8476 15.9994 OW -0.8476 15.9994 1430 H 176 SOL HW1 591 +0.4238 1.0080 H +0.4238 1.0080 1431 H 176 SOL HW2 591 +0.4238 1.0080 H +0.4238 1.0080 1432 OW 177 SOL OW 592 -0.8476 15.9994 OW -0.8476 15.9994 1433 H 177 SOL HW1 592 +0.4238 1.0080 H +0.4238 1.0080 1434 H 177 SOL HW2 592 +0.4238 1.0080 H +0.4238 1.0080 1435 OW 178 SOL OW 593 -0.8476 15.9994 OW -0.8476 15.9994 1436 H 178 SOL HW1 593 +0.4238 1.0080 H +0.4238 1.0080 1437 H 178 SOL HW2 593 +0.4238 1.0080 H +0.4238 1.0080 1438 OW 179 SOL OW 594 -0.8476 15.9994 OW -0.8476 15.9994 1439 H 179 SOL HW1 594 +0.4238 1.0080 H +0.4238 1.0080 1440 H 179 SOL HW2 594 +0.4238 1.0080 H +0.4238 1.0080 1441 OW 180 SOL OW 595 -0.8476 15.9994 OW -0.8476 15.9994 1442 H 180 SOL HW1 595 +0.4238 1.0080 H +0.4238 1.0080 1443 H 180 SOL HW2 595 +0.4238 1.0080 H +0.4238 1.0080 1444 OW 181 SOL OW 596 -0.8476 15.9994 OW -0.8476 15.9994 1445 H 181 SOL HW1 596 +0.4238 1.0080 H +0.4238 1.0080 1446 H 181 SOL HW2 596 +0.4238 1.0080 H +0.4238 1.0080 [ bonds ] 791 1244 1 0.2110 224000 1244 1245 1 0.2063 224000 1244 1255 1 0.2063 224000 1244 1265 1 0.2063 224000 1244 1275 1 0.2063 224000 1244 1289 1 0.2030 224000 784 785 2 gb_10 784 787 2 gb_10 785 786 2 gb_2 785 789 2 gb_10 787 788 2 gb_3 787 791 2 gb_10 789 790 2 gb_3 789 791 2 gb_10 1253 1251 1 1.3870e-01 4.0033e+05 ; C1 - C2 1253 1254 1 1.0880e-01 2.8694e+05 ; C1 - H1 CONST 1253 1245 1 1.3420e-01 4.0426e+05 ; C1 - N1 1251 1249 1 1.3870e-01 4.0033e+05 ; C2 - C3 1251 1252 1 1.0870e-01 2.8811e+05 ; C2 - H2 CONST 1249 1247 1 1.3870e-01 4.0033e+05 ; C3 - C4 1249 1250 1 1.0870e-01 2.8811e+05 ; C3 - H3 CONST 1247 1246 1 1.3980e-01 3.8643e+05 ; C4 - C5 1247 1248 1 1.0870e-01 2.8811e+05 ; C4 - H4 CONST 1246 1256 1 1.4900e-01 2.8995e+05 ; C5 - C6 1246 1245 1 1.3398e-01 4.0727e+05 ; C5 - N1 1256 1257 1 1.3980e-01 3.8643e+05 ; C6 - C7 1256 1255 1 1.3398e-01 4.0727e+05 ; C6 - N2 1257 1259 1 1.3870e-01 4.0033e+05 ; C7 - C8 1257 1258 1 1.0870e-01 2.8811e+05 ; C7 - H5 CONST 1259 1261 1 1.3870e-01 4.0033e+05 ; C8 - C10 1259 1260 1 1.0870e-01 2.8811e+05 ; C8 - H6 CONST 1263 1261 1 1.3870e-01 4.0033e+05 ; C9 - C10 1263 1264 1 1.0880e-01 2.8694e+05 ; C9 - H7 CONST 1263 1255 1 1.3420e-01 4.0426e+05 ; C9 - N2 1261 1262 1 1.0870e-01 2.8811e+05 ; C10 - H8 CONST 1273 1271 1 1.3870e-01 4.0033e+05 ; C1 - C2 1273 1274 1 1.0880e-01 2.8694e+05 ; C1 - H1 CONST 1273 1265 1 1.3420e-01 4.0426e+05 ; C1 - N1 1271 1269 1 1.3870e-01 4.0033e+05 ; C2 - C3 1271 1272 1 1.0870e-01 2.8811e+05 ; C2 - H2 CONST 1269 1267 1 1.3870e-01 4.0033e+05 ; C3 - C4 1269 1270 1 1.0870e-01 2.8811e+05 ; C3 - H3 CONST 1267 1266 1 1.3980e-01 3.8643e+05 ; C4 - C5 1267 1268 1 1.0870e-01 2.8811e+05 ; C4 - H4 CONST 1266 1276 1 1.4900e-01 2.8995e+05 ; C5 - C6 1266 1265 1 1.3398e-01 4.0727e+05 ; C5 - N1 1276 1277 1 1.3980e-01 3.8643e+05 ; C6 - C7 1276 1275 1 1.3398e-01 4.0727e+05 ; C6 - N2 1277 1279 1 1.3870e-01 4.0033e+05 ; C7 - C8 1277 1278 1 1.0870e-01 2.8811e+05 ; C7 - H5 CONST 1279 1281 1 1.3870e-01 4.0033e+05 ; C8 - C10 1279 1280 1 1.0870e-01 2.8811e+05 ; C8 - H6 CONST 1283 1281 1 1.3870e-01 4.0033e+05 ; C9 - C10 1283 1284 1 1.0880e-01 2.8694e+05 ; C9 - H7 CONST 1283 1275 1 1.3420e-01 4.0426e+05 ; C9 - N2 1281 1282 1 1.0870e-01 2.8811e+05 ; C10 - H8 CONST 1287 1290 1 1.3710e-01 4.2175e+05 ; C1 - C2 1287 1285 1 1.3710e-01 3.6719e+05 ; C1 - N1 1287 1288 1 1.0830e-01 2.9296e+05 ; C1 - H2 CONST 1290 1291 1 1.0830e-01 2.9296e+05 ; C2 - H3 CONST 1290 1289 1 1.3760e-01 3.6116e+05 ; C2 - N2 1292 1285 1 1.3710e-01 3.6719e+05 ; C3 - N1 1292 1293 1 1.0790e-01 2.9790e+05 ; C3 - H4 CONST 1292 1289 1 1.3350e-01 4.1388e+05 ; C3 - N2 1285 1286 1 1.0110e-01 3.4024e+05 ; N1 - H1 CONST 1243 432 1 0.311 2500 0.263 2500 1243 438 1 0.211 47600 0.198 47600 1243 1088 1 0.231 104300 0.220 104300 1243 1134 1 0.214 47400 0.201 47400 1243 1171 1 0.297 1200 0.297 1200 1 5 2 gb_21 5 6 2 gb_27 5 7 2 gb_27 7 8 2 gb_5 7 9 2 gb_10 9 11 2 gb_21 11 12 2 gb_27 11 17 2 gb_27 12 13 2 gb_27 13 14 2 gb_27 14 15 2 gb_6 14 16 2 gb_6 17 18 2 gb_5 17 19 2 gb_10 19 21 2 gb_21 21 22 2 gb_27 21 24 2 gb_27 22 23 2 gb_32 23 244 2 gb_36 24 25 2 gb_5 24 26 2 gb_10 26 28 2 gb_21 28 29 2 gb_27 28 32 2 gb_27 29 30 2 gb_18 32 33 2 gb_5 32 34 2 gb_10 34 36 2 gb_21 36 37 2 gb_27 36 40 2 gb_27 37 38 2 gb_27 37 39 2 gb_27 40 41 2 gb_5 40 42 2 gb_10 42 44 2 gb_21 44 45 2 gb_27 44 49 2 gb_27 45 46 2 gb_27 46 47 2 gb_6 46 48 2 gb_6 49 50 2 gb_5 49 51 2 gb_10 51 53 2 gb_21 53 54 2 gb_27 53 58 2 gb_27 54 55 2 gb_27 54 56 2 gb_27 55 57 2 gb_27 58 59 2 gb_5 58 60 2 gb_10 60 62 2 gb_21 62 63 2 gb_27 62 70 2 gb_27 63 64 2 gb_27 64 65 2 gb_27 65 66 2 gb_5 65 67 2 gb_9 70 71 2 gb_5 70 72 2 gb_10 72 74 2 gb_21 74 75 2 gb_27 75 76 2 gb_5 75 77 2 gb_10 77 79 2 gb_21 79 80 2 gb_27 79 86 2 gb_27 80 81 2 gb_27 81 82 2 gb_5 81 83 2 gb_9 86 87 2 gb_5 86 88 2 gb_10 88 90 2 gb_21 90 91 2 gb_27 90 95 2 gb_27 91 92 2 gb_27 92 93 2 gb_6 92 94 2 gb_6 95 96 2 gb_5 95 97 2 gb_10 97 99 2 gb_21 99 100 2 gb_27 99 107 2 gb_27 100 101 2 gb_27 101 102 2 gb_27 102 103 2 gb_5 102 104 2 gb_9 107 108 2 gb_5 107 109 2 gb_10 109 111 2 gb_21 111 112 2 gb_27 111 116 2 gb_27 112 113 2 gb_27 113 114 2 gb_32 114 115 2 gb_31 116 117 2 gb_5 116 118 2 gb_10 118 120 2 gb_21 120 121 2 gb_27 120 128 2 gb_27 121 122 2 gb_27 122 123 2 gb_27 123 124 2 gb_5 123 125 2 gb_9 128 129 2 gb_5 128 130 2 gb_10 130 132 2 gb_21 132 133 2 gb_27 132 145 2 gb_27 133 134 2 gb_27 134 135 2 gb_16 134 137 2 gb_16 135 139 2 gb_16 137 141 2 gb_16 139 143 2 gb_16 141 143 2 gb_16 145 146 2 gb_5 145 147 2 gb_10 147 149 2 gb_21 149 150 2 gb_27 149 156 2 gb_27 150 151 2 gb_27 151 152 2 gb_5 151 153 2 gb_9 156 157 2 gb_5 156 158 2 gb_10 158 160 2 gb_21 160 161 2 gb_27 160 165 2 gb_27 161 162 2 gb_18 161 164 2 gb_27 165 166 2 gb_5 165 167 2 gb_10 167 169 2 gb_21 169 170 2 gb_27 169 176 2 gb_27 170 171 2 gb_27 171 172 2 gb_5 171 173 2 gb_9 176 177 2 gb_5 176 178 2 gb_10 178 180 2 gb_21 180 181 2 gb_27 180 182 2 gb_27 182 183 2 gb_5 182 184 2 gb_10 184 186 2 gb_21 186 187 2 gb_27 186 191 2 gb_27 187 188 2 gb_27 187 189 2 gb_27 188 190 2 gb_27 191 192 2 gb_5 191 193 2 gb_10 193 195 2 gb_21 195 196 2 gb_27 195 200 2 gb_27 196 197 2 gb_18 196 199 2 gb_27 200 201 2 gb_5 200 202 2 gb_10 202 204 2 gb_21 204 205 2 gb_27 204 208 2 gb_27 205 206 2 gb_27 205 207 2 gb_27 208 209 2 gb_5 208 210 2 gb_10 210 212 2 gb_21 212 213 2 gb_27 212 217 2 gb_27 213 214 2 gb_27 214 215 2 gb_6 214 216 2 gb_6 217 218 2 gb_5 217 219 2 gb_10 219 221 2 gb_21 221 222 2 gb_27 221 230 2 gb_27 222 223 2 gb_27 223 224 2 gb_27 224 225 2 gb_27 225 226 2 gb_21 230 231 2 gb_5 230 232 2 gb_10 232 234 2 gb_21 234 235 2 gb_27 234 238 2 gb_27 235 236 2 gb_18 238 239 2 gb_5 238 240 2 gb_10 240 242 2 gb_21 242 243 2 gb_27 242 245 2 gb_27 243 244 2 gb_32 245 246 2 gb_5 245 247 2 gb_10 247 249 2 gb_21 249 250 2 gb_27 249 258 2 gb_27 250 251 2 gb_27 251 252 2 gb_27 252 253 2 gb_27 253 254 2 gb_21 258 259 2 gb_5 258 260 2 gb_10 260 262 2 gb_21 262 263 2 gb_27 262 270 2 gb_27 263 264 2 gb_27 264 265 2 gb_27 265 266 2 gb_5 265 267 2 gb_9 270 271 2 gb_5 270 272 2 gb_10 272 274 2 gb_21 274 275 2 gb_27 274 287 2 gb_27 275 276 2 gb_27 276 277 2 gb_16 276 279 2 gb_16 277 281 2 gb_16 279 283 2 gb_16 281 285 2 gb_16 283 285 2 gb_16 287 288 2 gb_5 287 289 2 gb_10 289 291 2 gb_21 291 292 2 gb_27 291 296 2 gb_27 292 293 2 gb_18 292 295 2 gb_27 296 297 2 gb_5 296 298 2 gb_10 298 300 2 gb_21 300 301 2 gb_27 300 304 2 gb_27 301 302 2 gb_27 301 303 2 gb_27 304 305 2 gb_5 304 306 2 gb_10 306 308 2 gb_21 308 309 2 gb_27 308 315 2 gb_27 309 310 2 gb_27 310 311 2 gb_5 310 312 2 gb_9 315 316 2 gb_5 315 317 2 gb_10 317 319 2 gb_21 319 320 2 gb_27 319 324 2 gb_27 320 321 2 gb_27 321 322 2 gb_27 321 323 2 gb_27 324 325 2 gb_5 324 326 2 gb_10 326 328 2 gb_21 328 329 2 gb_27 328 332 2 gb_27 329 330 2 gb_18 332 333 2 gb_5 332 334 2 gb_10 334 336 2 gb_21 336 337 2 gb_27 336 346 2 gb_27 337 338 2 gb_27 338 339 2 gb_10 338 340 2 gb_10 339 342 2 gb_10 340 344 2 gb_10 342 344 2 gb_10 346 347 2 gb_5 346 348 2 gb_10 348 349 2 gb_21 348 352 2 gb_21 349 350 2 gb_27 349 353 2 gb_27 350 351 2 gb_27 351 352 2 gb_27 353 354 2 gb_5 353 355 2 gb_10 355 357 2 gb_21 357 358 2 gb_27 358 359 2 gb_5 358 360 2 gb_10 360 362 2 gb_21 362 363 2 gb_27 362 369 2 gb_27 363 364 2 gb_27 364 365 2 gb_5 364 366 2 gb_9 369 370 2 gb_5 369 371 2 gb_10 371 373 2 gb_21 373 374 2 gb_27 373 378 2 gb_27 374 375 2 gb_27 375 376 2 gb_27 375 377 2 gb_27 378 379 2 gb_5 378 380 2 gb_10 380 381 2 gb_21 380 384 2 gb_21 381 382 2 gb_27 381 385 2 gb_27 382 383 2 gb_27 383 384 2 gb_27 385 386 2 gb_5 385 387 2 gb_10 387 389 2 gb_21 389 390 2 gb_27 389 398 2 gb_27 390 391 2 gb_27 391 392 2 gb_27 392 393 2 gb_27 393 394 2 gb_21 398 399 2 gb_5 398 400 2 gb_10 400 402 2 gb_21 402 403 2 gb_27 402 409 2 gb_27 403 404 2 gb_27 404 405 2 gb_5 404 406 2 gb_9 409 410 2 gb_5 409 411 2 gb_10 411 413 2 gb_21 413 414 2 gb_27 413 417 2 gb_27 414 415 2 gb_27 414 416 2 gb_27 417 418 2 gb_5 417 419 2 gb_10 419 421 2 gb_21 421 422 2 gb_27 421 426 2 gb_27 422 423 2 gb_27 423 424 2 gb_32 424 425 2 gb_31 426 427 2 gb_5 426 428 2 gb_10 428 430 2 gb_21 430 431 2 gb_27 431 432 2 gb_5 431 433 2 gb_10 433 435 2 gb_21 435 436 2 gb_27 435 445 2 gb_27 436 437 2 gb_27 437 438 2 gb_10 437 439 2 gb_10 438 441 2 gb_10 439 443 2 gb_10 441 443 2 gb_10 445 446 2 gb_5 445 447 2 gb_10 447 449 2 gb_21 449 450 2 gb_27 449 456 2 gb_27 450 451 2 gb_27 451 452 2 gb_5 451 453 2 gb_9 456 457 2 gb_5 456 458 2 gb_10 458 460 2 gb_21 460 461 2 gb_27 460 477 2 gb_27 461 462 2 gb_27 462 463 2 gb_10 462 465 2 gb_16 463 466 2 gb_10 465 468 2 gb_16 465 469 2 gb_16 466 468 2 gb_10 468 471 2 gb_16 469 473 2 gb_16 471 475 2 gb_16 473 475 2 gb_16 477 478 2 gb_5 477 479 2 gb_10 479 481 2 gb_21 481 482 2 gb_27 481 485 2 gb_27 482 483 2 gb_27 482 484 2 gb_27 485 486 2 gb_5 485 487 2 gb_10 487 489 2 gb_21 489 490 2 gb_27 489 494 2 gb_27 490 491 2 gb_27 491 492 2 gb_27 491 493 2 gb_27 494 495 2 gb_5 494 496 2 gb_10 496 498 2 gb_21 498 499 2 gb_27 498 502 2 gb_27 499 500 2 gb_18 502 503 2 gb_5 502 504 2 gb_10 504 506 2 gb_21 506 507 2 gb_27 506 511 2 gb_27 507 508 2 gb_18 507 510 2 gb_27 511 512 2 gb_5 511 513 2 gb_10 513 515 2 gb_21 515 516 2 gb_27 515 517 2 gb_27 517 518 2 gb_5 517 519 2 gb_10 519 521 2 gb_21 521 522 2 gb_27 521 523 2 gb_27 523 524 2 gb_5 523 525 2 gb_10 525 527 2 gb_21 527 528 2 gb_27 527 532 2 gb_27 528 529 2 gb_27 529 530 2 gb_6 529 531 2 gb_6 532 533 2 gb_5 532 534 2 gb_10 534 536 2 gb_21 536 537 2 gb_27 536 541 2 gb_27 537 538 2 gb_27 538 539 2 gb_32 539 540 2 gb_31 541 542 2 gb_5 541 543 2 gb_10 543 545 2 gb_21 545 546 2 gb_27 545 553 2 gb_27 546 547 2 gb_27 547 548 2 gb_27 548 549 2 gb_5 548 550 2 gb_9 553 554 2 gb_5 553 555 2 gb_10 555 557 2 gb_21 557 558 2 gb_27 558 559 2 gb_5 558 560 2 gb_10 560 562 2 gb_21 562 563 2 gb_27 562 566 2 gb_27 563 564 2 gb_27 563 565 2 gb_27 566 567 2 gb_5 566 568 2 gb_10 568 570 2 gb_21 570 571 2 gb_27 570 574 2 gb_27 571 572 2 gb_27 571 573 2 gb_27 574 575 2 gb_5 574 576 2 gb_10 576 578 2 gb_21 578 579 2 gb_27 578 583 2 gb_27 579 580 2 gb_18 579 582 2 gb_27 583 584 2 gb_5 583 585 2 gb_10 585 587 2 gb_21 587 588 2 gb_27 587 592 2 gb_27 588 589 2 gb_27 589 590 2 gb_6 589 591 2 gb_6 592 593 2 gb_5 592 594 2 gb_10 594 596 2 gb_21 596 597 2 gb_27 597 598 2 gb_5 597 599 2 gb_10 599 601 2 gb_21 601 602 2 gb_27 601 606 2 gb_27 602 603 2 gb_27 603 604 2 gb_32 604 605 2 gb_31 606 607 2 gb_5 606 608 2 gb_10 608 610 2 gb_21 610 611 2 gb_27 610 612 2 gb_27 612 613 2 gb_5 612 614 2 gb_10 614 616 2 gb_21 616 617 2 gb_27 616 620 2 gb_27 617 618 2 gb_18 620 621 2 gb_5 620 622 2 gb_10 622 624 2 gb_21 624 625 2 gb_27 625 626 2 gb_5 625 627 2 gb_10 627 629 2 gb_21 629 630 2 gb_27 629 634 2 gb_27 630 631 2 gb_27 631 632 2 gb_27 631 633 2 gb_27 634 635 2 gb_5 634 636 2 gb_10 636 638 2 gb_21 638 639 2 gb_27 638 643 2 gb_27 639 640 2 gb_27 640 641 2 gb_6 640 642 2 gb_6 643 644 2 gb_5 643 645 2 gb_10 645 647 2 gb_21 647 648 2 gb_27 647 656 2 gb_27 648 649 2 gb_27 649 650 2 gb_27 650 651 2 gb_27 651 652 2 gb_21 656 657 2 gb_5 656 658 2 gb_10 658 660 2 gb_21 660 661 2 gb_27 660 665 2 gb_27 661 662 2 gb_27 662 663 2 gb_6 662 664 2 gb_6 665 666 2 gb_5 665 667 2 gb_10 667 669 2 gb_21 669 670 2 gb_27 669 683 2 gb_27 670 671 2 gb_27 671 672 2 gb_16 671 674 2 gb_16 672 676 2 gb_16 674 678 2 gb_16 676 680 2 gb_16 678 680 2 gb_16 680 681 2 gb_13 683 684 2 gb_5 683 685 2 gb_10 685 687 2 gb_21 687 688 2 gb_27 687 692 2 gb_27 688 689 2 gb_27 689 690 2 gb_27 689 691 2 gb_27 692 693 2 gb_5 692 694 2 gb_10 694 696 2 gb_21 696 697 2 gb_27 696 705 2 gb_27 697 698 2 gb_27 698 699 2 gb_27 699 700 2 gb_27 700 701 2 gb_21 705 706 2 gb_5 705 707 2 gb_10 707 708 2 gb_21 707 711 2 gb_21 708 709 2 gb_27 708 712 2 gb_27 709 710 2 gb_27 710 711 2 gb_27 712 713 2 gb_5 712 714 2 gb_10 714 716 2 gb_21 716 717 2 gb_27 716 721 2 gb_27 717 718 2 gb_27 718 719 2 gb_6 718 720 2 gb_6 721 722 2 gb_5 721 723 2 gb_10 723 725 2 gb_21 725 726 2 gb_27 725 730 2 gb_27 726 727 2 gb_27 727 728 2 gb_6 727 729 2 gb_6 730 731 2 gb_5 730 732 2 gb_10 732 734 2 gb_21 734 735 2 gb_27 734 738 2 gb_27 735 736 2 gb_18 738 739 2 gb_5 738 740 2 gb_10 740 742 2 gb_21 742 743 2 gb_27 742 755 2 gb_27 743 744 2 gb_27 744 745 2 gb_27 745 746 2 gb_21 746 748 2 gb_11 748 749 2 gb_11 748 752 2 gb_11 755 756 2 gb_5 755 757 2 gb_10 757 759 2 gb_21 759 760 2 gb_27 759 763 2 gb_27 760 761 2 gb_27 760 762 2 gb_27 763 764 2 gb_5 763 765 2 gb_10 765 767 2 gb_21 767 768 2 gb_27 767 772 2 gb_27 768 769 2 gb_27 768 770 2 gb_27 769 771 2 gb_27 772 773 2 gb_5 772 774 2 gb_10 774 776 2 gb_21 776 777 2 gb_27 776 778 2 gb_27 778 779 2 gb_5 778 780 2 gb_10 780 782 2 gb_21 782 783 2 gb_27 782 792 2 gb_27 783 784 2 gb_27 792 793 2 gb_5 792 794 2 gb_10 794 796 2 gb_21 796 797 2 gb_27 796 801 2 gb_27 797 798 2 gb_18 797 800 2 gb_27 801 802 2 gb_5 801 803 2 gb_10 803 805 2 gb_21 805 806 2 gb_27 805 814 2 gb_27 806 807 2 gb_27 807 808 2 gb_27 808 809 2 gb_27 809 810 2 gb_21 814 815 2 gb_5 814 816 2 gb_10 816 818 2 gb_21 818 819 2 gb_27 818 823 2 gb_27 819 820 2 gb_27 820 821 2 gb_27 820 822 2 gb_27 823 824 2 gb_5 823 825 2 gb_10 825 827 2 gb_21 827 828 2 gb_27 827 832 2 gb_27 828 829 2 gb_27 828 830 2 gb_27 829 831 2 gb_27 832 833 2 gb_5 832 834 2 gb_10 834 836 2 gb_21 836 837 2 gb_27 837 838 2 gb_5 837 839 2 gb_10 839 841 2 gb_21 841 842 2 gb_27 841 845 2 gb_27 842 843 2 gb_18 845 846 2 gb_5 845 847 2 gb_10 847 849 2 gb_21 849 850 2 gb_27 850 851 2 gb_5 850 852 2 gb_10 852 854 2 gb_21 854 855 2 gb_27 854 860 2 gb_27 855 856 2 gb_27 856 857 2 gb_27 857 858 2 gb_6 857 859 2 gb_6 860 861 2 gb_5 860 862 2 gb_10 862 864 2 gb_21 864 865 2 gb_27 864 873 2 gb_27 865 866 2 gb_27 866 867 2 gb_27 867 868 2 gb_27 868 869 2 gb_21 873 874 2 gb_5 873 875 2 gb_10 875 877 2 gb_21 877 878 2 gb_27 877 882 2 gb_27 878 879 2 gb_27 879 880 2 gb_6 879 881 2 gb_6 882 883 2 gb_5 882 884 2 gb_10 884 886 2 gb_21 886 887 2 gb_27 886 890 2 gb_27 887 888 2 gb_18 890 891 2 gb_5 890 892 2 gb_10 892 894 2 gb_21 894 895 2 gb_27 894 898 2 gb_27 895 896 2 gb_27 895 897 2 gb_27 898 899 2 gb_5 898 900 2 gb_10 900 902 2 gb_21 902 903 2 gb_27 902 907 2 gb_27 903 904 2 gb_18 903 906 2 gb_27 907 908 2 gb_5 907 909 2 gb_10 909 911 2 gb_21 911 912 2 gb_27 911 924 2 gb_27 912 913 2 gb_27 913 914 2 gb_16 913 916 2 gb_16 914 918 2 gb_16 916 920 2 gb_16 918 922 2 gb_16 920 922 2 gb_16 924 925 2 gb_5 924 926 2 gb_10 926 928 2 gb_21 928 929 2 gb_27 928 933 2 gb_27 929 930 2 gb_27 930 931 2 gb_6 930 932 2 gb_6 933 934 2 gb_5 933 935 2 gb_10 935 937 2 gb_21 937 938 2 gb_27 937 941 2 gb_27 938 939 2 gb_27 938 940 2 gb_27 941 942 2 gb_5 941 943 2 gb_10 943 945 2 gb_21 945 946 2 gb_27 945 949 2 gb_27 946 947 2 gb_18 949 950 2 gb_5 949 951 2 gb_10 951 953 2 gb_21 953 954 2 gb_27 953 962 2 gb_27 954 955 2 gb_27 955 956 2 gb_27 956 957 2 gb_27 957 958 2 gb_21 962 963 2 gb_5 962 964 2 gb_10 964 966 2 gb_21 966 967 2 gb_27 966 971 2 gb_27 967 968 2 gb_27 968 969 2 gb_27 968 970 2 gb_27 971 972 2 gb_5 971 973 2 gb_10 973 975 2 gb_21 975 976 2 gb_27 975 984 2 gb_27 976 977 2 gb_27 977 978 2 gb_27 978 979 2 gb_27 979 980 2 gb_21 984 985 2 gb_5 984 986 2 gb_10 986 988 2 gb_21 988 989 2 gb_27 988 994 2 gb_27 989 990 2 gb_27 990 991 2 gb_27 991 992 2 gb_6 991 993 2 gb_6 994 995 2 gb_5 994 996 2 gb_10 996 998 2 gb_21 998 999 2 gb_27 999 1000 2 gb_5 999 1001 2 gb_10 1001 1003 2 gb_21 1003 1004 2 gb_27 1003 1009 2 gb_27 1004 1005 2 gb_27 1005 1006 2 gb_27 1006 1007 2 gb_6 1006 1008 2 gb_6 1009 1010 2 gb_5 1009 1011 2 gb_10 1011 1013 2 gb_21 1013 1014 2 gb_27 1013 1021 2 gb_27 1014 1015 2 gb_27 1015 1016 2 gb_27 1016 1017 2 gb_5 1016 1018 2 gb_9 1021 1022 2 gb_5 1021 1023 2 gb_10 1023 1025 2 gb_21 1025 1026 2 gb_27 1025 1039 2 gb_27 1026 1027 2 gb_27 1027 1028 2 gb_16 1027 1030 2 gb_16 1028 1032 2 gb_16 1030 1034 2 gb_16 1032 1036 2 gb_16 1034 1036 2 gb_16 1036 1037 2 gb_13 1039 1040 2 gb_5 1039 1041 2 gb_10 1041 1043 2 gb_21 1043 1044 2 gb_27 1043 1048 2 gb_27 1044 1045 2 gb_27 1045 1046 2 gb_32 1046 1047 2 gb_31 1048 1049 2 gb_5 1048 1050 2 gb_10 1050 1052 2 gb_21 1052 1053 2 gb_27 1052 1065 2 gb_27 1053 1054 2 gb_27 1054 1055 2 gb_16 1054 1057 2 gb_16 1055 1059 2 gb_16 1057 1061 2 gb_16 1059 1063 2 gb_16 1061 1063 2 gb_16 1065 1066 2 gb_5 1065 1067 2 gb_10 1067 1069 2 gb_21 1069 1070 2 gb_27 1069 1082 2 gb_27 1070 1071 2 gb_27 1071 1072 2 gb_16 1071 1074 2 gb_16 1072 1076 2 gb_16 1074 1078 2 gb_16 1076 1080 2 gb_16 1078 1080 2 gb_16 1082 1083 2 gb_5 1082 1084 2 gb_10 1084 1086 2 gb_21 1086 1087 2 gb_27 1086 1089 2 gb_27 1087 1088 2 gb_32 1089 1090 2 gb_5 1089 1091 2 gb_10 1091 1093 2 gb_21 1093 1094 2 gb_27 1093 1098 2 gb_27 1094 1095 2 gb_18 1094 1097 2 gb_27 1098 1099 2 gb_5 1098 1100 2 gb_10 1100 1102 2 gb_21 1102 1103 2 gb_27 1102 1115 2 gb_27 1103 1104 2 gb_27 1104 1105 2 gb_16 1104 1107 2 gb_16 1105 1109 2 gb_16 1107 1111 2 gb_16 1109 1113 2 gb_16 1111 1113 2 gb_16 1115 1116 2 gb_5 1115 1117 2 gb_10 1117 1118 2 gb_21 1117 1121 2 gb_21 1118 1119 2 gb_27 1118 1122 2 gb_27 1119 1120 2 gb_27 1120 1121 2 gb_27 1122 1123 2 gb_5 1122 1124 2 gb_10 1124 1126 2 gb_21 1126 1127 2 gb_27 1127 1128 2 gb_5 1127 1129 2 gb_10 1129 1131 2 gb_21 1131 1132 2 gb_27 1131 1141 2 gb_27 1132 1133 2 gb_27 1133 1134 2 gb_10 1133 1135 2 gb_10 1134 1137 2 gb_10 1135 1139 2 gb_10 1137 1139 2 gb_10 1141 1142 2 gb_5 1141 1143 2 gb_10 1143 1145 2 gb_21 1145 1146 2 gb_27 1145 1149 2 gb_27 1146 1147 2 gb_18 1149 1150 2 gb_5 1149 1151 2 gb_10 1151 1153 2 gb_21 1153 1154 2 gb_27 1153 1155 2 gb_27 1155 1156 2 gb_5 1155 1157 2 gb_10 1157 1159 2 gb_21 1159 1160 2 gb_27 1159 1164 2 gb_27 1160 1161 2 gb_27 1161 1162 2 gb_27 1161 1163 2 gb_27 1164 1165 2 gb_5 1164 1166 2 gb_10 1166 1168 2 gb_21 1168 1169 2 gb_27 1168 1173 2 gb_27 1169 1170 2 gb_27 1170 1171 2 gb_32 1171 1172 2 gb_31 1173 1174 2 gb_5 1173 1175 2 gb_10 1175 1177 2 gb_21 1177 1178 2 gb_27 1177 1186 2 gb_27 1178 1179 2 gb_27 1179 1180 2 gb_27 1180 1181 2 gb_27 1181 1182 2 gb_21 1186 1187 2 gb_5 1186 1188 2 gb_10 1188 1190 2 gb_21 1190 1191 2 gb_27 1191 1192 2 gb_5 1191 1193 2 gb_10 1193 1195 2 gb_21 1195 1196 2 gb_27 1195 1200 2 gb_27 1196 1197 2 gb_18 1196 1199 2 gb_27 1200 1201 2 gb_5 1200 1202 2 gb_10 1202 1204 2 gb_21 1204 1205 2 gb_27 1204 1209 2 gb_27 1205 1206 2 gb_27 1206 1207 2 gb_27 1206 1208 2 gb_27 1209 1210 2 gb_5 1209 1211 2 gb_10 1211 1213 2 gb_21 1213 1214 2 gb_27 1213 1218 2 gb_27 1214 1215 2 gb_18 1214 1217 2 gb_27 1218 1219 2 gb_5 1218 1220 2 gb_10 1220 1222 2 gb_21 1222 1223 2 gb_27 1222 1227 2 gb_27 1223 1224 2 gb_27 1224 1225 2 gb_27 1224 1226 2 gb_27 1227 1228 2 gb_5 1227 1229 2 gb_10 1229 1231 2 gb_21 1231 1232 2 gb_27 1231 1240 2 gb_27 1232 1233 2 gb_27 1233 1234 2 gb_27 1234 1235 2 gb_27 1235 1236 2 gb_21 1240 1241 2 gb_6 1240 1242 2 gb_6 [ pairs ] 1253 1247 1 ; C1 - C4 1253 1250 1 ; C1 - H3 1253 1256 1 ; C1 - C6 1251 1246 1 ; C2 - C5 1251 1248 1 ; C2 - H4 1249 1256 1 ; C3 - C6 1247 1252 1 ; C4 - H2 1247 1257 1 ; C4 - C7 1247 1255 1 ; C4 - N2 1246 1250 1 ; C5 - H3 1246 1259 1 ; C5 - C8 1246 1258 1 ; C5 - H5 1246 1263 1 ; C5 - C9 1254 1249 1 ; H1 - C3 1254 1246 1 ; H1 - C5 1254 1252 1 ; H1 - H2 1252 1250 1 ; H2 - H3 1250 1248 1 ; H3 - H4 1248 1256 1 ; H4 - C6 1248 1245 1 ; H4 - N1 1256 1261 1 ; C6 - C10 1256 1260 1 ; C6 - H6 1256 1264 1 ; C6 - H7 1257 1263 1 ; C7 - C9 1257 1262 1 ; C7 - H8 1257 1245 1 ; C7 - N1 1259 1264 1 ; C8 - H7 1259 1255 1 ; C8 - N2 1258 1261 1 ; H5 - C10 1258 1260 1 ; H5 - H6 1258 1255 1 ; H5 - N2 1263 1260 1 ; C9 - H6 1260 1262 1 ; H6 - H8 1264 1262 1 ; H7 - H8 1262 1255 1 ; H8 - N2 1245 1249 1 ; N1 - C3 1245 1252 1 ; N1 - H2 1245 1255 1 ; N1 - N2 1273 1267 1 ; C1 - C4 1273 1270 1 ; C1 - H3 1273 1276 1 ; C1 - C6 1271 1266 1 ; C2 - C5 1271 1268 1 ; C2 - H4 1269 1276 1 ; C3 - C6 1267 1272 1 ; C4 - H2 1267 1277 1 ; C4 - C7 1267 1275 1 ; C4 - N2 1266 1270 1 ; C5 - H3 1266 1279 1 ; C5 - C8 1266 1278 1 ; C5 - H5 1266 1283 1 ; C5 - C9 1274 1269 1 ; H1 - C3 1274 1266 1 ; H1 - C5 1274 1272 1 ; H1 - H2 1272 1270 1 ; H2 - H3 1270 1268 1 ; H3 - H4 1268 1276 1 ; H4 - C6 1268 1265 1 ; H4 - N1 1276 1281 1 ; C6 - C10 1276 1280 1 ; C6 - H6 1276 1284 1 ; C6 - H7 1277 1283 1 ; C7 - C9 1277 1282 1 ; C7 - H8 1277 1265 1 ; C7 - N1 1279 1284 1 ; C8 - H7 1279 1275 1 ; C8 - N2 1278 1281 1 ; H5 - C10 1278 1280 1 ; H5 - H6 1278 1275 1 ; H5 - N2 1283 1280 1 ; C9 - H6 1280 1282 1 ; H6 - H8 1284 1282 1 ; H7 - H8 1282 1275 1 ; H8 - N2 1265 1269 1 ; N1 - C3 1265 1272 1 ; N1 - H2 1265 1275 1 ; N1 - N2 1287 1293 1 ; C1 - H4 1290 1286 1 ; C2 - H1 1290 1293 1 ; C2 - H4 1292 1291 1 ; C3 - H3 1285 1291 1 ; N1 - H3 1286 1293 1 ; H1 - H4 1286 1289 1 ; H1 - N2 1288 1292 1 ; H2 - C3 1288 1286 1 ; H2 - H1 1288 1291 1 ; H2 - H3 1288 1289 1 ; H2 - N2 1 8 1 1 9 1 2 6 1 2 7 1 3 6 1 3 7 1 4 6 1 4 7 1 5 10 1 5 11 1 6 8 1 6 9 1 7 12 1 7 17 1 8 10 1 8 11 1 9 13 1 9 18 1 9 19 1 10 12 1 10 17 1 11 14 1 11 20 1 11 21 1 12 15 1 12 16 1 12 18 1 12 19 1 13 17 1 17 22 1 17 24 1 18 20 1 18 21 1 19 23 1 19 25 1 19 26 1 20 22 1 20 24 1 21 27 1 21 28 1 21 244 1 22 25 1 22 26 1 22 243 1 23 24 1 23 242 1 24 29 1 24 32 1 25 27 1 25 28 1 26 30 1 26 33 1 26 34 1 27 29 1 27 32 1 28 31 1 28 35 1 28 36 1 29 33 1 29 34 1 30 32 1 32 37 1 32 40 1 33 35 1 33 36 1 34 38 1 34 39 1 34 41 1 34 42 1 35 37 1 35 40 1 36 43 1 36 44 1 37 41 1 37 42 1 38 40 1 39 40 1 40 45 1 40 49 1 41 43 1 41 44 1 42 46 1 42 50 1 42 51 1 43 45 1 43 49 1 44 47 1 44 48 1 44 52 1 44 53 1 45 50 1 45 51 1 46 49 1 49 54 1 49 58 1 50 52 1 50 53 1 51 55 1 51 56 1 51 59 1 51 60 1 52 54 1 52 58 1 53 57 1 53 61 1 53 62 1 54 59 1 54 60 1 55 58 1 56 57 1 56 58 1 58 63 1 58 70 1 59 61 1 59 62 1 60 64 1 60 71 1 60 72 1 61 63 1 61 70 1 62 65 1 62 73 1 62 74 1 63 66 1 63 67 1 63 71 1 63 72 1 64 68 1 64 69 1 64 70 1 66 68 1 66 69 1 70 75 1 71 73 1 71 74 1 72 76 1 72 77 1 73 75 1 74 78 1 74 79 1 75 80 1 75 86 1 76 78 1 76 79 1 77 81 1 77 87 1 77 88 1 78 80 1 78 86 1 79 82 1 79 83 1 79 89 1 79 90 1 80 84 1 80 85 1 80 87 1 80 88 1 81 86 1 82 84 1 82 85 1 86 91 1 86 95 1 87 89 1 87 90 1 88 92 1 88 96 1 88 97 1 89 91 1 89 95 1 90 93 1 90 94 1 90 98 1 90 99 1 91 96 1 91 97 1 92 95 1 95 100 1 95 107 1 96 98 1 96 99 1 97 101 1 97 108 1 97 109 1 98 100 1 98 107 1 99 102 1 99 110 1 99 111 1 100 103 1 100 104 1 100 108 1 100 109 1 101 105 1 101 106 1 101 107 1 103 105 1 103 106 1 107 112 1 107 116 1 108 110 1 108 111 1 109 113 1 109 117 1 109 118 1 110 112 1 110 116 1 111 114 1 111 119 1 111 120 1 112 115 1 112 117 1 112 118 1 113 116 1 116 121 1 116 128 1 117 119 1 117 120 1 118 122 1 118 129 1 118 130 1 119 121 1 119 128 1 120 123 1 120 131 1 120 132 1 121 124 1 121 125 1 121 129 1 121 130 1 122 126 1 122 127 1 122 128 1 124 126 1 124 127 1 128 133 1 128 145 1 129 131 1 129 132 1 130 134 1 130 146 1 130 147 1 131 133 1 131 145 1 132 135 1 132 137 1 132 148 1 132 149 1 133 146 1 133 147 1 134 145 1 145 150 1 145 156 1 146 148 1 146 149 1 147 151 1 147 157 1 147 158 1 148 150 1 148 156 1 149 152 1 149 153 1 149 159 1 149 160 1 150 154 1 150 155 1 150 157 1 150 158 1 151 156 1 152 154 1 152 155 1 156 161 1 156 165 1 157 159 1 157 160 1 158 162 1 158 164 1 158 166 1 158 167 1 159 161 1 159 165 1 160 163 1 160 168 1 160 169 1 161 166 1 161 167 1 162 165 1 163 164 1 164 165 1 165 170 1 165 176 1 166 168 1 166 169 1 167 171 1 167 177 1 167 178 1 168 170 1 168 176 1 169 172 1 169 173 1 169 179 1 169 180 1 170 174 1 170 175 1 170 177 1 170 178 1 171 176 1 172 174 1 172 175 1 176 181 1 176 182 1 177 179 1 177 180 1 178 183 1 178 184 1 179 181 1 179 182 1 180 185 1 180 186 1 181 183 1 181 184 1 182 187 1 182 191 1 183 185 1 183 186 1 184 188 1 184 189 1 184 192 1 184 193 1 185 187 1 185 191 1 186 190 1 186 194 1 186 195 1 187 192 1 187 193 1 188 191 1 189 190 1 189 191 1 191 196 1 191 200 1 192 194 1 192 195 1 193 197 1 193 199 1 193 201 1 193 202 1 194 196 1 194 200 1 195 198 1 195 203 1 195 204 1 196 201 1 196 202 1 197 200 1 198 199 1 199 200 1 200 205 1 200 208 1 201 203 1 201 204 1 202 206 1 202 207 1 202 209 1 202 210 1 203 205 1 203 208 1 204 211 1 204 212 1 205 209 1 205 210 1 206 208 1 207 208 1 208 213 1 208 217 1 209 211 1 209 212 1 210 214 1 210 218 1 210 219 1 211 213 1 211 217 1 212 215 1 212 216 1 212 220 1 212 221 1 213 218 1 213 219 1 214 217 1 217 222 1 217 230 1 218 220 1 218 221 1 219 223 1 219 231 1 219 232 1 220 222 1 220 230 1 221 224 1 221 233 1 221 234 1 222 225 1 222 231 1 222 232 1 223 226 1 223 230 1 224 227 1 224 228 1 224 229 1 230 235 1 230 238 1 231 233 1 231 234 1 232 236 1 232 239 1 232 240 1 233 235 1 233 238 1 234 237 1 234 241 1 234 242 1 235 239 1 235 240 1 236 238 1 238 243 1 238 245 1 239 241 1 239 242 1 240 244 1 240 246 1 240 247 1 241 243 1 241 245 1 242 248 1 242 249 1 243 246 1 243 247 1 244 245 1 245 250 1 245 258 1 246 248 1 246 249 1 247 251 1 247 259 1 247 260 1 248 250 1 248 258 1 249 252 1 249 261 1 249 262 1 250 253 1 250 259 1 250 260 1 251 254 1 251 258 1 252 255 1 252 256 1 252 257 1 258 263 1 258 270 1 259 261 1 259 262 1 260 264 1 260 271 1 260 272 1 261 263 1 261 270 1 262 265 1 262 273 1 262 274 1 263 266 1 263 267 1 263 271 1 263 272 1 264 268 1 264 269 1 264 270 1 266 268 1 266 269 1 270 275 1 270 287 1 271 273 1 271 274 1 272 276 1 272 288 1 272 289 1 273 275 1 273 287 1 274 277 1 274 279 1 274 290 1 274 291 1 275 288 1 275 289 1 276 287 1 287 292 1 287 296 1 288 290 1 288 291 1 289 293 1 289 295 1 289 297 1 289 298 1 290 292 1 290 296 1 291 294 1 291 299 1 291 300 1 292 297 1 292 298 1 293 296 1 294 295 1 295 296 1 296 301 1 296 304 1 297 299 1 297 300 1 298 302 1 298 303 1 298 305 1 298 306 1 299 301 1 299 304 1 300 307 1 300 308 1 301 305 1 301 306 1 302 304 1 303 304 1 304 309 1 304 315 1 305 307 1 305 308 1 306 310 1 306 316 1 306 317 1 307 309 1 307 315 1 308 311 1 308 312 1 308 318 1 308 319 1 309 313 1 309 314 1 309 316 1 309 317 1 310 315 1 311 313 1 311 314 1 315 320 1 315 324 1 316 318 1 316 319 1 317 321 1 317 325 1 317 326 1 318 320 1 318 324 1 319 322 1 319 323 1 319 327 1 319 328 1 320 325 1 320 326 1 321 324 1 324 329 1 324 332 1 325 327 1 325 328 1 326 330 1 326 333 1 326 334 1 327 329 1 327 332 1 328 331 1 328 335 1 328 336 1 329 333 1 329 334 1 330 332 1 332 337 1 332 346 1 333 335 1 333 336 1 334 338 1 334 347 1 334 348 1 335 337 1 335 346 1 336 339 1 336 340 1 336 349 1 336 352 1 337 347 1 337 348 1 338 346 1 346 350 1 346 351 1 346 353 1 347 349 1 347 352 1 348 354 1 348 355 1 349 356 1 349 357 1 350 354 1 350 355 1 351 353 1 352 353 1 353 358 1 354 356 1 354 357 1 355 359 1 355 360 1 356 358 1 357 361 1 357 362 1 358 363 1 358 369 1 359 361 1 359 362 1 360 364 1 360 370 1 360 371 1 361 363 1 361 369 1 362 365 1 362 366 1 362 372 1 362 373 1 363 367 1 363 368 1 363 370 1 363 371 1 364 369 1 365 367 1 365 368 1 369 374 1 369 378 1 370 372 1 370 373 1 371 375 1 371 379 1 371 380 1 372 374 1 372 378 1 373 376 1 373 377 1 373 381 1 373 384 1 374 379 1 374 380 1 375 378 1 378 382 1 378 383 1 378 385 1 379 381 1 379 384 1 380 386 1 380 387 1 381 388 1 381 389 1 382 386 1 382 387 1 383 385 1 384 385 1 385 390 1 385 398 1 386 388 1 386 389 1 387 391 1 387 399 1 387 400 1 388 390 1 388 398 1 389 392 1 389 401 1 389 402 1 390 393 1 390 399 1 390 400 1 391 394 1 391 398 1 392 395 1 392 396 1 392 397 1 398 403 1 398 409 1 399 401 1 399 402 1 400 404 1 400 410 1 400 411 1 401 403 1 401 409 1 402 405 1 402 406 1 402 412 1 402 413 1 403 407 1 403 408 1 403 410 1 403 411 1 404 409 1 405 407 1 405 408 1 409 414 1 409 417 1 410 412 1 410 413 1 411 415 1 411 416 1 411 418 1 411 419 1 412 414 1 412 417 1 413 420 1 413 421 1 414 418 1 414 419 1 415 417 1 416 417 1 417 422 1 417 426 1 418 420 1 418 421 1 419 423 1 419 427 1 419 428 1 420 422 1 420 426 1 421 424 1 421 429 1 421 430 1 422 425 1 422 427 1 422 428 1 423 426 1 426 431 1 427 429 1 427 430 1 428 432 1 428 433 1 429 431 1 430 434 1 430 435 1 431 436 1 431 445 1 432 434 1 432 435 1 433 437 1 433 446 1 433 447 1 434 436 1 434 445 1 435 438 1 435 439 1 435 448 1 435 449 1 436 446 1 436 447 1 437 445 1 445 450 1 445 456 1 446 448 1 446 449 1 447 451 1 447 457 1 447 458 1 448 450 1 448 456 1 449 452 1 449 453 1 449 459 1 449 460 1 450 454 1 450 455 1 450 457 1 450 458 1 451 456 1 452 454 1 452 455 1 456 461 1 456 477 1 457 459 1 457 460 1 458 462 1 458 478 1 458 479 1 459 461 1 459 477 1 460 463 1 460 465 1 460 480 1 460 481 1 461 478 1 461 479 1 462 477 1 477 482 1 477 485 1 478 480 1 478 481 1 479 483 1 479 484 1 479 486 1 479 487 1 480 482 1 480 485 1 481 488 1 481 489 1 482 486 1 482 487 1 483 485 1 484 485 1 485 490 1 485 494 1 486 488 1 486 489 1 487 491 1 487 495 1 487 496 1 488 490 1 488 494 1 489 492 1 489 493 1 489 497 1 489 498 1 490 495 1 490 496 1 491 494 1 494 499 1 494 502 1 495 497 1 495 498 1 496 500 1 496 503 1 496 504 1 497 499 1 497 502 1 498 501 1 498 505 1 498 506 1 499 503 1 499 504 1 500 502 1 502 507 1 502 511 1 503 505 1 503 506 1 504 508 1 504 510 1 504 512 1 504 513 1 505 507 1 505 511 1 506 509 1 506 514 1 506 515 1 507 512 1 507 513 1 508 511 1 509 510 1 510 511 1 511 516 1 511 517 1 512 514 1 512 515 1 513 518 1 513 519 1 514 516 1 514 517 1 515 520 1 515 521 1 516 518 1 516 519 1 517 522 1 517 523 1 518 520 1 518 521 1 519 524 1 519 525 1 520 522 1 520 523 1 521 526 1 521 527 1 522 524 1 522 525 1 523 528 1 523 532 1 524 526 1 524 527 1 525 529 1 525 533 1 525 534 1 526 528 1 526 532 1 527 530 1 527 531 1 527 535 1 527 536 1 528 533 1 528 534 1 529 532 1 532 537 1 532 541 1 533 535 1 533 536 1 534 538 1 534 542 1 534 543 1 535 537 1 535 541 1 536 539 1 536 544 1 536 545 1 537 540 1 537 542 1 537 543 1 538 541 1 541 546 1 541 553 1 542 544 1 542 545 1 543 547 1 543 554 1 543 555 1 544 546 1 544 553 1 545 548 1 545 556 1 545 557 1 546 549 1 546 550 1 546 554 1 546 555 1 547 551 1 547 552 1 547 553 1 549 551 1 549 552 1 553 558 1 554 556 1 554 557 1 555 559 1 555 560 1 556 558 1 557 561 1 557 562 1 558 563 1 558 566 1 559 561 1 559 562 1 560 564 1 560 565 1 560 567 1 560 568 1 561 563 1 561 566 1 562 569 1 562 570 1 563 567 1 563 568 1 564 566 1 565 566 1 566 571 1 566 574 1 567 569 1 567 570 1 568 572 1 568 573 1 568 575 1 568 576 1 569 571 1 569 574 1 570 577 1 570 578 1 571 575 1 571 576 1 572 574 1 573 574 1 574 579 1 574 583 1 575 577 1 575 578 1 576 580 1 576 582 1 576 584 1 576 585 1 577 579 1 577 583 1 578 581 1 578 586 1 578 587 1 579 584 1 579 585 1 580 583 1 581 582 1 582 583 1 583 588 1 583 592 1 584 586 1 584 587 1 585 589 1 585 593 1 585 594 1 586 588 1 586 592 1 587 590 1 587 591 1 587 595 1 587 596 1 588 593 1 588 594 1 589 592 1 592 597 1 593 595 1 593 596 1 594 598 1 594 599 1 595 597 1 596 600 1 596 601 1 597 602 1 597 606 1 598 600 1 598 601 1 599 603 1 599 607 1 599 608 1 600 602 1 600 606 1 601 604 1 601 609 1 601 610 1 602 605 1 602 607 1 602 608 1 603 606 1 606 611 1 606 612 1 607 609 1 607 610 1 608 613 1 608 614 1 609 611 1 609 612 1 610 615 1 610 616 1 611 613 1 611 614 1 612 617 1 612 620 1 613 615 1 613 616 1 614 618 1 614 621 1 614 622 1 615 617 1 615 620 1 616 619 1 616 623 1 616 624 1 617 621 1 617 622 1 618 620 1 620 625 1 621 623 1 621 624 1 622 626 1 622 627 1 623 625 1 624 628 1 624 629 1 625 630 1 625 634 1 626 628 1 626 629 1 627 631 1 627 635 1 627 636 1 628 630 1 628 634 1 629 632 1 629 633 1 629 637 1 629 638 1 630 635 1 630 636 1 631 634 1 634 639 1 634 643 1 635 637 1 635 638 1 636 640 1 636 644 1 636 645 1 637 639 1 637 643 1 638 641 1 638 642 1 638 646 1 638 647 1 639 644 1 639 645 1 640 643 1 643 648 1 643 656 1 644 646 1 644 647 1 645 649 1 645 657 1 645 658 1 646 648 1 646 656 1 647 650 1 647 659 1 647 660 1 648 651 1 648 657 1 648 658 1 649 652 1 649 656 1 650 653 1 650 654 1 650 655 1 656 661 1 656 665 1 657 659 1 657 660 1 658 662 1 658 666 1 658 667 1 659 661 1 659 665 1 660 663 1 660 664 1 660 668 1 660 669 1 661 666 1 661 667 1 662 665 1 665 670 1 665 683 1 666 668 1 666 669 1 667 671 1 667 684 1 667 685 1 668 670 1 668 683 1 669 672 1 669 674 1 669 686 1 669 687 1 670 684 1 670 685 1 671 683 1 676 682 1 678 682 1 683 688 1 683 692 1 684 686 1 684 687 1 685 689 1 685 693 1 685 694 1 686 688 1 686 692 1 687 690 1 687 691 1 687 695 1 687 696 1 688 693 1 688 694 1 689 692 1 692 697 1 692 705 1 693 695 1 693 696 1 694 698 1 694 706 1 694 707 1 695 697 1 695 705 1 696 699 1 696 708 1 696 711 1 697 700 1 697 706 1 697 707 1 698 701 1 698 705 1 699 702 1 699 703 1 699 704 1 705 709 1 705 710 1 705 712 1 706 708 1 706 711 1 707 713 1 707 714 1 708 715 1 708 716 1 709 713 1 709 714 1 710 712 1 711 712 1 712 717 1 712 721 1 713 715 1 713 716 1 714 718 1 714 722 1 714 723 1 715 717 1 715 721 1 716 719 1 716 720 1 716 724 1 716 725 1 717 722 1 717 723 1 718 721 1 721 726 1 721 730 1 722 724 1 722 725 1 723 727 1 723 731 1 723 732 1 724 726 1 724 730 1 725 728 1 725 729 1 725 733 1 725 734 1 726 731 1 726 732 1 727 730 1 730 735 1 730 738 1 731 733 1 731 734 1 732 736 1 732 739 1 732 740 1 733 735 1 733 738 1 734 737 1 734 741 1 734 742 1 735 739 1 735 740 1 736 738 1 738 743 1 738 755 1 739 741 1 739 742 1 740 744 1 740 756 1 740 757 1 741 743 1 741 755 1 742 745 1 742 758 1 742 759 1 743 746 1 743 756 1 743 757 1 744 747 1 744 748 1 744 755 1 745 749 1 745 752 1 746 750 1 746 751 1 746 753 1 746 754 1 747 749 1 747 752 1 749 753 1 749 754 1 750 752 1 751 752 1 755 760 1 755 763 1 756 758 1 756 759 1 757 761 1 757 762 1 757 764 1 757 765 1 758 760 1 758 763 1 759 766 1 759 767 1 760 764 1 760 765 1 761 763 1 762 763 1 763 768 1 763 772 1 764 766 1 764 767 1 765 769 1 765 770 1 765 773 1 765 774 1 766 768 1 766 772 1 767 771 1 767 775 1 767 776 1 768 773 1 768 774 1 769 772 1 770 771 1 770 772 1 772 777 1 772 778 1 773 775 1 773 776 1 774 779 1 774 780 1 775 777 1 775 778 1 776 781 1 776 782 1 777 779 1 777 780 1 778 783 1 778 792 1 779 781 1 779 782 1 780 784 1 780 793 1 780 794 1 781 783 1 781 792 1 782 785 1 782 787 1 782 795 1 782 796 1 783 793 1 783 794 1 784 792 1 792 797 1 792 801 1 793 795 1 793 796 1 794 798 1 794 800 1 794 802 1 794 803 1 795 797 1 795 801 1 796 799 1 796 804 1 796 805 1 797 802 1 797 803 1 798 801 1 799 800 1 800 801 1 801 806 1 801 814 1 802 804 1 802 805 1 803 807 1 803 815 1 803 816 1 804 806 1 804 814 1 805 808 1 805 817 1 805 818 1 806 809 1 806 815 1 806 816 1 807 810 1 807 814 1 808 811 1 808 812 1 808 813 1 814 819 1 814 823 1 815 817 1 815 818 1 816 820 1 816 824 1 816 825 1 817 819 1 817 823 1 818 821 1 818 822 1 818 826 1 818 827 1 819 824 1 819 825 1 820 823 1 823 828 1 823 832 1 824 826 1 824 827 1 825 829 1 825 830 1 825 833 1 825 834 1 826 828 1 826 832 1 827 831 1 827 835 1 827 836 1 828 833 1 828 834 1 829 832 1 830 831 1 830 832 1 832 837 1 833 835 1 833 836 1 834 838 1 834 839 1 835 837 1 836 840 1 836 841 1 837 842 1 837 845 1 838 840 1 838 841 1 839 843 1 839 846 1 839 847 1 840 842 1 840 845 1 841 844 1 841 848 1 841 849 1 842 846 1 842 847 1 843 845 1 845 850 1 846 848 1 846 849 1 847 851 1 847 852 1 848 850 1 849 853 1 849 854 1 850 855 1 850 860 1 851 853 1 851 854 1 852 856 1 852 861 1 852 862 1 853 855 1 853 860 1 854 857 1 854 863 1 854 864 1 855 858 1 855 859 1 855 861 1 855 862 1 856 860 1 860 865 1 860 873 1 861 863 1 861 864 1 862 866 1 862 874 1 862 875 1 863 865 1 863 873 1 864 867 1 864 876 1 864 877 1 865 868 1 865 874 1 865 875 1 866 869 1 866 873 1 867 870 1 867 871 1 867 872 1 873 878 1 873 882 1 874 876 1 874 877 1 875 879 1 875 883 1 875 884 1 876 878 1 876 882 1 877 880 1 877 881 1 877 885 1 877 886 1 878 883 1 878 884 1 879 882 1 882 887 1 882 890 1 883 885 1 883 886 1 884 888 1 884 891 1 884 892 1 885 887 1 885 890 1 886 889 1 886 893 1 886 894 1 887 891 1 887 892 1 888 890 1 890 895 1 890 898 1 891 893 1 891 894 1 892 896 1 892 897 1 892 899 1 892 900 1 893 895 1 893 898 1 894 901 1 894 902 1 895 899 1 895 900 1 896 898 1 897 898 1 898 903 1 898 907 1 899 901 1 899 902 1 900 904 1 900 906 1 900 908 1 900 909 1 901 903 1 901 907 1 902 905 1 902 910 1 902 911 1 903 908 1 903 909 1 904 907 1 905 906 1 906 907 1 907 912 1 907 924 1 908 910 1 908 911 1 909 913 1 909 925 1 909 926 1 910 912 1 910 924 1 911 914 1 911 916 1 911 927 1 911 928 1 912 925 1 912 926 1 913 924 1 924 929 1 924 933 1 925 927 1 925 928 1 926 930 1 926 934 1 926 935 1 927 929 1 927 933 1 928 931 1 928 932 1 928 936 1 928 937 1 929 934 1 929 935 1 930 933 1 933 938 1 933 941 1 934 936 1 934 937 1 935 939 1 935 940 1 935 942 1 935 943 1 936 938 1 936 941 1 937 944 1 937 945 1 938 942 1 938 943 1 939 941 1 940 941 1 941 946 1 941 949 1 942 944 1 942 945 1 943 947 1 943 950 1 943 951 1 944 946 1 944 949 1 945 948 1 945 952 1 945 953 1 946 950 1 946 951 1 947 949 1 949 954 1 949 962 1 950 952 1 950 953 1 951 955 1 951 963 1 951 964 1 952 954 1 952 962 1 953 956 1 953 965 1 953 966 1 954 957 1 954 963 1 954 964 1 955 958 1 955 962 1 956 959 1 956 960 1 956 961 1 962 967 1 962 971 1 963 965 1 963 966 1 964 968 1 964 972 1 964 973 1 965 967 1 965 971 1 966 969 1 966 970 1 966 974 1 966 975 1 967 972 1 967 973 1 968 971 1 971 976 1 971 984 1 972 974 1 972 975 1 973 977 1 973 985 1 973 986 1 974 976 1 974 984 1 975 978 1 975 987 1 975 988 1 976 979 1 976 985 1 976 986 1 977 980 1 977 984 1 978 981 1 978 982 1 978 983 1 984 989 1 984 994 1 985 987 1 985 988 1 986 990 1 986 995 1 986 996 1 987 989 1 987 994 1 988 991 1 988 997 1 988 998 1 989 992 1 989 993 1 989 995 1 989 996 1 990 994 1 994 999 1 995 997 1 995 998 1 996 1000 1 996 1001 1 997 999 1 998 1002 1 998 1003 1 999 1004 1 999 1009 1 1000 1002 1 1000 1003 1 1001 1005 1 1001 1010 1 1001 1011 1 1002 1004 1 1002 1009 1 1003 1006 1 1003 1012 1 1003 1013 1 1004 1007 1 1004 1008 1 1004 1010 1 1004 1011 1 1005 1009 1 1009 1014 1 1009 1021 1 1010 1012 1 1010 1013 1 1011 1015 1 1011 1022 1 1011 1023 1 1012 1014 1 1012 1021 1 1013 1016 1 1013 1024 1 1013 1025 1 1014 1017 1 1014 1018 1 1014 1022 1 1014 1023 1 1015 1019 1 1015 1020 1 1015 1021 1 1017 1019 1 1017 1020 1 1021 1026 1 1021 1039 1 1022 1024 1 1022 1025 1 1023 1027 1 1023 1040 1 1023 1041 1 1024 1026 1 1024 1039 1 1025 1028 1 1025 1030 1 1025 1042 1 1025 1043 1 1026 1040 1 1026 1041 1 1027 1039 1 1032 1038 1 1034 1038 1 1039 1044 1 1039 1048 1 1040 1042 1 1040 1043 1 1041 1045 1 1041 1049 1 1041 1050 1 1042 1044 1 1042 1048 1 1043 1046 1 1043 1051 1 1043 1052 1 1044 1047 1 1044 1049 1 1044 1050 1 1045 1048 1 1048 1053 1 1048 1065 1 1049 1051 1 1049 1052 1 1050 1054 1 1050 1066 1 1050 1067 1 1051 1053 1 1051 1065 1 1052 1055 1 1052 1057 1 1052 1068 1 1052 1069 1 1053 1066 1 1053 1067 1 1054 1065 1 1065 1070 1 1065 1082 1 1066 1068 1 1066 1069 1 1067 1071 1 1067 1083 1 1067 1084 1 1068 1070 1 1068 1082 1 1069 1072 1 1069 1074 1 1069 1085 1 1069 1086 1 1070 1083 1 1070 1084 1 1071 1082 1 1082 1087 1 1082 1089 1 1083 1085 1 1083 1086 1 1084 1088 1 1084 1090 1 1084 1091 1 1085 1087 1 1085 1089 1 1086 1092 1 1086 1093 1 1087 1090 1 1087 1091 1 1088 1089 1 1089 1094 1 1089 1098 1 1090 1092 1 1090 1093 1 1091 1095 1 1091 1097 1 1091 1099 1 1091 1100 1 1092 1094 1 1092 1098 1 1093 1096 1 1093 1101 1 1093 1102 1 1094 1099 1 1094 1100 1 1095 1098 1 1096 1097 1 1097 1098 1 1098 1103 1 1098 1115 1 1099 1101 1 1099 1102 1 1100 1104 1 1100 1116 1 1100 1117 1 1101 1103 1 1101 1115 1 1102 1105 1 1102 1107 1 1102 1118 1 1102 1121 1 1103 1116 1 1103 1117 1 1104 1115 1 1115 1119 1 1115 1120 1 1115 1122 1 1116 1118 1 1116 1121 1 1117 1123 1 1117 1124 1 1118 1125 1 1118 1126 1 1119 1123 1 1119 1124 1 1120 1122 1 1121 1122 1 1122 1127 1 1123 1125 1 1123 1126 1 1124 1128 1 1124 1129 1 1125 1127 1 1126 1130 1 1126 1131 1 1127 1132 1 1127 1141 1 1128 1130 1 1128 1131 1 1129 1133 1 1129 1142 1 1129 1143 1 1130 1132 1 1130 1141 1 1131 1134 1 1131 1135 1 1131 1144 1 1131 1145 1 1132 1142 1 1132 1143 1 1133 1141 1 1141 1146 1 1141 1149 1 1142 1144 1 1142 1145 1 1143 1147 1 1143 1150 1 1143 1151 1 1144 1146 1 1144 1149 1 1145 1148 1 1145 1152 1 1145 1153 1 1146 1150 1 1146 1151 1 1147 1149 1 1149 1154 1 1149 1155 1 1150 1152 1 1150 1153 1 1151 1156 1 1151 1157 1 1152 1154 1 1152 1155 1 1153 1158 1 1153 1159 1 1154 1156 1 1154 1157 1 1155 1160 1 1155 1164 1 1156 1158 1 1156 1159 1 1157 1161 1 1157 1165 1 1157 1166 1 1158 1160 1 1158 1164 1 1159 1162 1 1159 1163 1 1159 1167 1 1159 1168 1 1160 1165 1 1160 1166 1 1161 1164 1 1164 1169 1 1164 1173 1 1165 1167 1 1165 1168 1 1166 1170 1 1166 1174 1 1166 1175 1 1167 1169 1 1167 1173 1 1168 1171 1 1168 1176 1 1168 1177 1 1169 1172 1 1169 1174 1 1169 1175 1 1170 1173 1 1173 1178 1 1173 1186 1 1174 1176 1 1174 1177 1 1175 1179 1 1175 1187 1 1175 1188 1 1176 1178 1 1176 1186 1 1177 1180 1 1177 1189 1 1177 1190 1 1178 1181 1 1178 1187 1 1178 1188 1 1179 1182 1 1179 1186 1 1180 1183 1 1180 1184 1 1180 1185 1 1186 1191 1 1187 1189 1 1187 1190 1 1188 1192 1 1188 1193 1 1189 1191 1 1190 1194 1 1190 1195 1 1191 1196 1 1191 1200 1 1192 1194 1 1192 1195 1 1193 1197 1 1193 1199 1 1193 1201 1 1193 1202 1 1194 1196 1 1194 1200 1 1195 1198 1 1195 1203 1 1195 1204 1 1196 1201 1 1196 1202 1 1197 1200 1 1198 1199 1 1199 1200 1 1200 1205 1 1200 1209 1 1201 1203 1 1201 1204 1 1202 1206 1 1202 1210 1 1202 1211 1 1203 1205 1 1203 1209 1 1204 1207 1 1204 1208 1 1204 1212 1 1204 1213 1 1205 1210 1 1205 1211 1 1206 1209 1 1209 1214 1 1209 1218 1 1210 1212 1 1210 1213 1 1211 1215 1 1211 1217 1 1211 1219 1 1211 1220 1 1212 1214 1 1212 1218 1 1213 1216 1 1213 1221 1 1213 1222 1 1214 1219 1 1214 1220 1 1215 1218 1 1216 1217 1 1217 1218 1 1218 1223 1 1218 1227 1 1219 1221 1 1219 1222 1 1220 1224 1 1220 1228 1 1220 1229 1 1221 1223 1 1221 1227 1 1222 1225 1 1222 1226 1 1222 1230 1 1222 1231 1 1223 1228 1 1223 1229 1 1224 1227 1 1227 1232 1 1227 1240 1 1228 1230 1 1228 1231 1 1229 1233 1 1229 1241 1 1229 1242 1 1230 1232 1 1230 1240 1 1231 1234 1 1232 1235 1 1232 1241 1 1232 1242 1 1233 1236 1 1233 1240 1 1234 1237 1 1234 1238 1 1234 1239 1 [ constraints ] 1253 1254 1 1.0880e-01 1251 1252 1 1.0870e-01 1249 1250 1 1.0870e-01 1247 1248 1 1.0870e-01 1257 1258 1 1.0870e-01 1259 1260 1 1.0870e-01 1263 1264 1 1.0880e-01 1261 1262 1 1.0870e-01 1273 1274 1 1.0880e-01 1271 1272 1 1.0870e-01 1269 1270 1 1.0870e-01 1267 1268 1 1.0870e-01 1277 1278 1 1.0870e-01 1279 1280 1 1.0870e-01 1283 1284 1 1.0880e-01 1281 1282 1 1.0870e-01 1287 1288 1 1.0830e-01 1290 1291 1 1.0830e-01 1292 1293 1 1.0790e-01 1285 1286 1 1.0110e-01 1 2 1 0.100 1 3 1 0.100 1 4 1 0.100 9 10 1 0.100 19 20 1 0.100 26 27 1 0.100 30 31 1 0.100 34 35 1 0.100 42 43 1 0.100 51 52 1 0.100 60 61 1 0.100 67 68 1 0.100 67 69 1 0.100 72 73 1 0.100 77 78 1 0.100 83 84 1 0.100 83 85 1 0.100 88 89 1 0.100 97 98 1 0.100 104 105 1 0.100 104 106 1 0.100 109 110 1 0.100 118 119 1 0.100 125 126 1 0.100 125 127 1 0.100 130 131 1 0.100 135 136 1 0.109 137 138 1 0.109 139 140 1 0.109 141 142 1 0.109 143 144 1 0.109 147 148 1 0.100 153 154 1 0.100 153 155 1 0.100 158 159 1 0.100 162 163 1 0.100 167 168 1 0.100 173 174 1 0.100 173 175 1 0.100 178 179 1 0.100 184 185 1 0.100 193 194 1 0.100 197 198 1 0.100 202 203 1 0.100 210 211 1 0.100 219 220 1 0.100 226 227 1 0.100 226 228 1 0.100 226 229 1 0.100 232 233 1 0.100 236 237 1 0.100 240 241 1 0.100 247 248 1 0.100 254 255 1 0.100 254 256 1 0.100 254 257 1 0.100 260 261 1 0.100 267 268 1 0.100 267 269 1 0.100 272 273 1 0.100 277 278 1 0.109 279 280 1 0.109 281 282 1 0.109 283 284 1 0.109 285 286 1 0.109 289 290 1 0.100 293 294 1 0.100 298 299 1 0.100 306 307 1 0.100 312 313 1 0.100 312 314 1 0.100 317 318 1 0.100 326 327 1 0.100 330 331 1 0.100 334 335 1 0.100 340 341 1 0.109 342 343 1 0.109 344 345 1 0.100 355 356 1 0.100 360 361 1 0.100 366 367 1 0.100 366 368 1 0.100 371 372 1 0.100 387 388 1 0.100 394 395 1 0.100 394 396 1 0.100 394 397 1 0.100 400 401 1 0.100 406 407 1 0.100 406 408 1 0.100 411 412 1 0.100 419 420 1 0.100 428 429 1 0.100 433 434 1 0.100 439 440 1 0.109 441 442 1 0.109 443 444 1 0.100 447 448 1 0.100 453 454 1 0.100 453 455 1 0.100 458 459 1 0.100 463 464 1 0.109 466 467 1 0.100 469 470 1 0.109 471 472 1 0.109 473 474 1 0.109 475 476 1 0.109 479 480 1 0.100 487 488 1 0.100 496 497 1 0.100 500 501 1 0.100 504 505 1 0.100 508 509 1 0.100 513 514 1 0.100 519 520 1 0.100 525 526 1 0.100 534 535 1 0.100 543 544 1 0.100 550 551 1 0.100 550 552 1 0.100 555 556 1 0.100 560 561 1 0.100 568 569 1 0.100 576 577 1 0.100 580 581 1 0.100 585 586 1 0.100 594 595 1 0.100 599 600 1 0.100 608 609 1 0.100 614 615 1 0.100 618 619 1 0.100 622 623 1 0.100 627 628 1 0.100 636 637 1 0.100 645 646 1 0.100 652 653 1 0.100 652 654 1 0.100 652 655 1 0.100 658 659 1 0.100 667 668 1 0.100 672 673 1 0.109 674 675 1 0.109 676 677 1 0.109 678 679 1 0.109 681 682 1 0.100 685 686 1 0.100 694 695 1 0.100 701 702 1 0.100 701 703 1 0.100 701 704 1 0.100 714 715 1 0.100 723 724 1 0.100 732 733 1 0.100 736 737 1 0.100 740 741 1 0.100 746 747 1 0.100 749 750 1 0.100 749 751 1 0.100 752 753 1 0.100 752 754 1 0.100 757 758 1 0.100 765 766 1 0.100 774 775 1 0.100 780 781 1 0.100 785 786 1 0.100 ;uncommented out HIS83 787 788 1 0.109 ;uncommented out HIS83 789 790 1 0.109 ;uncommented out HIS83 794 795 1 0.100 798 799 1 0.100 803 804 1 0.100 810 811 1 0.100 810 812 1 0.100 810 813 1 0.100 816 817 1 0.100 825 826 1 0.100 834 835 1 0.100 839 840 1 0.100 843 844 1 0.100 847 848 1 0.100 852 853 1 0.100 862 863 1 0.100 869 870 1 0.100 869 871 1 0.100 869 872 1 0.100 875 876 1 0.100 884 885 1 0.100 888 889 1 0.100 892 893 1 0.100 900 901 1 0.100 904 905 1 0.100 909 910 1 0.100 914 915 1 0.109 916 917 1 0.109 918 919 1 0.109 920 921 1 0.109 922 923 1 0.109 926 927 1 0.100 935 936 1 0.100 943 944 1 0.100 947 948 1 0.100 951 952 1 0.100 958 959 1 0.100 958 960 1 0.100 958 961 1 0.100 964 965 1 0.100 973 974 1 0.100 980 981 1 0.100 980 982 1 0.100 980 983 1 0.100 986 987 1 0.100 996 997 1 0.100 1001 1002 1 0.100 1011 1012 1 0.100 1018 1019 1 0.100 1018 1020 1 0.100 1023 1024 1 0.100 1028 1029 1 0.109 1030 1031 1 0.109 1032 1033 1 0.109 1034 1035 1 0.109 1037 1038 1 0.100 1041 1042 1 0.100 1050 1051 1 0.100 1055 1056 1 0.109 1057 1058 1 0.109 1059 1060 1 0.109 1061 1062 1 0.109 1063 1064 1 0.109 1067 1068 1 0.100 1072 1073 1 0.109 1074 1075 1 0.109 1076 1077 1 0.109 1078 1079 1 0.109 1080 1081 1 0.109 1084 1085 1 0.100 1091 1092 1 0.100 1095 1096 1 0.100 1100 1101 1 0.100 1105 1106 1 0.109 1107 1108 1 0.109 1109 1110 1 0.109 1111 1112 1 0.109 1113 1114 1 0.109 1124 1125 1 0.100 1129 1130 1 0.100 1135 1136 1 0.109 1137 1138 1 0.109 1139 1140 1 0.100 1143 1144 1 0.100 1147 1148 1 0.100 1151 1152 1 0.100 1157 1158 1 0.100 1166 1167 1 0.100 1175 1176 1 0.100 1182 1183 1 0.100 1182 1184 1 0.100 1182 1185 1 0.100 1188 1189 1 0.100 1193 1194 1 0.100 1197 1198 1 0.100 1202 1203 1 0.100 1211 1212 1 0.100 1215 1216 1 0.100 1220 1221 1 0.100 1229 1230 1 0.100 1236 1237 1 0.100 1236 1238 1 0.100 1236 1239 1 0.100 1294 1295 1 0.100 1294 1296 1 0.100 1295 1296 1 0.163298 1297 1298 1 0.100 1297 1299 1 0.100 1298 1299 1 0.163298 1300 1301 1 0.100 1300 1302 1 0.100 1301 1302 1 0.163298 1303 1304 1 0.100 1303 1305 1 0.100 1304 1305 1 0.163298 1306 1307 1 0.100 1306 1308 1 0.100 1307 1308 1 0.163298 1309 1310 1 0.100 1309 1311 1 0.100 1310 1311 1 0.163298 1312 1313 1 0.100 1312 1314 1 0.100 1313 1314 1 0.163298 1315 1316 1 0.100 1315 1317 1 0.100 1316 1317 1 0.163298 1318 1319 1 0.100 1318 1320 1 0.100 1319 1320 1 0.163298 1321 1322 1 0.100 1321 1323 1 0.100 1322 1323 1 0.163298 1324 1325 1 0.100 1324 1326 1 0.100 1325 1326 1 0.163298 1327 1328 1 0.100 1327 1329 1 0.100 1328 1329 1 0.163298 1330 1331 1 0.100 1330 1332 1 0.100 1331 1332 1 0.163298 1333 1334 1 0.100 1333 1335 1 0.100 1334 1335 1 0.163298 1336 1337 1 0.100 1336 1338 1 0.100 1337 1338 1 0.163298 1339 1340 1 0.100 1339 1341 1 0.100 1340 1341 1 0.163298 1342 1343 1 0.100 1342 1344 1 0.100 1343 1344 1 0.163298 1345 1346 1 0.100 1345 1347 1 0.100 1346 1347 1 0.163298 1348 1349 1 0.100 1348 1350 1 0.100 1349 1350 1 0.163298 1351 1352 1 0.100 1351 1353 1 0.100 1352 1353 1 0.163298 1354 1355 1 0.100 1354 1356 1 0.100 1355 1356 1 0.163298 1357 1358 1 0.100 1357 1359 1 0.100 1358 1359 1 0.163298 1360 1361 1 0.100 1360 1362 1 0.100 1361 1362 1 0.163298 1363 1364 1 0.100 1363 1365 1 0.100 1364 1365 1 0.163298 1366 1367 1 0.100 1366 1368 1 0.100 1367 1368 1 0.163298 1369 1370 1 0.100 1369 1371 1 0.100 1370 1371 1 0.163298 1372 1373 1 0.100 1372 1374 1 0.100 1373 1374 1 0.163298 1375 1376 1 0.100 1375 1377 1 0.100 1376 1377 1 0.163298 1378 1379 1 0.100 1378 1380 1 0.100 1379 1380 1 0.163298 1381 1382 1 0.100 1381 1383 1 0.100 1382 1383 1 0.163298 1384 1385 1 0.100 1384 1386 1 0.100 1385 1386 1 0.163298 1387 1388 1 0.100 1387 1389 1 0.100 1388 1389 1 0.163298 1390 1391 1 0.100 1390 1392 1 0.100 1391 1392 1 0.163298 1393 1394 1 0.100 1393 1395 1 0.100 1394 1395 1 0.163298 1396 1397 1 0.100 1396 1398 1 0.100 1397 1398 1 0.163298 1399 1400 1 0.100 1399 1401 1 0.100 1400 1401 1 0.163298 1402 1403 1 0.100 1402 1404 1 0.100 1403 1404 1 0.163298 1405 1406 1 0.100 1405 1407 1 0.100 1406 1407 1 0.163298 1408 1409 1 0.100 1408 1410 1 0.100 1409 1410 1 0.163298 1411 1412 1 0.100 1411 1413 1 0.100 1412 1413 1 0.163298 1414 1415 1 0.100 1414 1416 1 0.100 1415 1416 1 0.163298 1417 1418 1 0.100 1417 1419 1 0.100 1418 1419 1 0.163298 1420 1421 1 0.100 1420 1422 1 0.100 1421 1422 1 0.163298 1423 1424 1 0.100 1423 1425 1 0.100 1424 1425 1 0.163298 1426 1427 1 0.100 1426 1428 1 0.100 1427 1428 1 0.163298 1429 1430 1 0.100 1429 1431 1 0.100 1430 1431 1 0.163298 1432 1433 1 0.100 1432 1434 1 0.100 1433 1434 1 0.163298 1435 1436 1 0.100 1435 1437 1 0.100 1436 1437 1 0.163298 1438 1439 1 0.100 1438 1440 1 0.100 1439 1440 1 0.163298 1441 1442 1 0.100 1441 1443 1 0.100 1442 1443 1 0.163298 1444 1445 1 0.100 1444 1446 1 0.100 1445 1446 1 0.163298 [ angles ] 787 791 1244 1 125.5 866 789 791 1244 1 125.5 866 1244 1245 1246 1 123.5 866 1244 1245 1253 1 123.5 866 1244 1255 1256 1 123.5 866 1244 1255 1263 1 123.5 866 1244 1265 1266 1 123.5 866 1244 1265 1273 1 123.5 866 1244 1275 1276 1 123.5 866 1244 1275 1283 1 123.5 866 1244 1289 1290 1 128.5 866 1244 1289 1292 1 128.5 866 1265 1244 1289 1 180.0 206 1265 1244 1275 1 90.0 680 1265 1244 1255 1 90.0 680 1265 1244 791 1 90.0 680 1265 1244 1245 1 90.0 680 1289 1244 1275 1 90.0 680 1289 1244 1255 1 90.0 680 1289 1244 791 1 90.0 680 1289 1244 1245 1 90.0 680 1275 1244 1255 1 180.0 206 1275 1244 791 1 90.0 680 1275 1244 1245 1 90.0 680 1255 1244 791 1 90.0 680 1255 1244 1245 1 90.0 680 791 1244 1245 1 180.0 206 785 784 787 2 ga_7 784 785 786 2 ga_36 784 785 789 2 ga_7 786 785 789 2 ga_36 784 787 788 2 ga_36 784 787 791 2 ga_7 788 787 791 2 ga_36 785 789 790 2 ga_36 785 789 791 2 ga_7 790 789 791 2 ga_36 787 791 789 2 ga_7 1253 1251 1249 1 1.1997e+02 5.6216e+02 ; C1 - C2 - C3 1253 1251 1252 1 1.2001e+02 4.0551e+02 ; C1 - C2 - H2 1253 1245 1246 1 1.1804e+02 5.6911e+02 ; C1 - N1 - C5 1251 1253 1254 1 1.2109e+02 4.0367e+02 ; C2 - C1 - H1 1251 1253 1245 1 1.2263e+02 5.7873e+02 ; C2 - C1 - N1 1251 1249 1247 1 1.1997e+02 5.6216e+02 ; C2 - C3 - C4 1251 1249 1250 1 1.2001e+02 4.0551e+02 ; C2 - C3 - H3 1249 1251 1252 1 1.2001e+02 4.0551e+02 ; C3 - C2 - H2 1249 1247 1246 1 1.1907e+02 5.6199e+02 ; C3 - C4 - C5 1249 1247 1248 1 1.2001e+02 4.0551e+02 ; C3 - C4 - H4 1247 1249 1250 1 1.2001e+02 4.0551e+02 ; C4 - C3 - H3 1247 1246 1256 1 1.2113e+02 5.3631e+02 ; C4 - C5 - C6 1247 1246 1245 1 1.2165e+02 5.7898e+02 ; C4 - C5 - N1 1246 1247 1248 1 1.2108e+02 4.0116e+02 ; C5 - C4 - H4 1246 1256 1257 1 1.2113e+02 5.3631e+02 ; C5 - C6 - C7 1246 1256 1255 1 1.1660e+02 5.6944e+02 ; C5 - C6 - N2 1254 1253 1245 1 1.1594e+02 4.3363e+02 ; H1 - C1 - N1 1256 1246 1245 1 1.1660e+02 5.6944e+02 ; C6 - C5 - N1 1256 1257 1259 1 1.1907e+02 5.6199e+02 ; C6 - C7 - C8 1256 1257 1258 1 1.2108e+02 4.0116e+02 ; C6 - C7 - H5 1256 1255 1263 1 1.1804e+02 5.6911e+02 ; C6 - N2 - C9 1257 1256 1255 1 1.2165e+02 5.7898e+02 ; C7 - C6 - N2 1257 1259 1261 1 1.1997e+02 5.6216e+02 ; C7 - C8 - C10 1257 1259 1260 1 1.2001e+02 4.0551e+02 ; C7 - C8 - H6 1259 1257 1258 1 1.2001e+02 4.0551e+02 ; C8 - C7 - H5 1259 1261 1263 1 1.1997e+02 5.6216e+02 ; C8 - C10 - C9 1259 1261 1262 1 1.2001e+02 4.0551e+02 ; C8 - C10 - H8 1263 1261 1262 1 1.2001e+02 4.0551e+02 ; C9 - C10 - H8 1261 1259 1260 1 1.2001e+02 4.0551e+02 ; C10 - C8 - H6 1261 1263 1264 1 1.2109e+02 4.0367e+02 ; C10 - C9 - H7 1261 1263 1255 1 1.2263e+02 5.7873e+02 ; C10 - C9 - N2 1264 1263 1255 1 1.1594e+02 4.3363e+02 ; H7 - C9 - N2 1273 1271 1269 1 1.1997e+02 5.6216e+02 ; C1 - C2 - C3 1273 1271 1272 1 1.2001e+02 4.0551e+02 ; C1 - C2 - H2 1273 1265 1266 1 1.1804e+02 5.6911e+02 ; C1 - N1 - C5 1271 1273 1274 1 1.2109e+02 4.0367e+02 ; C2 - C1 - H1 1271 1273 1265 1 1.2263e+02 5.7873e+02 ; C2 - C1 - N1 1271 1269 1267 1 1.1997e+02 5.6216e+02 ; C2 - C3 - C4 1271 1269 1270 1 1.2001e+02 4.0551e+02 ; C2 - C3 - H3 1269 1271 1272 1 1.2001e+02 4.0551e+02 ; C3 - C2 - H2 1269 1267 1266 1 1.1907e+02 5.6199e+02 ; C3 - C4 - C5 1269 1267 1268 1 1.2001e+02 4.0551e+02 ; C3 - C4 - H4 1267 1269 1270 1 1.2001e+02 4.0551e+02 ; C4 - C3 - H3 1267 1266 1276 1 1.2113e+02 5.3631e+02 ; C4 - C5 - C6 1267 1266 1265 1 1.2165e+02 5.7898e+02 ; C4 - C5 - N1 1266 1267 1268 1 1.2108e+02 4.0116e+02 ; C5 - C4 - H4 1266 1276 1277 1 1.2113e+02 5.3631e+02 ; C5 - C6 - C7 1266 1276 1275 1 1.1660e+02 5.6944e+02 ; C5 - C6 - N2 1274 1273 1265 1 1.1594e+02 4.3363e+02 ; H1 - C1 - N1 1276 1266 1265 1 1.1660e+02 5.6944e+02 ; C6 - C5 - N1 1276 1277 1279 1 1.1907e+02 5.6199e+02 ; C6 - C7 - C8 1276 1277 1278 1 1.2108e+02 4.0116e+02 ; C6 - C7 - H5 1276 1275 1283 1 1.1804e+02 5.6911e+02 ; C6 - N2 - C9 1277 1276 1275 1 1.2165e+02 5.7898e+02 ; C7 - C6 - N2 1277 1279 1281 1 1.1997e+02 5.6216e+02 ; C7 - C8 - C10 1277 1279 1280 1 1.2001e+02 4.0551e+02 ; C7 - C8 - H6 1279 1277 1278 1 1.2001e+02 4.0551e+02 ; C8 - C7 - H5 1279 1281 1283 1 1.1997e+02 5.6216e+02 ; C8 - C10 - C9 1279 1281 1282 1 1.2001e+02 4.0551e+02 ; C8 - C10 - H8 1283 1281 1282 1 1.2001e+02 4.0551e+02 ; C9 - C10 - H8 1281 1279 1280 1 1.2001e+02 4.0551e+02 ; C10 - C8 - H6 1281 1283 1284 1 1.2109e+02 4.0367e+02 ; C10 - C9 - H7 1281 1283 1275 1 1.2263e+02 5.7873e+02 ; C10 - C9 - N2 1284 1283 1275 1 1.1594e+02 4.3363e+02 ; H7 - C9 - N2 1287 1290 1291 1 1.2911e+02 3.9489e+02 ; C1 - C2 - H3 1287 1290 1289 1 1.1175e+02 6.0258e+02 ; C1 - C2 - N2 1287 1285 1292 1 1.0990e+02 5.7689e+02 ; C1 - N1 - C3 1287 1285 1286 1 1.2550e+02 3.9346e+02 ; C1 - N1 - H1 1290 1287 1285 1 1.0942e+02 6.1011e+02 ; C2 - C1 - N1 1290 1287 1288 1 1.2911e+02 3.9489e+02 ; C2 - C1 - H2 1290 1289 1292 1 1.0567e+02 5.9480e+02 ; C2 - N2 - C3 1292 1285 1286 1 1.2550e+02 3.9346e+02 ; C3 - N1 - H1 1285 1287 1288 1 1.1966e+02 4.2024e+02 ; N1 - C1 - H2 1285 1292 1293 1 1.2210e+02 4.1639e+02 ; N1 - C3 - H4 1285 1292 1289 1 1.1202e+02 6.2576e+02 ; N1 - C3 - N2 1291 1290 1289 1 1.2003e+02 4.1840e+02 ; H3 - C2 - N2 1293 1292 1289 1 1.2538e+02 4.1949e+02 ; H4 - C3 - N2 1243 1088 1087 1 95.00 125.52 1243 438 437 1 130.00 167.36 1243 438 441 1 126.00 167.36 1088 1243 438 1 130.00 167.36 1243 1134 1133 1 130.00 167.36 1243 1134 1137 1 126.00 167.36 1088 1243 1134 1 130.00 167.36 438 1243 1134 1 100.00 167.36 2 1 3 2 ga_10 2 1 4 2 ga_10 2 1 5 2 ga_11 3 1 4 2 ga_10 3 1 5 2 ga_11 4 1 5 2 ga_11 1 5 6 2 ga_13 1 5 7 2 ga_13 6 5 7 2 ga_13 5 7 8 2 ga_30 5 7 9 2 ga_19 8 7 9 2 ga_33 7 9 10 2 ga_32 7 9 11 2 ga_31 10 9 11 2 ga_18 9 11 12 2 ga_13 9 11 17 2 ga_13 12 11 17 2 ga_13 11 12 13 2 ga_15 12 13 14 2 ga_15 13 14 15 2 ga_22 13 14 16 2 ga_22 15 14 16 2 ga_38 11 17 18 2 ga_30 11 17 19 2 ga_19 18 17 19 2 ga_33 17 19 20 2 ga_32 17 19 21 2 ga_31 20 19 21 2 ga_18 19 21 22 2 ga_13 19 21 24 2 ga_13 22 21 24 2 ga_13 21 22 23 2 ga_16 22 23 244 2 ga_6 21 24 25 2 ga_30 21 24 26 2 ga_19 25 24 26 2 ga_33 24 26 27 2 ga_32 24 26 28 2 ga_31 27 26 28 2 ga_18 26 28 29 2 ga_13 26 28 32 2 ga_13 29 28 32 2 ga_13 28 29 30 2 ga_13 29 30 31 2 ga_12 28 32 33 2 ga_30 28 32 34 2 ga_19 33 32 34 2 ga_33 32 34 35 2 ga_32 32 34 36 2 ga_31 35 34 36 2 ga_18 34 36 37 2 ga_13 34 36 40 2 ga_13 37 36 40 2 ga_13 36 37 38 2 ga_15 36 37 39 2 ga_15 38 37 39 2 ga_15 36 40 41 2 ga_30 36 40 42 2 ga_19 41 40 42 2 ga_33 40 42 43 2 ga_32 40 42 44 2 ga_31 43 42 44 2 ga_18 42 44 45 2 ga_13 42 44 49 2 ga_13 45 44 49 2 ga_13 44 45 46 2 ga_15 45 46 47 2 ga_22 45 46 48 2 ga_22 47 46 48 2 ga_38 44 49 50 2 ga_30 44 49 51 2 ga_19 50 49 51 2 ga_33 49 51 52 2 ga_32 49 51 53 2 ga_31 52 51 53 2 ga_18 51 53 54 2 ga_13 51 53 58 2 ga_13 54 53 58 2 ga_13 53 54 55 2 ga_15 53 54 56 2 ga_15 55 54 56 2 ga_15 54 55 57 2 ga_15 53 58 59 2 ga_30 53 58 60 2 ga_19 59 58 60 2 ga_33 58 60 61 2 ga_32 58 60 62 2 ga_31 61 60 62 2 ga_18 60 62 63 2 ga_13 60 62 70 2 ga_13 63 62 70 2 ga_13 62 63 64 2 ga_15 63 64 65 2 ga_15 64 65 66 2 ga_30 64 65 67 2 ga_19 66 65 67 2 ga_33 65 67 68 2 ga_23 65 67 69 2 ga_23 68 67 69 2 ga_24 62 70 71 2 ga_30 62 70 72 2 ga_19 71 70 72 2 ga_33 70 72 73 2 ga_32 70 72 74 2 ga_31 73 72 74 2 ga_18 72 74 75 2 ga_13 74 75 76 2 ga_30 74 75 77 2 ga_19 76 75 77 2 ga_33 75 77 78 2 ga_32 75 77 79 2 ga_31 78 77 79 2 ga_18 77 79 80 2 ga_13 77 79 86 2 ga_13 80 79 86 2 ga_13 79 80 81 2 ga_15 80 81 82 2 ga_30 80 81 83 2 ga_19 82 81 83 2 ga_33 81 83 84 2 ga_23 81 83 85 2 ga_23 84 83 85 2 ga_24 79 86 87 2 ga_30 79 86 88 2 ga_19 87 86 88 2 ga_33 86 88 89 2 ga_32 86 88 90 2 ga_31 89 88 90 2 ga_18 88 90 91 2 ga_13 88 90 95 2 ga_13 91 90 95 2 ga_13 90 91 92 2 ga_15 91 92 93 2 ga_22 91 92 94 2 ga_22 93 92 94 2 ga_38 90 95 96 2 ga_30 90 95 97 2 ga_19 96 95 97 2 ga_33 95 97 98 2 ga_32 95 97 99 2 ga_31 98 97 99 2 ga_18 97 99 100 2 ga_13 97 99 107 2 ga_13 100 99 107 2 ga_13 99 100 101 2 ga_15 100 101 102 2 ga_15 101 102 103 2 ga_30 101 102 104 2 ga_19 103 102 104 2 ga_33 102 104 105 2 ga_23 102 104 106 2 ga_23 105 104 106 2 ga_24 99 107 108 2 ga_30 99 107 109 2 ga_19 108 107 109 2 ga_33 107 109 110 2 ga_32 107 109 111 2 ga_31 110 109 111 2 ga_18 109 111 112 2 ga_13 109 111 116 2 ga_13 112 111 116 2 ga_13 111 112 113 2 ga_15 112 113 114 2 ga_16 113 114 115 2 ga_4 111 116 117 2 ga_30 111 116 118 2 ga_19 117 116 118 2 ga_33 116 118 119 2 ga_32 116 118 120 2 ga_31 119 118 120 2 ga_18 118 120 121 2 ga_13 118 120 128 2 ga_13 121 120 128 2 ga_13 120 121 122 2 ga_15 121 122 123 2 ga_15 122 123 124 2 ga_30 122 123 125 2 ga_19 124 123 125 2 ga_33 123 125 126 2 ga_23 123 125 127 2 ga_23 126 125 127 2 ga_24 120 128 129 2 ga_30 120 128 130 2 ga_19 129 128 130 2 ga_33 128 130 131 2 ga_32 128 130 132 2 ga_31 131 130 132 2 ga_18 130 132 133 2 ga_13 130 132 145 2 ga_13 133 132 145 2 ga_13 132 133 134 2 ga_15 133 134 135 2 ga_27 133 134 137 2 ga_27 135 134 137 2 ga_27 134 135 136 2 ga_25 134 135 139 2 ga_27 136 135 139 2 ga_25 134 137 138 2 ga_25 134 137 141 2 ga_27 138 137 141 2 ga_25 135 139 140 2 ga_25 135 139 143 2 ga_27 140 139 143 2 ga_25 137 141 142 2 ga_25 137 141 143 2 ga_27 142 141 143 2 ga_25 139 143 141 2 ga_27 139 143 144 2 ga_25 141 143 144 2 ga_25 132 145 146 2 ga_30 132 145 147 2 ga_19 146 145 147 2 ga_33 145 147 148 2 ga_32 145 147 149 2 ga_31 148 147 149 2 ga_18 147 149 150 2 ga_13 147 149 156 2 ga_13 150 149 156 2 ga_13 149 150 151 2 ga_15 150 151 152 2 ga_30 150 151 153 2 ga_19 152 151 153 2 ga_33 151 153 154 2 ga_23 151 153 155 2 ga_23 154 153 155 2 ga_24 149 156 157 2 ga_30 149 156 158 2 ga_19 157 156 158 2 ga_33 156 158 159 2 ga_32 156 158 160 2 ga_31 159 158 160 2 ga_18 158 160 161 2 ga_13 158 160 165 2 ga_13 161 160 165 2 ga_13 160 161 162 2 ga_13 160 161 164 2 ga_15 162 161 164 2 ga_15 161 162 163 2 ga_12 160 165 166 2 ga_30 160 165 167 2 ga_19 166 165 167 2 ga_33 165 167 168 2 ga_32 165 167 169 2 ga_31 168 167 169 2 ga_18 167 169 170 2 ga_13 167 169 176 2 ga_13 170 169 176 2 ga_13 169 170 171 2 ga_15 170 171 172 2 ga_30 170 171 173 2 ga_19 172 171 173 2 ga_33 171 173 174 2 ga_23 171 173 175 2 ga_23 174 173 175 2 ga_24 169 176 177 2 ga_30 169 176 178 2 ga_19 177 176 178 2 ga_33 176 178 179 2 ga_32 176 178 180 2 ga_31 179 178 180 2 ga_18 178 180 181 2 ga_13 178 180 182 2 ga_13 181 180 182 2 ga_13 180 182 183 2 ga_30 180 182 184 2 ga_19 183 182 184 2 ga_33 182 184 185 2 ga_32 182 184 186 2 ga_31 185 184 186 2 ga_18 184 186 187 2 ga_13 184 186 191 2 ga_13 187 186 191 2 ga_13 186 187 188 2 ga_15 186 187 189 2 ga_15 188 187 189 2 ga_15 187 188 190 2 ga_15 186 191 192 2 ga_30 186 191 193 2 ga_19 192 191 193 2 ga_33 191 193 194 2 ga_32 191 193 195 2 ga_31 194 193 195 2 ga_18 193 195 196 2 ga_13 193 195 200 2 ga_13 196 195 200 2 ga_13 195 196 197 2 ga_13 195 196 199 2 ga_15 197 196 199 2 ga_15 196 197 198 2 ga_12 195 200 201 2 ga_30 195 200 202 2 ga_19 201 200 202 2 ga_33 200 202 203 2 ga_32 200 202 204 2 ga_31 203 202 204 2 ga_18 202 204 205 2 ga_13 202 204 208 2 ga_13 205 204 208 2 ga_13 204 205 206 2 ga_15 204 205 207 2 ga_15 206 205 207 2 ga_15 204 208 209 2 ga_30 204 208 210 2 ga_19 209 208 210 2 ga_33 208 210 211 2 ga_32 208 210 212 2 ga_31 211 210 212 2 ga_18 210 212 213 2 ga_13 210 212 217 2 ga_13 213 212 217 2 ga_13 212 213 214 2 ga_15 213 214 215 2 ga_22 213 214 216 2 ga_22 215 214 216 2 ga_38 212 217 218 2 ga_30 212 217 219 2 ga_19 218 217 219 2 ga_33 217 219 220 2 ga_32 217 219 221 2 ga_31 220 219 221 2 ga_18 219 221 222 2 ga_13 219 221 230 2 ga_13 222 221 230 2 ga_13 221 222 223 2 ga_15 222 223 224 2 ga_15 223 224 225 2 ga_15 224 225 226 2 ga_15 225 226 227 2 ga_11 225 226 228 2 ga_11 225 226 229 2 ga_11 227 226 228 2 ga_10 227 226 229 2 ga_10 228 226 229 2 ga_10 221 230 231 2 ga_30 221 230 232 2 ga_19 231 230 232 2 ga_33 230 232 233 2 ga_32 230 232 234 2 ga_31 233 232 234 2 ga_18 232 234 235 2 ga_13 232 234 238 2 ga_13 235 234 238 2 ga_13 234 235 236 2 ga_13 235 236 237 2 ga_12 234 238 239 2 ga_30 234 238 240 2 ga_19 239 238 240 2 ga_33 238 240 241 2 ga_32 238 240 242 2 ga_31 241 240 242 2 ga_18 240 242 243 2 ga_13 240 242 245 2 ga_13 243 242 245 2 ga_13 242 243 244 2 ga_16 23 244 243 2 ga_6 242 245 246 2 ga_30 242 245 247 2 ga_19 246 245 247 2 ga_33 245 247 248 2 ga_32 245 247 249 2 ga_31 248 247 249 2 ga_18 247 249 250 2 ga_13 247 249 258 2 ga_13 250 249 258 2 ga_13 249 250 251 2 ga_15 250 251 252 2 ga_15 251 252 253 2 ga_15 252 253 254 2 ga_15 253 254 255 2 ga_11 253 254 256 2 ga_11 253 254 257 2 ga_11 255 254 256 2 ga_10 255 254 257 2 ga_10 256 254 257 2 ga_10 249 258 259 2 ga_30 249 258 260 2 ga_19 259 258 260 2 ga_33 258 260 261 2 ga_32 258 260 262 2 ga_31 261 260 262 2 ga_18 260 262 263 2 ga_13 260 262 270 2 ga_13 263 262 270 2 ga_13 262 263 264 2 ga_15 263 264 265 2 ga_15 264 265 266 2 ga_30 264 265 267 2 ga_19 266 265 267 2 ga_33 265 267 268 2 ga_23 265 267 269 2 ga_23 268 267 269 2 ga_24 262 270 271 2 ga_30 262 270 272 2 ga_19 271 270 272 2 ga_33 270 272 273 2 ga_32 270 272 274 2 ga_31 273 272 274 2 ga_18 272 274 275 2 ga_13 272 274 287 2 ga_13 275 274 287 2 ga_13 274 275 276 2 ga_15 275 276 277 2 ga_27 275 276 279 2 ga_27 277 276 279 2 ga_27 276 277 278 2 ga_25 276 277 281 2 ga_27 278 277 281 2 ga_25 276 279 280 2 ga_25 276 279 283 2 ga_27 280 279 283 2 ga_25 277 281 282 2 ga_25 277 281 285 2 ga_27 282 281 285 2 ga_25 279 283 284 2 ga_25 279 283 285 2 ga_27 284 283 285 2 ga_25 281 285 283 2 ga_27 281 285 286 2 ga_25 283 285 286 2 ga_25 274 287 288 2 ga_30 274 287 289 2 ga_19 288 287 289 2 ga_33 287 289 290 2 ga_32 287 289 291 2 ga_31 290 289 291 2 ga_18 289 291 292 2 ga_13 289 291 296 2 ga_13 292 291 296 2 ga_13 291 292 293 2 ga_13 291 292 295 2 ga_15 293 292 295 2 ga_15 292 293 294 2 ga_12 291 296 297 2 ga_30 291 296 298 2 ga_19 297 296 298 2 ga_33 296 298 299 2 ga_32 296 298 300 2 ga_31 299 298 300 2 ga_18 298 300 301 2 ga_13 298 300 304 2 ga_13 301 300 304 2 ga_13 300 301 302 2 ga_15 300 301 303 2 ga_15 302 301 303 2 ga_15 300 304 305 2 ga_30 300 304 306 2 ga_19 305 304 306 2 ga_33 304 306 307 2 ga_32 304 306 308 2 ga_31 307 306 308 2 ga_18 306 308 309 2 ga_13 306 308 315 2 ga_13 309 308 315 2 ga_13 308 309 310 2 ga_15 309 310 311 2 ga_30 309 310 312 2 ga_19 311 310 312 2 ga_33 310 312 313 2 ga_23 310 312 314 2 ga_23 313 312 314 2 ga_24 308 315 316 2 ga_30 308 315 317 2 ga_19 316 315 317 2 ga_33 315 317 318 2 ga_32 315 317 319 2 ga_31 318 317 319 2 ga_18 317 319 320 2 ga_13 317 319 324 2 ga_13 320 319 324 2 ga_13 319 320 321 2 ga_15 320 321 322 2 ga_15 320 321 323 2 ga_15 322 321 323 2 ga_15 319 324 325 2 ga_30 319 324 326 2 ga_19 325 324 326 2 ga_33 324 326 327 2 ga_32 324 326 328 2 ga_31 327 326 328 2 ga_18 326 328 329 2 ga_13 326 328 332 2 ga_13 329 328 332 2 ga_13 328 329 330 2 ga_13 329 330 331 2 ga_12 328 332 333 2 ga_30 328 332 334 2 ga_19 333 332 334 2 ga_33 332 334 335 2 ga_32 332 334 336 2 ga_31 335 334 336 2 ga_18 334 336 337 2 ga_13 334 336 346 2 ga_13 337 336 346 2 ga_13 336 337 338 2 ga_15 337 338 339 2 ga_37 337 338 340 2 ga_37 339 338 340 2 ga_7 338 339 342 2 ga_7 338 340 341 2 ga_36 338 340 344 2 ga_7 341 340 344 2 ga_36 339 342 343 2 ga_36 339 342 344 2 ga_7 343 342 344 2 ga_36 340 344 342 2 ga_7 340 344 345 2 ga_36 342 344 345 2 ga_36 336 346 347 2 ga_30 336 346 348 2 ga_19 347 346 348 2 ga_33 346 348 349 2 ga_31 346 348 352 2 ga_31 349 348 352 2 ga_21 348 349 350 2 ga_13 348 349 353 2 ga_13 350 349 353 2 ga_13 349 350 351 2 ga_13 350 351 352 2 ga_13 348 352 351 2 ga_13 349 353 354 2 ga_30 349 353 355 2 ga_19 354 353 355 2 ga_33 353 355 356 2 ga_32 353 355 357 2 ga_31 356 355 357 2 ga_18 355 357 358 2 ga_13 357 358 359 2 ga_30 357 358 360 2 ga_19 359 358 360 2 ga_33 358 360 361 2 ga_32 358 360 362 2 ga_31 361 360 362 2 ga_18 360 362 363 2 ga_13 360 362 369 2 ga_13 363 362 369 2 ga_13 362 363 364 2 ga_15 363 364 365 2 ga_30 363 364 366 2 ga_19 365 364 366 2 ga_33 364 366 367 2 ga_23 364 366 368 2 ga_23 367 366 368 2 ga_24 362 369 370 2 ga_30 362 369 371 2 ga_19 370 369 371 2 ga_33 369 371 372 2 ga_32 369 371 373 2 ga_31 372 371 373 2 ga_18 371 373 374 2 ga_13 371 373 378 2 ga_13 374 373 378 2 ga_13 373 374 375 2 ga_15 374 375 376 2 ga_15 374 375 377 2 ga_15 376 375 377 2 ga_15 373 378 379 2 ga_30 373 378 380 2 ga_19 379 378 380 2 ga_33 378 380 381 2 ga_31 378 380 384 2 ga_31 381 380 384 2 ga_21 380 381 382 2 ga_13 380 381 385 2 ga_13 382 381 385 2 ga_13 381 382 383 2 ga_13 382 383 384 2 ga_13 380 384 383 2 ga_13 381 385 386 2 ga_30 381 385 387 2 ga_19 386 385 387 2 ga_33 385 387 388 2 ga_32 385 387 389 2 ga_31 388 387 389 2 ga_18 387 389 390 2 ga_13 387 389 398 2 ga_13 390 389 398 2 ga_13 389 390 391 2 ga_15 390 391 392 2 ga_15 391 392 393 2 ga_15 392 393 394 2 ga_15 393 394 395 2 ga_11 393 394 396 2 ga_11 393 394 397 2 ga_11 395 394 396 2 ga_10 395 394 397 2 ga_10 396 394 397 2 ga_10 389 398 399 2 ga_30 389 398 400 2 ga_19 399 398 400 2 ga_33 398 400 401 2 ga_32 398 400 402 2 ga_31 401 400 402 2 ga_18 400 402 403 2 ga_13 400 402 409 2 ga_13 403 402 409 2 ga_13 402 403 404 2 ga_15 403 404 405 2 ga_30 403 404 406 2 ga_19 405 404 406 2 ga_33 404 406 407 2 ga_23 404 406 408 2 ga_23 407 406 408 2 ga_24 402 409 410 2 ga_30 402 409 411 2 ga_19 410 409 411 2 ga_33 409 411 412 2 ga_32 409 411 413 2 ga_31 412 411 413 2 ga_18 411 413 414 2 ga_13 411 413 417 2 ga_13 414 413 417 2 ga_13 413 414 415 2 ga_15 413 414 416 2 ga_15 415 414 416 2 ga_15 413 417 418 2 ga_30 413 417 419 2 ga_19 418 417 419 2 ga_33 417 419 420 2 ga_32 417 419 421 2 ga_31 420 419 421 2 ga_18 419 421 422 2 ga_13 419 421 426 2 ga_13 422 421 426 2 ga_13 421 422 423 2 ga_15 422 423 424 2 ga_16 423 424 425 2 ga_4 421 426 427 2 ga_30 421 426 428 2 ga_19 427 426 428 2 ga_33 426 428 429 2 ga_32 426 428 430 2 ga_31 429 428 430 2 ga_18 428 430 431 2 ga_13 430 431 432 2 ga_30 430 431 433 2 ga_19 432 431 433 2 ga_33 431 433 434 2 ga_32 431 433 435 2 ga_31 434 433 435 2 ga_18 433 435 436 2 ga_13 433 435 445 2 ga_13 436 435 445 2 ga_13 435 436 437 2 ga_15 436 437 438 2 ga_37 436 437 439 2 ga_37 438 437 439 2 ga_7 437 438 441 2 ga_7 437 439 440 2 ga_36 437 439 443 2 ga_7 440 439 443 2 ga_36 438 441 442 2 ga_36 438 441 443 2 ga_7 442 441 443 2 ga_36 439 443 441 2 ga_7 439 443 444 2 ga_36 441 443 444 2 ga_36 435 445 446 2 ga_30 435 445 447 2 ga_19 446 445 447 2 ga_33 445 447 448 2 ga_32 445 447 449 2 ga_31 448 447 449 2 ga_18 447 449 450 2 ga_13 447 449 456 2 ga_13 450 449 456 2 ga_13 449 450 451 2 ga_15 450 451 452 2 ga_30 450 451 453 2 ga_19 452 451 453 2 ga_33 451 453 454 2 ga_23 451 453 455 2 ga_23 454 453 455 2 ga_24 449 456 457 2 ga_30 449 456 458 2 ga_19 457 456 458 2 ga_33 456 458 459 2 ga_32 456 458 460 2 ga_31 459 458 460 2 ga_18 458 460 461 2 ga_13 458 460 477 2 ga_13 461 460 477 2 ga_13 460 461 462 2 ga_15 461 462 463 2 ga_37 461 462 465 2 ga_37 463 462 465 2 ga_7 462 463 464 2 ga_36 462 463 466 2 ga_7 464 463 466 2 ga_36 462 465 468 2 ga_7 462 465 469 2 ga_39 468 465 469 2 ga_27 463 466 467 2 ga_36 463 466 468 2 ga_7 467 466 468 2 ga_36 465 468 466 2 ga_7 465 468 471 2 ga_27 466 468 471 2 ga_39 465 469 470 2 ga_25 465 469 473 2 ga_27 470 469 473 2 ga_25 468 471 472 2 ga_25 468 471 475 2 ga_27 472 471 475 2 ga_25 469 473 474 2 ga_25 469 473 475 2 ga_27 474 473 475 2 ga_25 471 475 473 2 ga_27 471 475 476 2 ga_25 473 475 476 2 ga_25 460 477 478 2 ga_30 460 477 479 2 ga_19 478 477 479 2 ga_33 477 479 480 2 ga_32 477 479 481 2 ga_31 480 479 481 2 ga_18 479 481 482 2 ga_13 479 481 485 2 ga_13 482 481 485 2 ga_13 481 482 483 2 ga_15 481 482 484 2 ga_15 483 482 484 2 ga_15 481 485 486 2 ga_30 481 485 487 2 ga_19 486 485 487 2 ga_33 485 487 488 2 ga_32 485 487 489 2 ga_31 488 487 489 2 ga_18 487 489 490 2 ga_13 487 489 494 2 ga_13 490 489 494 2 ga_13 489 490 491 2 ga_15 490 491 492 2 ga_15 490 491 493 2 ga_15 492 491 493 2 ga_15 489 494 495 2 ga_30 489 494 496 2 ga_19 495 494 496 2 ga_33 494 496 497 2 ga_32 494 496 498 2 ga_31 497 496 498 2 ga_18 496 498 499 2 ga_13 496 498 502 2 ga_13 499 498 502 2 ga_13 498 499 500 2 ga_13 499 500 501 2 ga_12 498 502 503 2 ga_30 498 502 504 2 ga_19 503 502 504 2 ga_33 502 504 505 2 ga_32 502 504 506 2 ga_31 505 504 506 2 ga_18 504 506 507 2 ga_13 504 506 511 2 ga_13 507 506 511 2 ga_13 506 507 508 2 ga_13 506 507 510 2 ga_15 508 507 510 2 ga_15 507 508 509 2 ga_12 506 511 512 2 ga_30 506 511 513 2 ga_19 512 511 513 2 ga_33 511 513 514 2 ga_32 511 513 515 2 ga_31 514 513 515 2 ga_18 513 515 516 2 ga_13 513 515 517 2 ga_13 516 515 517 2 ga_13 515 517 518 2 ga_30 515 517 519 2 ga_19 518 517 519 2 ga_33 517 519 520 2 ga_32 517 519 521 2 ga_31 520 519 521 2 ga_18 519 521 522 2 ga_13 519 521 523 2 ga_13 522 521 523 2 ga_13 521 523 524 2 ga_30 521 523 525 2 ga_19 524 523 525 2 ga_33 523 525 526 2 ga_32 523 525 527 2 ga_31 526 525 527 2 ga_18 525 527 528 2 ga_13 525 527 532 2 ga_13 528 527 532 2 ga_13 527 528 529 2 ga_15 528 529 530 2 ga_22 528 529 531 2 ga_22 530 529 531 2 ga_38 527 532 533 2 ga_30 527 532 534 2 ga_19 533 532 534 2 ga_33 532 534 535 2 ga_32 532 534 536 2 ga_31 535 534 536 2 ga_18 534 536 537 2 ga_13 534 536 541 2 ga_13 537 536 541 2 ga_13 536 537 538 2 ga_15 537 538 539 2 ga_16 538 539 540 2 ga_4 536 541 542 2 ga_30 536 541 543 2 ga_19 542 541 543 2 ga_33 541 543 544 2 ga_32 541 543 545 2 ga_31 544 543 545 2 ga_18 543 545 546 2 ga_13 543 545 553 2 ga_13 546 545 553 2 ga_13 545 546 547 2 ga_15 546 547 548 2 ga_15 547 548 549 2 ga_30 547 548 550 2 ga_19 549 548 550 2 ga_33 548 550 551 2 ga_23 548 550 552 2 ga_23 551 550 552 2 ga_24 545 553 554 2 ga_30 545 553 555 2 ga_19 554 553 555 2 ga_33 553 555 556 2 ga_32 553 555 557 2 ga_31 556 555 557 2 ga_18 555 557 558 2 ga_13 557 558 559 2 ga_30 557 558 560 2 ga_19 559 558 560 2 ga_33 558 560 561 2 ga_32 558 560 562 2 ga_31 561 560 562 2 ga_18 560 562 563 2 ga_13 560 562 566 2 ga_13 563 562 566 2 ga_13 562 563 564 2 ga_15 562 563 565 2 ga_15 564 563 565 2 ga_15 562 566 567 2 ga_30 562 566 568 2 ga_19 567 566 568 2 ga_33 566 568 569 2 ga_32 566 568 570 2 ga_31 569 568 570 2 ga_18 568 570 571 2 ga_13 568 570 574 2 ga_13 571 570 574 2 ga_13 570 571 572 2 ga_15 570 571 573 2 ga_15 572 571 573 2 ga_15 570 574 575 2 ga_30 570 574 576 2 ga_19 575 574 576 2 ga_33 574 576 577 2 ga_32 574 576 578 2 ga_31 577 576 578 2 ga_18 576 578 579 2 ga_13 576 578 583 2 ga_13 579 578 583 2 ga_13 578 579 580 2 ga_13 578 579 582 2 ga_15 580 579 582 2 ga_15 579 580 581 2 ga_12 578 583 584 2 ga_30 578 583 585 2 ga_19 584 583 585 2 ga_33 583 585 586 2 ga_32 583 585 587 2 ga_31 586 585 587 2 ga_18 585 587 588 2 ga_13 585 587 592 2 ga_13 588 587 592 2 ga_13 587 588 589 2 ga_15 588 589 590 2 ga_22 588 589 591 2 ga_22 590 589 591 2 ga_38 587 592 593 2 ga_30 587 592 594 2 ga_19 593 592 594 2 ga_33 592 594 595 2 ga_32 592 594 596 2 ga_31 595 594 596 2 ga_18 594 596 597 2 ga_13 596 597 598 2 ga_30 596 597 599 2 ga_19 598 597 599 2 ga_33 597 599 600 2 ga_32 597 599 601 2 ga_31 600 599 601 2 ga_18 599 601 602 2 ga_13 599 601 606 2 ga_13 602 601 606 2 ga_13 601 602 603 2 ga_15 602 603 604 2 ga_16 603 604 605 2 ga_4 601 606 607 2 ga_30 601 606 608 2 ga_19 607 606 608 2 ga_33 606 608 609 2 ga_32 606 608 610 2 ga_31 609 608 610 2 ga_18 608 610 611 2 ga_13 608 610 612 2 ga_13 611 610 612 2 ga_13 610 612 613 2 ga_30 610 612 614 2 ga_19 613 612 614 2 ga_33 612 614 615 2 ga_32 612 614 616 2 ga_31 615 614 616 2 ga_18 614 616 617 2 ga_13 614 616 620 2 ga_13 617 616 620 2 ga_13 616 617 618 2 ga_13 617 618 619 2 ga_12 616 620 621 2 ga_30 616 620 622 2 ga_19 621 620 622 2 ga_33 620 622 623 2 ga_32 620 622 624 2 ga_31 623 622 624 2 ga_18 622 624 625 2 ga_13 624 625 626 2 ga_30 624 625 627 2 ga_19 626 625 627 2 ga_33 625 627 628 2 ga_32 625 627 629 2 ga_31 628 627 629 2 ga_18 627 629 630 2 ga_13 627 629 634 2 ga_13 630 629 634 2 ga_13 629 630 631 2 ga_15 630 631 632 2 ga_15 630 631 633 2 ga_15 632 631 633 2 ga_15 629 634 635 2 ga_30 629 634 636 2 ga_19 635 634 636 2 ga_33 634 636 637 2 ga_32 634 636 638 2 ga_31 637 636 638 2 ga_18 636 638 639 2 ga_13 636 638 643 2 ga_13 639 638 643 2 ga_13 638 639 640 2 ga_15 639 640 641 2 ga_22 639 640 642 2 ga_22 641 640 642 2 ga_38 638 643 644 2 ga_30 638 643 645 2 ga_19 644 643 645 2 ga_33 643 645 646 2 ga_32 643 645 647 2 ga_31 646 645 647 2 ga_18 645 647 648 2 ga_13 645 647 656 2 ga_13 648 647 656 2 ga_13 647 648 649 2 ga_15 648 649 650 2 ga_15 649 650 651 2 ga_15 650 651 652 2 ga_15 651 652 653 2 ga_11 651 652 654 2 ga_11 651 652 655 2 ga_11 653 652 654 2 ga_10 653 652 655 2 ga_10 654 652 655 2 ga_10 647 656 657 2 ga_30 647 656 658 2 ga_19 657 656 658 2 ga_33 656 658 659 2 ga_32 656 658 660 2 ga_31 659 658 660 2 ga_18 658 660 661 2 ga_13 658 660 665 2 ga_13 661 660 665 2 ga_13 660 661 662 2 ga_15 661 662 663 2 ga_22 661 662 664 2 ga_22 663 662 664 2 ga_38 660 665 666 2 ga_30 660 665 667 2 ga_19 666 665 667 2 ga_33 665 667 668 2 ga_32 665 667 669 2 ga_31 668 667 669 2 ga_18 667 669 670 2 ga_13 667 669 683 2 ga_13 670 669 683 2 ga_13 669 670 671 2 ga_15 670 671 672 2 ga_27 670 671 674 2 ga_27 672 671 674 2 ga_27 671 672 673 2 ga_25 671 672 676 2 ga_27 673 672 676 2 ga_25 671 674 675 2 ga_25 671 674 678 2 ga_27 675 674 678 2 ga_25 672 676 677 2 ga_25 672 676 680 2 ga_27 677 676 680 2 ga_25 674 678 679 2 ga_25 674 678 680 2 ga_27 679 678 680 2 ga_25 676 680 678 2 ga_27 676 680 681 2 ga_27 678 680 681 2 ga_27 680 681 682 2 ga_12 669 683 684 2 ga_30 669 683 685 2 ga_19 684 683 685 2 ga_33 683 685 686 2 ga_32 683 685 687 2 ga_31 686 685 687 2 ga_18 685 687 688 2 ga_13 685 687 692 2 ga_13 688 687 692 2 ga_13 687 688 689 2 ga_15 688 689 690 2 ga_15 688 689 691 2 ga_15 690 689 691 2 ga_15 687 692 693 2 ga_30 687 692 694 2 ga_19 693 692 694 2 ga_33 692 694 695 2 ga_32 692 694 696 2 ga_31 695 694 696 2 ga_18 694 696 697 2 ga_13 694 696 705 2 ga_13 697 696 705 2 ga_13 696 697 698 2 ga_15 697 698 699 2 ga_15 698 699 700 2 ga_15 699 700 701 2 ga_15 700 701 702 2 ga_11 700 701 703 2 ga_11 700 701 704 2 ga_11 702 701 703 2 ga_10 702 701 704 2 ga_10 703 701 704 2 ga_10 696 705 706 2 ga_30 696 705 707 2 ga_19 706 705 707 2 ga_33 705 707 708 2 ga_31 705 707 711 2 ga_31 708 707 711 2 ga_21 707 708 709 2 ga_13 707 708 712 2 ga_13 709 708 712 2 ga_13 708 709 710 2 ga_13 709 710 711 2 ga_13 707 711 710 2 ga_13 708 712 713 2 ga_30 708 712 714 2 ga_19 713 712 714 2 ga_33 712 714 715 2 ga_32 712 714 716 2 ga_31 715 714 716 2 ga_18 714 716 717 2 ga_13 714 716 721 2 ga_13 717 716 721 2 ga_13 716 717 718 2 ga_15 717 718 719 2 ga_22 717 718 720 2 ga_22 719 718 720 2 ga_38 716 721 722 2 ga_30 716 721 723 2 ga_19 722 721 723 2 ga_33 721 723 724 2 ga_32 721 723 725 2 ga_31 724 723 725 2 ga_18 723 725 726 2 ga_13 723 725 730 2 ga_13 726 725 730 2 ga_13 725 726 727 2 ga_15 726 727 728 2 ga_22 726 727 729 2 ga_22 728 727 729 2 ga_38 725 730 731 2 ga_30 725 730 732 2 ga_19 731 730 732 2 ga_33 730 732 733 2 ga_32 730 732 734 2 ga_31 733 732 734 2 ga_18 732 734 735 2 ga_13 732 734 738 2 ga_13 735 734 738 2 ga_13 734 735 736 2 ga_13 735 736 737 2 ga_12 734 738 739 2 ga_30 734 738 740 2 ga_19 739 738 740 2 ga_33 738 740 741 2 ga_32 738 740 742 2 ga_31 741 740 742 2 ga_18 740 742 743 2 ga_13 740 742 755 2 ga_13 743 742 755 2 ga_13 742 743 744 2 ga_15 743 744 745 2 ga_15 744 745 746 2 ga_13 745 746 747 2 ga_20 745 746 748 2 ga_33 747 746 748 2 ga_23 746 748 749 2 ga_28 746 748 752 2 ga_28 749 748 752 2 ga_28 748 749 750 2 ga_23 748 749 751 2 ga_23 750 749 751 2 ga_24 748 752 753 2 ga_23 748 752 754 2 ga_23 753 752 754 2 ga_24 742 755 756 2 ga_30 742 755 757 2 ga_19 756 755 757 2 ga_33 755 757 758 2 ga_32 755 757 759 2 ga_31 758 757 759 2 ga_18 757 759 760 2 ga_13 757 759 763 2 ga_13 760 759 763 2 ga_13 759 760 761 2 ga_15 759 760 762 2 ga_15 761 760 762 2 ga_15 759 763 764 2 ga_30 759 763 765 2 ga_19 764 763 765 2 ga_33 763 765 766 2 ga_32 763 765 767 2 ga_31 766 765 767 2 ga_18 765 767 768 2 ga_13 765 767 772 2 ga_13 768 767 772 2 ga_13 767 768 769 2 ga_15 767 768 770 2 ga_15 769 768 770 2 ga_15 768 769 771 2 ga_15 767 772 773 2 ga_30 767 772 774 2 ga_19 773 772 774 2 ga_33 772 774 775 2 ga_32 772 774 776 2 ga_31 775 774 776 2 ga_18 774 776 777 2 ga_13 774 776 778 2 ga_13 777 776 778 2 ga_13 776 778 779 2 ga_30 776 778 780 2 ga_19 779 778 780 2 ga_33 778 780 781 2 ga_32 778 780 782 2 ga_31 781 780 782 2 ga_18 780 782 783 2 ga_13 780 782 792 2 ga_13 783 782 792 2 ga_13 782 783 784 2 ga_15 783 784 785 2 ga_37 783 784 787 2 ga_37 782 792 793 2 ga_30 782 792 794 2 ga_19 793 792 794 2 ga_33 792 794 795 2 ga_32 792 794 796 2 ga_31 795 794 796 2 ga_18 794 796 797 2 ga_13 794 796 801 2 ga_13 797 796 801 2 ga_13 796 797 798 2 ga_13 796 797 800 2 ga_15 798 797 800 2 ga_15 797 798 799 2 ga_12 796 801 802 2 ga_30 796 801 803 2 ga_19 802 801 803 2 ga_33 801 803 804 2 ga_32 801 803 805 2 ga_31 804 803 805 2 ga_18 803 805 806 2 ga_13 803 805 814 2 ga_13 806 805 814 2 ga_13 805 806 807 2 ga_15 806 807 808 2 ga_15 807 808 809 2 ga_15 808 809 810 2 ga_15 809 810 811 2 ga_11 809 810 812 2 ga_11 809 810 813 2 ga_11 811 810 812 2 ga_10 811 810 813 2 ga_10 812 810 813 2 ga_10 805 814 815 2 ga_30 805 814 816 2 ga_19 815 814 816 2 ga_33 814 816 817 2 ga_32 814 816 818 2 ga_31 817 816 818 2 ga_18 816 818 819 2 ga_13 816 818 823 2 ga_13 819 818 823 2 ga_13 818 819 820 2 ga_15 819 820 821 2 ga_15 819 820 822 2 ga_15 821 820 822 2 ga_15 818 823 824 2 ga_30 818 823 825 2 ga_19 824 823 825 2 ga_33 823 825 826 2 ga_32 823 825 827 2 ga_31 826 825 827 2 ga_18 825 827 828 2 ga_13 825 827 832 2 ga_13 828 827 832 2 ga_13 827 828 829 2 ga_15 827 828 830 2 ga_15 829 828 830 2 ga_15 828 829 831 2 ga_15 827 832 833 2 ga_30 827 832 834 2 ga_19 833 832 834 2 ga_33 832 834 835 2 ga_32 832 834 836 2 ga_31 835 834 836 2 ga_18 834 836 837 2 ga_13 836 837 838 2 ga_30 836 837 839 2 ga_19 838 837 839 2 ga_33 837 839 840 2 ga_32 837 839 841 2 ga_31 840 839 841 2 ga_18 839 841 842 2 ga_13 839 841 845 2 ga_13 842 841 845 2 ga_13 841 842 843 2 ga_13 842 843 844 2 ga_12 841 845 846 2 ga_30 841 845 847 2 ga_19 846 845 847 2 ga_33 845 847 848 2 ga_32 845 847 849 2 ga_31 848 847 849 2 ga_18 847 849 850 2 ga_13 849 850 851 2 ga_30 849 850 852 2 ga_19 851 850 852 2 ga_33 850 852 853 2 ga_32 850 852 854 2 ga_31 853 852 854 2 ga_18 852 854 855 2 ga_13 852 854 860 2 ga_13 855 854 860 2 ga_13 854 855 856 2 ga_15 855 856 857 2 ga_15 856 857 858 2 ga_22 856 857 859 2 ga_22 858 857 859 2 ga_38 854 860 861 2 ga_30 854 860 862 2 ga_19 861 860 862 2 ga_33 860 862 863 2 ga_32 860 862 864 2 ga_31 863 862 864 2 ga_18 862 864 865 2 ga_13 862 864 873 2 ga_13 865 864 873 2 ga_13 864 865 866 2 ga_15 865 866 867 2 ga_15 866 867 868 2 ga_15 867 868 869 2 ga_15 868 869 870 2 ga_11 868 869 871 2 ga_11 868 869 872 2 ga_11 870 869 871 2 ga_10 870 869 872 2 ga_10 871 869 872 2 ga_10 864 873 874 2 ga_30 864 873 875 2 ga_19 874 873 875 2 ga_33 873 875 876 2 ga_32 873 875 877 2 ga_31 876 875 877 2 ga_18 875 877 878 2 ga_13 875 877 882 2 ga_13 878 877 882 2 ga_13 877 878 879 2 ga_15 878 879 880 2 ga_22 878 879 881 2 ga_22 880 879 881 2 ga_38 877 882 883 2 ga_30 877 882 884 2 ga_19 883 882 884 2 ga_33 882 884 885 2 ga_32 882 884 886 2 ga_31 885 884 886 2 ga_18 884 886 887 2 ga_13 884 886 890 2 ga_13 887 886 890 2 ga_13 886 887 888 2 ga_13 887 888 889 2 ga_12 886 890 891 2 ga_30 886 890 892 2 ga_19 891 890 892 2 ga_33 890 892 893 2 ga_32 890 892 894 2 ga_31 893 892 894 2 ga_18 892 894 895 2 ga_13 892 894 898 2 ga_13 895 894 898 2 ga_13 894 895 896 2 ga_15 894 895 897 2 ga_15 896 895 897 2 ga_15 894 898 899 2 ga_30 894 898 900 2 ga_19 899 898 900 2 ga_33 898 900 901 2 ga_32 898 900 902 2 ga_31 901 900 902 2 ga_18 900 902 903 2 ga_13 900 902 907 2 ga_13 903 902 907 2 ga_13 902 903 904 2 ga_13 902 903 906 2 ga_15 904 903 906 2 ga_15 903 904 905 2 ga_12 902 907 908 2 ga_30 902 907 909 2 ga_19 908 907 909 2 ga_33 907 909 910 2 ga_32 907 909 911 2 ga_31 910 909 911 2 ga_18 909 911 912 2 ga_13 909 911 924 2 ga_13 912 911 924 2 ga_13 911 912 913 2 ga_15 912 913 914 2 ga_27 912 913 916 2 ga_27 914 913 916 2 ga_27 913 914 915 2 ga_25 913 914 918 2 ga_27 915 914 918 2 ga_25 913 916 917 2 ga_25 913 916 920 2 ga_27 917 916 920 2 ga_25 914 918 919 2 ga_25 914 918 922 2 ga_27 919 918 922 2 ga_25 916 920 921 2 ga_25 916 920 922 2 ga_27 921 920 922 2 ga_25 918 922 920 2 ga_27 918 922 923 2 ga_25 920 922 923 2 ga_25 911 924 925 2 ga_30 911 924 926 2 ga_19 925 924 926 2 ga_33 924 926 927 2 ga_32 924 926 928 2 ga_31 927 926 928 2 ga_18 926 928 929 2 ga_13 926 928 933 2 ga_13 929 928 933 2 ga_13 928 929 930 2 ga_15 929 930 931 2 ga_22 929 930 932 2 ga_22 931 930 932 2 ga_38 928 933 934 2 ga_30 928 933 935 2 ga_19 934 933 935 2 ga_33 933 935 936 2 ga_32 933 935 937 2 ga_31 936 935 937 2 ga_18 935 937 938 2 ga_13 935 937 941 2 ga_13 938 937 941 2 ga_13 937 938 939 2 ga_15 937 938 940 2 ga_15 939 938 940 2 ga_15 937 941 942 2 ga_30 937 941 943 2 ga_19 942 941 943 2 ga_33 941 943 944 2 ga_32 941 943 945 2 ga_31 944 943 945 2 ga_18 943 945 946 2 ga_13 943 945 949 2 ga_13 946 945 949 2 ga_13 945 946 947 2 ga_13 946 947 948 2 ga_12 945 949 950 2 ga_30 945 949 951 2 ga_19 950 949 951 2 ga_33 949 951 952 2 ga_32 949 951 953 2 ga_31 952 951 953 2 ga_18 951 953 954 2 ga_13 951 953 962 2 ga_13 954 953 962 2 ga_13 953 954 955 2 ga_15 954 955 956 2 ga_15 955 956 957 2 ga_15 956 957 958 2 ga_15 957 958 959 2 ga_11 957 958 960 2 ga_11 957 958 961 2 ga_11 959 958 960 2 ga_10 959 958 961 2 ga_10 960 958 961 2 ga_10 953 962 963 2 ga_30 953 962 964 2 ga_19 963 962 964 2 ga_33 962 964 965 2 ga_32 962 964 966 2 ga_31 965 964 966 2 ga_18 964 966 967 2 ga_13 964 966 971 2 ga_13 967 966 971 2 ga_13 966 967 968 2 ga_15 967 968 969 2 ga_15 967 968 970 2 ga_15 969 968 970 2 ga_15 966 971 972 2 ga_30 966 971 973 2 ga_19 972 971 973 2 ga_33 971 973 974 2 ga_32 971 973 975 2 ga_31 974 973 975 2 ga_18 973 975 976 2 ga_13 973 975 984 2 ga_13 976 975 984 2 ga_13 975 976 977 2 ga_15 976 977 978 2 ga_15 977 978 979 2 ga_15 978 979 980 2 ga_15 979 980 981 2 ga_11 979 980 982 2 ga_11 979 980 983 2 ga_11 981 980 982 2 ga_10 981 980 983 2 ga_10 982 980 983 2 ga_10 975 984 985 2 ga_30 975 984 986 2 ga_19 985 984 986 2 ga_33 984 986 987 2 ga_32 984 986 988 2 ga_31 987 986 988 2 ga_18 986 988 989 2 ga_13 986 988 994 2 ga_13 989 988 994 2 ga_13 988 989 990 2 ga_15 989 990 991 2 ga_15 990 991 992 2 ga_22 990 991 993 2 ga_22 992 991 993 2 ga_38 988 994 995 2 ga_30 988 994 996 2 ga_19 995 994 996 2 ga_33 994 996 997 2 ga_32 994 996 998 2 ga_31 997 996 998 2 ga_18 996 998 999 2 ga_13 998 999 1000 2 ga_30 998 999 1001 2 ga_19 1000 999 1001 2 ga_33 999 1001 1002 2 ga_32 999 1001 1003 2 ga_31 1002 1001 1003 2 ga_18 1001 1003 1004 2 ga_13 1001 1003 1009 2 ga_13 1004 1003 1009 2 ga_13 1003 1004 1005 2 ga_15 1004 1005 1006 2 ga_15 1005 1006 1007 2 ga_22 1005 1006 1008 2 ga_22 1007 1006 1008 2 ga_38 1003 1009 1010 2 ga_30 1003 1009 1011 2 ga_19 1010 1009 1011 2 ga_33 1009 1011 1012 2 ga_32 1009 1011 1013 2 ga_31 1012 1011 1013 2 ga_18 1011 1013 1014 2 ga_13 1011 1013 1021 2 ga_13 1014 1013 1021 2 ga_13 1013 1014 1015 2 ga_15 1014 1015 1016 2 ga_15 1015 1016 1017 2 ga_30 1015 1016 1018 2 ga_19 1017 1016 1018 2 ga_33 1016 1018 1019 2 ga_23 1016 1018 1020 2 ga_23 1019 1018 1020 2 ga_24 1013 1021 1022 2 ga_30 1013 1021 1023 2 ga_19 1022 1021 1023 2 ga_33 1021 1023 1024 2 ga_32 1021 1023 1025 2 ga_31 1024 1023 1025 2 ga_18 1023 1025 1026 2 ga_13 1023 1025 1039 2 ga_13 1026 1025 1039 2 ga_13 1025 1026 1027 2 ga_15 1026 1027 1028 2 ga_27 1026 1027 1030 2 ga_27 1028 1027 1030 2 ga_27 1027 1028 1029 2 ga_25 1027 1028 1032 2 ga_27 1029 1028 1032 2 ga_25 1027 1030 1031 2 ga_25 1027 1030 1034 2 ga_27 1031 1030 1034 2 ga_25 1028 1032 1033 2 ga_25 1028 1032 1036 2 ga_27 1033 1032 1036 2 ga_25 1030 1034 1035 2 ga_25 1030 1034 1036 2 ga_27 1035 1034 1036 2 ga_25 1032 1036 1034 2 ga_27 1032 1036 1037 2 ga_27 1034 1036 1037 2 ga_27 1036 1037 1038 2 ga_12 1025 1039 1040 2 ga_30 1025 1039 1041 2 ga_19 1040 1039 1041 2 ga_33 1039 1041 1042 2 ga_32 1039 1041 1043 2 ga_31 1042 1041 1043 2 ga_18 1041 1043 1044 2 ga_13 1041 1043 1048 2 ga_13 1044 1043 1048 2 ga_13 1043 1044 1045 2 ga_15 1044 1045 1046 2 ga_16 1045 1046 1047 2 ga_4 1043 1048 1049 2 ga_30 1043 1048 1050 2 ga_19 1049 1048 1050 2 ga_33 1048 1050 1051 2 ga_32 1048 1050 1052 2 ga_31 1051 1050 1052 2 ga_18 1050 1052 1053 2 ga_13 1050 1052 1065 2 ga_13 1053 1052 1065 2 ga_13 1052 1053 1054 2 ga_15 1053 1054 1055 2 ga_27 1053 1054 1057 2 ga_27 1055 1054 1057 2 ga_27 1054 1055 1056 2 ga_25 1054 1055 1059 2 ga_27 1056 1055 1059 2 ga_25 1054 1057 1058 2 ga_25 1054 1057 1061 2 ga_27 1058 1057 1061 2 ga_25 1055 1059 1060 2 ga_25 1055 1059 1063 2 ga_27 1060 1059 1063 2 ga_25 1057 1061 1062 2 ga_25 1057 1061 1063 2 ga_27 1062 1061 1063 2 ga_25 1059 1063 1061 2 ga_27 1059 1063 1064 2 ga_25 1061 1063 1064 2 ga_25 1052 1065 1066 2 ga_30 1052 1065 1067 2 ga_19 1066 1065 1067 2 ga_33 1065 1067 1068 2 ga_32 1065 1067 1069 2 ga_31 1068 1067 1069 2 ga_18 1067 1069 1070 2 ga_13 1067 1069 1082 2 ga_13 1070 1069 1082 2 ga_13 1069 1070 1071 2 ga_15 1070 1071 1072 2 ga_27 1070 1071 1074 2 ga_27 1072 1071 1074 2 ga_27 1071 1072 1073 2 ga_25 1071 1072 1076 2 ga_27 1073 1072 1076 2 ga_25 1071 1074 1075 2 ga_25 1071 1074 1078 2 ga_27 1075 1074 1078 2 ga_25 1072 1076 1077 2 ga_25 1072 1076 1080 2 ga_27 1077 1076 1080 2 ga_25 1074 1078 1079 2 ga_25 1074 1078 1080 2 ga_27 1079 1078 1080 2 ga_25 1076 1080 1078 2 ga_27 1076 1080 1081 2 ga_25 1078 1080 1081 2 ga_25 1069 1082 1083 2 ga_30 1069 1082 1084 2 ga_19 1083 1082 1084 2 ga_33 1082 1084 1085 2 ga_32 1082 1084 1086 2 ga_31 1085 1084 1086 2 ga_18 1084 1086 1087 2 ga_13 1084 1086 1089 2 ga_13 1087 1086 1089 2 ga_13 1086 1087 1088 2 ga_16 1086 1089 1090 2 ga_30 1086 1089 1091 2 ga_19 1090 1089 1091 2 ga_33 1089 1091 1092 2 ga_32 1089 1091 1093 2 ga_31 1092 1091 1093 2 ga_18 1091 1093 1094 2 ga_13 1091 1093 1098 2 ga_13 1094 1093 1098 2 ga_13 1093 1094 1095 2 ga_13 1093 1094 1097 2 ga_15 1095 1094 1097 2 ga_15 1094 1095 1096 2 ga_12 1093 1098 1099 2 ga_30 1093 1098 1100 2 ga_19 1099 1098 1100 2 ga_33 1098 1100 1101 2 ga_32 1098 1100 1102 2 ga_31 1101 1100 1102 2 ga_18 1100 1102 1103 2 ga_13 1100 1102 1115 2 ga_13 1103 1102 1115 2 ga_13 1102 1103 1104 2 ga_15 1103 1104 1105 2 ga_27 1103 1104 1107 2 ga_27 1105 1104 1107 2 ga_27 1104 1105 1106 2 ga_25 1104 1105 1109 2 ga_27 1106 1105 1109 2 ga_25 1104 1107 1108 2 ga_25 1104 1107 1111 2 ga_27 1108 1107 1111 2 ga_25 1105 1109 1110 2 ga_25 1105 1109 1113 2 ga_27 1110 1109 1113 2 ga_25 1107 1111 1112 2 ga_25 1107 1111 1113 2 ga_27 1112 1111 1113 2 ga_25 1109 1113 1111 2 ga_27 1109 1113 1114 2 ga_25 1111 1113 1114 2 ga_25 1102 1115 1116 2 ga_30 1102 1115 1117 2 ga_19 1116 1115 1117 2 ga_33 1115 1117 1118 2 ga_31 1115 1117 1121 2 ga_31 1118 1117 1121 2 ga_21 1117 1118 1119 2 ga_13 1117 1118 1122 2 ga_13 1119 1118 1122 2 ga_13 1118 1119 1120 2 ga_13 1119 1120 1121 2 ga_13 1117 1121 1120 2 ga_13 1118 1122 1123 2 ga_30 1118 1122 1124 2 ga_19 1123 1122 1124 2 ga_33 1122 1124 1125 2 ga_32 1122 1124 1126 2 ga_31 1125 1124 1126 2 ga_18 1124 1126 1127 2 ga_13 1126 1127 1128 2 ga_30 1126 1127 1129 2 ga_19 1128 1127 1129 2 ga_33 1127 1129 1130 2 ga_32 1127 1129 1131 2 ga_31 1130 1129 1131 2 ga_18 1129 1131 1132 2 ga_13 1129 1131 1141 2 ga_13 1132 1131 1141 2 ga_13 1131 1132 1133 2 ga_15 1132 1133 1134 2 ga_37 1132 1133 1135 2 ga_37 1134 1133 1135 2 ga_7 1133 1134 1137 2 ga_7 1133 1135 1136 2 ga_36 1133 1135 1139 2 ga_7 1136 1135 1139 2 ga_36 1134 1137 1138 2 ga_36 1134 1137 1139 2 ga_7 1138 1137 1139 2 ga_36 1135 1139 1137 2 ga_7 1135 1139 1140 2 ga_36 1137 1139 1140 2 ga_36 1131 1141 1142 2 ga_30 1131 1141 1143 2 ga_19 1142 1141 1143 2 ga_33 1141 1143 1144 2 ga_32 1141 1143 1145 2 ga_31 1144 1143 1145 2 ga_18 1143 1145 1146 2 ga_13 1143 1145 1149 2 ga_13 1146 1145 1149 2 ga_13 1145 1146 1147 2 ga_13 1146 1147 1148 2 ga_12 1145 1149 1150 2 ga_30 1145 1149 1151 2 ga_19 1150 1149 1151 2 ga_33 1149 1151 1152 2 ga_32 1149 1151 1153 2 ga_31 1152 1151 1153 2 ga_18 1151 1153 1154 2 ga_13 1151 1153 1155 2 ga_13 1154 1153 1155 2 ga_13 1153 1155 1156 2 ga_30 1153 1155 1157 2 ga_19 1156 1155 1157 2 ga_33 1155 1157 1158 2 ga_32 1155 1157 1159 2 ga_31 1158 1157 1159 2 ga_18 1157 1159 1160 2 ga_13 1157 1159 1164 2 ga_13 1160 1159 1164 2 ga_13 1159 1160 1161 2 ga_15 1160 1161 1162 2 ga_15 1160 1161 1163 2 ga_15 1162 1161 1163 2 ga_15 1159 1164 1165 2 ga_30 1159 1164 1166 2 ga_19 1165 1164 1166 2 ga_33 1164 1166 1167 2 ga_32 1164 1166 1168 2 ga_31 1167 1166 1168 2 ga_18 1166 1168 1169 2 ga_13 1166 1168 1173 2 ga_13 1169 1168 1173 2 ga_13 1168 1169 1170 2 ga_15 1169 1170 1171 2 ga_16 1170 1171 1172 2 ga_4 1168 1173 1174 2 ga_30 1168 1173 1175 2 ga_19 1174 1173 1175 2 ga_33 1173 1175 1176 2 ga_32 1173 1175 1177 2 ga_31 1176 1175 1177 2 ga_18 1175 1177 1178 2 ga_13 1175 1177 1186 2 ga_13 1178 1177 1186 2 ga_13 1177 1178 1179 2 ga_15 1178 1179 1180 2 ga_15 1179 1180 1181 2 ga_15 1180 1181 1182 2 ga_15 1181 1182 1183 2 ga_11 1181 1182 1184 2 ga_11 1181 1182 1185 2 ga_11 1183 1182 1184 2 ga_10 1183 1182 1185 2 ga_10 1184 1182 1185 2 ga_10 1177 1186 1187 2 ga_30 1177 1186 1188 2 ga_19 1187 1186 1188 2 ga_33 1186 1188 1189 2 ga_32 1186 1188 1190 2 ga_31 1189 1188 1190 2 ga_18 1188 1190 1191 2 ga_13 1190 1191 1192 2 ga_30 1190 1191 1193 2 ga_19 1192 1191 1193 2 ga_33 1191 1193 1194 2 ga_32 1191 1193 1195 2 ga_31 1194 1193 1195 2 ga_18 1193 1195 1196 2 ga_13 1193 1195 1200 2 ga_13 1196 1195 1200 2 ga_13 1195 1196 1197 2 ga_13 1195 1196 1199 2 ga_15 1197 1196 1199 2 ga_15 1196 1197 1198 2 ga_12 1195 1200 1201 2 ga_30 1195 1200 1202 2 ga_19 1201 1200 1202 2 ga_33 1200 1202 1203 2 ga_32 1200 1202 1204 2 ga_31 1203 1202 1204 2 ga_18 1202 1204 1205 2 ga_13 1202 1204 1209 2 ga_13 1205 1204 1209 2 ga_13 1204 1205 1206 2 ga_15 1205 1206 1207 2 ga_15 1205 1206 1208 2 ga_15 1207 1206 1208 2 ga_15 1204 1209 1210 2 ga_30 1204 1209 1211 2 ga_19 1210 1209 1211 2 ga_33 1209 1211 1212 2 ga_32 1209 1211 1213 2 ga_31 1212 1211 1213 2 ga_18 1211 1213 1214 2 ga_13 1211 1213 1218 2 ga_13 1214 1213 1218 2 ga_13 1213 1214 1215 2 ga_13 1213 1214 1217 2 ga_15 1215 1214 1217 2 ga_15 1214 1215 1216 2 ga_12 1213 1218 1219 2 ga_30 1213 1218 1220 2 ga_19 1219 1218 1220 2 ga_33 1218 1220 1221 2 ga_32 1218 1220 1222 2 ga_31 1221 1220 1222 2 ga_18 1220 1222 1223 2 ga_13 1220 1222 1227 2 ga_13 1223 1222 1227 2 ga_13 1222 1223 1224 2 ga_15 1223 1224 1225 2 ga_15 1223 1224 1226 2 ga_15 1225 1224 1226 2 ga_15 1222 1227 1228 2 ga_30 1222 1227 1229 2 ga_19 1228 1227 1229 2 ga_33 1227 1229 1230 2 ga_32 1227 1229 1231 2 ga_31 1230 1229 1231 2 ga_18 1229 1231 1232 2 ga_13 1229 1231 1240 2 ga_13 1232 1231 1240 2 ga_13 1231 1232 1233 2 ga_15 1232 1233 1234 2 ga_15 1233 1234 1235 2 ga_15 1234 1235 1236 2 ga_15 1235 1236 1237 2 ga_11 1235 1236 1238 2 ga_11 1235 1236 1239 2 ga_11 1237 1236 1238 2 ga_10 1237 1236 1239 2 ga_10 1238 1236 1239 2 ga_10 1231 1240 1241 2 ga_22 1231 1240 1242 2 ga_22 1241 1240 1242 2 ga_38 [ dihedrals ] 784 787 791 1244 1 180 5.90 1 785 789 791 1244 1 180 5.90 1 788 787 791 1244 1 180 22.0 2 790 789 791 1244 1 180 22.0 2 1244 1245 1246 1247 1 180 5.90 1 1244 1245 1246 1256 1 0 5.06 -2 1244 1245 1253 1251 1 180 5.90 1 1244 1245 1253 1254 1 180 22.0 2 1244 1255 1256 1246 1 0 5.06 -2 1244 1255 1256 1257 1 180 5.90 1 1244 1255 1263 1261 1 180 5.90 1 1244 1255 1263 1264 1 180 22.0 2 1244 1265 1266 1267 1 180 5.90 1 1244 1265 1266 1276 1 0 5.06 -2 1244 1265 1273 1271 1 180 5.90 1 1244 1265 1273 1274 1 180 22.0 2 1244 1275 1276 1266 1 0 5.06 -2 1244 1275 1276 1277 1 180 5.90 1 1244 1275 1283 1281 1 180 5.90 1 1244 1275 1283 1284 1 180 22.0 2 1244 1289 1290 1287 1 180 5.90 1 1244 1289 1290 1291 1 180 22.0 2 1244 1289 1292 1285 1 180 5.90 1 1244 1289 1292 1293 1 180 22.0 2 1245 1244 1255 1256 1 180 1.05 4 1245 1244 1255 1263 1 180 1.05 4 1246 1245 1244 1255 1 180 1.05 4 1253 1245 1244 1255 1 180 1.05 4 1265 1244 1275 1276 1 180 1.05 4 1265 1244 1275 1283 1 180 1.05 4 1266 1265 1244 1275 1 180 1.05 4 1273 1265 1244 1275 1 180 1.05 4 1253 1251 1249 1247 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C1- C2- C3- 1253 1251 1249 1250 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C1- C2- C3- 1253 1245 1246 1247 3 40.16640 0.00000 -40.16640 0.00000 0.00000 0.00000 ; C1- N1- C5- 1253 1245 1246 1256 3 40.16640 0.00000 -40.16640 0.00000 0.00000 0.00000 ; C1- N1- C5- 1251 1253 1245 1246 3 40.16640 0.00000 -40.16640 0.00000 0.00000 0.00000 ; C2- C1- N1- 1251 1249 1247 1246 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C2- C3- C4- 1251 1249 1247 1248 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C2- C3- C4- 1249 1247 1246 1256 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C3- C4- C5- 1249 1247 1246 1245 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C3- C4- C5- 1247 1249 1251 1252 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C4- C3- C2- 1247 1246 1256 1257 3 8.36800 0.00000 -8.36800 0.00000 0.00000 0.00000 ; C4- C5- C6- 1247 1246 1256 1255 3 8.36800 0.00000 -8.36800 0.00000 0.00000 0.00000 ; C4- C5- C6- 1246 1247 1249 1250 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C5- C4- C3- 1246 1256 1257 1259 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C5- C6- C7- 1246 1256 1257 1258 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C5- C6- C7- 1246 1256 1255 1263 3 40.16640 0.00000 -40.16640 0.00000 0.00000 0.00000 ; C5- C6- N2- 1254 1253 1251 1249 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H1- C1- C2- 1254 1253 1251 1252 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H1- C1- C2- 1254 1253 1245 1246 3 40.16640 0.00000 -40.16640 0.00000 0.00000 0.00000 ; H1- C1- N1- 1252 1251 1249 1250 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H2- C2- C3- 1250 1249 1247 1248 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H3- C3- C4- 1248 1247 1246 1256 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H4- C4- C5- 1248 1247 1246 1245 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H4- C4- C5- 1256 1257 1259 1261 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C6- C7- C8- C 1256 1257 1259 1260 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C6- C7- C8- 1256 1255 1263 1261 3 40.16640 0.00000 -40.16640 0.00000 0.00000 0.00000 ; C6- N2- C9- C 1256 1255 1263 1264 3 40.16640 0.00000 -40.16640 0.00000 0.00000 0.00000 ; C6- N2- C9- 1257 1256 1246 1245 3 8.36800 0.00000 -8.36800 0.00000 0.00000 0.00000 ; C7- C6- C5- 1257 1256 1255 1263 3 40.16640 0.00000 -40.16640 0.00000 0.00000 0.00000 ; C7- C6- N2- 1257 1259 1261 1263 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C7- C8- C10- 1257 1259 1261 1262 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C7- C8- C10- 1259 1257 1256 1255 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C8- C7- C6- 1259 1261 1263 1264 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C8- C10- C9- 1259 1261 1263 1255 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C8- C10- C9- 1258 1257 1256 1255 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H5- C7- C6- 1258 1257 1259 1261 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H5- C7- C8- C 1258 1257 1259 1260 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H5- C7- C8- 1263 1261 1259 1260 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C9- C10- C8- 1260 1259 1261 1262 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H6- C8- C10- 1264 1263 1261 1262 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H7- C9- C10- 1262 1261 1263 1255 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H8- C10- C9- 1245 1253 1251 1249 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; N1- C1- C2- 1245 1253 1251 1252 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; N1- C1- C2- 1245 1246 1256 1255 3 8.36800 0.00000 -8.36800 0.00000 0.00000 0.00000 ; N1- C5- C6- 1273 1271 1269 1267 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C1- C2- C3- 1273 1271 1269 1270 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C1- C2- C3- 1273 1265 1266 1267 3 40.16640 0.00000 -40.16640 0.00000 0.00000 0.00000 ; C1- N1- C5- 1273 1265 1266 1276 3 40.16640 0.00000 -40.16640 0.00000 0.00000 0.00000 ; C1- N1- C5- 1271 1273 1265 1266 3 40.16640 0.00000 -40.16640 0.00000 0.00000 0.00000 ; C2- C1- N1- 1271 1269 1267 1266 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C2- C3- C4- 1271 1269 1267 1268 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C2- C3- C4- 1269 1267 1266 1276 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C3- C4- C5- 1269 1267 1266 1265 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C3- C4- C5- 1267 1269 1271 1272 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C4- C3- C2- 1267 1266 1276 1277 3 8.36800 0.00000 -8.36800 0.00000 0.00000 0.00000 ; C4- C5- C6- 1267 1266 1276 1275 3 8.36800 0.00000 -8.36800 0.00000 0.00000 0.00000 ; C4- C5- C6- 1266 1267 1269 1270 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C5- C4- C3- 1266 1276 1277 1279 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C5- C6- C7- 1266 1276 1277 1278 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C5- C6- C7- 1266 1276 1275 1283 3 40.16640 0.00000 -40.16640 0.00000 0.00000 0.00000 ; C5- C6- N2- 1274 1273 1271 1269 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H1- C1- C2- 1274 1273 1271 1272 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H1- C1- C2- 1274 1273 1265 1266 3 40.16640 0.00000 -40.16640 0.00000 0.00000 0.00000 ; H1- C1- N1- 1272 1271 1269 1270 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H2- C2- C3- 1270 1269 1267 1268 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H3- C3- C4- 1268 1267 1266 1276 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H4- C4- C5- 1268 1267 1266 1265 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H4- C4- C5- 1276 1277 1279 1281 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C6- C7- C8- C 1276 1277 1279 1280 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C6- C7- C8- 1276 1275 1283 1281 3 40.16640 0.00000 -40.16640 0.00000 0.00000 0.00000 ; C6- N2- C9- C 1276 1275 1283 1284 3 40.16640 0.00000 -40.16640 0.00000 0.00000 0.00000 ; C6- N2- C9- 1277 1276 1266 1265 3 8.36800 0.00000 -8.36800 0.00000 0.00000 0.00000 ; C7- C6- C5- 1277 1276 1275 1283 3 40.16640 0.00000 -40.16640 0.00000 0.00000 0.00000 ; C7- C6- N2- 1277 1279 1281 1283 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C7- C8- C10- 1277 1279 1281 1282 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C7- C8- C10- 1279 1277 1276 1275 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C8- C7- C6- 1279 1281 1283 1284 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C8- C10- C9- 1279 1281 1283 1275 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C8- C10- C9- 1278 1277 1276 1275 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H5- C7- C6- 1278 1277 1279 1281 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H5- C7- C8- C 1278 1277 1279 1280 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H5- C7- C8- 1283 1281 1279 1280 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; C9- C10- C8- 1280 1279 1281 1282 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H6- C8- C10- 1284 1283 1281 1282 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H7- C9- C10- 1282 1281 1283 1275 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; H8- C10- C9- 1265 1273 1271 1269 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; N1- C1- C2- 1265 1273 1271 1272 3 30.33400 0.00000 -30.33400 0.00000 0.00000 0.00000 ; N1- C1- C2- 1265 1266 1276 1275 3 8.36800 0.00000 -8.36800 0.00000 0.00000 0.00000 ; N1- C5- C6- 1287 1290 1289 1292 3 39.74800 0.00000 -39.74800 0.00000 0.00000 0.00000 ; C1- C2- N2- 1287 1285 1292 1293 3 14.22560 0.00000 -14.22560 0.00000 0.00000 0.00000 ; C1- N1- C3- 1287 1285 1292 1289 3 14.22560 0.00000 -14.22560 0.00000 0.00000 0.00000 ; C1- N1- C3- 1290 1287 1285 1292 3 14.22560 0.00000 -14.22560 0.00000 0.00000 0.00000 ; C2- C1- N1- 1290 1287 1285 1286 3 14.22560 0.00000 -14.22560 0.00000 0.00000 0.00000 ; C2- C1- N1- 1290 1289 1292 1285 3 39.74800 0.00000 -39.74800 0.00000 0.00000 0.00000 ; C2- N2- C3- 1290 1289 1292 1293 3 39.74800 0.00000 -39.74800 0.00000 0.00000 0.00000 ; C2- N2- C3- 1292 1289 1290 1291 3 39.74800 0.00000 -39.74800 0.00000 0.00000 0.00000 ; C3- N2- C2- 1285 1287 1290 1291 3 33.47200 0.00000 -33.47200 0.00000 0.00000 0.00000 ; N1- C1- C2- 1285 1287 1290 1289 3 33.47200 0.00000 -33.47200 0.00000 0.00000 0.00000 ; N1- C1- C2- 1286 1285 1292 1293 3 14.22560 0.00000 -14.22560 0.00000 0.00000 0.00000 ; H1- N1- C3- 1286 1285 1292 1289 3 14.22560 0.00000 -14.22560 0.00000 0.00000 0.00000 ; H1- N1- C3- 1288 1287 1290 1291 3 33.47200 0.00000 -33.47200 0.00000 0.00000 0.00000 ; H2- C1- C2- 1288 1287 1290 1289 3 33.47200 0.00000 -33.47200 0.00000 0.00000 0.00000 ; H2- C1- C2- 1288 1287 1285 1292 3 14.22560 0.00000 -14.22560 0.00000 0.00000 0.00000 ; H2- C1- N1- 1288 1287 1285 1286 3 14.22560 0.00000 -14.22560 0.00000 0.00000 0.00000 ; H2- C1- N1- 1243 1088 1087 1086 9 0.00 1.0042 1 1243 1088 1087 1086 9 0.00 0.6276 2 1243 1088 1087 1086 9 0.00 1.1297 3 1243 438 437 439 9 180.00 4.1840 2 1243 438 441 442 9 180.00 4.1840 2 1243 438 441 443 9 180.00 4.1840 2 1243 1134 1133 1135 9 180.00 4.1840 2 1243 1134 1137 1138 9 180.00 4.1840 2 1243 1134 1137 1139 9 180.00 4.1840 2 2 1 5 7 1 gd_29 1 5 7 9 1 gd_40 5 7 9 11 1 gd_14 7 9 11 17 1 gd_39 9 11 12 13 1 gd_34 9 11 17 19 1 gd_40 11 12 13 14 1 gd_34 12 13 14 16 1 gd_40 11 17 19 21 1 gd_14 17 19 21 24 1 gd_39 19 21 22 23 1 gd_34 19 21 24 26 1 gd_40 21 22 23 244 1 gd_26 22 23 244 243 1 gd_21 21 24 26 28 1 gd_14 24 26 28 32 1 gd_39 26 28 29 30 1 gd_34 26 28 32 34 1 gd_40 28 29 30 31 1 gd_23 28 32 34 36 1 gd_14 32 34 36 40 1 gd_39 34 36 37 38 1 gd_34 34 36 40 42 1 gd_40 36 40 42 44 1 gd_14 40 42 44 49 1 gd_39 42 44 45 46 1 gd_34 42 44 49 51 1 gd_40 44 45 46 47 1 gd_40 44 49 51 53 1 gd_14 49 51 53 58 1 gd_39 51 53 54 55 1 gd_34 51 53 58 60 1 gd_40 53 54 55 57 1 gd_34 53 58 60 62 1 gd_14 58 60 62 70 1 gd_39 60 62 63 64 1 gd_34 60 62 70 72 1 gd_40 62 63 64 65 1 gd_34 63 64 65 67 1 gd_40 64 65 67 68 1 gd_14 62 70 72 74 1 gd_14 70 72 74 75 1 gd_39 72 74 75 77 1 gd_40 74 75 77 79 1 gd_14 75 77 79 86 1 gd_39 77 79 80 81 1 gd_34 77 79 86 88 1 gd_40 79 80 81 83 1 gd_40 80 81 83 84 1 gd_14 79 86 88 90 1 gd_14 86 88 90 95 1 gd_39 88 90 91 92 1 gd_34 88 90 95 97 1 gd_40 90 91 92 93 1 gd_40 90 95 97 99 1 gd_14 95 97 99 107 1 gd_39 97 99 100 101 1 gd_34 97 99 107 109 1 gd_40 99 100 101 102 1 gd_34 100 101 102 104 1 gd_40 101 102 104 105 1 gd_14 99 107 109 111 1 gd_14 107 109 111 116 1 gd_39 109 111 112 113 1 gd_34 109 111 116 118 1 gd_40 111 112 113 114 1 gd_34 112 113 114 115 1 gd_26 111 116 118 120 1 gd_14 116 118 120 128 1 gd_39 118 120 121 122 1 gd_34 118 120 128 130 1 gd_40 120 121 122 123 1 gd_34 121 122 123 125 1 gd_40 122 123 125 126 1 gd_14 120 128 130 132 1 gd_14 128 130 132 145 1 gd_39 130 132 133 134 1 gd_34 130 132 145 147 1 gd_40 132 133 134 135 1 gd_40 132 145 147 149 1 gd_14 145 147 149 156 1 gd_39 147 149 150 151 1 gd_34 147 149 156 158 1 gd_40 149 150 151 153 1 gd_40 150 151 153 154 1 gd_14 149 156 158 160 1 gd_14 156 158 160 165 1 gd_39 158 160 161 162 1 gd_34 158 160 165 167 1 gd_40 160 161 162 163 1 gd_23 160 165 167 169 1 gd_14 165 167 169 176 1 gd_39 167 169 170 171 1 gd_34 167 169 176 178 1 gd_40 169 170 171 173 1 gd_40 170 171 173 174 1 gd_14 169 176 178 180 1 gd_14 176 178 180 182 1 gd_39 178 180 182 184 1 gd_40 180 182 184 186 1 gd_14 182 184 186 191 1 gd_39 184 186 187 188 1 gd_34 184 186 191 193 1 gd_40 186 187 188 190 1 gd_34 186 191 193 195 1 gd_14 191 193 195 200 1 gd_39 193 195 196 197 1 gd_34 193 195 200 202 1 gd_40 195 196 197 198 1 gd_23 195 200 202 204 1 gd_14 200 202 204 208 1 gd_39 202 204 205 206 1 gd_34 202 204 208 210 1 gd_40 204 208 210 212 1 gd_14 208 210 212 217 1 gd_39 210 212 213 214 1 gd_34 210 212 217 219 1 gd_40 212 213 214 215 1 gd_40 212 217 219 221 1 gd_14 217 219 221 230 1 gd_39 219 221 222 223 1 gd_34 219 221 230 232 1 gd_40 221 222 223 224 1 gd_34 222 223 224 225 1 gd_34 223 224 225 226 1 gd_34 224 225 226 227 1 gd_29 221 230 232 234 1 gd_14 230 232 234 238 1 gd_39 232 234 235 236 1 gd_34 232 234 238 240 1 gd_40 234 235 236 237 1 gd_23 234 238 240 242 1 gd_14 238 240 242 245 1 gd_39 240 242 243 244 1 gd_34 240 242 245 247 1 gd_40 242 243 244 23 1 gd_26 242 245 247 249 1 gd_14 245 247 249 258 1 gd_39 247 249 250 251 1 gd_34 247 249 258 260 1 gd_40 249 250 251 252 1 gd_34 250 251 252 253 1 gd_34 251 252 253 254 1 gd_34 252 253 254 255 1 gd_29 249 258 260 262 1 gd_14 258 260 262 270 1 gd_39 260 262 263 264 1 gd_34 260 262 270 272 1 gd_40 262 263 264 265 1 gd_34 263 264 265 267 1 gd_40 264 265 267 268 1 gd_14 262 270 272 274 1 gd_14 270 272 274 287 1 gd_39 272 274 275 276 1 gd_34 272 274 287 289 1 gd_40 274 275 276 277 1 gd_40 274 287 289 291 1 gd_14 287 289 291 296 1 gd_39 289 291 292 293 1 gd_34 289 291 296 298 1 gd_40 291 292 293 294 1 gd_23 291 296 298 300 1 gd_14 296 298 300 304 1 gd_39 298 300 301 302 1 gd_34 298 300 304 306 1 gd_40 300 304 306 308 1 gd_14 304 306 308 315 1 gd_39 306 308 309 310 1 gd_34 306 308 315 317 1 gd_40 308 309 310 312 1 gd_40 309 310 312 313 1 gd_14 308 315 317 319 1 gd_14 315 317 319 324 1 gd_39 317 319 320 321 1 gd_34 317 319 324 326 1 gd_40 319 320 321 322 1 gd_34 319 324 326 328 1 gd_14 324 326 328 332 1 gd_39 326 328 329 330 1 gd_34 326 328 332 334 1 gd_40 328 329 330 331 1 gd_23 328 332 334 336 1 gd_14 332 334 336 346 1 gd_39 334 336 337 338 1 gd_34 334 336 346 348 1 gd_40 336 337 338 339 1 gd_40 336 346 348 349 1 gd_14 346 348 349 353 1 gd_39 349 348 352 351 1 gd_39 348 349 350 351 1 gd_34 348 349 353 355 1 gd_40 349 350 351 352 1 gd_34 350 351 352 348 1 gd_34 349 353 355 357 1 gd_14 353 355 357 358 1 gd_39 355 357 358 360 1 gd_40 357 358 360 362 1 gd_14 358 360 362 369 1 gd_39 360 362 363 364 1 gd_34 360 362 369 371 1 gd_40 362 363 364 366 1 gd_40 363 364 366 367 1 gd_14 362 369 371 373 1 gd_14 369 371 373 378 1 gd_39 371 373 374 375 1 gd_34 371 373 378 380 1 gd_40 373 374 375 376 1 gd_34 373 378 380 381 1 gd_14 378 380 381 385 1 gd_39 381 380 384 383 1 gd_39 380 381 382 383 1 gd_34 380 381 385 387 1 gd_40 381 382 383 384 1 gd_34 382 383 384 380 1 gd_34 381 385 387 389 1 gd_14 385 387 389 398 1 gd_39 387 389 390 391 1 gd_34 387 389 398 400 1 gd_40 389 390 391 392 1 gd_34 390 391 392 393 1 gd_34 391 392 393 394 1 gd_34 392 393 394 395 1 gd_29 389 398 400 402 1 gd_14 398 400 402 409 1 gd_39 400 402 403 404 1 gd_34 400 402 409 411 1 gd_40 402 403 404 406 1 gd_40 403 404 406 407 1 gd_14 402 409 411 413 1 gd_14 409 411 413 417 1 gd_39 411 413 414 415 1 gd_34 411 413 417 419 1 gd_40 413 417 419 421 1 gd_14 417 419 421 426 1 gd_39 419 421 422 423 1 gd_34 419 421 426 428 1 gd_40 421 422 423 424 1 gd_34 422 423 424 425 1 gd_26 421 426 428 430 1 gd_14 426 428 430 431 1 gd_39 428 430 431 433 1 gd_40 430 431 433 435 1 gd_14 431 433 435 445 1 gd_39 433 435 436 437 1 gd_34 433 435 445 447 1 gd_40 435 436 437 438 1 gd_40 435 445 447 449 1 gd_14 445 447 449 456 1 gd_39 447 449 450 451 1 gd_34 447 449 456 458 1 gd_40 449 450 451 453 1 gd_40 450 451 453 454 1 gd_14 449 456 458 460 1 gd_14 456 458 460 477 1 gd_39 458 460 461 462 1 gd_34 458 460 477 479 1 gd_40 460 461 462 465 1 gd_40 460 477 479 481 1 gd_14 477 479 481 485 1 gd_39 479 481 482 483 1 gd_34 479 481 485 487 1 gd_40 481 485 487 489 1 gd_14 485 487 489 494 1 gd_39 487 489 490 491 1 gd_34 487 489 494 496 1 gd_40 489 490 491 492 1 gd_34 489 494 496 498 1 gd_14 494 496 498 502 1 gd_39 496 498 499 500 1 gd_34 496 498 502 504 1 gd_40 498 499 500 501 1 gd_23 498 502 504 506 1 gd_14 502 504 506 511 1 gd_39 504 506 507 508 1 gd_34 504 506 511 513 1 gd_40 506 507 508 509 1 gd_23 506 511 513 515 1 gd_14 511 513 515 517 1 gd_39 513 515 517 519 1 gd_40 515 517 519 521 1 gd_14 517 519 521 523 1 gd_39 519 521 523 525 1 gd_40 521 523 525 527 1 gd_14 523 525 527 532 1 gd_39 525 527 528 529 1 gd_34 525 527 532 534 1 gd_40 527 528 529 530 1 gd_40 527 532 534 536 1 gd_14 532 534 536 541 1 gd_39 534 536 537 538 1 gd_34 534 536 541 543 1 gd_40 536 537 538 539 1 gd_34 537 538 539 540 1 gd_26 536 541 543 545 1 gd_14 541 543 545 553 1 gd_39 543 545 546 547 1 gd_34 543 545 553 555 1 gd_40 545 546 547 548 1 gd_34 546 547 548 550 1 gd_40 547 548 550 551 1 gd_14 545 553 555 557 1 gd_14 553 555 557 558 1 gd_39 555 557 558 560 1 gd_40 557 558 560 562 1 gd_14 558 560 562 566 1 gd_39 560 562 563 564 1 gd_34 560 562 566 568 1 gd_40 562 566 568 570 1 gd_14 566 568 570 574 1 gd_39 568 570 571 572 1 gd_34 568 570 574 576 1 gd_40 570 574 576 578 1 gd_14 574 576 578 583 1 gd_39 576 578 579 580 1 gd_34 576 578 583 585 1 gd_40 578 579 580 581 1 gd_23 578 583 585 587 1 gd_14 583 585 587 592 1 gd_39 585 587 588 589 1 gd_34 585 587 592 594 1 gd_40 587 588 589 590 1 gd_40 587 592 594 596 1 gd_14 592 594 596 597 1 gd_39 594 596 597 599 1 gd_40 596 597 599 601 1 gd_14 597 599 601 606 1 gd_39 599 601 602 603 1 gd_34 599 601 606 608 1 gd_40 601 602 603 604 1 gd_34 602 603 604 605 1 gd_26 601 606 608 610 1 gd_14 606 608 610 612 1 gd_39 608 610 612 614 1 gd_40 610 612 614 616 1 gd_14 612 614 616 620 1 gd_39 614 616 617 618 1 gd_34 614 616 620 622 1 gd_40 616 617 618 619 1 gd_23 616 620 622 624 1 gd_14 620 622 624 625 1 gd_39 622 624 625 627 1 gd_40 624 625 627 629 1 gd_14 625 627 629 634 1 gd_39 627 629 630 631 1 gd_34 627 629 634 636 1 gd_40 629 630 631 632 1 gd_34 629 634 636 638 1 gd_14 634 636 638 643 1 gd_39 636 638 639 640 1 gd_34 636 638 643 645 1 gd_40 638 639 640 641 1 gd_40 638 643 645 647 1 gd_14 643 645 647 656 1 gd_39 645 647 648 649 1 gd_34 645 647 656 658 1 gd_40 647 648 649 650 1 gd_34 648 649 650 651 1 gd_34 649 650 651 652 1 gd_34 650 651 652 653 1 gd_29 647 656 658 660 1 gd_14 656 658 660 665 1 gd_39 658 660 661 662 1 gd_34 658 660 665 667 1 gd_40 660 661 662 663 1 gd_40 660 665 667 669 1 gd_14 665 667 669 683 1 gd_39 667 669 670 671 1 gd_34 667 669 683 685 1 gd_40 669 670 671 672 1 gd_40 676 680 681 682 1 gd_11 669 683 685 687 1 gd_14 683 685 687 692 1 gd_39 685 687 688 689 1 gd_34 685 687 692 694 1 gd_40 687 688 689 690 1 gd_34 687 692 694 696 1 gd_14 692 694 696 705 1 gd_39 694 696 697 698 1 gd_34 694 696 705 707 1 gd_40 696 697 698 699 1 gd_34 697 698 699 700 1 gd_34 698 699 700 701 1 gd_34 699 700 701 702 1 gd_29 696 705 707 708 1 gd_14 705 707 708 712 1 gd_39 708 707 711 710 1 gd_39 707 708 709 710 1 gd_34 707 708 712 714 1 gd_40 708 709 710 711 1 gd_34 709 710 711 707 1 gd_34 708 712 714 716 1 gd_14 712 714 716 721 1 gd_39 714 716 717 718 1 gd_34 714 716 721 723 1 gd_40 716 717 718 719 1 gd_40 716 721 723 725 1 gd_14 721 723 725 730 1 gd_39 723 725 726 727 1 gd_34 723 725 730 732 1 gd_40 725 726 727 728 1 gd_40 725 730 732 734 1 gd_14 730 732 734 738 1 gd_39 732 734 735 736 1 gd_34 732 734 738 740 1 gd_40 734 735 736 737 1 gd_23 734 738 740 742 1 gd_14 738 740 742 755 1 gd_39 740 742 743 744 1 gd_34 740 742 755 757 1 gd_40 742 743 744 745 1 gd_34 743 744 745 746 1 gd_34 744 745 746 748 1 gd_39 745 746 748 749 1 gd_14 746 748 749 750 1 gd_14 746 748 752 753 1 gd_14 742 755 757 759 1 gd_14 755 757 759 763 1 gd_39 757 759 760 761 1 gd_34 757 759 763 765 1 gd_40 759 763 765 767 1 gd_14 763 765 767 772 1 gd_39 765 767 768 769 1 gd_34 765 767 772 774 1 gd_40 767 768 769 771 1 gd_34 767 772 774 776 1 gd_14 772 774 776 778 1 gd_39 774 776 778 780 1 gd_40 776 778 780 782 1 gd_14 778 780 782 792 1 gd_39 780 782 783 784 1 gd_34 780 782 792 794 1 gd_40 782 783 784 785 1 gd_40 782 792 794 796 1 gd_14 792 794 796 801 1 gd_39 794 796 797 798 1 gd_34 794 796 801 803 1 gd_40 796 797 798 799 1 gd_23 796 801 803 805 1 gd_14 801 803 805 814 1 gd_39 803 805 806 807 1 gd_34 803 805 814 816 1 gd_40 805 806 807 808 1 gd_34 806 807 808 809 1 gd_34 807 808 809 810 1 gd_34 808 809 810 811 1 gd_29 805 814 816 818 1 gd_14 814 816 818 823 1 gd_39 816 818 819 820 1 gd_34 816 818 823 825 1 gd_40 818 819 820 821 1 gd_34 818 823 825 827 1 gd_14 823 825 827 832 1 gd_39 825 827 828 829 1 gd_34 825 827 832 834 1 gd_40 827 828 829 831 1 gd_34 827 832 834 836 1 gd_14 832 834 836 837 1 gd_39 834 836 837 839 1 gd_40 836 837 839 841 1 gd_14 837 839 841 845 1 gd_39 839 841 842 843 1 gd_34 839 841 845 847 1 gd_40 841 842 843 844 1 gd_23 841 845 847 849 1 gd_14 845 847 849 850 1 gd_39 847 849 850 852 1 gd_40 849 850 852 854 1 gd_14 850 852 854 860 1 gd_39 852 854 855 856 1 gd_34 852 854 860 862 1 gd_40 854 855 856 857 1 gd_34 855 856 857 859 1 gd_40 854 860 862 864 1 gd_14 860 862 864 873 1 gd_39 862 864 865 866 1 gd_34 862 864 873 875 1 gd_40 864 865 866 867 1 gd_34 865 866 867 868 1 gd_34 866 867 868 869 1 gd_34 867 868 869 870 1 gd_29 864 873 875 877 1 gd_14 873 875 877 882 1 gd_39 875 877 878 879 1 gd_34 875 877 882 884 1 gd_40 877 878 879 880 1 gd_40 877 882 884 886 1 gd_14 882 884 886 890 1 gd_39 884 886 887 888 1 gd_34 884 886 890 892 1 gd_40 886 887 888 889 1 gd_23 886 890 892 894 1 gd_14 890 892 894 898 1 gd_39 892 894 895 896 1 gd_34 892 894 898 900 1 gd_40 894 898 900 902 1 gd_14 898 900 902 907 1 gd_39 900 902 903 904 1 gd_34 900 902 907 909 1 gd_40 902 903 904 905 1 gd_23 902 907 909 911 1 gd_14 907 909 911 924 1 gd_39 909 911 912 913 1 gd_34 909 911 924 926 1 gd_40 911 912 913 914 1 gd_40 911 924 926 928 1 gd_14 924 926 928 933 1 gd_39 926 928 929 930 1 gd_34 926 928 933 935 1 gd_40 928 929 930 931 1 gd_40 928 933 935 937 1 gd_14 933 935 937 941 1 gd_39 935 937 938 939 1 gd_34 935 937 941 943 1 gd_40 937 941 943 945 1 gd_14 941 943 945 949 1 gd_39 943 945 946 947 1 gd_34 943 945 949 951 1 gd_40 945 946 947 948 1 gd_23 945 949 951 953 1 gd_14 949 951 953 962 1 gd_39 951 953 954 955 1 gd_34 951 953 962 964 1 gd_40 953 954 955 956 1 gd_34 954 955 956 957 1 gd_34 955 956 957 958 1 gd_34 956 957 958 959 1 gd_29 953 962 964 966 1 gd_14 962 964 966 971 1 gd_39 964 966 967 968 1 gd_34 964 966 971 973 1 gd_40 966 967 968 969 1 gd_34 966 971 973 975 1 gd_14 971 973 975 984 1 gd_39 973 975 976 977 1 gd_34 973 975 984 986 1 gd_40 975 976 977 978 1 gd_34 976 977 978 979 1 gd_34 977 978 979 980 1 gd_34 978 979 980 981 1 gd_29 975 984 986 988 1 gd_14 984 986 988 994 1 gd_39 986 988 989 990 1 gd_34 986 988 994 996 1 gd_40 988 989 990 991 1 gd_34 989 990 991 993 1 gd_40 988 994 996 998 1 gd_14 994 996 998 999 1 gd_39 996 998 999 1001 1 gd_40 998 999 1001 1003 1 gd_14 999 1001 1003 1009 1 gd_39 1001 1003 1004 1005 1 gd_34 1001 1003 1009 1011 1 gd_40 1003 1004 1005 1006 1 gd_34 1004 1005 1006 1008 1 gd_40 1003 1009 1011 1013 1 gd_14 1009 1011 1013 1021 1 gd_39 1011 1013 1014 1015 1 gd_34 1011 1013 1021 1023 1 gd_40 1013 1014 1015 1016 1 gd_34 1014 1015 1016 1018 1 gd_40 1015 1016 1018 1019 1 gd_14 1013 1021 1023 1025 1 gd_14 1021 1023 1025 1039 1 gd_39 1023 1025 1026 1027 1 gd_34 1023 1025 1039 1041 1 gd_40 1025 1026 1027 1028 1 gd_40 1032 1036 1037 1038 1 gd_11 1025 1039 1041 1043 1 gd_14 1039 1041 1043 1048 1 gd_39 1041 1043 1044 1045 1 gd_34 1041 1043 1048 1050 1 gd_40 1043 1044 1045 1046 1 gd_34 1044 1045 1046 1047 1 gd_26 1043 1048 1050 1052 1 gd_14 1048 1050 1052 1065 1 gd_39 1050 1052 1053 1054 1 gd_34 1050 1052 1065 1067 1 gd_40 1052 1053 1054 1055 1 gd_40 1052 1065 1067 1069 1 gd_14 1065 1067 1069 1082 1 gd_39 1067 1069 1070 1071 1 gd_34 1067 1069 1082 1084 1 gd_40 1069 1070 1071 1072 1 gd_40 1069 1082 1084 1086 1 gd_14 1082 1084 1086 1089 1 gd_39 1084 1086 1087 1088 1 gd_34 1084 1086 1089 1091 1 gd_40 1086 1089 1091 1093 1 gd_14 1089 1091 1093 1098 1 gd_39 1091 1093 1094 1095 1 gd_34 1091 1093 1098 1100 1 gd_40 1093 1094 1095 1096 1 gd_23 1093 1098 1100 1102 1 gd_14 1098 1100 1102 1115 1 gd_39 1100 1102 1103 1104 1 gd_34 1100 1102 1115 1117 1 gd_40 1102 1103 1104 1105 1 gd_40 1102 1115 1117 1118 1 gd_14 1115 1117 1118 1122 1 gd_39 1118 1117 1121 1120 1 gd_39 1117 1118 1119 1120 1 gd_34 1117 1118 1122 1124 1 gd_40 1118 1119 1120 1121 1 gd_34 1119 1120 1121 1117 1 gd_34 1118 1122 1124 1126 1 gd_14 1122 1124 1126 1127 1 gd_39 1124 1126 1127 1129 1 gd_40 1126 1127 1129 1131 1 gd_14 1127 1129 1131 1141 1 gd_39 1129 1131 1132 1133 1 gd_34 1129 1131 1141 1143 1 gd_40 1131 1132 1133 1134 1 gd_40 1131 1141 1143 1145 1 gd_14 1141 1143 1145 1149 1 gd_39 1143 1145 1146 1147 1 gd_34 1143 1145 1149 1151 1 gd_40 1145 1146 1147 1148 1 gd_23 1145 1149 1151 1153 1 gd_14 1149 1151 1153 1155 1 gd_39 1151 1153 1155 1157 1 gd_40 1153 1155 1157 1159 1 gd_14 1155 1157 1159 1164 1 gd_39 1157 1159 1160 1161 1 gd_34 1157 1159 1164 1166 1 gd_40 1159 1160 1161 1162 1 gd_34 1159 1164 1166 1168 1 gd_14 1164 1166 1168 1173 1 gd_39 1166 1168 1169 1170 1 gd_34 1166 1168 1173 1175 1 gd_40 1168 1169 1170 1171 1 gd_34 1169 1170 1171 1172 1 gd_26 1168 1173 1175 1177 1 gd_14 1173 1175 1177 1186 1 gd_39 1175 1177 1178 1179 1 gd_34 1175 1177 1186 1188 1 gd_40 1177 1178 1179 1180 1 gd_34 1178 1179 1180 1181 1 gd_34 1179 1180 1181 1182 1 gd_34 1180 1181 1182 1183 1 gd_29 1177 1186 1188 1190 1 gd_14 1186 1188 1190 1191 1 gd_39 1188 1190 1191 1193 1 gd_40 1190 1191 1193 1195 1 gd_14 1191 1193 1195 1200 1 gd_39 1193 1195 1196 1197 1 gd_34 1193 1195 1200 1202 1 gd_40 1195 1196 1197 1198 1 gd_23 1195 1200 1202 1204 1 gd_14 1200 1202 1204 1209 1 gd_39 1202 1204 1205 1206 1 gd_34 1202 1204 1209 1211 1 gd_40 1204 1205 1206 1207 1 gd_34 1204 1209 1211 1213 1 gd_14 1209 1211 1213 1218 1 gd_39 1211 1213 1214 1215 1 gd_34 1211 1213 1218 1220 1 gd_40 1213 1214 1215 1216 1 gd_23 1213 1218 1220 1222 1 gd_14 1218 1220 1222 1227 1 gd_39 1220 1222 1223 1224 1 gd_34 1220 1222 1227 1229 1 gd_40 1222 1223 1224 1225 1 gd_34 1222 1227 1229 1231 1 gd_14 1227 1229 1231 1240 1 gd_39 1229 1231 1232 1233 1 gd_34 1229 1231 1240 1242 1 gd_40 1231 1232 1233 1234 1 gd_34 1232 1233 1234 1235 1 gd_34 1233 1234 1235 1236 1 gd_34 1234 1235 1236 1237 1 gd_29 [ dihedrals ] 438 437 441 1243 2 0.00 3.7656 1134 1133 1137 1243 2 0.00 3.7656 1243 1088 438 1134 2 0.00 29.2880 1243 438 1088 1134 2 0.00 29.2880 1243 438 1134 1088 2 0.00 29.2880 784 785 789 791 2 gi_1 784 787 791 789 2 gi_1 785 784 787 791 2 gi_1 785 784 789 786 2 gi_1 785 789 791 787 2 gi_1 787 784 785 789 2 gi_1 787 784 791 788 2 gi_1 789 785 791 790 2 gi_1 1253 1249 1251 1252 1 180.00 4.60240 2 ; C1- C3- C2- H2 1251 1247 1249 1250 1 180.00 4.60240 2 ; C2- C4- C3- H3 1249 1246 1247 1248 1 180.00 4.60240 2 ; C3- C5- C4- H4 1247 1256 1246 1245 1 180.00 4.60240 2 ; C4- C6- C5- N1 1257 1246 1256 1255 1 180.00 4.60240 2 ; C7- C5- C6- N2 1257 1261 1259 1260 1 180.00 4.60240 2 ; C7- C10- C8- H6 1259 1256 1257 1258 1 180.00 4.60240 2 ; C8- C6- C7- H5 1259 1263 1261 1262 1 180.00 4.60240 2 ; C8- C9- C10- H8 1261 1264 1263 1255 1 180.00 4.60240 2 ; C10- H7- C9- N2 1245 1253 1254 1251 1 180.00 4.60240 2 ; N1- C1- H1- C2 1273 1269 1271 1272 1 180.00 4.60240 2 ; C1- C3- C2- H2 1271 1267 1269 1270 1 180.00 4.60240 2 ; C2- C4- C3- H3 1269 1266 1267 1268 1 180.00 4.60240 2 ; C3- C5- C4- H4 1267 1276 1266 1265 1 180.00 4.60240 2 ; C4- C6- C5- N1 1277 1266 1276 1275 1 180.00 4.60240 2 ; C7- C5- C6- N2 1277 1281 1279 1280 1 180.00 4.60240 2 ; C7- C10- C8- H6 1279 1276 1277 1278 1 180.00 4.60240 2 ; C8- C6- C7- H5 1279 1283 1281 1282 1 180.00 4.60240 2 ; C8- C9- C10- H8 1281 1284 1283 1275 1 180.00 4.60240 2 ; C10- H7- C9- N2 1265 1273 1274 1271 1 180.00 4.60240 2 ; N1- C1- H1- C2 1287 1292 1285 1286 1 180.00 4.60240 2 ; C1- C3- N1- H1 1287 1291 1290 1289 1 180.00 4.60240 2 ; C1- H3- C2- N2 1285 1287 1288 1290 1 180.00 4.60240 2 ; N1- C1- H2- C2 1293 1285 1292 1289 1 180.00 4.60240 2 ; H4- N1- C3- N2 5 1 7 6 2 gi_2 7 5 9 8 2 gi_1 9 7 11 10 2 gi_1 11 9 17 12 2 gi_2 13 16 15 14 2 gi_1 17 11 19 18 2 gi_1 19 17 21 20 2 gi_1 21 19 24 22 2 gi_2 24 21 26 25 2 gi_1 26 24 28 27 2 gi_1 28 26 32 29 2 gi_2 32 28 34 33 2 gi_1 34 32 36 35 2 gi_1 36 34 40 37 2 gi_2 36 38 39 37 2 gi_2 40 36 42 41 2 gi_1 42 40 44 43 2 gi_1 44 42 49 45 2 gi_2 45 48 47 46 2 gi_1 49 44 51 50 2 gi_1 51 49 53 52 2 gi_1 53 51 58 54 2 gi_2 53 56 55 54 2 gi_2 58 53 60 59 2 gi_1 60 58 62 61 2 gi_1 62 60 70 63 2 gi_2 64 67 66 65 2 gi_1 65 69 68 67 2 gi_1 70 62 72 71 2 gi_1 72 70 74 73 2 gi_1 75 74 77 76 2 gi_1 77 75 79 78 2 gi_1 79 77 86 80 2 gi_2 80 83 82 81 2 gi_1 81 85 84 83 2 gi_1 86 79 88 87 2 gi_1 88 86 90 89 2 gi_1 90 88 95 91 2 gi_2 91 94 93 92 2 gi_1 95 90 97 96 2 gi_1 97 95 99 98 2 gi_1 99 97 107 100 2 gi_2 101 104 103 102 2 gi_1 102 106 105 104 2 gi_1 107 99 109 108 2 gi_1 109 107 111 110 2 gi_1 111 109 116 112 2 gi_2 116 111 118 117 2 gi_1 118 116 120 119 2 gi_1 120 118 128 121 2 gi_2 122 125 124 123 2 gi_1 123 127 126 125 2 gi_1 128 120 130 129 2 gi_1 130 128 132 131 2 gi_1 132 130 145 133 2 gi_2 133 137 135 134 2 gi_1 134 135 139 143 2 gi_1 134 137 141 143 2 gi_1 135 134 139 136 2 gi_1 135 134 137 141 2 gi_1 135 139 143 141 2 gi_1 137 134 141 138 2 gi_1 137 134 135 139 2 gi_1 137 141 143 139 2 gi_1 139 143 135 140 2 gi_1 141 143 137 142 2 gi_1 143 139 141 144 2 gi_1 145 132 147 146 2 gi_1 147 145 149 148 2 gi_1 149 147 156 150 2 gi_2 150 153 152 151 2 gi_1 151 155 154 153 2 gi_1 156 149 158 157 2 gi_1 158 156 160 159 2 gi_1 160 158 165 161 2 gi_2 160 164 162 161 2 gi_2 165 160 167 166 2 gi_1 167 165 169 168 2 gi_1 169 167 176 170 2 gi_2 170 173 172 171 2 gi_1 171 175 174 173 2 gi_1 176 169 178 177 2 gi_1 178 176 180 179 2 gi_1 180 178 182 181 2 gi_2 182 180 184 183 2 gi_1 184 182 186 185 2 gi_1 186 184 191 187 2 gi_2 186 189 188 187 2 gi_2 191 186 193 192 2 gi_1 193 191 195 194 2 gi_1 195 193 200 196 2 gi_2 195 199 197 196 2 gi_2 200 195 202 201 2 gi_1 202 200 204 203 2 gi_1 204 202 208 205 2 gi_2 204 206 207 205 2 gi_2 208 204 210 209 2 gi_1 210 208 212 211 2 gi_1 212 210 217 213 2 gi_2 213 216 215 214 2 gi_1 217 212 219 218 2 gi_1 219 217 221 220 2 gi_1 221 219 230 222 2 gi_2 230 221 232 231 2 gi_1 232 230 234 233 2 gi_1 234 232 238 235 2 gi_2 238 234 240 239 2 gi_1 240 238 242 241 2 gi_1 242 240 245 243 2 gi_2 245 242 247 246 2 gi_1 247 245 249 248 2 gi_1 249 247 258 250 2 gi_2 258 249 260 259 2 gi_1 260 258 262 261 2 gi_1 262 260 270 263 2 gi_2 264 267 266 265 2 gi_1 265 269 268 267 2 gi_1 270 262 272 271 2 gi_1 272 270 274 273 2 gi_1 274 272 287 275 2 gi_2 275 279 277 276 2 gi_1 276 277 281 285 2 gi_1 276 279 283 285 2 gi_1 277 276 281 278 2 gi_1 277 276 279 283 2 gi_1 277 281 285 283 2 gi_1 279 276 283 280 2 gi_1 279 276 277 281 2 gi_1 279 283 285 281 2 gi_1 281 285 277 282 2 gi_1 283 285 279 284 2 gi_1 285 281 283 286 2 gi_1 287 274 289 288 2 gi_1 289 287 291 290 2 gi_1 291 289 296 292 2 gi_2 291 295 293 292 2 gi_2 296 291 298 297 2 gi_1 298 296 300 299 2 gi_1 300 298 304 301 2 gi_2 300 302 303 301 2 gi_2 304 300 306 305 2 gi_1 306 304 308 307 2 gi_1 308 306 315 309 2 gi_2 309 312 311 310 2 gi_1 310 314 313 312 2 gi_1 315 308 317 316 2 gi_1 317 315 319 318 2 gi_1 319 317 324 320 2 gi_2 320 322 323 321 2 gi_2 324 319 326 325 2 gi_1 326 324 328 327 2 gi_1 328 326 332 329 2 gi_2 332 328 334 333 2 gi_1 334 332 336 335 2 gi_1 336 334 346 337 2 gi_2 337 340 339 338 2 gi_1 338 340 344 342 2 gi_1 338 339 342 344 2 gi_1 339 342 344 340 2 gi_1 339 338 340 344 2 gi_1 340 338 344 341 2 gi_1 340 338 339 342 2 gi_1 342 339 344 343 2 gi_1 344 340 342 345 2 gi_1 346 336 348 347 2 gi_1 348 346 349 352 2 gi_1 349 348 353 350 2 gi_2 353 349 355 354 2 gi_1 355 353 357 356 2 gi_1 358 357 360 359 2 gi_1 360 358 362 361 2 gi_1 362 360 369 363 2 gi_2 363 366 365 364 2 gi_1 364 368 367 366 2 gi_1 369 362 371 370 2 gi_1 371 369 373 372 2 gi_1 373 371 378 374 2 gi_2 374 376 377 375 2 gi_2 378 373 380 379 2 gi_1 380 378 381 384 2 gi_1 381 380 385 382 2 gi_2 385 381 387 386 2 gi_1 387 385 389 388 2 gi_1 389 387 398 390 2 gi_2 398 389 400 399 2 gi_1 400 398 402 401 2 gi_1 402 400 409 403 2 gi_2 403 406 405 404 2 gi_1 404 408 407 406 2 gi_1 409 402 411 410 2 gi_1 411 409 413 412 2 gi_1 413 411 417 414 2 gi_2 413 415 416 414 2 gi_2 417 413 419 418 2 gi_1 419 417 421 420 2 gi_1 421 419 426 422 2 gi_2 426 421 428 427 2 gi_1 428 426 430 429 2 gi_1 431 430 433 432 2 gi_1 433 431 435 434 2 gi_1 435 433 445 436 2 gi_2 436 439 438 437 2 gi_1 437 439 443 441 2 gi_1 437 438 441 443 2 gi_1 438 441 443 439 2 gi_1 438 437 439 443 2 gi_1 439 437 443 440 2 gi_1 439 437 438 441 2 gi_1 441 438 443 442 2 gi_1 443 439 441 444 2 gi_1 445 435 447 446 2 gi_1 447 445 449 448 2 gi_1 449 447 456 450 2 gi_2 450 453 452 451 2 gi_1 451 455 454 453 2 gi_1 456 449 458 457 2 gi_1 458 456 460 459 2 gi_1 460 458 477 461 2 gi_2 461 465 463 462 2 gi_1 462 469 468 465 2 gi_1 462 465 468 466 2 gi_1 462 463 466 468 2 gi_1 463 462 466 464 2 gi_1 463 466 468 465 2 gi_1 463 462 465 468 2 gi_1 465 462 463 466 2 gi_1 465 468 471 475 2 gi_1 465 469 473 475 2 gi_1 466 463 468 467 2 gi_1 466 471 465 468 2 gi_1 468 465 469 473 2 gi_1 468 471 475 473 2 gi_1 469 465 473 470 2 gi_1 469 465 468 471 2 gi_1 469 473 475 471 2 gi_1 471 468 475 472 2 gi_1 473 469 475 474 2 gi_1 475 471 473 476 2 gi_1 477 460 479 478 2 gi_1 479 477 481 480 2 gi_1 481 479 485 482 2 gi_2 481 483 484 482 2 gi_2 485 481 487 486 2 gi_1 487 485 489 488 2 gi_1 489 487 494 490 2 gi_2 490 492 493 491 2 gi_2 494 489 496 495 2 gi_1 496 494 498 497 2 gi_1 498 496 502 499 2 gi_2 502 498 504 503 2 gi_1 504 502 506 505 2 gi_1 506 504 511 507 2 gi_2 506 510 508 507 2 gi_2 511 506 513 512 2 gi_1 513 511 515 514 2 gi_1 515 513 517 516 2 gi_2 517 515 519 518 2 gi_1 519 517 521 520 2 gi_1 521 519 523 522 2 gi_2 523 521 525 524 2 gi_1 525 523 527 526 2 gi_1 527 525 532 528 2 gi_2 528 531 530 529 2 gi_1 532 527 534 533 2 gi_1 534 532 536 535 2 gi_1 536 534 541 537 2 gi_2 541 536 543 542 2 gi_1 543 541 545 544 2 gi_1 545 543 553 546 2 gi_2 547 550 549 548 2 gi_1 548 552 551 550 2 gi_1 553 545 555 554 2 gi_1 555 553 557 556 2 gi_1 558 557 560 559 2 gi_1 560 558 562 561 2 gi_1 562 560 566 563 2 gi_2 562 564 565 563 2 gi_2 566 562 568 567 2 gi_1 568 566 570 569 2 gi_1 570 568 574 571 2 gi_2 570 572 573 571 2 gi_2 574 570 576 575 2 gi_1 576 574 578 577 2 gi_1 578 576 583 579 2 gi_2 578 582 580 579 2 gi_2 583 578 585 584 2 gi_1 585 583 587 586 2 gi_1 587 585 592 588 2 gi_2 588 591 590 589 2 gi_1 592 587 594 593 2 gi_1 594 592 596 595 2 gi_1 597 596 599 598 2 gi_1 599 597 601 600 2 gi_1 601 599 606 602 2 gi_2 606 601 608 607 2 gi_1 608 606 610 609 2 gi_1 610 608 612 611 2 gi_2 612 610 614 613 2 gi_1 614 612 616 615 2 gi_1 616 614 620 617 2 gi_2 620 616 622 621 2 gi_1 622 620 624 623 2 gi_1 625 624 627 626 2 gi_1 627 625 629 628 2 gi_1 629 627 634 630 2 gi_2 630 632 633 631 2 gi_2 634 629 636 635 2 gi_1 636 634 638 637 2 gi_1 638 636 643 639 2 gi_2 639 642 641 640 2 gi_1 643 638 645 644 2 gi_1 645 643 647 646 2 gi_1 647 645 656 648 2 gi_2 656 647 658 657 2 gi_1 658 656 660 659 2 gi_1 660 658 665 661 2 gi_2 661 664 663 662 2 gi_1 665 660 667 666 2 gi_1 667 665 669 668 2 gi_1 669 667 683 670 2 gi_2 670 674 672 671 2 gi_1 671 672 676 680 2 gi_1 671 674 678 680 2 gi_1 672 671 676 673 2 gi_1 672 671 674 678 2 gi_1 672 676 680 678 2 gi_1 674 671 678 675 2 gi_1 674 671 672 676 2 gi_1 674 678 680 676 2 gi_1 676 680 672 677 2 gi_1 678 680 674 679 2 gi_1 680 676 678 681 2 gi_1 683 669 685 684 2 gi_1 685 683 687 686 2 gi_1 687 685 692 688 2 gi_2 688 690 691 689 2 gi_2 692 687 694 693 2 gi_1 694 692 696 695 2 gi_1 696 694 705 697 2 gi_2 705 696 707 706 2 gi_1 707 705 708 711 2 gi_1 708 707 712 709 2 gi_2 712 708 714 713 2 gi_1 714 712 716 715 2 gi_1 716 714 721 717 2 gi_2 717 720 719 718 2 gi_1 721 716 723 722 2 gi_1 723 721 725 724 2 gi_1 725 723 730 726 2 gi_2 726 729 728 727 2 gi_1 730 725 732 731 2 gi_1 732 730 734 733 2 gi_1 734 732 738 735 2 gi_2 738 734 740 739 2 gi_1 740 738 742 741 2 gi_1 742 740 755 743 2 gi_2 746 745 748 747 2 gi_1 746 752 749 748 2 gi_1 748 751 750 749 2 gi_1 748 754 753 752 2 gi_1 755 742 757 756 2 gi_1 757 755 759 758 2 gi_1 759 757 763 760 2 gi_2 759 761 762 760 2 gi_2 763 759 765 764 2 gi_1 765 763 767 766 2 gi_1 767 765 772 768 2 gi_2 767 770 769 768 2 gi_2 772 767 774 773 2 gi_1 774 772 776 775 2 gi_1 776 774 778 777 2 gi_2 778 776 780 779 2 gi_1 780 778 782 781 2 gi_1 782 780 792 783 2 gi_2 783 787 785 784 2 gi_1 792 782 794 793 2 gi_1 794 792 796 795 2 gi_1 796 794 801 797 2 gi_2 796 800 798 797 2 gi_2 801 796 803 802 2 gi_1 803 801 805 804 2 gi_1 805 803 814 806 2 gi_2 814 805 816 815 2 gi_1 816 814 818 817 2 gi_1 818 816 823 819 2 gi_2 819 821 822 820 2 gi_2 823 818 825 824 2 gi_1 825 823 827 826 2 gi_1 827 825 832 828 2 gi_2 827 830 829 828 2 gi_2 832 827 834 833 2 gi_1 834 832 836 835 2 gi_1 837 836 839 838 2 gi_1 839 837 841 840 2 gi_1 841 839 845 842 2 gi_2 845 841 847 846 2 gi_1 847 845 849 848 2 gi_1 850 849 852 851 2 gi_1 852 850 854 853 2 gi_1 854 852 860 855 2 gi_2 856 859 858 857 2 gi_1 860 854 862 861 2 gi_1 862 860 864 863 2 gi_1 864 862 873 865 2 gi_2 873 864 875 874 2 gi_1 875 873 877 876 2 gi_1 877 875 882 878 2 gi_2 878 881 880 879 2 gi_1 882 877 884 883 2 gi_1 884 882 886 885 2 gi_1 886 884 890 887 2 gi_2 890 886 892 891 2 gi_1 892 890 894 893 2 gi_1 894 892 898 895 2 gi_2 894 896 897 895 2 gi_2 898 894 900 899 2 gi_1 900 898 902 901 2 gi_1 902 900 907 903 2 gi_2 902 906 904 903 2 gi_2 907 902 909 908 2 gi_1 909 907 911 910 2 gi_1 911 909 924 912 2 gi_2 912 916 914 913 2 gi_1 913 914 918 922 2 gi_1 913 916 920 922 2 gi_1 914 913 918 915 2 gi_1 914 913 916 920 2 gi_1 914 918 922 920 2 gi_1 916 913 920 917 2 gi_1 916 913 914 918 2 gi_1 916 920 922 918 2 gi_1 918 922 914 919 2 gi_1 920 922 916 921 2 gi_1 922 918 920 923 2 gi_1 924 911 926 925 2 gi_1 926 924 928 927 2 gi_1 928 926 933 929 2 gi_2 929 932 931 930 2 gi_1 933 928 935 934 2 gi_1 935 933 937 936 2 gi_1 937 935 941 938 2 gi_2 937 939 940 938 2 gi_2 941 937 943 942 2 gi_1 943 941 945 944 2 gi_1 945 943 949 946 2 gi_2 949 945 951 950 2 gi_1 951 949 953 952 2 gi_1 953 951 962 954 2 gi_2 962 953 964 963 2 gi_1 964 962 966 965 2 gi_1 966 964 971 967 2 gi_2 967 969 970 968 2 gi_2 971 966 973 972 2 gi_1 973 971 975 974 2 gi_1 975 973 984 976 2 gi_2 984 975 986 985 2 gi_1 986 984 988 987 2 gi_1 988 986 994 989 2 gi_2 990 993 992 991 2 gi_1 994 988 996 995 2 gi_1 996 994 998 997 2 gi_1 999 998 1001 1000 2 gi_1 1001 999 1003 1002 2 gi_1 1003 1001 1009 1004 2 gi_2 1005 1008 1007 1006 2 gi_1 1009 1003 1011 1010 2 gi_1 1011 1009 1013 1012 2 gi_1 1013 1011 1021 1014 2 gi_2 1015 1018 1017 1016 2 gi_1 1016 1020 1019 1018 2 gi_1 1021 1013 1023 1022 2 gi_1 1023 1021 1025 1024 2 gi_1 1025 1023 1039 1026 2 gi_2 1026 1030 1028 1027 2 gi_1 1027 1028 1032 1036 2 gi_1 1027 1030 1034 1036 2 gi_1 1028 1027 1032 1029 2 gi_1 1028 1027 1030 1034 2 gi_1 1028 1032 1036 1034 2 gi_1 1030 1027 1034 1031 2 gi_1 1030 1027 1028 1032 2 gi_1 1030 1034 1036 1032 2 gi_1 1032 1036 1028 1033 2 gi_1 1034 1036 1030 1035 2 gi_1 1036 1032 1034 1037 2 gi_1 1039 1025 1041 1040 2 gi_1 1041 1039 1043 1042 2 gi_1 1043 1041 1048 1044 2 gi_2 1048 1043 1050 1049 2 gi_1 1050 1048 1052 1051 2 gi_1 1052 1050 1065 1053 2 gi_2 1053 1057 1055 1054 2 gi_1 1054 1055 1059 1063 2 gi_1 1054 1057 1061 1063 2 gi_1 1055 1054 1059 1056 2 gi_1 1055 1054 1057 1061 2 gi_1 1055 1059 1063 1061 2 gi_1 1057 1054 1061 1058 2 gi_1 1057 1054 1055 1059 2 gi_1 1057 1061 1063 1059 2 gi_1 1059 1063 1055 1060 2 gi_1 1061 1063 1057 1062 2 gi_1 1063 1059 1061 1064 2 gi_1 1065 1052 1067 1066 2 gi_1 1067 1065 1069 1068 2 gi_1 1069 1067 1082 1070 2 gi_2 1070 1074 1072 1071 2 gi_1 1071 1072 1076 1080 2 gi_1 1071 1074 1078 1080 2 gi_1 1072 1071 1076 1073 2 gi_1 1072 1071 1074 1078 2 gi_1 1072 1076 1080 1078 2 gi_1 1074 1071 1078 1075 2 gi_1 1074 1071 1072 1076 2 gi_1 1074 1078 1080 1076 2 gi_1 1076 1080 1072 1077 2 gi_1 1078 1080 1074 1079 2 gi_1 1080 1076 1078 1081 2 gi_1 1082 1069 1084 1083 2 gi_1 1084 1082 1086 1085 2 gi_1 1086 1084 1089 1087 2 gi_2 1089 1086 1091 1090 2 gi_1 1091 1089 1093 1092 2 gi_1 1093 1091 1098 1094 2 gi_2 1093 1097 1095 1094 2 gi_2 1098 1093 1100 1099 2 gi_1 1100 1098 1102 1101 2 gi_1 1102 1100 1115 1103 2 gi_2 1103 1107 1105 1104 2 gi_1 1104 1105 1109 1113 2 gi_1 1104 1107 1111 1113 2 gi_1 1105 1104 1109 1106 2 gi_1 1105 1104 1107 1111 2 gi_1 1105 1109 1113 1111 2 gi_1 1107 1104 1111 1108 2 gi_1 1107 1104 1105 1109 2 gi_1 1107 1111 1113 1109 2 gi_1 1109 1113 1105 1110 2 gi_1 1111 1113 1107 1112 2 gi_1 1113 1109 1111 1114 2 gi_1 1115 1102 1117 1116 2 gi_1 1117 1115 1118 1121 2 gi_1 1118 1117 1122 1119 2 gi_2 1122 1118 1124 1123 2 gi_1 1124 1122 1126 1125 2 gi_1 1127 1126 1129 1128 2 gi_1 1129 1127 1131 1130 2 gi_1 1131 1129 1141 1132 2 gi_2 1132 1135 1134 1133 2 gi_1 1133 1135 1139 1137 2 gi_1 1133 1134 1137 1139 2 gi_1 1134 1137 1139 1135 2 gi_1 1134 1133 1135 1139 2 gi_1 1135 1133 1139 1136 2 gi_1 1135 1133 1134 1137 2 gi_1 1137 1134 1139 1138 2 gi_1 1139 1135 1137 1140 2 gi_1 1141 1131 1143 1142 2 gi_1 1143 1141 1145 1144 2 gi_1 1145 1143 1149 1146 2 gi_2 1149 1145 1151 1150 2 gi_1 1151 1149 1153 1152 2 gi_1 1153 1151 1155 1154 2 gi_2 1155 1153 1157 1156 2 gi_1 1157 1155 1159 1158 2 gi_1 1159 1157 1164 1160 2 gi_2 1160 1162 1163 1161 2 gi_2 1164 1159 1166 1165 2 gi_1 1166 1164 1168 1167 2 gi_1 1168 1166 1173 1169 2 gi_2 1173 1168 1175 1174 2 gi_1 1175 1173 1177 1176 2 gi_1 1177 1175 1186 1178 2 gi_2 1186 1177 1188 1187 2 gi_1 1188 1186 1190 1189 2 gi_1 1191 1190 1193 1192 2 gi_1 1193 1191 1195 1194 2 gi_1 1195 1193 1200 1196 2 gi_2 1195 1199 1197 1196 2 gi_2 1200 1195 1202 1201 2 gi_1 1202 1200 1204 1203 2 gi_1 1204 1202 1209 1205 2 gi_2 1205 1207 1208 1206 2 gi_2 1209 1204 1211 1210 2 gi_1 1211 1209 1213 1212 2 gi_1 1213 1211 1218 1214 2 gi_2 1213 1217 1215 1214 2 gi_2 1218 1213 1220 1219 2 gi_1 1220 1218 1222 1221 2 gi_1 1222 1220 1227 1223 2 gi_2 1223 1225 1226 1224 2 gi_2 1227 1222 1229 1228 2 gi_1 1229 1227 1231 1230 2 gi_1 1231 1229 1240 1232 2 gi_2 1240 1231 1242 1241 2 gi_1 [ dihedral_restraints ] 1 5 7 9 1 155.783356 0.0 30.5 5 7 9 11 1 -176.586334 0.0 30.5 7 9 11 17 1 -47.060863 0.0 30.5 9 11 17 19 1 144.945251 0.0 30.5 11 17 19 21 1 -178.713211 0.0 30.5 17 19 21 24 1 -91.456779 0.0 30.5 19 21 24 26 1 33.886631 0.0 30.5 21 24 26 28 1 178.058167 0.0 30.5 24 26 28 32 1 -164.679657 0.0 30.5 26 28 32 34 1 155.804565 0.0 30.5 28 32 34 36 1 179.571411 0.0 30.5 32 34 36 40 1 -139.529297 0.0 30.5 34 36 40 42 1 141.771667 0.0 30.5 36 40 42 44 1 179.936630 0.0 30.5 40 42 44 49 1 -103.593102 0.0 30.5 42 44 49 51 1 118.349785 0.0 30.5 44 49 51 53 1 -179.261765 0.0 30.5 49 51 53 58 1 -112.764664 0.0 30.5 51 53 58 60 1 141.771805 0.0 30.5 53 58 60 62 1 178.459061 0.0 30.5 58 60 62 70 1 -117.413406 0.0 30.5 60 62 70 72 1 134.251068 0.0 30.5 62 70 72 74 1 178.117020 0.0 30.5 70 72 74 75 1 -119.921265 0.0 30.5 72 74 75 77 1 114.886322 0.0 30.5 74 75 77 79 1 -176.772842 0.0 30.5 75 77 79 86 1 -103.037086 0.0 30.5 77 79 86 88 1 177.816406 0.0 30.5 79 86 88 90 1 -178.299362 0.0 30.5 86 88 90 95 1 -67.010544 0.0 30.5 88 90 95 97 1 -4.175944 0.0 30.5 90 95 97 99 1 179.933716 0.0 30.5 95 97 99 107 1 -104.537354 0.0 30.5 97 99 107 109 1 14.838719 0.0 30.5 99 107 109 111 1 179.164581 0.0 30.5 107 109 111 116 1 63.686596 0.0 30.5 109 111 116 118 1 52.887829 0.0 30.5 111 116 118 120 1 179.650894 0.0 30.5 116 118 120 128 1 -139.414917 0.0 30.5 118 120 128 130 1 146.147644 0.0 30.5 120 128 130 132 1 176.094696 0.0 30.5 128 130 132 145 1 -98.544846 0.0 30.5 130 132 145 147 1 149.982544 0.0 30.5 132 145 147 149 1 178.927551 0.0 30.5 145 147 149 156 1 -80.240654 0.0 30.5 147 149 156 158 1 19.651045 0.0 30.5 149 156 158 160 1 179.781891 0.0 30.5 156 158 160 165 1 -170.176758 0.0 30.5 158 160 165 167 1 147.059006 0.0 30.5 160 165 167 169 1 178.771927 0.0 30.5 165 167 169 176 1 -123.087471 0.0 30.5 167 169 176 178 1 16.598438 0.0 30.5 169 176 178 180 1 178.454849 0.0 30.5 176 178 180 182 1 -156.490875 0.0 30.5 178 180 182 184 1 124.368896 0.0 30.5 180 182 184 186 1 -179.184464 0.0 30.5 182 184 186 191 1 -123.334091 0.0 30.5 184 186 191 193 1 144.094772 0.0 30.5 186 191 193 195 1 178.062683 0.0 30.5 191 193 195 200 1 -128.747314 0.0 30.5 193 195 200 202 1 133.521011 0.0 30.5 195 200 202 204 1 -178.819366 0.0 30.5 200 202 204 208 1 -104.225990 0.0 30.5 202 204 208 210 1 122.179192 0.0 30.5 204 208 210 212 1 178.382584 0.0 30.5 208 210 212 217 1 -65.353027 0.0 30.5 210 212 217 219 1 108.327797 0.0 30.5 212 217 219 221 1 179.378113 0.0 30.5 217 219 221 230 1 -42.486050 0.0 30.5 219 221 230 232 1 -33.105114 0.0 30.5 221 230 232 234 1 -179.375610 0.0 30.5 230 232 234 238 1 -80.259697 0.0 30.5 232 234 238 240 1 -16.018738 0.0 30.5 234 238 240 242 1 178.158554 0.0 30.5 238 240 242 245 1 -65.488792 0.0 30.5 240 242 245 247 1 137.466827 0.0 30.5 242 245 247 249 1 176.870270 0.0 30.5 245 247 249 258 1 -76.181183 0.0 30.5 247 249 258 260 1 -31.221443 0.0 30.5 249 258 260 262 1 -179.273285 0.0 30.5 258 260 262 270 1 -138.030960 0.0 30.5 260 262 270 272 1 169.174667 0.0 30.5 262 270 272 274 1 178.172607 0.0 30.5 270 272 274 287 1 -141.444534 0.0 30.5 272 274 287 289 1 137.399460 0.0 30.5 274 287 289 291 1 -178.810989 0.0 30.5 287 289 291 296 1 -124.263901 0.0 30.5 289 291 296 298 1 133.392654 0.0 30.5 291 296 298 300 1 177.663269 0.0 30.5 296 298 300 304 1 -109.116676 0.0 30.5 298 300 304 306 1 130.752716 0.0 30.5 300 304 306 308 1 178.976517 0.0 30.5 304 306 308 315 1 -113.356895 0.0 30.5 306 308 315 317 1 103.845200 0.0 30.5 308 315 317 319 1 -179.716507 0.0 30.5 315 317 319 324 1 -92.621849 0.0 30.5 317 319 324 326 1 139.016129 0.0 30.5 319 324 326 328 1 176.369537 0.0 30.5 324 326 328 332 1 -137.485443 0.0 30.5 326 328 332 334 1 165.436707 0.0 30.5 328 332 334 336 1 -177.225052 0.0 30.5 332 334 336 346 1 -131.302979 0.0 30.5 334 336 346 348 1 81.604355 0.0 30.5 336 346 348 349 1 178.495377 0.0 30.5 346 348 349 353 1 -63.664265 0.0 30.5 348 349 353 355 1 159.445114 0.0 30.5 349 353 355 357 1 -179.748474 0.0 30.5 353 355 357 358 1 112.931595 0.0 30.5 355 357 358 360 1 -165.621109 0.0 30.5 357 358 360 362 1 -177.645172 0.0 30.5 358 360 362 369 1 -127.358063 0.0 30.5 360 362 369 371 1 -12.075650 0.0 30.5 362 369 371 373 1 -177.695175 0.0 30.5 369 371 373 378 1 -74.241234 0.0 30.5 371 373 378 380 1 131.076965 0.0 30.5 373 378 380 381 1 179.707321 0.0 30.5 378 380 381 385 1 -68.260277 0.0 30.5 380 381 385 387 1 164.904572 0.0 30.5 381 385 387 389 1 -177.169464 0.0 30.5 385 387 389 398 1 -66.308510 0.0 30.5 387 389 398 400 1 -30.435921 0.0 30.5 389 398 400 402 1 179.335236 0.0 30.5 398 400 402 409 1 -66.771370 0.0 30.5 400 402 409 411 1 -15.716033 0.0 30.5 402 409 411 413 1 -178.647095 0.0 30.5 409 411 413 417 1 -113.423950 0.0 30.5 411 413 417 419 1 -29.842302 0.0 30.5 413 417 419 421 1 -178.733826 0.0 30.5 417 419 421 426 1 -149.776215 0.0 30.5 419 421 426 428 1 40.424641 0.0 30.5 421 426 428 430 1 -179.148026 0.0 30.5 426 428 430 431 1 -71.209312 0.0 30.5 428 430 431 433 1 143.418579 0.0 30.5 430 431 433 435 1 -179.802490 0.0 30.5 431 433 435 445 1 -128.327850 0.0 30.5 433 435 445 447 1 141.202942 0.0 30.5 435 445 447 449 1 175.160110 0.0 30.5 445 447 449 456 1 -133.308640 0.0 30.5 447 449 456 458 1 167.700653 0.0 30.5 449 456 458 460 1 179.177612 0.0 30.5 456 458 460 477 1 -122.885895 0.0 30.5 458 460 477 479 1 117.207413 0.0 30.5 460 477 479 481 1 -177.909607 0.0 30.5 477 479 481 485 1 -124.925064 0.0 30.5 479 481 485 487 1 140.866440 0.0 30.5 481 485 487 489 1 -178.583679 0.0 30.5 485 487 489 494 1 -124.655418 0.0 30.5 487 489 494 496 1 131.463684 0.0 30.5 489 494 496 498 1 178.847412 0.0 30.5 494 496 498 502 1 -149.691818 0.0 30.5 496 498 502 504 1 173.842926 0.0 30.5 498 502 504 506 1 176.782074 0.0 30.5 502 504 506 511 1 -67.863503 0.0 30.5 504 506 511 513 1 172.001190 0.0 30.5 506 511 513 515 1 -178.517822 0.0 30.5 511 513 515 517 1 -71.096672 0.0 30.5 513 515 517 519 1 -33.781902 0.0 30.5 515 517 519 521 1 -178.759872 0.0 30.5 517 519 521 523 1 -67.678680 0.0 30.5 519 521 523 525 1 -26.586309 0.0 30.5 521 523 525 527 1 -179.368225 0.0 30.5 523 525 527 532 1 -92.352631 0.0 30.5 525 527 532 534 1 -13.355066 0.0 30.5 527 532 534 536 1 -178.864578 0.0 30.5 532 534 536 541 1 -47.075603 0.0 30.5 534 536 541 543 1 -51.115067 0.0 30.5 536 541 543 545 1 -177.855560 0.0 30.5 541 543 545 553 1 -59.841576 0.0 30.5 543 545 553 555 1 -43.535751 0.0 30.5 545 553 555 557 1 -179.970718 0.0 30.5 553 555 557 558 1 -68.140472 0.0 30.5 555 557 558 560 1 -35.925972 0.0 30.5 557 558 560 562 1 -179.578583 0.0 30.5 558 560 562 566 1 -69.106590 0.0 30.5 560 562 566 568 1 -36.353306 0.0 30.5 562 566 568 570 1 -179.676208 0.0 30.5 566 568 570 574 1 -69.825684 0.0 30.5 568 570 574 576 1 -48.930016 0.0 30.5 570 574 576 578 1 179.687363 0.0 30.5 574 576 578 583 1 -69.625999 0.0 30.5 576 578 583 585 1 -41.374821 0.0 30.5 578 583 585 587 1 178.092773 0.0 30.5 583 585 587 592 1 -69.586258 0.0 30.5 585 587 592 594 1 -29.146271 0.0 30.5 587 592 594 596 1 -179.863632 0.0 30.5 592 594 596 597 1 -65.187309 0.0 30.5 594 596 597 599 1 -47.189491 0.0 30.5 596 597 599 601 1 179.889603 0.0 30.5 597 599 601 606 1 -53.641670 0.0 30.5 599 601 606 608 1 -49.441921 0.0 30.5 601 606 608 610 1 -177.234116 0.0 30.5 606 608 610 612 1 -66.375931 0.0 30.5 608 610 612 614 1 -12.338917 0.0 30.5 610 612 614 616 1 -179.808533 0.0 30.5 612 614 616 620 1 -77.991493 0.0 30.5 614 616 620 622 1 -25.846077 0.0 30.5 616 620 622 624 1 -179.568268 0.0 30.5 620 622 624 625 1 100.199791 0.0 30.5 622 624 625 627 1 171.984360 0.0 30.5 624 625 627 629 1 178.554550 0.0 30.5 625 627 629 634 1 -74.689064 0.0 30.5 627 629 634 636 1 -38.320717 0.0 30.5 629 634 636 638 1 179.722641 0.0 30.5 634 636 638 643 1 -58.780396 0.0 30.5 636 638 643 645 1 -14.748023 0.0 30.5 638 643 645 647 1 -178.477844 0.0 30.5 643 645 647 656 1 -114.350838 0.0 30.5 645 647 656 658 1 6.704052 0.0 30.5 647 656 658 660 1 178.536499 0.0 30.5 656 658 660 665 1 70.611885 0.0 30.5 658 660 665 667 1 29.896145 0.0 30.5 660 665 667 669 1 -179.199097 0.0 30.5 665 667 669 683 1 46.246822 0.0 30.5 667 669 683 685 1 48.075905 0.0 30.5 669 683 685 687 1 -179.643417 0.0 30.5 683 685 687 692 1 -142.183624 0.0 30.5 685 687 692 694 1 129.800034 0.0 30.5 687 692 694 696 1 -179.851227 0.0 30.5 692 694 696 705 1 -67.377220 0.0 30.5 694 696 705 707 1 119.713326 0.0 30.5 696 705 707 708 1 179.483566 0.0 30.5 705 707 708 712 1 -49.286030 0.0 30.5 707 708 712 714 1 132.781281 0.0 30.5 708 712 714 716 1 178.804703 0.0 30.5 712 714 716 721 1 59.622341 0.0 30.5 714 716 721 723 1 32.719227 0.0 30.5 716 721 723 725 1 179.245789 0.0 30.5 721 723 725 730 1 -69.368530 0.0 30.5 723 725 730 732 1 113.967339 0.0 30.5 725 730 732 734 1 179.985611 0.0 30.5 730 732 734 738 1 -65.294319 0.0 30.5 732 734 738 740 1 -18.906687 0.0 30.5 734 738 740 742 1 -179.620453 0.0 30.5 738 740 742 755 1 -76.603096 0.0 30.5 740 742 755 757 1 -13.536614 0.0 30.5 742 755 757 759 1 -177.700912 0.0 30.5 755 757 759 763 1 -82.526756 0.0 30.5 757 759 763 765 1 115.126991 0.0 30.5 759 763 765 767 1 -179.080872 0.0 30.5 763 765 767 772 1 -81.279869 0.0 30.5 765 767 772 774 1 -39.083187 0.0 30.5 767 772 774 776 1 179.009476 0.0 30.5 772 774 776 778 1 -162.140030 0.0 30.5 774 776 778 780 1 152.025345 0.0 30.5 776 778 780 782 1 -178.961014 0.0 30.5 778 780 782 792 1 -161.690262 0.0 30.5 780 782 792 794 1 152.343704 0.0 30.5 782 792 794 796 1 175.480209 0.0 30.5 792 794 796 801 1 -101.070930 0.0 30.5 794 796 801 803 1 -175.037338 0.0 30.5 796 801 803 805 1 176.660370 0.0 30.5 801 803 805 814 1 -95.832802 0.0 30.5 803 805 814 816 1 179.570145 0.0 30.5 805 814 816 818 1 178.899017 0.0 30.5 814 816 818 823 1 -80.111053 0.0 30.5 816 818 823 825 1 124.391014 0.0 30.5 818 823 825 827 1 -177.495453 0.0 30.5 823 825 827 832 1 -113.420494 0.0 30.5 825 827 832 834 1 149.276047 0.0 30.5 827 832 834 836 1 178.395676 0.0 30.5 832 834 836 837 1 -110.205238 0.0 30.5 834 836 837 839 1 165.294617 0.0 30.5 836 837 839 841 1 -178.754486 0.0 30.5 837 839 841 845 1 -52.380436 0.0 30.5 839 841 845 847 1 142.941757 0.0 30.5 841 845 847 849 1 -178.942703 0.0 30.5 845 847 849 850 1 76.394753 0.0 30.5 847 849 850 852 1 0.607579 0.0 30.5 849 850 852 854 1 179.610504 0.0 30.5 850 852 854 860 1 -103.472893 0.0 30.5 852 854 860 862 1 171.402237 0.0 30.5 854 860 862 864 1 179.655777 0.0 30.5 860 862 864 873 1 -147.633270 0.0 30.5 862 864 873 875 1 152.945557 0.0 30.5 864 873 875 877 1 175.694214 0.0 30.5 873 875 877 882 1 -158.115387 0.0 30.5 875 877 882 884 1 153.500092 0.0 30.5 877 882 884 886 1 179.186508 0.0 30.5 882 884 886 890 1 -138.764938 0.0 30.5 884 886 890 892 1 148.349869 0.0 30.5 886 890 892 894 1 179.407349 0.0 30.5 890 892 894 898 1 -131.955643 0.0 30.5 892 894 898 900 1 138.817871 0.0 30.5 894 898 900 902 1 177.356705 0.0 30.5 898 900 902 907 1 -122.848549 0.0 30.5 900 902 907 909 1 138.789902 0.0 30.5 902 907 909 911 1 175.733948 0.0 30.5 907 909 911 924 1 -139.386307 0.0 30.5 909 911 924 926 1 156.379257 0.0 30.5 911 924 926 928 1 179.576981 0.0 30.5 924 926 928 933 1 -72.927269 0.0 30.5 926 928 933 935 1 130.529755 0.0 30.5 928 933 935 937 1 -179.832199 0.0 30.5 933 935 937 941 1 -63.290257 0.0 30.5 935 937 941 943 1 -16.073648 0.0 30.5 937 941 943 945 1 179.719315 0.0 30.5 941 943 945 949 1 -74.753235 0.0 30.5 943 945 949 951 1 -2.731159 0.0 30.5 945 949 951 953 1 -179.904892 0.0 30.5 949 951 953 962 1 -82.101349 0.0 30.5 951 953 962 964 1 -21.882429 0.0 30.5 953 962 964 966 1 -179.323288 0.0 30.5 962 964 966 971 1 -91.236008 0.0 30.5 964 966 971 973 1 151.566727 0.0 30.5 966 971 973 975 1 -178.989273 0.0 30.5 971 973 975 984 1 -126.379745 0.0 30.5 973 975 984 986 1 150.613358 0.0 30.5 975 984 986 988 1 179.435669 0.0 30.5 984 986 988 994 1 -69.527832 0.0 30.5 986 988 994 996 1 144.769196 0.0 30.5 988 994 996 998 1 179.131943 0.0 30.5 994 996 998 999 1 83.159935 0.0 30.5 996 998 999 1001 1 -33.556190 0.0 30.5 998 999 1001 1003 1 179.652878 0.0 30.5 999 1001 1003 1009 1 -65.086823 0.0 30.5 1001 1003 1009 1011 1 154.261368 0.0 30.5 1003 1009 1011 1013 1 -179.771622 0.0 30.5 1009 1011 1013 1021 1 -112.140495 0.0 30.5 1011 1013 1021 1023 1 112.728989 0.0 30.5 1013 1021 1023 1025 1 -179.652893 0.0 30.5 1021 1023 1025 1039 1 -101.751129 0.0 30.5 1023 1025 1039 1041 1 161.520599 0.0 30.5 1025 1039 1041 1043 1 178.776230 0.0 30.5 1039 1041 1043 1048 1 -141.754211 0.0 30.5 1041 1043 1048 1050 1 141.304276 0.0 30.5 1043 1048 1050 1052 1 175.799011 0.0 30.5 1048 1050 1052 1065 1 -111.480797 0.0 30.5 1050 1052 1065 1067 1 149.526505 0.0 30.5 1052 1065 1067 1069 1 -177.241852 0.0 30.5 1065 1067 1069 1082 1 -167.182877 0.0 30.5 1067 1069 1082 1084 1 165.371902 0.0 30.5 1069 1082 1084 1086 1 178.506561 0.0 30.5 1082 1084 1086 1089 1 -100.406013 0.0 30.5 1084 1086 1089 1091 1 138.092392 0.0 30.5 1086 1089 1091 1093 1 -179.264038 0.0 30.5 1089 1091 1093 1098 1 -106.996552 0.0 30.5 1091 1093 1098 1100 1 14.398260 0.0 30.5 1093 1098 1100 1102 1 177.154648 0.0 30.5 1098 1100 1102 1115 1 -68.139252 0.0 30.5 1100 1102 1115 1117 1 133.966599 0.0 30.5 1102 1115 1117 1118 1 -178.963593 0.0 30.5 1115 1117 1118 1122 1 -40.361256 0.0 30.5 1117 1118 1122 1124 1 119.313652 0.0 30.5 1118 1122 1124 1126 1 178.574921 0.0 30.5 1122 1124 1126 1127 1 82.770081 0.0 30.5 1124 1126 1127 1129 1 -6.257114 0.0 30.5 1126 1127 1129 1131 1 -179.501938 0.0 30.5 1127 1129 1131 1141 1 -79.533195 0.0 30.5 1129 1131 1141 1143 1 -32.880814 0.0 30.5 1131 1141 1143 1145 1 -178.643585 0.0 30.5 1141 1143 1145 1149 1 -57.576786 0.0 30.5 1143 1145 1149 1151 1 -19.532558 0.0 30.5 1145 1149 1151 1153 1 178.892776 0.0 30.5 1149 1151 1153 1155 1 -67.620834 0.0 30.5 1151 1153 1155 1157 1 -32.538929 0.0 30.5 1153 1155 1157 1159 1 -178.532867 0.0 30.5 1155 1157 1159 1164 1 -113.295959 0.0 30.5 1157 1159 1164 1166 1 -41.068256 0.0 30.5 1159 1164 1166 1168 1 -179.809464 0.0 30.5 1164 1166 1168 1173 1 -90.099678 0.0 30.5 1166 1168 1173 1175 1 82.463989 0.0 30.5 1168 1173 1175 1177 1 179.607178 0.0 30.5 1173 1175 1177 1186 1 -157.207031 0.0 30.5 1175 1177 1186 1188 1 158.881927 0.0 30.5 1177 1186 1188 1190 1 -178.624344 0.0 30.5 1186 1188 1190 1191 1 -174.546249 0.0 30.5 1188 1190 1191 1193 1 173.584824 0.0 30.5 1190 1191 1193 1195 1 -178.020111 0.0 30.5 1191 1193 1195 1200 1 -97.052612 0.0 30.5 1193 1195 1200 1202 1 150.273407 0.0 30.5 1195 1200 1202 1204 1 177.648743 0.0 30.5 1200 1202 1204 1209 1 -128.686798 0.0 30.5 1202 1204 1209 1211 1 122.212341 0.0 30.5 1204 1209 1211 1213 1 179.780838 0.0 30.5 1209 1211 1213 1218 1 -130.116714 0.0 30.5 1211 1213 1218 1220 1 140.701965 0.0 30.5 1213 1218 1220 1222 1 -178.649200 0.0 30.5 1218 1220 1222 1227 1 -90.424706 0.0 30.5 1220 1222 1227 1229 1 113.306610 0.0 30.5 1222 1227 1229 1231 1 -177.991943 0.0 30.5 1227 1229 1231 1240 1 -137.443222 0.0 30.5 #include "/global/u2/j/jkretchm/gromos53a6.ff/spce.itp" #ifdef POSRES_WATER [ position_restraints ] 1 1 1000 1000 1000 #endif [ system ] AZURIN in water [ molecules ] Azurin2state 1 SOL 4718