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*** ***elNémo ID: 21011707112813452Job options:ID = 21011707112813452 JOBID = USERID = unknown PRIVAT = 0 NMODES = 5 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = 0 CUTOFF = 0 CAONLY = 0 Input data for this run:ATOM 1 N GLU i 148 252.576 221.082 185.065 1.00 34.16 N ATOM 2 CA GLU i 148 251.274 220.842 185.677 1.00 34.16 C ATOM 3 C GLU i 148 251.386 220.743 187.194 1.00 34.16 C ATOM 4 O GLU i 148 252.457 220.467 187.734 1.00 34.16 O ATOM 5 CB GLU i 148 250.642 219.570 185.112 1.00 34.16 C ATOM 6 N LEU i 149 250.268 220.966 187.875 1.00 32.51 N ATOM 7 CA LEU i 149 250.231 220.972 189.328 1.00 32.51 C ATOM 8 C LEU i 149 249.851 219.599 189.867 1.00 32.51 C ATOM 9 O LEU i 149 249.161 218.819 189.208 1.00 32.51 O ATOM 10 CB LEU i 149 249.244 222.024 189.833 1.00 32.51 C ATOM 11 CG LEU i 149 249.478 223.444 189.315 1.00 32.51 C ATOM 12 CD1 LEU i 149 248.259 224.317 189.552 1.00 32.51 C ATOM 13 CD2 LEU i 149 250.714 224.045 189.960 1.00 32.51 C ATOM 14 N GLY i 150 250.304 219.317 191.086 1.00 33.99 N ATOM 15 CA GLY i 150 250.115 218.024 191.704 1.00 33.99 C ATOM 16 C GLY i 150 248.819 217.929 192.484 1.00 33.99 C ATOM 17 O GLY i 150 247.924 218.768 192.379 1.00 33.99 O ATOM 18 N THR i 151 248.732 216.875 193.295 1.00 37.02 N ATOM 19 CA THR i 151 247.501 216.522 193.986 1.00 37.02 C ATOM 20 C THR i 151 247.735 216.370 195.483 1.00 37.02 C ATOM 21 O THR i 151 248.721 215.768 195.916 1.00 37.02 O ATOM 22 CB THR i 151 246.908 215.217 193.433 1.00 37.02 C ATOM 23 N ASP i 152 246.808 216.925 196.260 1.00 37.78 N ATOM 24 CA ASP i 152 246.622 216.774 197.689 1.00 37.78 C ATOM 25 C ASP i 152 245.150 216.498 197.955 1.00 37.78 C ATOM 26 O ASP i 152 244.300 217.164 197.361 1.00 37.78 O ATOM 27 CB ASP i 152 247.044 218.046 198.436 1.00 37.78 C ATOM 28 CG ASP i 152 247.652 217.758 199.789 1.00 37.78 C ATOM 29 OD1 ASP i 152 248.063 216.608 200.034 1.00 37.78 O ATOM 30 OD2 ASP i 152 247.740 218.694 200.607 1.00 37.78 O ATOM 31 N PRO i 153 244.808 215.521 198.804 1.00 35.32 N ATOM 32 CA PRO i 153 243.380 215.277 199.085 1.00 35.32 C ATOM 33 C PRO i 153 242.704 216.430 199.806 1.00 35.32 C ATOM 34 O PRO i 153 241.517 216.694 199.571 1.00 35.32 O ATOM 35 CB PRO i 153 243.408 214.003 199.940 1.00 35.32 C ATOM 36 CG PRO i 153 244.715 213.366 199.636 1.00 35.32 C ATOM 37 CD PRO i 153 245.664 214.491 199.412 1.00 35.32 C ATOM 38 N TYR i 154 243.452 217.152 200.647 1.00 33.72 N ATOM 39 CA TYR i 154 242.916 218.332 201.315 1.00 33.72 C ATOM 40 C TYR i 154 242.631 219.450 200.323 1.00 33.72 C ATOM 41 O TYR i 154 241.565 220.075 200.375 1.00 33.72 O ATOM 42 CB TYR i 154 243.893 218.823 202.379 1.00 33.72 C ATOM 43 CG TYR i 154 244.152 217.858 203.502 1.00 33.72 C ATOM 44 CD1 TYR i 154 245.168 216.921 203.416 1.00 33.72 C ATOM 45 CD2 TYR i 154 243.386 217.892 204.654 1.00 33.72 C ATOM 46 CE1 TYR i 154 245.409 216.039 204.446 1.00 33.72 C ATOM 47 CE2 TYR i 154 243.618 217.018 205.687 1.00 33.72 C ATOM 48 CZ TYR i 154 244.632 216.094 205.578 1.00 33.72 C ATOM 49 OH TYR i 154 244.873 215.218 206.606 1.00 33.72 O ATOM 50 N GLU i 155 243.571 219.714 199.412 1.00 35.87 N ATOM 51 CA GLU i 155 243.377 220.770 198.424 1.00 35.87 C ATOM 52 C GLU i 155 242.269 220.412 197.440 1.00 35.87 C ATOM 53 O GLU i 155 241.451 221.270 197.079 1.00 35.87 O ATOM 54 CB GLU i 155 244.688 221.036 197.687 1.00 35.87 C ATOM 55 CG GLU i 155 244.620 222.168 196.678 1.00 35.87 C ATOM 56 CD GLU i 155 245.629 222.016 195.556 1.00 35.87 C ATOM 57 OE1 GLU i 155 245.341 222.484 194.435 1.00 35.87 O ATOM 58 OE2 GLU i 155 246.705 221.430 195.794 1.00 35.87 O ATOM 59 N ASP i 156 242.220 219.140 197.019 1.00 32.87 N ATOM 60 CA ASP i 156 241.157 218.663 196.139 1.00 32.87 C ATOM 61 C ASP i 156 239.792 218.788 196.796 1.00 32.87 C ATOM 62 O ASP i 156 238.825 219.202 196.149 1.00 32.87 O ATOM 63 CB ASP i 156 241.408 217.212 195.742 1.00 32.87 C ATOM 64 CG ASP i 156 242.573 217.062 194.807 1.00 32.87 C ATOM 65 OD1 ASP i 156 243.388 218.001 194.726 1.00 32.87 O ATOM 66 OD2 ASP i 156 242.676 216.006 194.151 1.00 32.87 O ATOM 67 N PHE i 157 239.704 218.462 198.086 1.00 28.95 N ATOM 68 CA PHE i 157 238.438 218.605 198.791 1.00 28.95 C ATOM 69 C PHE i 157 238.050 220.066 198.947 1.00 28.95 C ATOM 70 O PHE i 157 236.891 220.423 198.750 1.00 28.95 O ATOM 71 CB PHE i 157 238.503 217.935 200.156 1.00 28.95 C ATOM 72 CG PHE i 157 237.214 218.006 200.907 1.00 28.95 C ATOM 73 CD1 PHE i 157 236.143 217.222 200.524 1.00 28.95 C ATOM 74 CD2 PHE i 157 237.066 218.861 201.989 1.00 28.95 C ATOM 75 CE1 PHE i 157 234.946 217.284 201.207 1.00 28.95 C ATOM 76 CE2 PHE i 157 235.871 218.928 202.674 1.00 28.95 C ATOM 77 CZ PHE i 157 234.810 218.138 202.282 1.00 28.95 C ATOM 78 N GLN i 158 239.007 220.925 199.298 1.00 31.50 N ATOM 79 CA GLN i 158 238.679 222.315 199.598 1.00 31.50 C ATOM 80 C GLN i 158 238.286 223.082 198.346 1.00 31.50 C ATOM 81 O GLN i 158 237.474 224.010 198.414 1.00 31.50 O ATOM 82 CB GLN i 158 239.857 222.986 200.298 1.00 31.50 C ATOM 83 CG GLN i 158 239.999 222.588 201.745 1.00 31.50 C ATOM 84 CD GLN i 158 241.034 223.395 202.482 1.00 31.50 C ATOM 85 NE2 GLN i 158 241.045 224.698 202.250 1.00 31.50 N ATOM 86 OE1 GLN i 158 241.812 222.854 203.262 1.00 31.50 O ATOM 87 N GLU i 159 238.838 222.709 197.190 1.00 34.08 N ATOM 88 CA GLU i 159 238.454 223.401 195.965 1.00 34.08 C ATOM 89 C GLU i 159 237.315 222.699 195.237 1.00 34.08 C ATOM 90 O GLU i 159 236.664 223.307 194.381 1.00 34.08 O ATOM 91 CB GLU i 159 239.662 223.576 195.045 1.00 34.08 C ATOM 92 CG GLU i 159 240.894 224.162 195.722 1.00 34.08 C ATOM 93 CD GLU i 159 240.920 225.684 195.707 1.00 34.08 C ATOM 94 OE1 GLU i 159 242.012 226.254 195.909 1.00 34.08 O ATOM 95 OE2 GLU i 159 239.865 226.317 195.487 1.00 34.08 O ATOM 96 N ASN i 160 237.057 221.427 195.540 1.00 28.04 N ATOM 97 CA ASN i 160 236.056 220.672 194.799 1.00 28.04 C ATOM 98 C ASN i 160 234.902 220.172 195.653 1.00 28.04 C ATOM 99 O ASN i 160 234.177 219.284 195.203 1.00 28.04 O ATOM 100 CB ASN i 160 236.694 219.479 194.088 1.00 28.04 C ATOM 101 CG ASN i 160 237.816 219.878 193.176 1.00 28.04 C ATOM 102 ND2 ASN i 160 239.037 219.565 193.575 1.00 28.04 N ATOM 103 OD1 ASN i 160 237.591 220.444 192.111 1.00 28.04 O ATOM 104 N TRP i 161 234.702 220.719 196.857 1.00 26.68 N ATOM 105 CA TRP i 161 233.620 220.238 197.719 1.00 26.68 C ATOM 106 C TRP i 161 232.247 220.598 197.162 1.00 26.68 C ATOM 107 O TRP i 161 231.245 219.981 197.529 1.00 26.68 O ATOM 108 CB TRP i 161 233.769 220.797 199.138 1.00 26.68 C ATOM 109 CG TRP i 161 233.448 222.256 199.247 1.00 26.68 C ATOM 110 CD1 TRP i 161 234.305 223.297 199.088 1.00 26.68 C ATOM 111 CD2 TRP i 161 232.171 222.827 199.539 1.00 26.68 C ATOM 112 CE2 TRP i 161 232.327 224.220 199.526 1.00 26.68 C ATOM 113 CE3 TRP i 161 230.906 222.292 199.795 1.00 26.68 C ATOM 114 NE1 TRP i 161 233.642 224.482 199.247 1.00 26.68 N ATOM 115 CZ2 TRP i 161 231.269 225.085 199.769 1.00 26.68 C ATOM 116 CZ3 TRP i 161 229.865 223.146 200.036 1.00 26.68 C ATOM 117 CH2 TRP i 161 230.050 224.528 200.025 1.00 26.68 C ATOM 118 N ASN i 162 232.172 221.627 196.322 1.00 26.48 N ATOM 119 CA ASN i 162 230.907 222.115 195.795 1.00 26.48 C ATOM 120 C ASN i 162 230.762 221.904 194.299 1.00 26.48 C ATOM 121 O ASN i 162 229.737 222.292 193.731 1.00 26.48 O ATOM 122 CB ASN i 162 230.744 223.601 196.113 1.00 26.48 C ATOM 123 CG ASN i 162 232.008 224.384 195.864 1.00 26.48 C ATOM 124 ND2 ASN i 162 231.913 225.704 195.941 1.00 26.48 N ATOM 125 OD1 ASN i 162 233.059 223.808 195.586 1.00 26.48 O ATOM 126 N THR i 163 231.756 221.311 193.649 1.00 25.78 N ATOM 127 CA THR i 163 231.721 221.093 192.215 1.00 25.78 C ATOM 128 C THR i 163 230.984 219.793 191.898 1.00 25.78 C ATOM 129 O THR i 163 230.302 219.212 192.742 1.00 25.78 O ATOM 130 CB THR i 163 233.138 221.086 191.643 1.00 25.78 C ATOM 131 CG2 THR i 163 233.913 222.297 192.124 1.00 25.78 C ATOM 132 OG1 THR i 163 233.821 219.898 192.057 1.00 25.78 O ATOM 133 N LYS i 164 231.110 219.345 190.646 1.00 20.95 N ATOM 134 CA LYS i 164 230.558 218.058 190.239 1.00 20.95 C ATOM 135 C LYS i 164 231.261 216.902 190.937 1.00 20.95 C ATOM 136 O LYS i 164 230.637 215.877 191.230 1.00 20.95 O ATOM 137 CB LYS i 164 230.668 217.917 188.719 1.00 20.95 C ATOM 138 CG LYS i 164 230.173 216.602 188.130 1.00 20.95 C ATOM 139 CD LYS i 164 230.862 216.273 186.826 1.00 20.95 C ATOM 140 CE LYS i 164 230.519 214.871 186.384 1.00 20.95 C ATOM 141 NZ LYS i 164 231.084 214.532 185.059 1.00 20.95 N ATOM 142 N HIS i 165 232.539 217.066 191.262 1.00 19.69 N ATOM 143 CA HIS i 165 233.352 215.995 191.810 1.00 19.69 C ATOM 144 C HIS i 165 233.425 216.027 193.331 1.00 19.69 C ATOM 145 O HIS i 165 234.460 215.673 193.900 1.00 19.69 O ATOM 146 CB HIS i 165 234.748 216.041 191.190 1.00 19.69 C ATOM 147 CG HIS i 165 234.759 215.680 189.740 1.00 19.69 C ATOM 148 CD2 HIS i 165 234.299 216.344 188.654 1.00 19.69 C ATOM 149 ND1 HIS i 165 235.241 214.477 189.276 1.00 19.69 N ATOM 150 CE1 HIS i 165 235.099 214.424 187.966 1.00 19.69 C ATOM 151 NE2 HIS i 165 234.528 215.545 187.563 1.00 19.69 N ATOM 152 N SER i 166 232.335 216.433 193.987 1.00 21.10 N ATOM 153 CA SER i 166 232.301 216.606 195.435 1.00 21.10 C ATOM 154 C SER i 166 232.421 215.282 196.164 1.00 21.10 C ATOM 155 O SER i 166 233.180 215.149 197.132 1.00 21.10 O ATOM 156 CB SER i 166 230.984 217.263 195.822 1.00 21.10 C ATOM 157 OG SER i 166 230.593 218.209 194.850 1.00 21.10 O ATOM 158 N SER i 167 231.645 214.301 195.725 1.00 19.59 N ATOM 159 CA SER i 167 231.574 213.028 196.418 1.00 19.59 C ATOM 160 C SER i 167 232.845 212.214 196.215 1.00 19.59 C ATOM 161 O SER i 167 233.275 211.487 197.118 1.00 19.59 O ATOM 162 CB SER i 167 230.328 212.299 195.937 1.00 19.59 C ATOM 163 OG SER i 167 230.339 212.155 194.529 1.00 19.59 O ATOM 164 N GLY i 168 233.502 212.387 195.067 1.00 19.52 N ATOM 165 CA GLY i 168 234.762 211.707 194.829 1.00 19.52 C ATOM 166 C GLY i 168 235.907 212.238 195.669 1.00 19.52 C ATOM 167 O GLY i 168 236.697 211.461 196.214 1.00 19.52 O ATOM 168 N VAL i 169 236.016 213.565 195.793 1.00 22.14 N ATOM 169 CA VAL i 169 237.069 214.130 196.632 1.00 22.14 C ATOM 170 C VAL i 169 236.745 213.919 198.104 1.00 22.14 C ATOM 171 O VAL i 169 237.651 213.832 198.940 1.00 22.14 O ATOM 172 CB VAL i 169 237.322 215.619 196.302 1.00 22.14 C ATOM 173 CG1 VAL i 169 237.722 215.789 194.847 1.00 22.14 C ATOM 174 CG2 VAL i 169 236.136 216.502 196.640 1.00 22.14 C ATOM 175 N THR i 170 235.456 213.784 198.437 1.00 21.45 N ATOM 176 CA THR i 170 235.070 213.369 199.783 1.00 21.45 C ATOM 177 C THR i 170 235.566 211.960 200.090 1.00 21.45 C ATOM 178 O THR i 170 236.156 211.718 201.152 1.00 21.45 O ATOM 179 CB THR i 170 233.551 213.444 199.929 1.00 21.45 C ATOM 180 CG2 THR i 170 233.135 213.185 201.354 1.00 21.45 C ATOM 181 OG1 THR i 170 233.093 214.740 199.533 1.00 21.45 O ATOM 182 N ARG i 171 235.358 211.028 199.151 1.00 19.86 N ATOM 183 CA ARG i 171 235.817 209.652 199.321 1.00 19.86 C ATOM 184 C ARG i 171 237.340 209.567 199.389 1.00 19.86 C ATOM 185 O ARG i 171 237.891 208.802 200.191 1.00 19.86 O ATOM 186 CB ARG i 171 235.265 208.793 198.179 1.00 19.86 C ATOM 187 CG ARG i 171 235.757 207.352 198.138 1.00 19.86 C ATOM 188 CD ARG i 171 235.677 206.787 196.738 1.00 19.86 C ATOM 189 NE ARG i 171 236.561 207.473 195.812 1.00 19.86 N ATOM 190 CZ ARG i 171 236.277 207.722 194.540 1.00 19.86 C ATOM 191 NH1 ARG i 171 235.113 207.384 194.020 1.00 19.86 N ATOM 192 NH2 ARG i 171 237.157 208.355 193.795 1.00 19.86 N ATOM 193 N GLU i 172 238.038 210.382 198.597 1.00 22.95 N ATOM 194 CA GLU i 172 239.497 210.349 198.630 1.00 22.95 C ATOM 195 C GLU i 172 240.052 210.972 199.906 1.00 22.95 C ATOM 196 O GLU i 172 241.049 210.483 200.451 1.00 22.95 O ATOM 197 CB GLU i 172 240.073 211.034 197.393 1.00 22.95 C ATOM 198 CG GLU i 172 239.814 210.266 196.113 1.00 22.95 C ATOM 199 CD GLU i 172 240.392 208.864 196.145 1.00 22.95 C ATOM 200 OE1 GLU i 172 241.551 208.697 196.563 1.00 22.95 O ATOM 201 OE2 GLU i 172 239.669 207.917 195.781 1.00 22.95 O ATOM 202 N LEU i 173 239.414 212.033 200.414 1.00 25.67 N ATOM 203 CA LEU i 173 239.852 212.609 201.680 1.00 25.67 C ATOM 204 C LEU i 173 239.585 211.661 202.839 1.00 25.67 C ATOM 205 O LEU i 173 240.393 211.577 203.767 1.00 25.67 O ATOM 206 CB LEU i 173 239.175 213.957 201.921 1.00 25.67 C ATOM 207 CG LEU i 173 239.567 214.696 203.206 1.00 25.67 C ATOM 208 CD1 LEU i 173 241.077 214.909 203.312 1.00 25.67 C ATOM 209 CD2 LEU i 173 238.829 215.998 203.335 1.00 25.67 C ATOM 210 N MET i 174 238.457 210.969 202.811 1.00 24.26 N ATOM 211 CA MET i 174 238.166 210.014 203.864 1.00 24.26 C ATOM 212 C MET i 174 239.149 208.850 203.881 1.00 24.26 C ATOM 213 O MET i 174 239.511 208.383 204.940 1.00 24.26 O ATOM 214 CB MET i 174 236.711 209.572 203.855 1.00 24.26 C ATOM 215 CG MET i 174 235.784 210.628 204.424 1.00 24.26 C ATOM 216 SD MET i 174 236.134 211.161 206.114 1.00 24.26 S ATOM 217 CE MET i 174 235.178 209.980 207.057 1.00 24.26 C ATOM 218 N ARG i 175 239.548 208.368 202.706 1.00 24.10 N ATOM 219 CA ARG i 175 240.516 207.280 202.616 1.00 24.10 C ATOM 220 C ARG i 175 241.839 207.725 203.198 1.00 24.10 C ATOM 221 O ARG i 175 242.499 206.988 203.913 1.00 24.10 O ATOM 222 CB ARG i 175 240.789 206.889 201.162 1.00 24.10 C ATOM 223 CG ARG i 175 239.716 206.097 200.434 1.00 24.10 C ATOM 224 CD ARG i 175 240.347 205.349 199.275 1.00 24.10 C ATOM 225 NE ARG i 175 239.455 205.176 198.134 1.00 24.10 N ATOM 226 CZ ARG i 175 239.051 204.005 197.663 1.00 24.10 C ATOM 227 NH1 ARG i 175 239.442 202.890 198.233 1.00 24.10 N ATOM 228 NH2 ARG i 175 238.252 203.941 196.626 1.00 24.10 N ATOM 229 N GLU i 176 242.232 208.944 202.858 1.00 29.74 N ATOM 230 CA GLU i 176 243.476 209.519 203.325 1.00 29.74 C ATOM 231 C GLU i 176 243.517 209.722 204.823 1.00 29.74 C ATOM 232 O GLU i 176 244.517 209.436 205.461 1.00 29.74 O ATOM 233 CB GLU i 176 243.688 210.859 202.630 1.00 29.74 C ATOM 234 CG GLU i 176 244.523 211.856 203.407 1.00 29.74 C ATOM 235 CD GLU i 176 246.005 211.593 203.295 1.00 29.74 C ATOM 236 OE1 GLU i 176 246.388 210.596 202.652 1.00 29.74 O ATOM 237 OE2 GLU i 176 246.792 212.387 203.850 1.00 29.74 O ATOM 238 N LEU i 177 242.439 210.247 205.389 1.00 26.72 N ATOM 239 CA LEU i 177 242.408 210.480 206.824 1.00 26.72 C ATOM 240 C LEU i 177 242.427 209.211 207.633 1.00 26.72 C ATOM 241 O LEU i 177 243.184 209.084 208.583 1.00 26.72 O ATOM 242 CB LEU i 177 241.163 211.278 207.194 1.00 26.72 C ATOM 243 CG LEU i 177 241.148 212.701 206.651 1.00 26.72 C ATOM 244 CD1 LEU i 177 239.746 213.274 206.632 1.00 26.72 C ATOM 245 CD2 LEU i 177 242.096 213.569 207.456 1.00 26.72 C ATOM 246 N ASN i 178 241.581 208.267 207.257 1.00 29.26 N ATOM 247 CA ASN i 178 241.518 207.008 207.969 1.00 29.26 C ATOM 248 C ASN i 178 242.727 206.091 207.801 1.00 29.26 C ATOM 249 O ASN i 178 243.207 205.504 208.765 1.00 29.26 O ATOM 250 CB ASN i 178 240.180 206.335 207.731 1.00 29.26 C ATOM 251 CG ASN i 178 239.056 207.074 208.427 1.00 29.26 C ATOM 252 ND2 ASN i 178 237.901 207.136 207.788 1.00 29.26 N ATOM 253 OD1 ASN i 178 239.236 207.606 209.518 1.00 29.26 O ATOM 254 N GLY i 179 243.197 205.964 206.568 1.00 31.16 N ATOM 255 CA GLY i 179 244.381 205.192 206.261 1.00 31.16 C ATOM 256 C GLY i 179 244.209 203.690 206.246 1.00 31.16 C ATOM 257 O GLY i 179 243.154 203.153 206.562 1.00 31.16 O ATOM 258 N GLY i 180 245.286 203.008 205.891 1.00 34.34 N ATOM 259 CA GLY i 180 245.340 201.558 205.890 1.00 34.34 C ATOM 260 C GLY i 180 246.748 201.005 205.997 1.00 34.34 C ATOM 261 O GLY i 180 247.692 201.564 205.437 1.00 34.34 O END If you find results from this site helpful for your research, please cite one of our papers:
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