USER MOD reduce.3.24.130724 H: found=0, std=0, add=692, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 690 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 28 THR OG1 : rot 170:sc= -2.47! USER MOD Set 1.2: A 64 TYR OH : rot 180:sc= -0.973 USER MOD Single : A 2 SER OG : rot -71:sc= 1.02 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A -2 LEU N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 82:sc= 1.36 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot -110:sc= 0.237 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 180:sc=0.000303 USER MOD Single : A 33 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.453 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot -6:sc= 0.595 USER MOD Single : A 46 THR OG1 : rot -130:sc= 0 USER MOD Single : A 51 THR OG1 : rot 103:sc=0.000243 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 CYS SG : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ -119:sc= 0 (180deg=-0.152) USER MOD Single : A 85 MET CE :methyl -115:sc= -0.0328 (180deg=-0.421) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A -2 64.450 12.369 25.659 1.00 15.00 N ATOM 2 CA LEU A -2 63.486 12.032 24.568 1.00 15.00 C ATOM 3 C LEU A -2 62.070 11.894 25.137 1.00 15.00 C ATOM 4 O LEU A -2 61.851 11.194 26.108 1.00 15.00 O ATOM 5 CB LEU A -2 63.974 10.694 24.010 1.00 15.00 C ATOM 6 CG LEU A -2 63.273 10.404 22.680 1.00 15.00 C ATOM 7 CD1 LEU A -2 64.139 9.464 21.838 1.00 15.00 C ATOM 8 CD2 LEU A -2 61.918 9.744 22.950 1.00 15.00 C ATOM 0 H1 LEU A -2 65.407 12.460 25.261 1.00 15.00 H new ATOM 0 H2 LEU A -2 64.172 13.268 26.102 1.00 15.00 H new ATOM 0 H3 LEU A -2 64.443 11.614 26.374 1.00 15.00 H new ATOM 0 HA LEU A -2 63.444 12.804 23.799 1.00 15.00 H new ATOM 0 HB2 LEU A -2 65.054 10.722 23.865 1.00 15.00 H new ATOM 0 HB3 LEU A -2 63.769 9.895 24.722 1.00 15.00 H new ATOM 0 HG LEU A -2 63.122 11.338 22.140 1.00 15.00 H new ATOM 0 HD11 LEU A -2 63.639 9.258 20.892 1.00 15.00 H new ATOM 0 HD12 LEU A -2 65.103 9.934 21.644 1.00 15.00 H new ATOM 0 HD13 LEU A -2 64.292 8.530 22.378 1.00 15.00 H new ATOM 0 HD21 LEU A -2 61.419 9.537 22.003 1.00 15.00 H new ATOM 0 HD22 LEU A -2 62.070 8.810 23.492 1.00 15.00 H new ATOM 0 HD23 LEU A -2 61.300 10.414 23.548 1.00 15.00 H new ATOM 20 N GLU A -1 61.114 12.560 24.537 1.00 15.00 N ATOM 21 CA GLU A -1 59.706 12.480 25.034 1.00 15.00 C ATOM 22 C GLU A -1 58.918 11.446 24.225 1.00 15.00 C ATOM 23 O GLU A -1 58.396 10.489 24.770 1.00 15.00 O ATOM 24 CB GLU A -1 59.131 13.881 24.823 1.00 15.00 C ATOM 25 CG GLU A -1 57.766 13.984 25.507 1.00 15.00 C ATOM 26 CD GLU A -1 57.136 15.342 25.192 1.00 15.00 C ATOM 27 OE1 GLU A -1 57.696 16.343 25.607 1.00 15.00 O ATOM 28 OE2 GLU A -1 56.105 15.358 24.540 1.00 15.00 O ATOM 0 H GLU A -1 61.249 13.158 23.722 1.00 15.00 H new ATOM 0 HA GLU A -1 59.653 12.172 26.078 1.00 15.00 H new ATOM 0 HB2 GLU A -1 59.811 14.629 25.231 1.00 15.00 H new ATOM 0 HB3 GLU A -1 59.032 14.088 23.757 1.00 15.00 H new ATOM 0 HG2 GLU A -1 57.114 13.181 25.163 1.00 15.00 H new ATOM 0 HG3 GLU A -1 57.878 13.865 26.585 1.00 15.00 H new ATOM 35 N ASP A 0 58.829 11.635 22.931 1.00 15.00 N ATOM 36 CA ASP A 0 58.083 10.664 22.073 1.00 15.00 C ATOM 37 C ASP A 0 59.074 9.792 21.280 1.00 15.00 C ATOM 38 O ASP A 0 60.062 10.300 20.785 1.00 15.00 O ATOM 39 CB ASP A 0 57.255 11.533 21.125 1.00 15.00 C ATOM 40 CG ASP A 0 56.074 10.723 20.587 1.00 15.00 C ATOM 41 OD1 ASP A 0 54.958 10.998 20.995 1.00 15.00 O ATOM 42 OD2 ASP A 0 56.306 9.840 19.778 1.00 15.00 O ATOM 0 H ASP A 0 59.242 12.422 22.431 1.00 15.00 H new ATOM 0 HA ASP A 0 57.458 9.987 22.656 1.00 15.00 H new ATOM 0 HB2 ASP A 0 56.894 12.418 21.649 1.00 15.00 H new ATOM 0 HB3 ASP A 0 57.876 11.882 20.300 1.00 15.00 H new ATOM 47 N PRO A 1 58.786 8.504 21.178 1.00 15.00 N ATOM 48 CA PRO A 1 59.702 7.582 20.449 1.00 15.00 C ATOM 49 C PRO A 1 59.737 7.929 18.955 1.00 15.00 C ATOM 50 O PRO A 1 60.783 7.913 18.333 1.00 15.00 O ATOM 51 CB PRO A 1 59.095 6.196 20.674 1.00 15.00 C ATOM 52 CG PRO A 1 57.670 6.442 21.055 1.00 15.00 C ATOM 53 CD PRO A 1 57.613 7.793 21.712 1.00 15.00 C ATOM 0 HA PRO A 1 60.732 7.646 20.801 1.00 15.00 H new ATOM 0 HB2 PRO A 1 59.161 5.587 19.772 1.00 15.00 H new ATOM 0 HB3 PRO A 1 59.625 5.658 21.461 1.00 15.00 H new ATOM 0 HG2 PRO A 1 57.026 6.414 20.176 1.00 15.00 H new ATOM 0 HG3 PRO A 1 57.314 5.668 21.735 1.00 15.00 H new ATOM 0 HD2 PRO A 1 56.687 8.315 21.470 1.00 15.00 H new ATOM 0 HD3 PRO A 1 57.658 7.710 22.798 1.00 15.00 H new ATOM 61 N SER A 2 58.600 8.241 18.381 1.00 15.00 N ATOM 62 CA SER A 2 58.561 8.600 16.927 1.00 15.00 C ATOM 63 C SER A 2 59.241 9.953 16.700 1.00 15.00 C ATOM 64 O SER A 2 59.862 10.181 15.678 1.00 15.00 O ATOM 65 CB SER A 2 57.076 8.679 16.565 1.00 15.00 C ATOM 66 OG SER A 2 56.487 9.788 17.232 1.00 15.00 O ATOM 0 H SER A 2 57.697 8.263 18.856 1.00 15.00 H new ATOM 0 HA SER A 2 59.086 7.869 16.312 1.00 15.00 H new ATOM 0 HB2 SER A 2 56.958 8.784 15.487 1.00 15.00 H new ATOM 0 HB3 SER A 2 56.571 7.757 16.852 1.00 15.00 H new ATOM 0 HG SER A 2 56.416 9.593 18.190 1.00 15.00 H new ATOM 72 N GLY A 3 59.124 10.851 17.650 1.00 15.00 N ATOM 73 CA GLY A 3 59.783 12.185 17.519 1.00 15.00 C ATOM 74 C GLY A 3 61.301 12.026 17.649 1.00 15.00 C ATOM 75 O GLY A 3 62.061 12.733 17.014 1.00 15.00 O ATOM 0 H GLY A 3 58.598 10.714 18.513 1.00 15.00 H new ATOM 0 HA2 GLY A 3 59.536 12.631 16.555 1.00 15.00 H new ATOM 0 HA3 GLY A 3 59.411 12.862 18.288 1.00 15.00 H new ATOM 79 N GLY A 4 61.743 11.100 18.469 1.00 15.00 N ATOM 80 CA GLY A 4 63.212 10.896 18.665 1.00 15.00 C ATOM 81 C GLY A 4 63.835 10.351 17.377 1.00 15.00 C ATOM 82 O GLY A 4 64.937 10.718 17.011 1.00 15.00 O ATOM 0 H GLY A 4 61.146 10.476 19.012 1.00 15.00 H new ATOM 0 HA2 GLY A 4 63.686 11.838 18.939 1.00 15.00 H new ATOM 0 HA3 GLY A 4 63.386 10.201 19.487 1.00 15.00 H new ATOM 86 N THR A 5 63.138 9.477 16.691 1.00 15.00 N ATOM 87 CA THR A 5 63.685 8.892 15.428 1.00 15.00 C ATOM 88 C THR A 5 62.785 9.268 14.235 1.00 15.00 C ATOM 89 O THR A 5 61.605 8.972 14.253 1.00 15.00 O ATOM 90 CB THR A 5 63.661 7.380 15.657 1.00 15.00 C ATOM 91 OG1 THR A 5 64.278 7.081 16.901 1.00 15.00 O ATOM 92 CG2 THR A 5 64.418 6.679 14.529 1.00 15.00 C ATOM 0 H THR A 5 62.211 9.143 16.953 1.00 15.00 H new ATOM 0 HA THR A 5 64.686 9.258 15.200 1.00 15.00 H new ATOM 0 HB THR A 5 62.628 7.031 15.670 1.00 15.00 H new ATOM 0 HG1 THR A 5 64.262 6.112 17.050 1.00 15.00 H new ATOM 0 HG21 THR A 5 64.400 5.602 14.693 1.00 15.00 H new ATOM 0 HG22 THR A 5 63.943 6.908 13.575 1.00 15.00 H new ATOM 0 HG23 THR A 5 65.451 7.026 14.513 1.00 15.00 H new ATOM 100 N PRO A 6 63.360 9.908 13.229 1.00 15.00 N ATOM 101 CA PRO A 6 62.574 10.267 12.018 1.00 15.00 C ATOM 102 C PRO A 6 62.238 9.008 11.212 1.00 15.00 C ATOM 103 O PRO A 6 62.988 8.050 11.207 1.00 15.00 O ATOM 104 CB PRO A 6 63.506 11.186 11.229 1.00 15.00 C ATOM 105 CG PRO A 6 64.883 10.846 11.700 1.00 15.00 C ATOM 106 CD PRO A 6 64.762 10.353 13.117 1.00 15.00 C ATOM 0 HA PRO A 6 61.623 10.745 12.254 1.00 15.00 H new ATOM 0 HB2 PRO A 6 63.405 11.022 10.156 1.00 15.00 H new ATOM 0 HB3 PRO A 6 63.274 12.235 11.414 1.00 15.00 H new ATOM 0 HG2 PRO A 6 65.329 10.081 11.064 1.00 15.00 H new ATOM 0 HG3 PRO A 6 65.533 11.720 11.651 1.00 15.00 H new ATOM 0 HD2 PRO A 6 65.456 9.536 13.315 1.00 15.00 H new ATOM 0 HD3 PRO A 6 64.987 11.143 13.834 1.00 15.00 H new ATOM 114 N TYR A 7 61.115 9.006 10.532 1.00 15.00 N ATOM 115 CA TYR A 7 60.728 7.814 9.705 1.00 15.00 C ATOM 116 C TYR A 7 61.751 7.574 8.584 1.00 15.00 C ATOM 117 O TYR A 7 61.903 6.465 8.102 1.00 15.00 O ATOM 118 CB TYR A 7 59.344 8.136 9.127 1.00 15.00 C ATOM 119 CG TYR A 7 59.300 9.390 8.280 1.00 15.00 C ATOM 120 CD1 TYR A 7 58.878 10.616 8.850 1.00 15.00 C ATOM 121 CD2 TYR A 7 59.672 9.336 6.914 1.00 15.00 C ATOM 122 CE1 TYR A 7 58.828 11.787 8.056 1.00 15.00 C ATOM 123 CE2 TYR A 7 59.624 10.508 6.121 1.00 15.00 C ATOM 124 CZ TYR A 7 59.201 11.733 6.692 1.00 15.00 C ATOM 125 OH TYR A 7 59.155 12.874 5.918 1.00 15.00 O ATOM 0 H TYR A 7 60.449 9.778 10.513 1.00 15.00 H new ATOM 0 HA TYR A 7 60.705 6.903 10.302 1.00 15.00 H new ATOM 0 HB2 TYR A 7 59.010 7.292 8.524 1.00 15.00 H new ATOM 0 HB3 TYR A 7 58.635 8.241 9.949 1.00 15.00 H new ATOM 0 HD1 TYR A 7 58.594 10.658 9.891 1.00 15.00 H new ATOM 0 HD2 TYR A 7 59.992 8.401 6.478 1.00 15.00 H new ATOM 0 HE1 TYR A 7 58.505 12.721 8.491 1.00 15.00 H new ATOM 0 HE2 TYR A 7 59.910 10.468 5.080 1.00 15.00 H new ATOM 0 HH TYR A 7 59.444 12.662 5.006 1.00 15.00 H new ATOM 135 N ILE A 8 62.457 8.601 8.167 1.00 15.00 N ATOM 136 CA ILE A 8 63.548 8.401 7.154 1.00 15.00 C ATOM 137 C ILE A 8 64.654 7.529 7.769 1.00 15.00 C ATOM 138 O ILE A 8 65.002 7.682 8.926 1.00 15.00 O ATOM 139 CB ILE A 8 64.078 9.808 6.815 1.00 15.00 C ATOM 140 CG1 ILE A 8 62.948 10.662 6.227 1.00 15.00 C ATOM 141 CG2 ILE A 8 65.209 9.705 5.786 1.00 15.00 C ATOM 142 CD1 ILE A 8 63.379 12.129 6.196 1.00 15.00 C ATOM 0 H ILE A 8 62.327 9.563 8.481 1.00 15.00 H new ATOM 0 HA ILE A 8 63.193 7.897 6.255 1.00 15.00 H new ATOM 0 HB ILE A 8 64.453 10.271 7.728 1.00 15.00 H new ATOM 0 HG12 ILE A 8 62.707 10.322 5.220 1.00 15.00 H new ATOM 0 HG13 ILE A 8 62.044 10.550 6.826 1.00 15.00 H new ATOM 0 HG21 ILE A 8 65.579 10.703 5.551 1.00 15.00 H new ATOM 0 HG22 ILE A 8 66.021 9.104 6.196 1.00 15.00 H new ATOM 0 HG23 ILE A 8 64.833 9.234 4.878 1.00 15.00 H new ATOM 0 HD11 ILE A 8 62.576 12.736 5.778 1.00 15.00 H new ATOM 0 HD12 ILE A 8 63.598 12.465 7.209 1.00 15.00 H new ATOM 0 HD13 ILE A 8 64.271 12.233 5.578 1.00 15.00 H new ATOM 154 N GLY A 9 65.203 6.622 7.002 1.00 15.00 N ATOM 155 CA GLY A 9 66.178 5.637 7.563 1.00 15.00 C ATOM 156 C GLY A 9 65.468 4.327 7.955 1.00 15.00 C ATOM 157 O GLY A 9 66.109 3.390 8.395 1.00 15.00 O ATOM 0 H GLY A 9 65.017 6.520 6.004 1.00 15.00 H new ATOM 0 HA2 GLY A 9 66.955 5.429 6.828 1.00 15.00 H new ATOM 0 HA3 GLY A 9 66.671 6.064 8.436 1.00 15.00 H new ATOM 161 N SER A 10 64.161 4.245 7.803 1.00 15.00 N ATOM 162 CA SER A 10 63.448 2.957 8.089 1.00 15.00 C ATOM 163 C SER A 10 63.665 1.963 6.944 1.00 15.00 C ATOM 164 O SER A 10 64.011 2.342 5.843 1.00 15.00 O ATOM 165 CB SER A 10 61.968 3.326 8.202 1.00 15.00 C ATOM 166 OG SER A 10 61.787 4.212 9.299 1.00 15.00 O ATOM 0 H SER A 10 63.563 5.012 7.495 1.00 15.00 H new ATOM 0 HA SER A 10 63.817 2.482 8.998 1.00 15.00 H new ATOM 0 HB2 SER A 10 61.627 3.796 7.280 1.00 15.00 H new ATOM 0 HB3 SER A 10 61.367 2.428 8.342 1.00 15.00 H new ATOM 0 HG SER A 10 62.015 5.124 9.024 1.00 15.00 H new ATOM 172 N LYS A 11 63.464 0.692 7.204 1.00 15.00 N ATOM 173 CA LYS A 11 63.673 -0.346 6.144 1.00 15.00 C ATOM 174 C LYS A 11 62.396 -0.524 5.314 1.00 15.00 C ATOM 175 O LYS A 11 61.316 -0.701 5.851 1.00 15.00 O ATOM 176 CB LYS A 11 64.001 -1.631 6.907 1.00 15.00 C ATOM 177 CG LYS A 11 64.567 -2.674 5.941 1.00 15.00 C ATOM 178 CD LYS A 11 64.953 -3.933 6.722 1.00 15.00 C ATOM 179 CE LYS A 11 65.825 -4.834 5.845 1.00 15.00 C ATOM 180 NZ LYS A 11 66.711 -5.559 6.798 1.00 15.00 N ATOM 0 H LYS A 11 63.163 0.328 8.108 1.00 15.00 H new ATOM 0 HA LYS A 11 64.466 -0.071 5.448 1.00 15.00 H new ATOM 0 HB2 LYS A 11 64.723 -1.422 7.696 1.00 15.00 H new ATOM 0 HB3 LYS A 11 63.104 -2.018 7.390 1.00 15.00 H new ATOM 0 HG2 LYS A 11 63.828 -2.918 5.178 1.00 15.00 H new ATOM 0 HG3 LYS A 11 65.438 -2.272 5.424 1.00 15.00 H new ATOM 0 HD2 LYS A 11 65.492 -3.659 7.629 1.00 15.00 H new ATOM 0 HD3 LYS A 11 64.057 -4.469 7.033 1.00 15.00 H new ATOM 0 HE2 LYS A 11 65.217 -5.528 5.265 1.00 15.00 H new ATOM 0 HE3 LYS A 11 66.407 -4.248 5.133 1.00 15.00 H new ATOM 0 HZ1 LYS A 11 67.340 -6.198 6.270 1.00 15.00 H new ATOM 0 HZ2 LYS A 11 67.283 -4.873 7.331 1.00 15.00 H new ATOM 0 HZ3 LYS A 11 66.130 -6.113 7.459 1.00 15.00 H new ATOM 194 N ILE A 12 62.516 -0.480 4.007 1.00 15.00 N ATOM 195 CA ILE A 12 61.308 -0.586 3.131 1.00 15.00 C ATOM 196 C ILE A 12 61.565 -1.597 2.006 1.00 15.00 C ATOM 197 O ILE A 12 62.687 -1.780 1.566 1.00 15.00 O ATOM 198 CB ILE A 12 61.086 0.826 2.559 1.00 15.00 C ATOM 199 CG1 ILE A 12 60.826 1.812 3.707 1.00 15.00 C ATOM 200 CG2 ILE A 12 59.872 0.821 1.619 1.00 15.00 C ATOM 201 CD1 ILE A 12 60.820 3.245 3.168 1.00 15.00 C ATOM 0 H ILE A 12 63.401 -0.375 3.510 1.00 15.00 H new ATOM 0 HA ILE A 12 60.432 -0.933 3.679 1.00 15.00 H new ATOM 0 HB ILE A 12 61.975 1.129 2.006 1.00 15.00 H new ATOM 0 HG12 ILE A 12 59.871 1.588 4.182 1.00 15.00 H new ATOM 0 HG13 ILE A 12 61.595 1.705 4.472 1.00 15.00 H new ATOM 0 HG21 ILE A 12 59.719 1.822 1.217 1.00 15.00 H new ATOM 0 HG22 ILE A 12 60.049 0.124 0.800 1.00 15.00 H new ATOM 0 HG23 ILE A 12 58.985 0.513 2.172 1.00 15.00 H new ATOM 0 HD11 ILE A 12 60.635 3.941 3.986 1.00 15.00 H new ATOM 0 HD12 ILE A 12 61.786 3.467 2.714 1.00 15.00 H new ATOM 0 HD13 ILE A 12 60.035 3.349 2.419 1.00 15.00 H new ATOM 213 N SER A 13 60.525 -2.249 1.546 1.00 15.00 N ATOM 214 CA SER A 13 60.657 -3.182 0.389 1.00 15.00 C ATOM 215 C SER A 13 59.845 -2.651 -0.794 1.00 15.00 C ATOM 216 O SER A 13 58.702 -2.261 -0.643 1.00 15.00 O ATOM 217 CB SER A 13 60.083 -4.510 0.882 1.00 15.00 C ATOM 218 OG SER A 13 60.271 -5.503 -0.117 1.00 15.00 O ATOM 0 H SER A 13 59.582 -2.172 1.928 1.00 15.00 H new ATOM 0 HA SER A 13 61.688 -3.289 0.052 1.00 15.00 H new ATOM 0 HB2 SER A 13 60.575 -4.811 1.807 1.00 15.00 H new ATOM 0 HB3 SER A 13 59.022 -4.400 1.106 1.00 15.00 H new ATOM 0 HG SER A 13 59.405 -5.743 -0.507 1.00 15.00 H new ATOM 224 N LEU A 14 60.430 -2.633 -1.965 1.00 15.00 N ATOM 225 CA LEU A 14 59.741 -2.045 -3.151 1.00 15.00 C ATOM 226 C LEU A 14 59.628 -3.084 -4.270 1.00 15.00 C ATOM 227 O LEU A 14 60.565 -3.809 -4.548 1.00 15.00 O ATOM 228 CB LEU A 14 60.639 -0.887 -3.586 1.00 15.00 C ATOM 229 CG LEU A 14 59.823 0.118 -4.398 1.00 15.00 C ATOM 230 CD1 LEU A 14 58.925 0.925 -3.458 1.00 15.00 C ATOM 231 CD2 LEU A 14 60.773 1.066 -5.133 1.00 15.00 C ATOM 0 H LEU A 14 61.362 -3.003 -2.150 1.00 15.00 H new ATOM 0 HA LEU A 14 58.727 -1.717 -2.922 1.00 15.00 H new ATOM 0 HB2 LEU A 14 61.069 -0.399 -2.711 1.00 15.00 H new ATOM 0 HB3 LEU A 14 61.470 -1.263 -4.183 1.00 15.00 H new ATOM 0 HG LEU A 14 59.205 -0.414 -5.122 1.00 15.00 H new ATOM 0 HD11 LEU A 14 58.343 1.642 -4.037 1.00 15.00 H new ATOM 0 HD12 LEU A 14 58.250 0.250 -2.932 1.00 15.00 H new ATOM 0 HD13 LEU A 14 59.542 1.458 -2.735 1.00 15.00 H new ATOM 0 HD21 LEU A 14 60.194 1.784 -5.713 1.00 15.00 H new ATOM 0 HD22 LEU A 14 61.389 1.598 -4.408 1.00 15.00 H new ATOM 0 HD23 LEU A 14 61.414 0.492 -5.802 1.00 15.00 H new ATOM 243 N ILE A 15 58.488 -3.157 -4.909 1.00 15.00 N ATOM 244 CA ILE A 15 58.312 -4.111 -6.048 1.00 15.00 C ATOM 245 C ILE A 15 58.225 -3.316 -7.355 1.00 15.00 C ATOM 246 O ILE A 15 57.360 -2.473 -7.515 1.00 15.00 O ATOM 247 CB ILE A 15 56.996 -4.854 -5.763 1.00 15.00 C ATOM 248 CG1 ILE A 15 57.101 -5.603 -4.428 1.00 15.00 C ATOM 249 CG2 ILE A 15 56.716 -5.867 -6.880 1.00 15.00 C ATOM 250 CD1 ILE A 15 55.710 -6.065 -3.986 1.00 15.00 C ATOM 0 H ILE A 15 57.666 -2.594 -4.690 1.00 15.00 H new ATOM 0 HA ILE A 15 59.140 -4.813 -6.146 1.00 15.00 H new ATOM 0 HB ILE A 15 56.186 -4.127 -5.715 1.00 15.00 H new ATOM 0 HG12 ILE A 15 57.764 -6.462 -4.533 1.00 15.00 H new ATOM 0 HG13 ILE A 15 57.538 -4.954 -3.669 1.00 15.00 H new ATOM 0 HG21 ILE A 15 55.782 -6.390 -6.672 1.00 15.00 H new ATOM 0 HG22 ILE A 15 56.634 -5.344 -7.833 1.00 15.00 H new ATOM 0 HG23 ILE A 15 57.532 -6.588 -6.930 1.00 15.00 H new ATOM 0 HD11 ILE A 15 55.788 -6.597 -3.038 1.00 15.00 H new ATOM 0 HD12 ILE A 15 55.060 -5.198 -3.864 1.00 15.00 H new ATOM 0 HD13 ILE A 15 55.290 -6.730 -4.741 1.00 15.00 H new ATOM 262 N SER A 16 59.112 -3.586 -8.284 1.00 15.00 N ATOM 263 CA SER A 16 59.209 -2.738 -9.513 1.00 15.00 C ATOM 264 C SER A 16 58.358 -3.319 -10.648 1.00 15.00 C ATOM 265 O SER A 16 57.843 -4.418 -10.553 1.00 15.00 O ATOM 266 CB SER A 16 60.691 -2.755 -9.891 1.00 15.00 C ATOM 267 OG SER A 16 61.385 -1.789 -9.113 1.00 15.00 O ATOM 0 H SER A 16 59.775 -4.360 -8.243 1.00 15.00 H new ATOM 0 HA SER A 16 58.840 -1.727 -9.337 1.00 15.00 H new ATOM 0 HB2 SER A 16 61.111 -3.746 -9.720 1.00 15.00 H new ATOM 0 HB3 SER A 16 60.810 -2.538 -10.952 1.00 15.00 H new ATOM 0 HG SER A 16 62.335 -1.798 -9.352 1.00 15.00 H new ATOM 273 N LYS A 17 58.216 -2.584 -11.726 1.00 15.00 N ATOM 274 CA LYS A 17 57.358 -3.052 -12.870 1.00 15.00 C ATOM 275 C LYS A 17 57.872 -4.381 -13.450 1.00 15.00 C ATOM 276 O LYS A 17 57.142 -5.083 -14.127 1.00 15.00 O ATOM 277 CB LYS A 17 57.450 -1.944 -13.924 1.00 15.00 C ATOM 278 CG LYS A 17 56.411 -2.192 -15.021 1.00 15.00 C ATOM 279 CD LYS A 17 55.021 -1.815 -14.503 1.00 15.00 C ATOM 280 CE LYS A 17 53.992 -1.996 -15.621 1.00 15.00 C ATOM 281 NZ LYS A 17 52.690 -1.613 -15.009 1.00 15.00 N ATOM 0 H LYS A 17 58.658 -1.676 -11.866 1.00 15.00 H new ATOM 0 HA LYS A 17 56.333 -3.233 -12.546 1.00 15.00 H new ATOM 0 HB2 LYS A 17 57.280 -0.972 -13.461 1.00 15.00 H new ATOM 0 HB3 LYS A 17 58.451 -1.920 -14.355 1.00 15.00 H new ATOM 0 HG2 LYS A 17 56.653 -1.603 -15.906 1.00 15.00 H new ATOM 0 HG3 LYS A 17 56.427 -3.240 -15.321 1.00 15.00 H new ATOM 0 HD2 LYS A 17 54.758 -2.439 -13.648 1.00 15.00 H new ATOM 0 HD3 LYS A 17 55.019 -0.782 -14.156 1.00 15.00 H new ATOM 0 HE2 LYS A 17 54.226 -1.366 -16.479 1.00 15.00 H new ATOM 0 HE3 LYS A 17 53.973 -3.026 -15.978 1.00 15.00 H new ATOM 0 HZ1 LYS A 17 51.932 -1.711 -15.715 1.00 15.00 H new ATOM 0 HZ2 LYS A 17 52.491 -2.234 -14.199 1.00 15.00 H new ATOM 0 HZ3 LYS A 17 52.736 -0.626 -14.685 1.00 15.00 H new ATOM 295 N ALA A 18 59.113 -4.731 -13.195 1.00 15.00 N ATOM 296 CA ALA A 18 59.672 -6.001 -13.760 1.00 15.00 C ATOM 297 C ALA A 18 59.443 -7.185 -12.805 1.00 15.00 C ATOM 298 O ALA A 18 60.077 -8.215 -12.935 1.00 15.00 O ATOM 299 CB ALA A 18 61.170 -5.735 -13.924 1.00 15.00 C ATOM 0 H ALA A 18 59.761 -4.192 -12.621 1.00 15.00 H new ATOM 0 HA ALA A 18 59.190 -6.267 -14.701 1.00 15.00 H new ATOM 0 HB1 ALA A 18 61.654 -6.621 -14.335 1.00 15.00 H new ATOM 0 HB2 ALA A 18 61.318 -4.894 -14.601 1.00 15.00 H new ATOM 0 HB3 ALA A 18 61.606 -5.500 -12.953 1.00 15.00 H new ATOM 305 N GLU A 19 58.544 -7.049 -11.847 1.00 15.00 N ATOM 306 CA GLU A 19 58.218 -8.181 -10.910 1.00 15.00 C ATOM 307 C GLU A 19 59.477 -8.659 -10.173 1.00 15.00 C ATOM 308 O GLU A 19 59.582 -9.810 -9.793 1.00 15.00 O ATOM 309 CB GLU A 19 57.633 -9.305 -11.779 1.00 15.00 C ATOM 310 CG GLU A 19 56.334 -8.826 -12.433 1.00 15.00 C ATOM 311 CD GLU A 19 55.712 -9.970 -13.237 1.00 15.00 C ATOM 312 OE1 GLU A 19 55.680 -11.079 -12.728 1.00 15.00 O ATOM 313 OE2 GLU A 19 55.278 -9.718 -14.349 1.00 15.00 O ATOM 0 H GLU A 19 58.018 -6.192 -11.675 1.00 15.00 H new ATOM 0 HA GLU A 19 57.509 -7.866 -10.144 1.00 15.00 H new ATOM 0 HB2 GLU A 19 58.351 -9.597 -12.545 1.00 15.00 H new ATOM 0 HB3 GLU A 19 57.441 -10.188 -11.169 1.00 15.00 H new ATOM 0 HG2 GLU A 19 55.636 -8.483 -11.670 1.00 15.00 H new ATOM 0 HG3 GLU A 19 56.535 -7.977 -13.086 1.00 15.00 H new ATOM 320 N ILE A 20 60.428 -7.777 -9.975 1.00 15.00 N ATOM 321 CA ILE A 20 61.606 -8.110 -9.116 1.00 15.00 C ATOM 322 C ILE A 20 61.457 -7.396 -7.767 1.00 15.00 C ATOM 323 O ILE A 20 60.909 -6.309 -7.693 1.00 15.00 O ATOM 324 CB ILE A 20 62.833 -7.590 -9.882 1.00 15.00 C ATOM 325 CG1 ILE A 20 62.950 -8.317 -11.227 1.00 15.00 C ATOM 326 CG2 ILE A 20 64.105 -7.847 -9.064 1.00 15.00 C ATOM 327 CD1 ILE A 20 63.952 -7.584 -12.120 1.00 15.00 C ATOM 0 H ILE A 20 60.438 -6.838 -10.373 1.00 15.00 H new ATOM 0 HA ILE A 20 61.696 -9.178 -8.915 1.00 15.00 H new ATOM 0 HB ILE A 20 62.716 -6.520 -10.051 1.00 15.00 H new ATOM 0 HG12 ILE A 20 63.273 -9.346 -11.069 1.00 15.00 H new ATOM 0 HG13 ILE A 20 61.976 -8.360 -11.715 1.00 15.00 H new ATOM 0 HG21 ILE A 20 64.971 -7.476 -9.612 1.00 15.00 H new ATOM 0 HG22 ILE A 20 64.033 -7.330 -8.107 1.00 15.00 H new ATOM 0 HG23 ILE A 20 64.216 -8.917 -8.891 1.00 15.00 H new ATOM 0 HD11 ILE A 20 64.034 -8.102 -13.076 1.00 15.00 H new ATOM 0 HD12 ILE A 20 63.610 -6.563 -12.289 1.00 15.00 H new ATOM 0 HD13 ILE A 20 64.927 -7.564 -11.633 1.00 15.00 H new ATOM 339 N ARG A 21 61.942 -7.996 -6.708 1.00 15.00 N ATOM 340 CA ARG A 21 61.779 -7.388 -5.353 1.00 15.00 C ATOM 341 C ARG A 21 63.111 -6.811 -4.859 1.00 15.00 C ATOM 342 O ARG A 21 64.089 -7.521 -4.717 1.00 15.00 O ATOM 343 CB ARG A 21 61.326 -8.541 -4.455 1.00 15.00 C ATOM 344 CG ARG A 21 60.911 -7.996 -3.088 1.00 15.00 C ATOM 345 CD ARG A 21 60.500 -9.157 -2.176 1.00 15.00 C ATOM 346 NE ARG A 21 59.997 -8.515 -0.919 1.00 15.00 N ATOM 347 CZ ARG A 21 59.255 -9.183 -0.055 1.00 15.00 C ATOM 348 NH1 ARG A 21 58.930 -10.440 -0.252 1.00 15.00 N ATOM 349 NH2 ARG A 21 58.838 -8.580 1.024 1.00 15.00 N ATOM 0 H ARG A 21 62.445 -8.883 -6.725 1.00 15.00 H new ATOM 0 HA ARG A 21 61.064 -6.565 -5.355 1.00 15.00 H new ATOM 0 HB2 ARG A 21 60.491 -9.068 -4.916 1.00 15.00 H new ATOM 0 HB3 ARG A 21 62.134 -9.264 -4.339 1.00 15.00 H new ATOM 0 HG2 ARG A 21 61.736 -7.443 -2.640 1.00 15.00 H new ATOM 0 HG3 ARG A 21 60.082 -7.297 -3.200 1.00 15.00 H new ATOM 0 HD2 ARG A 21 59.727 -9.768 -2.642 1.00 15.00 H new ATOM 0 HD3 ARG A 21 61.345 -9.814 -1.971 1.00 15.00 H new ATOM 0 HE ARG A 21 60.233 -7.541 -0.727 1.00 15.00 H new ATOM 0 HH11 ARG A 21 59.252 -10.925 -1.090 1.00 15.00 H new ATOM 0 HH12 ARG A 21 58.355 -10.932 0.433 1.00 15.00 H new ATOM 0 HH21 ARG A 21 59.086 -7.605 1.191 1.00 15.00 H new ATOM 0 HH22 ARG A 21 58.264 -9.084 1.700 1.00 15.00 H new ATOM 363 N TYR A 22 63.145 -5.526 -4.601 1.00 15.00 N ATOM 364 CA TYR A 22 64.381 -4.889 -4.050 1.00 15.00 C ATOM 365 C TYR A 22 64.135 -4.445 -2.606 1.00 15.00 C ATOM 366 O TYR A 22 63.095 -3.902 -2.294 1.00 15.00 O ATOM 367 CB TYR A 22 64.629 -3.666 -4.933 1.00 15.00 C ATOM 368 CG TYR A 22 65.044 -3.994 -6.347 1.00 15.00 C ATOM 369 CD1 TYR A 22 66.416 -4.143 -6.665 1.00 15.00 C ATOM 370 CD2 TYR A 22 64.062 -4.144 -7.358 1.00 15.00 C ATOM 371 CE1 TYR A 22 66.806 -4.439 -7.994 1.00 15.00 C ATOM 372 CE2 TYR A 22 64.452 -4.441 -8.685 1.00 15.00 C ATOM 373 CZ TYR A 22 65.824 -4.589 -9.005 1.00 15.00 C ATOM 374 OH TYR A 22 66.205 -4.877 -10.299 1.00 15.00 O ATOM 0 H TYR A 22 62.364 -4.887 -4.750 1.00 15.00 H new ATOM 0 HA TYR A 22 65.230 -5.573 -4.047 1.00 15.00 H new ATOM 0 HB2 TYR A 22 63.720 -3.065 -4.964 1.00 15.00 H new ATOM 0 HB3 TYR A 22 65.403 -3.051 -4.473 1.00 15.00 H new ATOM 0 HD1 TYR A 22 67.164 -4.031 -5.895 1.00 15.00 H new ATOM 0 HD2 TYR A 22 63.016 -4.032 -7.115 1.00 15.00 H new ATOM 0 HE1 TYR A 22 67.852 -4.550 -8.237 1.00 15.00 H new ATOM 0 HE2 TYR A 22 63.703 -4.555 -9.455 1.00 15.00 H new ATOM 0 HH TYR A 22 65.409 -4.948 -10.866 1.00 15.00 H new ATOM 384 N GLU A 23 65.078 -4.672 -1.728 1.00 15.00 N ATOM 385 CA GLU A 23 64.944 -4.158 -0.329 1.00 15.00 C ATOM 386 C GLU A 23 66.117 -3.235 0.002 1.00 15.00 C ATOM 387 O GLU A 23 67.244 -3.495 -0.375 1.00 15.00 O ATOM 388 CB GLU A 23 64.974 -5.405 0.556 1.00 15.00 C ATOM 389 CG GLU A 23 64.629 -5.022 1.997 1.00 15.00 C ATOM 390 CD GLU A 23 64.738 -6.256 2.894 1.00 15.00 C ATOM 391 OE1 GLU A 23 63.842 -6.462 3.696 1.00 15.00 O ATOM 392 OE2 GLU A 23 65.715 -6.974 2.764 1.00 15.00 O ATOM 0 H GLU A 23 65.935 -5.191 -1.918 1.00 15.00 H new ATOM 0 HA GLU A 23 64.031 -3.580 -0.183 1.00 15.00 H new ATOM 0 HB2 GLU A 23 64.263 -6.143 0.185 1.00 15.00 H new ATOM 0 HB3 GLU A 23 65.961 -5.866 0.518 1.00 15.00 H new ATOM 0 HG2 GLU A 23 65.305 -4.243 2.349 1.00 15.00 H new ATOM 0 HG3 GLU A 23 63.620 -4.613 2.044 1.00 15.00 H new ATOM 399 N GLY A 24 65.855 -2.163 0.708 1.00 15.00 N ATOM 400 CA GLY A 24 66.940 -1.200 1.063 1.00 15.00 C ATOM 401 C GLY A 24 66.429 -0.254 2.148 1.00 15.00 C ATOM 402 O GLY A 24 65.303 -0.372 2.596 1.00 15.00 O ATOM 0 H GLY A 24 64.929 -1.913 1.055 1.00 15.00 H new ATOM 0 HA2 GLY A 24 67.820 -1.738 1.416 1.00 15.00 H new ATOM 0 HA3 GLY A 24 67.244 -0.634 0.183 1.00 15.00 H new ATOM 406 N ILE A 25 67.239 0.683 2.576 1.00 15.00 N ATOM 407 CA ILE A 25 66.786 1.634 3.640 1.00 15.00 C ATOM 408 C ILE A 25 66.486 3.001 3.017 1.00 15.00 C ATOM 409 O ILE A 25 67.219 3.481 2.173 1.00 15.00 O ATOM 410 CB ILE A 25 67.947 1.736 4.646 1.00 15.00 C ATOM 411 CG1 ILE A 25 68.396 0.332 5.109 1.00 15.00 C ATOM 412 CG2 ILE A 25 67.493 2.551 5.864 1.00 15.00 C ATOM 413 CD1 ILE A 25 67.225 -0.433 5.744 1.00 15.00 C ATOM 0 H ILE A 25 68.190 0.831 2.237 1.00 15.00 H new ATOM 0 HA ILE A 25 65.875 1.292 4.131 1.00 15.00 H new ATOM 0 HB ILE A 25 68.789 2.228 4.158 1.00 15.00 H new ATOM 0 HG12 ILE A 25 68.785 -0.229 4.259 1.00 15.00 H new ATOM 0 HG13 ILE A 25 69.209 0.424 5.829 1.00 15.00 H new ATOM 0 HG21 ILE A 25 68.313 2.625 6.578 1.00 15.00 H new ATOM 0 HG22 ILE A 25 67.199 3.551 5.544 1.00 15.00 H new ATOM 0 HG23 ILE A 25 66.644 2.057 6.336 1.00 15.00 H new ATOM 0 HD11 ILE A 25 67.564 -1.419 6.062 1.00 15.00 H new ATOM 0 HD12 ILE A 25 66.855 0.120 6.607 1.00 15.00 H new ATOM 0 HD13 ILE A 25 66.424 -0.544 5.013 1.00 15.00 H new ATOM 425 N LEU A 26 65.412 3.626 3.433 1.00 15.00 N ATOM 426 CA LEU A 26 65.012 4.940 2.830 1.00 15.00 C ATOM 427 C LEU A 26 66.049 6.013 3.168 1.00 15.00 C ATOM 428 O LEU A 26 66.146 6.449 4.299 1.00 15.00 O ATOM 429 CB LEU A 26 63.663 5.278 3.473 1.00 15.00 C ATOM 430 CG LEU A 26 62.928 6.313 2.621 1.00 15.00 C ATOM 431 CD1 LEU A 26 62.337 5.635 1.382 1.00 15.00 C ATOM 432 CD2 LEU A 26 61.799 6.934 3.447 1.00 15.00 C ATOM 0 H LEU A 26 64.792 3.283 4.167 1.00 15.00 H new ATOM 0 HA LEU A 26 64.945 4.892 1.743 1.00 15.00 H new ATOM 0 HB2 LEU A 26 63.059 4.376 3.567 1.00 15.00 H new ATOM 0 HB3 LEU A 26 63.817 5.666 4.480 1.00 15.00 H new ATOM 0 HG LEU A 26 63.627 7.089 2.308 1.00 15.00 H new ATOM 0 HD11 LEU A 26 61.814 6.375 0.777 1.00 15.00 H new ATOM 0 HD12 LEU A 26 63.139 5.187 0.795 1.00 15.00 H new ATOM 0 HD13 LEU A 26 61.637 4.859 1.691 1.00 15.00 H new ATOM 0 HD21 LEU A 26 61.271 7.673 2.844 1.00 15.00 H new ATOM 0 HD22 LEU A 26 61.103 6.154 3.756 1.00 15.00 H new ATOM 0 HD23 LEU A 26 62.218 7.418 4.330 1.00 15.00 H new ATOM 444 N TYR A 27 66.815 6.439 2.194 1.00 15.00 N ATOM 445 CA TYR A 27 67.919 7.409 2.468 1.00 15.00 C ATOM 446 C TYR A 27 67.437 8.846 2.250 1.00 15.00 C ATOM 447 O TYR A 27 67.588 9.694 3.110 1.00 15.00 O ATOM 448 CB TYR A 27 69.018 7.053 1.465 1.00 15.00 C ATOM 449 CG TYR A 27 70.265 7.895 1.610 1.00 15.00 C ATOM 450 CD1 TYR A 27 70.989 7.881 2.826 1.00 15.00 C ATOM 451 CD2 TYR A 27 70.706 8.697 0.530 1.00 15.00 C ATOM 452 CE1 TYR A 27 72.156 8.672 2.963 1.00 15.00 C ATOM 453 CE2 TYR A 27 71.873 9.488 0.667 1.00 15.00 C ATOM 454 CZ TYR A 27 72.599 9.476 1.884 1.00 15.00 C ATOM 455 OH TYR A 27 73.735 10.246 2.017 1.00 15.00 O ATOM 0 H TYR A 27 66.723 6.156 1.219 1.00 15.00 H new ATOM 0 HA TYR A 27 68.271 7.349 3.498 1.00 15.00 H new ATOM 0 HB2 TYR A 27 69.283 6.003 1.586 1.00 15.00 H new ATOM 0 HB3 TYR A 27 68.627 7.169 0.454 1.00 15.00 H new ATOM 0 HD1 TYR A 27 70.652 7.268 3.649 1.00 15.00 H new ATOM 0 HD2 TYR A 27 70.153 8.706 -0.398 1.00 15.00 H new ATOM 0 HE1 TYR A 27 72.709 8.662 3.891 1.00 15.00 H new ATOM 0 HE2 TYR A 27 72.210 10.101 -0.156 1.00 15.00 H new ATOM 0 HH TYR A 27 73.898 10.735 1.183 1.00 15.00 H new ATOM 465 N THR A 28 66.859 9.124 1.106 1.00 15.00 N ATOM 466 CA THR A 28 66.393 10.516 0.816 1.00 15.00 C ATOM 467 C THR A 28 65.065 10.489 0.058 1.00 15.00 C ATOM 468 O THR A 28 64.850 9.656 -0.803 1.00 15.00 O ATOM 469 CB THR A 28 67.493 11.136 -0.052 1.00 15.00 C ATOM 470 OG1 THR A 28 67.856 10.225 -1.080 1.00 15.00 O ATOM 471 CG2 THR A 28 68.715 11.447 0.814 1.00 15.00 C ATOM 0 H THR A 28 66.690 8.447 0.362 1.00 15.00 H new ATOM 0 HA THR A 28 66.224 11.087 1.729 1.00 15.00 H new ATOM 0 HB THR A 28 67.124 12.059 -0.500 1.00 15.00 H new ATOM 0 HG1 THR A 28 68.437 10.677 -1.727 1.00 15.00 H new ATOM 0 HG21 THR A 28 69.497 11.888 0.195 1.00 15.00 H new ATOM 0 HG22 THR A 28 68.435 12.149 1.600 1.00 15.00 H new ATOM 0 HG23 THR A 28 69.085 10.526 1.265 1.00 15.00 H new ATOM 479 N ILE A 29 64.176 11.400 0.374 1.00 15.00 N ATOM 480 CA ILE A 29 62.837 11.421 -0.294 1.00 15.00 C ATOM 481 C ILE A 29 62.664 12.739 -1.062 1.00 15.00 C ATOM 482 O ILE A 29 62.793 13.812 -0.500 1.00 15.00 O ATOM 483 CB ILE A 29 61.811 11.319 0.848 1.00 15.00 C ATOM 484 CG1 ILE A 29 62.035 10.024 1.643 1.00 15.00 C ATOM 485 CG2 ILE A 29 60.391 11.307 0.271 1.00 15.00 C ATOM 486 CD1 ILE A 29 61.231 10.078 2.944 1.00 15.00 C ATOM 0 H ILE A 29 64.321 12.133 1.069 1.00 15.00 H new ATOM 0 HA ILE A 29 62.717 10.610 -1.012 1.00 15.00 H new ATOM 0 HB ILE A 29 61.936 12.179 1.507 1.00 15.00 H new ATOM 0 HG12 ILE A 29 61.729 9.163 1.049 1.00 15.00 H new ATOM 0 HG13 ILE A 29 63.095 9.899 1.863 1.00 15.00 H new ATOM 0 HG21 ILE A 29 59.669 11.235 1.084 1.00 15.00 H new ATOM 0 HG22 ILE A 29 60.218 12.227 -0.288 1.00 15.00 H new ATOM 0 HG23 ILE A 29 60.276 10.451 -0.394 1.00 15.00 H new ATOM 0 HD11 ILE A 29 61.390 9.159 3.508 1.00 15.00 H new ATOM 0 HD12 ILE A 29 61.559 10.930 3.539 1.00 15.00 H new ATOM 0 HD13 ILE A 29 60.171 10.183 2.713 1.00 15.00 H new ATOM 498 N ASP A 30 62.371 12.664 -2.338 1.00 15.00 N ATOM 499 CA ASP A 30 62.138 13.903 -3.139 1.00 15.00 C ATOM 500 C ASP A 30 60.668 13.984 -3.558 1.00 15.00 C ATOM 501 O ASP A 30 60.261 13.378 -4.533 1.00 15.00 O ATOM 502 CB ASP A 30 63.040 13.759 -4.366 1.00 15.00 C ATOM 503 CG ASP A 30 63.093 15.089 -5.120 1.00 15.00 C ATOM 504 OD1 ASP A 30 62.269 15.281 -5.999 1.00 15.00 O ATOM 505 OD2 ASP A 30 63.955 15.892 -4.806 1.00 15.00 O ATOM 0 H ASP A 30 62.283 11.792 -2.860 1.00 15.00 H new ATOM 0 HA ASP A 30 62.362 14.810 -2.577 1.00 15.00 H new ATOM 0 HB2 ASP A 30 64.043 13.462 -4.060 1.00 15.00 H new ATOM 0 HB3 ASP A 30 62.660 12.973 -5.019 1.00 15.00 H new ATOM 510 N THR A 31 59.874 14.726 -2.826 1.00 15.00 N ATOM 511 CA THR A 31 58.411 14.807 -3.138 1.00 15.00 C ATOM 512 C THR A 31 58.184 15.580 -4.441 1.00 15.00 C ATOM 513 O THR A 31 57.306 15.255 -5.217 1.00 15.00 O ATOM 514 CB THR A 31 57.782 15.552 -1.957 1.00 15.00 C ATOM 515 OG1 THR A 31 58.211 14.955 -0.741 1.00 15.00 O ATOM 516 CG2 THR A 31 56.258 15.478 -2.055 1.00 15.00 C ATOM 0 H THR A 31 60.175 15.280 -2.024 1.00 15.00 H new ATOM 0 HA THR A 31 57.971 13.819 -3.274 1.00 15.00 H new ATOM 0 HB THR A 31 58.093 16.597 -1.979 1.00 15.00 H new ATOM 0 HG1 THR A 31 57.811 15.431 0.016 1.00 15.00 H new ATOM 0 HG21 THR A 31 55.813 16.009 -1.213 1.00 15.00 H new ATOM 0 HG22 THR A 31 55.931 15.937 -2.988 1.00 15.00 H new ATOM 0 HG23 THR A 31 55.942 14.435 -2.034 1.00 15.00 H new ATOM 524 N GLU A 32 58.978 16.594 -4.689 1.00 15.00 N ATOM 525 CA GLU A 32 58.706 17.514 -5.845 1.00 15.00 C ATOM 526 C GLU A 32 58.697 16.744 -7.173 1.00 15.00 C ATOM 527 O GLU A 32 58.011 17.118 -8.107 1.00 15.00 O ATOM 528 CB GLU A 32 59.849 18.533 -5.833 1.00 15.00 C ATOM 529 CG GLU A 32 59.742 19.406 -4.580 1.00 15.00 C ATOM 530 CD GLU A 32 60.840 20.473 -4.606 1.00 15.00 C ATOM 531 OE1 GLU A 32 60.517 21.620 -4.863 1.00 15.00 O ATOM 532 OE2 GLU A 32 61.984 20.122 -4.370 1.00 15.00 O ATOM 0 H GLU A 32 59.806 16.827 -4.140 1.00 15.00 H new ATOM 0 HA GLU A 32 57.729 17.989 -5.752 1.00 15.00 H new ATOM 0 HB2 GLU A 32 60.810 18.018 -5.849 1.00 15.00 H new ATOM 0 HB3 GLU A 32 59.805 19.155 -6.727 1.00 15.00 H new ATOM 0 HG2 GLU A 32 58.761 19.879 -4.536 1.00 15.00 H new ATOM 0 HG3 GLU A 32 59.839 18.791 -3.686 1.00 15.00 H new ATOM 539 N ASN A 33 59.451 15.674 -7.261 1.00 15.00 N ATOM 540 CA ASN A 33 59.536 14.914 -8.550 1.00 15.00 C ATOM 541 C ASN A 33 58.960 13.495 -8.406 1.00 15.00 C ATOM 542 O ASN A 33 59.167 12.655 -9.262 1.00 15.00 O ATOM 543 CB ASN A 33 61.032 14.847 -8.868 1.00 15.00 C ATOM 544 CG ASN A 33 61.561 16.250 -9.182 1.00 15.00 C ATOM 545 OD1 ASN A 33 60.838 17.091 -9.684 1.00 15.00 O ATOM 546 ND2 ASN A 33 62.802 16.541 -8.906 1.00 15.00 N ATOM 0 H ASN A 33 60.011 15.294 -6.497 1.00 15.00 H new ATOM 0 HA ASN A 33 58.959 15.399 -9.338 1.00 15.00 H new ATOM 0 HB2 ASN A 33 61.574 14.425 -8.022 1.00 15.00 H new ATOM 0 HB3 ASN A 33 61.203 14.186 -9.717 1.00 15.00 H new ATOM 0 HD21 ASN A 33 63.165 17.472 -9.111 1.00 15.00 H new ATOM 0 HD22 ASN A 33 63.409 15.838 -8.485 1.00 15.00 H new ATOM 553 N SER A 34 58.235 13.218 -7.337 1.00 15.00 N ATOM 554 CA SER A 34 57.698 11.831 -7.097 1.00 15.00 C ATOM 555 C SER A 34 58.808 10.772 -7.239 1.00 15.00 C ATOM 556 O SER A 34 58.630 9.755 -7.887 1.00 15.00 O ATOM 557 CB SER A 34 56.613 11.628 -8.160 1.00 15.00 C ATOM 558 OG SER A 34 55.427 12.296 -7.752 1.00 15.00 O ATOM 0 H SER A 34 57.992 13.899 -6.617 1.00 15.00 H new ATOM 0 HA SER A 34 57.304 11.723 -6.087 1.00 15.00 H new ATOM 0 HB2 SER A 34 56.951 12.017 -9.121 1.00 15.00 H new ATOM 0 HB3 SER A 34 56.417 10.565 -8.298 1.00 15.00 H new ATOM 0 HG SER A 34 54.731 12.170 -8.430 1.00 15.00 H new ATOM 564 N THR A 35 59.949 11.007 -6.635 1.00 15.00 N ATOM 565 CA THR A 35 61.089 10.046 -6.767 1.00 15.00 C ATOM 566 C THR A 35 61.684 9.727 -5.392 1.00 15.00 C ATOM 567 O THR A 35 61.662 10.542 -4.489 1.00 15.00 O ATOM 568 CB THR A 35 62.121 10.766 -7.641 1.00 15.00 C ATOM 569 OG1 THR A 35 62.304 12.091 -7.163 1.00 15.00 O ATOM 570 CG2 THR A 35 61.640 10.807 -9.095 1.00 15.00 C ATOM 0 H THR A 35 60.140 11.824 -6.055 1.00 15.00 H new ATOM 0 HA THR A 35 60.774 9.098 -7.203 1.00 15.00 H new ATOM 0 HB THR A 35 63.067 10.227 -7.595 1.00 15.00 H new ATOM 0 HG1 THR A 35 62.965 12.552 -7.721 1.00 15.00 H new ATOM 0 HG21 THR A 35 62.380 11.321 -9.709 1.00 15.00 H new ATOM 0 HG22 THR A 35 61.507 9.790 -9.463 1.00 15.00 H new ATOM 0 HG23 THR A 35 60.691 11.340 -9.149 1.00 15.00 H new ATOM 578 N VAL A 36 62.217 8.540 -5.233 1.00 15.00 N ATOM 579 CA VAL A 36 62.823 8.147 -3.922 1.00 15.00 C ATOM 580 C VAL A 36 64.192 7.495 -4.159 1.00 15.00 C ATOM 581 O VAL A 36 64.368 6.733 -5.090 1.00 15.00 O ATOM 582 CB VAL A 36 61.836 7.142 -3.305 1.00 15.00 C ATOM 583 CG1 VAL A 36 62.352 6.674 -1.941 1.00 15.00 C ATOM 584 CG2 VAL A 36 60.468 7.808 -3.116 1.00 15.00 C ATOM 0 H VAL A 36 62.259 7.823 -5.958 1.00 15.00 H new ATOM 0 HA VAL A 36 62.985 9.001 -3.264 1.00 15.00 H new ATOM 0 HB VAL A 36 61.742 6.287 -3.974 1.00 15.00 H new ATOM 0 HG11 VAL A 36 61.648 5.962 -1.510 1.00 15.00 H new ATOM 0 HG12 VAL A 36 63.323 6.194 -2.064 1.00 15.00 H new ATOM 0 HG13 VAL A 36 62.453 7.532 -1.276 1.00 15.00 H new ATOM 0 HG21 VAL A 36 59.772 7.092 -2.679 1.00 15.00 H new ATOM 0 HG22 VAL A 36 60.570 8.667 -2.452 1.00 15.00 H new ATOM 0 HG23 VAL A 36 60.088 8.139 -4.082 1.00 15.00 H new ATOM 594 N ALA A 37 65.155 7.793 -3.321 1.00 15.00 N ATOM 595 CA ALA A 37 66.506 7.166 -3.463 1.00 15.00 C ATOM 596 C ALA A 37 66.773 6.226 -2.283 1.00 15.00 C ATOM 597 O ALA A 37 66.607 6.602 -1.135 1.00 15.00 O ATOM 598 CB ALA A 37 67.502 8.332 -3.462 1.00 15.00 C ATOM 0 H ALA A 37 65.063 8.446 -2.542 1.00 15.00 H new ATOM 0 HA ALA A 37 66.589 6.571 -4.373 1.00 15.00 H new ATOM 0 HB1 ALA A 37 68.516 7.945 -3.563 1.00 15.00 H new ATOM 0 HB2 ALA A 37 67.283 8.998 -4.297 1.00 15.00 H new ATOM 0 HB3 ALA A 37 67.416 8.883 -2.526 1.00 15.00 H new ATOM 604 N LEU A 38 67.189 5.015 -2.564 1.00 15.00 N ATOM 605 CA LEU A 38 67.449 4.026 -1.472 1.00 15.00 C ATOM 606 C LEU A 38 68.929 3.643 -1.463 1.00 15.00 C ATOM 607 O LEU A 38 69.528 3.437 -2.503 1.00 15.00 O ATOM 608 CB LEU A 38 66.591 2.800 -1.814 1.00 15.00 C ATOM 609 CG LEU A 38 65.103 3.171 -1.831 1.00 15.00 C ATOM 610 CD1 LEU A 38 64.288 1.963 -2.300 1.00 15.00 C ATOM 611 CD2 LEU A 38 64.652 3.567 -0.422 1.00 15.00 C ATOM 0 H LEU A 38 67.360 4.668 -3.508 1.00 15.00 H new ATOM 0 HA LEU A 38 67.205 4.429 -0.489 1.00 15.00 H new ATOM 0 HB2 LEU A 38 66.884 2.404 -2.786 1.00 15.00 H new ATOM 0 HB3 LEU A 38 66.766 2.011 -1.083 1.00 15.00 H new ATOM 0 HG LEU A 38 64.947 4.010 -2.509 1.00 15.00 H new ATOM 0 HD11 LEU A 38 63.229 2.222 -2.314 1.00 15.00 H new ATOM 0 HD12 LEU A 38 64.605 1.678 -3.303 1.00 15.00 H new ATOM 0 HD13 LEU A 38 64.449 1.128 -1.617 1.00 15.00 H new ATOM 0 HD21 LEU A 38 63.594 3.830 -0.439 1.00 15.00 H new ATOM 0 HD22 LEU A 38 64.807 2.730 0.258 1.00 15.00 H new ATOM 0 HD23 LEU A 38 65.233 4.424 -0.081 1.00 15.00 H new ATOM 623 N ALA A 39 69.519 3.545 -0.297 1.00 15.00 N ATOM 624 CA ALA A 39 70.959 3.158 -0.207 1.00 15.00 C ATOM 625 C ALA A 39 71.091 1.803 0.490 1.00 15.00 C ATOM 626 O ALA A 39 70.176 1.349 1.155 1.00 15.00 O ATOM 627 CB ALA A 39 71.615 4.259 0.627 1.00 15.00 C ATOM 0 H ALA A 39 69.063 3.717 0.599 1.00 15.00 H new ATOM 0 HA ALA A 39 71.426 3.061 -1.187 1.00 15.00 H new ATOM 0 HB1 ALA A 39 72.678 4.046 0.739 1.00 15.00 H new ATOM 0 HB2 ALA A 39 71.488 5.219 0.127 1.00 15.00 H new ATOM 0 HB3 ALA A 39 71.147 4.298 1.611 1.00 15.00 H new ATOM 633 N LYS A 40 72.228 1.152 0.341 1.00 15.00 N ATOM 634 CA LYS A 40 72.431 -0.212 0.945 1.00 15.00 C ATOM 635 C LYS A 40 71.278 -1.152 0.549 1.00 15.00 C ATOM 636 O LYS A 40 70.551 -1.651 1.390 1.00 15.00 O ATOM 637 CB LYS A 40 72.467 0.008 2.463 1.00 15.00 C ATOM 638 CG LYS A 40 73.702 0.833 2.832 1.00 15.00 C ATOM 639 CD LYS A 40 73.802 0.952 4.354 1.00 15.00 C ATOM 640 CE LYS A 40 74.951 1.893 4.720 1.00 15.00 C ATOM 641 NZ LYS A 40 75.271 1.575 6.139 1.00 15.00 N ATOM 0 H LYS A 40 73.030 1.511 -0.177 1.00 15.00 H new ATOM 0 HA LYS A 40 73.350 -0.680 0.592 1.00 15.00 H new ATOM 0 HB2 LYS A 40 71.563 0.523 2.788 1.00 15.00 H new ATOM 0 HB3 LYS A 40 72.490 -0.952 2.979 1.00 15.00 H new ATOM 0 HG2 LYS A 40 74.600 0.360 2.434 1.00 15.00 H new ATOM 0 HG3 LYS A 40 73.638 1.824 2.383 1.00 15.00 H new ATOM 0 HD2 LYS A 40 72.865 1.330 4.762 1.00 15.00 H new ATOM 0 HD3 LYS A 40 73.968 -0.031 4.796 1.00 15.00 H new ATOM 0 HE2 LYS A 40 75.814 1.731 4.075 1.00 15.00 H new ATOM 0 HE3 LYS A 40 74.658 2.937 4.606 1.00 15.00 H new ATOM 0 HZ1 LYS A 40 76.052 2.181 6.463 1.00 15.00 H new ATOM 0 HZ2 LYS A 40 74.432 1.745 6.730 1.00 15.00 H new ATOM 0 HZ3 LYS A 40 75.553 0.577 6.216 1.00 15.00 H new ATOM 655 N VAL A 41 71.116 -1.390 -0.730 1.00 15.00 N ATOM 656 CA VAL A 41 69.933 -2.169 -1.211 1.00 15.00 C ATOM 657 C VAL A 41 70.391 -3.405 -1.998 1.00 15.00 C ATOM 658 O VAL A 41 71.397 -3.378 -2.682 1.00 15.00 O ATOM 659 CB VAL A 41 69.145 -1.188 -2.100 1.00 15.00 C ATOM 660 CG1 VAL A 41 69.975 -0.786 -3.326 1.00 15.00 C ATOM 661 CG2 VAL A 41 67.840 -1.845 -2.564 1.00 15.00 C ATOM 0 H VAL A 41 71.753 -1.078 -1.463 1.00 15.00 H new ATOM 0 HA VAL A 41 69.318 -2.544 -0.393 1.00 15.00 H new ATOM 0 HB VAL A 41 68.921 -0.295 -1.517 1.00 15.00 H new ATOM 0 HG11 VAL A 41 69.402 -0.093 -3.942 1.00 15.00 H new ATOM 0 HG12 VAL A 41 70.897 -0.304 -2.999 1.00 15.00 H new ATOM 0 HG13 VAL A 41 70.217 -1.675 -3.909 1.00 15.00 H new ATOM 0 HG21 VAL A 41 67.285 -1.148 -3.192 1.00 15.00 H new ATOM 0 HG22 VAL A 41 68.069 -2.745 -3.134 1.00 15.00 H new ATOM 0 HG23 VAL A 41 67.237 -2.109 -1.695 1.00 15.00 H new ATOM 671 N ARG A 42 69.653 -4.482 -1.898 1.00 15.00 N ATOM 672 CA ARG A 42 70.012 -5.724 -2.646 1.00 15.00 C ATOM 673 C ARG A 42 68.774 -6.289 -3.347 1.00 15.00 C ATOM 674 O ARG A 42 67.663 -6.137 -2.874 1.00 15.00 O ATOM 675 CB ARG A 42 70.516 -6.698 -1.581 1.00 15.00 C ATOM 676 CG ARG A 42 71.846 -6.195 -1.016 1.00 15.00 C ATOM 677 CD ARG A 42 72.375 -7.199 0.014 1.00 15.00 C ATOM 678 NE ARG A 42 72.766 -8.411 -0.777 1.00 15.00 N ATOM 679 CZ ARG A 42 72.937 -9.585 -0.198 1.00 15.00 C ATOM 680 NH1 ARG A 42 72.782 -9.746 1.096 1.00 15.00 N ATOM 681 NH2 ARG A 42 73.272 -10.611 -0.931 1.00 15.00 N ATOM 0 H ARG A 42 68.811 -4.554 -1.326 1.00 15.00 H new ATOM 0 HA ARG A 42 70.761 -5.542 -3.416 1.00 15.00 H new ATOM 0 HB2 ARG A 42 69.781 -6.791 -0.781 1.00 15.00 H new ATOM 0 HB3 ARG A 42 70.644 -7.691 -2.013 1.00 15.00 H new ATOM 0 HG2 ARG A 42 72.570 -6.067 -1.821 1.00 15.00 H new ATOM 0 HG3 ARG A 42 71.710 -5.218 -0.551 1.00 15.00 H new ATOM 0 HD2 ARG A 42 73.228 -6.792 0.557 1.00 15.00 H new ATOM 0 HD3 ARG A 42 71.612 -7.442 0.754 1.00 15.00 H new ATOM 0 HE ARG A 42 72.903 -8.327 -1.784 1.00 15.00 H new ATOM 0 HH11 ARG A 42 72.523 -8.952 1.681 1.00 15.00 H new ATOM 0 HH12 ARG A 42 72.921 -10.665 1.516 1.00 15.00 H new ATOM 0 HH21 ARG A 42 73.398 -10.500 -1.937 1.00 15.00 H new ATOM 0 HH22 ARG A 42 73.408 -11.525 -0.498 1.00 15.00 H new ATOM 695 N SER A 43 68.962 -6.939 -4.470 1.00 15.00 N ATOM 696 CA SER A 43 67.810 -7.571 -5.181 1.00 15.00 C ATOM 697 C SER A 43 67.735 -9.059 -4.820 1.00 15.00 C ATOM 698 O SER A 43 68.710 -9.780 -4.933 1.00 15.00 O ATOM 699 CB SER A 43 68.113 -7.377 -6.670 1.00 15.00 C ATOM 700 OG SER A 43 69.136 -8.280 -7.072 1.00 15.00 O ATOM 0 H SER A 43 69.867 -7.059 -4.925 1.00 15.00 H new ATOM 0 HA SER A 43 66.850 -7.132 -4.909 1.00 15.00 H new ATOM 0 HB2 SER A 43 67.212 -7.547 -7.260 1.00 15.00 H new ATOM 0 HB3 SER A 43 68.427 -6.350 -6.856 1.00 15.00 H new ATOM 0 HG SER A 43 69.480 -8.755 -6.287 1.00 15.00 H new ATOM 706 N PHE A 44 66.586 -9.521 -4.387 1.00 15.00 N ATOM 707 CA PHE A 44 66.482 -10.928 -3.881 1.00 15.00 C ATOM 708 C PHE A 44 66.651 -11.927 -5.028 1.00 15.00 C ATOM 709 O PHE A 44 67.295 -12.948 -4.879 1.00 15.00 O ATOM 710 CB PHE A 44 65.080 -11.044 -3.280 1.00 15.00 C ATOM 711 CG PHE A 44 64.907 -10.275 -1.993 1.00 15.00 C ATOM 712 CD1 PHE A 44 65.631 -10.654 -0.837 1.00 15.00 C ATOM 713 CD2 PHE A 44 64.018 -9.175 -1.941 1.00 15.00 C ATOM 714 CE1 PHE A 44 65.467 -9.933 0.370 1.00 15.00 C ATOM 715 CE2 PHE A 44 63.854 -8.453 -0.735 1.00 15.00 C ATOM 716 CZ PHE A 44 64.578 -8.833 0.421 1.00 15.00 C ATOM 0 H PHE A 44 65.718 -8.987 -4.362 1.00 15.00 H new ATOM 0 HA PHE A 44 67.259 -11.150 -3.149 1.00 15.00 H new ATOM 0 HB2 PHE A 44 64.352 -10.686 -4.008 1.00 15.00 H new ATOM 0 HB3 PHE A 44 64.858 -12.095 -3.097 1.00 15.00 H new ATOM 0 HD1 PHE A 44 66.309 -11.494 -0.876 1.00 15.00 H new ATOM 0 HD2 PHE A 44 63.464 -8.886 -2.822 1.00 15.00 H new ATOM 0 HE1 PHE A 44 66.020 -10.222 1.251 1.00 15.00 H new ATOM 0 HE2 PHE A 44 63.177 -7.612 -0.696 1.00 15.00 H new ATOM 0 HZ PHE A 44 64.452 -8.283 1.342 1.00 15.00 H new ATOM 726 N GLY A 45 66.078 -11.636 -6.171 1.00 15.00 N ATOM 727 CA GLY A 45 66.229 -12.550 -7.342 1.00 15.00 C ATOM 728 C GLY A 45 65.236 -12.156 -8.437 1.00 15.00 C ATOM 729 O GLY A 45 64.357 -11.340 -8.227 1.00 15.00 O ATOM 0 H GLY A 45 65.513 -10.804 -6.342 1.00 15.00 H new ATOM 0 HA2 GLY A 45 67.248 -12.499 -7.726 1.00 15.00 H new ATOM 0 HA3 GLY A 45 66.056 -13.581 -7.035 1.00 15.00 H new ATOM 733 N THR A 46 65.376 -12.735 -9.604 1.00 15.00 N ATOM 734 CA THR A 46 64.407 -12.465 -10.711 1.00 15.00 C ATOM 735 C THR A 46 63.682 -13.757 -11.118 1.00 15.00 C ATOM 736 O THR A 46 62.543 -13.726 -11.545 1.00 15.00 O ATOM 737 CB THR A 46 65.263 -11.947 -11.870 1.00 15.00 C ATOM 738 OG1 THR A 46 66.308 -12.874 -12.134 1.00 15.00 O ATOM 739 CG2 THR A 46 65.866 -10.589 -11.502 1.00 15.00 C ATOM 0 H THR A 46 66.125 -13.387 -9.839 1.00 15.00 H new ATOM 0 HA THR A 46 63.638 -11.751 -10.416 1.00 15.00 H new ATOM 0 HB THR A 46 64.640 -11.834 -12.757 1.00 15.00 H new ATOM 0 HG1 THR A 46 67.164 -12.399 -12.174 1.00 15.00 H new ATOM 0 HG21 THR A 46 66.474 -10.225 -12.330 1.00 15.00 H new ATOM 0 HG22 THR A 46 65.065 -9.878 -11.300 1.00 15.00 H new ATOM 0 HG23 THR A 46 66.489 -10.696 -10.614 1.00 15.00 H new ATOM 747 N GLU A 47 64.337 -14.890 -10.989 1.00 15.00 N ATOM 748 CA GLU A 47 63.714 -16.188 -11.415 1.00 15.00 C ATOM 749 C GLU A 47 62.456 -16.488 -10.590 1.00 15.00 C ATOM 750 O GLU A 47 61.545 -17.147 -11.058 1.00 15.00 O ATOM 751 CB GLU A 47 64.784 -17.255 -11.160 1.00 15.00 C ATOM 752 CG GLU A 47 64.348 -18.579 -11.794 1.00 15.00 C ATOM 753 CD GLU A 47 65.342 -19.678 -11.414 1.00 15.00 C ATOM 754 OE1 GLU A 47 64.949 -20.582 -10.695 1.00 15.00 O ATOM 755 OE2 GLU A 47 66.479 -19.597 -11.849 1.00 15.00 O ATOM 0 H GLU A 47 65.279 -14.972 -10.606 1.00 15.00 H new ATOM 0 HA GLU A 47 63.404 -16.159 -12.460 1.00 15.00 H new ATOM 0 HB2 GLU A 47 65.738 -16.936 -11.579 1.00 15.00 H new ATOM 0 HB3 GLU A 47 64.935 -17.385 -10.088 1.00 15.00 H new ATOM 0 HG2 GLU A 47 63.347 -18.845 -11.454 1.00 15.00 H new ATOM 0 HG3 GLU A 47 64.299 -18.477 -12.878 1.00 15.00 H new ATOM 762 N ASP A 48 62.398 -16.009 -9.367 1.00 15.00 N ATOM 763 CA ASP A 48 61.189 -16.256 -8.508 1.00 15.00 C ATOM 764 C ASP A 48 59.937 -15.667 -9.169 1.00 15.00 C ATOM 765 O ASP A 48 58.846 -16.187 -9.027 1.00 15.00 O ATOM 766 CB ASP A 48 61.477 -15.544 -7.184 1.00 15.00 C ATOM 767 CG ASP A 48 60.466 -15.995 -6.129 1.00 15.00 C ATOM 768 OD1 ASP A 48 60.886 -16.286 -5.021 1.00 15.00 O ATOM 769 OD2 ASP A 48 59.289 -16.041 -6.447 1.00 15.00 O ATOM 0 H ASP A 48 63.134 -15.458 -8.926 1.00 15.00 H new ATOM 0 HA ASP A 48 61.004 -17.321 -8.364 1.00 15.00 H new ATOM 0 HB2 ASP A 48 62.490 -15.769 -6.851 1.00 15.00 H new ATOM 0 HB3 ASP A 48 61.419 -14.464 -7.320 1.00 15.00 H new ATOM 774 N ARG A 49 60.096 -14.584 -9.889 1.00 15.00 N ATOM 775 CA ARG A 49 58.948 -13.989 -10.638 1.00 15.00 C ATOM 776 C ARG A 49 59.258 -13.986 -12.147 1.00 15.00 C ATOM 777 O ARG A 49 59.897 -13.073 -12.634 1.00 15.00 O ATOM 778 CB ARG A 49 58.828 -12.560 -10.106 1.00 15.00 C ATOM 779 CG ARG A 49 58.356 -12.595 -8.650 1.00 15.00 C ATOM 780 CD ARG A 49 57.695 -11.259 -8.292 1.00 15.00 C ATOM 781 NE ARG A 49 56.720 -11.577 -7.198 1.00 15.00 N ATOM 782 CZ ARG A 49 55.755 -10.738 -6.872 1.00 15.00 C ATOM 783 NH1 ARG A 49 55.608 -9.584 -7.483 1.00 15.00 N ATOM 784 NH2 ARG A 49 54.929 -11.062 -5.915 1.00 15.00 N ATOM 0 H ARG A 49 60.979 -14.084 -9.990 1.00 15.00 H new ATOM 0 HA ARG A 49 58.022 -14.548 -10.502 1.00 15.00 H new ATOM 0 HB2 ARG A 49 59.790 -12.053 -10.175 1.00 15.00 H new ATOM 0 HB3 ARG A 49 58.124 -11.992 -10.714 1.00 15.00 H new ATOM 0 HG2 ARG A 49 57.649 -13.412 -8.506 1.00 15.00 H new ATOM 0 HG3 ARG A 49 59.201 -12.783 -7.988 1.00 15.00 H new ATOM 0 HD2 ARG A 49 58.435 -10.531 -7.959 1.00 15.00 H new ATOM 0 HD3 ARG A 49 57.189 -10.827 -9.156 1.00 15.00 H new ATOM 0 HE ARG A 49 56.804 -12.460 -6.695 1.00 15.00 H new ATOM 0 HH11 ARG A 49 56.249 -9.317 -8.230 1.00 15.00 H new ATOM 0 HH12 ARG A 49 54.853 -8.955 -7.210 1.00 15.00 H new ATOM 0 HH21 ARG A 49 55.034 -11.953 -5.430 1.00 15.00 H new ATOM 0 HH22 ARG A 49 54.178 -10.424 -5.652 1.00 15.00 H new ATOM 798 N PRO A 50 58.796 -15.008 -12.849 1.00 15.00 N ATOM 799 CA PRO A 50 59.159 -15.174 -14.289 1.00 15.00 C ATOM 800 C PRO A 50 58.810 -13.918 -15.103 1.00 15.00 C ATOM 801 O PRO A 50 57.739 -13.357 -14.967 1.00 15.00 O ATOM 802 CB PRO A 50 58.320 -16.368 -14.748 1.00 15.00 C ATOM 803 CG PRO A 50 57.958 -17.103 -13.498 1.00 15.00 C ATOM 804 CD PRO A 50 57.911 -16.091 -12.387 1.00 15.00 C ATOM 0 HA PRO A 50 60.229 -15.329 -14.430 1.00 15.00 H new ATOM 0 HB2 PRO A 50 57.429 -16.039 -15.283 1.00 15.00 H new ATOM 0 HB3 PRO A 50 58.884 -17.005 -15.429 1.00 15.00 H new ATOM 0 HG2 PRO A 50 56.994 -17.599 -13.608 1.00 15.00 H new ATOM 0 HG3 PRO A 50 58.692 -17.879 -13.281 1.00 15.00 H new ATOM 0 HD2 PRO A 50 56.896 -15.731 -12.218 1.00 15.00 H new ATOM 0 HD3 PRO A 50 58.259 -16.516 -11.446 1.00 15.00 H new ATOM 812 N THR A 51 59.718 -13.483 -15.944 1.00 15.00 N ATOM 813 CA THR A 51 59.462 -12.277 -16.790 1.00 15.00 C ATOM 814 C THR A 51 59.855 -12.562 -18.242 1.00 15.00 C ATOM 815 O THR A 51 60.542 -13.526 -18.527 1.00 15.00 O ATOM 816 CB THR A 51 60.350 -11.177 -16.203 1.00 15.00 C ATOM 817 OG1 THR A 51 61.664 -11.683 -16.010 1.00 15.00 O ATOM 818 CG2 THR A 51 59.779 -10.711 -14.863 1.00 15.00 C ATOM 0 H THR A 51 60.631 -13.916 -16.080 1.00 15.00 H new ATOM 0 HA THR A 51 58.410 -11.991 -16.791 1.00 15.00 H new ATOM 0 HB THR A 51 60.382 -10.333 -16.892 1.00 15.00 H new ATOM 0 HG1 THR A 51 62.249 -11.354 -16.724 1.00 15.00 H new ATOM 0 HG21 THR A 51 60.415 -9.928 -14.449 1.00 15.00 H new ATOM 0 HG22 THR A 51 58.773 -10.320 -15.013 1.00 15.00 H new ATOM 0 HG23 THR A 51 59.742 -11.552 -14.171 1.00 15.00 H new ATOM 826 N ASP A 52 59.423 -11.730 -19.158 1.00 15.00 N ATOM 827 CA ASP A 52 59.794 -11.930 -20.597 1.00 15.00 C ATOM 828 C ASP A 52 61.235 -11.456 -20.876 1.00 15.00 C ATOM 829 O ASP A 52 61.720 -11.578 -21.985 1.00 15.00 O ATOM 830 CB ASP A 52 58.795 -11.086 -21.393 1.00 15.00 C ATOM 831 CG ASP A 52 57.392 -11.678 -21.248 1.00 15.00 C ATOM 832 OD1 ASP A 52 57.266 -12.888 -21.351 1.00 15.00 O ATOM 833 OD2 ASP A 52 56.466 -10.913 -21.035 1.00 15.00 O ATOM 0 H ASP A 52 58.830 -10.921 -18.973 1.00 15.00 H new ATOM 0 HA ASP A 52 59.758 -12.984 -20.872 1.00 15.00 H new ATOM 0 HB2 ASP A 52 58.805 -10.057 -21.033 1.00 15.00 H new ATOM 0 HB3 ASP A 52 59.082 -11.059 -22.444 1.00 15.00 H new ATOM 838 N ARG A 53 61.921 -10.919 -19.888 1.00 15.00 N ATOM 839 CA ARG A 53 63.345 -10.512 -20.087 1.00 15.00 C ATOM 840 C ARG A 53 64.262 -11.339 -19.168 1.00 15.00 C ATOM 841 O ARG A 53 64.278 -11.116 -17.971 1.00 15.00 O ATOM 842 CB ARG A 53 63.389 -9.034 -19.692 1.00 15.00 C ATOM 843 CG ARG A 53 64.738 -8.438 -20.100 1.00 15.00 C ATOM 844 CD ARG A 53 64.652 -6.909 -20.064 1.00 15.00 C ATOM 845 NE ARG A 53 64.043 -6.521 -21.375 1.00 15.00 N ATOM 846 CZ ARG A 53 64.741 -6.539 -22.495 1.00 15.00 C ATOM 847 NH1 ARG A 53 66.000 -6.913 -22.517 1.00 15.00 N ATOM 848 NH2 ARG A 53 64.165 -6.181 -23.609 1.00 15.00 N ATOM 0 H ARG A 53 61.551 -10.747 -18.953 1.00 15.00 H new ATOM 0 HA ARG A 53 63.685 -10.674 -21.110 1.00 15.00 H new ATOM 0 HB2 ARG A 53 62.578 -8.492 -20.178 1.00 15.00 H new ATOM 0 HB3 ARG A 53 63.243 -8.929 -18.617 1.00 15.00 H new ATOM 0 HG2 ARG A 53 65.520 -8.785 -19.425 1.00 15.00 H new ATOM 0 HG3 ARG A 53 65.009 -8.774 -21.101 1.00 15.00 H new ATOM 0 HD2 ARG A 53 64.040 -6.568 -19.229 1.00 15.00 H new ATOM 0 HD3 ARG A 53 65.638 -6.462 -19.940 1.00 15.00 H new ATOM 0 HE ARG A 53 63.064 -6.236 -21.404 1.00 15.00 H new ATOM 0 HH11 ARG A 53 66.462 -7.199 -21.654 1.00 15.00 H new ATOM 0 HH12 ARG A 53 66.515 -6.917 -23.397 1.00 15.00 H new ATOM 0 HH21 ARG A 53 63.187 -5.892 -23.607 1.00 15.00 H new ATOM 0 HH22 ARG A 53 64.693 -6.190 -24.482 1.00 15.00 H new ATOM 862 N PRO A 54 65.002 -12.275 -19.744 1.00 15.00 N ATOM 863 CA PRO A 54 65.885 -13.155 -18.926 1.00 15.00 C ATOM 864 C PRO A 54 66.966 -12.330 -18.211 1.00 15.00 C ATOM 865 O PRO A 54 67.598 -11.475 -18.803 1.00 15.00 O ATOM 866 CB PRO A 54 66.517 -14.111 -19.945 1.00 15.00 C ATOM 867 CG PRO A 54 65.695 -13.979 -21.188 1.00 15.00 C ATOM 868 CD PRO A 54 65.088 -12.604 -21.174 1.00 15.00 C ATOM 0 HA PRO A 54 65.338 -13.682 -18.144 1.00 15.00 H new ATOM 0 HB2 PRO A 54 67.558 -13.849 -20.134 1.00 15.00 H new ATOM 0 HB3 PRO A 54 66.508 -15.137 -19.577 1.00 15.00 H new ATOM 0 HG2 PRO A 54 66.313 -14.118 -22.075 1.00 15.00 H new ATOM 0 HG3 PRO A 54 64.918 -14.743 -21.218 1.00 15.00 H new ATOM 0 HD2 PRO A 54 65.708 -11.887 -21.713 1.00 15.00 H new ATOM 0 HD3 PRO A 54 64.106 -12.595 -21.647 1.00 15.00 H new ATOM 876 N ILE A 55 67.175 -12.586 -16.942 1.00 15.00 N ATOM 877 CA ILE A 55 68.233 -11.852 -16.178 1.00 15.00 C ATOM 878 C ILE A 55 69.238 -12.854 -15.596 1.00 15.00 C ATOM 879 O ILE A 55 68.879 -13.957 -15.224 1.00 15.00 O ATOM 880 CB ILE A 55 67.486 -11.111 -15.054 1.00 15.00 C ATOM 881 CG1 ILE A 55 66.419 -10.166 -15.648 1.00 15.00 C ATOM 882 CG2 ILE A 55 68.479 -10.296 -14.212 1.00 15.00 C ATOM 883 CD1 ILE A 55 67.067 -9.131 -16.580 1.00 15.00 C ATOM 0 H ILE A 55 66.655 -13.276 -16.400 1.00 15.00 H new ATOM 0 HA ILE A 55 68.794 -11.159 -16.805 1.00 15.00 H new ATOM 0 HB ILE A 55 66.994 -11.850 -14.421 1.00 15.00 H new ATOM 0 HG12 ILE A 55 65.679 -10.746 -16.199 1.00 15.00 H new ATOM 0 HG13 ILE A 55 65.889 -9.656 -14.843 1.00 15.00 H new ATOM 0 HG21 ILE A 55 67.942 -9.775 -13.419 1.00 15.00 H new ATOM 0 HG22 ILE A 55 69.217 -10.966 -13.771 1.00 15.00 H new ATOM 0 HG23 ILE A 55 68.983 -9.568 -14.848 1.00 15.00 H new ATOM 0 HD11 ILE A 55 66.297 -8.476 -16.987 1.00 15.00 H new ATOM 0 HD12 ILE A 55 67.789 -8.538 -16.019 1.00 15.00 H new ATOM 0 HD13 ILE A 55 67.575 -9.644 -17.396 1.00 15.00 H new ATOM 895 N ALA A 56 70.491 -12.475 -15.516 1.00 15.00 N ATOM 896 CA ALA A 56 71.529 -13.400 -14.968 1.00 15.00 C ATOM 897 C ALA A 56 71.738 -13.138 -13.468 1.00 15.00 C ATOM 898 O ALA A 56 71.432 -12.063 -12.989 1.00 15.00 O ATOM 899 CB ALA A 56 72.802 -13.079 -15.752 1.00 15.00 C ATOM 0 H ALA A 56 70.839 -11.562 -15.808 1.00 15.00 H new ATOM 0 HA ALA A 56 71.242 -14.447 -15.069 1.00 15.00 H new ATOM 0 HB1 ALA A 56 73.613 -13.719 -15.406 1.00 15.00 H new ATOM 0 HB2 ALA A 56 72.629 -13.254 -16.814 1.00 15.00 H new ATOM 0 HB3 ALA A 56 73.072 -12.035 -15.595 1.00 15.00 H new ATOM 905 N PRO A 57 72.257 -14.131 -12.763 1.00 15.00 N ATOM 906 CA PRO A 57 72.512 -13.976 -11.303 1.00 15.00 C ATOM 907 C PRO A 57 73.547 -12.870 -11.049 1.00 15.00 C ATOM 908 O PRO A 57 74.391 -12.598 -11.883 1.00 15.00 O ATOM 909 CB PRO A 57 73.057 -15.341 -10.865 1.00 15.00 C ATOM 910 CG PRO A 57 72.745 -16.283 -11.985 1.00 15.00 C ATOM 911 CD PRO A 57 72.645 -15.466 -13.241 1.00 15.00 C ATOM 0 HA PRO A 57 71.617 -13.690 -10.751 1.00 15.00 H new ATOM 0 HB2 PRO A 57 74.130 -15.293 -10.682 1.00 15.00 H new ATOM 0 HB3 PRO A 57 72.590 -15.669 -9.936 1.00 15.00 H new ATOM 0 HG2 PRO A 57 73.524 -17.039 -12.080 1.00 15.00 H new ATOM 0 HG3 PRO A 57 71.810 -16.811 -11.794 1.00 15.00 H new ATOM 0 HD2 PRO A 57 73.594 -15.439 -13.777 1.00 15.00 H new ATOM 0 HD3 PRO A 57 71.904 -15.876 -13.927 1.00 15.00 H new ATOM 919 N ARG A 58 73.481 -12.237 -9.903 1.00 15.00 N ATOM 920 CA ARG A 58 74.460 -11.156 -9.576 1.00 15.00 C ATOM 921 C ARG A 58 74.907 -11.269 -8.115 1.00 15.00 C ATOM 922 O ARG A 58 76.086 -11.259 -7.818 1.00 15.00 O ATOM 923 CB ARG A 58 73.699 -9.848 -9.804 1.00 15.00 C ATOM 924 CG ARG A 58 73.406 -9.680 -11.297 1.00 15.00 C ATOM 925 CD ARG A 58 72.733 -8.325 -11.537 1.00 15.00 C ATOM 926 NE ARG A 58 73.822 -7.306 -11.381 1.00 15.00 N ATOM 927 CZ ARG A 58 73.688 -6.079 -11.845 1.00 15.00 C ATOM 928 NH1 ARG A 58 72.593 -5.688 -12.456 1.00 15.00 N ATOM 929 NH2 ARG A 58 74.667 -5.230 -11.691 1.00 15.00 N ATOM 0 H ARG A 58 72.788 -12.424 -9.178 1.00 15.00 H new ATOM 0 HA ARG A 58 75.360 -11.216 -10.188 1.00 15.00 H new ATOM 0 HB2 ARG A 58 72.767 -9.854 -9.238 1.00 15.00 H new ATOM 0 HB3 ARG A 58 74.287 -9.005 -9.441 1.00 15.00 H new ATOM 0 HG2 ARG A 58 74.331 -9.745 -11.869 1.00 15.00 H new ATOM 0 HG3 ARG A 58 72.759 -10.486 -11.644 1.00 15.00 H new ATOM 0 HD2 ARG A 58 72.290 -8.277 -12.532 1.00 15.00 H new ATOM 0 HD3 ARG A 58 71.929 -8.153 -10.821 1.00 15.00 H new ATOM 0 HE ARG A 58 74.686 -7.568 -10.905 1.00 15.00 H new ATOM 0 HH11 ARG A 58 71.819 -6.340 -12.582 1.00 15.00 H new ATOM 0 HH12 ARG A 58 72.517 -4.733 -12.805 1.00 15.00 H new ATOM 0 HH21 ARG A 58 75.523 -5.519 -11.217 1.00 15.00 H new ATOM 0 HH22 ARG A 58 74.577 -4.278 -12.045 1.00 15.00 H new ATOM 943 N ASP A 59 73.964 -11.377 -7.201 1.00 15.00 N ATOM 944 CA ASP A 59 74.301 -11.497 -5.738 1.00 15.00 C ATOM 945 C ASP A 59 75.244 -10.367 -5.296 1.00 15.00 C ATOM 946 O ASP A 59 76.154 -10.576 -4.513 1.00 15.00 O ATOM 947 CB ASP A 59 74.983 -12.865 -5.583 1.00 15.00 C ATOM 948 CG ASP A 59 73.977 -13.977 -5.885 1.00 15.00 C ATOM 949 OD1 ASP A 59 74.347 -14.911 -6.577 1.00 15.00 O ATOM 950 OD2 ASP A 59 72.854 -13.879 -5.415 1.00 15.00 O ATOM 0 H ASP A 59 72.965 -11.387 -7.408 1.00 15.00 H new ATOM 0 HA ASP A 59 73.410 -11.416 -5.115 1.00 15.00 H new ATOM 0 HB2 ASP A 59 75.834 -12.937 -6.260 1.00 15.00 H new ATOM 0 HB3 ASP A 59 75.371 -12.977 -4.570 1.00 15.00 H new ATOM 955 N GLU A 60 75.025 -9.174 -5.794 1.00 15.00 N ATOM 956 CA GLU A 60 75.898 -8.020 -5.416 1.00 15.00 C ATOM 957 C GLU A 60 75.073 -6.948 -4.698 1.00 15.00 C ATOM 958 O GLU A 60 73.874 -6.848 -4.888 1.00 15.00 O ATOM 959 CB GLU A 60 76.438 -7.482 -6.741 1.00 15.00 C ATOM 960 CG GLU A 60 77.528 -6.443 -6.467 1.00 15.00 C ATOM 961 CD GLU A 60 77.985 -5.822 -7.789 1.00 15.00 C ATOM 962 OE1 GLU A 60 78.548 -6.543 -8.596 1.00 15.00 O ATOM 963 OE2 GLU A 60 77.766 -4.636 -7.970 1.00 15.00 O ATOM 0 H GLU A 60 74.276 -8.950 -6.449 1.00 15.00 H new ATOM 0 HA GLU A 60 76.700 -8.312 -4.738 1.00 15.00 H new ATOM 0 HB2 GLU A 60 76.842 -8.299 -7.339 1.00 15.00 H new ATOM 0 HB3 GLU A 60 75.630 -7.033 -7.319 1.00 15.00 H new ATOM 0 HG2 GLU A 60 77.148 -5.668 -5.801 1.00 15.00 H new ATOM 0 HG3 GLU A 60 78.373 -6.911 -5.962 1.00 15.00 H new ATOM 970 N THR A 61 75.708 -6.149 -3.875 1.00 15.00 N ATOM 971 CA THR A 61 74.972 -5.072 -3.144 1.00 15.00 C ATOM 972 C THR A 61 75.239 -3.714 -3.800 1.00 15.00 C ATOM 973 O THR A 61 76.363 -3.388 -4.135 1.00 15.00 O ATOM 974 CB THR A 61 75.536 -5.103 -1.722 1.00 15.00 C ATOM 975 OG1 THR A 61 75.496 -6.434 -1.228 1.00 15.00 O ATOM 976 CG2 THR A 61 74.697 -4.196 -0.819 1.00 15.00 C ATOM 0 H THR A 61 76.708 -6.197 -3.678 1.00 15.00 H new ATOM 0 HA THR A 61 73.893 -5.224 -3.157 1.00 15.00 H new ATOM 0 HB THR A 61 76.567 -4.749 -1.731 1.00 15.00 H new ATOM 0 HG1 THR A 61 75.859 -6.456 -0.318 1.00 15.00 H new ATOM 0 HG21 THR A 61 75.099 -4.218 0.194 1.00 15.00 H new ATOM 0 HG22 THR A 61 74.728 -3.175 -1.199 1.00 15.00 H new ATOM 0 HG23 THR A 61 73.665 -4.548 -0.808 1.00 15.00 H new ATOM 984 N PHE A 62 74.209 -2.923 -3.982 1.00 15.00 N ATOM 985 CA PHE A 62 74.380 -1.591 -4.633 1.00 15.00 C ATOM 986 C PHE A 62 74.372 -0.483 -3.577 1.00 15.00 C ATOM 987 O PHE A 62 73.521 -0.456 -2.706 1.00 15.00 O ATOM 988 CB PHE A 62 73.180 -1.453 -5.568 1.00 15.00 C ATOM 989 CG PHE A 62 73.157 -2.483 -6.672 1.00 15.00 C ATOM 990 CD1 PHE A 62 73.939 -2.291 -7.837 1.00 15.00 C ATOM 991 CD2 PHE A 62 72.353 -3.642 -6.542 1.00 15.00 C ATOM 992 CE1 PHE A 62 73.917 -3.257 -8.873 1.00 15.00 C ATOM 993 CE2 PHE A 62 72.331 -4.608 -7.577 1.00 15.00 C ATOM 994 CZ PHE A 62 73.113 -4.416 -8.743 1.00 15.00 C ATOM 0 H PHE A 62 73.253 -3.146 -3.705 1.00 15.00 H new ATOM 0 HA PHE A 62 75.325 -1.509 -5.170 1.00 15.00 H new ATOM 0 HB2 PHE A 62 72.263 -1.536 -4.985 1.00 15.00 H new ATOM 0 HB3 PHE A 62 73.187 -0.457 -6.011 1.00 15.00 H new ATOM 0 HD1 PHE A 62 74.552 -1.408 -7.936 1.00 15.00 H new ATOM 0 HD2 PHE A 62 71.757 -3.789 -5.654 1.00 15.00 H new ATOM 0 HE1 PHE A 62 74.513 -3.110 -9.762 1.00 15.00 H new ATOM 0 HE2 PHE A 62 71.718 -5.492 -7.478 1.00 15.00 H new ATOM 0 HZ PHE A 62 73.096 -5.153 -9.532 1.00 15.00 H new ATOM 1004 N GLU A 63 75.312 0.427 -3.654 1.00 15.00 N ATOM 1005 CA GLU A 63 75.398 1.517 -2.631 1.00 15.00 C ATOM 1006 C GLU A 63 74.208 2.475 -2.761 1.00 15.00 C ATOM 1007 O GLU A 63 73.610 2.864 -1.774 1.00 15.00 O ATOM 1008 CB GLU A 63 76.709 2.253 -2.927 1.00 15.00 C ATOM 1009 CG GLU A 63 77.022 3.223 -1.786 1.00 15.00 C ATOM 1010 CD GLU A 63 77.458 2.439 -0.545 1.00 15.00 C ATOM 1011 OE1 GLU A 63 77.034 2.803 0.539 1.00 15.00 O ATOM 1012 OE2 GLU A 63 78.210 1.491 -0.700 1.00 15.00 O ATOM 0 H GLU A 63 76.025 0.462 -4.382 1.00 15.00 H new ATOM 0 HA GLU A 63 75.375 1.119 -1.617 1.00 15.00 H new ATOM 0 HB2 GLU A 63 77.522 1.536 -3.042 1.00 15.00 H new ATOM 0 HB3 GLU A 63 76.628 2.797 -3.868 1.00 15.00 H new ATOM 0 HG2 GLU A 63 77.811 3.912 -2.088 1.00 15.00 H new ATOM 0 HG3 GLU A 63 76.143 3.825 -1.557 1.00 15.00 H new ATOM 1019 N TYR A 64 73.862 2.854 -3.968 1.00 15.00 N ATOM 1020 CA TYR A 64 72.764 3.852 -4.159 1.00 15.00 C ATOM 1021 C TYR A 64 72.039 3.608 -5.487 1.00 15.00 C ATOM 1022 O TYR A 64 72.641 3.625 -6.545 1.00 15.00 O ATOM 1023 CB TYR A 64 73.473 5.207 -4.178 1.00 15.00 C ATOM 1024 CG TYR A 64 72.542 6.385 -4.007 1.00 15.00 C ATOM 1025 CD1 TYR A 64 71.589 6.692 -5.010 1.00 15.00 C ATOM 1026 CD2 TYR A 64 72.627 7.190 -2.843 1.00 15.00 C ATOM 1027 CE1 TYR A 64 70.724 7.800 -4.848 1.00 15.00 C ATOM 1028 CE2 TYR A 64 71.759 8.297 -2.684 1.00 15.00 C ATOM 1029 CZ TYR A 64 70.809 8.603 -3.686 1.00 15.00 C ATOM 1030 OH TYR A 64 69.965 9.684 -3.530 1.00 15.00 O ATOM 0 H TYR A 64 74.293 2.515 -4.828 1.00 15.00 H new ATOM 0 HA TYR A 64 72.009 3.790 -3.376 1.00 15.00 H new ATOM 0 HB2 TYR A 64 74.219 5.227 -3.384 1.00 15.00 H new ATOM 0 HB3 TYR A 64 74.009 5.313 -5.121 1.00 15.00 H new ATOM 0 HD1 TYR A 64 71.523 6.080 -5.898 1.00 15.00 H new ATOM 0 HD2 TYR A 64 73.354 6.959 -2.078 1.00 15.00 H new ATOM 0 HE1 TYR A 64 69.998 8.033 -5.613 1.00 15.00 H new ATOM 0 HE2 TYR A 64 71.822 8.909 -1.796 1.00 15.00 H new ATOM 0 HH TYR A 64 70.155 10.127 -2.677 1.00 15.00 H new ATOM 1040 N ILE A 65 70.747 3.383 -5.434 1.00 15.00 N ATOM 1041 CA ILE A 65 69.940 3.269 -6.693 1.00 15.00 C ATOM 1042 C ILE A 65 68.697 4.165 -6.590 1.00 15.00 C ATOM 1043 O ILE A 65 68.155 4.363 -5.518 1.00 15.00 O ATOM 1044 CB ILE A 65 69.548 1.784 -6.807 1.00 15.00 C ATOM 1045 CG1 ILE A 65 70.820 0.925 -6.896 1.00 15.00 C ATOM 1046 CG2 ILE A 65 68.703 1.558 -8.071 1.00 15.00 C ATOM 1047 CD1 ILE A 65 70.461 -0.563 -6.813 1.00 15.00 C ATOM 0 H ILE A 65 70.215 3.273 -4.571 1.00 15.00 H new ATOM 0 HA ILE A 65 70.496 3.591 -7.573 1.00 15.00 H new ATOM 0 HB ILE A 65 68.968 1.502 -5.928 1.00 15.00 H new ATOM 0 HG12 ILE A 65 71.341 1.129 -7.832 1.00 15.00 H new ATOM 0 HG13 ILE A 65 71.502 1.188 -6.087 1.00 15.00 H new ATOM 0 HG21 ILE A 65 68.431 0.505 -8.143 1.00 15.00 H new ATOM 0 HG22 ILE A 65 67.799 2.164 -8.017 1.00 15.00 H new ATOM 0 HG23 ILE A 65 69.280 1.845 -8.950 1.00 15.00 H new ATOM 0 HD11 ILE A 65 71.370 -1.161 -6.877 1.00 15.00 H new ATOM 0 HD12 ILE A 65 69.961 -0.764 -5.866 1.00 15.00 H new ATOM 0 HD13 ILE A 65 69.797 -0.824 -7.637 1.00 15.00 H new ATOM 1059 N ILE A 66 68.250 4.703 -7.700 1.00 15.00 N ATOM 1060 CA ILE A 66 67.068 5.623 -7.678 1.00 15.00 C ATOM 1061 C ILE A 66 65.871 4.952 -8.367 1.00 15.00 C ATOM 1062 O ILE A 66 66.012 4.326 -9.401 1.00 15.00 O ATOM 1063 CB ILE A 66 67.512 6.875 -8.453 1.00 15.00 C ATOM 1064 CG1 ILE A 66 68.717 7.519 -7.757 1.00 15.00 C ATOM 1065 CG2 ILE A 66 66.366 7.894 -8.502 1.00 15.00 C ATOM 1066 CD1 ILE A 66 69.355 8.550 -8.689 1.00 15.00 C ATOM 0 H ILE A 66 68.654 4.544 -8.623 1.00 15.00 H new ATOM 0 HA ILE A 66 66.755 5.872 -6.664 1.00 15.00 H new ATOM 0 HB ILE A 66 67.785 6.580 -9.466 1.00 15.00 H new ATOM 0 HG12 ILE A 66 68.402 7.998 -6.830 1.00 15.00 H new ATOM 0 HG13 ILE A 66 69.447 6.755 -7.489 1.00 15.00 H new ATOM 0 HG21 ILE A 66 66.688 8.778 -9.052 1.00 15.00 H new ATOM 0 HG22 ILE A 66 65.505 7.450 -9.001 1.00 15.00 H new ATOM 0 HG23 ILE A 66 66.089 8.180 -7.487 1.00 15.00 H new ATOM 0 HD11 ILE A 66 70.211 9.007 -8.194 1.00 15.00 H new ATOM 0 HD12 ILE A 66 69.685 8.058 -9.604 1.00 15.00 H new ATOM 0 HD13 ILE A 66 68.624 9.320 -8.934 1.00 15.00 H new ATOM 1078 N PHE A 67 64.699 5.085 -7.795 1.00 15.00 N ATOM 1079 CA PHE A 67 63.468 4.541 -8.445 1.00 15.00 C ATOM 1080 C PHE A 67 62.391 5.626 -8.514 1.00 15.00 C ATOM 1081 O PHE A 67 62.283 6.456 -7.630 1.00 15.00 O ATOM 1082 CB PHE A 67 63.017 3.392 -7.543 1.00 15.00 C ATOM 1083 CG PHE A 67 63.967 2.218 -7.538 1.00 15.00 C ATOM 1084 CD1 PHE A 67 64.078 1.393 -8.684 1.00 15.00 C ATOM 1085 CD2 PHE A 67 64.745 1.941 -6.389 1.00 15.00 C ATOM 1086 CE1 PHE A 67 64.968 0.292 -8.680 1.00 15.00 C ATOM 1087 CE2 PHE A 67 65.636 0.839 -6.384 1.00 15.00 C ATOM 1088 CZ PHE A 67 65.746 0.014 -7.530 1.00 15.00 C ATOM 0 H PHE A 67 64.543 5.550 -6.901 1.00 15.00 H new ATOM 0 HA PHE A 67 63.651 4.206 -9.466 1.00 15.00 H new ATOM 0 HB2 PHE A 67 62.906 3.763 -6.524 1.00 15.00 H new ATOM 0 HB3 PHE A 67 62.034 3.051 -7.867 1.00 15.00 H new ATOM 0 HD1 PHE A 67 63.484 1.604 -9.561 1.00 15.00 H new ATOM 0 HD2 PHE A 67 64.660 2.570 -5.515 1.00 15.00 H new ATOM 0 HE1 PHE A 67 65.054 -0.336 -9.554 1.00 15.00 H new ATOM 0 HE2 PHE A 67 66.231 0.628 -5.507 1.00 15.00 H new ATOM 0 HZ PHE A 67 66.423 -0.827 -7.527 1.00 15.00 H new ATOM 1098 N ARG A 68 61.596 5.624 -9.556 1.00 15.00 N ATOM 1099 CA ARG A 68 60.521 6.655 -9.692 1.00 15.00 C ATOM 1100 C ARG A 68 59.146 6.015 -9.482 1.00 15.00 C ATOM 1101 O ARG A 68 58.955 4.840 -9.734 1.00 15.00 O ATOM 1102 CB ARG A 68 60.653 7.187 -11.121 1.00 15.00 C ATOM 1103 CG ARG A 68 61.976 7.941 -11.269 1.00 15.00 C ATOM 1104 CD ARG A 68 62.052 8.574 -12.662 1.00 15.00 C ATOM 1105 NE ARG A 68 63.446 9.111 -12.781 1.00 15.00 N ATOM 1106 CZ ARG A 68 63.965 9.424 -13.953 1.00 15.00 C ATOM 1107 NH1 ARG A 68 63.283 9.287 -15.069 1.00 15.00 N ATOM 1108 NH2 ARG A 68 65.184 9.885 -14.006 1.00 15.00 N ATOM 0 H ARG A 68 61.646 4.950 -10.320 1.00 15.00 H new ATOM 0 HA ARG A 68 60.618 7.450 -8.953 1.00 15.00 H new ATOM 0 HB2 ARG A 68 60.612 6.362 -11.832 1.00 15.00 H new ATOM 0 HB3 ARG A 68 59.818 7.849 -11.352 1.00 15.00 H new ATOM 0 HG2 ARG A 68 62.055 8.712 -10.503 1.00 15.00 H new ATOM 0 HG3 ARG A 68 62.814 7.259 -11.122 1.00 15.00 H new ATOM 0 HD2 ARG A 68 61.847 7.838 -13.439 1.00 15.00 H new ATOM 0 HD3 ARG A 68 61.314 9.369 -12.773 1.00 15.00 H new ATOM 0 HE ARG A 68 64.006 9.237 -11.938 1.00 15.00 H new ATOM 0 HH11 ARG A 68 62.328 8.931 -15.042 1.00 15.00 H new ATOM 0 HH12 ARG A 68 63.709 9.537 -15.961 1.00 15.00 H new ATOM 0 HH21 ARG A 68 65.724 10.000 -13.148 1.00 15.00 H new ATOM 0 HH22 ARG A 68 65.598 10.131 -14.905 1.00 15.00 H new ATOM 1122 N GLY A 69 58.186 6.784 -9.021 1.00 15.00 N ATOM 1123 CA GLY A 69 56.818 6.228 -8.759 1.00 15.00 C ATOM 1124 C GLY A 69 56.234 5.598 -10.033 1.00 15.00 C ATOM 1125 O GLY A 69 55.402 4.711 -9.964 1.00 15.00 O ATOM 0 H GLY A 69 58.292 7.777 -8.814 1.00 15.00 H new ATOM 0 HA2 GLY A 69 56.870 5.480 -7.968 1.00 15.00 H new ATOM 0 HA3 GLY A 69 56.159 7.021 -8.405 1.00 15.00 H new ATOM 1129 N SER A 70 56.660 6.048 -11.190 1.00 15.00 N ATOM 1130 CA SER A 70 56.101 5.503 -12.471 1.00 15.00 C ATOM 1131 C SER A 70 56.479 4.026 -12.641 1.00 15.00 C ATOM 1132 O SER A 70 55.651 3.207 -12.996 1.00 15.00 O ATOM 1133 CB SER A 70 56.732 6.344 -13.582 1.00 15.00 C ATOM 1134 OG SER A 70 56.479 7.719 -13.330 1.00 15.00 O ATOM 0 H SER A 70 57.371 6.770 -11.303 1.00 15.00 H new ATOM 0 HA SER A 70 55.012 5.555 -12.489 1.00 15.00 H new ATOM 0 HB2 SER A 70 57.806 6.162 -13.627 1.00 15.00 H new ATOM 0 HB3 SER A 70 56.320 6.058 -14.550 1.00 15.00 H new ATOM 0 HG SER A 70 56.883 8.261 -14.039 1.00 15.00 H new ATOM 1140 N ASP A 71 57.721 3.683 -12.391 1.00 15.00 N ATOM 1141 CA ASP A 71 58.171 2.268 -12.597 1.00 15.00 C ATOM 1142 C ASP A 71 57.794 1.398 -11.389 1.00 15.00 C ATOM 1143 O ASP A 71 57.530 0.218 -11.526 1.00 15.00 O ATOM 1144 CB ASP A 71 59.698 2.337 -12.775 1.00 15.00 C ATOM 1145 CG ASP A 71 60.363 2.910 -11.517 1.00 15.00 C ATOM 1146 OD1 ASP A 71 60.638 4.097 -11.506 1.00 15.00 O ATOM 1147 OD2 ASP A 71 60.586 2.149 -10.590 1.00 15.00 O ATOM 0 H ASP A 71 58.442 4.321 -12.054 1.00 15.00 H new ATOM 0 HA ASP A 71 57.692 1.815 -13.465 1.00 15.00 H new ATOM 0 HB2 ASP A 71 60.091 1.341 -12.979 1.00 15.00 H new ATOM 0 HB3 ASP A 71 59.941 2.959 -13.637 1.00 15.00 H new ATOM 1152 N ILE A 72 57.767 1.976 -10.211 1.00 15.00 N ATOM 1153 CA ILE A 72 57.405 1.186 -8.985 1.00 15.00 C ATOM 1154 C ILE A 72 55.938 0.741 -9.067 1.00 15.00 C ATOM 1155 O ILE A 72 55.085 1.474 -9.534 1.00 15.00 O ATOM 1156 CB ILE A 72 57.619 2.137 -7.794 1.00 15.00 C ATOM 1157 CG1 ILE A 72 59.087 2.576 -7.735 1.00 15.00 C ATOM 1158 CG2 ILE A 72 57.264 1.421 -6.485 1.00 15.00 C ATOM 1159 CD1 ILE A 72 59.216 3.803 -6.829 1.00 15.00 C ATOM 0 H ILE A 72 57.979 2.959 -10.043 1.00 15.00 H new ATOM 0 HA ILE A 72 58.012 0.286 -8.884 1.00 15.00 H new ATOM 0 HB ILE A 72 56.978 3.009 -7.923 1.00 15.00 H new ATOM 0 HG12 ILE A 72 59.706 1.763 -7.355 1.00 15.00 H new ATOM 0 HG13 ILE A 72 59.448 2.810 -8.736 1.00 15.00 H new ATOM 0 HG21 ILE A 72 57.418 2.100 -5.646 1.00 15.00 H new ATOM 0 HG22 ILE A 72 56.220 1.109 -6.513 1.00 15.00 H new ATOM 0 HG23 ILE A 72 57.902 0.545 -6.365 1.00 15.00 H new ATOM 0 HD11 ILE A 72 60.259 4.116 -6.786 1.00 15.00 H new ATOM 0 HD12 ILE A 72 58.610 4.616 -7.229 1.00 15.00 H new ATOM 0 HD13 ILE A 72 58.871 3.552 -5.826 1.00 15.00 H new ATOM 1171 N LYS A 73 55.648 -0.455 -8.615 1.00 15.00 N ATOM 1172 CA LYS A 73 54.245 -0.966 -8.669 1.00 15.00 C ATOM 1173 C LYS A 73 53.638 -1.001 -7.263 1.00 15.00 C ATOM 1174 O LYS A 73 52.501 -0.615 -7.062 1.00 15.00 O ATOM 1175 CB LYS A 73 54.361 -2.381 -9.239 1.00 15.00 C ATOM 1176 CG LYS A 73 52.966 -2.916 -9.566 1.00 15.00 C ATOM 1177 CD LYS A 73 53.076 -4.361 -10.058 1.00 15.00 C ATOM 1178 CE LYS A 73 51.700 -4.852 -10.515 1.00 15.00 C ATOM 1179 NZ LYS A 73 51.752 -6.333 -10.367 1.00 15.00 N ATOM 0 H LYS A 73 56.326 -1.100 -8.210 1.00 15.00 H new ATOM 0 HA LYS A 73 53.598 -0.333 -9.277 1.00 15.00 H new ATOM 0 HB2 LYS A 73 54.979 -2.373 -10.137 1.00 15.00 H new ATOM 0 HB3 LYS A 73 54.853 -3.035 -8.519 1.00 15.00 H new ATOM 0 HG2 LYS A 73 52.330 -2.869 -8.682 1.00 15.00 H new ATOM 0 HG3 LYS A 73 52.497 -2.295 -10.329 1.00 15.00 H new ATOM 0 HD2 LYS A 73 53.788 -4.423 -10.881 1.00 15.00 H new ATOM 0 HD3 LYS A 73 53.455 -5.000 -9.260 1.00 15.00 H new ATOM 0 HE2 LYS A 73 50.905 -4.422 -9.906 1.00 15.00 H new ATOM 0 HE3 LYS A 73 51.501 -4.565 -11.548 1.00 15.00 H new ATOM 0 HZ1 LYS A 73 50.843 -6.743 -10.661 1.00 15.00 H new ATOM 0 HZ2 LYS A 73 52.514 -6.715 -10.963 1.00 15.00 H new ATOM 0 HZ3 LYS A 73 51.936 -6.576 -9.373 1.00 15.00 H new ATOM 1193 N ASP A 74 54.391 -1.461 -6.292 1.00 15.00 N ATOM 1194 CA ASP A 74 53.845 -1.572 -4.902 1.00 15.00 C ATOM 1195 C ASP A 74 54.914 -1.197 -3.869 1.00 15.00 C ATOM 1196 O ASP A 74 56.089 -1.430 -4.072 1.00 15.00 O ATOM 1197 CB ASP A 74 53.446 -3.040 -4.751 1.00 15.00 C ATOM 1198 CG ASP A 74 52.644 -3.224 -3.461 1.00 15.00 C ATOM 1199 OD1 ASP A 74 53.236 -3.618 -2.470 1.00 15.00 O ATOM 1200 OD2 ASP A 74 51.453 -2.967 -3.486 1.00 15.00 O ATOM 0 H ASP A 74 55.359 -1.764 -6.402 1.00 15.00 H new ATOM 0 HA ASP A 74 53.004 -0.898 -4.739 1.00 15.00 H new ATOM 0 HB2 ASP A 74 52.852 -3.356 -5.609 1.00 15.00 H new ATOM 0 HB3 ASP A 74 54.336 -3.669 -4.731 1.00 15.00 H new ATOM 1205 N LEU A 75 54.506 -0.619 -2.764 1.00 15.00 N ATOM 1206 CA LEU A 75 55.484 -0.231 -1.700 1.00 15.00 C ATOM 1207 C LEU A 75 54.986 -0.700 -0.327 1.00 15.00 C ATOM 1208 O LEU A 75 53.855 -0.447 0.048 1.00 15.00 O ATOM 1209 CB LEU A 75 55.541 1.297 -1.755 1.00 15.00 C ATOM 1210 CG LEU A 75 56.750 1.798 -0.961 1.00 15.00 C ATOM 1211 CD1 LEU A 75 57.156 3.183 -1.468 1.00 15.00 C ATOM 1212 CD2 LEU A 75 56.385 1.889 0.524 1.00 15.00 C ATOM 0 H LEU A 75 53.533 -0.399 -2.553 1.00 15.00 H new ATOM 0 HA LEU A 75 56.464 -0.683 -1.854 1.00 15.00 H new ATOM 0 HB2 LEU A 75 55.610 1.631 -2.790 1.00 15.00 H new ATOM 0 HB3 LEU A 75 54.624 1.720 -1.345 1.00 15.00 H new ATOM 0 HG LEU A 75 57.580 1.104 -1.091 1.00 15.00 H new ATOM 0 HD11 LEU A 75 58.017 3.540 -0.902 1.00 15.00 H new ATOM 0 HD12 LEU A 75 57.416 3.122 -2.525 1.00 15.00 H new ATOM 0 HD13 LEU A 75 56.325 3.876 -1.339 1.00 15.00 H new ATOM 0 HD21 LEU A 75 57.246 2.246 1.089 1.00 15.00 H new ATOM 0 HD22 LEU A 75 55.554 2.582 0.653 1.00 15.00 H new ATOM 0 HD23 LEU A 75 56.095 0.904 0.888 1.00 15.00 H new ATOM 1224 N THR A 76 55.823 -1.378 0.421 1.00 15.00 N ATOM 1225 CA THR A 76 55.420 -1.849 1.784 1.00 15.00 C ATOM 1226 C THR A 76 56.501 -1.495 2.812 1.00 15.00 C ATOM 1227 O THR A 76 57.682 -1.580 2.532 1.00 15.00 O ATOM 1228 CB THR A 76 55.280 -3.367 1.652 1.00 15.00 C ATOM 1229 OG1 THR A 76 54.462 -3.669 0.530 1.00 15.00 O ATOM 1230 CG2 THR A 76 54.639 -3.935 2.920 1.00 15.00 C ATOM 0 H THR A 76 56.773 -1.627 0.145 1.00 15.00 H new ATOM 0 HA THR A 76 54.496 -1.382 2.125 1.00 15.00 H new ATOM 0 HB THR A 76 56.265 -3.813 1.515 1.00 15.00 H new ATOM 0 HG1 THR A 76 54.372 -4.641 0.443 1.00 15.00 H new ATOM 0 HG21 THR A 76 54.540 -5.016 2.825 1.00 15.00 H new ATOM 0 HG22 THR A 76 55.267 -3.703 3.780 1.00 15.00 H new ATOM 0 HG23 THR A 76 53.653 -3.491 3.060 1.00 15.00 H new ATOM 1238 N VAL A 77 56.101 -1.103 3.998 1.00 15.00 N ATOM 1239 CA VAL A 77 57.097 -0.722 5.052 1.00 15.00 C ATOM 1240 C VAL A 77 57.246 -1.867 6.064 1.00 15.00 C ATOM 1241 O VAL A 77 56.288 -2.548 6.385 1.00 15.00 O ATOM 1242 CB VAL A 77 56.518 0.534 5.725 1.00 15.00 C ATOM 1243 CG1 VAL A 77 57.474 1.029 6.815 1.00 15.00 C ATOM 1244 CG2 VAL A 77 56.337 1.644 4.683 1.00 15.00 C ATOM 0 H VAL A 77 55.124 -1.030 4.283 1.00 15.00 H new ATOM 0 HA VAL A 77 58.087 -0.530 4.639 1.00 15.00 H new ATOM 0 HB VAL A 77 55.554 0.282 6.168 1.00 15.00 H new ATOM 0 HG11 VAL A 77 57.058 1.919 7.287 1.00 15.00 H new ATOM 0 HG12 VAL A 77 57.607 0.249 7.564 1.00 15.00 H new ATOM 0 HG13 VAL A 77 58.439 1.272 6.370 1.00 15.00 H new ATOM 0 HG21 VAL A 77 55.927 2.532 5.164 1.00 15.00 H new ATOM 0 HG22 VAL A 77 57.302 1.886 4.238 1.00 15.00 H new ATOM 0 HG23 VAL A 77 55.653 1.305 3.905 1.00 15.00 H new ATOM 1254 N CYS A 78 58.441 -2.079 6.566 1.00 15.00 N ATOM 1255 CA CYS A 78 58.671 -3.202 7.526 1.00 15.00 C ATOM 1256 C CYS A 78 58.549 -2.701 8.967 1.00 15.00 C ATOM 1257 O CYS A 78 58.045 -3.397 9.831 1.00 15.00 O ATOM 1258 CB CYS A 78 60.096 -3.681 7.244 1.00 15.00 C ATOM 1259 SG CYS A 78 60.151 -4.496 5.629 1.00 15.00 S ATOM 0 H CYS A 78 59.267 -1.520 6.350 1.00 15.00 H new ATOM 0 HA CYS A 78 57.941 -4.002 7.406 1.00 15.00 H new ATOM 0 HB2 CYS A 78 60.785 -2.836 7.261 1.00 15.00 H new ATOM 0 HB3 CYS A 78 60.420 -4.372 8.023 1.00 15.00 H new ATOM 0 HG CYS A 78 61.363 -4.901 5.388 1.00 15.00 H new ATOM 1265 N GLU A 79 59.006 -1.500 9.231 1.00 15.00 N ATOM 1266 CA GLU A 79 58.892 -0.934 10.612 1.00 15.00 C ATOM 1267 C GLU A 79 57.504 -0.296 10.807 1.00 15.00 C ATOM 1268 O GLU A 79 57.175 0.651 10.118 1.00 15.00 O ATOM 1269 CB GLU A 79 59.986 0.133 10.698 1.00 15.00 C ATOM 1270 CG GLU A 79 61.347 -0.543 10.870 1.00 15.00 C ATOM 1271 CD GLU A 79 61.549 -0.919 12.339 1.00 15.00 C ATOM 1272 OE1 GLU A 79 62.378 -0.296 12.981 1.00 15.00 O ATOM 1273 OE2 GLU A 79 60.872 -1.826 12.796 1.00 15.00 O ATOM 0 H GLU A 79 59.453 -0.887 8.549 1.00 15.00 H new ATOM 0 HA GLU A 79 59.007 -1.697 11.382 1.00 15.00 H new ATOM 0 HB2 GLU A 79 59.984 0.745 9.796 1.00 15.00 H new ATOM 0 HB3 GLU A 79 59.792 0.801 11.537 1.00 15.00 H new ATOM 0 HG2 GLU A 79 61.404 -1.434 10.245 1.00 15.00 H new ATOM 0 HG3 GLU A 79 62.142 0.127 10.543 1.00 15.00 H new ATOM 1280 N PRO A 80 56.725 -0.826 11.737 1.00 15.00 N ATOM 1281 CA PRO A 80 55.365 -0.276 11.980 1.00 15.00 C ATOM 1282 C PRO A 80 55.458 1.120 12.619 1.00 15.00 C ATOM 1283 O PRO A 80 56.454 1.438 13.244 1.00 15.00 O ATOM 1284 CB PRO A 80 54.727 -1.275 12.944 1.00 15.00 C ATOM 1285 CG PRO A 80 55.872 -1.973 13.604 1.00 15.00 C ATOM 1286 CD PRO A 80 57.021 -1.959 12.632 1.00 15.00 C ATOM 0 HA PRO A 80 54.787 -0.156 11.064 1.00 15.00 H new ATOM 0 HB2 PRO A 80 54.100 -0.768 13.677 1.00 15.00 H new ATOM 0 HB3 PRO A 80 54.089 -1.981 12.413 1.00 15.00 H new ATOM 0 HG2 PRO A 80 56.146 -1.470 14.531 1.00 15.00 H new ATOM 0 HG3 PRO A 80 55.601 -2.996 13.864 1.00 15.00 H new ATOM 0 HD2 PRO A 80 57.974 -1.824 13.144 1.00 15.00 H new ATOM 0 HD3 PRO A 80 57.086 -2.896 12.079 1.00 15.00 H new ATOM 1294 N PRO A 81 54.418 1.914 12.447 1.00 15.00 N ATOM 1295 CA PRO A 81 54.398 3.276 13.044 1.00 15.00 C ATOM 1296 C PRO A 81 54.308 3.185 14.571 1.00 15.00 C ATOM 1297 O PRO A 81 53.778 2.231 15.112 1.00 15.00 O ATOM 1298 CB PRO A 81 53.140 3.920 12.461 1.00 15.00 C ATOM 1299 CG PRO A 81 52.273 2.780 12.031 1.00 15.00 C ATOM 1300 CD PRO A 81 53.184 1.630 11.693 1.00 15.00 C ATOM 0 HA PRO A 81 55.298 3.850 12.822 1.00 15.00 H new ATOM 0 HB2 PRO A 81 52.636 4.539 13.203 1.00 15.00 H new ATOM 0 HB3 PRO A 81 53.384 4.567 11.619 1.00 15.00 H new ATOM 0 HG2 PRO A 81 51.581 2.502 12.826 1.00 15.00 H new ATOM 0 HG3 PRO A 81 51.670 3.060 11.167 1.00 15.00 H new ATOM 0 HD2 PRO A 81 52.747 0.676 11.988 1.00 15.00 H new ATOM 0 HD3 PRO A 81 53.376 1.575 10.621 1.00 15.00 H new ATOM 1308 N LYS A 82 54.822 4.171 15.265 1.00 15.00 N ATOM 1309 CA LYS A 82 54.775 4.152 16.759 1.00 15.00 C ATOM 1310 C LYS A 82 53.582 4.981 17.263 1.00 15.00 C ATOM 1311 O LYS A 82 53.020 5.757 16.514 1.00 15.00 O ATOM 1312 CB LYS A 82 56.095 4.783 17.207 1.00 15.00 C ATOM 1313 CG LYS A 82 57.194 3.718 17.211 1.00 15.00 C ATOM 1314 CD LYS A 82 58.566 4.397 17.215 1.00 15.00 C ATOM 1315 CE LYS A 82 59.613 3.430 17.771 1.00 15.00 C ATOM 1316 NZ LYS A 82 59.787 2.399 16.710 1.00 15.00 N ATOM 0 H LYS A 82 55.273 4.991 14.859 1.00 15.00 H new ATOM 0 HA LYS A 82 54.651 3.144 17.155 1.00 15.00 H new ATOM 0 HB2 LYS A 82 56.367 5.599 16.537 1.00 15.00 H new ATOM 0 HB3 LYS A 82 55.986 5.212 18.203 1.00 15.00 H new ATOM 0 HG2 LYS A 82 57.091 3.078 18.087 1.00 15.00 H new ATOM 0 HG3 LYS A 82 57.097 3.077 16.335 1.00 15.00 H new ATOM 0 HD2 LYS A 82 58.836 4.700 16.203 1.00 15.00 H new ATOM 0 HD3 LYS A 82 58.534 5.302 17.821 1.00 15.00 H new ATOM 0 HE2 LYS A 82 60.552 3.943 17.981 1.00 15.00 H new ATOM 0 HE3 LYS A 82 59.279 2.981 18.706 1.00 15.00 H new ATOM 0 HZ1 LYS A 82 59.526 1.465 17.087 1.00 15.00 H new ATOM 0 HZ2 LYS A 82 59.176 2.628 15.900 1.00 15.00 H new ATOM 0 HZ3 LYS A 82 60.780 2.383 16.401 1.00 15.00 H new ATOM 1330 N PRO A 83 53.232 4.793 18.522 1.00 15.00 N ATOM 1331 CA PRO A 83 52.084 5.539 19.108 1.00 15.00 C ATOM 1332 C PRO A 83 52.407 7.036 19.195 1.00 15.00 C ATOM 1333 O PRO A 83 53.547 7.421 19.374 1.00 15.00 O ATOM 1334 CB PRO A 83 51.920 4.934 20.504 1.00 15.00 C ATOM 1335 CG PRO A 83 53.233 4.288 20.815 1.00 15.00 C ATOM 1336 CD PRO A 83 53.855 3.889 19.504 1.00 15.00 C ATOM 0 HA PRO A 83 51.176 5.456 18.510 1.00 15.00 H new ATOM 0 HB2 PRO A 83 51.676 5.702 21.238 1.00 15.00 H new ATOM 0 HB3 PRO A 83 51.110 4.205 20.523 1.00 15.00 H new ATOM 0 HG2 PRO A 83 53.882 4.977 21.355 1.00 15.00 H new ATOM 0 HG3 PRO A 83 53.091 3.417 21.454 1.00 15.00 H new ATOM 0 HD2 PRO A 83 54.938 4.008 19.524 1.00 15.00 H new ATOM 0 HD3 PRO A 83 53.653 2.844 19.268 1.00 15.00 H new ATOM 1344 N ILE A 84 51.407 7.875 19.069 1.00 15.00 N ATOM 1345 CA ILE A 84 51.639 9.351 19.141 1.00 15.00 C ATOM 1346 C ILE A 84 50.998 9.913 20.417 1.00 15.00 C ATOM 1347 O ILE A 84 49.878 9.578 20.756 1.00 15.00 O ATOM 1348 CB ILE A 84 50.965 9.935 17.886 1.00 15.00 C ATOM 1349 CG1 ILE A 84 51.585 9.314 16.621 1.00 15.00 C ATOM 1350 CG2 ILE A 84 51.169 11.454 17.849 1.00 15.00 C ATOM 1351 CD1 ILE A 84 50.810 8.053 16.230 1.00 15.00 C ATOM 0 H ILE A 84 50.437 7.599 18.919 1.00 15.00 H new ATOM 0 HA ILE A 84 52.699 9.604 19.174 1.00 15.00 H new ATOM 0 HB ILE A 84 49.900 9.707 17.920 1.00 15.00 H new ATOM 0 HG12 ILE A 84 51.563 10.034 15.803 1.00 15.00 H new ATOM 0 HG13 ILE A 84 52.631 9.068 16.801 1.00 15.00 H new ATOM 0 HG21 ILE A 84 50.691 11.864 16.959 1.00 15.00 H new ATOM 0 HG22 ILE A 84 50.726 11.902 18.738 1.00 15.00 H new ATOM 0 HG23 ILE A 84 52.236 11.677 17.823 1.00 15.00 H new ATOM 0 HD11 ILE A 84 51.252 7.617 15.334 1.00 15.00 H new ATOM 0 HD12 ILE A 84 50.855 7.331 17.045 1.00 15.00 H new ATOM 0 HD13 ILE A 84 49.770 8.312 16.032 1.00 15.00 H new ATOM 1363 N MET A 85 51.704 10.765 21.120 1.00 15.00 N ATOM 1364 CA MET A 85 51.146 11.362 22.375 1.00 15.00 C ATOM 1365 C MET A 85 51.523 12.844 22.472 1.00 15.00 C ATOM 1366 O MET A 85 52.465 13.241 21.805 1.00 15.00 O ATOM 1367 CB MET A 85 51.774 10.558 23.527 1.00 15.00 C ATOM 1368 CG MET A 85 53.307 10.629 23.463 1.00 15.00 C ATOM 1369 SD MET A 85 54.005 9.982 25.002 1.00 15.00 S ATOM 1370 CE MET A 85 53.717 11.452 26.017 1.00 15.00 C ATOM 1371 OXT MET A 85 50.863 13.556 23.211 1.00 15.00 O ATOM 0 H MET A 85 52.646 11.074 20.878 1.00 15.00 H new ATOM 0 HA MET A 85 50.057 11.313 22.403 1.00 15.00 H new ATOM 0 HB2 MET A 85 51.426 10.950 24.483 1.00 15.00 H new ATOM 0 HB3 MET A 85 51.450 9.519 23.471 1.00 15.00 H new ATOM 0 HG2 MET A 85 53.673 10.052 22.614 1.00 15.00 H new ATOM 0 HG3 MET A 85 53.628 11.659 23.310 1.00 15.00 H new ATOM 0 HE1 MET A 85 54.673 11.877 26.322 1.00 15.00 H new ATOM 0 HE2 MET A 85 53.160 12.190 25.439 1.00 15.00 H new ATOM 0 HE3 MET A 85 53.144 11.176 26.902 1.00 15.00 H new TER 1381 MET A 85