USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1069 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 44 THR OG1 : rot -150:sc= 0.526 USER MOD Set 1.2: A 63 LYS NZ :NH3+ 163:sc= 1.71 (180deg=1.01) USER MOD Set 2.1: A 59 LYS NZ :NH3+ 163:sc= 1.31 (180deg=1.16) USER MOD Set 2.2: A 71 GLN : amide:sc= 0.685 K(o=2,f=0.85) USER MOD Set 3.1: A 51 SER OG : rot -154:sc= 1.3 USER MOD Set 3.2: A 126 HIS : no HE2:sc= 1.07 K(o=2.4,f=-2.3) USER MOD Single : A 0 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 171:sc= 0 (180deg=-0.11) USER MOD Single : A 3 THR OG1 : rot 5:sc= 0.477 USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -1 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A -3 SER OG : rot 180:sc= 0 USER MOD Single : A -4 GLY N :NH3+ -114:sc= 0.059 (180deg=0) USER MOD Single : A 12 CYS SG : rot 180:sc= -0.115 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 2.52 (180deg=2.52) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 30:sc= 0 USER MOD Single : A 27 SER OG : rot 180:sc= 0.197 USER MOD Single : A 28 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 TYR OH : rot 180:sc=-0.00211 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 158:sc= 1.07 (180deg=0.937) USER MOD Single : A 40 GLN : amide:sc= -0.287 X(o=-0.29,f=-0.48) USER MOD Single : A 50 THR OG1 : rot 24:sc= 0.762 USER MOD Single : A 52 LYS NZ :NH3+ -159:sc= 0.265 (180deg=0.136) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= 0.205 X(o=0.21,f=-0.17) USER MOD Single : A 77 TYR OH : rot 30:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 72:sc= 1.2 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= 1.04 K(o=1,f=0) USER MOD Single : A 100 THR OG1 : rot -36:sc= 0.326 USER MOD Single : A 103 SER OG : rot -130:sc= 0.826 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 ASN : amide:sc= -0.136 K(o=-0.14,f=-1.3) USER MOD Single : A 122 SER OG : rot -88:sc= 1.25 USER MOD Single : A 124 GLN : amide:sc= 0.817 K(o=0.82,f=0) USER MOD Single : A 128 LYS NZ :NH3+ 175:sc= 1.9 (180deg=1.85) USER MOD Single : A 131 LYS NZ :NH3+ -176:sc= 1.2 (180deg=1.16) USER MOD Single : A 132 GLN : amide:sc= 0.93 K(o=0.93,f=-0.039) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -4 -1.420 35.379 11.957 1.00 0.00 N ATOM 2 CA GLY A -4 -2.502 34.377 12.078 1.00 0.00 C ATOM 3 C GLY A -4 -3.705 34.731 11.215 1.00 0.00 C ATOM 4 O GLY A -4 -3.863 35.878 10.790 1.00 0.00 O ATOM 0 H1 GLY A -4 -0.592 34.942 11.504 1.00 0.00 H new ATOM 0 H2 GLY A -4 -1.750 36.178 11.379 1.00 0.00 H new ATOM 0 H3 GLY A -4 -1.157 35.722 12.903 1.00 0.00 H new ATOM 0 HA2 GLY A -4 -2.123 33.397 11.788 1.00 0.00 H new ATOM 0 HA3 GLY A -4 -2.813 34.303 13.120 1.00 0.00 H new ATOM 10 N SER A -3 -4.572 33.750 10.947 1.00 0.00 N ATOM 11 CA SER A -3 -5.778 33.908 10.113 1.00 0.00 C ATOM 12 C SER A -3 -6.839 34.830 10.757 1.00 0.00 C ATOM 13 O SER A -3 -6.970 34.829 11.986 1.00 0.00 O ATOM 14 CB SER A -3 -6.410 32.538 9.832 1.00 0.00 C ATOM 15 OG SER A -3 -5.465 31.677 9.212 1.00 0.00 O ATOM 0 H SER A -3 -4.457 32.803 11.309 1.00 0.00 H new ATOM 0 HA SER A -3 -5.452 34.377 9.185 1.00 0.00 H new ATOM 0 HB2 SER A -3 -6.761 32.094 10.764 1.00 0.00 H new ATOM 0 HB3 SER A -3 -7.281 32.657 9.188 1.00 0.00 H new ATOM 0 HG SER A -3 -5.880 30.806 9.040 1.00 0.00 H new ATOM 21 N PRO A -2 -7.651 35.570 9.968 1.00 0.00 N ATOM 22 CA PRO A -2 -8.770 36.370 10.493 1.00 0.00 C ATOM 23 C PRO A -2 -9.910 35.533 11.104 1.00 0.00 C ATOM 24 O PRO A -2 -10.644 36.015 11.970 1.00 0.00 O ATOM 25 CB PRO A -2 -9.290 37.184 9.298 1.00 0.00 C ATOM 26 CG PRO A -2 -8.106 37.229 8.338 1.00 0.00 C ATOM 27 CD PRO A -2 -7.454 35.867 8.554 1.00 0.00 C ATOM 0 HA PRO A -2 -8.415 36.991 11.316 1.00 0.00 H new ATOM 0 HB2 PRO A -2 -10.158 36.710 8.839 1.00 0.00 H new ATOM 0 HB3 PRO A -2 -9.597 38.185 9.600 1.00 0.00 H new ATOM 0 HG2 PRO A -2 -8.426 37.366 7.305 1.00 0.00 H new ATOM 0 HG3 PRO A -2 -7.425 38.047 8.572 1.00 0.00 H new ATOM 0 HD2 PRO A -2 -7.914 35.106 7.924 1.00 0.00 H new ATOM 0 HD3 PRO A -2 -6.394 35.893 8.301 1.00 0.00 H new ATOM 35 N ASN A -1 -10.068 34.286 10.649 1.00 0.00 N ATOM 36 CA ASN A -1 -11.093 33.339 11.103 1.00 0.00 C ATOM 37 C ASN A -1 -10.699 32.624 12.415 1.00 0.00 C ATOM 38 O ASN A -1 -9.528 32.584 12.797 1.00 0.00 O ATOM 39 CB ASN A -1 -11.382 32.344 9.962 1.00 0.00 C ATOM 40 CG ASN A -1 -11.953 33.025 8.727 1.00 0.00 C ATOM 41 OD1 ASN A -1 -13.075 33.514 8.723 1.00 0.00 O ATOM 42 ND2 ASN A -1 -11.204 33.098 7.648 1.00 0.00 N ATOM 0 H ASN A -1 -9.463 33.893 9.928 1.00 0.00 H new ATOM 0 HA ASN A -1 -12.003 33.889 11.341 1.00 0.00 H new ATOM 0 HB2 ASN A -1 -10.461 31.826 9.694 1.00 0.00 H new ATOM 0 HB3 ASN A -1 -12.084 31.587 10.313 1.00 0.00 H new ATOM 0 HD21 ASN A -1 -11.559 33.561 6.811 1.00 0.00 H new ATOM 0 HD22 ASN A -1 -10.269 32.692 7.648 1.00 0.00 H new ATOM 49 N SER A 0 -11.680 32.011 13.086 1.00 0.00 N ATOM 50 CA SER A 0 -11.524 31.313 14.378 1.00 0.00 C ATOM 51 C SER A 0 -10.834 29.934 14.304 1.00 0.00 C ATOM 52 O SER A 0 -10.589 29.310 15.340 1.00 0.00 O ATOM 53 CB SER A 0 -12.898 31.187 15.051 1.00 0.00 C ATOM 54 OG SER A 0 -13.812 30.509 14.198 1.00 0.00 O ATOM 0 H SER A 0 -12.638 31.983 12.738 1.00 0.00 H new ATOM 0 HA SER A 0 -10.847 31.928 14.971 1.00 0.00 H new ATOM 0 HB2 SER A 0 -12.800 30.646 15.992 1.00 0.00 H new ATOM 0 HB3 SER A 0 -13.283 32.178 15.292 1.00 0.00 H new ATOM 0 HG SER A 0 -14.682 30.436 14.643 1.00 0.00 H new ATOM 60 N MET A 1 -10.500 29.456 13.099 1.00 0.00 N ATOM 61 CA MET A 1 -9.776 28.207 12.848 1.00 0.00 C ATOM 62 C MET A 1 -8.370 28.190 13.475 1.00 0.00 C ATOM 63 O MET A 1 -7.698 29.221 13.575 1.00 0.00 O ATOM 64 CB MET A 1 -9.722 27.925 11.335 1.00 0.00 C ATOM 65 CG MET A 1 -8.988 29.009 10.528 1.00 0.00 C ATOM 66 SD MET A 1 -8.856 28.704 8.741 1.00 0.00 S ATOM 67 CE MET A 1 -10.602 28.743 8.240 1.00 0.00 C ATOM 0 H MET A 1 -10.737 29.950 12.239 1.00 0.00 H new ATOM 0 HA MET A 1 -10.329 27.406 13.339 1.00 0.00 H new ATOM 0 HB2 MET A 1 -9.229 26.967 11.171 1.00 0.00 H new ATOM 0 HB3 MET A 1 -10.740 27.829 10.956 1.00 0.00 H new ATOM 0 HG2 MET A 1 -9.501 29.959 10.679 1.00 0.00 H new ATOM 0 HG3 MET A 1 -7.983 29.121 10.934 1.00 0.00 H new ATOM 0 HE1 MET A 1 -10.669 28.731 7.152 1.00 0.00 H new ATOM 0 HE2 MET A 1 -11.116 27.871 8.645 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.070 29.650 8.622 1.00 0.00 H new ATOM 77 N ALA A 2 -7.922 26.999 13.873 1.00 0.00 N ATOM 78 CA ALA A 2 -6.585 26.747 14.422 1.00 0.00 C ATOM 79 C ALA A 2 -6.135 25.296 14.169 1.00 0.00 C ATOM 80 O ALA A 2 -5.103 25.066 13.534 1.00 0.00 O ATOM 81 CB ALA A 2 -6.586 27.081 15.923 1.00 0.00 C ATOM 0 H ALA A 2 -8.495 26.157 13.822 1.00 0.00 H new ATOM 0 HA ALA A 2 -5.866 27.389 13.914 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -5.595 26.896 16.338 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -6.847 28.130 16.062 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -7.316 26.454 16.435 1.00 0.00 H new ATOM 87 N THR A 3 -6.914 24.319 14.643 1.00 0.00 N ATOM 88 CA THR A 3 -6.794 22.885 14.323 1.00 0.00 C ATOM 89 C THR A 3 -8.162 22.217 14.495 1.00 0.00 C ATOM 90 O THR A 3 -8.714 22.179 15.597 1.00 0.00 O ATOM 91 CB THR A 3 -5.758 22.175 15.218 1.00 0.00 C ATOM 92 OG1 THR A 3 -4.454 22.674 14.990 1.00 0.00 O ATOM 93 CG2 THR A 3 -5.679 20.675 14.929 1.00 0.00 C ATOM 0 H THR A 3 -7.680 24.510 15.289 1.00 0.00 H new ATOM 0 HA THR A 3 -6.451 22.798 13.292 1.00 0.00 H new ATOM 0 HB THR A 3 -6.089 22.359 16.240 1.00 0.00 H new ATOM 0 HG1 THR A 3 -4.497 23.430 14.368 1.00 0.00 H new ATOM 0 HG21 THR A 3 -4.937 20.217 15.583 1.00 0.00 H new ATOM 0 HG22 THR A 3 -6.652 20.218 15.109 1.00 0.00 H new ATOM 0 HG23 THR A 3 -5.392 20.519 13.889 1.00 0.00 H new ATOM 101 N GLU A 4 -8.714 21.692 13.401 1.00 0.00 N ATOM 102 CA GLU A 4 -10.069 21.110 13.333 1.00 0.00 C ATOM 103 C GLU A 4 -10.199 19.986 12.279 1.00 0.00 C ATOM 104 O GLU A 4 -11.301 19.595 11.888 1.00 0.00 O ATOM 105 CB GLU A 4 -11.122 22.229 13.158 1.00 0.00 C ATOM 106 CG GLU A 4 -10.947 23.136 11.926 1.00 0.00 C ATOM 107 CD GLU A 4 -9.728 24.076 12.038 1.00 0.00 C ATOM 108 OE1 GLU A 4 -9.683 24.914 12.970 1.00 0.00 O ATOM 109 OE2 GLU A 4 -8.795 23.957 11.209 1.00 0.00 O ATOM 0 H GLU A 4 -8.223 21.655 12.508 1.00 0.00 H new ATOM 0 HA GLU A 4 -10.263 20.614 14.284 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -12.108 21.767 13.107 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -11.109 22.855 14.050 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -10.840 22.515 11.037 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -11.848 23.734 11.790 1.00 0.00 H new ATOM 116 N LEU A 5 -9.064 19.441 11.829 1.00 0.00 N ATOM 117 CA LEU A 5 -8.935 18.403 10.798 1.00 0.00 C ATOM 118 C LEU A 5 -9.187 16.989 11.373 1.00 0.00 C ATOM 119 O LEU A 5 -8.386 16.065 11.226 1.00 0.00 O ATOM 120 CB LEU A 5 -7.569 18.605 10.102 1.00 0.00 C ATOM 121 CG LEU A 5 -7.585 18.316 8.593 1.00 0.00 C ATOM 122 CD1 LEU A 5 -6.261 18.756 7.965 1.00 0.00 C ATOM 123 CD2 LEU A 5 -7.786 16.839 8.258 1.00 0.00 C ATOM 0 H LEU A 5 -8.157 19.729 12.196 1.00 0.00 H new ATOM 0 HA LEU A 5 -9.708 18.497 10.036 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -7.241 19.632 10.261 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -6.832 17.958 10.577 1.00 0.00 H new ATOM 0 HG LEU A 5 -8.431 18.874 8.192 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -6.279 18.548 6.895 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -6.120 19.825 8.125 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -5.439 18.209 8.427 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -7.787 16.708 7.176 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -6.976 16.254 8.694 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -8.739 16.500 8.665 1.00 0.00 H new ATOM 135 N GLU A 6 -10.298 16.828 12.092 1.00 0.00 N ATOM 136 CA GLU A 6 -10.645 15.637 12.885 1.00 0.00 C ATOM 137 C GLU A 6 -11.324 14.536 12.037 1.00 0.00 C ATOM 138 O GLU A 6 -12.352 13.967 12.415 1.00 0.00 O ATOM 139 CB GLU A 6 -11.445 16.083 14.127 1.00 0.00 C ATOM 140 CG GLU A 6 -11.400 15.062 15.273 1.00 0.00 C ATOM 141 CD GLU A 6 -12.169 15.580 16.503 1.00 0.00 C ATOM 142 OE1 GLU A 6 -13.397 15.340 16.608 1.00 0.00 O ATOM 143 OE2 GLU A 6 -11.549 16.226 17.385 1.00 0.00 O ATOM 0 H GLU A 6 -11.015 17.552 12.143 1.00 0.00 H new ATOM 0 HA GLU A 6 -9.736 15.151 13.240 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -11.052 17.036 14.482 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -12.483 16.253 13.841 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -11.831 14.118 14.941 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -10.364 14.861 15.545 1.00 0.00 H new ATOM 150 N TYR A 7 -10.774 14.261 10.849 1.00 0.00 N ATOM 151 CA TYR A 7 -11.293 13.294 9.879 1.00 0.00 C ATOM 152 C TYR A 7 -10.186 12.599 9.071 1.00 0.00 C ATOM 153 O TYR A 7 -9.110 13.147 8.829 1.00 0.00 O ATOM 154 CB TYR A 7 -12.313 13.972 8.956 1.00 0.00 C ATOM 155 CG TYR A 7 -11.802 15.195 8.224 1.00 0.00 C ATOM 156 CD1 TYR A 7 -12.008 16.474 8.778 1.00 0.00 C ATOM 157 CD2 TYR A 7 -11.128 15.053 6.995 1.00 0.00 C ATOM 158 CE1 TYR A 7 -11.575 17.624 8.094 1.00 0.00 C ATOM 159 CE2 TYR A 7 -10.684 16.207 6.318 1.00 0.00 C ATOM 160 CZ TYR A 7 -10.917 17.493 6.853 1.00 0.00 C ATOM 161 OH TYR A 7 -10.493 18.594 6.173 1.00 0.00 O ATOM 0 H TYR A 7 -9.924 14.723 10.526 1.00 0.00 H new ATOM 0 HA TYR A 7 -11.790 12.505 10.444 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -12.655 13.244 8.221 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -13.182 14.259 9.548 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -12.501 16.572 9.734 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -10.954 14.073 6.577 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -11.745 18.603 8.517 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -10.160 16.106 5.379 1.00 0.00 H new ATOM 0 HH TYR A 7 -10.060 18.317 5.339 1.00 0.00 H new ATOM 171 N GLU A 8 -10.487 11.361 8.683 1.00 0.00 N ATOM 172 CA GLU A 8 -9.642 10.353 8.015 1.00 0.00 C ATOM 173 C GLU A 8 -10.546 9.129 7.751 1.00 0.00 C ATOM 174 O GLU A 8 -10.597 8.166 8.517 1.00 0.00 O ATOM 175 CB GLU A 8 -8.454 9.990 8.927 1.00 0.00 C ATOM 176 CG GLU A 8 -7.210 9.528 8.176 1.00 0.00 C ATOM 177 CD GLU A 8 -6.071 9.216 9.152 1.00 0.00 C ATOM 178 OE1 GLU A 8 -6.142 8.169 9.841 1.00 0.00 O ATOM 179 OE2 GLU A 8 -5.113 10.022 9.231 1.00 0.00 O ATOM 0 H GLU A 8 -11.425 10.994 8.842 1.00 0.00 H new ATOM 0 HA GLU A 8 -9.227 10.723 7.078 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -8.197 10.858 9.534 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -8.764 9.202 9.613 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -7.444 8.641 7.587 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -6.894 10.301 7.476 1.00 0.00 H new ATOM 186 N SER A 9 -11.384 9.223 6.723 1.00 0.00 N ATOM 187 CA SER A 9 -12.513 8.316 6.495 1.00 0.00 C ATOM 188 C SER A 9 -12.031 6.917 6.091 1.00 0.00 C ATOM 189 O SER A 9 -11.408 6.749 5.044 1.00 0.00 O ATOM 190 CB SER A 9 -13.423 8.928 5.424 1.00 0.00 C ATOM 191 OG SER A 9 -14.767 8.536 5.648 1.00 0.00 O ATOM 0 H SER A 9 -11.299 9.946 6.008 1.00 0.00 H new ATOM 0 HA SER A 9 -13.076 8.195 7.420 1.00 0.00 H new ATOM 0 HB2 SER A 9 -13.344 10.015 5.446 1.00 0.00 H new ATOM 0 HB3 SER A 9 -13.101 8.605 4.434 1.00 0.00 H new ATOM 0 HG SER A 9 -15.342 8.932 4.961 1.00 0.00 H new ATOM 197 N VAL A 10 -12.261 5.915 6.941 1.00 0.00 N ATOM 198 CA VAL A 10 -11.681 4.557 6.822 1.00 0.00 C ATOM 199 C VAL A 10 -12.339 3.759 5.686 1.00 0.00 C ATOM 200 O VAL A 10 -13.546 3.864 5.457 1.00 0.00 O ATOM 201 CB VAL A 10 -11.770 3.808 8.169 1.00 0.00 C ATOM 202 CG1 VAL A 10 -11.146 2.409 8.110 1.00 0.00 C ATOM 203 CG2 VAL A 10 -11.036 4.573 9.279 1.00 0.00 C ATOM 0 H VAL A 10 -12.869 6.018 7.754 1.00 0.00 H new ATOM 0 HA VAL A 10 -10.627 4.663 6.566 1.00 0.00 H new ATOM 0 HB VAL A 10 -12.836 3.728 8.381 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -11.237 1.929 9.084 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -11.664 1.811 7.361 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -10.092 2.492 7.843 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -11.116 4.021 10.216 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -9.985 4.683 9.011 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -11.485 5.559 9.399 1.00 0.00 H new ATOM 213 N LEU A 11 -11.542 2.941 4.987 1.00 0.00 N ATOM 214 CA LEU A 11 -11.931 2.178 3.789 1.00 0.00 C ATOM 215 C LEU A 11 -11.573 0.684 3.896 1.00 0.00 C ATOM 216 O LEU A 11 -12.360 -0.164 3.478 1.00 0.00 O ATOM 217 CB LEU A 11 -11.259 2.804 2.549 1.00 0.00 C ATOM 218 CG LEU A 11 -11.678 4.249 2.215 1.00 0.00 C ATOM 219 CD1 LEU A 11 -10.880 4.753 1.011 1.00 0.00 C ATOM 220 CD2 LEU A 11 -13.164 4.359 1.876 1.00 0.00 C ATOM 0 H LEU A 11 -10.569 2.785 5.249 1.00 0.00 H new ATOM 0 HA LEU A 11 -13.016 2.232 3.697 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -10.179 2.784 2.696 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -11.475 2.175 1.686 1.00 0.00 H new ATOM 0 HG LEU A 11 -11.478 4.850 3.102 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -11.179 5.775 0.778 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -9.816 4.731 1.245 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -11.076 4.113 0.151 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -13.409 5.396 1.648 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -13.387 3.735 1.011 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -13.757 4.024 2.727 1.00 0.00 H new ATOM 232 N CYS A 12 -10.414 0.357 4.478 1.00 0.00 N ATOM 233 CA CYS A 12 -9.990 -1.016 4.779 1.00 0.00 C ATOM 234 C CYS A 12 -9.003 -1.034 5.949 1.00 0.00 C ATOM 235 O CYS A 12 -8.072 -0.230 5.994 1.00 0.00 O ATOM 236 CB CYS A 12 -9.340 -1.638 3.537 1.00 0.00 C ATOM 237 SG CYS A 12 -9.045 -3.412 3.789 1.00 0.00 S ATOM 0 H CYS A 12 -9.727 1.057 4.760 1.00 0.00 H new ATOM 0 HA CYS A 12 -10.867 -1.598 5.061 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -9.985 -1.491 2.670 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -8.398 -1.134 3.322 1.00 0.00 H new ATOM 0 HG CYS A 12 -8.497 -3.916 2.724 1.00 0.00 H new ATOM 243 N VAL A 13 -9.180 -1.980 6.869 1.00 0.00 N ATOM 244 CA VAL A 13 -8.237 -2.273 7.959 1.00 0.00 C ATOM 245 C VAL A 13 -7.952 -3.778 7.994 1.00 0.00 C ATOM 246 O VAL A 13 -8.883 -4.585 8.046 1.00 0.00 O ATOM 247 CB VAL A 13 -8.765 -1.745 9.310 1.00 0.00 C ATOM 248 CG1 VAL A 13 -7.839 -2.093 10.484 1.00 0.00 C ATOM 249 CG2 VAL A 13 -8.914 -0.215 9.279 1.00 0.00 C ATOM 0 H VAL A 13 -10.003 -2.582 6.882 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.297 -1.753 7.774 1.00 0.00 H new ATOM 0 HB VAL A 13 -9.730 -2.230 9.459 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -8.259 -1.697 11.409 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -7.743 -3.176 10.563 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -6.856 -1.653 10.315 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -9.287 0.134 10.242 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -7.944 0.241 9.079 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -9.616 0.066 8.494 1.00 0.00 H new ATOM 259 N LYS A 14 -6.667 -4.151 7.973 1.00 0.00 N ATOM 260 CA LYS A 14 -6.168 -5.539 8.071 1.00 0.00 C ATOM 261 C LYS A 14 -5.084 -5.655 9.160 1.00 0.00 C ATOM 262 O LYS A 14 -4.251 -4.750 9.271 1.00 0.00 O ATOM 263 CB LYS A 14 -5.645 -6.051 6.710 1.00 0.00 C ATOM 264 CG LYS A 14 -6.681 -6.077 5.571 1.00 0.00 C ATOM 265 CD LYS A 14 -7.780 -7.126 5.781 1.00 0.00 C ATOM 266 CE LYS A 14 -8.727 -7.161 4.581 1.00 0.00 C ATOM 267 NZ LYS A 14 -9.748 -8.223 4.744 1.00 0.00 N ATOM 0 H LYS A 14 -5.912 -3.471 7.884 1.00 0.00 H new ATOM 0 HA LYS A 14 -7.007 -6.173 8.357 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -4.808 -5.424 6.403 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -5.255 -7.060 6.846 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -7.139 -5.092 5.482 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -6.171 -6.277 4.629 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -7.330 -8.108 5.925 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -8.341 -6.897 6.687 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -9.217 -6.194 4.471 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.157 -7.335 3.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -10.379 -8.228 3.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -9.278 -9.147 4.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -10.304 -8.041 5.603 1.00 0.00 H new ATOM 281 N PRO A 15 -5.066 -6.740 9.959 1.00 0.00 N ATOM 282 CA PRO A 15 -4.248 -6.837 11.174 1.00 0.00 C ATOM 283 C PRO A 15 -2.757 -7.118 10.955 1.00 0.00 C ATOM 284 O PRO A 15 -1.950 -6.776 11.818 1.00 0.00 O ATOM 285 CB PRO A 15 -4.846 -7.994 11.973 1.00 0.00 C ATOM 286 CG PRO A 15 -5.489 -8.878 10.903 1.00 0.00 C ATOM 287 CD PRO A 15 -5.988 -7.866 9.883 1.00 0.00 C ATOM 0 HA PRO A 15 -4.275 -5.867 11.671 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -4.081 -8.533 12.531 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -5.581 -7.643 12.697 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -4.770 -9.571 10.466 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -6.304 -9.477 11.310 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -6.001 -8.294 8.881 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -7.007 -7.553 10.109 1.00 0.00 H new ATOM 295 N ASP A 16 -2.385 -7.779 9.856 1.00 0.00 N ATOM 296 CA ASP A 16 -1.001 -8.183 9.602 1.00 0.00 C ATOM 297 C ASP A 16 -0.613 -7.995 8.132 1.00 0.00 C ATOM 298 O ASP A 16 -1.162 -8.625 7.223 1.00 0.00 O ATOM 299 CB ASP A 16 -0.761 -9.620 10.076 1.00 0.00 C ATOM 300 CG ASP A 16 0.744 -9.930 10.158 1.00 0.00 C ATOM 301 OD1 ASP A 16 1.211 -10.853 9.451 1.00 0.00 O ATOM 302 OD2 ASP A 16 1.456 -9.262 10.947 1.00 0.00 O ATOM 0 H ASP A 16 -3.035 -8.049 9.118 1.00 0.00 H new ATOM 0 HA ASP A 16 -0.350 -7.528 10.181 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -1.220 -9.765 11.054 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -1.243 -10.318 9.391 1.00 0.00 H new ATOM 307 N VAL A 17 0.345 -7.099 7.925 1.00 0.00 N ATOM 308 CA VAL A 17 0.935 -6.724 6.635 1.00 0.00 C ATOM 309 C VAL A 17 2.426 -6.415 6.818 1.00 0.00 C ATOM 310 O VAL A 17 2.842 -5.905 7.864 1.00 0.00 O ATOM 311 CB VAL A 17 0.140 -5.562 5.999 1.00 0.00 C ATOM 312 CG1 VAL A 17 0.330 -4.208 6.698 1.00 0.00 C ATOM 313 CG2 VAL A 17 0.459 -5.381 4.513 1.00 0.00 C ATOM 0 H VAL A 17 0.760 -6.580 8.699 1.00 0.00 H new ATOM 0 HA VAL A 17 0.869 -7.557 5.935 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.899 -5.866 6.127 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -0.263 -3.449 6.188 1.00 0.00 H new ATOM 0 HG12 VAL A 17 0.005 -4.285 7.736 1.00 0.00 H new ATOM 0 HG13 VAL A 17 1.383 -3.927 6.667 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -0.125 -4.552 4.114 1.00 0.00 H new ATOM 0 HG22 VAL A 17 1.521 -5.167 4.392 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.209 -6.294 3.973 1.00 0.00 H new ATOM 323 N SER A 18 3.237 -6.746 5.814 1.00 0.00 N ATOM 324 CA SER A 18 4.705 -6.764 5.920 1.00 0.00 C ATOM 325 C SER A 18 5.369 -5.893 4.857 1.00 0.00 C ATOM 326 O SER A 18 5.050 -6.034 3.681 1.00 0.00 O ATOM 327 CB SER A 18 5.211 -8.206 5.789 1.00 0.00 C ATOM 328 OG SER A 18 4.639 -9.038 6.787 1.00 0.00 O ATOM 0 H SER A 18 2.894 -7.013 4.891 1.00 0.00 H new ATOM 0 HA SER A 18 4.970 -6.356 6.895 1.00 0.00 H new ATOM 0 HB2 SER A 18 4.963 -8.594 4.801 1.00 0.00 H new ATOM 0 HB3 SER A 18 6.297 -8.223 5.875 1.00 0.00 H new ATOM 0 HG SER A 18 4.975 -9.953 6.682 1.00 0.00 H new ATOM 334 N VAL A 19 6.294 -5.013 5.256 1.00 0.00 N ATOM 335 CA VAL A 19 7.022 -4.084 4.371 1.00 0.00 C ATOM 336 C VAL A 19 8.359 -4.649 3.928 1.00 0.00 C ATOM 337 O VAL A 19 9.141 -5.148 4.738 1.00 0.00 O ATOM 338 CB VAL A 19 7.216 -2.697 5.015 1.00 0.00 C ATOM 339 CG1 VAL A 19 8.123 -1.760 4.198 1.00 0.00 C ATOM 340 CG2 VAL A 19 5.871 -1.984 5.153 1.00 0.00 C ATOM 0 H VAL A 19 6.569 -4.921 6.234 1.00 0.00 H new ATOM 0 HA VAL A 19 6.397 -3.959 3.487 1.00 0.00 H new ATOM 0 HB VAL A 19 7.684 -2.894 5.980 1.00 0.00 H new ATOM 0 HG11 VAL A 19 8.214 -0.803 4.711 1.00 0.00 H new ATOM 0 HG12 VAL A 19 9.110 -2.210 4.092 1.00 0.00 H new ATOM 0 HG13 VAL A 19 7.688 -1.602 3.211 1.00 0.00 H new ATOM 0 HG21 VAL A 19 6.023 -1.006 5.609 1.00 0.00 H new ATOM 0 HG22 VAL A 19 5.423 -1.859 4.167 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.207 -2.578 5.781 1.00 0.00 H new ATOM 350 N TYR A 20 8.653 -4.460 2.645 1.00 0.00 N ATOM 351 CA TYR A 20 9.955 -4.713 2.050 1.00 0.00 C ATOM 352 C TYR A 20 10.378 -3.524 1.182 1.00 0.00 C ATOM 353 O TYR A 20 9.650 -3.086 0.287 1.00 0.00 O ATOM 354 CB TYR A 20 9.954 -6.020 1.236 1.00 0.00 C ATOM 355 CG TYR A 20 8.894 -7.046 1.599 1.00 0.00 C ATOM 356 CD1 TYR A 20 9.135 -7.989 2.613 1.00 0.00 C ATOM 357 CD2 TYR A 20 7.658 -7.041 0.928 1.00 0.00 C ATOM 358 CE1 TYR A 20 8.143 -8.922 2.967 1.00 0.00 C ATOM 359 CE2 TYR A 20 6.666 -7.979 1.268 1.00 0.00 C ATOM 360 CZ TYR A 20 6.902 -8.920 2.293 1.00 0.00 C ATOM 361 OH TYR A 20 5.941 -9.829 2.612 1.00 0.00 O ATOM 0 H TYR A 20 7.968 -4.116 1.972 1.00 0.00 H new ATOM 0 HA TYR A 20 10.682 -4.832 2.854 1.00 0.00 H new ATOM 0 HB2 TYR A 20 9.835 -5.765 0.183 1.00 0.00 H new ATOM 0 HB3 TYR A 20 10.932 -6.489 1.342 1.00 0.00 H new ATOM 0 HD1 TYR A 20 10.087 -7.998 3.123 1.00 0.00 H new ATOM 0 HD2 TYR A 20 7.470 -6.316 0.150 1.00 0.00 H new ATOM 0 HE1 TYR A 20 8.330 -9.639 3.753 1.00 0.00 H new ATOM 0 HE2 TYR A 20 5.722 -7.979 0.743 1.00 0.00 H new ATOM 0 HH TYR A 20 6.023 -10.073 3.557 1.00 0.00 H new ATOM 371 N ARG A 21 11.589 -3.027 1.415 1.00 0.00 N ATOM 372 CA ARG A 21 12.332 -2.180 0.472 1.00 0.00 C ATOM 373 C ARG A 21 12.546 -2.902 -0.867 1.00 0.00 C ATOM 374 O ARG A 21 12.909 -4.080 -0.900 1.00 0.00 O ATOM 375 CB ARG A 21 13.666 -1.769 1.121 1.00 0.00 C ATOM 376 CG ARG A 21 13.494 -0.583 2.088 1.00 0.00 C ATOM 377 CD ARG A 21 13.781 0.791 1.458 1.00 0.00 C ATOM 378 NE ARG A 21 12.965 1.087 0.255 1.00 0.00 N ATOM 379 CZ ARG A 21 13.320 0.926 -1.008 1.00 0.00 C ATOM 380 NH1 ARG A 21 12.471 1.111 -1.973 1.00 0.00 N ATOM 381 NH2 ARG A 21 14.502 0.523 -1.369 1.00 0.00 N ATOM 0 H ARG A 21 12.097 -3.202 2.282 1.00 0.00 H new ATOM 0 HA ARG A 21 11.756 -1.282 0.251 1.00 0.00 H new ATOM 0 HB2 ARG A 21 14.084 -2.619 1.660 1.00 0.00 H new ATOM 0 HB3 ARG A 21 14.381 -1.502 0.343 1.00 0.00 H new ATOM 0 HG2 ARG A 21 12.474 -0.588 2.473 1.00 0.00 H new ATOM 0 HG3 ARG A 21 14.158 -0.725 2.941 1.00 0.00 H new ATOM 0 HD2 ARG A 21 13.603 1.565 2.204 1.00 0.00 H new ATOM 0 HD3 ARG A 21 14.836 0.843 1.190 1.00 0.00 H new ATOM 0 HE ARG A 21 12.028 1.455 0.420 1.00 0.00 H new ATOM 0 HH11 ARG A 21 11.511 1.385 -1.762 1.00 0.00 H new ATOM 0 HH12 ARG A 21 12.764 0.982 -2.942 1.00 0.00 H new ATOM 0 HH21 ARG A 21 15.208 0.314 -0.663 1.00 0.00 H new ATOM 0 HH22 ARG A 21 14.724 0.415 -2.359 1.00 0.00 H new ATOM 395 N ILE A 22 12.329 -2.172 -1.960 1.00 0.00 N ATOM 396 CA ILE A 22 12.417 -2.643 -3.355 1.00 0.00 C ATOM 397 C ILE A 22 13.460 -1.855 -4.174 1.00 0.00 C ATOM 398 O ILE A 22 13.683 -0.669 -3.895 1.00 0.00 O ATOM 399 CB ILE A 22 11.032 -2.584 -4.049 1.00 0.00 C ATOM 400 CG1 ILE A 22 10.474 -1.144 -4.151 1.00 0.00 C ATOM 401 CG2 ILE A 22 10.029 -3.522 -3.360 1.00 0.00 C ATOM 402 CD1 ILE A 22 9.119 -1.072 -4.857 1.00 0.00 C ATOM 0 H ILE A 22 12.074 -1.186 -1.901 1.00 0.00 H new ATOM 0 HA ILE A 22 12.748 -3.681 -3.316 1.00 0.00 H new ATOM 0 HB ILE A 22 11.180 -2.931 -5.072 1.00 0.00 H new ATOM 0 HG12 ILE A 22 10.377 -0.727 -3.149 1.00 0.00 H new ATOM 0 HG13 ILE A 22 11.190 -0.521 -4.687 1.00 0.00 H new ATOM 0 HG21 ILE A 22 9.066 -3.461 -3.867 1.00 0.00 H new ATOM 0 HG22 ILE A 22 10.399 -4.546 -3.405 1.00 0.00 H new ATOM 0 HG23 ILE A 22 9.910 -3.225 -2.318 1.00 0.00 H new ATOM 0 HD11 ILE A 22 8.783 -0.036 -4.896 1.00 0.00 H new ATOM 0 HD12 ILE A 22 9.216 -1.460 -5.871 1.00 0.00 H new ATOM 0 HD13 ILE A 22 8.391 -1.669 -4.308 1.00 0.00 H new ATOM 414 N PRO A 23 14.068 -2.453 -5.216 1.00 0.00 N ATOM 415 CA PRO A 23 14.752 -1.692 -6.263 1.00 0.00 C ATOM 416 C PRO A 23 13.739 -0.898 -7.120 1.00 0.00 C ATOM 417 O PRO A 23 12.560 -1.268 -7.175 1.00 0.00 O ATOM 418 CB PRO A 23 15.497 -2.744 -7.091 1.00 0.00 C ATOM 419 CG PRO A 23 14.591 -3.971 -6.985 1.00 0.00 C ATOM 420 CD PRO A 23 14.032 -3.869 -5.565 1.00 0.00 C ATOM 0 HA PRO A 23 15.436 -0.947 -5.855 1.00 0.00 H new ATOM 0 HB2 PRO A 23 15.626 -2.426 -8.126 1.00 0.00 H new ATOM 0 HB3 PRO A 23 16.492 -2.941 -6.692 1.00 0.00 H new ATOM 0 HG2 PRO A 23 13.798 -3.952 -7.733 1.00 0.00 H new ATOM 0 HG3 PRO A 23 15.147 -4.897 -7.134 1.00 0.00 H new ATOM 0 HD2 PRO A 23 13.014 -4.256 -5.518 1.00 0.00 H new ATOM 0 HD3 PRO A 23 14.629 -4.457 -4.868 1.00 0.00 H new ATOM 428 N PRO A 24 14.162 0.172 -7.819 1.00 0.00 N ATOM 429 CA PRO A 24 13.297 0.905 -8.744 1.00 0.00 C ATOM 430 C PRO A 24 12.859 0.027 -9.930 1.00 0.00 C ATOM 431 O PRO A 24 13.618 -0.824 -10.409 1.00 0.00 O ATOM 432 CB PRO A 24 14.115 2.121 -9.192 1.00 0.00 C ATOM 433 CG PRO A 24 15.561 1.640 -9.064 1.00 0.00 C ATOM 434 CD PRO A 24 15.511 0.722 -7.844 1.00 0.00 C ATOM 0 HA PRO A 24 12.366 1.213 -8.267 1.00 0.00 H new ATOM 0 HB2 PRO A 24 13.877 2.411 -10.215 1.00 0.00 H new ATOM 0 HB3 PRO A 24 13.923 2.989 -8.562 1.00 0.00 H new ATOM 0 HG2 PRO A 24 15.890 1.108 -9.957 1.00 0.00 H new ATOM 0 HG3 PRO A 24 16.251 2.471 -8.916 1.00 0.00 H new ATOM 0 HD2 PRO A 24 16.256 -0.071 -7.920 1.00 0.00 H new ATOM 0 HD3 PRO A 24 15.725 1.275 -6.929 1.00 0.00 H new ATOM 442 N ARG A 25 11.628 0.233 -10.415 1.00 0.00 N ATOM 443 CA ARG A 25 11.030 -0.550 -11.513 1.00 0.00 C ATOM 444 C ARG A 25 11.727 -0.312 -12.856 1.00 0.00 C ATOM 445 O ARG A 25 12.267 0.766 -13.118 1.00 0.00 O ATOM 446 CB ARG A 25 9.538 -0.189 -11.667 1.00 0.00 C ATOM 447 CG ARG A 25 8.642 -1.319 -12.215 1.00 0.00 C ATOM 448 CD ARG A 25 7.637 -0.799 -13.251 1.00 0.00 C ATOM 449 NE ARG A 25 6.725 0.212 -12.675 1.00 0.00 N ATOM 450 CZ ARG A 25 6.628 1.490 -12.996 1.00 0.00 C ATOM 451 NH1 ARG A 25 5.965 2.304 -12.230 1.00 0.00 N ATOM 452 NH2 ARG A 25 7.174 2.002 -14.064 1.00 0.00 N ATOM 0 H ARG A 25 11.008 0.957 -10.053 1.00 0.00 H new ATOM 0 HA ARG A 25 11.152 -1.600 -11.248 1.00 0.00 H new ATOM 0 HB2 ARG A 25 9.153 0.119 -10.695 1.00 0.00 H new ATOM 0 HB3 ARG A 25 9.456 0.672 -12.330 1.00 0.00 H new ATOM 0 HG2 ARG A 25 9.266 -2.089 -12.669 1.00 0.00 H new ATOM 0 HG3 ARG A 25 8.104 -1.788 -11.391 1.00 0.00 H new ATOM 0 HD2 ARG A 25 8.176 -0.364 -14.093 1.00 0.00 H new ATOM 0 HD3 ARG A 25 7.054 -1.633 -13.642 1.00 0.00 H new ATOM 0 HE ARG A 25 6.096 -0.116 -11.942 1.00 0.00 H new ATOM 0 HH11 ARG A 25 5.519 1.956 -11.381 1.00 0.00 H new ATOM 0 HH12 ARG A 25 5.890 3.291 -12.478 1.00 0.00 H new ATOM 0 HH21 ARG A 25 7.707 1.408 -14.699 1.00 0.00 H new ATOM 0 HH22 ARG A 25 7.068 2.996 -14.264 1.00 0.00 H new ATOM 466 N ALA A 26 11.552 -1.275 -13.753 1.00 0.00 N ATOM 467 CA ALA A 26 11.457 -1.034 -15.188 1.00 0.00 C ATOM 468 C ALA A 26 10.136 -1.618 -15.705 1.00 0.00 C ATOM 469 O ALA A 26 9.747 -2.714 -15.325 1.00 0.00 O ATOM 470 CB ALA A 26 12.672 -1.650 -15.873 1.00 0.00 C ATOM 0 H ALA A 26 11.471 -2.260 -13.500 1.00 0.00 H new ATOM 0 HA ALA A 26 11.456 0.033 -15.410 1.00 0.00 H new ATOM 0 HB1 ALA A 26 12.611 -1.476 -16.947 1.00 0.00 H new ATOM 0 HB2 ALA A 26 13.581 -1.193 -15.482 1.00 0.00 H new ATOM 0 HB3 ALA A 26 12.694 -2.723 -15.680 1.00 0.00 H new ATOM 476 N SER A 27 9.425 -0.898 -16.560 1.00 0.00 N ATOM 477 CA SER A 27 8.072 -1.234 -17.040 1.00 0.00 C ATOM 478 C SER A 27 8.037 -2.423 -18.007 1.00 0.00 C ATOM 479 O SER A 27 7.023 -3.114 -18.106 1.00 0.00 O ATOM 480 CB SER A 27 7.474 -0.005 -17.721 1.00 0.00 C ATOM 481 OG SER A 27 7.486 1.091 -16.817 1.00 0.00 O ATOM 0 H SER A 27 9.779 -0.029 -16.960 1.00 0.00 H new ATOM 0 HA SER A 27 7.489 -1.532 -16.169 1.00 0.00 H new ATOM 0 HB2 SER A 27 8.045 0.242 -18.616 1.00 0.00 H new ATOM 0 HB3 SER A 27 6.454 -0.214 -18.042 1.00 0.00 H new ATOM 0 HG SER A 27 7.104 1.880 -17.255 1.00 0.00 H new ATOM 487 N ASN A 28 9.166 -2.714 -18.663 1.00 0.00 N ATOM 488 CA ASN A 28 9.389 -3.937 -19.444 1.00 0.00 C ATOM 489 C ASN A 28 9.870 -5.121 -18.571 1.00 0.00 C ATOM 490 O ASN A 28 10.312 -6.143 -19.102 1.00 0.00 O ATOM 491 CB ASN A 28 10.346 -3.619 -20.611 1.00 0.00 C ATOM 492 CG ASN A 28 9.766 -2.593 -21.573 1.00 0.00 C ATOM 493 OD1 ASN A 28 8.778 -2.832 -22.253 1.00 0.00 O ATOM 494 ND2 ASN A 28 10.344 -1.415 -21.657 1.00 0.00 N ATOM 0 H ASN A 28 9.972 -2.089 -18.666 1.00 0.00 H new ATOM 0 HA ASN A 28 8.438 -4.272 -19.858 1.00 0.00 H new ATOM 0 HB2 ASN A 28 11.290 -3.247 -20.212 1.00 0.00 H new ATOM 0 HB3 ASN A 28 10.570 -4.537 -21.154 1.00 0.00 H new ATOM 0 HD21 ASN A 28 9.968 -0.706 -22.287 1.00 0.00 H new ATOM 0 HD22 ASN A 28 11.168 -1.210 -21.092 1.00 0.00 H new ATOM 501 N ARG A 29 9.825 -4.980 -17.236 1.00 0.00 N ATOM 502 CA ARG A 29 10.233 -5.987 -16.242 1.00 0.00 C ATOM 503 C ARG A 29 9.167 -6.201 -15.177 1.00 0.00 C ATOM 504 O ARG A 29 8.675 -7.321 -15.038 1.00 0.00 O ATOM 505 CB ARG A 29 11.577 -5.591 -15.596 1.00 0.00 C ATOM 506 CG ARG A 29 12.734 -5.494 -16.600 1.00 0.00 C ATOM 507 CD ARG A 29 13.001 -6.876 -17.199 1.00 0.00 C ATOM 508 NE ARG A 29 14.134 -6.856 -18.145 1.00 0.00 N ATOM 509 CZ ARG A 29 14.078 -6.748 -19.462 1.00 0.00 C ATOM 510 NH1 ARG A 29 15.175 -6.772 -20.165 1.00 0.00 N ATOM 511 NH2 ARG A 29 12.958 -6.614 -20.114 1.00 0.00 N ATOM 0 H ARG A 29 9.488 -4.122 -16.800 1.00 0.00 H new ATOM 0 HA ARG A 29 10.359 -6.934 -16.767 1.00 0.00 H new ATOM 0 HB2 ARG A 29 11.461 -4.631 -15.094 1.00 0.00 H new ATOM 0 HB3 ARG A 29 11.832 -6.323 -14.829 1.00 0.00 H new ATOM 0 HG2 ARG A 29 12.487 -4.784 -17.390 1.00 0.00 H new ATOM 0 HG3 ARG A 29 13.630 -5.120 -16.105 1.00 0.00 H new ATOM 0 HD2 ARG A 29 13.210 -7.585 -16.398 1.00 0.00 H new ATOM 0 HD3 ARG A 29 12.106 -7.229 -17.712 1.00 0.00 H new ATOM 0 HE ARG A 29 15.065 -6.934 -17.737 1.00 0.00 H new ATOM 0 HH11 ARG A 29 16.077 -6.874 -19.700 1.00 0.00 H new ATOM 0 HH12 ARG A 29 15.132 -6.689 -21.181 1.00 0.00 H new ATOM 0 HH21 ARG A 29 12.073 -6.589 -19.608 1.00 0.00 H new ATOM 0 HH22 ARG A 29 12.966 -6.534 -21.131 1.00 0.00 H new ATOM 525 N GLY A 30 8.785 -5.139 -14.464 1.00 0.00 N ATOM 526 CA GLY A 30 7.782 -5.209 -13.422 1.00 0.00 C ATOM 527 C GLY A 30 8.300 -5.820 -12.122 1.00 0.00 C ATOM 528 O GLY A 30 9.272 -6.581 -12.091 1.00 0.00 O ATOM 0 H GLY A 30 9.171 -4.205 -14.601 1.00 0.00 H new ATOM 0 HA2 GLY A 30 7.408 -4.205 -13.219 1.00 0.00 H new ATOM 0 HA3 GLY A 30 6.937 -5.797 -13.780 1.00 0.00 H new ATOM 532 N TYR A 31 7.632 -5.473 -11.028 1.00 0.00 N ATOM 533 CA TYR A 31 7.822 -6.106 -9.732 1.00 0.00 C ATOM 534 C TYR A 31 7.149 -7.482 -9.718 1.00 0.00 C ATOM 535 O TYR A 31 6.036 -7.626 -10.207 1.00 0.00 O ATOM 536 CB TYR A 31 7.213 -5.213 -8.654 1.00 0.00 C ATOM 537 CG TYR A 31 7.662 -3.765 -8.647 1.00 0.00 C ATOM 538 CD1 TYR A 31 6.731 -2.780 -8.278 1.00 0.00 C ATOM 539 CD2 TYR A 31 8.985 -3.397 -8.962 1.00 0.00 C ATOM 540 CE1 TYR A 31 7.127 -1.436 -8.157 1.00 0.00 C ATOM 541 CE2 TYR A 31 9.401 -2.065 -8.771 1.00 0.00 C ATOM 542 CZ TYR A 31 8.477 -1.080 -8.360 1.00 0.00 C ATOM 543 OH TYR A 31 8.893 0.203 -8.166 1.00 0.00 O ATOM 0 H TYR A 31 6.932 -4.731 -11.018 1.00 0.00 H new ATOM 0 HA TYR A 31 8.886 -6.240 -9.539 1.00 0.00 H new ATOM 0 HB2 TYR A 31 6.129 -5.234 -8.765 1.00 0.00 H new ATOM 0 HB3 TYR A 31 7.443 -5.647 -7.681 1.00 0.00 H new ATOM 0 HD1 TYR A 31 5.705 -3.057 -8.086 1.00 0.00 H new ATOM 0 HD2 TYR A 31 9.676 -4.132 -9.348 1.00 0.00 H new ATOM 0 HE1 TYR A 31 6.399 -0.678 -7.909 1.00 0.00 H new ATOM 0 HE2 TYR A 31 10.433 -1.796 -8.940 1.00 0.00 H new ATOM 0 HH TYR A 31 9.853 0.267 -8.351 1.00 0.00 H new ATOM 553 N ARG A 32 7.786 -8.494 -9.128 1.00 0.00 N ATOM 554 CA ARG A 32 7.351 -9.909 -9.207 1.00 0.00 C ATOM 555 C ARG A 32 7.209 -10.600 -7.857 1.00 0.00 C ATOM 556 O ARG A 32 7.180 -11.823 -7.804 1.00 0.00 O ATOM 557 CB ARG A 32 8.212 -10.716 -10.210 1.00 0.00 C ATOM 558 CG ARG A 32 9.739 -10.610 -10.041 1.00 0.00 C ATOM 559 CD ARG A 32 10.310 -9.394 -10.786 1.00 0.00 C ATOM 560 NE ARG A 32 11.769 -9.250 -10.624 1.00 0.00 N ATOM 561 CZ ARG A 32 12.514 -8.277 -11.119 1.00 0.00 C ATOM 562 NH1 ARG A 32 13.785 -8.231 -10.853 1.00 0.00 N ATOM 563 NH2 ARG A 32 12.021 -7.327 -11.863 1.00 0.00 N ATOM 0 H ARG A 32 8.631 -8.363 -8.572 1.00 0.00 H new ATOM 0 HA ARG A 32 6.334 -9.882 -9.599 1.00 0.00 H new ATOM 0 HB2 ARG A 32 7.932 -11.767 -10.133 1.00 0.00 H new ATOM 0 HB3 ARG A 32 7.956 -10.391 -11.219 1.00 0.00 H new ATOM 0 HG2 ARG A 32 9.984 -10.535 -8.981 1.00 0.00 H new ATOM 0 HG3 ARG A 32 10.210 -11.519 -10.414 1.00 0.00 H new ATOM 0 HD2 ARG A 32 10.075 -9.482 -11.847 1.00 0.00 H new ATOM 0 HD3 ARG A 32 9.819 -8.490 -10.425 1.00 0.00 H new ATOM 0 HE ARG A 32 12.247 -9.968 -10.080 1.00 0.00 H new ATOM 0 HH11 ARG A 32 14.209 -8.946 -10.262 1.00 0.00 H new ATOM 0 HH12 ARG A 32 14.359 -7.480 -11.235 1.00 0.00 H new ATOM 0 HH21 ARG A 32 11.025 -7.316 -12.083 1.00 0.00 H new ATOM 0 HH22 ARG A 32 12.631 -6.594 -12.225 1.00 0.00 H new ATOM 577 N ALA A 33 7.109 -9.812 -6.786 1.00 0.00 N ATOM 578 CA ALA A 33 7.063 -10.211 -5.376 1.00 0.00 C ATOM 579 C ALA A 33 8.283 -11.017 -4.873 1.00 0.00 C ATOM 580 O ALA A 33 8.909 -10.635 -3.887 1.00 0.00 O ATOM 581 CB ALA A 33 5.724 -10.909 -5.142 1.00 0.00 C ATOM 0 H ALA A 33 7.054 -8.799 -6.888 1.00 0.00 H new ATOM 0 HA ALA A 33 7.134 -9.314 -4.762 1.00 0.00 H new ATOM 0 HB1 ALA A 33 5.654 -11.221 -4.100 1.00 0.00 H new ATOM 0 HB2 ALA A 33 4.910 -10.221 -5.370 1.00 0.00 H new ATOM 0 HB3 ALA A 33 5.652 -11.784 -5.788 1.00 0.00 H new ATOM 587 N SER A 34 8.679 -12.083 -5.572 1.00 0.00 N ATOM 588 CA SER A 34 9.788 -12.986 -5.222 1.00 0.00 C ATOM 589 C SER A 34 11.177 -12.332 -5.287 1.00 0.00 C ATOM 590 O SER A 34 12.147 -12.873 -4.755 1.00 0.00 O ATOM 591 CB SER A 34 9.767 -14.218 -6.133 1.00 0.00 C ATOM 592 OG SER A 34 8.536 -14.914 -6.005 1.00 0.00 O ATOM 0 H SER A 34 8.216 -12.357 -6.439 1.00 0.00 H new ATOM 0 HA SER A 34 9.625 -13.266 -4.181 1.00 0.00 H new ATOM 0 HB2 SER A 34 9.912 -13.913 -7.169 1.00 0.00 H new ATOM 0 HB3 SER A 34 10.594 -14.880 -5.877 1.00 0.00 H new ATOM 0 HG SER A 34 8.540 -15.696 -6.595 1.00 0.00 H new ATOM 598 N ASP A 35 11.281 -11.161 -5.919 1.00 0.00 N ATOM 599 CA ASP A 35 12.489 -10.327 -5.941 1.00 0.00 C ATOM 600 C ASP A 35 12.705 -9.562 -4.617 1.00 0.00 C ATOM 601 O ASP A 35 13.827 -9.155 -4.307 1.00 0.00 O ATOM 602 CB ASP A 35 12.356 -9.360 -7.124 1.00 0.00 C ATOM 603 CG ASP A 35 13.698 -8.755 -7.552 1.00 0.00 C ATOM 604 OD1 ASP A 35 14.029 -7.626 -7.124 1.00 0.00 O ATOM 605 OD2 ASP A 35 14.385 -9.388 -8.391 1.00 0.00 O ATOM 0 H ASP A 35 10.507 -10.754 -6.444 1.00 0.00 H new ATOM 0 HA ASP A 35 13.367 -10.963 -6.056 1.00 0.00 H new ATOM 0 HB2 ASP A 35 11.914 -9.887 -7.970 1.00 0.00 H new ATOM 0 HB3 ASP A 35 11.670 -8.557 -6.855 1.00 0.00 H new ATOM 610 N TRP A 36 11.641 -9.372 -3.827 1.00 0.00 N ATOM 611 CA TRP A 36 11.637 -8.635 -2.569 1.00 0.00 C ATOM 612 C TRP A 36 12.078 -9.525 -1.391 1.00 0.00 C ATOM 613 O TRP A 36 12.215 -10.747 -1.506 1.00 0.00 O ATOM 614 CB TRP A 36 10.231 -8.058 -2.328 1.00 0.00 C ATOM 615 CG TRP A 36 9.522 -7.317 -3.436 1.00 0.00 C ATOM 616 CD1 TRP A 36 10.042 -6.851 -4.601 1.00 0.00 C ATOM 617 CD2 TRP A 36 8.120 -6.906 -3.447 1.00 0.00 C ATOM 618 NE1 TRP A 36 9.062 -6.188 -5.322 1.00 0.00 N ATOM 619 CE2 TRP A 36 7.878 -6.141 -4.625 1.00 0.00 C ATOM 620 CE3 TRP A 36 7.035 -7.083 -2.562 1.00 0.00 C ATOM 621 CZ2 TRP A 36 6.645 -5.528 -4.882 1.00 0.00 C ATOM 622 CZ3 TRP A 36 5.789 -6.475 -2.810 1.00 0.00 C ATOM 623 CH2 TRP A 36 5.596 -5.699 -3.965 1.00 0.00 C ATOM 0 H TRP A 36 10.722 -9.746 -4.063 1.00 0.00 H new ATOM 0 HA TRP A 36 12.357 -7.819 -2.636 1.00 0.00 H new ATOM 0 HB2 TRP A 36 9.588 -8.885 -2.027 1.00 0.00 H new ATOM 0 HB3 TRP A 36 10.299 -7.381 -1.476 1.00 0.00 H new ATOM 0 HD1 TRP A 36 11.067 -6.978 -4.918 1.00 0.00 H new ATOM 0 HE1 TRP A 36 9.201 -5.787 -6.249 1.00 0.00 H new ATOM 0 HE3 TRP A 36 7.162 -7.694 -1.681 1.00 0.00 H new ATOM 0 HZ2 TRP A 36 6.504 -4.933 -5.772 1.00 0.00 H new ATOM 0 HZ3 TRP A 36 4.978 -6.606 -2.109 1.00 0.00 H new ATOM 0 HH2 TRP A 36 4.639 -5.233 -4.148 1.00 0.00 H new ATOM 634 N LYS A 37 12.267 -8.909 -0.221 1.00 0.00 N ATOM 635 CA LYS A 37 12.744 -9.556 1.019 1.00 0.00 C ATOM 636 C LYS A 37 11.653 -10.317 1.785 1.00 0.00 C ATOM 637 O LYS A 37 11.453 -10.107 2.980 1.00 0.00 O ATOM 638 CB LYS A 37 13.455 -8.528 1.908 1.00 0.00 C ATOM 639 CG LYS A 37 14.760 -8.014 1.291 1.00 0.00 C ATOM 640 CD LYS A 37 15.631 -7.276 2.313 1.00 0.00 C ATOM 641 CE LYS A 37 14.845 -6.225 3.103 1.00 0.00 C ATOM 642 NZ LYS A 37 15.731 -5.435 3.991 1.00 0.00 N ATOM 0 H LYS A 37 12.088 -7.912 -0.100 1.00 0.00 H new ATOM 0 HA LYS A 37 13.458 -10.323 0.719 1.00 0.00 H new ATOM 0 HB2 LYS A 37 12.787 -7.686 2.088 1.00 0.00 H new ATOM 0 HB3 LYS A 37 13.669 -8.978 2.877 1.00 0.00 H new ATOM 0 HG2 LYS A 37 15.320 -8.853 0.877 1.00 0.00 H new ATOM 0 HG3 LYS A 37 14.529 -7.345 0.462 1.00 0.00 H new ATOM 0 HD2 LYS A 37 16.064 -7.998 3.006 1.00 0.00 H new ATOM 0 HD3 LYS A 37 16.461 -6.793 1.797 1.00 0.00 H new ATOM 0 HE2 LYS A 37 14.333 -5.557 2.411 1.00 0.00 H new ATOM 0 HE3 LYS A 37 14.076 -6.717 3.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 15.276 -4.528 4.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 15.904 -5.965 4.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 16.636 -5.258 3.510 1.00 0.00 H new ATOM 656 N LEU A 38 10.970 -11.240 1.113 1.00 0.00 N ATOM 657 CA LEU A 38 9.814 -11.977 1.655 1.00 0.00 C ATOM 658 C LEU A 38 10.116 -12.824 2.909 1.00 0.00 C ATOM 659 O LEU A 38 9.193 -13.194 3.636 1.00 0.00 O ATOM 660 CB LEU A 38 9.210 -12.866 0.557 1.00 0.00 C ATOM 661 CG LEU A 38 8.795 -12.135 -0.732 1.00 0.00 C ATOM 662 CD1 LEU A 38 8.096 -13.136 -1.654 1.00 0.00 C ATOM 663 CD2 LEU A 38 7.852 -10.962 -0.474 1.00 0.00 C ATOM 0 H LEU A 38 11.203 -11.508 0.157 1.00 0.00 H new ATOM 0 HA LEU A 38 9.104 -11.217 1.981 1.00 0.00 H new ATOM 0 HB2 LEU A 38 9.935 -13.638 0.299 1.00 0.00 H new ATOM 0 HB3 LEU A 38 8.335 -13.373 0.964 1.00 0.00 H new ATOM 0 HG LEU A 38 9.699 -11.729 -1.186 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.795 -12.635 -2.574 1.00 0.00 H new ATOM 0 HD12 LEU A 38 8.780 -13.950 -1.892 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.215 -13.537 -1.154 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.595 -10.487 -1.421 1.00 0.00 H new ATOM 0 HD22 LEU A 38 6.944 -11.324 0.008 1.00 0.00 H new ATOM 0 HD23 LEU A 38 8.343 -10.237 0.175 1.00 0.00 H new ATOM 675 N ASP A 39 11.392 -13.110 3.186 1.00 0.00 N ATOM 676 CA ASP A 39 11.848 -13.856 4.370 1.00 0.00 C ATOM 677 C ASP A 39 12.431 -12.945 5.473 1.00 0.00 C ATOM 678 O ASP A 39 12.696 -13.410 6.584 1.00 0.00 O ATOM 679 CB ASP A 39 12.852 -14.936 3.932 1.00 0.00 C ATOM 680 CG ASP A 39 12.181 -16.054 3.119 1.00 0.00 C ATOM 681 OD1 ASP A 39 12.386 -16.119 1.884 1.00 0.00 O ATOM 682 OD2 ASP A 39 11.463 -16.891 3.720 1.00 0.00 O ATOM 0 H ASP A 39 12.159 -12.823 2.578 1.00 0.00 H new ATOM 0 HA ASP A 39 10.978 -14.332 4.823 1.00 0.00 H new ATOM 0 HB2 ASP A 39 13.640 -14.477 3.335 1.00 0.00 H new ATOM 0 HB3 ASP A 39 13.329 -15.365 4.813 1.00 0.00 H new ATOM 687 N GLN A 40 12.613 -11.648 5.187 1.00 0.00 N ATOM 688 CA GLN A 40 13.145 -10.647 6.123 1.00 0.00 C ATOM 689 C GLN A 40 12.559 -9.237 5.855 1.00 0.00 C ATOM 690 O GLN A 40 13.270 -8.361 5.347 1.00 0.00 O ATOM 691 CB GLN A 40 14.695 -10.679 6.171 1.00 0.00 C ATOM 692 CG GLN A 40 15.479 -10.692 4.845 1.00 0.00 C ATOM 693 CD GLN A 40 15.482 -12.038 4.118 1.00 0.00 C ATOM 694 OE1 GLN A 40 15.644 -13.103 4.698 1.00 0.00 O ATOM 695 NE2 GLN A 40 15.330 -12.049 2.809 1.00 0.00 N ATOM 0 H GLN A 40 12.388 -11.255 4.273 1.00 0.00 H new ATOM 0 HA GLN A 40 12.811 -10.915 7.125 1.00 0.00 H new ATOM 0 HB2 GLN A 40 15.025 -9.811 6.741 1.00 0.00 H new ATOM 0 HB3 GLN A 40 14.989 -11.563 6.737 1.00 0.00 H new ATOM 0 HG2 GLN A 40 15.057 -9.937 4.182 1.00 0.00 H new ATOM 0 HG3 GLN A 40 16.510 -10.400 5.045 1.00 0.00 H new ATOM 0 HE21 GLN A 40 15.193 -11.173 2.304 1.00 0.00 H new ATOM 0 HE22 GLN A 40 15.349 -12.933 2.301 1.00 0.00 H new ATOM 704 N PRO A 41 11.271 -8.987 6.186 1.00 0.00 N ATOM 705 CA PRO A 41 10.666 -7.658 6.090 1.00 0.00 C ATOM 706 C PRO A 41 11.419 -6.613 6.920 1.00 0.00 C ATOM 707 O PRO A 41 11.928 -6.888 8.009 1.00 0.00 O ATOM 708 CB PRO A 41 9.205 -7.802 6.546 1.00 0.00 C ATOM 709 CG PRO A 41 9.230 -9.061 7.410 1.00 0.00 C ATOM 710 CD PRO A 41 10.307 -9.923 6.751 1.00 0.00 C ATOM 0 HA PRO A 41 10.718 -7.295 5.064 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.873 -6.932 7.112 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.528 -7.909 5.699 1.00 0.00 H new ATOM 0 HG2 PRO A 41 9.477 -8.832 8.447 1.00 0.00 H new ATOM 0 HG3 PRO A 41 8.262 -9.563 7.417 1.00 0.00 H new ATOM 0 HD2 PRO A 41 10.781 -10.581 7.479 1.00 0.00 H new ATOM 0 HD3 PRO A 41 9.879 -10.560 5.976 1.00 0.00 H new ATOM 718 N ASP A 42 11.452 -5.385 6.405 1.00 0.00 N ATOM 719 CA ASP A 42 12.027 -4.218 7.078 1.00 0.00 C ATOM 720 C ASP A 42 11.175 -3.776 8.280 1.00 0.00 C ATOM 721 O ASP A 42 11.699 -3.242 9.260 1.00 0.00 O ATOM 722 CB ASP A 42 12.153 -3.080 6.054 1.00 0.00 C ATOM 723 CG ASP A 42 13.191 -3.422 4.983 1.00 0.00 C ATOM 724 OD1 ASP A 42 12.798 -3.800 3.856 1.00 0.00 O ATOM 725 OD2 ASP A 42 14.408 -3.353 5.273 1.00 0.00 O ATOM 0 H ASP A 42 11.070 -5.167 5.485 1.00 0.00 H new ATOM 0 HA ASP A 42 13.010 -4.481 7.470 1.00 0.00 H new ATOM 0 HB2 ASP A 42 11.186 -2.899 5.584 1.00 0.00 H new ATOM 0 HB3 ASP A 42 12.438 -2.159 6.562 1.00 0.00 H new ATOM 730 N TRP A 43 9.863 -4.028 8.210 1.00 0.00 N ATOM 731 CA TRP A 43 8.876 -3.764 9.263 1.00 0.00 C ATOM 732 C TRP A 43 7.616 -4.621 9.047 1.00 0.00 C ATOM 733 O TRP A 43 7.289 -4.953 7.906 1.00 0.00 O ATOM 734 CB TRP A 43 8.534 -2.266 9.233 1.00 0.00 C ATOM 735 CG TRP A 43 7.382 -1.816 10.075 1.00 0.00 C ATOM 736 CD1 TRP A 43 7.456 -1.299 11.322 1.00 0.00 C ATOM 737 CD2 TRP A 43 5.969 -1.788 9.713 1.00 0.00 C ATOM 738 NE1 TRP A 43 6.193 -0.929 11.745 1.00 0.00 N ATOM 739 CE2 TRP A 43 5.244 -1.166 10.772 1.00 0.00 C ATOM 740 CE3 TRP A 43 5.232 -2.222 8.591 1.00 0.00 C ATOM 741 CZ2 TRP A 43 3.868 -0.919 10.686 1.00 0.00 C ATOM 742 CZ3 TRP A 43 3.848 -1.972 8.497 1.00 0.00 C ATOM 743 CH2 TRP A 43 3.166 -1.319 9.537 1.00 0.00 C ATOM 0 H TRP A 43 9.441 -4.441 7.378 1.00 0.00 H new ATOM 0 HA TRP A 43 9.285 -4.028 10.238 1.00 0.00 H new ATOM 0 HB2 TRP A 43 9.419 -1.710 9.544 1.00 0.00 H new ATOM 0 HB3 TRP A 43 8.328 -1.986 8.200 1.00 0.00 H new ATOM 0 HD1 TRP A 43 8.363 -1.192 11.899 1.00 0.00 H new ATOM 0 HE1 TRP A 43 5.988 -0.531 12.661 1.00 0.00 H new ATOM 0 HE3 TRP A 43 5.734 -2.752 7.795 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 3.351 -0.425 11.496 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 3.307 -2.286 7.617 1.00 0.00 H new ATOM 0 HH2 TRP A 43 2.107 -1.125 9.454 1.00 0.00 H new ATOM 754 N THR A 44 6.874 -4.947 10.111 1.00 0.00 N ATOM 755 CA THR A 44 5.516 -5.512 10.009 1.00 0.00 C ATOM 756 C THR A 44 4.531 -4.832 10.956 1.00 0.00 C ATOM 757 O THR A 44 4.903 -4.336 12.024 1.00 0.00 O ATOM 758 CB THR A 44 5.466 -7.031 10.226 1.00 0.00 C ATOM 759 OG1 THR A 44 5.737 -7.404 11.561 1.00 0.00 O ATOM 760 CG2 THR A 44 6.419 -7.804 9.331 1.00 0.00 C ATOM 0 H THR A 44 7.196 -4.828 11.072 1.00 0.00 H new ATOM 0 HA THR A 44 5.215 -5.313 8.980 1.00 0.00 H new ATOM 0 HB THR A 44 4.440 -7.292 9.967 1.00 0.00 H new ATOM 0 HG1 THR A 44 6.155 -8.290 11.575 1.00 0.00 H new ATOM 0 HG21 THR A 44 6.330 -8.870 9.539 1.00 0.00 H new ATOM 0 HG22 THR A 44 6.170 -7.616 8.287 1.00 0.00 H new ATOM 0 HG23 THR A 44 7.442 -7.481 9.524 1.00 0.00 H new ATOM 768 N GLY A 45 3.255 -4.833 10.576 1.00 0.00 N ATOM 769 CA GLY A 45 2.192 -4.158 11.326 1.00 0.00 C ATOM 770 C GLY A 45 0.809 -4.275 10.689 1.00 0.00 C ATOM 771 O GLY A 45 0.485 -5.294 10.088 1.00 0.00 O ATOM 0 H GLY A 45 2.925 -5.305 9.734 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.153 -4.573 12.333 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.446 -3.103 11.426 1.00 0.00 H new ATOM 775 N ARG A 46 -0.010 -3.233 10.847 1.00 0.00 N ATOM 776 CA ARG A 46 -1.409 -3.131 10.406 1.00 0.00 C ATOM 777 C ARG A 46 -1.549 -2.246 9.170 1.00 0.00 C ATOM 778 O ARG A 46 -0.839 -1.249 9.020 1.00 0.00 O ATOM 779 CB ARG A 46 -2.285 -2.566 11.539 1.00 0.00 C ATOM 780 CG ARG A 46 -2.272 -3.434 12.806 1.00 0.00 C ATOM 781 CD ARG A 46 -3.184 -2.888 13.911 1.00 0.00 C ATOM 782 NE ARG A 46 -2.631 -1.659 14.510 1.00 0.00 N ATOM 783 CZ ARG A 46 -2.990 -0.412 14.284 1.00 0.00 C ATOM 784 NH1 ARG A 46 -2.328 0.547 14.843 1.00 0.00 N ATOM 785 NH2 ARG A 46 -3.959 -0.049 13.498 1.00 0.00 N ATOM 0 H ARG A 46 0.303 -2.383 11.316 1.00 0.00 H new ATOM 0 HA ARG A 46 -1.742 -4.136 10.147 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -1.940 -1.563 11.790 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -3.311 -2.470 11.183 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -2.585 -4.446 12.550 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -1.252 -3.502 13.184 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -4.172 -2.681 13.500 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -3.313 -3.645 14.685 1.00 0.00 H new ATOM 0 HE ARG A 46 -1.876 -1.791 15.183 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -1.537 0.334 15.451 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -2.596 1.517 14.676 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -4.505 -0.754 13.002 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -4.174 0.941 13.377 1.00 0.00 H new ATOM 799 N LEU A 47 -2.530 -2.578 8.335 1.00 0.00 N ATOM 800 CA LEU A 47 -3.020 -1.747 7.234 1.00 0.00 C ATOM 801 C LEU A 47 -4.149 -0.829 7.723 1.00 0.00 C ATOM 802 O LEU A 47 -5.050 -1.289 8.428 1.00 0.00 O ATOM 803 CB LEU A 47 -3.538 -2.683 6.128 1.00 0.00 C ATOM 804 CG LEU A 47 -4.126 -1.975 4.893 1.00 0.00 C ATOM 805 CD1 LEU A 47 -3.035 -1.336 4.036 1.00 0.00 C ATOM 806 CD2 LEU A 47 -4.901 -2.994 4.066 1.00 0.00 C ATOM 0 H LEU A 47 -3.026 -3.467 8.408 1.00 0.00 H new ATOM 0 HA LEU A 47 -2.217 -1.118 6.851 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.719 -3.324 5.804 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.303 -3.333 6.553 1.00 0.00 H new ATOM 0 HG LEU A 47 -4.786 -1.177 5.232 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.489 -0.846 3.174 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.492 -0.599 4.628 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.344 -2.106 3.693 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -5.323 -2.505 3.188 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -4.229 -3.792 3.749 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -5.706 -3.415 4.668 1.00 0.00 H new ATOM 818 N ARG A 48 -4.155 0.425 7.267 1.00 0.00 N ATOM 819 CA ARG A 48 -5.263 1.379 7.401 1.00 0.00 C ATOM 820 C ARG A 48 -5.387 2.207 6.122 1.00 0.00 C ATOM 821 O ARG A 48 -4.685 3.195 5.928 1.00 0.00 O ATOM 822 CB ARG A 48 -5.015 2.234 8.661 1.00 0.00 C ATOM 823 CG ARG A 48 -6.030 3.371 8.874 1.00 0.00 C ATOM 824 CD ARG A 48 -5.694 4.118 10.171 1.00 0.00 C ATOM 825 NE ARG A 48 -6.492 5.345 10.338 1.00 0.00 N ATOM 826 CZ ARG A 48 -7.655 5.485 10.940 1.00 0.00 C ATOM 827 NH1 ARG A 48 -8.157 6.678 11.023 1.00 0.00 N ATOM 828 NH2 ARG A 48 -8.319 4.490 11.456 1.00 0.00 N ATOM 0 H ARG A 48 -3.356 0.822 6.773 1.00 0.00 H new ATOM 0 HA ARG A 48 -6.218 0.869 7.528 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -5.030 1.583 9.535 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -4.015 2.664 8.601 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -6.005 4.059 8.029 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -7.041 2.966 8.926 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -5.866 3.458 11.021 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -4.635 4.374 10.175 1.00 0.00 H new ATOM 0 HE ARG A 48 -6.093 6.194 9.937 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -7.653 7.472 10.629 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -9.056 6.822 11.483 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -7.941 3.544 11.405 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -9.216 4.657 11.911 1.00 0.00 H new ATOM 842 N ILE A 49 -6.293 1.801 5.238 1.00 0.00 N ATOM 843 CA ILE A 49 -6.701 2.599 4.080 1.00 0.00 C ATOM 844 C ILE A 49 -7.769 3.591 4.539 1.00 0.00 C ATOM 845 O ILE A 49 -8.737 3.229 5.209 1.00 0.00 O ATOM 846 CB ILE A 49 -7.175 1.739 2.894 1.00 0.00 C ATOM 847 CG1 ILE A 49 -6.163 0.610 2.611 1.00 0.00 C ATOM 848 CG2 ILE A 49 -7.375 2.629 1.652 1.00 0.00 C ATOM 849 CD1 ILE A 49 -6.530 -0.232 1.392 1.00 0.00 C ATOM 0 H ILE A 49 -6.770 0.902 5.303 1.00 0.00 H new ATOM 0 HA ILE A 49 -5.835 3.140 3.698 1.00 0.00 H new ATOM 0 HB ILE A 49 -8.130 1.277 3.145 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -5.175 1.045 2.460 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -6.096 -0.037 3.485 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -7.710 2.016 0.815 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -8.124 3.391 1.867 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -6.432 3.111 1.394 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -5.779 -1.009 1.247 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -7.504 -0.694 1.549 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.569 0.405 0.508 1.00 0.00 H new ATOM 861 N THR A 50 -7.560 4.845 4.170 1.00 0.00 N ATOM 862 CA THR A 50 -8.264 6.043 4.639 1.00 0.00 C ATOM 863 C THR A 50 -8.441 7.023 3.472 1.00 0.00 C ATOM 864 O THR A 50 -7.774 6.887 2.451 1.00 0.00 O ATOM 865 CB THR A 50 -7.508 6.678 5.814 1.00 0.00 C ATOM 866 OG1 THR A 50 -6.109 6.484 5.819 1.00 0.00 O ATOM 867 CG2 THR A 50 -8.022 6.081 7.127 1.00 0.00 C ATOM 0 H THR A 50 -6.842 5.076 3.484 1.00 0.00 H new ATOM 0 HA THR A 50 -9.255 5.771 5.003 1.00 0.00 H new ATOM 0 HB THR A 50 -7.692 7.747 5.706 1.00 0.00 H new ATOM 0 HG1 THR A 50 -5.800 6.309 4.906 1.00 0.00 H new ATOM 0 HG21 THR A 50 -7.487 6.529 7.964 1.00 0.00 H new ATOM 0 HG22 THR A 50 -9.088 6.284 7.226 1.00 0.00 H new ATOM 0 HG23 THR A 50 -7.857 5.004 7.126 1.00 0.00 H new ATOM 875 N SER A 51 -9.335 8.006 3.568 1.00 0.00 N ATOM 876 CA SER A 51 -9.528 9.063 2.563 1.00 0.00 C ATOM 877 C SER A 51 -10.316 10.225 3.155 1.00 0.00 C ATOM 878 O SER A 51 -11.060 10.027 4.108 1.00 0.00 O ATOM 879 CB SER A 51 -10.289 8.515 1.349 1.00 0.00 C ATOM 880 OG SER A 51 -10.480 9.528 0.374 1.00 0.00 O ATOM 0 H SER A 51 -9.964 8.096 4.366 1.00 0.00 H new ATOM 0 HA SER A 51 -8.544 9.412 2.250 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.736 7.684 0.912 1.00 0.00 H new ATOM 0 HB3 SER A 51 -11.255 8.123 1.667 1.00 0.00 H new ATOM 0 HG SER A 51 -11.269 9.316 -0.168 1.00 0.00 H new ATOM 886 N LYS A 52 -10.156 11.448 2.643 1.00 0.00 N ATOM 887 CA LYS A 52 -10.828 12.624 3.204 1.00 0.00 C ATOM 888 C LYS A 52 -11.610 13.507 2.223 1.00 0.00 C ATOM 889 O LYS A 52 -12.708 13.953 2.560 1.00 0.00 O ATOM 890 CB LYS A 52 -9.790 13.437 3.964 1.00 0.00 C ATOM 891 CG LYS A 52 -9.036 12.703 5.080 1.00 0.00 C ATOM 892 CD LYS A 52 -7.992 13.635 5.717 1.00 0.00 C ATOM 893 CE LYS A 52 -7.064 12.822 6.618 1.00 0.00 C ATOM 894 NZ LYS A 52 -6.444 13.654 7.679 1.00 0.00 N ATOM 0 H LYS A 52 -9.564 11.651 1.837 1.00 0.00 H new ATOM 0 HA LYS A 52 -11.614 12.241 3.855 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -9.060 13.814 3.248 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -10.286 14.304 4.399 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -9.739 12.360 5.839 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -8.545 11.817 4.676 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -7.415 14.136 4.940 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -8.489 14.413 6.297 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -7.627 12.010 7.078 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -6.281 12.365 6.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -5.585 13.185 8.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -6.196 14.585 7.289 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -7.117 13.775 8.463 1.00 0.00 H new ATOM 908 N GLY A 53 -11.072 13.771 1.032 1.00 0.00 N ATOM 909 CA GLY A 53 -11.680 14.688 0.054 1.00 0.00 C ATOM 910 C GLY A 53 -11.024 14.580 -1.317 1.00 0.00 C ATOM 911 O GLY A 53 -10.107 15.338 -1.634 1.00 0.00 O ATOM 0 H GLY A 53 -10.197 13.355 0.712 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -12.744 14.469 -0.035 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -11.595 15.712 0.417 1.00 0.00 H new ATOM 915 N LYS A 54 -11.459 13.579 -2.098 1.00 0.00 N ATOM 916 CA LYS A 54 -10.861 13.156 -3.384 1.00 0.00 C ATOM 917 C LYS A 54 -9.364 12.832 -3.265 1.00 0.00 C ATOM 918 O LYS A 54 -8.618 12.909 -4.239 1.00 0.00 O ATOM 919 CB LYS A 54 -11.197 14.153 -4.512 1.00 0.00 C ATOM 920 CG LYS A 54 -12.714 14.310 -4.715 1.00 0.00 C ATOM 921 CD LYS A 54 -13.078 15.226 -5.891 1.00 0.00 C ATOM 922 CE LYS A 54 -12.601 16.670 -5.679 1.00 0.00 C ATOM 923 NZ LYS A 54 -13.019 17.554 -6.798 1.00 0.00 N ATOM 0 H LYS A 54 -12.271 13.016 -1.844 1.00 0.00 H new ATOM 0 HA LYS A 54 -11.323 12.210 -3.666 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -10.761 15.124 -4.278 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -10.741 13.814 -5.442 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -13.155 13.327 -4.879 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -13.156 14.709 -3.802 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -12.636 14.831 -6.806 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -14.159 15.220 -6.031 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -13.004 17.053 -4.742 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -11.515 16.685 -5.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -12.680 18.521 -6.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -12.613 17.202 -7.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -14.057 17.558 -6.868 1.00 0.00 H new ATOM 937 N THR A 55 -8.935 12.461 -2.055 1.00 0.00 N ATOM 938 CA THR A 55 -7.558 12.097 -1.724 1.00 0.00 C ATOM 939 C THR A 55 -7.611 10.934 -0.746 1.00 0.00 C ATOM 940 O THR A 55 -8.189 11.067 0.336 1.00 0.00 O ATOM 941 CB THR A 55 -6.795 13.275 -1.094 1.00 0.00 C ATOM 942 OG1 THR A 55 -6.881 14.440 -1.891 1.00 0.00 O ATOM 943 CG2 THR A 55 -5.314 12.941 -0.957 1.00 0.00 C ATOM 0 H THR A 55 -9.561 12.405 -1.252 1.00 0.00 H new ATOM 0 HA THR A 55 -7.028 11.821 -2.636 1.00 0.00 H new ATOM 0 HB THR A 55 -7.252 13.452 -0.121 1.00 0.00 H new ATOM 0 HG1 THR A 55 -6.387 15.168 -1.460 1.00 0.00 H new ATOM 0 HG21 THR A 55 -4.790 13.786 -0.510 1.00 0.00 H new ATOM 0 HG22 THR A 55 -5.196 12.063 -0.322 1.00 0.00 H new ATOM 0 HG23 THR A 55 -4.895 12.735 -1.942 1.00 0.00 H new ATOM 951 N ALA A 56 -7.058 9.791 -1.136 1.00 0.00 N ATOM 952 CA ALA A 56 -6.910 8.617 -0.282 1.00 0.00 C ATOM 953 C ALA A 56 -5.519 8.583 0.360 1.00 0.00 C ATOM 954 O ALA A 56 -4.581 9.220 -0.114 1.00 0.00 O ATOM 955 CB ALA A 56 -7.244 7.348 -1.072 1.00 0.00 C ATOM 0 H ALA A 56 -6.691 9.651 -2.077 1.00 0.00 H new ATOM 0 HA ALA A 56 -7.621 8.673 0.542 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -7.131 6.477 -0.426 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -8.272 7.403 -1.431 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.567 7.260 -1.922 1.00 0.00 H new ATOM 961 N TYR A 57 -5.399 7.828 1.442 1.00 0.00 N ATOM 962 CA TYR A 57 -4.192 7.640 2.233 1.00 0.00 C ATOM 963 C TYR A 57 -4.075 6.159 2.620 1.00 0.00 C ATOM 964 O TYR A 57 -4.895 5.655 3.391 1.00 0.00 O ATOM 965 CB TYR A 57 -4.261 8.544 3.480 1.00 0.00 C ATOM 966 CG TYR A 57 -4.527 10.016 3.206 1.00 0.00 C ATOM 967 CD1 TYR A 57 -3.472 10.853 2.795 1.00 0.00 C ATOM 968 CD2 TYR A 57 -5.826 10.550 3.356 1.00 0.00 C ATOM 969 CE1 TYR A 57 -3.707 12.218 2.537 1.00 0.00 C ATOM 970 CE2 TYR A 57 -6.064 11.909 3.088 1.00 0.00 C ATOM 971 CZ TYR A 57 -5.008 12.749 2.683 1.00 0.00 C ATOM 972 OH TYR A 57 -5.253 14.067 2.446 1.00 0.00 O ATOM 0 H TYR A 57 -6.188 7.299 1.813 1.00 0.00 H new ATOM 0 HA TYR A 57 -3.307 7.916 1.659 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -5.044 8.167 4.138 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -3.320 8.457 4.023 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -2.478 10.447 2.677 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -6.637 9.913 3.677 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -2.894 12.858 2.228 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -7.061 12.311 3.193 1.00 0.00 H new ATOM 0 HH TYR A 57 -6.203 14.255 2.595 1.00 0.00 H new ATOM 982 N ILE A 58 -3.063 5.450 2.112 1.00 0.00 N ATOM 983 CA ILE A 58 -2.682 4.125 2.627 1.00 0.00 C ATOM 984 C ILE A 58 -1.726 4.366 3.791 1.00 0.00 C ATOM 985 O ILE A 58 -0.557 4.694 3.580 1.00 0.00 O ATOM 986 CB ILE A 58 -2.077 3.200 1.539 1.00 0.00 C ATOM 987 CG1 ILE A 58 -3.072 2.795 0.427 1.00 0.00 C ATOM 988 CG2 ILE A 58 -1.563 1.895 2.182 1.00 0.00 C ATOM 989 CD1 ILE A 58 -3.361 3.881 -0.612 1.00 0.00 C ATOM 0 H ILE A 58 -2.485 5.773 1.336 1.00 0.00 H new ATOM 0 HA ILE A 58 -3.567 3.586 2.964 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.277 3.784 1.083 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.681 1.917 -0.087 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -4.012 2.499 0.892 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.140 1.251 1.411 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.796 2.130 2.919 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.390 1.380 2.671 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -4.069 3.501 -1.348 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.786 4.754 -0.117 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -2.434 4.163 -1.111 1.00 0.00 H new ATOM 1001 N LYS A 59 -2.229 4.240 5.018 1.00 0.00 N ATOM 1002 CA LYS A 59 -1.445 4.365 6.250 1.00 0.00 C ATOM 1003 C LYS A 59 -1.096 2.996 6.830 1.00 0.00 C ATOM 1004 O LYS A 59 -1.904 2.067 6.827 1.00 0.00 O ATOM 1005 CB LYS A 59 -2.159 5.285 7.254 1.00 0.00 C ATOM 1006 CG LYS A 59 -2.393 6.677 6.640 1.00 0.00 C ATOM 1007 CD LYS A 59 -2.600 7.763 7.699 1.00 0.00 C ATOM 1008 CE LYS A 59 -2.645 9.136 7.016 1.00 0.00 C ATOM 1009 NZ LYS A 59 -2.655 10.238 8.009 1.00 0.00 N ATOM 0 H LYS A 59 -3.215 4.044 5.189 1.00 0.00 H new ATOM 0 HA LYS A 59 -0.492 4.839 6.013 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.113 4.845 7.545 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -1.561 5.377 8.161 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -1.540 6.942 6.016 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -3.266 6.640 5.988 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -3.527 7.584 8.243 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -1.791 7.734 8.429 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -1.782 9.245 6.359 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -3.534 9.202 6.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -2.398 11.130 7.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -3.606 10.325 8.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -1.968 10.033 8.763 1.00 0.00 H new ATOM 1023 N LEU A 60 0.129 2.885 7.325 1.00 0.00 N ATOM 1024 CA LEU A 60 0.690 1.717 7.998 1.00 0.00 C ATOM 1025 C LEU A 60 0.953 2.049 9.470 1.00 0.00 C ATOM 1026 O LEU A 60 1.577 3.064 9.774 1.00 0.00 O ATOM 1027 CB LEU A 60 1.976 1.295 7.267 1.00 0.00 C ATOM 1028 CG LEU A 60 1.786 0.159 6.250 1.00 0.00 C ATOM 1029 CD1 LEU A 60 0.740 0.437 5.168 1.00 0.00 C ATOM 1030 CD2 LEU A 60 3.116 -0.088 5.544 1.00 0.00 C ATOM 0 H LEU A 60 0.799 3.652 7.265 1.00 0.00 H new ATOM 0 HA LEU A 60 -0.011 0.883 7.970 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.387 2.163 6.751 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.714 0.984 8.006 1.00 0.00 H new ATOM 0 HG LEU A 60 1.434 -0.698 6.824 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.675 -0.419 4.496 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.230 0.607 5.635 1.00 0.00 H new ATOM 0 HD13 LEU A 60 1.029 1.322 4.601 1.00 0.00 H new ATOM 0 HD21 LEU A 60 2.999 -0.892 4.818 1.00 0.00 H new ATOM 0 HD22 LEU A 60 3.430 0.821 5.031 1.00 0.00 H new ATOM 0 HD23 LEU A 60 3.871 -0.369 6.278 1.00 0.00 H new ATOM 1042 N GLU A 61 0.498 1.194 10.383 1.00 0.00 N ATOM 1043 CA GLU A 61 0.567 1.424 11.835 1.00 0.00 C ATOM 1044 C GLU A 61 1.025 0.179 12.598 1.00 0.00 C ATOM 1045 O GLU A 61 0.817 -0.947 12.156 1.00 0.00 O ATOM 1046 CB GLU A 61 -0.795 1.852 12.387 1.00 0.00 C ATOM 1047 CG GLU A 61 -1.408 3.134 11.810 1.00 0.00 C ATOM 1048 CD GLU A 61 -2.687 3.538 12.580 1.00 0.00 C ATOM 1049 OE1 GLU A 61 -3.335 2.664 13.211 1.00 0.00 O ATOM 1050 OE2 GLU A 61 -3.048 4.737 12.554 1.00 0.00 O ATOM 0 H GLU A 61 0.063 0.305 10.137 1.00 0.00 H new ATOM 0 HA GLU A 61 1.300 2.217 11.981 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -1.499 1.036 12.223 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -0.699 1.978 13.465 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -0.679 3.943 11.860 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -1.646 2.984 10.757 1.00 0.00 H new ATOM 1057 N ASP A 62 1.640 0.351 13.766 1.00 0.00 N ATOM 1058 CA ASP A 62 2.157 -0.754 14.563 1.00 0.00 C ATOM 1059 C ASP A 62 1.027 -1.554 15.237 1.00 0.00 C ATOM 1060 O ASP A 62 0.021 -0.996 15.694 1.00 0.00 O ATOM 1061 CB ASP A 62 3.149 -0.182 15.575 1.00 0.00 C ATOM 1062 CG ASP A 62 4.064 -1.269 16.137 1.00 0.00 C ATOM 1063 OD1 ASP A 62 5.216 -1.410 15.667 1.00 0.00 O ATOM 1064 OD2 ASP A 62 3.591 -1.989 17.040 1.00 0.00 O ATOM 0 H ASP A 62 1.794 1.267 14.187 1.00 0.00 H new ATOM 0 HA ASP A 62 2.669 -1.468 13.919 1.00 0.00 H new ATOM 0 HB2 ASP A 62 3.751 0.592 15.099 1.00 0.00 H new ATOM 0 HB3 ASP A 62 2.605 0.295 16.390 1.00 0.00 H new ATOM 1069 N LYS A 63 1.209 -2.874 15.311 1.00 0.00 N ATOM 1070 CA LYS A 63 0.271 -3.846 15.903 1.00 0.00 C ATOM 1071 C LYS A 63 0.392 -4.023 17.419 1.00 0.00 C ATOM 1072 O LYS A 63 -0.426 -4.722 18.019 1.00 0.00 O ATOM 1073 CB LYS A 63 0.358 -5.190 15.144 1.00 0.00 C ATOM 1074 CG LYS A 63 1.795 -5.717 15.000 1.00 0.00 C ATOM 1075 CD LYS A 63 1.842 -7.042 14.231 1.00 0.00 C ATOM 1076 CE LYS A 63 3.246 -7.243 13.651 1.00 0.00 C ATOM 1077 NZ LYS A 63 3.358 -8.493 12.856 1.00 0.00 N ATOM 0 H LYS A 63 2.050 -3.320 14.945 1.00 0.00 H new ATOM 0 HA LYS A 63 -0.726 -3.425 15.777 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -0.243 -5.934 15.667 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -0.078 -5.068 14.152 1.00 0.00 H new ATOM 0 HG2 LYS A 63 2.404 -4.975 14.483 1.00 0.00 H new ATOM 0 HG3 LYS A 63 2.232 -5.855 15.989 1.00 0.00 H new ATOM 0 HD2 LYS A 63 1.588 -7.869 14.894 1.00 0.00 H new ATOM 0 HD3 LYS A 63 1.103 -7.037 13.430 1.00 0.00 H new ATOM 0 HE2 LYS A 63 3.501 -6.391 13.021 1.00 0.00 H new ATOM 0 HE3 LYS A 63 3.972 -7.267 14.464 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 4.207 -8.449 12.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 3.429 -9.308 13.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 2.516 -8.599 12.255 1.00 0.00 H new ATOM 1091 N VAL A 64 1.374 -3.371 18.036 1.00 0.00 N ATOM 1092 CA VAL A 64 1.645 -3.406 19.478 1.00 0.00 C ATOM 1093 C VAL A 64 1.670 -1.999 20.074 1.00 0.00 C ATOM 1094 O VAL A 64 1.061 -1.774 21.123 1.00 0.00 O ATOM 1095 CB VAL A 64 2.972 -4.150 19.725 1.00 0.00 C ATOM 1096 CG1 VAL A 64 3.456 -4.062 21.178 1.00 0.00 C ATOM 1097 CG2 VAL A 64 2.847 -5.637 19.365 1.00 0.00 C ATOM 0 H VAL A 64 2.031 -2.779 17.528 1.00 0.00 H new ATOM 0 HA VAL A 64 0.840 -3.943 19.980 1.00 0.00 H new ATOM 0 HB VAL A 64 3.700 -3.653 19.084 1.00 0.00 H new ATOM 0 HG11 VAL A 64 4.394 -4.607 21.283 1.00 0.00 H new ATOM 0 HG12 VAL A 64 3.611 -3.017 21.447 1.00 0.00 H new ATOM 0 HG13 VAL A 64 2.707 -4.500 21.838 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.798 -6.137 19.549 1.00 0.00 H new ATOM 0 HG22 VAL A 64 2.071 -6.096 19.978 1.00 0.00 H new ATOM 0 HG23 VAL A 64 2.583 -5.735 18.312 1.00 0.00 H new ATOM 1107 N SER A 65 2.317 -1.036 19.407 1.00 0.00 N ATOM 1108 CA SER A 65 2.450 0.339 19.915 1.00 0.00 C ATOM 1109 C SER A 65 1.325 1.265 19.442 1.00 0.00 C ATOM 1110 O SER A 65 1.041 2.273 20.092 1.00 0.00 O ATOM 1111 CB SER A 65 3.807 0.927 19.517 1.00 0.00 C ATOM 1112 OG SER A 65 4.865 0.189 20.107 1.00 0.00 O ATOM 0 H SER A 65 2.763 -1.185 18.502 1.00 0.00 H new ATOM 0 HA SER A 65 2.377 0.275 21.001 1.00 0.00 H new ATOM 0 HB2 SER A 65 3.910 0.916 18.432 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.864 1.969 19.832 1.00 0.00 H new ATOM 0 HG SER A 65 5.724 0.578 19.840 1.00 0.00 H new ATOM 1118 N GLY A 66 0.683 0.945 18.311 1.00 0.00 N ATOM 1119 CA GLY A 66 -0.384 1.760 17.713 1.00 0.00 C ATOM 1120 C GLY A 66 0.129 2.983 16.940 1.00 0.00 C ATOM 1121 O GLY A 66 -0.661 3.814 16.493 1.00 0.00 O ATOM 0 H GLY A 66 0.893 0.101 17.778 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -0.970 1.136 17.039 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.057 2.097 18.502 1.00 0.00 H new ATOM 1125 N GLU A 67 1.451 3.106 16.794 1.00 0.00 N ATOM 1126 CA GLU A 67 2.134 4.259 16.207 1.00 0.00 C ATOM 1127 C GLU A 67 2.167 4.206 14.671 1.00 0.00 C ATOM 1128 O GLU A 67 2.185 3.125 14.083 1.00 0.00 O ATOM 1129 CB GLU A 67 3.534 4.387 16.833 1.00 0.00 C ATOM 1130 CG GLU A 67 4.533 3.298 16.415 1.00 0.00 C ATOM 1131 CD GLU A 67 5.897 3.518 17.098 1.00 0.00 C ATOM 1132 OE1 GLU A 67 6.761 4.227 16.528 1.00 0.00 O ATOM 1133 OE2 GLU A 67 6.113 2.987 18.214 1.00 0.00 O ATOM 0 H GLU A 67 2.098 2.377 17.093 1.00 0.00 H new ATOM 0 HA GLU A 67 1.568 5.161 16.440 1.00 0.00 H new ATOM 0 HB2 GLU A 67 3.947 5.360 16.567 1.00 0.00 H new ATOM 0 HB3 GLU A 67 3.433 4.370 17.918 1.00 0.00 H new ATOM 0 HG2 GLU A 67 4.141 2.316 16.682 1.00 0.00 H new ATOM 0 HG3 GLU A 67 4.657 3.308 15.332 1.00 0.00 H new ATOM 1140 N LEU A 68 2.200 5.366 14.011 1.00 0.00 N ATOM 1141 CA LEU A 68 2.294 5.467 12.550 1.00 0.00 C ATOM 1142 C LEU A 68 3.712 5.105 12.064 1.00 0.00 C ATOM 1143 O LEU A 68 4.696 5.710 12.498 1.00 0.00 O ATOM 1144 CB LEU A 68 1.881 6.891 12.118 1.00 0.00 C ATOM 1145 CG LEU A 68 1.795 7.102 10.592 1.00 0.00 C ATOM 1146 CD1 LEU A 68 0.572 6.417 9.982 1.00 0.00 C ATOM 1147 CD2 LEU A 68 1.686 8.593 10.273 1.00 0.00 C ATOM 0 H LEU A 68 2.162 6.271 14.479 1.00 0.00 H new ATOM 0 HA LEU A 68 1.614 4.752 12.087 1.00 0.00 H new ATOM 0 HB2 LEU A 68 0.911 7.123 12.558 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.596 7.603 12.530 1.00 0.00 H new ATOM 0 HG LEU A 68 2.701 6.668 10.168 1.00 0.00 H new ATOM 0 HD11 LEU A 68 0.555 6.594 8.907 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.622 5.345 10.173 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.334 6.823 10.431 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.626 8.731 9.193 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.790 9.001 10.741 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.564 9.112 10.657 1.00 0.00 H new ATOM 1159 N PHE A 69 3.811 4.157 11.130 1.00 0.00 N ATOM 1160 CA PHE A 69 5.053 3.807 10.430 1.00 0.00 C ATOM 1161 C PHE A 69 5.254 4.681 9.184 1.00 0.00 C ATOM 1162 O PHE A 69 6.287 5.341 9.049 1.00 0.00 O ATOM 1163 CB PHE A 69 5.041 2.310 10.079 1.00 0.00 C ATOM 1164 CG PHE A 69 6.163 1.880 9.146 1.00 0.00 C ATOM 1165 CD1 PHE A 69 7.485 1.806 9.623 1.00 0.00 C ATOM 1166 CD2 PHE A 69 5.895 1.597 7.792 1.00 0.00 C ATOM 1167 CE1 PHE A 69 8.534 1.454 8.753 1.00 0.00 C ATOM 1168 CE2 PHE A 69 6.946 1.267 6.917 1.00 0.00 C ATOM 1169 CZ PHE A 69 8.265 1.189 7.397 1.00 0.00 C ATOM 0 H PHE A 69 3.013 3.597 10.831 1.00 0.00 H new ATOM 0 HA PHE A 69 5.899 4.001 11.089 1.00 0.00 H new ATOM 0 HB2 PHE A 69 5.108 1.732 11.000 1.00 0.00 H new ATOM 0 HB3 PHE A 69 4.085 2.064 9.617 1.00 0.00 H new ATOM 0 HD1 PHE A 69 7.695 2.020 10.660 1.00 0.00 H new ATOM 0 HD2 PHE A 69 4.880 1.634 7.425 1.00 0.00 H new ATOM 0 HE1 PHE A 69 9.545 1.387 9.126 1.00 0.00 H new ATOM 0 HE2 PHE A 69 6.739 1.073 5.875 1.00 0.00 H new ATOM 0 HZ PHE A 69 9.070 0.926 6.727 1.00 0.00 H new ATOM 1179 N ALA A 70 4.261 4.705 8.287 1.00 0.00 N ATOM 1180 CA ALA A 70 4.298 5.448 7.027 1.00 0.00 C ATOM 1181 C ALA A 70 2.885 5.748 6.492 1.00 0.00 C ATOM 1182 O ALA A 70 1.906 5.120 6.901 1.00 0.00 O ATOM 1183 CB ALA A 70 5.106 4.636 6.006 1.00 0.00 C ATOM 0 H ALA A 70 3.389 4.194 8.423 1.00 0.00 H new ATOM 0 HA ALA A 70 4.775 6.413 7.201 1.00 0.00 H new ATOM 0 HB1 ALA A 70 5.144 5.176 5.060 1.00 0.00 H new ATOM 0 HB2 ALA A 70 6.119 4.487 6.379 1.00 0.00 H new ATOM 0 HB3 ALA A 70 4.630 3.668 5.852 1.00 0.00 H new ATOM 1189 N GLN A 71 2.787 6.691 5.552 1.00 0.00 N ATOM 1190 CA GLN A 71 1.537 7.084 4.889 1.00 0.00 C ATOM 1191 C GLN A 71 1.758 7.394 3.400 1.00 0.00 C ATOM 1192 O GLN A 71 2.688 8.117 3.056 1.00 0.00 O ATOM 1193 CB GLN A 71 0.915 8.292 5.618 1.00 0.00 C ATOM 1194 CG GLN A 71 1.907 9.433 5.911 1.00 0.00 C ATOM 1195 CD GLN A 71 1.240 10.803 5.971 1.00 0.00 C ATOM 1196 OE1 GLN A 71 0.199 11.002 6.587 1.00 0.00 O ATOM 1197 NE2 GLN A 71 1.814 11.790 5.318 1.00 0.00 N ATOM 0 H GLN A 71 3.595 7.218 5.221 1.00 0.00 H new ATOM 0 HA GLN A 71 0.844 6.244 4.941 1.00 0.00 H new ATOM 0 HB2 GLN A 71 0.096 8.684 5.015 1.00 0.00 H new ATOM 0 HB3 GLN A 71 0.483 7.951 6.559 1.00 0.00 H new ATOM 0 HG2 GLN A 71 2.408 9.237 6.859 1.00 0.00 H new ATOM 0 HG3 GLN A 71 2.678 9.444 5.140 1.00 0.00 H new ATOM 0 HE21 GLN A 71 2.680 11.626 4.805 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.393 12.719 5.325 1.00 0.00 H new ATOM 1206 N ALA A 72 0.897 6.889 2.515 1.00 0.00 N ATOM 1207 CA ALA A 72 0.930 7.137 1.070 1.00 0.00 C ATOM 1208 C ALA A 72 -0.352 7.846 0.584 1.00 0.00 C ATOM 1209 O ALA A 72 -1.363 7.177 0.346 1.00 0.00 O ATOM 1210 CB ALA A 72 1.184 5.808 0.347 1.00 0.00 C ATOM 0 H ALA A 72 0.131 6.275 2.792 1.00 0.00 H new ATOM 0 HA ALA A 72 1.746 7.820 0.834 1.00 0.00 H new ATOM 0 HB1 ALA A 72 1.211 5.979 -0.729 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.138 5.393 0.673 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.384 5.107 0.583 1.00 0.00 H new ATOM 1216 N PRO A 73 -0.328 9.187 0.436 1.00 0.00 N ATOM 1217 CA PRO A 73 -1.347 9.962 -0.270 1.00 0.00 C ATOM 1218 C PRO A 73 -1.518 9.546 -1.739 1.00 0.00 C ATOM 1219 O PRO A 73 -0.531 9.330 -2.448 1.00 0.00 O ATOM 1220 CB PRO A 73 -0.905 11.428 -0.189 1.00 0.00 C ATOM 1221 CG PRO A 73 0.013 11.469 1.026 1.00 0.00 C ATOM 1222 CD PRO A 73 0.645 10.080 1.042 1.00 0.00 C ATOM 0 HA PRO A 73 -2.317 9.790 0.197 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -0.383 11.738 -1.094 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -1.758 12.096 -0.068 1.00 0.00 H new ATOM 0 HG2 PRO A 73 0.766 12.252 0.934 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -0.543 11.668 1.942 1.00 0.00 H new ATOM 0 HD2 PRO A 73 1.582 10.072 0.485 1.00 0.00 H new ATOM 0 HD3 PRO A 73 0.878 9.769 2.061 1.00 0.00 H new ATOM 1230 N VAL A 74 -2.768 9.501 -2.205 1.00 0.00 N ATOM 1231 CA VAL A 74 -3.185 9.106 -3.560 1.00 0.00 C ATOM 1232 C VAL A 74 -4.301 10.039 -4.045 1.00 0.00 C ATOM 1233 O VAL A 74 -5.300 10.206 -3.348 1.00 0.00 O ATOM 1234 CB VAL A 74 -3.718 7.652 -3.589 1.00 0.00 C ATOM 1235 CG1 VAL A 74 -3.787 7.124 -5.025 1.00 0.00 C ATOM 1236 CG2 VAL A 74 -2.911 6.654 -2.754 1.00 0.00 C ATOM 0 H VAL A 74 -3.563 9.752 -1.618 1.00 0.00 H new ATOM 0 HA VAL A 74 -2.312 9.175 -4.209 1.00 0.00 H new ATOM 0 HB VAL A 74 -4.709 7.721 -3.141 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -4.164 6.101 -5.019 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -4.455 7.754 -5.612 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -2.791 7.141 -5.467 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -3.360 5.664 -2.836 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -1.885 6.619 -3.120 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -2.913 6.968 -1.710 1.00 0.00 H new ATOM 1246 N GLU A 75 -4.180 10.626 -5.239 1.00 0.00 N ATOM 1247 CA GLU A 75 -5.201 11.558 -5.771 1.00 0.00 C ATOM 1248 C GLU A 75 -6.292 10.863 -6.610 1.00 0.00 C ATOM 1249 O GLU A 75 -7.404 11.375 -6.736 1.00 0.00 O ATOM 1250 CB GLU A 75 -4.517 12.662 -6.594 1.00 0.00 C ATOM 1251 CG GLU A 75 -3.619 13.563 -5.735 1.00 0.00 C ATOM 1252 CD GLU A 75 -3.022 14.707 -6.579 1.00 0.00 C ATOM 1253 OE1 GLU A 75 -1.921 14.531 -7.156 1.00 0.00 O ATOM 1254 OE2 GLU A 75 -3.643 15.795 -6.664 1.00 0.00 O ATOM 0 H GLU A 75 -3.387 10.477 -5.863 1.00 0.00 H new ATOM 0 HA GLU A 75 -5.711 11.991 -4.910 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -3.920 12.205 -7.383 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -5.278 13.271 -7.082 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -4.197 13.978 -4.909 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -2.816 12.971 -5.297 1.00 0.00 H new ATOM 1261 N GLN A 76 -5.983 9.694 -7.178 1.00 0.00 N ATOM 1262 CA GLN A 76 -6.908 8.816 -7.906 1.00 0.00 C ATOM 1263 C GLN A 76 -6.340 7.391 -8.009 1.00 0.00 C ATOM 1264 O GLN A 76 -5.120 7.222 -8.094 1.00 0.00 O ATOM 1265 CB GLN A 76 -7.240 9.380 -9.307 1.00 0.00 C ATOM 1266 CG GLN A 76 -6.146 9.307 -10.389 1.00 0.00 C ATOM 1267 CD GLN A 76 -4.878 10.099 -10.071 1.00 0.00 C ATOM 1268 OE1 GLN A 76 -4.740 11.270 -10.399 1.00 0.00 O ATOM 1269 NE2 GLN A 76 -3.900 9.492 -9.431 1.00 0.00 N ATOM 0 H GLN A 76 -5.037 9.315 -7.142 1.00 0.00 H new ATOM 0 HA GLN A 76 -7.839 8.774 -7.340 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -8.117 8.852 -9.681 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -7.524 10.426 -9.188 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -5.876 8.262 -10.543 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -6.559 9.672 -11.329 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -4.002 8.516 -9.152 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -3.041 9.998 -9.215 1.00 0.00 H new ATOM 1278 N TYR A 77 -7.210 6.380 -8.058 1.00 0.00 N ATOM 1279 CA TYR A 77 -6.843 4.977 -8.253 1.00 0.00 C ATOM 1280 C TYR A 77 -7.471 4.402 -9.543 1.00 0.00 C ATOM 1281 O TYR A 77 -8.687 4.540 -9.723 1.00 0.00 O ATOM 1282 CB TYR A 77 -7.263 4.161 -7.026 1.00 0.00 C ATOM 1283 CG TYR A 77 -6.758 2.736 -7.056 1.00 0.00 C ATOM 1284 CD1 TYR A 77 -5.390 2.481 -6.858 1.00 0.00 C ATOM 1285 CD2 TYR A 77 -7.644 1.672 -7.314 1.00 0.00 C ATOM 1286 CE1 TYR A 77 -4.900 1.166 -6.950 1.00 0.00 C ATOM 1287 CE2 TYR A 77 -7.162 0.350 -7.368 1.00 0.00 C ATOM 1288 CZ TYR A 77 -5.787 0.093 -7.193 1.00 0.00 C ATOM 1289 OH TYR A 77 -5.322 -1.184 -7.268 1.00 0.00 O ATOM 0 H TYR A 77 -8.216 6.519 -7.960 1.00 0.00 H new ATOM 0 HA TYR A 77 -5.761 4.914 -8.369 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -6.892 4.652 -6.127 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.351 4.153 -6.958 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -4.715 3.295 -6.635 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -8.694 1.870 -7.471 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -3.843 0.976 -6.835 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -7.846 -0.467 -7.544 1.00 0.00 H new ATOM 0 HH TYR A 77 -4.530 -1.278 -6.698 1.00 0.00 H new ATOM 1299 N PRO A 78 -6.697 3.733 -10.425 1.00 0.00 N ATOM 1300 CA PRO A 78 -5.236 3.594 -10.396 1.00 0.00 C ATOM 1301 C PRO A 78 -4.486 4.932 -10.550 1.00 0.00 C ATOM 1302 O PRO A 78 -4.955 5.846 -11.231 1.00 0.00 O ATOM 1303 CB PRO A 78 -4.883 2.625 -11.533 1.00 0.00 C ATOM 1304 CG PRO A 78 -6.180 1.849 -11.758 1.00 0.00 C ATOM 1305 CD PRO A 78 -7.239 2.916 -11.500 1.00 0.00 C ATOM 0 HA PRO A 78 -4.920 3.219 -9.422 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -4.573 3.158 -12.432 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -4.063 1.963 -11.256 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -6.244 1.447 -12.769 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -6.275 1.006 -11.073 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -7.424 3.512 -12.394 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -8.190 2.467 -11.213 1.00 0.00 H new ATOM 1313 N GLY A 79 -3.313 5.035 -9.921 1.00 0.00 N ATOM 1314 CA GLY A 79 -2.422 6.202 -9.960 1.00 0.00 C ATOM 1315 C GLY A 79 -0.950 5.823 -9.750 1.00 0.00 C ATOM 1316 O GLY A 79 -0.584 4.652 -9.850 1.00 0.00 O ATOM 0 H GLY A 79 -2.941 4.278 -9.347 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -2.531 6.707 -10.920 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -2.725 6.912 -9.191 1.00 0.00 H new ATOM 1320 N ILE A 80 -0.096 6.805 -9.438 1.00 0.00 N ATOM 1321 CA ILE A 80 1.347 6.577 -9.207 1.00 0.00 C ATOM 1322 C ILE A 80 1.646 5.989 -7.818 1.00 0.00 C ATOM 1323 O ILE A 80 2.533 5.152 -7.674 1.00 0.00 O ATOM 1324 CB ILE A 80 2.157 7.871 -9.468 1.00 0.00 C ATOM 1325 CG1 ILE A 80 3.672 7.585 -9.332 1.00 0.00 C ATOM 1326 CG2 ILE A 80 1.718 9.033 -8.555 1.00 0.00 C ATOM 1327 CD1 ILE A 80 4.592 8.743 -9.727 1.00 0.00 C ATOM 0 H ILE A 80 -0.379 7.780 -9.337 1.00 0.00 H new ATOM 0 HA ILE A 80 1.668 5.823 -9.926 1.00 0.00 H new ATOM 0 HB ILE A 80 1.951 8.192 -10.489 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.882 7.311 -8.298 1.00 0.00 H new ATOM 0 HG13 ILE A 80 3.919 6.720 -9.947 1.00 0.00 H new ATOM 0 HG21 ILE A 80 2.316 9.917 -8.778 1.00 0.00 H new ATOM 0 HG22 ILE A 80 0.665 9.254 -8.729 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.862 8.751 -7.512 1.00 0.00 H new ATOM 0 HD11 ILE A 80 5.632 8.443 -9.596 1.00 0.00 H new ATOM 0 HD12 ILE A 80 4.419 9.006 -10.771 1.00 0.00 H new ATOM 0 HD13 ILE A 80 4.382 9.606 -9.096 1.00 0.00 H new ATOM 1339 N ALA A 81 0.903 6.401 -6.788 1.00 0.00 N ATOM 1340 CA ALA A 81 1.212 6.107 -5.386 1.00 0.00 C ATOM 1341 C ALA A 81 0.751 4.718 -4.920 1.00 0.00 C ATOM 1342 O ALA A 81 0.838 4.424 -3.730 1.00 0.00 O ATOM 1343 CB ALA A 81 0.676 7.259 -4.529 1.00 0.00 C ATOM 0 H ALA A 81 0.056 6.957 -6.906 1.00 0.00 H new ATOM 0 HA ALA A 81 2.294 6.047 -5.268 1.00 0.00 H new ATOM 0 HB1 ALA A 81 0.894 7.063 -3.479 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.154 8.191 -4.831 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -0.402 7.343 -4.666 1.00 0.00 H new ATOM 1349 N VAL A 82 0.295 3.870 -5.846 1.00 0.00 N ATOM 1350 CA VAL A 82 -0.153 2.490 -5.617 1.00 0.00 C ATOM 1351 C VAL A 82 0.120 1.648 -6.874 1.00 0.00 C ATOM 1352 O VAL A 82 -0.198 2.072 -7.985 1.00 0.00 O ATOM 1353 CB VAL A 82 -1.657 2.431 -5.280 1.00 0.00 C ATOM 1354 CG1 VAL A 82 -2.047 1.013 -4.840 1.00 0.00 C ATOM 1355 CG2 VAL A 82 -2.128 3.390 -4.180 1.00 0.00 C ATOM 0 H VAL A 82 0.224 4.140 -6.827 1.00 0.00 H new ATOM 0 HA VAL A 82 0.401 2.092 -4.767 1.00 0.00 H new ATOM 0 HB VAL A 82 -2.145 2.737 -6.205 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -3.111 0.985 -4.605 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -1.835 0.311 -5.646 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -1.473 0.735 -3.956 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -3.200 3.266 -4.023 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -1.598 3.169 -3.253 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -1.922 4.417 -4.480 1.00 0.00 H new ATOM 1365 N GLU A 83 0.687 0.454 -6.714 1.00 0.00 N ATOM 1366 CA GLU A 83 1.067 -0.465 -7.802 1.00 0.00 C ATOM 1367 C GLU A 83 0.909 -1.946 -7.405 1.00 0.00 C ATOM 1368 O GLU A 83 0.917 -2.291 -6.225 1.00 0.00 O ATOM 1369 CB GLU A 83 2.522 -0.185 -8.248 1.00 0.00 C ATOM 1370 CG GLU A 83 2.584 0.290 -9.705 1.00 0.00 C ATOM 1371 CD GLU A 83 4.036 0.487 -10.176 1.00 0.00 C ATOM 1372 OE1 GLU A 83 4.594 -0.397 -10.868 1.00 0.00 O ATOM 1373 OE2 GLU A 83 4.628 1.559 -9.916 1.00 0.00 O ATOM 0 H GLU A 83 0.906 0.079 -5.791 1.00 0.00 H new ATOM 0 HA GLU A 83 0.386 -0.281 -8.633 1.00 0.00 H new ATOM 0 HB2 GLU A 83 2.963 0.572 -7.599 1.00 0.00 H new ATOM 0 HB3 GLU A 83 3.119 -1.090 -8.134 1.00 0.00 H new ATOM 0 HG2 GLU A 83 2.088 -0.438 -10.347 1.00 0.00 H new ATOM 0 HG3 GLU A 83 2.038 1.228 -9.806 1.00 0.00 H new ATOM 1380 N THR A 84 0.806 -2.833 -8.397 1.00 0.00 N ATOM 1381 CA THR A 84 0.723 -4.305 -8.261 1.00 0.00 C ATOM 1382 C THR A 84 2.001 -4.992 -8.752 1.00 0.00 C ATOM 1383 O THR A 84 2.711 -4.471 -9.616 1.00 0.00 O ATOM 1384 CB THR A 84 -0.469 -4.862 -9.066 1.00 0.00 C ATOM 1385 OG1 THR A 84 -0.525 -4.312 -10.371 1.00 0.00 O ATOM 1386 CG2 THR A 84 -1.800 -4.549 -8.390 1.00 0.00 C ATOM 0 H THR A 84 0.776 -2.537 -9.373 1.00 0.00 H new ATOM 0 HA THR A 84 0.589 -4.515 -7.200 1.00 0.00 H new ATOM 0 HB THR A 84 -0.312 -5.939 -9.116 1.00 0.00 H new ATOM 0 HG1 THR A 84 -1.291 -4.689 -10.852 1.00 0.00 H new ATOM 0 HG21 THR A 84 -2.616 -4.957 -8.986 1.00 0.00 H new ATOM 0 HG22 THR A 84 -1.818 -4.997 -7.396 1.00 0.00 H new ATOM 0 HG23 THR A 84 -1.919 -3.469 -8.303 1.00 0.00 H new ATOM 1394 N VAL A 85 2.270 -6.199 -8.249 1.00 0.00 N ATOM 1395 CA VAL A 85 3.260 -7.125 -8.818 1.00 0.00 C ATOM 1396 C VAL A 85 2.676 -7.883 -10.027 1.00 0.00 C ATOM 1397 O VAL A 85 1.476 -7.813 -10.305 1.00 0.00 O ATOM 1398 CB VAL A 85 3.752 -8.117 -7.748 1.00 0.00 C ATOM 1399 CG1 VAL A 85 4.367 -7.367 -6.565 1.00 0.00 C ATOM 1400 CG2 VAL A 85 2.631 -9.031 -7.254 1.00 0.00 C ATOM 0 H VAL A 85 1.801 -6.569 -7.422 1.00 0.00 H new ATOM 0 HA VAL A 85 4.111 -6.538 -9.164 1.00 0.00 H new ATOM 0 HB VAL A 85 4.511 -8.743 -8.217 1.00 0.00 H new ATOM 0 HG11 VAL A 85 4.709 -8.083 -5.818 1.00 0.00 H new ATOM 0 HG12 VAL A 85 5.212 -6.772 -6.911 1.00 0.00 H new ATOM 0 HG13 VAL A 85 3.618 -6.711 -6.121 1.00 0.00 H new ATOM 0 HG21 VAL A 85 3.024 -9.714 -6.501 1.00 0.00 H new ATOM 0 HG22 VAL A 85 1.835 -8.427 -6.817 1.00 0.00 H new ATOM 0 HG23 VAL A 85 2.233 -9.604 -8.091 1.00 0.00 H new ATOM 1410 N THR A 86 3.507 -8.658 -10.723 1.00 0.00 N ATOM 1411 CA THR A 86 3.138 -9.465 -11.901 1.00 0.00 C ATOM 1412 C THR A 86 2.811 -10.920 -11.561 1.00 0.00 C ATOM 1413 O THR A 86 2.000 -11.552 -12.242 1.00 0.00 O ATOM 1414 CB THR A 86 4.282 -9.455 -12.928 1.00 0.00 C ATOM 1415 OG1 THR A 86 5.444 -10.043 -12.379 1.00 0.00 O ATOM 1416 CG2 THR A 86 4.652 -8.033 -13.335 1.00 0.00 C ATOM 0 H THR A 86 4.493 -8.749 -10.479 1.00 0.00 H new ATOM 0 HA THR A 86 2.237 -9.006 -12.308 1.00 0.00 H new ATOM 0 HB THR A 86 3.930 -10.015 -13.794 1.00 0.00 H new ATOM 0 HG1 THR A 86 6.163 -10.031 -13.045 1.00 0.00 H new ATOM 0 HG21 THR A 86 5.464 -8.062 -14.062 1.00 0.00 H new ATOM 0 HG22 THR A 86 3.785 -7.544 -13.779 1.00 0.00 H new ATOM 0 HG23 THR A 86 4.972 -7.475 -12.455 1.00 0.00 H new ATOM 1424 N ASP A 87 3.438 -11.460 -10.513 1.00 0.00 N ATOM 1425 CA ASP A 87 3.439 -12.895 -10.210 1.00 0.00 C ATOM 1426 C ASP A 87 2.291 -13.320 -9.282 1.00 0.00 C ATOM 1427 O ASP A 87 1.573 -14.277 -9.586 1.00 0.00 O ATOM 1428 CB ASP A 87 4.795 -13.264 -9.598 1.00 0.00 C ATOM 1429 CG ASP A 87 4.869 -14.757 -9.242 1.00 0.00 C ATOM 1430 OD1 ASP A 87 4.525 -15.114 -8.090 1.00 0.00 O ATOM 1431 OD2 ASP A 87 5.254 -15.571 -10.116 1.00 0.00 O ATOM 0 H ASP A 87 3.967 -10.905 -9.841 1.00 0.00 H new ATOM 0 HA ASP A 87 3.279 -13.435 -11.143 1.00 0.00 H new ATOM 0 HB2 ASP A 87 5.591 -13.017 -10.301 1.00 0.00 H new ATOM 0 HB3 ASP A 87 4.965 -12.667 -8.702 1.00 0.00 H new ATOM 1436 N SER A 88 2.123 -12.612 -8.157 1.00 0.00 N ATOM 1437 CA SER A 88 1.243 -13.048 -7.052 1.00 0.00 C ATOM 1438 C SER A 88 0.336 -11.933 -6.525 1.00 0.00 C ATOM 1439 O SER A 88 0.809 -10.960 -5.944 1.00 0.00 O ATOM 1440 CB SER A 88 2.082 -13.625 -5.901 1.00 0.00 C ATOM 1441 OG SER A 88 2.529 -14.939 -6.190 1.00 0.00 O ATOM 0 H SER A 88 2.590 -11.722 -7.983 1.00 0.00 H new ATOM 0 HA SER A 88 0.591 -13.818 -7.463 1.00 0.00 H new ATOM 0 HB2 SER A 88 2.941 -12.980 -5.717 1.00 0.00 H new ATOM 0 HB3 SER A 88 1.489 -13.634 -4.987 1.00 0.00 H new ATOM 0 HG SER A 88 3.232 -14.903 -6.872 1.00 0.00 H new ATOM 1447 N SER A 89 -0.985 -12.097 -6.644 1.00 0.00 N ATOM 1448 CA SER A 89 -2.015 -11.074 -6.357 1.00 0.00 C ATOM 1449 C SER A 89 -2.258 -10.764 -4.860 1.00 0.00 C ATOM 1450 O SER A 89 -3.361 -10.376 -4.472 1.00 0.00 O ATOM 1451 CB SER A 89 -3.331 -11.452 -7.057 1.00 0.00 C ATOM 1452 OG SER A 89 -3.118 -11.824 -8.412 1.00 0.00 O ATOM 0 H SER A 89 -1.390 -12.980 -6.955 1.00 0.00 H new ATOM 0 HA SER A 89 -1.615 -10.143 -6.759 1.00 0.00 H new ATOM 0 HB2 SER A 89 -3.803 -12.277 -6.523 1.00 0.00 H new ATOM 0 HB3 SER A 89 -4.021 -10.609 -7.015 1.00 0.00 H new ATOM 0 HG SER A 89 -3.975 -12.059 -8.825 1.00 0.00 H new ATOM 1458 N ARG A 90 -1.235 -10.937 -4.013 1.00 0.00 N ATOM 1459 CA ARG A 90 -1.213 -10.612 -2.570 1.00 0.00 C ATOM 1460 C ARG A 90 -0.055 -9.683 -2.166 1.00 0.00 C ATOM 1461 O ARG A 90 0.350 -9.659 -1.003 1.00 0.00 O ATOM 1462 CB ARG A 90 -1.375 -11.880 -1.706 1.00 0.00 C ATOM 1463 CG ARG A 90 -0.342 -12.969 -2.012 1.00 0.00 C ATOM 1464 CD ARG A 90 -0.464 -14.200 -1.105 1.00 0.00 C ATOM 1465 NE ARG A 90 0.204 -14.003 0.198 1.00 0.00 N ATOM 1466 CZ ARG A 90 0.894 -14.897 0.885 1.00 0.00 C ATOM 1467 NH1 ARG A 90 1.488 -14.538 1.983 1.00 0.00 N ATOM 1468 NH2 ARG A 90 1.017 -16.140 0.510 1.00 0.00 N ATOM 0 H ARG A 90 -0.348 -11.329 -4.328 1.00 0.00 H new ATOM 0 HA ARG A 90 -2.092 -10.004 -2.358 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -1.299 -11.605 -0.654 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -2.375 -12.287 -1.857 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -0.451 -13.281 -3.051 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.659 -12.549 -1.909 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -1.518 -14.425 -0.941 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -0.029 -15.064 -1.607 1.00 0.00 H new ATOM 0 HE ARG A 90 0.124 -13.075 0.613 1.00 0.00 H new ATOM 0 HH11 ARG A 90 1.420 -13.574 2.308 1.00 0.00 H new ATOM 0 HH12 ARG A 90 2.023 -15.221 2.520 1.00 0.00 H new ATOM 0 HH21 ARG A 90 0.569 -16.460 -0.349 1.00 0.00 H new ATOM 0 HH22 ARG A 90 1.561 -16.792 1.075 1.00 0.00 H new ATOM 1482 N TYR A 91 0.464 -8.912 -3.125 1.00 0.00 N ATOM 1483 CA TYR A 91 1.586 -7.991 -2.953 1.00 0.00 C ATOM 1484 C TYR A 91 1.359 -6.693 -3.744 1.00 0.00 C ATOM 1485 O TYR A 91 0.931 -6.730 -4.902 1.00 0.00 O ATOM 1486 CB TYR A 91 2.874 -8.683 -3.413 1.00 0.00 C ATOM 1487 CG TYR A 91 3.267 -9.907 -2.608 1.00 0.00 C ATOM 1488 CD1 TYR A 91 2.913 -11.194 -3.056 1.00 0.00 C ATOM 1489 CD2 TYR A 91 3.978 -9.753 -1.405 1.00 0.00 C ATOM 1490 CE1 TYR A 91 3.275 -12.330 -2.306 1.00 0.00 C ATOM 1491 CE2 TYR A 91 4.306 -10.883 -0.632 1.00 0.00 C ATOM 1492 CZ TYR A 91 3.965 -12.176 -1.083 1.00 0.00 C ATOM 1493 OH TYR A 91 4.294 -13.264 -0.335 1.00 0.00 O ATOM 0 H TYR A 91 0.099 -8.914 -4.078 1.00 0.00 H new ATOM 0 HA TYR A 91 1.671 -7.723 -1.900 1.00 0.00 H new ATOM 0 HB2 TYR A 91 2.759 -8.975 -4.457 1.00 0.00 H new ATOM 0 HB3 TYR A 91 3.691 -7.962 -3.372 1.00 0.00 H new ATOM 0 HD1 TYR A 91 2.362 -11.311 -3.978 1.00 0.00 H new ATOM 0 HD2 TYR A 91 4.273 -8.768 -1.074 1.00 0.00 H new ATOM 0 HE1 TYR A 91 3.025 -13.317 -2.665 1.00 0.00 H new ATOM 0 HE2 TYR A 91 4.820 -10.760 0.310 1.00 0.00 H new ATOM 0 HH TYR A 91 4.766 -12.975 0.473 1.00 0.00 H new ATOM 1503 N PHE A 92 1.674 -5.547 -3.134 1.00 0.00 N ATOM 1504 CA PHE A 92 1.521 -4.213 -3.725 1.00 0.00 C ATOM 1505 C PHE A 92 2.736 -3.336 -3.427 1.00 0.00 C ATOM 1506 O PHE A 92 3.521 -3.629 -2.531 1.00 0.00 O ATOM 1507 CB PHE A 92 0.258 -3.526 -3.186 1.00 0.00 C ATOM 1508 CG PHE A 92 -1.015 -4.311 -3.392 1.00 0.00 C ATOM 1509 CD1 PHE A 92 -1.685 -4.277 -4.628 1.00 0.00 C ATOM 1510 CD2 PHE A 92 -1.521 -5.091 -2.341 1.00 0.00 C ATOM 1511 CE1 PHE A 92 -2.855 -5.039 -4.808 1.00 0.00 C ATOM 1512 CE2 PHE A 92 -2.702 -5.823 -2.509 1.00 0.00 C ATOM 1513 CZ PHE A 92 -3.366 -5.810 -3.749 1.00 0.00 C ATOM 0 H PHE A 92 2.054 -5.520 -2.188 1.00 0.00 H new ATOM 0 HA PHE A 92 1.433 -4.341 -4.804 1.00 0.00 H new ATOM 0 HB2 PHE A 92 0.387 -3.340 -2.120 1.00 0.00 H new ATOM 0 HB3 PHE A 92 0.153 -2.554 -3.669 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -1.304 -3.669 -5.435 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -0.996 -5.127 -1.398 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -3.361 -5.031 -5.762 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -3.103 -6.397 -1.687 1.00 0.00 H new ATOM 0 HZ PHE A 92 -4.266 -6.391 -3.887 1.00 0.00 H new ATOM 1523 N VAL A 93 2.867 -2.226 -4.143 1.00 0.00 N ATOM 1524 CA VAL A 93 3.816 -1.147 -3.844 1.00 0.00 C ATOM 1525 C VAL A 93 3.033 0.136 -3.616 1.00 0.00 C ATOM 1526 O VAL A 93 2.039 0.362 -4.302 1.00 0.00 O ATOM 1527 CB VAL A 93 4.853 -1.004 -4.971 1.00 0.00 C ATOM 1528 CG1 VAL A 93 5.794 0.193 -4.797 1.00 0.00 C ATOM 1529 CG2 VAL A 93 5.696 -2.280 -5.034 1.00 0.00 C ATOM 0 H VAL A 93 2.303 -2.041 -4.972 1.00 0.00 H new ATOM 0 HA VAL A 93 4.377 -1.379 -2.939 1.00 0.00 H new ATOM 0 HB VAL A 93 4.292 -0.838 -5.891 1.00 0.00 H new ATOM 0 HG11 VAL A 93 6.496 0.228 -5.630 1.00 0.00 H new ATOM 0 HG12 VAL A 93 5.211 1.114 -4.775 1.00 0.00 H new ATOM 0 HG13 VAL A 93 6.345 0.090 -3.862 1.00 0.00 H new ATOM 0 HG21 VAL A 93 6.435 -2.189 -5.830 1.00 0.00 H new ATOM 0 HG22 VAL A 93 6.205 -2.427 -4.082 1.00 0.00 H new ATOM 0 HG23 VAL A 93 5.049 -3.134 -5.235 1.00 0.00 H new ATOM 1539 N ILE A 94 3.460 0.988 -2.684 1.00 0.00 N ATOM 1540 CA ILE A 94 2.872 2.318 -2.495 1.00 0.00 C ATOM 1541 C ILE A 94 3.947 3.395 -2.330 1.00 0.00 C ATOM 1542 O ILE A 94 5.031 3.126 -1.805 1.00 0.00 O ATOM 1543 CB ILE A 94 1.820 2.373 -1.361 1.00 0.00 C ATOM 1544 CG1 ILE A 94 2.350 2.087 0.064 1.00 0.00 C ATOM 1545 CG2 ILE A 94 0.581 1.518 -1.668 1.00 0.00 C ATOM 1546 CD1 ILE A 94 2.586 0.615 0.435 1.00 0.00 C ATOM 0 H ILE A 94 4.222 0.778 -2.039 1.00 0.00 H new ATOM 0 HA ILE A 94 2.326 2.534 -3.413 1.00 0.00 H new ATOM 0 HB ILE A 94 1.528 3.423 -1.346 1.00 0.00 H new ATOM 0 HG12 ILE A 94 3.290 2.624 0.190 1.00 0.00 H new ATOM 0 HG13 ILE A 94 1.644 2.508 0.780 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -0.126 1.591 -0.841 1.00 0.00 H new ATOM 0 HG22 ILE A 94 0.108 1.877 -2.582 1.00 0.00 H new ATOM 0 HG23 ILE A 94 0.880 0.478 -1.799 1.00 0.00 H new ATOM 0 HD11 ILE A 94 2.957 0.553 1.458 1.00 0.00 H new ATOM 0 HD12 ILE A 94 1.649 0.065 0.354 1.00 0.00 H new ATOM 0 HD13 ILE A 94 3.321 0.182 -0.244 1.00 0.00 H new ATOM 1558 N ARG A 95 3.644 4.622 -2.776 1.00 0.00 N ATOM 1559 CA ARG A 95 4.555 5.776 -2.640 1.00 0.00 C ATOM 1560 C ARG A 95 4.263 6.551 -1.357 1.00 0.00 C ATOM 1561 O ARG A 95 3.446 7.473 -1.351 1.00 0.00 O ATOM 1562 CB ARG A 95 4.539 6.661 -3.899 1.00 0.00 C ATOM 1563 CG ARG A 95 5.751 7.605 -3.913 1.00 0.00 C ATOM 1564 CD ARG A 95 5.761 8.496 -5.160 1.00 0.00 C ATOM 1565 NE ARG A 95 6.973 9.338 -5.191 1.00 0.00 N ATOM 1566 CZ ARG A 95 7.632 9.779 -6.245 1.00 0.00 C ATOM 1567 NH1 ARG A 95 8.712 10.478 -6.068 1.00 0.00 N ATOM 1568 NH2 ARG A 95 7.246 9.547 -7.467 1.00 0.00 N ATOM 0 H ARG A 95 2.764 4.846 -3.240 1.00 0.00 H new ATOM 0 HA ARG A 95 5.575 5.401 -2.553 1.00 0.00 H new ATOM 0 HB2 ARG A 95 4.549 6.034 -4.791 1.00 0.00 H new ATOM 0 HB3 ARG A 95 3.618 7.243 -3.929 1.00 0.00 H new ATOM 0 HG2 ARG A 95 5.736 8.229 -3.020 1.00 0.00 H new ATOM 0 HG3 ARG A 95 6.669 7.019 -3.877 1.00 0.00 H new ATOM 0 HD2 ARG A 95 5.720 7.876 -6.056 1.00 0.00 H new ATOM 0 HD3 ARG A 95 4.873 9.128 -5.168 1.00 0.00 H new ATOM 0 HE ARG A 95 7.348 9.613 -4.283 1.00 0.00 H new ATOM 0 HH11 ARG A 95 9.040 10.679 -5.123 1.00 0.00 H new ATOM 0 HH12 ARG A 95 9.232 10.826 -6.874 1.00 0.00 H new ATOM 0 HH21 ARG A 95 6.401 9.003 -7.640 1.00 0.00 H new ATOM 0 HH22 ARG A 95 7.789 9.909 -8.251 1.00 0.00 H new ATOM 1582 N ILE A 96 4.924 6.181 -0.265 1.00 0.00 N ATOM 1583 CA ILE A 96 4.790 6.876 1.023 1.00 0.00 C ATOM 1584 C ILE A 96 5.448 8.263 0.971 1.00 0.00 C ATOM 1585 O ILE A 96 6.480 8.440 0.323 1.00 0.00 O ATOM 1586 CB ILE A 96 5.211 6.002 2.229 1.00 0.00 C ATOM 1587 CG1 ILE A 96 6.710 5.628 2.282 1.00 0.00 C ATOM 1588 CG2 ILE A 96 4.361 4.722 2.283 1.00 0.00 C ATOM 1589 CD1 ILE A 96 7.537 6.571 3.160 1.00 0.00 C ATOM 0 H ILE A 96 5.569 5.391 -0.242 1.00 0.00 H new ATOM 0 HA ILE A 96 3.729 7.056 1.199 1.00 0.00 H new ATOM 0 HB ILE A 96 5.033 6.629 3.102 1.00 0.00 H new ATOM 0 HG12 ILE A 96 6.811 4.610 2.659 1.00 0.00 H new ATOM 0 HG13 ILE A 96 7.115 5.635 1.270 1.00 0.00 H new ATOM 0 HG21 ILE A 96 4.668 4.117 3.136 1.00 0.00 H new ATOM 0 HG22 ILE A 96 3.309 4.988 2.387 1.00 0.00 H new ATOM 0 HG23 ILE A 96 4.502 4.152 1.365 1.00 0.00 H new ATOM 0 HD11 ILE A 96 8.580 6.253 3.154 1.00 0.00 H new ATOM 0 HD12 ILE A 96 7.465 7.587 2.771 1.00 0.00 H new ATOM 0 HD13 ILE A 96 7.156 6.546 4.181 1.00 0.00 H new ATOM 1601 N GLN A 97 4.825 9.259 1.606 1.00 0.00 N ATOM 1602 CA GLN A 97 5.196 10.681 1.561 1.00 0.00 C ATOM 1603 C GLN A 97 5.104 11.330 2.948 1.00 0.00 C ATOM 1604 O GLN A 97 4.199 11.047 3.736 1.00 0.00 O ATOM 1605 CB GLN A 97 4.280 11.465 0.603 1.00 0.00 C ATOM 1606 CG GLN A 97 4.446 11.130 -0.889 1.00 0.00 C ATOM 1607 CD GLN A 97 3.124 11.209 -1.644 1.00 0.00 C ATOM 1608 OE1 GLN A 97 2.602 12.274 -1.945 1.00 0.00 O ATOM 1609 NE2 GLN A 97 2.525 10.080 -1.949 1.00 0.00 N ATOM 0 H GLN A 97 4.009 9.091 2.194 1.00 0.00 H new ATOM 0 HA GLN A 97 6.226 10.721 1.206 1.00 0.00 H new ATOM 0 HB2 GLN A 97 3.244 11.281 0.886 1.00 0.00 H new ATOM 0 HB3 GLN A 97 4.464 12.530 0.742 1.00 0.00 H new ATOM 0 HG2 GLN A 97 5.161 11.819 -1.338 1.00 0.00 H new ATOM 0 HG3 GLN A 97 4.862 10.128 -0.991 1.00 0.00 H new ATOM 0 HE21 GLN A 97 2.957 9.190 -1.700 1.00 0.00 H new ATOM 0 HE22 GLN A 97 1.628 10.093 -2.435 1.00 0.00 H new ATOM 1618 N ASP A 98 5.994 12.286 3.206 1.00 0.00 N ATOM 1619 CA ASP A 98 6.026 13.067 4.460 1.00 0.00 C ATOM 1620 C ASP A 98 5.173 14.358 4.393 1.00 0.00 C ATOM 1621 O ASP A 98 5.104 15.123 5.355 1.00 0.00 O ATOM 1622 CB ASP A 98 7.491 13.361 4.815 1.00 0.00 C ATOM 1623 CG ASP A 98 7.726 13.814 6.267 1.00 0.00 C ATOM 1624 OD1 ASP A 98 8.560 14.731 6.467 1.00 0.00 O ATOM 1625 OD2 ASP A 98 7.149 13.214 7.206 1.00 0.00 O ATOM 0 H ASP A 98 6.727 12.550 2.547 1.00 0.00 H new ATOM 0 HA ASP A 98 5.569 12.473 5.251 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.082 12.464 4.629 1.00 0.00 H new ATOM 0 HB3 ASP A 98 7.865 14.134 4.143 1.00 0.00 H new ATOM 1630 N GLY A 99 4.530 14.617 3.246 1.00 0.00 N ATOM 1631 CA GLY A 99 3.656 15.779 3.005 1.00 0.00 C ATOM 1632 C GLY A 99 4.389 17.066 2.597 1.00 0.00 C ATOM 1633 O GLY A 99 3.798 18.147 2.616 1.00 0.00 O ATOM 0 H GLY A 99 4.605 14.006 2.433 1.00 0.00 H new ATOM 0 HA2 GLY A 99 2.941 15.522 2.223 1.00 0.00 H new ATOM 0 HA3 GLY A 99 3.081 15.977 3.910 1.00 0.00 H new ATOM 1637 N THR A 100 5.678 16.961 2.245 1.00 0.00 N ATOM 1638 CA THR A 100 6.583 18.096 1.958 1.00 0.00 C ATOM 1639 C THR A 100 7.497 17.860 0.735 1.00 0.00 C ATOM 1640 O THR A 100 8.527 18.518 0.574 1.00 0.00 O ATOM 1641 CB THR A 100 7.357 18.458 3.244 1.00 0.00 C ATOM 1642 OG1 THR A 100 8.037 19.691 3.129 1.00 0.00 O ATOM 1643 CG2 THR A 100 8.359 17.382 3.674 1.00 0.00 C ATOM 0 H THR A 100 6.140 16.057 2.147 1.00 0.00 H new ATOM 0 HA THR A 100 5.980 18.955 1.663 1.00 0.00 H new ATOM 0 HB THR A 100 6.588 18.536 4.012 1.00 0.00 H new ATOM 0 HG1 THR A 100 8.382 19.790 2.217 1.00 0.00 H new ATOM 0 HG21 THR A 100 8.867 17.701 4.584 1.00 0.00 H new ATOM 0 HG22 THR A 100 7.831 16.447 3.862 1.00 0.00 H new ATOM 0 HG23 THR A 100 9.093 17.231 2.882 1.00 0.00 H new ATOM 1651 N GLY A 101 7.152 16.896 -0.130 1.00 0.00 N ATOM 1652 CA GLY A 101 7.935 16.515 -1.321 1.00 0.00 C ATOM 1653 C GLY A 101 8.977 15.409 -1.085 1.00 0.00 C ATOM 1654 O GLY A 101 9.556 14.892 -2.045 1.00 0.00 O ATOM 0 H GLY A 101 6.301 16.344 -0.021 1.00 0.00 H new ATOM 0 HA2 GLY A 101 7.247 16.186 -2.100 1.00 0.00 H new ATOM 0 HA3 GLY A 101 8.446 17.400 -1.700 1.00 0.00 H new ATOM 1658 N ARG A 102 9.173 14.985 0.171 1.00 0.00 N ATOM 1659 CA ARG A 102 9.858 13.743 0.550 1.00 0.00 C ATOM 1660 C ARG A 102 8.951 12.574 0.219 1.00 0.00 C ATOM 1661 O ARG A 102 7.790 12.556 0.637 1.00 0.00 O ATOM 1662 CB ARG A 102 10.137 13.698 2.058 1.00 0.00 C ATOM 1663 CG ARG A 102 11.091 14.786 2.537 1.00 0.00 C ATOM 1664 CD ARG A 102 11.096 14.847 4.070 1.00 0.00 C ATOM 1665 NE ARG A 102 11.943 15.944 4.572 1.00 0.00 N ATOM 1666 CZ ARG A 102 11.782 16.627 5.694 1.00 0.00 C ATOM 1667 NH1 ARG A 102 12.634 17.559 6.013 1.00 0.00 N ATOM 1668 NH2 ARG A 102 10.796 16.423 6.522 1.00 0.00 N ATOM 0 H ARG A 102 8.847 15.516 0.979 1.00 0.00 H new ATOM 0 HA ARG A 102 10.803 13.694 0.008 1.00 0.00 H new ATOM 0 HB2 ARG A 102 9.194 13.792 2.596 1.00 0.00 H new ATOM 0 HB3 ARG A 102 10.554 12.724 2.313 1.00 0.00 H new ATOM 0 HG2 ARG A 102 12.098 14.585 2.170 1.00 0.00 H new ATOM 0 HG3 ARG A 102 10.790 15.750 2.128 1.00 0.00 H new ATOM 0 HD2 ARG A 102 10.076 14.980 4.432 1.00 0.00 H new ATOM 0 HD3 ARG A 102 11.455 13.899 4.470 1.00 0.00 H new ATOM 0 HE ARG A 102 12.740 16.205 3.991 1.00 0.00 H new ATOM 0 HH11 ARG A 102 13.423 17.761 5.399 1.00 0.00 H new ATOM 0 HH12 ARG A 102 12.512 18.087 6.877 1.00 0.00 H new ATOM 0 HH21 ARG A 102 10.099 15.706 6.319 1.00 0.00 H new ATOM 0 HH22 ARG A 102 10.721 16.980 7.373 1.00 0.00 H new ATOM 1682 N SER A 103 9.497 11.590 -0.478 1.00 0.00 N ATOM 1683 CA SER A 103 8.800 10.330 -0.741 1.00 0.00 C ATOM 1684 C SER A 103 9.714 9.116 -0.954 1.00 0.00 C ATOM 1685 O SER A 103 10.900 9.254 -1.268 1.00 0.00 O ATOM 1686 CB SER A 103 7.858 10.494 -1.939 1.00 0.00 C ATOM 1687 OG SER A 103 8.576 10.749 -3.136 1.00 0.00 O ATOM 0 H SER A 103 10.434 11.637 -0.879 1.00 0.00 H new ATOM 0 HA SER A 103 8.239 10.113 0.168 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.259 9.591 -2.058 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.165 11.313 -1.748 1.00 0.00 H new ATOM 0 HG SER A 103 8.191 11.528 -3.589 1.00 0.00 H new ATOM 1693 N ALA A 104 9.137 7.919 -0.809 1.00 0.00 N ATOM 1694 CA ALA A 104 9.752 6.632 -1.141 1.00 0.00 C ATOM 1695 C ALA A 104 8.707 5.631 -1.657 1.00 0.00 C ATOM 1696 O ALA A 104 7.568 5.615 -1.194 1.00 0.00 O ATOM 1697 CB ALA A 104 10.476 6.085 0.098 1.00 0.00 C ATOM 0 H ALA A 104 8.191 7.817 -0.442 1.00 0.00 H new ATOM 0 HA ALA A 104 10.475 6.780 -1.943 1.00 0.00 H new ATOM 0 HB1 ALA A 104 10.936 5.127 -0.143 1.00 0.00 H new ATOM 0 HB2 ALA A 104 11.247 6.790 0.409 1.00 0.00 H new ATOM 0 HB3 ALA A 104 9.759 5.950 0.908 1.00 0.00 H new ATOM 1703 N PHE A 105 9.099 4.758 -2.586 1.00 0.00 N ATOM 1704 CA PHE A 105 8.310 3.582 -2.956 1.00 0.00 C ATOM 1705 C PHE A 105 8.663 2.415 -2.021 1.00 0.00 C ATOM 1706 O PHE A 105 9.833 2.040 -1.906 1.00 0.00 O ATOM 1707 CB PHE A 105 8.536 3.223 -4.431 1.00 0.00 C ATOM 1708 CG PHE A 105 7.873 4.155 -5.433 1.00 0.00 C ATOM 1709 CD1 PHE A 105 8.605 5.178 -6.066 1.00 0.00 C ATOM 1710 CD2 PHE A 105 6.523 3.957 -5.785 1.00 0.00 C ATOM 1711 CE1 PHE A 105 8.003 5.973 -7.059 1.00 0.00 C ATOM 1712 CE2 PHE A 105 5.923 4.741 -6.785 1.00 0.00 C ATOM 1713 CZ PHE A 105 6.667 5.744 -7.430 1.00 0.00 C ATOM 0 H PHE A 105 9.973 4.846 -3.104 1.00 0.00 H new ATOM 0 HA PHE A 105 7.249 3.802 -2.840 1.00 0.00 H new ATOM 0 HB2 PHE A 105 9.609 3.210 -4.625 1.00 0.00 H new ATOM 0 HB3 PHE A 105 8.169 2.211 -4.602 1.00 0.00 H new ATOM 0 HD1 PHE A 105 9.634 5.353 -5.788 1.00 0.00 H new ATOM 0 HD2 PHE A 105 5.945 3.196 -5.282 1.00 0.00 H new ATOM 0 HE1 PHE A 105 8.568 6.760 -7.536 1.00 0.00 H new ATOM 0 HE2 PHE A 105 4.892 4.573 -7.058 1.00 0.00 H new ATOM 0 HZ PHE A 105 6.213 6.338 -8.209 1.00 0.00 H new ATOM 1723 N ILE A 106 7.659 1.838 -1.359 1.00 0.00 N ATOM 1724 CA ILE A 106 7.801 0.652 -0.492 1.00 0.00 C ATOM 1725 C ILE A 106 6.891 -0.485 -0.961 1.00 0.00 C ATOM 1726 O ILE A 106 5.770 -0.236 -1.405 1.00 0.00 O ATOM 1727 CB ILE A 106 7.591 0.983 1.007 1.00 0.00 C ATOM 1728 CG1 ILE A 106 6.123 1.295 1.378 1.00 0.00 C ATOM 1729 CG2 ILE A 106 8.522 2.136 1.415 1.00 0.00 C ATOM 1730 CD1 ILE A 106 5.879 1.469 2.882 1.00 0.00 C ATOM 0 H ILE A 106 6.701 2.185 -1.407 1.00 0.00 H new ATOM 0 HA ILE A 106 8.832 0.310 -0.584 1.00 0.00 H new ATOM 0 HB ILE A 106 7.845 0.084 1.569 1.00 0.00 H new ATOM 0 HG12 ILE A 106 5.815 2.205 0.864 1.00 0.00 H new ATOM 0 HG13 ILE A 106 5.488 0.490 1.009 1.00 0.00 H new ATOM 0 HG21 ILE A 106 8.373 2.368 2.470 1.00 0.00 H new ATOM 0 HG22 ILE A 106 9.559 1.842 1.251 1.00 0.00 H new ATOM 0 HG23 ILE A 106 8.295 3.017 0.814 1.00 0.00 H new ATOM 0 HD11 ILE A 106 4.825 1.685 3.057 1.00 0.00 H new ATOM 0 HD12 ILE A 106 6.153 0.552 3.404 1.00 0.00 H new ATOM 0 HD13 ILE A 106 6.486 2.294 3.256 1.00 0.00 H new ATOM 1742 N GLY A 107 7.357 -1.730 -0.851 1.00 0.00 N ATOM 1743 CA GLY A 107 6.557 -2.924 -1.128 1.00 0.00 C ATOM 1744 C GLY A 107 5.845 -3.407 0.132 1.00 0.00 C ATOM 1745 O GLY A 107 6.410 -3.322 1.221 1.00 0.00 O ATOM 0 H GLY A 107 8.313 -1.940 -0.563 1.00 0.00 H new ATOM 0 HA2 GLY A 107 5.823 -2.703 -1.903 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.199 -3.716 -1.514 1.00 0.00 H new ATOM 1749 N ILE A 108 4.625 -3.925 -0.012 1.00 0.00 N ATOM 1750 CA ILE A 108 3.838 -4.560 1.050 1.00 0.00 C ATOM 1751 C ILE A 108 3.299 -5.929 0.624 1.00 0.00 C ATOM 1752 O ILE A 108 2.860 -6.112 -0.512 1.00 0.00 O ATOM 1753 CB ILE A 108 2.711 -3.657 1.601 1.00 0.00 C ATOM 1754 CG1 ILE A 108 1.696 -3.187 0.536 1.00 0.00 C ATOM 1755 CG2 ILE A 108 3.324 -2.478 2.366 1.00 0.00 C ATOM 1756 CD1 ILE A 108 0.445 -2.530 1.138 1.00 0.00 C ATOM 0 H ILE A 108 4.137 -3.914 -0.907 1.00 0.00 H new ATOM 0 HA ILE A 108 4.533 -4.718 1.875 1.00 0.00 H new ATOM 0 HB ILE A 108 2.122 -4.268 2.285 1.00 0.00 H new ATOM 0 HG12 ILE A 108 2.184 -2.478 -0.133 1.00 0.00 H new ATOM 0 HG13 ILE A 108 1.394 -4.041 -0.070 1.00 0.00 H new ATOM 0 HG21 ILE A 108 2.528 -1.842 2.754 1.00 0.00 H new ATOM 0 HG22 ILE A 108 3.924 -2.854 3.195 1.00 0.00 H new ATOM 0 HG23 ILE A 108 3.957 -1.898 1.694 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -0.226 -2.223 0.336 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -0.065 -3.244 1.785 1.00 0.00 H new ATOM 0 HD13 ILE A 108 0.737 -1.656 1.721 1.00 0.00 H new ATOM 1768 N GLY A 109 3.318 -6.889 1.550 1.00 0.00 N ATOM 1769 CA GLY A 109 2.817 -8.252 1.375 1.00 0.00 C ATOM 1770 C GLY A 109 1.738 -8.629 2.386 1.00 0.00 C ATOM 1771 O GLY A 109 1.844 -8.318 3.575 1.00 0.00 O ATOM 0 H GLY A 109 3.700 -6.730 2.483 1.00 0.00 H new ATOM 0 HA2 GLY A 109 2.415 -8.358 0.367 1.00 0.00 H new ATOM 0 HA3 GLY A 109 3.648 -8.952 1.462 1.00 0.00 H new ATOM 1775 N PHE A 110 0.699 -9.305 1.892 1.00 0.00 N ATOM 1776 CA PHE A 110 -0.476 -9.758 2.642 1.00 0.00 C ATOM 1777 C PHE A 110 -0.388 -11.255 2.964 1.00 0.00 C ATOM 1778 O PHE A 110 0.357 -12.002 2.326 1.00 0.00 O ATOM 1779 CB PHE A 110 -1.748 -9.451 1.831 1.00 0.00 C ATOM 1780 CG PHE A 110 -2.162 -7.992 1.811 1.00 0.00 C ATOM 1781 CD1 PHE A 110 -1.354 -7.022 1.185 1.00 0.00 C ATOM 1782 CD2 PHE A 110 -3.373 -7.603 2.414 1.00 0.00 C ATOM 1783 CE1 PHE A 110 -1.733 -5.671 1.205 1.00 0.00 C ATOM 1784 CE2 PHE A 110 -3.773 -6.256 2.391 1.00 0.00 C ATOM 1785 CZ PHE A 110 -2.945 -5.290 1.798 1.00 0.00 C ATOM 0 H PHE A 110 0.651 -9.565 0.907 1.00 0.00 H new ATOM 0 HA PHE A 110 -0.514 -9.223 3.591 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -1.594 -9.783 0.804 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -2.570 -10.040 2.237 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -0.442 -7.319 0.689 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -3.996 -8.342 2.896 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -1.090 -4.924 0.763 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -4.716 -5.964 2.829 1.00 0.00 H new ATOM 0 HZ PHE A 110 -3.242 -4.252 1.799 1.00 0.00 H new ATOM 1795 N THR A 111 -1.195 -11.715 3.923 1.00 0.00 N ATOM 1796 CA THR A 111 -1.259 -13.132 4.330 1.00 0.00 C ATOM 1797 C THR A 111 -1.988 -14.018 3.308 1.00 0.00 C ATOM 1798 O THR A 111 -1.677 -15.203 3.178 1.00 0.00 O ATOM 1799 CB THR A 111 -1.880 -13.240 5.735 1.00 0.00 C ATOM 1800 OG1 THR A 111 -1.693 -14.536 6.262 1.00 0.00 O ATOM 1801 CG2 THR A 111 -3.377 -12.915 5.795 1.00 0.00 C ATOM 0 H THR A 111 -1.831 -11.114 4.447 1.00 0.00 H new ATOM 0 HA THR A 111 -0.239 -13.515 4.365 1.00 0.00 H new ATOM 0 HB THR A 111 -1.359 -12.487 6.326 1.00 0.00 H new ATOM 0 HG1 THR A 111 -2.092 -14.587 7.156 1.00 0.00 H new ATOM 0 HG21 THR A 111 -3.730 -13.016 6.821 1.00 0.00 H new ATOM 0 HG22 THR A 111 -3.541 -11.893 5.454 1.00 0.00 H new ATOM 0 HG23 THR A 111 -3.925 -13.604 5.153 1.00 0.00 H new ATOM 1809 N ASP A 112 -2.925 -13.448 2.538 1.00 0.00 N ATOM 1810 CA ASP A 112 -3.737 -14.171 1.553 1.00 0.00 C ATOM 1811 C ASP A 112 -4.294 -13.239 0.460 1.00 0.00 C ATOM 1812 O ASP A 112 -4.528 -12.048 0.697 1.00 0.00 O ATOM 1813 CB ASP A 112 -4.887 -14.895 2.277 1.00 0.00 C ATOM 1814 CG ASP A 112 -5.629 -15.860 1.340 1.00 0.00 C ATOM 1815 OD1 ASP A 112 -5.109 -16.972 1.084 1.00 0.00 O ATOM 1816 OD2 ASP A 112 -6.705 -15.487 0.821 1.00 0.00 O ATOM 0 H ASP A 112 -3.143 -12.453 2.584 1.00 0.00 H new ATOM 0 HA ASP A 112 -3.095 -14.897 1.053 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -4.490 -15.448 3.129 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -5.588 -14.160 2.672 1.00 0.00 H new ATOM 1821 N ARG A 113 -4.556 -13.788 -0.734 1.00 0.00 N ATOM 1822 CA ARG A 113 -5.158 -13.070 -1.871 1.00 0.00 C ATOM 1823 C ARG A 113 -6.548 -12.505 -1.559 1.00 0.00 C ATOM 1824 O ARG A 113 -6.862 -11.411 -2.021 1.00 0.00 O ATOM 1825 CB ARG A 113 -5.179 -14.012 -3.087 1.00 0.00 C ATOM 1826 CG ARG A 113 -5.702 -13.327 -4.359 1.00 0.00 C ATOM 1827 CD ARG A 113 -5.621 -14.282 -5.554 1.00 0.00 C ATOM 1828 NE ARG A 113 -6.253 -13.699 -6.755 1.00 0.00 N ATOM 1829 CZ ARG A 113 -6.012 -14.023 -8.015 1.00 0.00 C ATOM 1830 NH1 ARG A 113 -6.673 -13.449 -8.978 1.00 0.00 N ATOM 1831 NH2 ARG A 113 -5.130 -14.923 -8.348 1.00 0.00 N ATOM 0 H ARG A 113 -4.352 -14.765 -0.943 1.00 0.00 H new ATOM 0 HA ARG A 113 -4.546 -12.196 -2.092 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -4.172 -14.386 -3.269 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -5.804 -14.876 -2.861 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -6.734 -13.008 -4.210 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -5.118 -12.430 -4.563 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -4.577 -14.513 -5.766 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -6.111 -15.223 -5.304 1.00 0.00 H new ATOM 0 HE ARG A 113 -6.948 -12.970 -6.596 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -7.380 -12.746 -8.763 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -6.484 -13.702 -9.948 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -4.596 -15.406 -7.625 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -4.974 -15.144 -9.331 1.00 0.00 H new ATOM 1845 N GLY A 114 -7.357 -13.184 -0.745 1.00 0.00 N ATOM 1846 CA GLY A 114 -8.679 -12.700 -0.331 1.00 0.00 C ATOM 1847 C GLY A 114 -8.621 -11.427 0.527 1.00 0.00 C ATOM 1848 O GLY A 114 -9.500 -10.572 0.422 1.00 0.00 O ATOM 0 H GLY A 114 -7.114 -14.092 -0.350 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -9.280 -12.504 -1.219 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -9.186 -13.485 0.230 1.00 0.00 H new ATOM 1852 N ASP A 115 -7.558 -11.257 1.321 1.00 0.00 N ATOM 1853 CA ASP A 115 -7.320 -10.048 2.120 1.00 0.00 C ATOM 1854 C ASP A 115 -6.645 -8.938 1.301 1.00 0.00 C ATOM 1855 O ASP A 115 -6.981 -7.765 1.468 1.00 0.00 O ATOM 1856 CB ASP A 115 -6.508 -10.398 3.375 1.00 0.00 C ATOM 1857 CG ASP A 115 -7.355 -11.184 4.387 1.00 0.00 C ATOM 1858 OD1 ASP A 115 -7.049 -12.367 4.658 1.00 0.00 O ATOM 1859 OD2 ASP A 115 -8.330 -10.599 4.919 1.00 0.00 O ATOM 0 H ASP A 115 -6.830 -11.963 1.429 1.00 0.00 H new ATOM 0 HA ASP A 115 -8.287 -9.654 2.432 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -5.635 -10.987 3.093 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -6.139 -9.483 3.839 1.00 0.00 H new ATOM 1864 N ALA A 116 -5.761 -9.293 0.362 1.00 0.00 N ATOM 1865 CA ALA A 116 -5.215 -8.348 -0.609 1.00 0.00 C ATOM 1866 C ALA A 116 -6.271 -7.795 -1.580 1.00 0.00 C ATOM 1867 O ALA A 116 -6.208 -6.626 -1.956 1.00 0.00 O ATOM 1868 CB ALA A 116 -4.115 -9.064 -1.374 1.00 0.00 C ATOM 0 H ALA A 116 -5.406 -10.244 0.257 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.830 -7.481 -0.071 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -3.683 -8.386 -2.110 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -3.340 -9.387 -0.679 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -4.532 -9.934 -1.882 1.00 0.00 H new ATOM 1874 N PHE A 117 -7.280 -8.585 -1.954 1.00 0.00 N ATOM 1875 CA PHE A 117 -8.378 -8.093 -2.789 1.00 0.00 C ATOM 1876 C PHE A 117 -9.171 -6.962 -2.115 1.00 0.00 C ATOM 1877 O PHE A 117 -9.588 -6.028 -2.797 1.00 0.00 O ATOM 1878 CB PHE A 117 -9.268 -9.251 -3.266 1.00 0.00 C ATOM 1879 CG PHE A 117 -8.968 -9.667 -4.699 1.00 0.00 C ATOM 1880 CD1 PHE A 117 -9.973 -9.581 -5.684 1.00 0.00 C ATOM 1881 CD2 PHE A 117 -7.669 -10.068 -5.069 1.00 0.00 C ATOM 1882 CE1 PHE A 117 -9.677 -9.883 -7.026 1.00 0.00 C ATOM 1883 CE2 PHE A 117 -7.371 -10.362 -6.412 1.00 0.00 C ATOM 1884 CZ PHE A 117 -8.375 -10.265 -7.392 1.00 0.00 C ATOM 0 H PHE A 117 -7.359 -9.568 -1.692 1.00 0.00 H new ATOM 0 HA PHE A 117 -7.938 -7.642 -3.679 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -9.129 -10.107 -2.606 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -10.314 -8.956 -3.189 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -10.973 -9.282 -5.408 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -6.898 -10.150 -4.317 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -10.452 -9.821 -7.776 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -6.372 -10.662 -6.690 1.00 0.00 H new ATOM 0 HZ PHE A 117 -8.146 -10.484 -8.424 1.00 0.00 H new ATOM 1894 N ASP A 118 -9.301 -6.956 -0.783 1.00 0.00 N ATOM 1895 CA ASP A 118 -9.923 -5.835 -0.062 1.00 0.00 C ATOM 1896 C ASP A 118 -9.097 -4.535 -0.154 1.00 0.00 C ATOM 1897 O ASP A 118 -9.680 -3.452 -0.195 1.00 0.00 O ATOM 1898 CB ASP A 118 -10.199 -6.218 1.401 1.00 0.00 C ATOM 1899 CG ASP A 118 -11.366 -7.206 1.567 1.00 0.00 C ATOM 1900 OD1 ASP A 118 -12.409 -7.060 0.885 1.00 0.00 O ATOM 1901 OD2 ASP A 118 -11.260 -8.101 2.439 1.00 0.00 O ATOM 0 H ASP A 118 -8.984 -7.715 -0.180 1.00 0.00 H new ATOM 0 HA ASP A 118 -10.874 -5.629 -0.553 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -9.298 -6.657 1.829 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -10.415 -5.314 1.970 1.00 0.00 H new ATOM 1906 N PHE A 119 -7.764 -4.610 -0.269 1.00 0.00 N ATOM 1907 CA PHE A 119 -6.902 -3.441 -0.502 1.00 0.00 C ATOM 1908 C PHE A 119 -7.203 -2.764 -1.852 1.00 0.00 C ATOM 1909 O PHE A 119 -7.427 -1.553 -1.897 1.00 0.00 O ATOM 1910 CB PHE A 119 -5.426 -3.853 -0.355 1.00 0.00 C ATOM 1911 CG PHE A 119 -4.407 -2.807 -0.762 1.00 0.00 C ATOM 1912 CD1 PHE A 119 -4.050 -2.661 -2.116 1.00 0.00 C ATOM 1913 CD2 PHE A 119 -3.795 -1.994 0.206 1.00 0.00 C ATOM 1914 CE1 PHE A 119 -3.129 -1.673 -2.501 1.00 0.00 C ATOM 1915 CE2 PHE A 119 -2.881 -1.003 -0.178 1.00 0.00 C ATOM 1916 CZ PHE A 119 -2.549 -0.835 -1.532 1.00 0.00 C ATOM 0 H PHE A 119 -7.250 -5.488 -0.203 1.00 0.00 H new ATOM 0 HA PHE A 119 -7.117 -2.685 0.254 1.00 0.00 H new ATOM 0 HB2 PHE A 119 -5.246 -4.124 0.685 1.00 0.00 H new ATOM 0 HB3 PHE A 119 -5.257 -4.749 -0.952 1.00 0.00 H new ATOM 0 HD1 PHE A 119 -4.486 -3.311 -2.861 1.00 0.00 H new ATOM 0 HD2 PHE A 119 -4.030 -2.133 1.251 1.00 0.00 H new ATOM 0 HE1 PHE A 119 -2.866 -1.557 -3.542 1.00 0.00 H new ATOM 0 HE2 PHE A 119 -2.431 -0.367 0.570 1.00 0.00 H new ATOM 0 HZ PHE A 119 -1.851 -0.066 -1.828 1.00 0.00 H new ATOM 1926 N ASN A 120 -7.269 -3.528 -2.949 1.00 0.00 N ATOM 1927 CA ASN A 120 -7.494 -2.953 -4.284 1.00 0.00 C ATOM 1928 C ASN A 120 -8.972 -2.676 -4.615 1.00 0.00 C ATOM 1929 O ASN A 120 -9.258 -1.800 -5.436 1.00 0.00 O ATOM 1930 CB ASN A 120 -6.776 -3.785 -5.365 1.00 0.00 C ATOM 1931 CG ASN A 120 -7.264 -5.215 -5.533 1.00 0.00 C ATOM 1932 OD1 ASN A 120 -6.610 -6.163 -5.136 1.00 0.00 O ATOM 1933 ND2 ASN A 120 -8.398 -5.433 -6.159 1.00 0.00 N ATOM 0 H ASN A 120 -7.170 -4.543 -2.941 1.00 0.00 H new ATOM 0 HA ASN A 120 -7.043 -1.961 -4.273 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -6.880 -3.271 -6.321 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -5.712 -3.810 -5.130 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -8.723 -6.388 -6.308 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -8.954 -4.647 -6.496 1.00 0.00 H new ATOM 1940 N VAL A 121 -9.923 -3.382 -3.994 1.00 0.00 N ATOM 1941 CA VAL A 121 -11.364 -3.131 -4.186 1.00 0.00 C ATOM 1942 C VAL A 121 -11.831 -1.914 -3.382 1.00 0.00 C ATOM 1943 O VAL A 121 -12.564 -1.085 -3.919 1.00 0.00 O ATOM 1944 CB VAL A 121 -12.201 -4.389 -3.872 1.00 0.00 C ATOM 1945 CG1 VAL A 121 -13.711 -4.117 -3.841 1.00 0.00 C ATOM 1946 CG2 VAL A 121 -11.968 -5.466 -4.941 1.00 0.00 C ATOM 0 H VAL A 121 -9.721 -4.142 -3.345 1.00 0.00 H new ATOM 0 HA VAL A 121 -11.523 -2.897 -5.239 1.00 0.00 H new ATOM 0 HB VAL A 121 -11.876 -4.716 -2.884 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -14.243 -5.041 -3.615 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -13.931 -3.375 -3.074 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -14.033 -3.741 -4.812 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -12.565 -6.347 -4.706 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -12.261 -5.079 -5.917 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -10.913 -5.737 -4.960 1.00 0.00 H new ATOM 1956 N SER A 122 -11.379 -1.742 -2.134 1.00 0.00 N ATOM 1957 CA SER A 122 -11.779 -0.587 -1.308 1.00 0.00 C ATOM 1958 C SER A 122 -11.299 0.757 -1.871 1.00 0.00 C ATOM 1959 O SER A 122 -11.990 1.765 -1.717 1.00 0.00 O ATOM 1960 CB SER A 122 -11.296 -0.746 0.134 1.00 0.00 C ATOM 1961 OG SER A 122 -9.887 -0.774 0.195 1.00 0.00 O ATOM 0 H SER A 122 -10.737 -2.385 -1.671 1.00 0.00 H new ATOM 0 HA SER A 122 -12.869 -0.574 -1.328 1.00 0.00 H new ATOM 0 HB2 SER A 122 -11.674 0.077 0.741 1.00 0.00 H new ATOM 0 HB3 SER A 122 -11.700 -1.665 0.557 1.00 0.00 H new ATOM 0 HG SER A 122 -9.573 -1.696 0.090 1.00 0.00 H new ATOM 1967 N LEU A 123 -10.167 0.771 -2.586 1.00 0.00 N ATOM 1968 CA LEU A 123 -9.688 1.932 -3.338 1.00 0.00 C ATOM 1969 C LEU A 123 -10.556 2.204 -4.579 1.00 0.00 C ATOM 1970 O LEU A 123 -11.090 3.305 -4.725 1.00 0.00 O ATOM 1971 CB LEU A 123 -8.208 1.726 -3.710 1.00 0.00 C ATOM 1972 CG LEU A 123 -7.215 1.851 -2.537 1.00 0.00 C ATOM 1973 CD1 LEU A 123 -5.822 1.416 -2.998 1.00 0.00 C ATOM 1974 CD2 LEU A 123 -7.110 3.290 -2.019 1.00 0.00 C ATOM 0 H LEU A 123 -9.550 -0.038 -2.658 1.00 0.00 H new ATOM 0 HA LEU A 123 -9.770 2.817 -2.707 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -8.096 0.738 -4.157 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -7.937 2.454 -4.474 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.586 1.215 -1.734 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -5.120 1.504 -2.169 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -5.857 0.380 -3.335 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -5.495 2.053 -3.820 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.399 3.329 -1.193 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -6.768 3.942 -2.823 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -8.088 3.624 -1.672 1.00 0.00 H new ATOM 1986 N GLN A 124 -10.756 1.218 -5.462 1.00 0.00 N ATOM 1987 CA GLN A 124 -11.478 1.445 -6.727 1.00 0.00 C ATOM 1988 C GLN A 124 -12.977 1.735 -6.527 1.00 0.00 C ATOM 1989 O GLN A 124 -13.548 2.551 -7.250 1.00 0.00 O ATOM 1990 CB GLN A 124 -11.217 0.292 -7.713 1.00 0.00 C ATOM 1991 CG GLN A 124 -12.053 -0.968 -7.469 1.00 0.00 C ATOM 1992 CD GLN A 124 -11.548 -2.148 -8.294 1.00 0.00 C ATOM 1993 OE1 GLN A 124 -12.153 -2.574 -9.268 1.00 0.00 O ATOM 1994 NE2 GLN A 124 -10.408 -2.710 -7.945 1.00 0.00 N ATOM 0 H GLN A 124 -10.432 0.260 -5.328 1.00 0.00 H new ATOM 0 HA GLN A 124 -11.077 2.357 -7.170 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -11.410 0.648 -8.725 1.00 0.00 H new ATOM 0 HB3 GLN A 124 -10.161 0.025 -7.665 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -12.024 -1.225 -6.410 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -13.095 -0.768 -7.720 1.00 0.00 H new ATOM 0 HE21 GLN A 124 -9.895 -2.363 -7.135 1.00 0.00 H new ATOM 0 HE22 GLN A 124 -10.039 -3.492 -8.485 1.00 0.00 H new ATOM 2003 N ASP A 125 -13.606 1.146 -5.505 1.00 0.00 N ATOM 2004 CA ASP A 125 -15.006 1.399 -5.145 1.00 0.00 C ATOM 2005 C ASP A 125 -15.167 2.651 -4.259 1.00 0.00 C ATOM 2006 O ASP A 125 -16.285 3.055 -3.941 1.00 0.00 O ATOM 2007 CB ASP A 125 -15.609 0.136 -4.507 1.00 0.00 C ATOM 2008 CG ASP A 125 -17.127 0.240 -4.259 1.00 0.00 C ATOM 2009 OD1 ASP A 125 -17.583 -0.099 -3.141 1.00 0.00 O ATOM 2010 OD2 ASP A 125 -17.876 0.650 -5.179 1.00 0.00 O ATOM 0 H ASP A 125 -13.150 0.469 -4.894 1.00 0.00 H new ATOM 0 HA ASP A 125 -15.565 1.621 -6.054 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -15.412 -0.719 -5.154 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -15.106 -0.059 -3.560 1.00 0.00 H new ATOM 2015 N HIS A 126 -14.067 3.324 -3.906 1.00 0.00 N ATOM 2016 CA HIS A 126 -14.101 4.684 -3.365 1.00 0.00 C ATOM 2017 C HIS A 126 -13.857 5.749 -4.438 1.00 0.00 C ATOM 2018 O HIS A 126 -14.460 6.818 -4.383 1.00 0.00 O ATOM 2019 CB HIS A 126 -13.112 4.797 -2.204 1.00 0.00 C ATOM 2020 CG HIS A 126 -13.129 6.162 -1.572 1.00 0.00 C ATOM 2021 ND1 HIS A 126 -14.164 6.680 -0.784 1.00 0.00 N ATOM 2022 CD2 HIS A 126 -12.142 7.094 -1.684 1.00 0.00 C ATOM 2023 CE1 HIS A 126 -13.761 7.909 -0.422 1.00 0.00 C ATOM 2024 NE2 HIS A 126 -12.559 8.183 -0.956 1.00 0.00 N ATOM 0 H HIS A 126 -13.126 2.939 -3.988 1.00 0.00 H new ATOM 0 HA HIS A 126 -15.105 4.877 -2.988 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -13.352 4.047 -1.450 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -12.107 4.578 -2.563 1.00 0.00 H new ATOM 0 HD1 HIS A 126 -15.040 6.220 -0.537 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -11.218 6.997 -2.234 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -14.323 8.582 0.209 1.00 0.00 H new ATOM 2032 N PHE A 127 -13.032 5.455 -5.448 1.00 0.00 N ATOM 2033 CA PHE A 127 -12.692 6.388 -6.529 1.00 0.00 C ATOM 2034 C PHE A 127 -13.567 6.293 -7.790 1.00 0.00 C ATOM 2035 O PHE A 127 -13.384 7.127 -8.676 1.00 0.00 O ATOM 2036 CB PHE A 127 -11.198 6.246 -6.871 1.00 0.00 C ATOM 2037 CG PHE A 127 -10.241 6.922 -5.904 1.00 0.00 C ATOM 2038 CD1 PHE A 127 -10.218 8.326 -5.807 1.00 0.00 C ATOM 2039 CD2 PHE A 127 -9.307 6.163 -5.176 1.00 0.00 C ATOM 2040 CE1 PHE A 127 -9.243 8.967 -5.021 1.00 0.00 C ATOM 2041 CE2 PHE A 127 -8.314 6.800 -4.414 1.00 0.00 C ATOM 2042 CZ PHE A 127 -8.277 8.203 -4.342 1.00 0.00 C ATOM 0 H PHE A 127 -12.574 4.548 -5.540 1.00 0.00 H new ATOM 0 HA PHE A 127 -12.907 7.385 -6.143 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -10.952 5.185 -6.917 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -11.030 6.655 -7.867 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -10.952 8.914 -6.338 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -9.354 5.084 -5.203 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -9.236 10.044 -4.939 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -7.579 6.212 -3.884 1.00 0.00 H new ATOM 0 HZ PHE A 127 -7.507 8.694 -3.766 1.00 0.00 H new ATOM 2052 N LYS A 128 -14.533 5.365 -7.909 1.00 0.00 N ATOM 2053 CA LYS A 128 -15.313 5.201 -9.162 1.00 0.00 C ATOM 2054 C LYS A 128 -16.003 6.477 -9.667 1.00 0.00 C ATOM 2055 O LYS A 128 -16.130 6.668 -10.875 1.00 0.00 O ATOM 2056 CB LYS A 128 -16.295 4.011 -9.107 1.00 0.00 C ATOM 2057 CG LYS A 128 -17.597 4.210 -8.307 1.00 0.00 C ATOM 2058 CD LYS A 128 -17.448 3.838 -6.832 1.00 0.00 C ATOM 2059 CE LYS A 128 -18.756 4.110 -6.084 1.00 0.00 C ATOM 2060 NZ LYS A 128 -18.866 3.261 -4.872 1.00 0.00 N ATOM 0 H LYS A 128 -14.795 4.720 -7.164 1.00 0.00 H new ATOM 0 HA LYS A 128 -14.553 4.970 -9.909 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -16.564 3.747 -10.130 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -15.767 3.156 -8.685 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -17.910 5.251 -8.385 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -18.387 3.605 -8.752 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -17.180 2.785 -6.740 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -16.638 4.414 -6.384 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -18.804 5.161 -5.801 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -19.602 3.918 -6.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -19.719 3.525 -4.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -18.929 2.262 -5.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -18.027 3.400 -4.273 1.00 0.00 H new ATOM 2074 N TRP A 129 -16.406 7.370 -8.757 1.00 0.00 N ATOM 2075 CA TRP A 129 -17.040 8.661 -9.073 1.00 0.00 C ATOM 2076 C TRP A 129 -16.038 9.765 -9.460 1.00 0.00 C ATOM 2077 O TRP A 129 -16.410 10.730 -10.130 1.00 0.00 O ATOM 2078 CB TRP A 129 -17.905 9.103 -7.887 1.00 0.00 C ATOM 2079 CG TRP A 129 -17.147 9.470 -6.645 1.00 0.00 C ATOM 2080 CD1 TRP A 129 -16.618 8.593 -5.762 1.00 0.00 C ATOM 2081 CD2 TRP A 129 -16.817 10.799 -6.127 1.00 0.00 C ATOM 2082 NE1 TRP A 129 -15.950 9.278 -4.769 1.00 0.00 N ATOM 2083 CE2 TRP A 129 -16.078 10.642 -4.915 1.00 0.00 C ATOM 2084 CE3 TRP A 129 -17.071 12.122 -6.553 1.00 0.00 C ATOM 2085 CZ2 TRP A 129 -15.638 11.733 -4.152 1.00 0.00 C ATOM 2086 CZ3 TRP A 129 -16.643 13.226 -5.790 1.00 0.00 C ATOM 2087 CH2 TRP A 129 -15.940 13.035 -4.586 1.00 0.00 C ATOM 0 H TRP A 129 -16.299 7.214 -7.755 1.00 0.00 H new ATOM 0 HA TRP A 129 -17.660 8.507 -9.956 1.00 0.00 H new ATOM 0 HB2 TRP A 129 -18.504 9.960 -8.194 1.00 0.00 H new ATOM 0 HB3 TRP A 129 -18.600 8.299 -7.645 1.00 0.00 H new ATOM 0 HD1 TRP A 129 -16.705 7.518 -5.825 1.00 0.00 H new ATOM 0 HE1 TRP A 129 -15.425 8.830 -4.018 1.00 0.00 H new ATOM 0 HE3 TRP A 129 -17.602 12.290 -7.479 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 -15.075 11.575 -3.244 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 -16.856 14.228 -6.132 1.00 0.00 H new ATOM 0 HH2 TRP A 129 -15.633 13.887 -3.997 1.00 0.00 H new ATOM 2098 N VAL A 130 -14.764 9.609 -9.085 1.00 0.00 N ATOM 2099 CA VAL A 130 -13.637 10.453 -9.528 1.00 0.00 C ATOM 2100 C VAL A 130 -13.099 9.960 -10.882 1.00 0.00 C ATOM 2101 O VAL A 130 -12.751 10.762 -11.750 1.00 0.00 O ATOM 2102 CB VAL A 130 -12.523 10.482 -8.458 1.00 0.00 C ATOM 2103 CG1 VAL A 130 -11.385 11.441 -8.831 1.00 0.00 C ATOM 2104 CG2 VAL A 130 -13.064 10.926 -7.089 1.00 0.00 C ATOM 0 H VAL A 130 -14.474 8.870 -8.445 1.00 0.00 H new ATOM 0 HA VAL A 130 -13.996 11.474 -9.659 1.00 0.00 H new ATOM 0 HB VAL A 130 -12.145 9.461 -8.406 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -10.626 11.427 -8.049 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -10.939 11.127 -9.775 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -11.780 12.452 -8.935 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -12.252 10.934 -6.362 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -13.487 11.927 -7.172 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -13.838 10.232 -6.761 1.00 0.00 H new ATOM 2114 N LYS A 131 -13.094 8.637 -11.095 1.00 0.00 N ATOM 2115 CA LYS A 131 -12.596 7.922 -12.281 1.00 0.00 C ATOM 2116 C LYS A 131 -13.720 7.670 -13.305 1.00 0.00 C ATOM 2117 O LYS A 131 -13.889 6.569 -13.828 1.00 0.00 O ATOM 2118 CB LYS A 131 -11.840 6.666 -11.787 1.00 0.00 C ATOM 2119 CG LYS A 131 -11.029 5.876 -12.832 1.00 0.00 C ATOM 2120 CD LYS A 131 -10.046 6.731 -13.642 1.00 0.00 C ATOM 2121 CE LYS A 131 -9.253 5.824 -14.589 1.00 0.00 C ATOM 2122 NZ LYS A 131 -8.338 6.605 -15.456 1.00 0.00 N ATOM 0 H LYS A 131 -13.463 7.993 -10.396 1.00 0.00 H new ATOM 0 HA LYS A 131 -11.885 8.523 -12.847 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -11.160 6.972 -10.992 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -12.567 5.988 -11.341 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -10.474 5.087 -12.324 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -11.720 5.388 -13.519 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -10.586 7.488 -14.211 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -9.368 7.260 -12.972 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -8.677 5.104 -14.007 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -9.944 5.253 -15.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -7.868 5.966 -16.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -8.882 7.321 -15.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -7.621 7.077 -14.868 1.00 0.00 H new ATOM 2136 N GLN A 132 -14.523 8.703 -13.568 1.00 0.00 N ATOM 2137 CA GLN A 132 -15.620 8.679 -14.537 1.00 0.00 C ATOM 2138 C GLN A 132 -15.101 8.964 -15.955 1.00 0.00 C ATOM 2139 O GLN A 132 -14.951 10.115 -16.375 1.00 0.00 O ATOM 2140 CB GLN A 132 -16.724 9.670 -14.140 1.00 0.00 C ATOM 2141 CG GLN A 132 -17.562 9.212 -12.938 1.00 0.00 C ATOM 2142 CD GLN A 132 -18.484 8.042 -13.280 1.00 0.00 C ATOM 2143 OE1 GLN A 132 -19.495 8.185 -13.955 1.00 0.00 O ATOM 2144 NE2 GLN A 132 -18.173 6.839 -12.846 1.00 0.00 N ATOM 0 H GLN A 132 -14.425 9.604 -13.100 1.00 0.00 H new ATOM 0 HA GLN A 132 -16.055 7.679 -14.534 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -16.269 10.633 -13.909 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -17.384 9.826 -14.993 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -16.897 8.921 -12.125 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -18.160 10.048 -12.576 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -17.334 6.701 -12.282 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -18.771 6.044 -13.073 1.00 0.00 H new ATOM 2153 N GLU A 133 -14.836 7.884 -16.688 1.00 0.00 N ATOM 2154 CA GLU A 133 -14.405 7.852 -18.103 1.00 0.00 C ATOM 2155 C GLU A 133 -15.123 6.753 -18.911 1.00 0.00 C ATOM 2156 O GLU A 133 -15.213 5.600 -18.427 1.00 0.00 O ATOM 2157 CB GLU A 133 -12.878 7.681 -18.205 1.00 0.00 C ATOM 2158 CG GLU A 133 -12.089 8.897 -17.692 1.00 0.00 C ATOM 2159 CD GLU A 133 -10.581 8.753 -17.990 1.00 0.00 C ATOM 2160 OE1 GLU A 133 -9.839 8.209 -17.134 1.00 0.00 O ATOM 2161 OE2 GLU A 133 -10.119 9.189 -19.074 1.00 0.00 O ATOM 2162 OXT GLU A 133 -15.607 7.058 -20.024 1.00 0.00 O ATOM 0 H GLU A 133 -14.918 6.946 -16.295 1.00 0.00 H new ATOM 0 HA GLU A 133 -14.685 8.810 -18.540 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -12.580 6.799 -17.638 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -12.610 7.496 -19.245 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -12.470 9.804 -18.161 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -12.241 9.005 -16.618 1.00 0.00 H new TER 2169 GLU A 133