USER MOD reduce.3.24.130724 H: found=0, std=0, add=1296, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1286 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 74 MET CE :methyl -167:sc=-0.00154 (180deg=-0.0315) USER MOD Set 1.2: B 74 MET CE :methyl -167:sc= 0 (180deg=-0.0305) USER MOD Single : A 1 SER N :NH3+ -142:sc= 0.58 (180deg=-0.781!) USER MOD Single : A 1 SER OG : rot 177:sc= 0.0199 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 HIS : no HD1:sc= -0.178 K(o=-0.18,f=-0.74) USER MOD Single : A 16 GLN : amide:sc= -0.754 K(o=-0.75,f=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 70:sc= 1.15 USER MOD Single : A 24 LYS NZ :NH3+ 151:sc= -0.123 (180deg=-0.67) USER MOD Single : A 25 HIS : no HD1:sc=-0.00445 X(o=-0.0045,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -142:sc= 0.881 (180deg=-2.06!) USER MOD Single : A 29 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.619) USER MOD Single : A 30 SER OG : rot 180:sc= -0.0622 USER MOD Single : A 33 LYS NZ :NH3+ 152:sc= -0.0696 (180deg=-0.563) USER MOD Single : A 37 ASN : amide:sc= -0.0497 K(o=-0.05,f=-2.5!) USER MOD Single : A 38 ASN : amide:sc= -0.98 K(o=-0.98,f=-6.4!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= -0.0188 X(o=-0.019,f=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= -3.55! K(o=-3.6!,f=-1.7) USER MOD Single : A 55 LYS NZ :NH3+ -150:sc= 0.425 (180deg=-0.194) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 81:sc= 0.832 USER MOD Single : A 68 CYS SG : rot 29:sc= -0.0917 USER MOD Single : A 71 GLN : amide:sc= -0.0326 K(o=-0.033,f=-1.1) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 91:sc= 1.24 USER MOD Single : A 82 THR OG1 : rot 2:sc= -0.0463 USER MOD Single : B 1 SER N :NH3+ -142:sc= 0.596 (180deg=-0.582!) USER MOD Single : B 1 SER OG : rot 176:sc= 0.0184 USER MOD Single : B 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 15 HIS : no HD1:sc= -0.17 K(o=-0.17,f=-0.74) USER MOD Single : B 16 GLN : amide:sc= -0.782 K(o=-0.78,f=0) USER MOD Single : B 17 TYR OH : rot 180:sc= 0 USER MOD Single : B 18 SER OG : rot 75:sc= 1.1 USER MOD Single : B 24 LYS NZ :NH3+ 151:sc= -0.128 (180deg=-0.671) USER MOD Single : B 25 HIS : no HD1:sc=-0.00909 X(o=-0.0091,f=0) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ -144:sc= 0.833 (180deg=-2.19!) USER MOD Single : B 29 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.5) USER MOD Single : B 30 SER OG : rot 180:sc= -0.0925 USER MOD Single : B 33 LYS NZ :NH3+ 152:sc= -0.0774 (180deg=-0.554) USER MOD Single : B 37 ASN : amide:sc= -0.0537 K(o=-0.054,f=-2.5!) USER MOD Single : B 38 ASN : amide:sc= -0.961 K(o=-0.96,f=-6.4!) USER MOD Single : B 41 SER OG : rot 180:sc=-0.000887 USER MOD Single : B 42 HIS : no HD1:sc= -0.013 X(o=-0.013,f=-0.0011) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 GLN : amide:sc= -2.89! K(o=-2.9!,f=-1.7) USER MOD Single : B 55 LYS NZ :NH3+ -151:sc= 0.425 (180deg=-0.219) USER MOD Single : B 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 59 THR OG1 : rot 89:sc= 0.908 USER MOD Single : B 68 CYS SG : rot 34:sc= -0.106 USER MOD Single : B 71 GLN : amide:sc= -0.0329 K(o=-0.033,f=-1.1) USER MOD Single : B 78 SER OG : rot 180:sc= 0 USER MOD Single : B 79 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 81 THR OG1 : rot 82:sc= 1.21 USER MOD Single : B 82 THR OG1 : rot -77:sc= 0.141 USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 1 -10.334 4.803 12.434 1.00 0.00 N ATOM 21 CA SER A 1 -10.450 3.320 12.472 1.00 0.00 C ATOM 22 C SER A 1 -9.062 2.715 12.676 1.00 0.00 C ATOM 23 O SER A 1 -8.064 3.408 12.653 1.00 0.00 O ATOM 24 CB SER A 1 -11.044 2.814 11.158 1.00 0.00 C ATOM 25 OG SER A 1 -10.042 2.839 10.151 1.00 0.00 O ATOM 0 H1 SER A 1 -11.149 5.228 12.921 1.00 0.00 H new ATOM 0 H2 SER A 1 -9.456 5.095 12.909 1.00 0.00 H new ATOM 0 H3 SER A 1 -10.316 5.125 11.445 1.00 0.00 H new ATOM 0 HA SER A 1 -11.103 3.026 13.293 1.00 0.00 H new ATOM 0 HB2 SER A 1 -11.425 1.800 11.284 1.00 0.00 H new ATOM 0 HB3 SER A 1 -11.888 3.437 10.863 1.00 0.00 H new ATOM 0 HG SER A 1 -10.403 2.463 9.321 1.00 0.00 H new ATOM 31 N GLU A 2 -8.987 1.430 12.882 1.00 0.00 N ATOM 32 CA GLU A 2 -7.658 0.792 13.096 1.00 0.00 C ATOM 33 C GLU A 2 -6.797 0.966 11.844 1.00 0.00 C ATOM 34 O GLU A 2 -5.596 1.136 11.923 1.00 0.00 O ATOM 35 CB GLU A 2 -7.850 -0.699 13.381 1.00 0.00 C ATOM 36 CG GLU A 2 -8.509 -0.875 14.751 1.00 0.00 C ATOM 37 CD GLU A 2 -7.486 -0.583 15.851 1.00 0.00 C ATOM 38 OE1 GLU A 2 -6.489 -1.284 15.907 1.00 0.00 O ATOM 39 OE2 GLU A 2 -7.718 0.336 16.619 1.00 0.00 O ATOM 0 H GLU A 2 -9.785 0.796 12.911 1.00 0.00 H new ATOM 0 HA GLU A 2 -7.161 1.264 13.944 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -8.469 -1.152 12.607 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -6.888 -1.211 13.360 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -9.362 -0.203 14.845 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -8.891 -1.891 14.855 1.00 0.00 H new ATOM 46 N LEU A 3 -7.401 0.917 10.687 1.00 0.00 N ATOM 47 CA LEU A 3 -6.618 1.070 9.428 1.00 0.00 C ATOM 48 C LEU A 3 -6.033 2.486 9.355 1.00 0.00 C ATOM 49 O LEU A 3 -4.868 2.669 9.064 1.00 0.00 O ATOM 50 CB LEU A 3 -7.541 0.809 8.219 1.00 0.00 C ATOM 51 CG LEU A 3 -6.747 0.189 7.062 1.00 0.00 C ATOM 52 CD1 LEU A 3 -7.686 -0.060 5.880 1.00 0.00 C ATOM 53 CD2 LEU A 3 -5.626 1.143 6.632 1.00 0.00 C ATOM 0 H LEU A 3 -8.403 0.778 10.560 1.00 0.00 H new ATOM 0 HA LEU A 3 -5.799 0.351 9.413 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -8.352 0.142 8.510 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -7.998 1.744 7.894 1.00 0.00 H new ATOM 0 HG LEU A 3 -6.310 -0.755 7.388 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -7.125 -0.501 5.056 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -8.480 -0.742 6.184 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -8.123 0.885 5.557 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -5.065 0.698 5.810 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -6.058 2.089 6.306 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -4.957 1.321 7.474 1.00 0.00 H new ATOM 65 N GLU A 4 -6.822 3.491 9.628 1.00 0.00 N ATOM 66 CA GLU A 4 -6.286 4.879 9.580 1.00 0.00 C ATOM 67 C GLU A 4 -5.043 4.956 10.466 1.00 0.00 C ATOM 68 O GLU A 4 -4.012 5.465 10.075 1.00 0.00 O ATOM 69 CB GLU A 4 -7.348 5.857 10.090 1.00 0.00 C ATOM 70 CG GLU A 4 -8.431 6.033 9.022 1.00 0.00 C ATOM 71 CD GLU A 4 -9.612 6.807 9.610 1.00 0.00 C ATOM 72 OE1 GLU A 4 -10.218 6.306 10.543 1.00 0.00 O ATOM 73 OE2 GLU A 4 -9.891 7.887 9.117 1.00 0.00 O ATOM 0 H GLU A 4 -7.807 3.411 9.880 1.00 0.00 H new ATOM 0 HA GLU A 4 -6.025 5.143 8.555 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.790 5.483 11.013 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -6.891 6.819 10.322 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -8.025 6.567 8.163 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -8.764 5.059 8.664 1.00 0.00 H new ATOM 80 N LYS A 5 -5.139 4.433 11.657 1.00 0.00 N ATOM 81 CA LYS A 5 -3.975 4.445 12.584 1.00 0.00 C ATOM 82 C LYS A 5 -2.737 3.924 11.855 1.00 0.00 C ATOM 83 O LYS A 5 -1.642 4.423 12.017 1.00 0.00 O ATOM 84 CB LYS A 5 -4.270 3.513 13.764 1.00 0.00 C ATOM 85 CG LYS A 5 -3.221 3.731 14.863 1.00 0.00 C ATOM 86 CD LYS A 5 -3.213 2.535 15.817 1.00 0.00 C ATOM 87 CE LYS A 5 -4.616 2.326 16.389 1.00 0.00 C ATOM 88 NZ LYS A 5 -4.544 1.396 17.551 1.00 0.00 N ATOM 0 H LYS A 5 -5.981 3.995 12.030 1.00 0.00 H new ATOM 0 HA LYS A 5 -3.800 5.462 12.935 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -5.268 3.709 14.155 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -4.255 2.474 13.433 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -2.235 3.858 14.417 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -3.442 4.645 15.413 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -2.887 1.638 15.290 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -2.502 2.706 16.625 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -5.040 3.281 16.699 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -5.276 1.918 15.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -5.498 1.253 17.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -4.156 0.482 17.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -3.928 1.803 18.284 1.00 0.00 H new ATOM 102 N ALA A 6 -2.921 2.906 11.057 1.00 0.00 N ATOM 103 CA ALA A 6 -1.787 2.303 10.301 1.00 0.00 C ATOM 104 C ALA A 6 -1.390 3.193 9.120 1.00 0.00 C ATOM 105 O ALA A 6 -0.249 3.193 8.701 1.00 0.00 O ATOM 106 CB ALA A 6 -2.199 0.916 9.789 1.00 0.00 C ATOM 0 H ALA A 6 -3.824 2.461 10.895 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.929 2.211 10.967 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -1.372 0.472 9.235 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -2.454 0.277 10.634 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.064 1.013 9.133 1.00 0.00 H new ATOM 112 N MET A 7 -2.289 3.972 8.591 1.00 0.00 N ATOM 113 CA MET A 7 -1.896 4.863 7.464 1.00 0.00 C ATOM 114 C MET A 7 -0.931 5.925 8.015 1.00 0.00 C ATOM 115 O MET A 7 0.150 6.134 7.491 1.00 0.00 O ATOM 116 CB MET A 7 -3.156 5.537 6.876 1.00 0.00 C ATOM 117 CG MET A 7 -3.702 4.724 5.685 1.00 0.00 C ATOM 118 SD MET A 7 -2.936 5.322 4.150 1.00 0.00 S ATOM 119 CE MET A 7 -2.197 3.763 3.599 1.00 0.00 C ATOM 0 H MET A 7 -3.264 4.032 8.883 1.00 0.00 H new ATOM 0 HA MET A 7 -1.409 4.293 6.672 1.00 0.00 H new ATOM 0 HB2 MET A 7 -3.922 5.622 7.647 1.00 0.00 H new ATOM 0 HB3 MET A 7 -2.916 6.550 6.552 1.00 0.00 H new ATOM 0 HG2 MET A 7 -3.487 3.664 5.824 1.00 0.00 H new ATOM 0 HG3 MET A 7 -4.786 4.824 5.627 1.00 0.00 H new ATOM 0 HE1 MET A 7 -1.672 3.922 2.657 1.00 0.00 H new ATOM 0 HE2 MET A 7 -1.492 3.408 4.351 1.00 0.00 H new ATOM 0 HE3 MET A 7 -2.981 3.019 3.457 1.00 0.00 H new ATOM 129 N VAL A 8 -1.307 6.585 9.079 1.00 0.00 N ATOM 130 CA VAL A 8 -0.411 7.621 9.663 1.00 0.00 C ATOM 131 C VAL A 8 0.850 6.942 10.207 1.00 0.00 C ATOM 132 O VAL A 8 1.943 7.459 10.093 1.00 0.00 O ATOM 133 CB VAL A 8 -1.143 8.358 10.796 1.00 0.00 C ATOM 134 CG1 VAL A 8 -0.505 9.734 11.022 1.00 0.00 C ATOM 135 CG2 VAL A 8 -2.616 8.539 10.414 1.00 0.00 C ATOM 0 H VAL A 8 -2.193 6.451 9.566 1.00 0.00 H new ATOM 0 HA VAL A 8 -0.132 8.344 8.896 1.00 0.00 H new ATOM 0 HB VAL A 8 -1.068 7.773 11.712 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -1.029 10.250 11.826 1.00 0.00 H new ATOM 0 HG12 VAL A 8 0.543 9.609 11.293 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.575 10.322 10.107 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -3.138 9.061 11.216 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -2.685 9.122 9.496 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -3.074 7.562 10.259 1.00 0.00 H new ATOM 145 N ALA A 9 0.707 5.781 10.788 1.00 0.00 N ATOM 146 CA ALA A 9 1.899 5.067 11.324 1.00 0.00 C ATOM 147 C ALA A 9 2.889 4.830 10.183 1.00 0.00 C ATOM 148 O ALA A 9 4.068 5.082 10.309 1.00 0.00 O ATOM 149 CB ALA A 9 1.465 3.719 11.906 1.00 0.00 C ATOM 0 H ALA A 9 -0.182 5.298 10.914 1.00 0.00 H new ATOM 0 HA ALA A 9 2.368 5.665 12.105 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.336 3.195 12.299 1.00 0.00 H new ATOM 0 HB2 ALA A 9 0.748 3.884 12.710 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.002 3.117 11.124 1.00 0.00 H new ATOM 155 N LEU A 10 2.417 4.331 9.074 1.00 0.00 N ATOM 156 CA LEU A 10 3.332 4.058 7.925 1.00 0.00 C ATOM 157 C LEU A 10 4.265 5.256 7.729 1.00 0.00 C ATOM 158 O LEU A 10 5.446 5.104 7.490 1.00 0.00 O ATOM 159 CB LEU A 10 2.478 3.843 6.652 1.00 0.00 C ATOM 160 CG LEU A 10 2.158 2.340 6.469 1.00 0.00 C ATOM 161 CD1 LEU A 10 0.889 2.173 5.630 1.00 0.00 C ATOM 162 CD2 LEU A 10 3.321 1.638 5.753 1.00 0.00 C ATOM 0 H LEU A 10 1.437 4.100 8.912 1.00 0.00 H new ATOM 0 HA LEU A 10 3.930 3.168 8.120 1.00 0.00 H new ATOM 0 HB2 LEU A 10 1.552 4.413 6.726 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.013 4.217 5.779 1.00 0.00 H new ATOM 0 HG LEU A 10 2.010 1.895 7.453 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.672 1.112 5.506 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.053 2.658 6.134 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.037 2.629 4.651 1.00 0.00 H new ATOM 0 HD21 LEU A 10 3.087 0.581 5.629 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.474 2.093 4.775 1.00 0.00 H new ATOM 0 HD23 LEU A 10 4.229 1.741 6.347 1.00 0.00 H new ATOM 174 N ILE A 11 3.747 6.450 7.854 1.00 0.00 N ATOM 175 CA ILE A 11 4.626 7.643 7.699 1.00 0.00 C ATOM 176 C ILE A 11 5.648 7.618 8.844 1.00 0.00 C ATOM 177 O ILE A 11 6.806 7.941 8.672 1.00 0.00 O ATOM 178 CB ILE A 11 3.779 8.934 7.760 1.00 0.00 C ATOM 179 CG1 ILE A 11 3.086 9.170 6.408 1.00 0.00 C ATOM 180 CG2 ILE A 11 4.673 10.142 8.070 1.00 0.00 C ATOM 181 CD1 ILE A 11 1.968 8.147 6.203 1.00 0.00 C ATOM 0 H ILE A 11 2.767 6.648 8.054 1.00 0.00 H new ATOM 0 HA ILE A 11 5.137 7.623 6.736 1.00 0.00 H new ATOM 0 HB ILE A 11 3.033 8.819 8.546 1.00 0.00 H new ATOM 0 HG12 ILE A 11 2.676 10.179 6.372 1.00 0.00 H new ATOM 0 HG13 ILE A 11 3.813 9.092 5.600 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.064 11.045 8.110 1.00 0.00 H new ATOM 0 HG22 ILE A 11 5.165 9.993 9.031 1.00 0.00 H new ATOM 0 HG23 ILE A 11 5.426 10.247 7.289 1.00 0.00 H new ATOM 0 HD11 ILE A 11 1.484 8.324 5.242 1.00 0.00 H new ATOM 0 HD12 ILE A 11 2.388 7.141 6.218 1.00 0.00 H new ATOM 0 HD13 ILE A 11 1.234 8.246 7.002 1.00 0.00 H new ATOM 193 N ASP A 12 5.210 7.228 10.013 1.00 0.00 N ATOM 194 CA ASP A 12 6.124 7.160 11.188 1.00 0.00 C ATOM 195 C ASP A 12 7.376 6.361 10.834 1.00 0.00 C ATOM 196 O ASP A 12 8.491 6.808 11.017 1.00 0.00 O ATOM 197 CB ASP A 12 5.400 6.444 12.341 1.00 0.00 C ATOM 198 CG ASP A 12 6.113 6.745 13.664 1.00 0.00 C ATOM 199 OD1 ASP A 12 5.845 7.790 14.233 1.00 0.00 O ATOM 200 OD2 ASP A 12 6.914 5.926 14.083 1.00 0.00 O ATOM 0 H ASP A 12 4.247 6.951 10.204 1.00 0.00 H new ATOM 0 HA ASP A 12 6.407 8.172 11.478 1.00 0.00 H new ATOM 0 HB2 ASP A 12 4.362 6.774 12.393 1.00 0.00 H new ATOM 0 HB3 ASP A 12 5.384 5.369 12.162 1.00 0.00 H new ATOM 205 N VAL A 13 7.188 5.159 10.355 1.00 0.00 N ATOM 206 CA VAL A 13 8.351 4.291 10.016 1.00 0.00 C ATOM 207 C VAL A 13 9.030 4.755 8.724 1.00 0.00 C ATOM 208 O VAL A 13 10.241 4.725 8.627 1.00 0.00 O ATOM 209 CB VAL A 13 7.887 2.841 9.875 1.00 0.00 C ATOM 210 CG1 VAL A 13 9.074 1.957 9.484 1.00 0.00 C ATOM 211 CG2 VAL A 13 7.309 2.359 11.207 1.00 0.00 C ATOM 0 H VAL A 13 6.274 4.741 10.184 1.00 0.00 H new ATOM 0 HA VAL A 13 9.080 4.363 10.823 1.00 0.00 H new ATOM 0 HB VAL A 13 7.121 2.780 9.102 1.00 0.00 H new ATOM 0 HG11 VAL A 13 8.741 0.924 9.384 1.00 0.00 H new ATOM 0 HG12 VAL A 13 9.485 2.299 8.534 1.00 0.00 H new ATOM 0 HG13 VAL A 13 9.842 2.018 10.255 1.00 0.00 H new ATOM 0 HG21 VAL A 13 6.978 1.325 11.107 1.00 0.00 H new ATOM 0 HG22 VAL A 13 8.075 2.422 11.980 1.00 0.00 H new ATOM 0 HG23 VAL A 13 6.462 2.986 11.484 1.00 0.00 H new ATOM 221 N PHE A 14 8.305 5.178 7.730 1.00 0.00 N ATOM 222 CA PHE A 14 9.007 5.616 6.490 1.00 0.00 C ATOM 223 C PHE A 14 9.903 6.807 6.829 1.00 0.00 C ATOM 224 O PHE A 14 10.964 6.988 6.263 1.00 0.00 O ATOM 225 CB PHE A 14 8.004 6.023 5.411 1.00 0.00 C ATOM 226 CG PHE A 14 8.756 6.362 4.145 1.00 0.00 C ATOM 227 CD1 PHE A 14 9.028 5.361 3.203 1.00 0.00 C ATOM 228 CD2 PHE A 14 9.190 7.675 3.915 1.00 0.00 C ATOM 229 CE1 PHE A 14 9.732 5.673 2.033 1.00 0.00 C ATOM 230 CE2 PHE A 14 9.893 7.986 2.743 1.00 0.00 C ATOM 231 CZ PHE A 14 10.163 6.984 1.803 1.00 0.00 C ATOM 0 H PHE A 14 7.287 5.240 7.717 1.00 0.00 H new ATOM 0 HA PHE A 14 9.603 4.788 6.107 1.00 0.00 H new ATOM 0 HB2 PHE A 14 7.300 5.212 5.225 1.00 0.00 H new ATOM 0 HB3 PHE A 14 7.420 6.881 5.744 1.00 0.00 H new ATOM 0 HD1 PHE A 14 8.695 4.349 3.379 1.00 0.00 H new ATOM 0 HD2 PHE A 14 8.983 8.447 4.641 1.00 0.00 H new ATOM 0 HE1 PHE A 14 9.942 4.901 1.308 1.00 0.00 H new ATOM 0 HE2 PHE A 14 10.226 8.998 2.565 1.00 0.00 H new ATOM 0 HZ PHE A 14 10.704 7.223 0.900 1.00 0.00 H new ATOM 241 N HIS A 15 9.473 7.625 7.753 1.00 0.00 N ATOM 242 CA HIS A 15 10.278 8.815 8.143 1.00 0.00 C ATOM 243 C HIS A 15 11.389 8.404 9.115 1.00 0.00 C ATOM 244 O HIS A 15 12.453 8.991 9.142 1.00 0.00 O ATOM 245 CB HIS A 15 9.367 9.842 8.818 1.00 0.00 C ATOM 246 CG HIS A 15 10.133 11.111 9.064 1.00 0.00 C ATOM 247 ND1 HIS A 15 10.081 11.781 10.276 1.00 0.00 N ATOM 248 CD2 HIS A 15 10.971 11.848 8.264 1.00 0.00 C ATOM 249 CE1 HIS A 15 10.866 12.868 10.173 1.00 0.00 C ATOM 250 NE2 HIS A 15 11.433 12.957 8.967 1.00 0.00 N ATOM 0 H HIS A 15 8.592 7.517 8.256 1.00 0.00 H new ATOM 0 HA HIS A 15 10.729 9.250 7.251 1.00 0.00 H new ATOM 0 HB2 HIS A 15 8.501 10.045 8.188 1.00 0.00 H new ATOM 0 HB3 HIS A 15 8.990 9.445 9.760 1.00 0.00 H new ATOM 0 HD2 HIS A 15 11.232 11.604 7.245 1.00 0.00 H new ATOM 0 HE1 HIS A 15 11.019 13.582 10.969 1.00 0.00 H new ATOM 0 HE2 HIS A 15 12.068 13.682 8.633 1.00 0.00 H new ATOM 258 N GLN A 16 11.137 7.414 9.931 1.00 0.00 N ATOM 259 CA GLN A 16 12.166 6.981 10.922 1.00 0.00 C ATOM 260 C GLN A 16 13.477 6.661 10.205 1.00 0.00 C ATOM 261 O GLN A 16 14.536 7.086 10.622 1.00 0.00 O ATOM 262 CB GLN A 16 11.670 5.742 11.670 1.00 0.00 C ATOM 263 CG GLN A 16 12.682 5.355 12.751 1.00 0.00 C ATOM 264 CD GLN A 16 12.053 4.324 13.689 1.00 0.00 C ATOM 265 OE1 GLN A 16 12.476 4.174 14.818 1.00 0.00 O ATOM 266 NE2 GLN A 16 11.051 3.603 13.265 1.00 0.00 N ATOM 0 H GLN A 16 10.264 6.887 9.954 1.00 0.00 H new ATOM 0 HA GLN A 16 12.338 7.788 11.635 1.00 0.00 H new ATOM 0 HB2 GLN A 16 10.699 5.942 12.122 1.00 0.00 H new ATOM 0 HB3 GLN A 16 11.533 4.915 10.973 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.582 4.945 12.292 1.00 0.00 H new ATOM 0 HG3 GLN A 16 12.985 6.238 13.314 1.00 0.00 H new ATOM 0 HE21 GLN A 16 10.697 3.730 12.317 1.00 0.00 H new ATOM 0 HE22 GLN A 16 10.622 2.913 13.882 1.00 0.00 H new ATOM 275 N TYR A 17 13.426 5.923 9.130 1.00 0.00 N ATOM 276 CA TYR A 17 14.681 5.596 8.403 1.00 0.00 C ATOM 277 C TYR A 17 15.204 6.865 7.730 1.00 0.00 C ATOM 278 O TYR A 17 16.363 7.211 7.847 1.00 0.00 O ATOM 279 CB TYR A 17 14.398 4.528 7.337 1.00 0.00 C ATOM 280 CG TYR A 17 14.308 3.163 7.987 1.00 0.00 C ATOM 281 CD1 TYR A 17 13.278 2.890 8.896 1.00 0.00 C ATOM 282 CD2 TYR A 17 15.249 2.170 7.680 1.00 0.00 C ATOM 283 CE1 TYR A 17 13.189 1.628 9.497 1.00 0.00 C ATOM 284 CE2 TYR A 17 15.159 0.908 8.280 1.00 0.00 C ATOM 285 CZ TYR A 17 14.129 0.637 9.189 1.00 0.00 C ATOM 286 OH TYR A 17 14.039 -0.606 9.780 1.00 0.00 O ATOM 0 H TYR A 17 12.573 5.535 8.727 1.00 0.00 H new ATOM 0 HA TYR A 17 15.424 5.212 9.102 1.00 0.00 H new ATOM 0 HB2 TYR A 17 13.466 4.756 6.819 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.189 4.532 6.587 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.552 3.653 9.134 1.00 0.00 H new ATOM 0 HD2 TYR A 17 16.044 2.379 6.980 1.00 0.00 H new ATOM 0 HE1 TYR A 17 12.395 1.419 10.198 1.00 0.00 H new ATOM 0 HE2 TYR A 17 15.884 0.144 8.042 1.00 0.00 H new ATOM 0 HH TYR A 17 14.768 -1.176 9.456 1.00 0.00 H new ATOM 296 N SER A 18 14.352 7.562 7.024 1.00 0.00 N ATOM 297 CA SER A 18 14.784 8.813 6.333 1.00 0.00 C ATOM 298 C SER A 18 14.365 10.037 7.150 1.00 0.00 C ATOM 299 O SER A 18 13.656 10.893 6.660 1.00 0.00 O ATOM 300 CB SER A 18 14.123 8.882 4.956 1.00 0.00 C ATOM 301 OG SER A 18 12.776 9.314 5.103 1.00 0.00 O ATOM 0 H SER A 18 13.370 7.317 6.896 1.00 0.00 H new ATOM 0 HA SER A 18 15.869 8.805 6.228 1.00 0.00 H new ATOM 0 HB2 SER A 18 14.670 9.570 4.311 1.00 0.00 H new ATOM 0 HB3 SER A 18 14.153 7.904 4.476 1.00 0.00 H new ATOM 0 HG SER A 18 12.762 10.256 5.373 1.00 0.00 H new ATOM 307 N GLY A 19 14.816 10.148 8.382 1.00 0.00 N ATOM 308 CA GLY A 19 14.465 11.344 9.220 1.00 0.00 C ATOM 309 C GLY A 19 15.766 12.033 9.638 1.00 0.00 C ATOM 310 O GLY A 19 15.778 13.193 9.998 1.00 0.00 O ATOM 0 H GLY A 19 15.412 9.461 8.843 1.00 0.00 H new ATOM 0 HA2 GLY A 19 13.835 12.032 8.656 1.00 0.00 H new ATOM 0 HA3 GLY A 19 13.897 11.039 10.099 1.00 0.00 H new ATOM 314 N ARG A 20 16.867 11.333 9.571 1.00 0.00 N ATOM 315 CA ARG A 20 18.169 11.956 9.939 1.00 0.00 C ATOM 316 C ARG A 20 18.460 13.091 8.960 1.00 0.00 C ATOM 317 O ARG A 20 19.077 14.073 9.325 1.00 0.00 O ATOM 318 CB ARG A 20 19.295 10.911 9.926 1.00 0.00 C ATOM 319 CG ARG A 20 19.038 9.882 8.822 1.00 0.00 C ATOM 320 CD ARG A 20 20.279 9.005 8.643 1.00 0.00 C ATOM 321 NE ARG A 20 20.587 8.319 9.929 1.00 0.00 N ATOM 322 CZ ARG A 20 21.702 7.654 10.065 1.00 0.00 C ATOM 323 NH1 ARG A 20 22.842 8.286 10.086 1.00 0.00 N ATOM 324 NH2 ARG A 20 21.676 6.355 10.182 1.00 0.00 N ATOM 0 H ARG A 20 16.920 10.358 9.277 1.00 0.00 H new ATOM 0 HA ARG A 20 18.113 12.357 10.951 1.00 0.00 H new ATOM 0 HB2 ARG A 20 20.255 11.400 9.763 1.00 0.00 H new ATOM 0 HB3 ARG A 20 19.352 10.413 10.894 1.00 0.00 H new ATOM 0 HG2 ARG A 20 18.177 9.265 9.079 1.00 0.00 H new ATOM 0 HG3 ARG A 20 18.799 10.388 7.887 1.00 0.00 H new ATOM 0 HD2 ARG A 20 20.108 8.269 7.857 1.00 0.00 H new ATOM 0 HD3 ARG A 20 21.127 9.614 8.330 1.00 0.00 H new ATOM 0 HE ARG A 20 19.926 8.369 10.704 1.00 0.00 H new ATOM 0 HH11 ARG A 20 22.864 9.302 9.996 1.00 0.00 H new ATOM 0 HH12 ARG A 20 23.712 7.765 10.192 1.00 0.00 H new ATOM 0 HH21 ARG A 20 20.785 5.859 10.167 1.00 0.00 H new ATOM 0 HH22 ARG A 20 22.547 5.835 10.288 1.00 0.00 H new ATOM 338 N GLU A 21 17.985 13.012 7.741 1.00 0.00 N ATOM 339 CA GLU A 21 18.208 14.150 6.793 1.00 0.00 C ATOM 340 C GLU A 21 16.978 14.284 5.894 1.00 0.00 C ATOM 341 O GLU A 21 16.446 15.363 5.728 1.00 0.00 O ATOM 342 CB GLU A 21 19.459 13.901 5.936 1.00 0.00 C ATOM 343 CG GLU A 21 20.734 14.163 6.752 1.00 0.00 C ATOM 344 CD GLU A 21 21.016 12.973 7.671 1.00 0.00 C ATOM 345 OE1 GLU A 21 20.814 11.851 7.235 1.00 0.00 O ATOM 346 OE2 GLU A 21 21.429 13.203 8.796 1.00 0.00 O ATOM 0 H GLU A 21 17.460 12.222 7.365 1.00 0.00 H new ATOM 0 HA GLU A 21 18.361 15.069 7.358 1.00 0.00 H new ATOM 0 HB2 GLU A 21 19.458 12.874 5.572 1.00 0.00 H new ATOM 0 HB3 GLU A 21 19.442 14.550 5.060 1.00 0.00 H new ATOM 0 HG2 GLU A 21 21.578 14.325 6.082 1.00 0.00 H new ATOM 0 HG3 GLU A 21 20.618 15.071 7.343 1.00 0.00 H new ATOM 353 N GLY A 22 16.506 13.198 5.333 1.00 0.00 N ATOM 354 CA GLY A 22 15.294 13.264 4.458 1.00 0.00 C ATOM 355 C GLY A 22 15.383 14.476 3.530 1.00 0.00 C ATOM 356 O GLY A 22 14.396 14.910 2.969 1.00 0.00 O ATOM 0 H GLY A 22 16.908 12.267 5.443 1.00 0.00 H new ATOM 0 HA2 GLY A 22 15.210 12.350 3.869 1.00 0.00 H new ATOM 0 HA3 GLY A 22 14.396 13.331 5.072 1.00 0.00 H new ATOM 360 N ASP A 23 16.552 15.029 3.358 1.00 0.00 N ATOM 361 CA ASP A 23 16.680 16.210 2.459 1.00 0.00 C ATOM 362 C ASP A 23 15.993 15.889 1.131 1.00 0.00 C ATOM 363 O ASP A 23 15.181 16.648 0.641 1.00 0.00 O ATOM 364 CB ASP A 23 18.159 16.516 2.215 1.00 0.00 C ATOM 365 CG ASP A 23 18.825 16.910 3.534 1.00 0.00 C ATOM 366 OD1 ASP A 23 18.133 17.432 4.393 1.00 0.00 O ATOM 367 OD2 ASP A 23 20.016 16.681 3.665 1.00 0.00 O ATOM 0 H ASP A 23 17.418 14.717 3.797 1.00 0.00 H new ATOM 0 HA ASP A 23 16.212 17.080 2.919 1.00 0.00 H new ATOM 0 HB2 ASP A 23 18.656 15.644 1.791 1.00 0.00 H new ATOM 0 HB3 ASP A 23 18.259 17.324 1.490 1.00 0.00 H new ATOM 372 N LYS A 24 16.296 14.756 0.552 1.00 0.00 N ATOM 373 CA LYS A 24 15.642 14.373 -0.733 1.00 0.00 C ATOM 374 C LYS A 24 14.375 13.571 -0.421 1.00 0.00 C ATOM 375 O LYS A 24 14.337 12.799 0.515 1.00 0.00 O ATOM 376 CB LYS A 24 16.601 13.514 -1.561 1.00 0.00 C ATOM 377 CG LYS A 24 17.996 14.154 -1.556 1.00 0.00 C ATOM 378 CD LYS A 24 18.956 13.348 -2.453 1.00 0.00 C ATOM 379 CE LYS A 24 18.863 13.839 -3.904 1.00 0.00 C ATOM 380 NZ LYS A 24 19.410 15.223 -3.996 1.00 0.00 N ATOM 0 H LYS A 24 16.968 14.080 0.914 1.00 0.00 H new ATOM 0 HA LYS A 24 15.385 15.268 -1.300 1.00 0.00 H new ATOM 0 HB2 LYS A 24 16.650 12.506 -1.150 1.00 0.00 H new ATOM 0 HB3 LYS A 24 16.234 13.424 -2.584 1.00 0.00 H new ATOM 0 HG2 LYS A 24 17.933 15.183 -1.911 1.00 0.00 H new ATOM 0 HG3 LYS A 24 18.383 14.191 -0.538 1.00 0.00 H new ATOM 0 HD2 LYS A 24 19.979 13.453 -2.091 1.00 0.00 H new ATOM 0 HD3 LYS A 24 18.708 12.288 -2.403 1.00 0.00 H new ATOM 0 HE2 LYS A 24 19.420 13.172 -4.561 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.826 13.823 -4.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 19.804 15.378 -4.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 18.649 15.910 -3.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 20.160 15.348 -3.286 1.00 0.00 H new ATOM 394 N HIS A 25 13.346 13.726 -1.213 1.00 0.00 N ATOM 395 CA HIS A 25 12.088 12.950 -0.983 1.00 0.00 C ATOM 396 C HIS A 25 12.092 11.759 -1.939 1.00 0.00 C ATOM 397 O HIS A 25 11.078 11.384 -2.493 1.00 0.00 O ATOM 398 CB HIS A 25 10.878 13.841 -1.276 1.00 0.00 C ATOM 399 CG HIS A 25 10.780 14.910 -0.222 1.00 0.00 C ATOM 400 ND1 HIS A 25 10.724 16.259 -0.538 1.00 0.00 N ATOM 401 CD2 HIS A 25 10.729 14.845 1.149 1.00 0.00 C ATOM 402 CE1 HIS A 25 10.644 16.944 0.618 1.00 0.00 C ATOM 403 NE2 HIS A 25 10.643 16.130 1.677 1.00 0.00 N ATOM 0 H HIS A 25 13.321 14.359 -2.013 1.00 0.00 H new ATOM 0 HA HIS A 25 12.031 12.608 0.051 1.00 0.00 H new ATOM 0 HB2 HIS A 25 10.976 14.295 -2.262 1.00 0.00 H new ATOM 0 HB3 HIS A 25 9.967 13.243 -1.290 1.00 0.00 H new ATOM 0 HD2 HIS A 25 10.752 13.935 1.730 1.00 0.00 H new ATOM 0 HE1 HIS A 25 10.588 18.021 0.681 1.00 0.00 H new ATOM 0 HE2 HIS A 25 10.591 16.393 2.661 1.00 0.00 H new ATOM 411 N LYS A 26 13.239 11.157 -2.121 1.00 0.00 N ATOM 412 CA LYS A 26 13.355 9.974 -3.025 1.00 0.00 C ATOM 413 C LYS A 26 14.175 8.889 -2.325 1.00 0.00 C ATOM 414 O LYS A 26 14.990 9.182 -1.471 1.00 0.00 O ATOM 415 CB LYS A 26 14.061 10.389 -4.318 1.00 0.00 C ATOM 416 CG LYS A 26 13.261 11.498 -5.002 1.00 0.00 C ATOM 417 CD LYS A 26 13.763 11.681 -6.437 1.00 0.00 C ATOM 418 CE LYS A 26 12.903 12.723 -7.157 1.00 0.00 C ATOM 419 NZ LYS A 26 13.636 13.231 -8.351 1.00 0.00 N ATOM 0 H LYS A 26 14.112 11.439 -1.675 1.00 0.00 H new ATOM 0 HA LYS A 26 12.362 9.592 -3.261 1.00 0.00 H new ATOM 0 HB2 LYS A 26 15.070 10.737 -4.098 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.157 9.531 -4.984 1.00 0.00 H new ATOM 0 HG2 LYS A 26 12.201 11.246 -5.006 1.00 0.00 H new ATOM 0 HG3 LYS A 26 13.365 12.431 -4.448 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.806 11.999 -6.430 1.00 0.00 H new ATOM 0 HD3 LYS A 26 13.723 10.731 -6.970 1.00 0.00 H new ATOM 0 HE2 LYS A 26 11.954 12.281 -7.460 1.00 0.00 H new ATOM 0 HE3 LYS A 26 12.669 13.547 -6.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 13.053 13.939 -8.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 14.530 13.668 -8.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 13.837 12.441 -8.997 1.00 0.00 H new ATOM 433 N LEU A 27 13.972 7.641 -2.674 1.00 0.00 N ATOM 434 CA LEU A 27 14.742 6.527 -2.027 1.00 0.00 C ATOM 435 C LEU A 27 15.461 5.723 -3.114 1.00 0.00 C ATOM 436 O LEU A 27 14.927 5.498 -4.182 1.00 0.00 O ATOM 437 CB LEU A 27 13.763 5.616 -1.262 1.00 0.00 C ATOM 438 CG LEU A 27 14.502 4.861 -0.135 1.00 0.00 C ATOM 439 CD1 LEU A 27 14.599 5.738 1.121 1.00 0.00 C ATOM 440 CD2 LEU A 27 13.735 3.581 0.213 1.00 0.00 C ATOM 0 H LEU A 27 13.302 7.343 -3.383 1.00 0.00 H new ATOM 0 HA LEU A 27 15.476 6.932 -1.330 1.00 0.00 H new ATOM 0 HB2 LEU A 27 12.955 6.213 -0.840 1.00 0.00 H new ATOM 0 HB3 LEU A 27 13.307 4.903 -1.949 1.00 0.00 H new ATOM 0 HG LEU A 27 15.506 4.615 -0.481 1.00 0.00 H new ATOM 0 HD11 LEU A 27 15.122 5.192 1.906 1.00 0.00 H new ATOM 0 HD12 LEU A 27 15.147 6.650 0.886 1.00 0.00 H new ATOM 0 HD13 LEU A 27 13.597 5.995 1.464 1.00 0.00 H new ATOM 0 HD21 LEU A 27 14.257 3.049 1.008 1.00 0.00 H new ATOM 0 HD22 LEU A 27 12.730 3.839 0.548 1.00 0.00 H new ATOM 0 HD23 LEU A 27 13.671 2.944 -0.669 1.00 0.00 H new ATOM 452 N LYS A 28 16.672 5.292 -2.860 1.00 0.00 N ATOM 453 CA LYS A 28 17.416 4.509 -3.892 1.00 0.00 C ATOM 454 C LYS A 28 17.115 3.017 -3.717 1.00 0.00 C ATOM 455 O LYS A 28 16.874 2.549 -2.621 1.00 0.00 O ATOM 456 CB LYS A 28 18.919 4.758 -3.740 1.00 0.00 C ATOM 457 CG LYS A 28 19.206 6.250 -3.948 1.00 0.00 C ATOM 458 CD LYS A 28 20.718 6.488 -4.087 1.00 0.00 C ATOM 459 CE LYS A 28 21.399 6.390 -2.717 1.00 0.00 C ATOM 460 NZ LYS A 28 20.731 7.314 -1.756 1.00 0.00 N ATOM 0 H LYS A 28 17.175 5.448 -1.986 1.00 0.00 H new ATOM 0 HA LYS A 28 17.100 4.825 -4.886 1.00 0.00 H new ATOM 0 HB2 LYS A 28 19.253 4.445 -2.751 1.00 0.00 H new ATOM 0 HB3 LYS A 28 19.474 4.164 -4.466 1.00 0.00 H new ATOM 0 HG2 LYS A 28 18.691 6.605 -4.841 1.00 0.00 H new ATOM 0 HG3 LYS A 28 18.817 6.823 -3.106 1.00 0.00 H new ATOM 0 HD2 LYS A 28 21.148 5.753 -4.768 1.00 0.00 H new ATOM 0 HD3 LYS A 28 20.900 7.471 -4.522 1.00 0.00 H new ATOM 0 HE2 LYS A 28 21.348 5.366 -2.347 1.00 0.00 H new ATOM 0 HE3 LYS A 28 22.455 6.644 -2.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 21.445 7.745 -1.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 20.233 8.060 -2.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 20.048 6.781 -1.180 1.00 0.00 H new ATOM 474 N LYS A 29 17.120 2.269 -4.785 1.00 0.00 N ATOM 475 CA LYS A 29 16.828 0.807 -4.687 1.00 0.00 C ATOM 476 C LYS A 29 17.781 0.129 -3.694 1.00 0.00 C ATOM 477 O LYS A 29 17.386 -0.715 -2.913 1.00 0.00 O ATOM 478 CB LYS A 29 17.021 0.175 -6.071 1.00 0.00 C ATOM 479 CG LYS A 29 18.517 0.158 -6.429 1.00 0.00 C ATOM 480 CD LYS A 29 18.698 -0.042 -7.939 1.00 0.00 C ATOM 481 CE LYS A 29 20.108 -0.565 -8.224 1.00 0.00 C ATOM 482 NZ LYS A 29 21.101 0.246 -7.464 1.00 0.00 N ATOM 0 H LYS A 29 17.315 2.607 -5.727 1.00 0.00 H new ATOM 0 HA LYS A 29 15.804 0.672 -4.338 1.00 0.00 H new ATOM 0 HB2 LYS A 29 16.624 -0.840 -6.076 1.00 0.00 H new ATOM 0 HB3 LYS A 29 16.464 0.739 -6.820 1.00 0.00 H new ATOM 0 HG2 LYS A 29 18.983 1.094 -6.120 1.00 0.00 H new ATOM 0 HG3 LYS A 29 19.019 -0.643 -5.886 1.00 0.00 H new ATOM 0 HD2 LYS A 29 17.956 -0.746 -8.314 1.00 0.00 H new ATOM 0 HD3 LYS A 29 18.536 0.900 -8.463 1.00 0.00 H new ATOM 0 HE2 LYS A 29 20.183 -1.614 -7.937 1.00 0.00 H new ATOM 0 HE3 LYS A 29 20.319 -0.510 -9.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 22.035 0.162 -7.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 20.806 1.243 -7.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 21.156 -0.101 -6.485 1.00 0.00 H new ATOM 496 N SER A 30 19.035 0.475 -3.741 1.00 0.00 N ATOM 497 CA SER A 30 20.031 -0.160 -2.831 1.00 0.00 C ATOM 498 C SER A 30 19.606 -0.003 -1.369 1.00 0.00 C ATOM 499 O SER A 30 19.769 -0.903 -0.562 1.00 0.00 O ATOM 500 CB SER A 30 21.393 0.508 -3.032 1.00 0.00 C ATOM 501 OG SER A 30 21.358 1.820 -2.486 1.00 0.00 O ATOM 0 H SER A 30 19.418 1.176 -4.375 1.00 0.00 H new ATOM 0 HA SER A 30 20.092 -1.223 -3.066 1.00 0.00 H new ATOM 0 HB2 SER A 30 22.174 -0.079 -2.548 1.00 0.00 H new ATOM 0 HB3 SER A 30 21.637 0.550 -4.093 1.00 0.00 H new ATOM 0 HG SER A 30 22.230 2.250 -2.612 1.00 0.00 H new ATOM 507 N GLU A 31 19.050 1.125 -1.015 1.00 0.00 N ATOM 508 CA GLU A 31 18.622 1.310 0.403 1.00 0.00 C ATOM 509 C GLU A 31 17.262 0.645 0.592 1.00 0.00 C ATOM 510 O GLU A 31 16.951 0.122 1.644 1.00 0.00 O ATOM 511 CB GLU A 31 18.544 2.798 0.748 1.00 0.00 C ATOM 512 CG GLU A 31 19.916 3.442 0.538 1.00 0.00 C ATOM 513 CD GLU A 31 19.853 4.920 0.926 1.00 0.00 C ATOM 514 OE1 GLU A 31 20.010 5.211 2.101 1.00 0.00 O ATOM 515 OE2 GLU A 31 19.649 5.737 0.043 1.00 0.00 O ATOM 0 H GLU A 31 18.875 1.916 -1.635 1.00 0.00 H new ATOM 0 HA GLU A 31 19.351 0.851 1.071 1.00 0.00 H new ATOM 0 HB2 GLU A 31 17.800 3.289 0.121 1.00 0.00 H new ATOM 0 HB3 GLU A 31 18.224 2.926 1.782 1.00 0.00 H new ATOM 0 HG2 GLU A 31 20.666 2.929 1.140 1.00 0.00 H new ATOM 0 HG3 GLU A 31 20.221 3.342 -0.504 1.00 0.00 H new ATOM 522 N LEU A 32 16.455 0.641 -0.437 1.00 0.00 N ATOM 523 CA LEU A 32 15.125 -0.014 -0.334 1.00 0.00 C ATOM 524 C LEU A 32 15.351 -1.503 -0.060 1.00 0.00 C ATOM 525 O LEU A 32 14.723 -2.080 0.804 1.00 0.00 O ATOM 526 CB LEU A 32 14.346 0.186 -1.647 1.00 0.00 C ATOM 527 CG LEU A 32 12.833 0.142 -1.387 1.00 0.00 C ATOM 528 CD1 LEU A 32 12.090 0.440 -2.693 1.00 0.00 C ATOM 529 CD2 LEU A 32 12.428 -1.247 -0.867 1.00 0.00 C ATOM 0 H LEU A 32 16.663 1.064 -1.342 1.00 0.00 H new ATOM 0 HA LEU A 32 14.541 0.424 0.475 1.00 0.00 H new ATOM 0 HB2 LEU A 32 14.616 1.142 -2.095 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.621 -0.590 -2.362 1.00 0.00 H new ATOM 0 HG LEU A 32 12.573 0.889 -0.637 1.00 0.00 H new ATOM 0 HD11 LEU A 32 11.015 0.410 -2.515 1.00 0.00 H new ATOM 0 HD12 LEU A 32 12.371 1.430 -3.054 1.00 0.00 H new ATOM 0 HD13 LEU A 32 12.355 -0.307 -3.441 1.00 0.00 H new ATOM 0 HD21 LEU A 32 11.353 -1.268 -0.686 1.00 0.00 H new ATOM 0 HD22 LEU A 32 12.686 -2.003 -1.609 1.00 0.00 H new ATOM 0 HD23 LEU A 32 12.957 -1.456 0.063 1.00 0.00 H new ATOM 541 N LYS A 33 16.228 -2.148 -0.784 1.00 0.00 N ATOM 542 CA LYS A 33 16.440 -3.598 -0.534 1.00 0.00 C ATOM 543 C LYS A 33 16.726 -3.800 0.950 1.00 0.00 C ATOM 544 O LYS A 33 16.038 -4.531 1.635 1.00 0.00 O ATOM 545 CB LYS A 33 17.628 -4.096 -1.360 1.00 0.00 C ATOM 546 CG LYS A 33 17.735 -5.617 -1.237 1.00 0.00 C ATOM 547 CD LYS A 33 18.975 -6.106 -1.991 1.00 0.00 C ATOM 548 CE LYS A 33 19.304 -7.536 -1.559 1.00 0.00 C ATOM 549 NZ LYS A 33 18.068 -8.368 -1.607 1.00 0.00 N ATOM 0 H LYS A 33 16.797 -1.739 -1.525 1.00 0.00 H new ATOM 0 HA LYS A 33 15.550 -4.158 -0.821 1.00 0.00 H new ATOM 0 HB2 LYS A 33 17.502 -3.813 -2.405 1.00 0.00 H new ATOM 0 HB3 LYS A 33 18.548 -3.627 -1.012 1.00 0.00 H new ATOM 0 HG2 LYS A 33 17.798 -5.904 -0.187 1.00 0.00 H new ATOM 0 HG3 LYS A 33 16.840 -6.089 -1.643 1.00 0.00 H new ATOM 0 HD2 LYS A 33 18.797 -6.071 -3.066 1.00 0.00 H new ATOM 0 HD3 LYS A 33 19.821 -5.449 -1.786 1.00 0.00 H new ATOM 0 HE2 LYS A 33 20.065 -7.959 -2.215 1.00 0.00 H new ATOM 0 HE3 LYS A 33 19.716 -7.536 -0.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 18.324 -9.360 -1.786 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 17.567 -8.298 -0.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 17.449 -8.027 -2.370 1.00 0.00 H new ATOM 563 N GLU A 34 17.743 -3.155 1.451 1.00 0.00 N ATOM 564 CA GLU A 34 18.076 -3.311 2.898 1.00 0.00 C ATOM 565 C GLU A 34 16.803 -3.116 3.730 1.00 0.00 C ATOM 566 O GLU A 34 16.601 -3.775 4.731 1.00 0.00 O ATOM 567 CB GLU A 34 19.116 -2.265 3.300 1.00 0.00 C ATOM 568 CG GLU A 34 20.444 -2.572 2.605 1.00 0.00 C ATOM 569 CD GLU A 34 21.438 -1.443 2.881 1.00 0.00 C ATOM 570 OE1 GLU A 34 21.162 -0.325 2.478 1.00 0.00 O ATOM 571 OE2 GLU A 34 22.458 -1.716 3.493 1.00 0.00 O ATOM 0 H GLU A 34 18.355 -2.530 0.926 1.00 0.00 H new ATOM 0 HA GLU A 34 18.482 -4.307 3.076 1.00 0.00 H new ATOM 0 HB2 GLU A 34 18.771 -1.269 3.024 1.00 0.00 H new ATOM 0 HB3 GLU A 34 19.250 -2.267 4.382 1.00 0.00 H new ATOM 0 HG2 GLU A 34 20.845 -3.520 2.965 1.00 0.00 H new ATOM 0 HG3 GLU A 34 20.288 -2.679 1.532 1.00 0.00 H new ATOM 578 N LEU A 35 15.940 -2.223 3.326 1.00 0.00 N ATOM 579 CA LEU A 35 14.683 -2.001 4.098 1.00 0.00 C ATOM 580 C LEU A 35 13.787 -3.240 3.985 1.00 0.00 C ATOM 581 O LEU A 35 13.171 -3.651 4.947 1.00 0.00 O ATOM 582 CB LEU A 35 13.955 -0.762 3.560 1.00 0.00 C ATOM 583 CG LEU A 35 12.693 -0.479 4.387 1.00 0.00 C ATOM 584 CD1 LEU A 35 13.067 -0.169 5.848 1.00 0.00 C ATOM 585 CD2 LEU A 35 11.963 0.721 3.774 1.00 0.00 C ATOM 0 H LEU A 35 16.050 -1.639 2.497 1.00 0.00 H new ATOM 0 HA LEU A 35 14.924 -1.834 5.148 1.00 0.00 H new ATOM 0 HB2 LEU A 35 14.620 0.101 3.593 1.00 0.00 H new ATOM 0 HB3 LEU A 35 13.685 -0.916 2.515 1.00 0.00 H new ATOM 0 HG LEU A 35 12.047 -1.357 4.376 1.00 0.00 H new ATOM 0 HD11 LEU A 35 12.161 0.029 6.421 1.00 0.00 H new ATOM 0 HD12 LEU A 35 13.589 -1.023 6.279 1.00 0.00 H new ATOM 0 HD13 LEU A 35 13.715 0.707 5.880 1.00 0.00 H new ATOM 0 HD21 LEU A 35 11.064 0.934 4.352 1.00 0.00 H new ATOM 0 HD22 LEU A 35 12.618 1.592 3.789 1.00 0.00 H new ATOM 0 HD23 LEU A 35 11.687 0.492 2.745 1.00 0.00 H new ATOM 597 N ILE A 36 13.725 -3.861 2.838 1.00 0.00 N ATOM 598 CA ILE A 36 12.888 -5.089 2.700 1.00 0.00 C ATOM 599 C ILE A 36 13.384 -6.152 3.686 1.00 0.00 C ATOM 600 O ILE A 36 12.608 -6.849 4.310 1.00 0.00 O ATOM 601 CB ILE A 36 13.025 -5.623 1.266 1.00 0.00 C ATOM 602 CG1 ILE A 36 12.274 -4.681 0.315 1.00 0.00 C ATOM 603 CG2 ILE A 36 12.421 -7.033 1.176 1.00 0.00 C ATOM 604 CD1 ILE A 36 12.538 -5.079 -1.141 1.00 0.00 C ATOM 0 H ILE A 36 14.216 -3.572 1.992 1.00 0.00 H new ATOM 0 HA ILE A 36 11.845 -4.855 2.912 1.00 0.00 H new ATOM 0 HB ILE A 36 14.078 -5.670 0.989 1.00 0.00 H new ATOM 0 HG12 ILE A 36 11.205 -4.720 0.522 1.00 0.00 H new ATOM 0 HG13 ILE A 36 12.594 -3.653 0.482 1.00 0.00 H new ATOM 0 HG21 ILE A 36 12.521 -7.407 0.157 1.00 0.00 H new ATOM 0 HG22 ILE A 36 12.947 -7.699 1.860 1.00 0.00 H new ATOM 0 HG23 ILE A 36 11.366 -6.995 1.447 1.00 0.00 H new ATOM 0 HD11 ILE A 36 12.000 -4.404 -1.806 1.00 0.00 H new ATOM 0 HD12 ILE A 36 13.606 -5.017 -1.347 1.00 0.00 H new ATOM 0 HD13 ILE A 36 12.196 -6.100 -1.307 1.00 0.00 H new ATOM 616 N ASN A 37 14.675 -6.301 3.798 1.00 0.00 N ATOM 617 CA ASN A 37 15.241 -7.341 4.704 1.00 0.00 C ATOM 618 C ASN A 37 14.789 -7.124 6.153 1.00 0.00 C ATOM 619 O ASN A 37 14.482 -8.062 6.862 1.00 0.00 O ATOM 620 CB ASN A 37 16.768 -7.273 4.648 1.00 0.00 C ATOM 621 CG ASN A 37 17.241 -7.538 3.217 1.00 0.00 C ATOM 622 OD1 ASN A 37 17.949 -6.736 2.641 1.00 0.00 O ATOM 623 ND2 ASN A 37 16.880 -8.638 2.615 1.00 0.00 N ATOM 0 H ASN A 37 15.367 -5.743 3.298 1.00 0.00 H new ATOM 0 HA ASN A 37 14.884 -8.316 4.372 1.00 0.00 H new ATOM 0 HB2 ASN A 37 17.111 -6.293 4.980 1.00 0.00 H new ATOM 0 HB3 ASN A 37 17.200 -8.008 5.327 1.00 0.00 H new ATOM 0 HD21 ASN A 37 17.192 -8.824 1.662 1.00 0.00 H new ATOM 0 HD22 ASN A 37 16.286 -9.312 3.098 1.00 0.00 H new ATOM 630 N ASN A 38 14.779 -5.898 6.611 1.00 0.00 N ATOM 631 CA ASN A 38 14.388 -5.617 8.030 1.00 0.00 C ATOM 632 C ASN A 38 12.940 -5.120 8.123 1.00 0.00 C ATOM 633 O ASN A 38 12.480 -4.772 9.192 1.00 0.00 O ATOM 634 CB ASN A 38 15.316 -4.536 8.590 1.00 0.00 C ATOM 635 CG ASN A 38 16.767 -5.008 8.493 1.00 0.00 C ATOM 636 OD1 ASN A 38 17.149 -5.643 7.530 1.00 0.00 O ATOM 637 ND2 ASN A 38 17.600 -4.724 9.456 1.00 0.00 N ATOM 0 H ASN A 38 15.026 -5.074 6.062 1.00 0.00 H new ATOM 0 HA ASN A 38 14.472 -6.542 8.601 1.00 0.00 H new ATOM 0 HB2 ASN A 38 15.187 -3.607 8.034 1.00 0.00 H new ATOM 0 HB3 ASN A 38 15.060 -4.324 9.628 1.00 0.00 H new ATOM 0 HD21 ASN A 38 18.570 -5.035 9.400 1.00 0.00 H new ATOM 0 HD22 ASN A 38 17.281 -4.191 10.265 1.00 0.00 H new ATOM 644 N GLU A 39 12.218 -5.065 7.027 1.00 0.00 N ATOM 645 CA GLU A 39 10.799 -4.565 7.079 1.00 0.00 C ATOM 646 C GLU A 39 9.818 -5.681 6.709 1.00 0.00 C ATOM 647 O GLU A 39 8.698 -5.700 7.180 1.00 0.00 O ATOM 648 CB GLU A 39 10.643 -3.413 6.082 1.00 0.00 C ATOM 649 CG GLU A 39 9.297 -2.713 6.301 1.00 0.00 C ATOM 650 CD GLU A 39 9.370 -1.846 7.559 1.00 0.00 C ATOM 651 OE1 GLU A 39 9.894 -0.748 7.469 1.00 0.00 O ATOM 652 OE2 GLU A 39 8.902 -2.296 8.593 1.00 0.00 O ATOM 0 H GLU A 39 12.545 -5.343 6.102 1.00 0.00 H new ATOM 0 HA GLU A 39 10.580 -4.228 8.092 1.00 0.00 H new ATOM 0 HB2 GLU A 39 11.458 -2.700 6.206 1.00 0.00 H new ATOM 0 HB3 GLU A 39 10.704 -3.792 5.062 1.00 0.00 H new ATOM 0 HG2 GLU A 39 9.051 -2.097 5.436 1.00 0.00 H new ATOM 0 HG3 GLU A 39 8.503 -3.453 6.402 1.00 0.00 H new ATOM 659 N LEU A 40 10.224 -6.612 5.879 1.00 0.00 N ATOM 660 CA LEU A 40 9.310 -7.736 5.480 1.00 0.00 C ATOM 661 C LEU A 40 9.941 -9.076 5.871 1.00 0.00 C ATOM 662 O LEU A 40 9.902 -10.033 5.124 1.00 0.00 O ATOM 663 CB LEU A 40 9.090 -7.699 3.964 1.00 0.00 C ATOM 664 CG LEU A 40 8.557 -6.320 3.547 1.00 0.00 C ATOM 665 CD1 LEU A 40 8.362 -6.288 2.026 1.00 0.00 C ATOM 666 CD2 LEU A 40 7.213 -6.042 4.242 1.00 0.00 C ATOM 0 H LEU A 40 11.152 -6.644 5.458 1.00 0.00 H new ATOM 0 HA LEU A 40 8.354 -7.624 5.991 1.00 0.00 H new ATOM 0 HB2 LEU A 40 10.026 -7.908 3.447 1.00 0.00 H new ATOM 0 HB3 LEU A 40 8.383 -8.476 3.671 1.00 0.00 H new ATOM 0 HG LEU A 40 9.275 -5.555 3.842 1.00 0.00 H new ATOM 0 HD11 LEU A 40 7.984 -5.310 1.728 1.00 0.00 H new ATOM 0 HD12 LEU A 40 9.316 -6.474 1.533 1.00 0.00 H new ATOM 0 HD13 LEU A 40 7.647 -7.058 1.735 1.00 0.00 H new ATOM 0 HD21 LEU A 40 6.843 -5.062 3.940 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.491 -6.806 3.956 1.00 0.00 H new ATOM 0 HD23 LEU A 40 7.352 -6.060 5.323 1.00 0.00 H new ATOM 678 N SER A 41 10.522 -9.148 7.038 1.00 0.00 N ATOM 679 CA SER A 41 11.158 -10.421 7.484 1.00 0.00 C ATOM 680 C SER A 41 10.082 -11.447 7.849 1.00 0.00 C ATOM 681 O SER A 41 10.268 -12.636 7.683 1.00 0.00 O ATOM 682 CB SER A 41 12.029 -10.151 8.711 1.00 0.00 C ATOM 683 OG SER A 41 11.198 -9.789 9.806 1.00 0.00 O ATOM 0 H SER A 41 10.584 -8.378 7.704 1.00 0.00 H new ATOM 0 HA SER A 41 11.770 -10.815 6.673 1.00 0.00 H new ATOM 0 HB2 SER A 41 12.612 -11.038 8.960 1.00 0.00 H new ATOM 0 HB3 SER A 41 12.739 -9.352 8.499 1.00 0.00 H new ATOM 0 HG SER A 41 11.753 -9.617 10.595 1.00 0.00 H new ATOM 689 N HIS A 42 8.962 -11.006 8.357 1.00 0.00 N ATOM 690 CA HIS A 42 7.891 -11.971 8.740 1.00 0.00 C ATOM 691 C HIS A 42 7.324 -12.646 7.489 1.00 0.00 C ATOM 692 O HIS A 42 7.220 -13.855 7.419 1.00 0.00 O ATOM 693 CB HIS A 42 6.770 -11.224 9.467 1.00 0.00 C ATOM 694 CG HIS A 42 5.867 -12.213 10.151 1.00 0.00 C ATOM 695 ND1 HIS A 42 4.504 -12.263 9.906 1.00 0.00 N ATOM 696 CD2 HIS A 42 6.118 -13.197 11.075 1.00 0.00 C ATOM 697 CE1 HIS A 42 3.991 -13.245 10.669 1.00 0.00 C ATOM 698 NE2 HIS A 42 4.932 -13.847 11.401 1.00 0.00 N ATOM 0 H HIS A 42 8.743 -10.024 8.523 1.00 0.00 H new ATOM 0 HA HIS A 42 8.313 -12.732 9.397 1.00 0.00 H new ATOM 0 HB2 HIS A 42 7.193 -10.535 10.199 1.00 0.00 H new ATOM 0 HB3 HIS A 42 6.199 -10.625 8.758 1.00 0.00 H new ATOM 0 HD2 HIS A 42 7.089 -13.431 11.486 1.00 0.00 H new ATOM 0 HE1 HIS A 42 2.945 -13.514 10.687 1.00 0.00 H new ATOM 0 HE2 HIS A 42 4.808 -14.618 12.058 1.00 0.00 H new ATOM 706 N PHE A 43 6.951 -11.879 6.502 1.00 0.00 N ATOM 707 CA PHE A 43 6.388 -12.485 5.263 1.00 0.00 C ATOM 708 C PHE A 43 7.472 -13.316 4.567 1.00 0.00 C ATOM 709 O PHE A 43 7.185 -14.282 3.891 1.00 0.00 O ATOM 710 CB PHE A 43 5.893 -11.368 4.325 1.00 0.00 C ATOM 711 CG PHE A 43 4.472 -10.981 4.689 1.00 0.00 C ATOM 712 CD1 PHE A 43 4.185 -10.500 5.974 1.00 0.00 C ATOM 713 CD2 PHE A 43 3.443 -11.107 3.746 1.00 0.00 C ATOM 714 CE1 PHE A 43 2.873 -10.147 6.313 1.00 0.00 C ATOM 715 CE2 PHE A 43 2.132 -10.753 4.085 1.00 0.00 C ATOM 716 CZ PHE A 43 1.847 -10.274 5.369 1.00 0.00 C ATOM 0 H PHE A 43 7.012 -10.861 6.500 1.00 0.00 H new ATOM 0 HA PHE A 43 5.549 -13.133 5.517 1.00 0.00 H new ATOM 0 HB2 PHE A 43 6.547 -10.499 4.403 1.00 0.00 H new ATOM 0 HB3 PHE A 43 5.933 -11.706 3.290 1.00 0.00 H new ATOM 0 HD1 PHE A 43 4.976 -10.402 6.703 1.00 0.00 H new ATOM 0 HD2 PHE A 43 3.662 -11.478 2.756 1.00 0.00 H new ATOM 0 HE1 PHE A 43 2.652 -9.777 7.303 1.00 0.00 H new ATOM 0 HE2 PHE A 43 1.341 -10.849 3.356 1.00 0.00 H new ATOM 0 HZ PHE A 43 0.835 -10.002 5.632 1.00 0.00 H new ATOM 726 N LEU A 44 8.713 -12.941 4.719 1.00 0.00 N ATOM 727 CA LEU A 44 9.809 -13.704 4.055 1.00 0.00 C ATOM 728 C LEU A 44 9.641 -15.202 4.350 1.00 0.00 C ATOM 729 O LEU A 44 10.065 -16.046 3.585 1.00 0.00 O ATOM 730 CB LEU A 44 11.170 -13.197 4.583 1.00 0.00 C ATOM 731 CG LEU A 44 12.247 -13.236 3.478 1.00 0.00 C ATOM 732 CD1 LEU A 44 12.352 -14.654 2.905 1.00 0.00 C ATOM 733 CD2 LEU A 44 11.908 -12.236 2.348 1.00 0.00 C ATOM 0 H LEU A 44 9.015 -12.140 5.274 1.00 0.00 H new ATOM 0 HA LEU A 44 9.769 -13.555 2.976 1.00 0.00 H new ATOM 0 HB2 LEU A 44 11.062 -12.178 4.954 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.488 -13.811 5.426 1.00 0.00 H new ATOM 0 HG LEU A 44 13.203 -12.951 3.916 1.00 0.00 H new ATOM 0 HD11 LEU A 44 13.114 -14.676 2.125 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.626 -15.348 3.700 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.391 -14.948 2.482 1.00 0.00 H new ATOM 0 HD21 LEU A 44 12.680 -12.280 1.580 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.944 -12.495 1.909 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.860 -11.227 2.757 1.00 0.00 H new ATOM 745 N GLU A 45 9.023 -15.540 5.448 1.00 0.00 N ATOM 746 CA GLU A 45 8.831 -16.982 5.778 1.00 0.00 C ATOM 747 C GLU A 45 7.602 -17.519 5.043 1.00 0.00 C ATOM 748 O GLU A 45 7.582 -18.646 4.589 1.00 0.00 O ATOM 749 CB GLU A 45 8.630 -17.142 7.286 1.00 0.00 C ATOM 750 CG GLU A 45 8.768 -18.619 7.663 1.00 0.00 C ATOM 751 CD GLU A 45 8.220 -18.841 9.074 1.00 0.00 C ATOM 752 OE1 GLU A 45 7.124 -18.378 9.343 1.00 0.00 O ATOM 753 OE2 GLU A 45 8.906 -19.472 9.862 1.00 0.00 O ATOM 0 H GLU A 45 8.643 -14.883 6.130 1.00 0.00 H new ATOM 0 HA GLU A 45 9.713 -17.541 5.467 1.00 0.00 H new ATOM 0 HB2 GLU A 45 9.365 -16.547 7.827 1.00 0.00 H new ATOM 0 HB3 GLU A 45 7.646 -16.772 7.574 1.00 0.00 H new ATOM 0 HG2 GLU A 45 8.226 -19.239 6.949 1.00 0.00 H new ATOM 0 HG3 GLU A 45 9.814 -18.921 7.617 1.00 0.00 H new ATOM 760 N GLU A 46 6.572 -16.725 4.930 1.00 0.00 N ATOM 761 CA GLU A 46 5.335 -17.191 4.234 1.00 0.00 C ATOM 762 C GLU A 46 5.423 -16.885 2.735 1.00 0.00 C ATOM 763 O GLU A 46 4.575 -16.212 2.182 1.00 0.00 O ATOM 764 CB GLU A 46 4.122 -16.469 4.826 1.00 0.00 C ATOM 765 CG GLU A 46 3.873 -16.970 6.250 1.00 0.00 C ATOM 766 CD GLU A 46 2.606 -16.318 6.808 1.00 0.00 C ATOM 767 OE1 GLU A 46 2.246 -15.257 6.324 1.00 0.00 O ATOM 768 OE2 GLU A 46 2.018 -16.890 7.711 1.00 0.00 O ATOM 0 H GLU A 46 6.532 -15.771 5.290 1.00 0.00 H new ATOM 0 HA GLU A 46 5.233 -18.267 4.371 1.00 0.00 H new ATOM 0 HB2 GLU A 46 4.294 -15.393 4.833 1.00 0.00 H new ATOM 0 HB3 GLU A 46 3.242 -16.647 4.208 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.767 -18.055 6.252 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.727 -16.732 6.885 1.00 0.00 H new ATOM 775 N ILE A 47 6.437 -17.388 2.071 1.00 0.00 N ATOM 776 CA ILE A 47 6.592 -17.150 0.598 1.00 0.00 C ATOM 777 C ILE A 47 6.498 -18.491 -0.131 1.00 0.00 C ATOM 778 O ILE A 47 7.396 -19.307 -0.061 1.00 0.00 O ATOM 779 CB ILE A 47 7.965 -16.532 0.318 1.00 0.00 C ATOM 780 CG1 ILE A 47 8.159 -15.278 1.181 1.00 0.00 C ATOM 781 CG2 ILE A 47 8.074 -16.163 -1.163 1.00 0.00 C ATOM 782 CD1 ILE A 47 6.992 -14.300 0.990 1.00 0.00 C ATOM 0 H ILE A 47 7.171 -17.959 2.490 1.00 0.00 H new ATOM 0 HA ILE A 47 5.809 -16.474 0.253 1.00 0.00 H new ATOM 0 HB ILE A 47 8.740 -17.258 0.565 1.00 0.00 H new ATOM 0 HG12 ILE A 47 8.234 -15.561 2.231 1.00 0.00 H new ATOM 0 HG13 ILE A 47 9.096 -14.789 0.915 1.00 0.00 H new ATOM 0 HG21 ILE A 47 9.052 -15.724 -1.357 1.00 0.00 H new ATOM 0 HG22 ILE A 47 7.951 -17.059 -1.771 1.00 0.00 H new ATOM 0 HG23 ILE A 47 7.296 -15.443 -1.417 1.00 0.00 H new ATOM 0 HD11 ILE A 47 7.151 -13.419 1.611 1.00 0.00 H new ATOM 0 HD12 ILE A 47 6.936 -14.001 -0.057 1.00 0.00 H new ATOM 0 HD13 ILE A 47 6.060 -14.785 1.280 1.00 0.00 H new ATOM 794 N LYS A 48 5.420 -18.732 -0.831 1.00 0.00 N ATOM 795 CA LYS A 48 5.278 -20.027 -1.561 1.00 0.00 C ATOM 796 C LYS A 48 5.835 -19.877 -2.980 1.00 0.00 C ATOM 797 O LYS A 48 6.498 -20.757 -3.492 1.00 0.00 O ATOM 798 CB LYS A 48 3.800 -20.419 -1.632 1.00 0.00 C ATOM 799 CG LYS A 48 3.159 -20.289 -0.246 1.00 0.00 C ATOM 800 CD LYS A 48 3.975 -21.080 0.785 1.00 0.00 C ATOM 801 CE LYS A 48 3.117 -21.343 2.027 1.00 0.00 C ATOM 802 NZ LYS A 48 3.918 -22.094 3.035 1.00 0.00 N ATOM 0 H LYS A 48 4.634 -18.090 -0.929 1.00 0.00 H new ATOM 0 HA LYS A 48 5.832 -20.802 -1.032 1.00 0.00 H new ATOM 0 HB2 LYS A 48 3.279 -19.780 -2.345 1.00 0.00 H new ATOM 0 HB3 LYS A 48 3.703 -21.443 -1.992 1.00 0.00 H new ATOM 0 HG2 LYS A 48 3.110 -19.240 0.044 1.00 0.00 H new ATOM 0 HG3 LYS A 48 2.135 -20.660 -0.274 1.00 0.00 H new ATOM 0 HD2 LYS A 48 4.308 -22.024 0.354 1.00 0.00 H new ATOM 0 HD3 LYS A 48 4.870 -20.523 1.060 1.00 0.00 H new ATOM 0 HE2 LYS A 48 2.772 -20.400 2.450 1.00 0.00 H new ATOM 0 HE3 LYS A 48 2.229 -21.913 1.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 3.336 -22.273 3.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 4.226 -23.000 2.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 4.752 -21.534 3.303 1.00 0.00 H new ATOM 816 N GLU A 49 5.566 -18.769 -3.625 1.00 0.00 N ATOM 817 CA GLU A 49 6.076 -18.564 -5.016 1.00 0.00 C ATOM 818 C GLU A 49 7.451 -17.892 -4.966 1.00 0.00 C ATOM 819 O GLU A 49 7.611 -16.761 -5.382 1.00 0.00 O ATOM 820 CB GLU A 49 5.101 -17.673 -5.788 1.00 0.00 C ATOM 821 CG GLU A 49 3.669 -18.153 -5.546 1.00 0.00 C ATOM 822 CD GLU A 49 3.548 -19.620 -5.962 1.00 0.00 C ATOM 823 OE1 GLU A 49 3.990 -19.944 -7.053 1.00 0.00 O ATOM 824 OE2 GLU A 49 3.016 -20.395 -5.185 1.00 0.00 O ATOM 0 H GLU A 49 5.015 -17.997 -3.248 1.00 0.00 H new ATOM 0 HA GLU A 49 6.164 -19.529 -5.516 1.00 0.00 H new ATOM 0 HB2 GLU A 49 5.207 -16.637 -5.468 1.00 0.00 H new ATOM 0 HB3 GLU A 49 5.330 -17.702 -6.853 1.00 0.00 H new ATOM 0 HG2 GLU A 49 3.408 -18.039 -4.494 1.00 0.00 H new ATOM 0 HG3 GLU A 49 2.968 -17.543 -6.116 1.00 0.00 H new ATOM 831 N GLN A 50 8.441 -18.566 -4.450 1.00 0.00 N ATOM 832 CA GLN A 50 9.798 -17.953 -4.362 1.00 0.00 C ATOM 833 C GLN A 50 10.161 -17.280 -5.691 1.00 0.00 C ATOM 834 O GLN A 50 11.004 -16.406 -5.744 1.00 0.00 O ATOM 835 CB GLN A 50 10.822 -19.051 -4.047 1.00 0.00 C ATOM 836 CG GLN A 50 12.249 -18.489 -4.114 1.00 0.00 C ATOM 837 CD GLN A 50 12.358 -17.239 -3.239 1.00 0.00 C ATOM 838 OE1 GLN A 50 12.185 -17.308 -2.038 1.00 0.00 O ATOM 839 NE2 GLN A 50 12.639 -16.091 -3.792 1.00 0.00 N ATOM 0 H GLN A 50 8.370 -19.516 -4.085 1.00 0.00 H new ATOM 0 HA GLN A 50 9.804 -17.200 -3.574 1.00 0.00 H new ATOM 0 HB2 GLN A 50 10.632 -19.460 -3.055 1.00 0.00 H new ATOM 0 HB3 GLN A 50 10.714 -19.872 -4.756 1.00 0.00 H new ATOM 0 HG2 GLN A 50 12.962 -19.242 -3.778 1.00 0.00 H new ATOM 0 HG3 GLN A 50 12.505 -18.245 -5.145 1.00 0.00 H new ATOM 0 HE21 GLN A 50 12.784 -16.032 -4.800 1.00 0.00 H new ATOM 0 HE22 GLN A 50 12.713 -15.252 -3.216 1.00 0.00 H new ATOM 848 N GLU A 51 9.542 -17.687 -6.767 1.00 0.00 N ATOM 849 CA GLU A 51 9.868 -17.074 -8.089 1.00 0.00 C ATOM 850 C GLU A 51 9.277 -15.662 -8.184 1.00 0.00 C ATOM 851 O GLU A 51 9.778 -14.829 -8.913 1.00 0.00 O ATOM 852 CB GLU A 51 9.335 -17.948 -9.226 1.00 0.00 C ATOM 853 CG GLU A 51 10.206 -19.198 -9.362 1.00 0.00 C ATOM 854 CD GLU A 51 11.563 -18.814 -9.955 1.00 0.00 C ATOM 855 OE1 GLU A 51 11.588 -17.957 -10.823 1.00 0.00 O ATOM 856 OE2 GLU A 51 12.555 -19.383 -9.531 1.00 0.00 O ATOM 0 H GLU A 51 8.827 -18.414 -6.789 1.00 0.00 H new ATOM 0 HA GLU A 51 10.952 -17.004 -8.180 1.00 0.00 H new ATOM 0 HB2 GLU A 51 8.302 -18.232 -9.026 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.337 -17.388 -10.161 1.00 0.00 H new ATOM 0 HG2 GLU A 51 10.343 -19.666 -8.387 1.00 0.00 H new ATOM 0 HG3 GLU A 51 9.712 -19.930 -10.001 1.00 0.00 H new ATOM 863 N VAL A 52 8.254 -15.361 -7.435 1.00 0.00 N ATOM 864 CA VAL A 52 7.697 -13.978 -7.480 1.00 0.00 C ATOM 865 C VAL A 52 8.655 -13.058 -6.726 1.00 0.00 C ATOM 866 O VAL A 52 9.027 -12.009 -7.214 1.00 0.00 O ATOM 867 CB VAL A 52 6.324 -13.944 -6.802 1.00 0.00 C ATOM 868 CG1 VAL A 52 5.840 -12.494 -6.695 1.00 0.00 C ATOM 869 CG2 VAL A 52 5.324 -14.747 -7.632 1.00 0.00 C ATOM 0 H VAL A 52 7.782 -16.004 -6.799 1.00 0.00 H new ATOM 0 HA VAL A 52 7.585 -13.654 -8.515 1.00 0.00 H new ATOM 0 HB VAL A 52 6.405 -14.377 -5.805 1.00 0.00 H new ATOM 0 HG11 VAL A 52 4.863 -12.471 -6.212 1.00 0.00 H new ATOM 0 HG12 VAL A 52 6.550 -11.916 -6.104 1.00 0.00 H new ATOM 0 HG13 VAL A 52 5.762 -12.062 -7.693 1.00 0.00 H new ATOM 0 HG21 VAL A 52 4.347 -14.722 -7.149 1.00 0.00 H new ATOM 0 HG22 VAL A 52 5.247 -14.313 -8.629 1.00 0.00 H new ATOM 0 HG23 VAL A 52 5.663 -15.780 -7.711 1.00 0.00 H new ATOM 879 N VAL A 53 9.070 -13.435 -5.552 1.00 0.00 N ATOM 880 CA VAL A 53 10.012 -12.566 -4.798 1.00 0.00 C ATOM 881 C VAL A 53 11.318 -12.452 -5.583 1.00 0.00 C ATOM 882 O VAL A 53 11.967 -11.425 -5.583 1.00 0.00 O ATOM 883 CB VAL A 53 10.288 -13.181 -3.425 1.00 0.00 C ATOM 884 CG1 VAL A 53 11.370 -12.370 -2.709 1.00 0.00 C ATOM 885 CG2 VAL A 53 9.003 -13.160 -2.593 1.00 0.00 C ATOM 0 H VAL A 53 8.801 -14.300 -5.084 1.00 0.00 H new ATOM 0 HA VAL A 53 9.576 -11.576 -4.664 1.00 0.00 H new ATOM 0 HB VAL A 53 10.628 -14.209 -3.549 1.00 0.00 H new ATOM 0 HG11 VAL A 53 11.566 -12.809 -1.731 1.00 0.00 H new ATOM 0 HG12 VAL A 53 12.285 -12.381 -3.302 1.00 0.00 H new ATOM 0 HG13 VAL A 53 11.031 -11.342 -2.584 1.00 0.00 H new ATOM 0 HG21 VAL A 53 9.196 -13.598 -1.614 1.00 0.00 H new ATOM 0 HG22 VAL A 53 8.666 -12.131 -2.470 1.00 0.00 H new ATOM 0 HG23 VAL A 53 8.231 -13.737 -3.102 1.00 0.00 H new ATOM 895 N ASP A 54 11.708 -13.500 -6.254 1.00 0.00 N ATOM 896 CA ASP A 54 12.971 -13.450 -7.040 1.00 0.00 C ATOM 897 C ASP A 54 12.893 -12.315 -8.063 1.00 0.00 C ATOM 898 O ASP A 54 13.838 -11.577 -8.257 1.00 0.00 O ATOM 899 CB ASP A 54 13.174 -14.780 -7.769 1.00 0.00 C ATOM 900 CG ASP A 54 13.541 -15.869 -6.758 1.00 0.00 C ATOM 901 OD1 ASP A 54 14.117 -15.531 -5.738 1.00 0.00 O ATOM 902 OD2 ASP A 54 13.239 -17.021 -7.023 1.00 0.00 O ATOM 0 H ASP A 54 11.207 -14.388 -6.292 1.00 0.00 H new ATOM 0 HA ASP A 54 13.809 -13.274 -6.366 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.264 -15.056 -8.302 1.00 0.00 H new ATOM 0 HB3 ASP A 54 13.963 -14.681 -8.514 1.00 0.00 H new ATOM 907 N LYS A 55 11.776 -12.177 -8.730 1.00 0.00 N ATOM 908 CA LYS A 55 11.651 -11.096 -9.749 1.00 0.00 C ATOM 909 C LYS A 55 11.603 -9.734 -9.058 1.00 0.00 C ATOM 910 O LYS A 55 12.001 -8.736 -9.623 1.00 0.00 O ATOM 911 CB LYS A 55 10.388 -11.299 -10.584 1.00 0.00 C ATOM 912 CG LYS A 55 10.555 -12.533 -11.481 1.00 0.00 C ATOM 913 CD LYS A 55 9.384 -12.636 -12.477 1.00 0.00 C ATOM 914 CE LYS A 55 8.185 -13.331 -11.820 1.00 0.00 C ATOM 915 NZ LYS A 55 8.478 -14.784 -11.670 1.00 0.00 N ATOM 0 H LYS A 55 10.950 -12.764 -8.613 1.00 0.00 H new ATOM 0 HA LYS A 55 12.518 -11.133 -10.409 1.00 0.00 H new ATOM 0 HB2 LYS A 55 9.525 -11.426 -9.931 1.00 0.00 H new ATOM 0 HB3 LYS A 55 10.198 -10.416 -11.195 1.00 0.00 H new ATOM 0 HG2 LYS A 55 11.498 -12.471 -12.024 1.00 0.00 H new ATOM 0 HG3 LYS A 55 10.599 -13.433 -10.868 1.00 0.00 H new ATOM 0 HD2 LYS A 55 9.096 -11.640 -12.814 1.00 0.00 H new ATOM 0 HD3 LYS A 55 9.697 -13.193 -13.360 1.00 0.00 H new ATOM 0 HE2 LYS A 55 7.982 -12.887 -10.845 1.00 0.00 H new ATOM 0 HE3 LYS A 55 7.291 -13.190 -12.427 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 7.591 -15.324 -11.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 9.115 -15.090 -12.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 8.933 -14.953 -10.750 1.00 0.00 H new ATOM 929 N VAL A 56 11.157 -9.674 -7.834 1.00 0.00 N ATOM 930 CA VAL A 56 11.138 -8.366 -7.124 1.00 0.00 C ATOM 931 C VAL A 56 12.583 -7.923 -6.905 1.00 0.00 C ATOM 932 O VAL A 56 12.991 -6.862 -7.333 1.00 0.00 O ATOM 933 CB VAL A 56 10.442 -8.537 -5.772 1.00 0.00 C ATOM 934 CG1 VAL A 56 10.501 -7.220 -4.997 1.00 0.00 C ATOM 935 CG2 VAL A 56 8.979 -8.931 -5.999 1.00 0.00 C ATOM 0 H VAL A 56 10.807 -10.468 -7.298 1.00 0.00 H new ATOM 0 HA VAL A 56 10.601 -7.620 -7.710 1.00 0.00 H new ATOM 0 HB VAL A 56 10.945 -9.317 -5.200 1.00 0.00 H new ATOM 0 HG11 VAL A 56 10.005 -7.342 -4.034 1.00 0.00 H new ATOM 0 HG12 VAL A 56 11.542 -6.939 -4.836 1.00 0.00 H new ATOM 0 HG13 VAL A 56 9.998 -6.439 -5.568 1.00 0.00 H new ATOM 0 HG21 VAL A 56 8.482 -9.053 -5.037 1.00 0.00 H new ATOM 0 HG22 VAL A 56 8.477 -8.151 -6.571 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.936 -9.870 -6.551 1.00 0.00 H new ATOM 945 N MET A 57 13.362 -8.731 -6.241 1.00 0.00 N ATOM 946 CA MET A 57 14.781 -8.360 -5.993 1.00 0.00 C ATOM 947 C MET A 57 15.462 -8.014 -7.323 1.00 0.00 C ATOM 948 O MET A 57 16.405 -7.249 -7.364 1.00 0.00 O ATOM 949 CB MET A 57 15.505 -9.545 -5.331 1.00 0.00 C ATOM 950 CG MET A 57 15.247 -9.540 -3.819 1.00 0.00 C ATOM 951 SD MET A 57 13.466 -9.458 -3.504 1.00 0.00 S ATOM 952 CE MET A 57 13.549 -9.599 -1.700 1.00 0.00 C ATOM 0 H MET A 57 13.076 -9.633 -5.860 1.00 0.00 H new ATOM 0 HA MET A 57 14.824 -7.493 -5.334 1.00 0.00 H new ATOM 0 HB2 MET A 57 15.157 -10.483 -5.764 1.00 0.00 H new ATOM 0 HB3 MET A 57 16.576 -9.482 -5.526 1.00 0.00 H new ATOM 0 HG2 MET A 57 15.665 -10.439 -3.366 1.00 0.00 H new ATOM 0 HG3 MET A 57 15.747 -8.688 -3.358 1.00 0.00 H new ATOM 0 HE1 MET A 57 12.541 -9.570 -1.286 1.00 0.00 H new ATOM 0 HE2 MET A 57 14.025 -10.542 -1.430 1.00 0.00 H new ATOM 0 HE3 MET A 57 14.131 -8.770 -1.297 1.00 0.00 H new ATOM 962 N GLU A 58 14.983 -8.556 -8.418 1.00 0.00 N ATOM 963 CA GLU A 58 15.593 -8.242 -9.747 1.00 0.00 C ATOM 964 C GLU A 58 14.955 -6.979 -10.334 1.00 0.00 C ATOM 965 O GLU A 58 15.625 -6.179 -10.956 1.00 0.00 O ATOM 966 CB GLU A 58 15.415 -9.421 -10.707 1.00 0.00 C ATOM 967 CG GLU A 58 16.294 -9.214 -11.943 1.00 0.00 C ATOM 968 CD GLU A 58 15.835 -10.153 -13.060 1.00 0.00 C ATOM 969 OE1 GLU A 58 15.198 -11.146 -12.748 1.00 0.00 O ATOM 970 OE2 GLU A 58 16.128 -9.863 -14.209 1.00 0.00 O ATOM 0 H GLU A 58 14.195 -9.203 -8.447 1.00 0.00 H new ATOM 0 HA GLU A 58 16.660 -8.065 -9.609 1.00 0.00 H new ATOM 0 HB2 GLU A 58 15.684 -10.352 -10.209 1.00 0.00 H new ATOM 0 HB3 GLU A 58 14.369 -9.508 -11.002 1.00 0.00 H new ATOM 0 HG2 GLU A 58 16.233 -8.178 -12.276 1.00 0.00 H new ATOM 0 HG3 GLU A 58 17.338 -9.408 -11.696 1.00 0.00 H new ATOM 977 N THR A 59 13.678 -6.775 -10.150 1.00 0.00 N ATOM 978 CA THR A 59 13.056 -5.543 -10.716 1.00 0.00 C ATOM 979 C THR A 59 13.617 -4.334 -9.966 1.00 0.00 C ATOM 980 O THR A 59 14.071 -3.385 -10.574 1.00 0.00 O ATOM 981 CB THR A 59 11.530 -5.602 -10.588 1.00 0.00 C ATOM 982 OG1 THR A 59 11.087 -6.927 -10.851 1.00 0.00 O ATOM 983 CG2 THR A 59 10.892 -4.640 -11.593 1.00 0.00 C ATOM 0 H THR A 59 13.048 -7.396 -9.642 1.00 0.00 H new ATOM 0 HA THR A 59 13.292 -5.461 -11.777 1.00 0.00 H new ATOM 0 HB THR A 59 11.238 -5.313 -9.578 1.00 0.00 H new ATOM 0 HG1 THR A 59 11.212 -7.479 -10.051 1.00 0.00 H new ATOM 0 HG21 THR A 59 9.807 -4.684 -11.500 1.00 0.00 H new ATOM 0 HG22 THR A 59 11.233 -3.624 -11.391 1.00 0.00 H new ATOM 0 HG23 THR A 59 11.181 -4.926 -12.604 1.00 0.00 H new ATOM 991 N LEU A 60 13.645 -4.364 -8.667 1.00 0.00 N ATOM 992 CA LEU A 60 14.243 -3.218 -7.933 1.00 0.00 C ATOM 993 C LEU A 60 15.683 -3.053 -8.420 1.00 0.00 C ATOM 994 O LEU A 60 16.071 -1.998 -8.879 1.00 0.00 O ATOM 995 CB LEU A 60 14.235 -3.509 -6.421 1.00 0.00 C ATOM 996 CG LEU A 60 12.904 -3.059 -5.805 1.00 0.00 C ATOM 997 CD1 LEU A 60 11.765 -3.916 -6.358 1.00 0.00 C ATOM 998 CD2 LEU A 60 12.969 -3.218 -4.286 1.00 0.00 C ATOM 0 H LEU A 60 13.285 -5.122 -8.087 1.00 0.00 H new ATOM 0 HA LEU A 60 13.672 -2.307 -8.114 1.00 0.00 H new ATOM 0 HB2 LEU A 60 14.383 -4.575 -6.247 1.00 0.00 H new ATOM 0 HB3 LEU A 60 15.062 -2.989 -5.938 1.00 0.00 H new ATOM 0 HG LEU A 60 12.724 -2.014 -6.056 1.00 0.00 H new ATOM 0 HD11 LEU A 60 10.821 -3.594 -5.919 1.00 0.00 H new ATOM 0 HD12 LEU A 60 11.718 -3.804 -7.441 1.00 0.00 H new ATOM 0 HD13 LEU A 60 11.943 -4.962 -6.109 1.00 0.00 H new ATOM 0 HD21 LEU A 60 12.024 -2.899 -3.846 1.00 0.00 H new ATOM 0 HD22 LEU A 60 13.150 -4.264 -4.037 1.00 0.00 H new ATOM 0 HD23 LEU A 60 13.779 -2.605 -3.890 1.00 0.00 H new ATOM 1010 N ASP A 61 16.476 -4.088 -8.343 1.00 0.00 N ATOM 1011 CA ASP A 61 17.883 -3.976 -8.822 1.00 0.00 C ATOM 1012 C ASP A 61 17.885 -3.364 -10.225 1.00 0.00 C ATOM 1013 O ASP A 61 18.847 -2.750 -10.644 1.00 0.00 O ATOM 1014 CB ASP A 61 18.519 -5.366 -8.873 1.00 0.00 C ATOM 1015 CG ASP A 61 18.708 -5.896 -7.451 1.00 0.00 C ATOM 1016 OD1 ASP A 61 18.751 -5.087 -6.539 1.00 0.00 O ATOM 1017 OD2 ASP A 61 18.806 -7.103 -7.298 1.00 0.00 O ATOM 0 H ASP A 61 16.212 -5.001 -7.971 1.00 0.00 H new ATOM 0 HA ASP A 61 18.453 -3.344 -8.142 1.00 0.00 H new ATOM 0 HB2 ASP A 61 17.887 -6.046 -9.444 1.00 0.00 H new ATOM 0 HB3 ASP A 61 19.480 -5.319 -9.385 1.00 0.00 H new ATOM 1022 N GLU A 62 16.806 -3.523 -10.953 1.00 0.00 N ATOM 1023 CA GLU A 62 16.728 -2.950 -12.334 1.00 0.00 C ATOM 1024 C GLU A 62 15.967 -1.632 -12.280 1.00 0.00 C ATOM 1025 O GLU A 62 15.174 -1.305 -13.140 1.00 0.00 O ATOM 1026 CB GLU A 62 15.987 -3.896 -13.230 1.00 0.00 C ATOM 1027 CG GLU A 62 16.834 -5.141 -13.503 1.00 0.00 C ATOM 1028 CD GLU A 62 17.923 -4.805 -14.524 1.00 0.00 C ATOM 1029 OE1 GLU A 62 17.579 -4.308 -15.584 1.00 0.00 O ATOM 1030 OE2 GLU A 62 19.081 -5.049 -14.230 1.00 0.00 O ATOM 0 H GLU A 62 15.973 -4.027 -10.649 1.00 0.00 H new ATOM 0 HA GLU A 62 17.735 -2.791 -12.719 1.00 0.00 H new ATOM 0 HB2 GLU A 62 15.044 -4.184 -12.766 1.00 0.00 H new ATOM 0 HB3 GLU A 62 15.742 -3.401 -14.170 1.00 0.00 H new ATOM 0 HG2 GLU A 62 17.286 -5.496 -12.577 1.00 0.00 H new ATOM 0 HG3 GLU A 62 16.204 -5.947 -13.880 1.00 0.00 H new ATOM 1037 N ASP A 63 16.224 -0.893 -11.273 1.00 0.00 N ATOM 1038 CA ASP A 63 15.559 0.429 -11.092 1.00 0.00 C ATOM 1039 C ASP A 63 15.561 1.197 -12.409 1.00 0.00 C ATOM 1040 O ASP A 63 14.594 1.836 -12.773 1.00 0.00 O ATOM 1041 CB ASP A 63 16.381 1.232 -10.081 1.00 0.00 C ATOM 1042 CG ASP A 63 15.792 2.638 -9.936 1.00 0.00 C ATOM 1043 OD1 ASP A 63 14.742 2.881 -10.508 1.00 0.00 O ATOM 1044 OD2 ASP A 63 16.403 3.447 -9.258 1.00 0.00 O ATOM 0 H ASP A 63 16.884 -1.140 -10.535 1.00 0.00 H new ATOM 0 HA ASP A 63 14.533 0.281 -10.754 1.00 0.00 H new ATOM 0 HB2 ASP A 63 16.382 0.726 -9.115 1.00 0.00 H new ATOM 0 HB3 ASP A 63 17.419 1.294 -10.409 1.00 0.00 H new ATOM 1049 N GLY A 64 16.635 1.102 -13.138 1.00 0.00 N ATOM 1050 CA GLY A 64 16.727 1.788 -14.461 1.00 0.00 C ATOM 1051 C GLY A 64 16.357 3.277 -14.357 1.00 0.00 C ATOM 1052 O GLY A 64 16.453 3.996 -15.331 1.00 0.00 O ATOM 0 H GLY A 64 17.465 0.572 -12.873 1.00 0.00 H new ATOM 0 HA2 GLY A 64 17.740 1.691 -14.851 1.00 0.00 H new ATOM 0 HA3 GLY A 64 16.063 1.297 -15.172 1.00 0.00 H new ATOM 1056 N ASP A 65 15.925 3.754 -13.202 1.00 0.00 N ATOM 1057 CA ASP A 65 15.537 5.211 -13.066 1.00 0.00 C ATOM 1058 C ASP A 65 16.540 6.018 -12.197 1.00 0.00 C ATOM 1059 O ASP A 65 16.450 7.227 -12.146 1.00 0.00 O ATOM 1060 CB ASP A 65 14.153 5.291 -12.422 1.00 0.00 C ATOM 1061 CG ASP A 65 13.585 6.698 -12.610 1.00 0.00 C ATOM 1062 OD1 ASP A 65 13.817 7.273 -13.660 1.00 0.00 O ATOM 1063 OD2 ASP A 65 12.929 7.178 -11.700 1.00 0.00 O ATOM 0 H ASP A 65 15.824 3.201 -12.351 1.00 0.00 H new ATOM 0 HA ASP A 65 15.541 5.649 -14.064 1.00 0.00 H new ATOM 0 HB2 ASP A 65 13.487 4.555 -12.873 1.00 0.00 H new ATOM 0 HB3 ASP A 65 14.220 5.053 -11.360 1.00 0.00 H new ATOM 1068 N GLY A 66 17.497 5.406 -11.526 1.00 0.00 N ATOM 1069 CA GLY A 66 18.462 6.207 -10.710 1.00 0.00 C ATOM 1070 C GLY A 66 17.854 6.579 -9.351 1.00 0.00 C ATOM 1071 O GLY A 66 18.565 6.740 -8.380 1.00 0.00 O ATOM 0 H GLY A 66 17.646 4.397 -11.511 1.00 0.00 H new ATOM 0 HA2 GLY A 66 19.378 5.636 -10.559 1.00 0.00 H new ATOM 0 HA3 GLY A 66 18.737 7.113 -11.250 1.00 0.00 H new ATOM 1075 N GLU A 67 16.552 6.707 -9.260 1.00 0.00 N ATOM 1076 CA GLU A 67 15.929 7.062 -7.940 1.00 0.00 C ATOM 1077 C GLU A 67 14.526 6.454 -7.835 1.00 0.00 C ATOM 1078 O GLU A 67 13.722 6.578 -8.738 1.00 0.00 O ATOM 1079 CB GLU A 67 15.820 8.587 -7.804 1.00 0.00 C ATOM 1080 CG GLU A 67 17.218 9.224 -7.692 1.00 0.00 C ATOM 1081 CD GLU A 67 17.818 9.434 -9.088 1.00 0.00 C ATOM 1082 OE1 GLU A 67 17.071 9.777 -9.989 1.00 0.00 O ATOM 1083 OE2 GLU A 67 19.016 9.250 -9.228 1.00 0.00 O ATOM 0 H GLU A 67 15.897 6.583 -10.032 1.00 0.00 H new ATOM 0 HA GLU A 67 16.559 6.665 -7.144 1.00 0.00 H new ATOM 0 HB2 GLU A 67 15.296 8.998 -8.667 1.00 0.00 H new ATOM 0 HB3 GLU A 67 15.229 8.837 -6.923 1.00 0.00 H new ATOM 0 HG2 GLU A 67 17.150 10.179 -7.170 1.00 0.00 H new ATOM 0 HG3 GLU A 67 17.871 8.583 -7.100 1.00 0.00 H new ATOM 1090 N CYS A 68 14.217 5.813 -6.731 1.00 0.00 N ATOM 1091 CA CYS A 68 12.856 5.209 -6.551 1.00 0.00 C ATOM 1092 C CYS A 68 12.041 6.077 -5.585 1.00 0.00 C ATOM 1093 O CYS A 68 12.487 6.402 -4.502 1.00 0.00 O ATOM 1094 CB CYS A 68 12.995 3.800 -5.970 1.00 0.00 C ATOM 1095 SG CYS A 68 14.051 2.803 -7.050 1.00 0.00 S ATOM 0 H CYS A 68 14.852 5.682 -5.943 1.00 0.00 H new ATOM 0 HA CYS A 68 12.350 5.157 -7.515 1.00 0.00 H new ATOM 0 HB2 CYS A 68 13.423 3.849 -4.969 1.00 0.00 H new ATOM 0 HB3 CYS A 68 12.013 3.336 -5.874 1.00 0.00 H new ATOM 0 HG CYS A 68 14.898 3.576 -7.662 1.00 0.00 H new ATOM 1101 N ASP A 69 10.853 6.464 -5.971 1.00 0.00 N ATOM 1102 CA ASP A 69 10.012 7.322 -5.081 1.00 0.00 C ATOM 1103 C ASP A 69 9.214 6.449 -4.106 1.00 0.00 C ATOM 1104 O ASP A 69 9.396 5.250 -4.036 1.00 0.00 O ATOM 1105 CB ASP A 69 9.042 8.139 -5.934 1.00 0.00 C ATOM 1106 CG ASP A 69 9.821 8.887 -7.017 1.00 0.00 C ATOM 1107 OD1 ASP A 69 10.796 8.340 -7.504 1.00 0.00 O ATOM 1108 OD2 ASP A 69 9.429 9.996 -7.341 1.00 0.00 O ATOM 0 H ASP A 69 10.427 6.223 -6.866 1.00 0.00 H new ATOM 0 HA ASP A 69 10.662 7.989 -4.514 1.00 0.00 H new ATOM 0 HB2 ASP A 69 8.302 7.483 -6.391 1.00 0.00 H new ATOM 0 HB3 ASP A 69 8.498 8.846 -5.308 1.00 0.00 H new ATOM 1113 N PHE A 70 8.322 7.047 -3.361 1.00 0.00 N ATOM 1114 CA PHE A 70 7.498 6.260 -2.396 1.00 0.00 C ATOM 1115 C PHE A 70 6.450 5.463 -3.173 1.00 0.00 C ATOM 1116 O PHE A 70 6.134 4.342 -2.827 1.00 0.00 O ATOM 1117 CB PHE A 70 6.809 7.217 -1.415 1.00 0.00 C ATOM 1118 CG PHE A 70 6.108 6.439 -0.321 1.00 0.00 C ATOM 1119 CD1 PHE A 70 4.895 5.787 -0.583 1.00 0.00 C ATOM 1120 CD2 PHE A 70 6.669 6.379 0.961 1.00 0.00 C ATOM 1121 CE1 PHE A 70 4.247 5.076 0.435 1.00 0.00 C ATOM 1122 CE2 PHE A 70 6.020 5.668 1.978 1.00 0.00 C ATOM 1123 CZ PHE A 70 4.810 5.017 1.715 1.00 0.00 C ATOM 0 H PHE A 70 8.128 8.048 -3.379 1.00 0.00 H new ATOM 0 HA PHE A 70 8.133 5.574 -1.835 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.546 7.890 -0.976 1.00 0.00 H new ATOM 0 HB3 PHE A 70 6.088 7.837 -1.948 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.460 5.833 -1.570 1.00 0.00 H new ATOM 0 HD2 PHE A 70 7.603 6.882 1.165 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.313 4.573 0.232 1.00 0.00 H new ATOM 0 HE2 PHE A 70 6.454 5.622 2.966 1.00 0.00 H new ATOM 0 HZ PHE A 70 4.310 4.469 2.500 1.00 0.00 H new ATOM 1133 N GLN A 71 5.909 6.017 -4.220 1.00 0.00 N ATOM 1134 CA GLN A 71 4.890 5.263 -5.001 1.00 0.00 C ATOM 1135 C GLN A 71 5.485 3.914 -5.413 1.00 0.00 C ATOM 1136 O GLN A 71 4.811 2.903 -5.417 1.00 0.00 O ATOM 1137 CB GLN A 71 4.510 6.062 -6.250 1.00 0.00 C ATOM 1138 CG GLN A 71 3.298 5.415 -6.924 1.00 0.00 C ATOM 1139 CD GLN A 71 3.039 6.095 -8.269 1.00 0.00 C ATOM 1140 OE1 GLN A 71 3.964 6.470 -8.961 1.00 0.00 O ATOM 1141 NE2 GLN A 71 1.810 6.272 -8.671 1.00 0.00 N ATOM 0 H GLN A 71 6.125 6.951 -4.567 1.00 0.00 H new ATOM 0 HA GLN A 71 3.998 5.104 -4.395 1.00 0.00 H new ATOM 0 HB2 GLN A 71 4.281 7.093 -5.979 1.00 0.00 H new ATOM 0 HB3 GLN A 71 5.350 6.094 -6.943 1.00 0.00 H new ATOM 0 HG2 GLN A 71 3.476 4.350 -7.071 1.00 0.00 H new ATOM 0 HG3 GLN A 71 2.421 5.506 -6.284 1.00 0.00 H new ATOM 0 HE21 GLN A 71 1.033 5.957 -8.090 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.626 6.725 -9.566 1.00 0.00 H new ATOM 1150 N GLU A 72 6.746 3.889 -5.750 1.00 0.00 N ATOM 1151 CA GLU A 72 7.388 2.604 -6.150 1.00 0.00 C ATOM 1152 C GLU A 72 7.582 1.715 -4.917 1.00 0.00 C ATOM 1153 O GLU A 72 7.599 0.506 -5.006 1.00 0.00 O ATOM 1154 CB GLU A 72 8.739 2.881 -6.812 1.00 0.00 C ATOM 1155 CG GLU A 72 8.595 4.039 -7.803 1.00 0.00 C ATOM 1156 CD GLU A 72 9.861 4.143 -8.654 1.00 0.00 C ATOM 1157 OE1 GLU A 72 10.822 3.464 -8.335 1.00 0.00 O ATOM 1158 OE2 GLU A 72 9.848 4.901 -9.611 1.00 0.00 O ATOM 0 H GLU A 72 7.360 4.703 -5.766 1.00 0.00 H new ATOM 0 HA GLU A 72 6.743 2.089 -6.862 1.00 0.00 H new ATOM 0 HB2 GLU A 72 9.483 3.127 -6.055 1.00 0.00 H new ATOM 0 HB3 GLU A 72 9.093 1.989 -7.328 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.727 3.879 -8.442 1.00 0.00 H new ATOM 0 HG3 GLU A 72 8.427 4.973 -7.266 1.00 0.00 H new ATOM 1165 N PHE A 73 7.680 2.306 -3.758 1.00 0.00 N ATOM 1166 CA PHE A 73 7.824 1.499 -2.510 1.00 0.00 C ATOM 1167 C PHE A 73 6.466 0.883 -2.168 1.00 0.00 C ATOM 1168 O PHE A 73 6.391 -0.252 -1.748 1.00 0.00 O ATOM 1169 CB PHE A 73 8.331 2.385 -1.365 1.00 0.00 C ATOM 1170 CG PHE A 73 8.231 1.650 -0.046 1.00 0.00 C ATOM 1171 CD1 PHE A 73 9.195 0.694 0.300 1.00 0.00 C ATOM 1172 CD2 PHE A 73 7.180 1.934 0.836 1.00 0.00 C ATOM 1173 CE1 PHE A 73 9.105 0.022 1.526 1.00 0.00 C ATOM 1174 CE2 PHE A 73 7.092 1.262 2.062 1.00 0.00 C ATOM 1175 CZ PHE A 73 8.055 0.306 2.407 1.00 0.00 C ATOM 0 H PHE A 73 7.667 3.316 -3.620 1.00 0.00 H new ATOM 0 HA PHE A 73 8.552 0.702 -2.659 1.00 0.00 H new ATOM 0 HB2 PHE A 73 9.366 2.673 -1.550 1.00 0.00 H new ATOM 0 HB3 PHE A 73 7.747 3.304 -1.322 1.00 0.00 H new ATOM 0 HD1 PHE A 73 10.007 0.475 -0.378 1.00 0.00 H new ATOM 0 HD2 PHE A 73 6.437 2.672 0.570 1.00 0.00 H new ATOM 0 HE1 PHE A 73 9.847 -0.716 1.792 1.00 0.00 H new ATOM 0 HE2 PHE A 73 6.281 1.481 2.741 1.00 0.00 H new ATOM 0 HZ PHE A 73 7.988 -0.212 3.352 1.00 0.00 H new ATOM 1185 N MET A 74 5.394 1.588 -2.355 1.00 0.00 N ATOM 1186 CA MET A 74 4.075 0.971 -2.041 1.00 0.00 C ATOM 1187 C MET A 74 3.794 -0.142 -3.064 1.00 0.00 C ATOM 1188 O MET A 74 3.502 -1.261 -2.690 1.00 0.00 O ATOM 1189 CB MET A 74 2.969 2.037 -2.085 1.00 0.00 C ATOM 1190 CG MET A 74 1.790 1.608 -1.201 1.00 0.00 C ATOM 1191 SD MET A 74 2.180 1.969 0.535 1.00 0.00 S ATOM 1192 CE MET A 74 2.116 0.275 1.177 1.00 0.00 C ATOM 0 H MET A 74 5.367 2.546 -2.704 1.00 0.00 H new ATOM 0 HA MET A 74 4.094 0.545 -1.038 1.00 0.00 H new ATOM 0 HB2 MET A 74 3.362 2.994 -1.742 1.00 0.00 H new ATOM 0 HB3 MET A 74 2.631 2.180 -3.111 1.00 0.00 H new ATOM 0 HG2 MET A 74 0.885 2.137 -1.500 1.00 0.00 H new ATOM 0 HG3 MET A 74 1.594 0.543 -1.328 1.00 0.00 H new ATOM 0 HE1 MET A 74 2.100 0.299 2.267 1.00 0.00 H new ATOM 0 HE2 MET A 74 1.215 -0.219 0.812 1.00 0.00 H new ATOM 0 HE3 MET A 74 2.994 -0.276 0.839 1.00 0.00 H new ATOM 1202 N ALA A 75 3.868 0.126 -4.338 1.00 0.00 N ATOM 1203 CA ALA A 75 3.593 -0.945 -5.342 1.00 0.00 C ATOM 1204 C ALA A 75 4.526 -2.147 -5.152 1.00 0.00 C ATOM 1205 O ALA A 75 4.074 -3.270 -5.057 1.00 0.00 O ATOM 1206 CB ALA A 75 3.794 -0.375 -6.747 1.00 0.00 C ATOM 0 H ALA A 75 4.106 1.038 -4.729 1.00 0.00 H new ATOM 0 HA ALA A 75 2.566 -1.285 -5.206 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.595 -1.151 -7.486 1.00 0.00 H new ATOM 0 HB2 ALA A 75 3.109 0.459 -6.903 1.00 0.00 H new ATOM 0 HB3 ALA A 75 4.821 -0.026 -6.855 1.00 0.00 H new ATOM 1212 N PHE A 76 5.813 -1.946 -5.118 1.00 0.00 N ATOM 1213 CA PHE A 76 6.724 -3.124 -4.961 1.00 0.00 C ATOM 1214 C PHE A 76 6.450 -3.815 -3.619 1.00 0.00 C ATOM 1215 O PHE A 76 6.553 -5.020 -3.499 1.00 0.00 O ATOM 1216 CB PHE A 76 8.199 -2.673 -5.037 1.00 0.00 C ATOM 1217 CG PHE A 76 8.653 -2.622 -6.487 1.00 0.00 C ATOM 1218 CD1 PHE A 76 8.645 -3.789 -7.266 1.00 0.00 C ATOM 1219 CD2 PHE A 76 9.071 -1.410 -7.055 1.00 0.00 C ATOM 1220 CE1 PHE A 76 9.053 -3.741 -8.603 1.00 0.00 C ATOM 1221 CE2 PHE A 76 9.481 -1.366 -8.392 1.00 0.00 C ATOM 1222 CZ PHE A 76 9.470 -2.531 -9.167 1.00 0.00 C ATOM 0 H PHE A 76 6.271 -1.038 -5.190 1.00 0.00 H new ATOM 0 HA PHE A 76 6.535 -3.829 -5.770 1.00 0.00 H new ATOM 0 HB2 PHE A 76 8.312 -1.691 -4.577 1.00 0.00 H new ATOM 0 HB3 PHE A 76 8.828 -3.363 -4.474 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.324 -4.725 -6.833 1.00 0.00 H new ATOM 0 HD2 PHE A 76 9.076 -0.509 -6.459 1.00 0.00 H new ATOM 0 HE1 PHE A 76 9.046 -4.640 -9.201 1.00 0.00 H new ATOM 0 HE2 PHE A 76 9.806 -0.432 -8.826 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.783 -2.496 -10.200 1.00 0.00 H new ATOM 1232 N VAL A 77 6.095 -3.066 -2.619 1.00 0.00 N ATOM 1233 CA VAL A 77 5.807 -3.690 -1.295 1.00 0.00 C ATOM 1234 C VAL A 77 4.527 -4.528 -1.404 1.00 0.00 C ATOM 1235 O VAL A 77 4.390 -5.553 -0.767 1.00 0.00 O ATOM 1236 CB VAL A 77 5.635 -2.585 -0.241 1.00 0.00 C ATOM 1237 CG1 VAL A 77 4.982 -3.158 1.025 1.00 0.00 C ATOM 1238 CG2 VAL A 77 7.013 -1.999 0.113 1.00 0.00 C ATOM 0 H VAL A 77 5.991 -2.052 -2.656 1.00 0.00 H new ATOM 0 HA VAL A 77 6.632 -4.337 -0.996 1.00 0.00 H new ATOM 0 HB VAL A 77 4.994 -1.802 -0.647 1.00 0.00 H new ATOM 0 HG11 VAL A 77 4.865 -2.366 1.765 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.004 -3.569 0.776 1.00 0.00 H new ATOM 0 HG13 VAL A 77 5.613 -3.947 1.435 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.894 -1.215 0.861 1.00 0.00 H new ATOM 0 HG22 VAL A 77 7.652 -2.787 0.512 1.00 0.00 H new ATOM 0 HG23 VAL A 77 7.471 -1.580 -0.783 1.00 0.00 H new ATOM 1248 N SER A 78 3.591 -4.102 -2.207 1.00 0.00 N ATOM 1249 CA SER A 78 2.326 -4.876 -2.354 1.00 0.00 C ATOM 1250 C SER A 78 2.622 -6.235 -2.999 1.00 0.00 C ATOM 1251 O SER A 78 2.136 -7.256 -2.556 1.00 0.00 O ATOM 1252 CB SER A 78 1.356 -4.095 -3.241 1.00 0.00 C ATOM 1253 OG SER A 78 0.054 -4.653 -3.119 1.00 0.00 O ATOM 0 H SER A 78 3.647 -3.252 -2.768 1.00 0.00 H new ATOM 0 HA SER A 78 1.882 -5.033 -1.371 1.00 0.00 H new ATOM 0 HB2 SER A 78 1.343 -3.045 -2.949 1.00 0.00 H new ATOM 0 HB3 SER A 78 1.684 -4.133 -4.280 1.00 0.00 H new ATOM 0 HG SER A 78 -0.570 -4.153 -3.685 1.00 0.00 H new ATOM 1259 N MET A 79 3.393 -6.259 -4.051 1.00 0.00 N ATOM 1260 CA MET A 79 3.690 -7.555 -4.727 1.00 0.00 C ATOM 1261 C MET A 79 4.277 -8.552 -3.730 1.00 0.00 C ATOM 1262 O MET A 79 3.799 -9.658 -3.592 1.00 0.00 O ATOM 1263 CB MET A 79 4.699 -7.317 -5.855 1.00 0.00 C ATOM 1264 CG MET A 79 4.010 -6.620 -7.033 1.00 0.00 C ATOM 1265 SD MET A 79 3.110 -7.845 -8.014 1.00 0.00 S ATOM 1266 CE MET A 79 4.480 -8.322 -9.097 1.00 0.00 C ATOM 0 H MET A 79 3.830 -5.439 -4.472 1.00 0.00 H new ATOM 0 HA MET A 79 2.764 -7.963 -5.133 1.00 0.00 H new ATOM 0 HB2 MET A 79 5.525 -6.706 -5.492 1.00 0.00 H new ATOM 0 HB3 MET A 79 5.124 -8.266 -6.181 1.00 0.00 H new ATOM 0 HG2 MET A 79 3.324 -5.856 -6.667 1.00 0.00 H new ATOM 0 HG3 MET A 79 4.750 -6.114 -7.653 1.00 0.00 H new ATOM 0 HE1 MET A 79 4.141 -9.085 -9.798 1.00 0.00 H new ATOM 0 HE2 MET A 79 4.827 -7.449 -9.650 1.00 0.00 H new ATOM 0 HE3 MET A 79 5.298 -8.720 -8.496 1.00 0.00 H new ATOM 1276 N VAL A 80 5.321 -8.180 -3.049 1.00 0.00 N ATOM 1277 CA VAL A 80 5.943 -9.130 -2.080 1.00 0.00 C ATOM 1278 C VAL A 80 4.881 -9.619 -1.092 1.00 0.00 C ATOM 1279 O VAL A 80 4.861 -10.772 -0.711 1.00 0.00 O ATOM 1280 CB VAL A 80 7.063 -8.427 -1.307 1.00 0.00 C ATOM 1281 CG1 VAL A 80 7.627 -9.380 -0.251 1.00 0.00 C ATOM 1282 CG2 VAL A 80 8.180 -8.025 -2.272 1.00 0.00 C ATOM 0 H VAL A 80 5.771 -7.267 -3.118 1.00 0.00 H new ATOM 0 HA VAL A 80 6.357 -9.977 -2.627 1.00 0.00 H new ATOM 0 HB VAL A 80 6.663 -7.536 -0.823 1.00 0.00 H new ATOM 0 HG11 VAL A 80 8.424 -8.882 0.300 1.00 0.00 H new ATOM 0 HG12 VAL A 80 6.834 -9.669 0.439 1.00 0.00 H new ATOM 0 HG13 VAL A 80 8.025 -10.270 -0.739 1.00 0.00 H new ATOM 0 HG21 VAL A 80 8.976 -7.525 -1.720 1.00 0.00 H new ATOM 0 HG22 VAL A 80 8.579 -8.915 -2.757 1.00 0.00 H new ATOM 0 HG23 VAL A 80 7.782 -7.348 -3.028 1.00 0.00 H new ATOM 1292 N THR A 81 3.991 -8.758 -0.686 1.00 0.00 N ATOM 1293 CA THR A 81 2.926 -9.185 0.263 1.00 0.00 C ATOM 1294 C THR A 81 1.976 -10.146 -0.457 1.00 0.00 C ATOM 1295 O THR A 81 1.685 -11.225 0.019 1.00 0.00 O ATOM 1296 CB THR A 81 2.148 -7.956 0.743 1.00 0.00 C ATOM 1297 OG1 THR A 81 3.063 -6.927 1.094 1.00 0.00 O ATOM 1298 CG2 THR A 81 1.303 -8.327 1.961 1.00 0.00 C ATOM 0 H THR A 81 3.955 -7.779 -0.969 1.00 0.00 H new ATOM 0 HA THR A 81 3.373 -9.684 1.122 1.00 0.00 H new ATOM 0 HB THR A 81 1.494 -7.605 -0.055 1.00 0.00 H new ATOM 0 HG1 THR A 81 3.230 -6.358 0.314 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.750 -7.451 2.301 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.602 -9.116 1.690 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.954 -8.679 2.762 1.00 0.00 H new ATOM 1306 N THR A 82 1.498 -9.758 -1.608 1.00 0.00 N ATOM 1307 CA THR A 82 0.572 -10.638 -2.377 1.00 0.00 C ATOM 1308 C THR A 82 1.351 -11.818 -2.965 1.00 0.00 C ATOM 1309 O THR A 82 0.783 -12.827 -3.332 1.00 0.00 O ATOM 1310 CB THR A 82 -0.071 -9.837 -3.512 1.00 0.00 C ATOM 1311 OG1 THR A 82 0.947 -9.231 -4.295 1.00 0.00 O ATOM 1312 CG2 THR A 82 -0.981 -8.756 -2.924 1.00 0.00 C ATOM 0 H THR A 82 1.710 -8.864 -2.051 1.00 0.00 H new ATOM 0 HA THR A 82 -0.204 -11.013 -1.710 1.00 0.00 H new ATOM 0 HB THR A 82 -0.663 -10.503 -4.139 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.826 -9.495 -3.950 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.438 -8.186 -3.733 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.761 -9.224 -2.324 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.392 -8.087 -2.296 1.00 0.00 H new ATOM 1320 N ALA A 83 2.648 -11.700 -3.056 1.00 0.00 N ATOM 1321 CA ALA A 83 3.459 -12.816 -3.618 1.00 0.00 C ATOM 1322 C ALA A 83 3.161 -14.094 -2.835 1.00 0.00 C ATOM 1323 O ALA A 83 3.288 -15.191 -3.342 1.00 0.00 O ATOM 1324 CB ALA A 83 4.947 -12.478 -3.500 1.00 0.00 C ATOM 0 H ALA A 83 3.180 -10.880 -2.766 1.00 0.00 H new ATOM 0 HA ALA A 83 3.206 -12.961 -4.668 1.00 0.00 H new ATOM 0 HB1 ALA A 83 5.539 -13.295 -3.911 1.00 0.00 H new ATOM 0 HB2 ALA A 83 5.157 -11.563 -4.054 1.00 0.00 H new ATOM 0 HB3 ALA A 83 5.206 -12.335 -2.451 1.00 0.00 H new ATOM 1481 N SER B 1 8.105 -5.424 13.901 1.00 0.00 N ATOM 1482 CA SER B 1 8.212 -3.942 13.994 1.00 0.00 C ATOM 1483 C SER B 1 6.808 -3.339 13.972 1.00 0.00 C ATOM 1484 O SER B 1 5.830 -4.028 13.764 1.00 0.00 O ATOM 1485 CB SER B 1 9.021 -3.407 12.814 1.00 0.00 C ATOM 1486 OG SER B 1 8.205 -3.406 11.650 1.00 0.00 O ATOM 0 H1 SER B 1 8.825 -5.863 14.510 1.00 0.00 H new ATOM 0 H2 SER B 1 7.159 -5.724 14.212 1.00 0.00 H new ATOM 0 H3 SER B 1 8.256 -5.722 12.916 1.00 0.00 H new ATOM 0 HA SER B 1 8.715 -3.668 14.921 1.00 0.00 H new ATOM 0 HB2 SER B 1 9.373 -2.398 13.027 1.00 0.00 H new ATOM 0 HB3 SER B 1 9.904 -4.025 12.653 1.00 0.00 H new ATOM 0 HG SER B 1 8.700 -3.007 10.904 1.00 0.00 H new ATOM 1492 N GLU B 2 6.697 -2.059 14.194 1.00 0.00 N ATOM 1493 CA GLU B 2 5.351 -1.423 14.194 1.00 0.00 C ATOM 1494 C GLU B 2 4.716 -1.564 12.809 1.00 0.00 C ATOM 1495 O GLU B 2 3.520 -1.732 12.678 1.00 0.00 O ATOM 1496 CB GLU B 2 5.490 0.061 14.543 1.00 0.00 C ATOM 1497 CG GLU B 2 5.905 0.202 16.009 1.00 0.00 C ATOM 1498 CD GLU B 2 4.710 -0.113 16.911 1.00 0.00 C ATOM 1499 OE1 GLU B 2 3.717 0.589 16.812 1.00 0.00 O ATOM 1500 OE2 GLU B 2 4.808 -1.051 17.685 1.00 0.00 O ATOM 0 H GLU B 2 7.478 -1.428 14.375 1.00 0.00 H new ATOM 0 HA GLU B 2 4.718 -1.914 14.933 1.00 0.00 H new ATOM 0 HB2 GLU B 2 6.232 0.530 13.897 1.00 0.00 H new ATOM 0 HB3 GLU B 2 4.545 0.577 14.370 1.00 0.00 H new ATOM 0 HG2 GLU B 2 6.730 -0.475 16.231 1.00 0.00 H new ATOM 0 HG3 GLU B 2 6.262 1.214 16.201 1.00 0.00 H new ATOM 1507 N LEU B 3 5.509 -1.489 11.774 1.00 0.00 N ATOM 1508 CA LEU B 3 4.953 -1.609 10.396 1.00 0.00 C ATOM 1509 C LEU B 3 4.391 -3.022 10.190 1.00 0.00 C ATOM 1510 O LEU B 3 3.293 -3.194 9.701 1.00 0.00 O ATOM 1511 CB LEU B 3 6.069 -1.323 9.370 1.00 0.00 C ATOM 1512 CG LEU B 3 5.483 -0.673 8.108 1.00 0.00 C ATOM 1513 CD1 LEU B 3 6.610 -0.399 7.111 1.00 0.00 C ATOM 1514 CD2 LEU B 3 4.453 -1.613 7.471 1.00 0.00 C ATOM 0 H LEU B 3 6.518 -1.350 11.824 1.00 0.00 H new ATOM 0 HA LEU B 3 4.148 -0.887 10.258 1.00 0.00 H new ATOM 0 HB2 LEU B 3 6.818 -0.665 9.811 1.00 0.00 H new ATOM 0 HB3 LEU B 3 6.576 -2.251 9.107 1.00 0.00 H new ATOM 0 HG LEU B 3 4.995 0.264 8.376 1.00 0.00 H new ATOM 0 HD11 LEU B 3 6.198 0.062 6.214 1.00 0.00 H new ATOM 0 HD12 LEU B 3 7.340 0.273 7.562 1.00 0.00 H new ATOM 0 HD13 LEU B 3 7.097 -1.337 6.845 1.00 0.00 H new ATOM 0 HD21 LEU B 3 4.040 -1.147 6.576 1.00 0.00 H new ATOM 0 HD22 LEU B 3 4.935 -2.553 7.202 1.00 0.00 H new ATOM 0 HD23 LEU B 3 3.650 -1.808 8.182 1.00 0.00 H new ATOM 1526 N GLU B 4 5.123 -4.035 10.570 1.00 0.00 N ATOM 1527 CA GLU B 4 4.604 -5.420 10.397 1.00 0.00 C ATOM 1528 C GLU B 4 3.228 -5.514 11.056 1.00 0.00 C ATOM 1529 O GLU B 4 2.280 -6.011 10.483 1.00 0.00 O ATOM 1530 CB GLU B 4 5.565 -6.413 11.057 1.00 0.00 C ATOM 1531 CG GLU B 4 6.814 -6.567 10.187 1.00 0.00 C ATOM 1532 CD GLU B 4 7.879 -7.358 10.949 1.00 0.00 C ATOM 1533 OE1 GLU B 4 8.316 -6.882 11.984 1.00 0.00 O ATOM 1534 OE2 GLU B 4 8.239 -8.426 10.485 1.00 0.00 O ATOM 0 H GLU B 4 6.050 -3.964 10.989 1.00 0.00 H new ATOM 0 HA GLU B 4 4.522 -5.659 9.337 1.00 0.00 H new ATOM 0 HB2 GLU B 4 5.842 -6.062 12.051 1.00 0.00 H new ATOM 0 HB3 GLU B 4 5.076 -7.379 11.185 1.00 0.00 H new ATOM 0 HG2 GLU B 4 6.561 -7.079 9.259 1.00 0.00 H new ATOM 0 HG3 GLU B 4 7.202 -5.586 9.914 1.00 0.00 H new ATOM 1541 N LYS B 5 3.119 -5.020 12.258 1.00 0.00 N ATOM 1542 CA LYS B 5 1.814 -5.051 12.973 1.00 0.00 C ATOM 1543 C LYS B 5 0.718 -4.509 12.055 1.00 0.00 C ATOM 1544 O LYS B 5 -0.388 -5.009 12.016 1.00 0.00 O ATOM 1545 CB LYS B 5 1.902 -4.148 14.208 1.00 0.00 C ATOM 1546 CG LYS B 5 0.681 -4.389 15.105 1.00 0.00 C ATOM 1547 CD LYS B 5 0.509 -3.216 16.073 1.00 0.00 C ATOM 1548 CE LYS B 5 1.793 -3.026 16.881 1.00 0.00 C ATOM 1549 NZ LYS B 5 1.523 -2.123 18.036 1.00 0.00 N ATOM 0 H LYS B 5 3.885 -4.593 12.779 1.00 0.00 H new ATOM 0 HA LYS B 5 1.583 -6.075 13.265 1.00 0.00 H new ATOM 0 HB2 LYS B 5 2.819 -4.356 14.760 1.00 0.00 H new ATOM 0 HB3 LYS B 5 1.943 -3.102 13.905 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -0.214 -4.502 14.494 1.00 0.00 H new ATOM 0 HG3 LYS B 5 0.805 -5.317 15.663 1.00 0.00 H new ATOM 0 HD2 LYS B 5 0.277 -2.306 15.520 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -0.330 -3.404 16.743 1.00 0.00 H new ATOM 0 HE2 LYS B 5 2.158 -3.990 17.236 1.00 0.00 H new ATOM 0 HE3 LYS B 5 2.574 -2.603 16.249 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 2.396 -1.993 18.586 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 1.194 -1.201 17.686 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 0.791 -2.545 18.642 1.00 0.00 H new ATOM 1563 N ALA B 6 1.034 -3.473 11.325 1.00 0.00 N ATOM 1564 CA ALA B 6 0.045 -2.848 10.401 1.00 0.00 C ATOM 1565 C ALA B 6 -0.143 -3.709 9.149 1.00 0.00 C ATOM 1566 O ALA B 6 -1.195 -3.695 8.541 1.00 0.00 O ATOM 1567 CB ALA B 6 0.537 -1.451 10.001 1.00 0.00 C ATOM 0 H ALA B 6 1.951 -3.027 11.331 1.00 0.00 H new ATOM 0 HA ALA B 6 -0.915 -2.769 10.912 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -0.184 -0.991 9.325 1.00 0.00 H new ATOM 0 HB2 ALA B 6 0.643 -0.834 10.893 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.502 -1.535 9.500 1.00 0.00 H new ATOM 1573 N MET B 7 0.834 -4.477 8.763 1.00 0.00 N ATOM 1574 CA MET B 7 0.640 -5.340 7.564 1.00 0.00 C ATOM 1575 C MET B 7 -0.404 -6.412 7.916 1.00 0.00 C ATOM 1576 O MET B 7 -1.379 -6.606 7.210 1.00 0.00 O ATOM 1577 CB MET B 7 1.983 -6.004 7.184 1.00 0.00 C ATOM 1578 CG MET B 7 2.723 -5.164 6.123 1.00 0.00 C ATOM 1579 SD MET B 7 2.232 -5.723 4.466 1.00 0.00 S ATOM 1580 CE MET B 7 1.596 -4.149 3.835 1.00 0.00 C ATOM 0 H MET B 7 1.745 -4.546 9.216 1.00 0.00 H new ATOM 0 HA MET B 7 0.295 -4.750 6.715 1.00 0.00 H new ATOM 0 HB2 MET B 7 2.607 -6.110 8.072 1.00 0.00 H new ATOM 0 HB3 MET B 7 1.803 -7.008 6.800 1.00 0.00 H new ATOM 0 HG2 MET B 7 2.485 -4.108 6.248 1.00 0.00 H new ATOM 0 HG3 MET B 7 3.801 -5.265 6.249 1.00 0.00 H new ATOM 0 HE1 MET B 7 1.240 -4.284 2.813 1.00 0.00 H new ATOM 0 HE2 MET B 7 0.773 -3.811 4.464 1.00 0.00 H new ATOM 0 HE3 MET B 7 2.392 -3.404 3.847 1.00 0.00 H new ATOM 1590 N VAL B 8 -0.214 -7.099 9.013 1.00 0.00 N ATOM 1591 CA VAL B 8 -1.196 -8.146 9.411 1.00 0.00 C ATOM 1592 C VAL B 8 -2.532 -7.476 9.747 1.00 0.00 C ATOM 1593 O VAL B 8 -3.589 -7.986 9.435 1.00 0.00 O ATOM 1594 CB VAL B 8 -0.667 -8.912 10.634 1.00 0.00 C ATOM 1595 CG1 VAL B 8 -1.333 -10.290 10.714 1.00 0.00 C ATOM 1596 CG2 VAL B 8 0.850 -9.088 10.504 1.00 0.00 C ATOM 0 H VAL B 8 0.576 -6.979 9.647 1.00 0.00 H new ATOM 0 HA VAL B 8 -1.340 -8.850 8.591 1.00 0.00 H new ATOM 0 HB VAL B 8 -0.897 -8.349 11.538 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -0.954 -10.828 11.583 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -2.412 -10.168 10.806 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -1.108 -10.856 9.810 1.00 0.00 H new ATOM 0 HG21 VAL B 8 1.229 -9.631 11.370 1.00 0.00 H new ATOM 0 HG22 VAL B 8 1.075 -9.649 9.597 1.00 0.00 H new ATOM 0 HG23 VAL B 8 1.327 -8.109 10.453 1.00 0.00 H new ATOM 1606 N ALA B 9 -2.491 -6.330 10.371 1.00 0.00 N ATOM 1607 CA ALA B 9 -3.758 -5.625 10.713 1.00 0.00 C ATOM 1608 C ALA B 9 -4.539 -5.358 9.426 1.00 0.00 C ATOM 1609 O ALA B 9 -5.722 -5.609 9.343 1.00 0.00 O ATOM 1610 CB ALA B 9 -3.431 -4.293 11.393 1.00 0.00 C ATOM 0 H ALA B 9 -1.636 -5.853 10.658 1.00 0.00 H new ATOM 0 HA ALA B 9 -4.353 -6.240 11.388 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -4.357 -3.776 11.644 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -2.861 -4.479 12.303 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -2.842 -3.674 10.716 1.00 0.00 H new ATOM 1616 N LEU B 10 -3.885 -4.834 8.426 1.00 0.00 N ATOM 1617 CA LEU B 10 -4.591 -4.531 7.144 1.00 0.00 C ATOM 1618 C LEU B 10 -5.475 -5.721 6.763 1.00 0.00 C ATOM 1619 O LEU B 10 -6.598 -5.560 6.330 1.00 0.00 O ATOM 1620 CB LEU B 10 -3.532 -4.288 6.042 1.00 0.00 C ATOM 1621 CG LEU B 10 -3.187 -2.782 5.952 1.00 0.00 C ATOM 1622 CD1 LEU B 10 -1.793 -2.599 5.347 1.00 0.00 C ATOM 1623 CD2 LEU B 10 -4.212 -2.059 5.066 1.00 0.00 C ATOM 0 H LEU B 10 -2.892 -4.602 8.439 1.00 0.00 H new ATOM 0 HA LEU B 10 -5.215 -3.644 7.255 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -2.631 -4.862 6.260 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -3.909 -4.640 5.082 1.00 0.00 H new ATOM 0 HG LEU B 10 -3.209 -2.361 6.957 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -1.559 -1.536 5.288 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -1.055 -3.099 5.975 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -1.771 -3.032 4.347 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -3.961 -1.000 5.009 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -4.196 -2.490 4.065 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -5.208 -2.173 5.494 1.00 0.00 H new ATOM 1635 N ILE B 11 -4.985 -6.919 6.946 1.00 0.00 N ATOM 1636 CA ILE B 11 -5.823 -8.106 6.615 1.00 0.00 C ATOM 1637 C ILE B 11 -7.025 -8.105 7.569 1.00 0.00 C ATOM 1638 O ILE B 11 -8.137 -8.420 7.194 1.00 0.00 O ATOM 1639 CB ILE B 11 -4.998 -9.400 6.788 1.00 0.00 C ATOM 1640 CG1 ILE B 11 -4.083 -9.606 5.570 1.00 0.00 C ATOM 1641 CG2 ILE B 11 -5.930 -10.613 6.912 1.00 0.00 C ATOM 1642 CD1 ILE B 11 -2.948 -8.581 5.583 1.00 0.00 C ATOM 0 H ILE B 11 -4.053 -7.125 7.306 1.00 0.00 H new ATOM 0 HA ILE B 11 -6.162 -8.062 5.580 1.00 0.00 H new ATOM 0 HB ILE B 11 -4.398 -9.305 7.693 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -3.672 -10.615 5.582 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -4.661 -9.508 4.651 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -5.335 -11.518 7.033 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -6.579 -10.486 7.779 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -6.539 -10.697 6.012 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -2.307 -8.737 4.715 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -3.366 -7.575 5.549 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -2.361 -8.699 6.494 1.00 0.00 H new ATOM 1654 N ASP B 12 -6.794 -7.744 8.804 1.00 0.00 N ATOM 1655 CA ASP B 12 -7.895 -7.702 9.808 1.00 0.00 C ATOM 1656 C ASP B 12 -9.070 -6.890 9.264 1.00 0.00 C ATOM 1657 O ASP B 12 -10.199 -7.338 9.243 1.00 0.00 O ATOM 1658 CB ASP B 12 -7.380 -7.015 11.084 1.00 0.00 C ATOM 1659 CG ASP B 12 -8.308 -7.346 12.258 1.00 0.00 C ATOM 1660 OD1 ASP B 12 -8.140 -8.405 12.840 1.00 0.00 O ATOM 1661 OD2 ASP B 12 -9.170 -6.535 12.553 1.00 0.00 O ATOM 0 H ASP B 12 -5.878 -7.474 9.163 1.00 0.00 H new ATOM 0 HA ASP B 12 -8.221 -8.720 10.022 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -6.366 -7.348 11.304 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -7.336 -5.936 10.935 1.00 0.00 H new ATOM 1666 N VAL B 13 -8.804 -5.678 8.854 1.00 0.00 N ATOM 1667 CA VAL B 13 -9.893 -4.799 8.341 1.00 0.00 C ATOM 1668 C VAL B 13 -10.341 -5.229 6.942 1.00 0.00 C ATOM 1669 O VAL B 13 -11.517 -5.193 6.640 1.00 0.00 O ATOM 1670 CB VAL B 13 -9.413 -3.346 8.316 1.00 0.00 C ATOM 1671 CG1 VAL B 13 -10.516 -2.450 7.751 1.00 0.00 C ATOM 1672 CG2 VAL B 13 -9.071 -2.898 9.739 1.00 0.00 C ATOM 0 H VAL B 13 -7.874 -5.258 8.853 1.00 0.00 H new ATOM 0 HA VAL B 13 -10.750 -4.889 9.009 1.00 0.00 H new ATOM 0 HB VAL B 13 -8.527 -3.269 7.686 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -10.172 -1.416 7.734 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -10.759 -2.768 6.737 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -11.404 -2.527 8.378 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -8.729 -1.863 9.722 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -9.957 -2.977 10.368 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -8.283 -3.534 10.141 1.00 0.00 H new ATOM 1682 N PHE B 14 -9.456 -5.631 6.076 1.00 0.00 N ATOM 1683 CA PHE B 14 -9.936 -6.037 4.724 1.00 0.00 C ATOM 1684 C PHE B 14 -10.875 -7.233 4.877 1.00 0.00 C ATOM 1685 O PHE B 14 -11.823 -7.397 4.134 1.00 0.00 O ATOM 1686 CB PHE B 14 -8.762 -6.421 3.823 1.00 0.00 C ATOM 1687 CG PHE B 14 -9.287 -6.727 2.439 1.00 0.00 C ATOM 1688 CD1 PHE B 14 -9.395 -5.704 1.489 1.00 0.00 C ATOM 1689 CD2 PHE B 14 -9.674 -8.033 2.107 1.00 0.00 C ATOM 1690 CE1 PHE B 14 -9.888 -5.985 0.209 1.00 0.00 C ATOM 1691 CE2 PHE B 14 -10.166 -8.314 0.826 1.00 0.00 C ATOM 1692 CZ PHE B 14 -10.273 -7.289 -0.122 1.00 0.00 C ATOM 0 H PHE B 14 -8.451 -5.696 6.235 1.00 0.00 H new ATOM 0 HA PHE B 14 -10.459 -5.199 4.264 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -8.038 -5.607 3.780 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -8.243 -7.289 4.230 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -9.098 -4.697 1.744 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -9.593 -8.823 2.839 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -9.971 -5.195 -0.523 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -10.463 -9.320 0.570 1.00 0.00 H new ATOM 0 HZ PHE B 14 -10.653 -7.505 -1.110 1.00 0.00 H new ATOM 1702 N HIS B 15 -10.608 -8.074 5.841 1.00 0.00 N ATOM 1703 CA HIS B 15 -11.467 -9.271 6.059 1.00 0.00 C ATOM 1704 C HIS B 15 -12.727 -8.880 6.836 1.00 0.00 C ATOM 1705 O HIS B 15 -13.780 -9.464 6.667 1.00 0.00 O ATOM 1706 CB HIS B 15 -10.683 -10.316 6.855 1.00 0.00 C ATOM 1707 CG HIS B 15 -11.478 -11.589 6.935 1.00 0.00 C ATOM 1708 ND1 HIS B 15 -11.633 -12.287 8.122 1.00 0.00 N ATOM 1709 CD2 HIS B 15 -12.167 -12.303 5.986 1.00 0.00 C ATOM 1710 CE1 HIS B 15 -12.388 -13.369 7.860 1.00 0.00 C ATOM 1711 NE2 HIS B 15 -12.741 -13.427 6.573 1.00 0.00 N ATOM 0 H HIS B 15 -9.826 -7.981 6.490 1.00 0.00 H new ATOM 0 HA HIS B 15 -11.759 -9.683 5.093 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -9.721 -10.505 6.378 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -10.473 -9.943 7.857 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -12.251 -12.034 4.943 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -12.674 -14.102 8.600 1.00 0.00 H new ATOM 0 HE2 HIS B 15 -13.309 -14.142 6.118 1.00 0.00 H new ATOM 1719 N GLN B 16 -12.620 -7.910 7.707 1.00 0.00 N ATOM 1720 CA GLN B 16 -13.803 -7.497 8.518 1.00 0.00 C ATOM 1721 C GLN B 16 -14.973 -7.157 7.595 1.00 0.00 C ATOM 1722 O GLN B 16 -16.087 -7.588 7.815 1.00 0.00 O ATOM 1723 CB GLN B 16 -13.444 -6.279 9.369 1.00 0.00 C ATOM 1724 CG GLN B 16 -14.626 -5.915 10.270 1.00 0.00 C ATOM 1725 CD GLN B 16 -14.167 -4.909 11.327 1.00 0.00 C ATOM 1726 OE1 GLN B 16 -14.777 -4.784 12.370 1.00 0.00 O ATOM 1727 NE2 GLN B 16 -13.109 -4.180 11.098 1.00 0.00 N ATOM 0 H GLN B 16 -11.764 -7.386 7.891 1.00 0.00 H new ATOM 0 HA GLN B 16 -14.093 -8.319 9.172 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -12.564 -6.493 9.976 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -13.191 -5.436 8.726 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -15.434 -5.491 9.675 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -15.020 -6.810 10.751 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -12.597 -4.285 10.222 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -12.794 -3.505 11.795 1.00 0.00 H new ATOM 1736 N TYR B 17 -14.740 -6.394 6.563 1.00 0.00 N ATOM 1737 CA TYR B 17 -15.853 -6.046 5.640 1.00 0.00 C ATOM 1738 C TYR B 17 -16.252 -7.297 4.858 1.00 0.00 C ATOM 1739 O TYR B 17 -17.413 -7.642 4.767 1.00 0.00 O ATOM 1740 CB TYR B 17 -15.393 -4.953 4.664 1.00 0.00 C ATOM 1741 CG TYR B 17 -15.417 -3.604 5.353 1.00 0.00 C ATOM 1742 CD1 TYR B 17 -14.557 -3.356 6.431 1.00 0.00 C ATOM 1743 CD2 TYR B 17 -16.293 -2.601 4.913 1.00 0.00 C ATOM 1744 CE1 TYR B 17 -14.574 -2.109 7.068 1.00 0.00 C ATOM 1745 CE2 TYR B 17 -16.308 -1.354 5.551 1.00 0.00 C ATOM 1746 CZ TYR B 17 -15.448 -1.109 6.628 1.00 0.00 C ATOM 1747 OH TYR B 17 -15.462 0.120 7.255 1.00 0.00 O ATOM 0 H TYR B 17 -13.831 -5.999 6.321 1.00 0.00 H new ATOM 0 HA TYR B 17 -16.705 -5.677 6.210 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -14.386 -5.171 4.308 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -16.044 -4.936 3.790 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -13.881 -4.127 6.771 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -16.956 -2.790 4.082 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -13.912 -1.919 7.900 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -16.983 -0.582 5.212 1.00 0.00 H new ATOM 0 HH TYR B 17 -16.125 0.699 6.825 1.00 0.00 H new ATOM 1757 N SER B 18 -15.291 -7.979 4.291 1.00 0.00 N ATOM 1758 CA SER B 18 -15.597 -9.212 3.506 1.00 0.00 C ATOM 1759 C SER B 18 -15.322 -10.456 4.354 1.00 0.00 C ATOM 1760 O SER B 18 -14.539 -11.303 3.971 1.00 0.00 O ATOM 1761 CB SER B 18 -14.711 -9.250 2.261 1.00 0.00 C ATOM 1762 OG SER B 18 -13.409 -9.689 2.626 1.00 0.00 O ATOM 0 H SER B 18 -14.302 -7.733 4.338 1.00 0.00 H new ATOM 0 HA SER B 18 -16.648 -9.199 3.217 1.00 0.00 H new ATOM 0 HB2 SER B 18 -15.139 -9.921 1.516 1.00 0.00 H new ATOM 0 HB3 SER B 18 -14.660 -8.261 1.806 1.00 0.00 H new ATOM 0 HG SER B 18 -13.425 -10.654 2.795 1.00 0.00 H new ATOM 1768 N GLY B 19 -15.978 -10.595 5.488 1.00 0.00 N ATOM 1769 CA GLY B 19 -15.773 -11.812 6.344 1.00 0.00 C ATOM 1770 C GLY B 19 -17.126 -12.507 6.516 1.00 0.00 C ATOM 1771 O GLY B 19 -17.197 -13.675 6.841 1.00 0.00 O ATOM 0 H GLY B 19 -16.646 -9.918 5.856 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -15.055 -12.487 5.879 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -15.364 -11.530 7.314 1.00 0.00 H new ATOM 1775 N ARG B 20 -18.200 -11.802 6.280 1.00 0.00 N ATOM 1776 CA ARG B 20 -19.545 -12.429 6.405 1.00 0.00 C ATOM 1777 C ARG B 20 -19.663 -13.540 5.363 1.00 0.00 C ATOM 1778 O ARG B 20 -20.332 -14.529 5.593 1.00 0.00 O ATOM 1779 CB ARG B 20 -20.653 -11.381 6.225 1.00 0.00 C ATOM 1780 CG ARG B 20 -20.212 -10.326 5.206 1.00 0.00 C ATOM 1781 CD ARG B 20 -21.406 -9.443 4.839 1.00 0.00 C ATOM 1782 NE ARG B 20 -21.930 -8.786 6.069 1.00 0.00 N ATOM 1783 CZ ARG B 20 -23.052 -8.121 6.029 1.00 0.00 C ATOM 1784 NH1 ARG B 20 -24.178 -8.751 5.840 1.00 0.00 N ATOM 1785 NH2 ARG B 20 -23.048 -6.826 6.179 1.00 0.00 N ATOM 0 H ARG B 20 -18.203 -10.819 6.006 1.00 0.00 H new ATOM 0 HA ARG B 20 -19.663 -12.854 7.402 1.00 0.00 H new ATOM 0 HB2 ARG B 20 -21.571 -11.863 5.888 1.00 0.00 H new ATOM 0 HB3 ARG B 20 -20.875 -10.906 7.181 1.00 0.00 H new ATOM 0 HG2 ARG B 20 -19.409 -9.717 5.621 1.00 0.00 H new ATOM 0 HG3 ARG B 20 -19.816 -10.810 4.313 1.00 0.00 H new ATOM 0 HD2 ARG B 20 -21.105 -8.690 4.111 1.00 0.00 H new ATOM 0 HD3 ARG B 20 -22.187 -10.043 4.373 1.00 0.00 H new ATOM 0 HE ARG B 20 -21.411 -8.856 6.944 1.00 0.00 H new ATOM 0 HH11 ARG B 20 -24.182 -9.764 5.723 1.00 0.00 H new ATOM 0 HH12 ARG B 20 -25.055 -8.230 5.809 1.00 0.00 H new ATOM 0 HH21 ARG B 20 -22.168 -6.333 6.328 1.00 0.00 H new ATOM 0 HH22 ARG B 20 -23.925 -6.306 6.148 1.00 0.00 H new ATOM 1799 N GLU B 21 -18.988 -13.433 4.246 1.00 0.00 N ATOM 1800 CA GLU B 21 -19.044 -14.548 3.247 1.00 0.00 C ATOM 1801 C GLU B 21 -17.678 -14.664 2.568 1.00 0.00 C ATOM 1802 O GLU B 21 -17.124 -15.741 2.469 1.00 0.00 O ATOM 1803 CB GLU B 21 -20.130 -14.275 2.194 1.00 0.00 C ATOM 1804 CG GLU B 21 -21.525 -14.553 2.774 1.00 0.00 C ATOM 1805 CD GLU B 21 -21.962 -13.383 3.660 1.00 0.00 C ATOM 1806 OE1 GLU B 21 -21.689 -12.253 3.292 1.00 0.00 O ATOM 1807 OE2 GLU B 21 -22.561 -13.639 4.692 1.00 0.00 O ATOM 0 H GLU B 21 -18.409 -12.636 3.983 1.00 0.00 H new ATOM 0 HA GLU B 21 -19.290 -15.480 3.756 1.00 0.00 H new ATOM 0 HB2 GLU B 21 -20.069 -13.239 1.860 1.00 0.00 H new ATOM 0 HB3 GLU B 21 -19.962 -14.903 1.319 1.00 0.00 H new ATOM 0 HG2 GLU B 21 -22.242 -14.697 1.966 1.00 0.00 H new ATOM 0 HG3 GLU B 21 -21.510 -15.475 3.355 1.00 0.00 H new ATOM 1814 N GLY B 22 -17.118 -13.567 2.122 1.00 0.00 N ATOM 1815 CA GLY B 22 -15.775 -13.615 1.465 1.00 0.00 C ATOM 1816 C GLY B 22 -15.703 -14.805 0.507 1.00 0.00 C ATOM 1817 O GLY B 22 -14.634 -15.227 0.113 1.00 0.00 O ATOM 0 H GLY B 22 -17.534 -12.638 2.185 1.00 0.00 H new ATOM 0 HA2 GLY B 22 -15.594 -12.688 0.921 1.00 0.00 H new ATOM 0 HA3 GLY B 22 -14.994 -13.698 2.221 1.00 0.00 H new ATOM 1821 N ASP B 23 -16.824 -15.349 0.124 1.00 0.00 N ATOM 1822 CA ASP B 23 -16.795 -16.508 -0.811 1.00 0.00 C ATOM 1823 C ASP B 23 -15.892 -16.158 -1.995 1.00 0.00 C ATOM 1824 O ASP B 23 -15.007 -16.908 -2.356 1.00 0.00 O ATOM 1825 CB ASP B 23 -18.210 -16.804 -1.312 1.00 0.00 C ATOM 1826 CG ASP B 23 -19.092 -17.227 -0.135 1.00 0.00 C ATOM 1827 OD1 ASP B 23 -18.556 -17.772 0.816 1.00 0.00 O ATOM 1828 OD2 ASP B 23 -20.288 -16.998 -0.205 1.00 0.00 O ATOM 0 H ASP B 23 -17.753 -15.044 0.415 1.00 0.00 H new ATOM 0 HA ASP B 23 -16.411 -17.390 -0.298 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -18.628 -15.921 -1.794 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -18.183 -17.594 -2.062 1.00 0.00 H new ATOM 1833 N LYS B 24 -16.093 -15.011 -2.589 1.00 0.00 N ATOM 1834 CA LYS B 24 -15.230 -14.598 -3.734 1.00 0.00 C ATOM 1835 C LYS B 24 -14.035 -13.809 -3.191 1.00 0.00 C ATOM 1836 O LYS B 24 -14.158 -13.059 -2.244 1.00 0.00 O ATOM 1837 CB LYS B 24 -16.034 -13.717 -4.693 1.00 0.00 C ATOM 1838 CG LYS B 24 -17.408 -14.353 -4.941 1.00 0.00 C ATOM 1839 CD LYS B 24 -18.202 -13.523 -5.970 1.00 0.00 C ATOM 1840 CE LYS B 24 -17.863 -13.979 -7.395 1.00 0.00 C ATOM 1841 NZ LYS B 24 -18.384 -15.359 -7.612 1.00 0.00 N ATOM 0 H LYS B 24 -16.818 -14.342 -2.330 1.00 0.00 H new ATOM 0 HA LYS B 24 -14.880 -15.480 -4.271 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -16.154 -12.719 -4.273 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -15.498 -13.604 -5.635 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -17.284 -15.373 -5.304 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -17.963 -14.413 -4.005 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -19.271 -13.634 -5.790 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -17.967 -12.465 -5.854 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -18.302 -13.295 -8.121 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -16.784 -13.958 -7.548 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -18.610 -15.490 -8.619 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -17.663 -16.051 -7.326 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -19.243 -15.499 -7.043 1.00 0.00 H new ATOM 1855 N HIS B 25 -12.886 -13.947 -3.799 1.00 0.00 N ATOM 1856 CA HIS B 25 -11.686 -13.181 -3.339 1.00 0.00 C ATOM 1857 C HIS B 25 -11.529 -11.967 -4.253 1.00 0.00 C ATOM 1858 O HIS B 25 -10.435 -11.582 -4.617 1.00 0.00 O ATOM 1859 CB HIS B 25 -10.444 -14.069 -3.443 1.00 0.00 C ATOM 1860 CG HIS B 25 -10.525 -15.163 -2.413 1.00 0.00 C ATOM 1861 ND1 HIS B 25 -10.415 -16.504 -2.747 1.00 0.00 N ATOM 1862 CD2 HIS B 25 -10.709 -15.130 -1.053 1.00 0.00 C ATOM 1863 CE1 HIS B 25 -10.533 -17.216 -1.611 1.00 0.00 C ATOM 1864 NE2 HIS B 25 -10.714 -16.428 -0.549 1.00 0.00 N ATOM 0 H HIS B 25 -12.725 -14.560 -4.598 1.00 0.00 H new ATOM 0 HA HIS B 25 -11.805 -12.864 -2.303 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -10.374 -14.499 -4.442 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -9.544 -13.474 -3.288 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -10.831 -14.233 -0.463 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -10.487 -18.294 -1.564 1.00 0.00 H new ATOM 0 HE2 HIS B 25 -10.831 -16.715 0.423 1.00 0.00 H new ATOM 1872 N LYS B 26 -12.628 -11.358 -4.614 1.00 0.00 N ATOM 1873 CA LYS B 26 -12.589 -10.153 -5.496 1.00 0.00 C ATOM 1874 C LYS B 26 -13.519 -9.083 -4.919 1.00 0.00 C ATOM 1875 O LYS B 26 -14.466 -9.393 -4.225 1.00 0.00 O ATOM 1876 CB LYS B 26 -13.064 -10.535 -6.899 1.00 0.00 C ATOM 1877 CG LYS B 26 -12.157 -11.630 -7.463 1.00 0.00 C ATOM 1878 CD LYS B 26 -12.407 -11.776 -8.967 1.00 0.00 C ATOM 1879 CE LYS B 26 -11.435 -12.804 -9.555 1.00 0.00 C ATOM 1880 NZ LYS B 26 -11.953 -13.282 -10.868 1.00 0.00 N ATOM 0 H LYS B 26 -13.564 -11.648 -4.331 1.00 0.00 H new ATOM 0 HA LYS B 26 -11.571 -9.768 -5.550 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -14.096 -10.885 -6.863 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -13.047 -9.662 -7.551 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -11.112 -11.381 -7.280 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -12.353 -12.576 -6.957 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -13.435 -12.090 -9.146 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -12.277 -10.814 -9.462 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -10.449 -12.357 -9.682 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -11.319 -13.644 -8.870 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -11.294 -13.980 -11.268 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -12.885 -13.723 -10.734 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -12.042 -12.477 -11.520 1.00 0.00 H new ATOM 1894 N LEU B 27 -13.259 -7.828 -5.199 1.00 0.00 N ATOM 1895 CA LEU B 27 -14.130 -6.726 -4.666 1.00 0.00 C ATOM 1896 C LEU B 27 -14.653 -5.895 -5.841 1.00 0.00 C ATOM 1897 O LEU B 27 -13.945 -5.646 -6.796 1.00 0.00 O ATOM 1898 CB LEU B 27 -13.298 -5.837 -3.723 1.00 0.00 C ATOM 1899 CG LEU B 27 -14.219 -5.107 -2.722 1.00 0.00 C ATOM 1900 CD1 LEU B 27 -14.528 -6.013 -1.522 1.00 0.00 C ATOM 1901 CD2 LEU B 27 -13.525 -3.838 -2.217 1.00 0.00 C ATOM 0 H LEU B 27 -12.478 -7.516 -5.776 1.00 0.00 H new ATOM 0 HA LEU B 27 -14.972 -7.144 -4.114 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -12.574 -6.447 -3.183 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -12.732 -5.109 -4.304 1.00 0.00 H new ATOM 0 HG LEU B 27 -15.149 -4.850 -3.229 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -15.178 -5.484 -0.825 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -15.027 -6.918 -1.868 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -13.599 -6.281 -1.019 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -14.176 -3.324 -1.510 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -12.592 -4.106 -1.721 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -13.312 -3.180 -3.059 1.00 0.00 H new ATOM 1913 N LYS B 28 -15.891 -5.467 -5.786 1.00 0.00 N ATOM 1914 CA LYS B 28 -16.449 -4.657 -6.912 1.00 0.00 C ATOM 1915 C LYS B 28 -16.184 -3.170 -6.651 1.00 0.00 C ATOM 1916 O LYS B 28 -16.134 -2.729 -5.520 1.00 0.00 O ATOM 1917 CB LYS B 28 -17.955 -4.905 -7.024 1.00 0.00 C ATOM 1918 CG LYS B 28 -18.201 -6.390 -7.314 1.00 0.00 C ATOM 1919 CD LYS B 28 -19.666 -6.620 -7.715 1.00 0.00 C ATOM 1920 CE LYS B 28 -20.571 -6.553 -6.479 1.00 0.00 C ATOM 1921 NZ LYS B 28 -20.077 -7.502 -5.442 1.00 0.00 N ATOM 0 H LYS B 28 -16.535 -5.642 -5.015 1.00 0.00 H new ATOM 0 HA LYS B 28 -15.968 -4.949 -7.845 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -18.453 -4.615 -6.099 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -18.379 -4.292 -7.819 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -17.541 -6.725 -8.114 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -17.961 -6.984 -6.432 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -19.974 -5.868 -8.441 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -19.770 -7.591 -8.198 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -20.584 -5.539 -6.081 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -21.596 -6.801 -6.753 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -20.886 -7.920 -4.940 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -19.524 -8.256 -5.897 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -19.475 -6.993 -4.764 1.00 0.00 H new ATOM 1935 N LYS B 29 -16.007 -2.397 -7.686 1.00 0.00 N ATOM 1936 CA LYS B 29 -15.738 -0.938 -7.505 1.00 0.00 C ATOM 1937 C LYS B 29 -16.847 -0.281 -6.673 1.00 0.00 C ATOM 1938 O LYS B 29 -16.593 0.542 -5.816 1.00 0.00 O ATOM 1939 CB LYS B 29 -15.692 -0.274 -8.886 1.00 0.00 C ATOM 1940 CG LYS B 29 -17.105 -0.244 -9.494 1.00 0.00 C ATOM 1941 CD LYS B 29 -17.026 -0.007 -11.007 1.00 0.00 C ATOM 1942 CE LYS B 29 -18.367 0.528 -11.516 1.00 0.00 C ATOM 1943 NZ LYS B 29 -19.474 -0.299 -10.957 1.00 0.00 N ATOM 0 H LYS B 29 -16.037 -2.712 -8.656 1.00 0.00 H new ATOM 0 HA LYS B 29 -14.789 -0.813 -6.984 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -15.301 0.740 -8.800 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -15.015 -0.822 -9.541 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -17.616 -1.186 -9.292 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -17.694 0.545 -9.025 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -16.231 0.704 -11.233 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -16.777 -0.937 -11.518 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -18.491 1.570 -11.220 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -18.392 0.501 -12.605 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -20.332 -0.162 -11.528 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -19.202 -1.303 -10.977 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -19.662 -0.010 -9.976 1.00 0.00 H new ATOM 1957 N SER B 30 -18.074 -0.623 -6.942 1.00 0.00 N ATOM 1958 CA SER B 30 -19.212 -0.007 -6.200 1.00 0.00 C ATOM 1959 C SER B 30 -19.042 -0.200 -4.692 1.00 0.00 C ATOM 1960 O SER B 30 -19.342 0.681 -3.903 1.00 0.00 O ATOM 1961 CB SER B 30 -20.518 -0.665 -6.647 1.00 0.00 C ATOM 1962 OG SER B 30 -20.576 -1.990 -6.134 1.00 0.00 O ATOM 0 H SER B 30 -18.342 -1.308 -7.649 1.00 0.00 H new ATOM 0 HA SER B 30 -19.234 1.061 -6.416 1.00 0.00 H new ATOM 0 HB2 SER B 30 -21.371 -0.087 -6.290 1.00 0.00 H new ATOM 0 HB3 SER B 30 -20.577 -0.681 -7.735 1.00 0.00 H new ATOM 0 HG SER B 30 -21.413 -2.414 -6.417 1.00 0.00 H new ATOM 1968 N GLU B 31 -18.554 -1.338 -4.275 1.00 0.00 N ATOM 1969 CA GLU B 31 -18.374 -1.558 -2.810 1.00 0.00 C ATOM 1970 C GLU B 31 -17.067 -0.901 -2.375 1.00 0.00 C ATOM 1971 O GLU B 31 -16.941 -0.404 -1.274 1.00 0.00 O ATOM 1972 CB GLU B 31 -18.354 -3.054 -2.493 1.00 0.00 C ATOM 1973 CG GLU B 31 -19.669 -3.689 -2.950 1.00 0.00 C ATOM 1974 CD GLU B 31 -19.672 -5.176 -2.591 1.00 0.00 C ATOM 1975 OE1 GLU B 31 -20.028 -5.494 -1.469 1.00 0.00 O ATOM 1976 OE2 GLU B 31 -19.319 -5.972 -3.446 1.00 0.00 O ATOM 0 H GLU B 31 -18.276 -2.115 -4.875 1.00 0.00 H new ATOM 0 HA GLU B 31 -19.207 -1.113 -2.266 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -17.513 -3.532 -2.995 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -18.216 -3.208 -1.423 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -20.512 -3.188 -2.474 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -19.790 -3.564 -4.026 1.00 0.00 H new ATOM 1983 N LEU B 32 -16.097 -0.875 -3.251 1.00 0.00 N ATOM 1984 CA LEU B 32 -14.804 -0.227 -2.907 1.00 0.00 C ATOM 1985 C LEU B 32 -15.075 1.256 -2.639 1.00 0.00 C ATOM 1986 O LEU B 32 -14.605 1.810 -1.668 1.00 0.00 O ATOM 1987 CB LEU B 32 -13.812 -0.398 -4.072 1.00 0.00 C ATOM 1988 CG LEU B 32 -12.366 -0.365 -3.556 1.00 0.00 C ATOM 1989 CD1 LEU B 32 -11.410 -0.634 -4.723 1.00 0.00 C ATOM 1990 CD2 LEU B 32 -12.057 1.010 -2.942 1.00 0.00 C ATOM 0 H LEU B 32 -16.147 -1.275 -4.188 1.00 0.00 H new ATOM 0 HA LEU B 32 -14.366 -0.686 -2.021 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -14.001 -1.342 -4.583 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -13.961 0.396 -4.804 1.00 0.00 H new ATOM 0 HG LEU B 32 -12.238 -1.130 -2.790 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -10.381 -0.612 -4.363 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -11.624 -1.614 -5.150 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -11.544 0.132 -5.487 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -11.029 1.024 -2.579 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -12.185 1.784 -3.699 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -12.738 1.199 -2.112 1.00 0.00 H new ATOM 2002 N LYS B 33 -15.816 1.920 -3.487 1.00 0.00 N ATOM 2003 CA LYS B 33 -16.070 3.364 -3.242 1.00 0.00 C ATOM 2004 C LYS B 33 -16.605 3.532 -1.824 1.00 0.00 C ATOM 2005 O LYS B 33 -16.045 4.244 -1.015 1.00 0.00 O ATOM 2006 CB LYS B 33 -17.100 3.886 -4.247 1.00 0.00 C ATOM 2007 CG LYS B 33 -17.228 5.404 -4.107 1.00 0.00 C ATOM 2008 CD LYS B 33 -18.321 5.915 -5.049 1.00 0.00 C ATOM 2009 CE LYS B 33 -18.721 7.335 -4.646 1.00 0.00 C ATOM 2010 NZ LYS B 33 -17.496 8.163 -4.462 1.00 0.00 N ATOM 0 H LYS B 33 -16.249 1.530 -4.324 1.00 0.00 H new ATOM 0 HA LYS B 33 -15.145 3.928 -3.360 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -16.796 3.628 -5.262 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -18.066 3.412 -4.073 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -17.470 5.665 -3.077 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -16.277 5.883 -4.343 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -17.962 5.905 -6.078 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -19.188 5.256 -5.008 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -19.359 7.776 -5.412 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -19.300 7.313 -3.723 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -17.718 9.160 -4.659 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -17.158 8.070 -3.483 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -16.756 7.838 -5.116 1.00 0.00 H new ATOM 2024 N GLU B 34 -17.692 2.878 -1.520 1.00 0.00 N ATOM 2025 CA GLU B 34 -18.267 3.001 -0.148 1.00 0.00 C ATOM 2026 C GLU B 34 -17.155 2.782 0.885 1.00 0.00 C ATOM 2027 O GLU B 34 -17.128 3.416 1.921 1.00 0.00 O ATOM 2028 CB GLU B 34 -19.360 1.948 0.045 1.00 0.00 C ATOM 2029 CG GLU B 34 -20.549 2.276 -0.859 1.00 0.00 C ATOM 2030 CD GLU B 34 -21.575 1.144 -0.783 1.00 0.00 C ATOM 2031 OE1 GLU B 34 -21.233 0.035 -1.160 1.00 0.00 O ATOM 2032 OE2 GLU B 34 -22.685 1.405 -0.349 1.00 0.00 O ATOM 0 H GLU B 34 -18.205 2.268 -2.156 1.00 0.00 H new ATOM 0 HA GLU B 34 -18.697 3.994 -0.018 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -18.972 0.958 -0.192 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -19.678 1.925 1.087 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -21.006 3.216 -0.550 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -20.212 2.408 -1.887 1.00 0.00 H new ATOM 2039 N LEU B 35 -16.235 1.896 0.612 1.00 0.00 N ATOM 2040 CA LEU B 35 -15.128 1.652 1.583 1.00 0.00 C ATOM 2041 C LEU B 35 -14.227 2.891 1.653 1.00 0.00 C ATOM 2042 O LEU B 35 -13.785 3.277 2.716 1.00 0.00 O ATOM 2043 CB LEU B 35 -14.317 0.424 1.147 1.00 0.00 C ATOM 2044 CG LEU B 35 -13.215 0.118 2.170 1.00 0.00 C ATOM 2045 CD1 LEU B 35 -13.832 -0.226 3.538 1.00 0.00 C ATOM 2046 CD2 LEU B 35 -12.390 -1.070 1.663 1.00 0.00 C ATOM 0 H LEU B 35 -16.201 1.332 -0.238 1.00 0.00 H new ATOM 0 HA LEU B 35 -15.544 1.461 2.572 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -14.977 -0.438 1.045 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -13.873 0.603 0.168 1.00 0.00 H new ATOM 0 HG LEU B 35 -12.578 0.995 2.290 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -13.037 -0.440 4.252 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -14.421 0.619 3.894 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -14.475 -1.100 3.438 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -11.602 -1.299 2.381 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -13.037 -1.939 1.546 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -11.943 -0.818 0.701 1.00 0.00 H new ATOM 2058 N ILE B 36 -13.971 3.539 0.550 1.00 0.00 N ATOM 2059 CA ILE B 36 -13.124 4.767 0.586 1.00 0.00 C ATOM 2060 C ILE B 36 -13.782 5.808 1.498 1.00 0.00 C ATOM 2061 O ILE B 36 -13.125 6.488 2.262 1.00 0.00 O ATOM 2062 CB ILE B 36 -13.014 5.336 -0.838 1.00 0.00 C ATOM 2063 CG1 ILE B 36 -12.111 4.415 -1.669 1.00 0.00 C ATOM 2064 CG2 ILE B 36 -12.405 6.746 -0.789 1.00 0.00 C ATOM 2065 CD1 ILE B 36 -12.123 4.848 -3.138 1.00 0.00 C ATOM 0 H ILE B 36 -14.311 3.273 -0.374 1.00 0.00 H new ATOM 0 HA ILE B 36 -12.132 4.524 0.967 1.00 0.00 H new ATOM 0 HB ILE B 36 -14.004 5.393 -1.290 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -11.093 4.446 -1.281 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -12.454 3.384 -1.583 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -12.329 7.145 -1.801 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -13.041 7.397 -0.189 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -11.412 6.698 -0.342 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -11.479 4.187 -3.717 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -13.141 4.794 -3.525 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -11.758 5.872 -3.218 1.00 0.00 H new ATOM 2077 N ASN B 37 -15.073 5.958 1.392 1.00 0.00 N ATOM 2078 CA ASN B 37 -15.787 6.978 2.213 1.00 0.00 C ATOM 2079 C ASN B 37 -15.589 6.725 3.712 1.00 0.00 C ATOM 2080 O ASN B 37 -15.409 7.645 4.485 1.00 0.00 O ATOM 2081 CB ASN B 37 -17.282 6.916 1.894 1.00 0.00 C ATOM 2082 CG ASN B 37 -17.504 7.217 0.411 1.00 0.00 C ATOM 2083 OD1 ASN B 37 -18.102 6.430 -0.297 1.00 0.00 O ATOM 2084 ND2 ASN B 37 -17.047 8.330 -0.094 1.00 0.00 N ATOM 0 H ASN B 37 -15.669 5.414 0.768 1.00 0.00 H new ATOM 0 HA ASN B 37 -15.379 7.960 1.972 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -17.675 5.929 2.138 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -17.825 7.636 2.507 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -17.192 8.539 -1.082 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -16.545 8.991 0.499 1.00 0.00 H new ATOM 2091 N ASN B 38 -15.656 5.488 4.134 1.00 0.00 N ATOM 2092 CA ASN B 38 -15.512 5.172 5.593 1.00 0.00 C ATOM 2093 C ASN B 38 -14.101 4.669 5.919 1.00 0.00 C ATOM 2094 O ASN B 38 -13.830 4.294 7.043 1.00 0.00 O ATOM 2095 CB ASN B 38 -16.521 4.081 5.960 1.00 0.00 C ATOM 2096 CG ASN B 38 -17.936 4.560 5.627 1.00 0.00 C ATOM 2097 OD1 ASN B 38 -18.148 5.219 4.629 1.00 0.00 O ATOM 2098 ND2 ASN B 38 -18.920 4.255 6.428 1.00 0.00 N ATOM 0 H ASN B 38 -15.805 4.679 3.531 1.00 0.00 H new ATOM 0 HA ASN B 38 -15.693 6.083 6.164 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -16.298 3.165 5.413 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -16.446 3.844 7.021 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -19.867 4.570 6.216 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -18.742 3.702 7.266 1.00 0.00 H new ATOM 2105 N GLU B 39 -13.203 4.638 4.962 1.00 0.00 N ATOM 2106 CA GLU B 39 -11.813 4.132 5.243 1.00 0.00 C ATOM 2107 C GLU B 39 -10.784 5.254 5.073 1.00 0.00 C ATOM 2108 O GLU B 39 -9.761 5.258 5.729 1.00 0.00 O ATOM 2109 CB GLU B 39 -11.487 3.004 4.260 1.00 0.00 C ATOM 2110 CG GLU B 39 -10.198 2.295 4.689 1.00 0.00 C ATOM 2111 CD GLU B 39 -10.484 1.399 5.895 1.00 0.00 C ATOM 2112 OE1 GLU B 39 -10.983 0.305 5.690 1.00 0.00 O ATOM 2113 OE2 GLU B 39 -10.200 1.822 7.004 1.00 0.00 O ATOM 0 H GLU B 39 -13.368 4.939 4.001 1.00 0.00 H new ATOM 0 HA GLU B 39 -11.771 3.769 6.270 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -12.310 2.291 4.225 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -11.373 3.408 3.254 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -9.807 1.699 3.865 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -9.433 3.030 4.942 1.00 0.00 H new ATOM 2120 N LEU B 40 -11.044 6.206 4.209 1.00 0.00 N ATOM 2121 CA LEU B 40 -10.076 7.336 3.999 1.00 0.00 C ATOM 2122 C LEU B 40 -10.766 8.668 4.308 1.00 0.00 C ATOM 2123 O LEU B 40 -10.602 9.643 3.602 1.00 0.00 O ATOM 2124 CB LEU B 40 -9.601 7.335 2.542 1.00 0.00 C ATOM 2125 CG LEU B 40 -9.003 5.965 2.189 1.00 0.00 C ATOM 2126 CD1 LEU B 40 -8.551 5.968 0.724 1.00 0.00 C ATOM 2127 CD2 LEU B 40 -7.797 5.666 3.097 1.00 0.00 C ATOM 0 H LEU B 40 -11.887 6.252 3.637 1.00 0.00 H new ATOM 0 HA LEU B 40 -9.221 7.208 4.663 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -10.436 7.559 1.878 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -8.856 8.116 2.393 1.00 0.00 H new ATOM 0 HG LEU B 40 -9.761 5.196 2.338 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -8.126 4.996 0.472 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -9.407 6.168 0.080 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -7.798 6.742 0.577 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -7.380 4.693 2.839 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -7.037 6.435 2.958 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -8.119 5.658 4.138 1.00 0.00 H new ATOM 2139 N SER B 41 -11.538 8.714 5.360 1.00 0.00 N ATOM 2140 CA SER B 41 -12.242 9.979 5.722 1.00 0.00 C ATOM 2141 C SER B 41 -11.245 10.992 6.290 1.00 0.00 C ATOM 2142 O SER B 41 -11.401 12.185 6.123 1.00 0.00 O ATOM 2143 CB SER B 41 -13.310 9.682 6.775 1.00 0.00 C ATOM 2144 OG SER B 41 -12.677 9.291 7.987 1.00 0.00 O ATOM 0 H SER B 41 -11.712 7.928 5.986 1.00 0.00 H new ATOM 0 HA SER B 41 -12.707 10.395 4.828 1.00 0.00 H new ATOM 0 HB2 SER B 41 -13.928 10.564 6.942 1.00 0.00 H new ATOM 0 HB3 SER B 41 -13.972 8.890 6.425 1.00 0.00 H new ATOM 0 HG SER B 41 -13.358 9.101 8.665 1.00 0.00 H new ATOM 2150 N HIS B 42 -10.228 10.536 6.971 1.00 0.00 N ATOM 2151 CA HIS B 42 -9.240 11.488 7.554 1.00 0.00 C ATOM 2152 C HIS B 42 -8.468 12.191 6.435 1.00 0.00 C ATOM 2153 O HIS B 42 -8.355 13.401 6.413 1.00 0.00 O ATOM 2154 CB HIS B 42 -8.258 10.720 8.443 1.00 0.00 C ATOM 2155 CG HIS B 42 -7.487 11.690 9.295 1.00 0.00 C ATOM 2156 ND1 HIS B 42 -6.102 11.741 9.288 1.00 0.00 N ATOM 2157 CD2 HIS B 42 -7.893 12.652 10.186 1.00 0.00 C ATOM 2158 CE1 HIS B 42 -5.727 12.704 10.151 1.00 0.00 C ATOM 2159 NE2 HIS B 42 -6.781 13.291 10.725 1.00 0.00 N ATOM 0 H HIS B 42 -10.039 9.549 7.148 1.00 0.00 H new ATOM 0 HA HIS B 42 -9.769 12.234 8.147 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -8.798 10.015 9.075 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -7.573 10.137 7.827 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -8.920 12.879 10.431 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -4.700 12.969 10.354 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -6.772 14.046 11.411 1.00 0.00 H new ATOM 2167 N PHE B 43 -7.931 11.446 5.508 1.00 0.00 N ATOM 2168 CA PHE B 43 -7.165 12.081 4.398 1.00 0.00 C ATOM 2169 C PHE B 43 -8.116 12.931 3.548 1.00 0.00 C ATOM 2170 O PHE B 43 -7.718 13.912 2.954 1.00 0.00 O ATOM 2171 CB PHE B 43 -6.516 10.985 3.532 1.00 0.00 C ATOM 2172 CG PHE B 43 -5.178 10.584 4.124 1.00 0.00 C ATOM 2173 CD1 PHE B 43 -5.114 10.072 5.427 1.00 0.00 C ATOM 2174 CD2 PHE B 43 -4.002 10.730 3.374 1.00 0.00 C ATOM 2175 CE1 PHE B 43 -3.879 9.707 5.976 1.00 0.00 C ATOM 2176 CE2 PHE B 43 -2.769 10.364 3.924 1.00 0.00 C ATOM 2177 CZ PHE B 43 -2.707 9.853 5.225 1.00 0.00 C ATOM 0 H PHE B 43 -7.989 10.428 5.471 1.00 0.00 H new ATOM 0 HA PHE B 43 -6.383 12.721 4.806 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -7.173 10.117 3.475 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -6.379 11.348 2.513 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -6.018 9.959 6.008 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -4.048 11.126 2.370 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -3.831 9.312 6.980 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -1.865 10.476 3.344 1.00 0.00 H new ATOM 0 HZ PHE B 43 -1.755 9.571 5.650 1.00 0.00 H new ATOM 2187 N LEU B 44 -9.364 12.557 3.476 1.00 0.00 N ATOM 2188 CA LEU B 44 -10.331 13.338 2.654 1.00 0.00 C ATOM 2189 C LEU B 44 -10.218 14.828 3.009 1.00 0.00 C ATOM 2190 O LEU B 44 -10.505 15.691 2.204 1.00 0.00 O ATOM 2191 CB LEU B 44 -11.761 12.822 2.929 1.00 0.00 C ATOM 2192 CG LEU B 44 -12.634 12.892 1.658 1.00 0.00 C ATOM 2193 CD1 LEU B 44 -12.641 14.323 1.109 1.00 0.00 C ATOM 2194 CD2 LEU B 44 -12.106 11.917 0.578 1.00 0.00 C ATOM 0 H LEU B 44 -9.756 11.744 3.951 1.00 0.00 H new ATOM 0 HA LEU B 44 -10.107 13.214 1.594 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -11.717 11.793 3.287 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -12.219 13.415 3.721 1.00 0.00 H new ATOM 0 HG LEU B 44 -13.651 12.601 1.920 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -13.259 14.366 0.212 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -13.047 14.999 1.861 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -11.623 14.623 0.863 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -12.735 11.982 -0.310 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -11.082 12.183 0.317 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -12.129 10.898 0.965 1.00 0.00 H new ATOM 2206 N GLU B 45 -9.796 15.138 4.204 1.00 0.00 N ATOM 2207 CA GLU B 45 -9.665 16.571 4.596 1.00 0.00 C ATOM 2208 C GLU B 45 -8.330 17.122 4.095 1.00 0.00 C ATOM 2209 O GLU B 45 -8.233 18.259 3.679 1.00 0.00 O ATOM 2210 CB GLU B 45 -9.725 16.694 6.120 1.00 0.00 C ATOM 2211 CG GLU B 45 -9.927 18.162 6.504 1.00 0.00 C ATOM 2212 CD GLU B 45 -9.628 18.349 7.993 1.00 0.00 C ATOM 2213 OE1 GLU B 45 -8.594 17.876 8.433 1.00 0.00 O ATOM 2214 OE2 GLU B 45 -10.439 18.963 8.666 1.00 0.00 O ATOM 0 H GLU B 45 -9.537 14.464 4.924 1.00 0.00 H new ATOM 0 HA GLU B 45 -10.482 17.140 4.152 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -10.542 16.088 6.513 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -8.804 16.314 6.563 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -9.272 18.798 5.909 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -10.951 18.468 6.287 1.00 0.00 H new ATOM 2221 N GLU B 46 -7.295 16.328 4.141 1.00 0.00 N ATOM 2222 CA GLU B 46 -5.957 16.806 3.678 1.00 0.00 C ATOM 2223 C GLU B 46 -5.788 16.536 2.179 1.00 0.00 C ATOM 2224 O GLU B 46 -4.857 15.874 1.763 1.00 0.00 O ATOM 2225 CB GLU B 46 -4.862 16.067 4.450 1.00 0.00 C ATOM 2226 CG GLU B 46 -4.861 16.533 5.908 1.00 0.00 C ATOM 2227 CD GLU B 46 -3.707 15.863 6.659 1.00 0.00 C ATOM 2228 OE1 GLU B 46 -3.269 14.814 6.218 1.00 0.00 O ATOM 2229 OE2 GLU B 46 -3.282 16.412 7.662 1.00 0.00 O ATOM 0 H GLU B 46 -7.317 15.366 4.480 1.00 0.00 H new ATOM 0 HA GLU B 46 -5.881 17.878 3.857 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -5.031 14.991 4.401 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -3.890 16.258 3.996 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -4.758 17.617 5.954 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -5.810 16.283 6.381 1.00 0.00 H new ATOM 2236 N ILE B 47 -6.674 17.058 1.364 1.00 0.00 N ATOM 2237 CA ILE B 47 -6.574 16.856 -0.119 1.00 0.00 C ATOM 2238 C ILE B 47 -6.359 18.213 -0.789 1.00 0.00 C ATOM 2239 O ILE B 47 -7.256 19.030 -0.854 1.00 0.00 O ATOM 2240 CB ILE B 47 -7.879 16.249 -0.644 1.00 0.00 C ATOM 2241 CG1 ILE B 47 -8.216 14.975 0.142 1.00 0.00 C ATOM 2242 CG2 ILE B 47 -7.733 15.916 -2.131 1.00 0.00 C ATOM 2243 CD1 ILE B 47 -7.033 13.999 0.130 1.00 0.00 C ATOM 0 H ILE B 47 -7.470 17.621 1.665 1.00 0.00 H new ATOM 0 HA ILE B 47 -5.743 16.187 -0.341 1.00 0.00 H new ATOM 0 HB ILE B 47 -8.685 16.971 -0.515 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -8.470 15.233 1.170 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -9.093 14.496 -0.292 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -8.663 15.485 -2.500 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -7.509 16.826 -2.687 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -6.922 15.200 -2.266 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -7.295 13.103 0.693 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -6.798 13.725 -0.898 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -6.165 14.474 0.587 1.00 0.00 H new ATOM 2255 N LYS B 48 -5.177 18.468 -1.288 1.00 0.00 N ATOM 2256 CA LYS B 48 -4.915 19.780 -1.952 1.00 0.00 C ATOM 2257 C LYS B 48 -5.220 19.666 -3.449 1.00 0.00 C ATOM 2258 O LYS B 48 -5.788 20.560 -4.045 1.00 0.00 O ATOM 2259 CB LYS B 48 -3.446 20.169 -1.761 1.00 0.00 C ATOM 2260 CG LYS B 48 -3.051 20.004 -0.289 1.00 0.00 C ATOM 2261 CD LYS B 48 -4.032 20.773 0.606 1.00 0.00 C ATOM 2262 CE LYS B 48 -3.400 21.003 1.982 1.00 0.00 C ATOM 2263 NZ LYS B 48 -4.361 21.732 2.856 1.00 0.00 N ATOM 0 H LYS B 48 -4.384 17.827 -1.265 1.00 0.00 H new ATOM 0 HA LYS B 48 -5.553 20.543 -1.507 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -2.811 19.545 -2.389 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -3.290 21.201 -2.075 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -3.051 18.948 -0.020 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -2.037 20.372 -0.132 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -4.286 21.728 0.147 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -4.961 20.212 0.710 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -3.133 20.048 2.435 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -2.479 21.576 1.879 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -3.931 21.888 3.790 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -4.595 22.649 2.425 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -5.229 21.169 2.964 1.00 0.00 H new ATOM 2277 N GLU B 49 -4.844 18.572 -4.065 1.00 0.00 N ATOM 2278 CA GLU B 49 -5.109 18.402 -5.527 1.00 0.00 C ATOM 2279 C GLU B 49 -6.472 17.733 -5.729 1.00 0.00 C ATOM 2280 O GLU B 49 -6.557 16.613 -6.193 1.00 0.00 O ATOM 2281 CB GLU B 49 -4.015 17.527 -6.143 1.00 0.00 C ATOM 2282 CG GLU B 49 -2.646 17.997 -5.648 1.00 0.00 C ATOM 2283 CD GLU B 49 -2.457 19.473 -6.002 1.00 0.00 C ATOM 2284 OE1 GLU B 49 -2.707 19.824 -7.144 1.00 0.00 O ATOM 2285 OE2 GLU B 49 -2.067 20.227 -5.127 1.00 0.00 O ATOM 0 H GLU B 49 -4.365 17.790 -3.618 1.00 0.00 H new ATOM 0 HA GLU B 49 -5.111 19.379 -6.011 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -4.173 16.483 -5.871 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -4.059 17.583 -7.231 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -2.569 17.858 -4.570 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -1.857 17.398 -6.104 1.00 0.00 H new ATOM 2292 N GLN B 50 -7.535 18.398 -5.374 1.00 0.00 N ATOM 2293 CA GLN B 50 -8.887 17.787 -5.533 1.00 0.00 C ATOM 2294 C GLN B 50 -9.017 17.147 -6.921 1.00 0.00 C ATOM 2295 O GLN B 50 -9.838 16.277 -7.137 1.00 0.00 O ATOM 2296 CB GLN B 50 -9.951 18.880 -5.371 1.00 0.00 C ATOM 2297 CG GLN B 50 -11.345 18.324 -5.695 1.00 0.00 C ATOM 2298 CD GLN B 50 -11.601 17.054 -4.881 1.00 0.00 C ATOM 2299 OE1 GLN B 50 -11.636 17.094 -3.668 1.00 0.00 O ATOM 2300 NE2 GLN B 50 -11.781 15.920 -5.502 1.00 0.00 N ATOM 0 H GLN B 50 -7.528 19.339 -4.980 1.00 0.00 H new ATOM 0 HA GLN B 50 -9.027 17.016 -4.775 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -9.934 19.264 -4.351 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -9.724 19.717 -6.031 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -12.106 19.071 -5.469 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -11.420 18.105 -6.760 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -11.752 15.886 -6.521 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -11.951 15.068 -4.968 1.00 0.00 H new ATOM 2309 N GLU B 51 -8.224 17.577 -7.865 1.00 0.00 N ATOM 2310 CA GLU B 51 -8.318 16.997 -9.237 1.00 0.00 C ATOM 2311 C GLU B 51 -7.719 15.586 -9.264 1.00 0.00 C ATOM 2312 O GLU B 51 -8.087 14.773 -10.088 1.00 0.00 O ATOM 2313 CB GLU B 51 -7.600 17.897 -10.245 1.00 0.00 C ATOM 2314 CG GLU B 51 -8.437 19.152 -10.498 1.00 0.00 C ATOM 2315 CD GLU B 51 -9.672 18.786 -11.323 1.00 0.00 C ATOM 2316 OE1 GLU B 51 -9.547 17.950 -12.203 1.00 0.00 O ATOM 2317 OE2 GLU B 51 -10.723 19.348 -11.061 1.00 0.00 O ATOM 0 H GLU B 51 -7.517 18.303 -7.747 1.00 0.00 H new ATOM 0 HA GLU B 51 -9.370 16.933 -9.514 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -6.617 18.174 -9.865 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -7.441 17.359 -11.180 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -8.739 19.597 -9.550 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -7.842 19.898 -11.026 1.00 0.00 H new ATOM 2324 N VAL B 52 -6.838 15.265 -8.359 1.00 0.00 N ATOM 2325 CA VAL B 52 -6.280 13.881 -8.342 1.00 0.00 C ATOM 2326 C VAL B 52 -7.352 12.946 -7.785 1.00 0.00 C ATOM 2327 O VAL B 52 -7.634 11.910 -8.353 1.00 0.00 O ATOM 2328 CB VAL B 52 -5.043 13.826 -7.440 1.00 0.00 C ATOM 2329 CG1 VAL B 52 -4.583 12.374 -7.286 1.00 0.00 C ATOM 2330 CG2 VAL B 52 -3.916 14.646 -8.067 1.00 0.00 C ATOM 0 H VAL B 52 -6.482 15.892 -7.637 1.00 0.00 H new ATOM 0 HA VAL B 52 -5.993 13.582 -9.350 1.00 0.00 H new ATOM 0 HB VAL B 52 -5.294 14.236 -6.462 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -3.703 12.337 -6.644 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -5.383 11.784 -6.839 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -4.335 11.965 -8.265 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -3.036 14.606 -7.425 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -3.669 14.236 -9.046 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -4.238 15.681 -8.178 1.00 0.00 H new ATOM 2340 N VAL B 53 -7.962 13.296 -6.690 1.00 0.00 N ATOM 2341 CA VAL B 53 -9.018 12.412 -6.129 1.00 0.00 C ATOM 2342 C VAL B 53 -10.171 12.321 -7.128 1.00 0.00 C ATOM 2343 O VAL B 53 -10.809 11.296 -7.263 1.00 0.00 O ATOM 2344 CB VAL B 53 -9.525 12.995 -4.808 1.00 0.00 C ATOM 2345 CG1 VAL B 53 -10.712 12.171 -4.308 1.00 0.00 C ATOM 2346 CG2 VAL B 53 -8.401 12.951 -3.770 1.00 0.00 C ATOM 0 H VAL B 53 -7.777 14.149 -6.162 1.00 0.00 H new ATOM 0 HA VAL B 53 -8.610 11.418 -5.947 1.00 0.00 H new ATOM 0 HB VAL B 53 -9.840 14.027 -4.962 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -11.073 12.587 -3.367 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -11.512 12.199 -5.048 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -10.398 11.139 -4.152 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -8.759 13.366 -2.828 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -8.088 11.918 -3.616 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -7.554 13.538 -4.126 1.00 0.00 H new ATOM 2356 N ASP B 54 -10.442 13.386 -7.831 1.00 0.00 N ATOM 2357 CA ASP B 54 -11.552 13.359 -8.821 1.00 0.00 C ATOM 2358 C ASP B 54 -11.299 12.249 -9.843 1.00 0.00 C ATOM 2359 O ASP B 54 -12.195 11.518 -10.214 1.00 0.00 O ATOM 2360 CB ASP B 54 -11.628 14.706 -9.542 1.00 0.00 C ATOM 2361 CG ASP B 54 -12.163 15.771 -8.583 1.00 0.00 C ATOM 2362 OD1 ASP B 54 -12.906 15.412 -7.684 1.00 0.00 O ATOM 2363 OD2 ASP B 54 -11.822 16.929 -8.764 1.00 0.00 O ATOM 0 H ASP B 54 -9.942 14.273 -7.762 1.00 0.00 H new ATOM 0 HA ASP B 54 -12.493 13.170 -8.304 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -10.641 14.992 -9.905 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -12.278 14.627 -10.414 1.00 0.00 H new ATOM 2368 N LYS B 55 -10.084 12.123 -10.313 1.00 0.00 N ATOM 2369 CA LYS B 55 -9.786 11.066 -11.321 1.00 0.00 C ATOM 2370 C LYS B 55 -9.854 9.688 -10.665 1.00 0.00 C ATOM 2371 O LYS B 55 -10.149 8.705 -11.314 1.00 0.00 O ATOM 2372 CB LYS B 55 -8.398 11.286 -11.923 1.00 0.00 C ATOM 2373 CG LYS B 55 -8.411 12.541 -12.805 1.00 0.00 C ATOM 2374 CD LYS B 55 -7.087 12.664 -13.584 1.00 0.00 C ATOM 2375 CE LYS B 55 -6.019 13.340 -12.715 1.00 0.00 C ATOM 2376 NZ LYS B 55 -6.335 14.789 -12.583 1.00 0.00 N ATOM 0 H LYS B 55 -9.290 12.704 -10.043 1.00 0.00 H new ATOM 0 HA LYS B 55 -10.528 11.121 -12.117 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -7.660 11.395 -11.129 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -8.105 10.418 -12.513 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -9.248 12.495 -13.502 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -8.560 13.426 -12.187 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -6.744 11.676 -13.890 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -7.245 13.243 -14.494 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -5.985 12.872 -11.731 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -5.034 13.210 -13.163 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -5.454 15.326 -12.453 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -6.817 15.119 -13.443 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -6.955 14.936 -11.761 1.00 0.00 H new ATOM 2390 N VAL B 56 -9.624 9.597 -9.384 1.00 0.00 N ATOM 2391 CA VAL B 56 -9.725 8.273 -8.713 1.00 0.00 C ATOM 2392 C VAL B 56 -11.186 7.829 -8.755 1.00 0.00 C ATOM 2393 O VAL B 56 -11.514 6.780 -9.272 1.00 0.00 O ATOM 2394 CB VAL B 56 -9.271 8.409 -7.259 1.00 0.00 C ATOM 2395 CG1 VAL B 56 -9.460 7.074 -6.537 1.00 0.00 C ATOM 2396 CG2 VAL B 56 -7.790 8.804 -7.223 1.00 0.00 C ATOM 0 H VAL B 56 -9.372 10.377 -8.777 1.00 0.00 H new ATOM 0 HA VAL B 56 -9.095 7.540 -9.216 1.00 0.00 H new ATOM 0 HB VAL B 56 -9.865 9.176 -6.763 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -9.136 7.172 -5.501 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -10.513 6.792 -6.563 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -8.866 6.306 -7.032 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -7.465 8.901 -6.187 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -7.196 8.036 -7.719 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -7.655 9.756 -7.737 1.00 0.00 H new ATOM 2406 N MET B 57 -12.067 8.623 -8.214 1.00 0.00 N ATOM 2407 CA MET B 57 -13.508 8.251 -8.222 1.00 0.00 C ATOM 2408 C MET B 57 -13.951 7.939 -9.656 1.00 0.00 C ATOM 2409 O MET B 57 -14.873 7.178 -9.876 1.00 0.00 O ATOM 2410 CB MET B 57 -14.336 9.421 -7.665 1.00 0.00 C ATOM 2411 CG MET B 57 -14.339 9.380 -6.131 1.00 0.00 C ATOM 2412 SD MET B 57 -12.639 9.285 -5.518 1.00 0.00 S ATOM 2413 CE MET B 57 -13.029 9.383 -3.752 1.00 0.00 C ATOM 0 H MET B 57 -11.851 9.514 -7.767 1.00 0.00 H new ATOM 0 HA MET B 57 -13.662 7.368 -7.601 1.00 0.00 H new ATOM 0 HB2 MET B 57 -13.921 10.368 -8.011 1.00 0.00 H new ATOM 0 HB3 MET B 57 -15.358 9.365 -8.040 1.00 0.00 H new ATOM 0 HG2 MET B 57 -14.829 10.270 -5.735 1.00 0.00 H new ATOM 0 HG3 MET B 57 -14.910 8.520 -5.782 1.00 0.00 H new ATOM 0 HE1 MET B 57 -12.107 9.341 -3.173 1.00 0.00 H new ATOM 0 HE2 MET B 57 -13.545 10.320 -3.545 1.00 0.00 H new ATOM 0 HE3 MET B 57 -13.670 8.546 -3.474 1.00 0.00 H new ATOM 2423 N GLU B 58 -13.293 8.506 -10.640 1.00 0.00 N ATOM 2424 CA GLU B 58 -13.667 8.225 -12.061 1.00 0.00 C ATOM 2425 C GLU B 58 -12.936 6.974 -12.560 1.00 0.00 C ATOM 2426 O GLU B 58 -13.489 6.191 -13.306 1.00 0.00 O ATOM 2427 CB GLU B 58 -13.329 9.425 -12.947 1.00 0.00 C ATOM 2428 CG GLU B 58 -13.983 9.251 -14.321 1.00 0.00 C ATOM 2429 CD GLU B 58 -13.342 10.215 -15.320 1.00 0.00 C ATOM 2430 OE1 GLU B 58 -12.768 11.198 -14.880 1.00 0.00 O ATOM 2431 OE2 GLU B 58 -13.433 9.953 -16.508 1.00 0.00 O ATOM 0 H GLU B 58 -12.513 9.152 -10.519 1.00 0.00 H new ATOM 0 HA GLU B 58 -14.741 8.048 -12.112 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -13.680 10.345 -12.480 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -12.248 9.516 -13.057 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -13.864 8.223 -14.664 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -15.054 9.442 -14.252 1.00 0.00 H new ATOM 2438 N THR B 59 -11.710 6.762 -12.166 1.00 0.00 N ATOM 2439 CA THR B 59 -10.999 5.542 -12.647 1.00 0.00 C ATOM 2440 C THR B 59 -11.678 4.318 -12.033 1.00 0.00 C ATOM 2441 O THR B 59 -12.020 3.385 -12.732 1.00 0.00 O ATOM 2442 CB THR B 59 -9.517 5.594 -12.259 1.00 0.00 C ATOM 2443 OG1 THR B 59 -9.037 6.922 -12.410 1.00 0.00 O ATOM 2444 CG2 THR B 59 -8.715 4.653 -13.162 1.00 0.00 C ATOM 0 H THR B 59 -11.177 7.368 -11.543 1.00 0.00 H new ATOM 0 HA THR B 59 -11.050 5.485 -13.734 1.00 0.00 H new ATOM 0 HB THR B 59 -9.402 5.281 -11.221 1.00 0.00 H new ATOM 0 HG1 THR B 59 -9.185 7.420 -11.579 1.00 0.00 H new ATOM 0 HG21 THR B 59 -7.662 4.692 -12.884 1.00 0.00 H new ATOM 0 HG22 THR B 59 -9.084 3.634 -13.045 1.00 0.00 H new ATOM 0 HG23 THR B 59 -8.828 4.962 -14.201 1.00 0.00 H new ATOM 2452 N LEU B 60 -11.927 4.317 -10.757 1.00 0.00 N ATOM 2453 CA LEU B 60 -12.640 3.154 -10.164 1.00 0.00 C ATOM 2454 C LEU B 60 -13.976 3.006 -10.895 1.00 0.00 C ATOM 2455 O LEU B 60 -14.279 1.963 -11.438 1.00 0.00 O ATOM 2456 CB LEU B 60 -12.892 3.410 -8.666 1.00 0.00 C ATOM 2457 CG LEU B 60 -11.685 2.941 -7.844 1.00 0.00 C ATOM 2458 CD1 LEU B 60 -10.469 3.808 -8.173 1.00 0.00 C ATOM 2459 CD2 LEU B 60 -12.009 3.064 -6.354 1.00 0.00 C ATOM 0 H LEU B 60 -11.673 5.059 -10.105 1.00 0.00 H new ATOM 0 HA LEU B 60 -12.046 2.246 -10.266 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -13.069 4.472 -8.495 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -13.789 2.881 -8.344 1.00 0.00 H new ATOM 0 HG LEU B 60 -11.463 1.902 -8.087 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -9.613 3.472 -7.587 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -10.238 3.723 -9.235 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -10.688 4.848 -7.932 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -11.153 2.731 -5.767 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -12.231 4.104 -6.115 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -12.874 2.444 -6.117 1.00 0.00 H new ATOM 2471 N ASP B 61 -14.772 4.041 -10.929 1.00 0.00 N ATOM 2472 CA ASP B 61 -16.076 3.945 -11.643 1.00 0.00 C ATOM 2473 C ASP B 61 -15.838 3.366 -13.040 1.00 0.00 C ATOM 2474 O ASP B 61 -16.713 2.765 -13.632 1.00 0.00 O ATOM 2475 CB ASP B 61 -16.696 5.338 -11.769 1.00 0.00 C ATOM 2476 CG ASP B 61 -17.125 5.834 -10.387 1.00 0.00 C ATOM 2477 OD1 ASP B 61 -17.322 5.004 -9.516 1.00 0.00 O ATOM 2478 OD2 ASP B 61 -17.249 7.037 -10.224 1.00 0.00 O ATOM 0 H ASP B 61 -14.577 4.943 -10.496 1.00 0.00 H new ATOM 0 HA ASP B 61 -16.753 3.299 -11.085 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -15.976 6.029 -12.208 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -17.556 5.306 -12.438 1.00 0.00 H new ATOM 2483 N GLU B 62 -14.652 3.538 -13.568 1.00 0.00 N ATOM 2484 CA GLU B 62 -14.339 2.994 -14.926 1.00 0.00 C ATOM 2485 C GLU B 62 -13.597 1.676 -14.779 1.00 0.00 C ATOM 2486 O GLU B 62 -12.667 1.369 -15.498 1.00 0.00 O ATOM 2487 CB GLU B 62 -13.454 3.963 -15.661 1.00 0.00 C ATOM 2488 CG GLU B 62 -14.245 5.218 -16.047 1.00 0.00 C ATOM 2489 CD GLU B 62 -15.142 4.909 -17.247 1.00 0.00 C ATOM 2490 OE1 GLU B 62 -14.622 4.437 -18.244 1.00 0.00 O ATOM 2491 OE2 GLU B 62 -16.334 5.150 -17.149 1.00 0.00 O ATOM 0 H GLU B 62 -13.884 4.034 -13.115 1.00 0.00 H new ATOM 0 HA GLU B 62 -15.267 2.844 -15.478 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -12.605 4.238 -15.035 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -13.050 3.490 -16.556 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -14.850 5.553 -15.204 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -13.561 6.031 -16.291 1.00 0.00 H new ATOM 2498 N ASP B 63 -14.022 0.913 -13.848 1.00 0.00 N ATOM 2499 CA ASP B 63 -13.397 -0.419 -13.582 1.00 0.00 C ATOM 2500 C ASP B 63 -13.172 -1.149 -14.903 1.00 0.00 C ATOM 2501 O ASP B 63 -12.155 -1.782 -15.112 1.00 0.00 O ATOM 2502 CB ASP B 63 -14.374 -1.238 -12.748 1.00 0.00 C ATOM 2503 CG ASP B 63 -13.819 -2.647 -12.542 1.00 0.00 C ATOM 2504 OD1 ASP B 63 -12.686 -2.879 -12.932 1.00 0.00 O ATOM 2505 OD2 ASP B 63 -14.535 -3.471 -11.998 1.00 0.00 O ATOM 0 H ASP B 63 -14.799 1.146 -13.230 1.00 0.00 H new ATOM 0 HA ASP B 63 -12.446 -0.289 -13.065 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -14.537 -0.756 -11.784 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -15.342 -1.287 -13.248 1.00 0.00 H new ATOM 2510 N GLY B 64 -14.104 -1.031 -15.802 1.00 0.00 N ATOM 2511 CA GLY B 64 -13.968 -1.684 -17.133 1.00 0.00 C ATOM 2512 C GLY B 64 -13.620 -3.178 -17.007 1.00 0.00 C ATOM 2513 O GLY B 64 -13.547 -3.873 -18.002 1.00 0.00 O ATOM 0 H GLY B 64 -14.967 -0.503 -15.671 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -14.900 -1.574 -17.688 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -13.193 -1.178 -17.708 1.00 0.00 H new ATOM 2517 N ASP B 65 -13.390 -3.683 -15.811 1.00 0.00 N ATOM 2518 CA ASP B 65 -13.030 -5.139 -15.646 1.00 0.00 C ATOM 2519 C ASP B 65 -14.165 -5.967 -14.979 1.00 0.00 C ATOM 2520 O ASP B 65 -14.084 -7.180 -14.942 1.00 0.00 O ATOM 2521 CB ASP B 65 -11.776 -5.243 -14.775 1.00 0.00 C ATOM 2522 CG ASP B 65 -11.183 -6.649 -14.897 1.00 0.00 C ATOM 2523 OD1 ASP B 65 -11.231 -7.198 -15.985 1.00 0.00 O ATOM 2524 OD2 ASP B 65 -10.691 -7.152 -13.900 1.00 0.00 O ATOM 0 H ASP B 65 -13.436 -3.151 -14.942 1.00 0.00 H new ATOM 0 HA ASP B 65 -12.863 -5.548 -16.643 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -11.042 -4.499 -15.086 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -12.024 -5.031 -13.735 1.00 0.00 H new ATOM 2529 N GLY B 66 -15.223 -5.371 -14.468 1.00 0.00 N ATOM 2530 CA GLY B 66 -16.311 -6.187 -13.850 1.00 0.00 C ATOM 2531 C GLY B 66 -15.945 -6.593 -12.414 1.00 0.00 C ATOM 2532 O GLY B 66 -16.812 -6.777 -11.582 1.00 0.00 O ATOM 0 H GLY B 66 -15.374 -4.362 -14.455 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -17.240 -5.617 -13.845 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -16.487 -7.079 -14.451 1.00 0.00 H new ATOM 2536 N GLU B 67 -14.678 -6.728 -12.104 1.00 0.00 N ATOM 2537 CA GLU B 67 -14.289 -7.117 -10.706 1.00 0.00 C ATOM 2538 C GLU B 67 -12.925 -6.516 -10.348 1.00 0.00 C ATOM 2539 O GLU B 67 -11.979 -6.621 -11.103 1.00 0.00 O ATOM 2540 CB GLU B 67 -14.204 -8.645 -10.590 1.00 0.00 C ATOM 2541 CG GLU B 67 -15.599 -9.281 -10.734 1.00 0.00 C ATOM 2542 CD GLU B 67 -15.952 -9.454 -12.216 1.00 0.00 C ATOM 2543 OE1 GLU B 67 -15.061 -9.779 -12.985 1.00 0.00 O ATOM 2544 OE2 GLU B 67 -17.108 -9.265 -12.555 1.00 0.00 O ATOM 0 H GLU B 67 -13.901 -6.588 -12.750 1.00 0.00 H new ATOM 0 HA GLU B 67 -15.046 -6.737 -10.020 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -13.539 -9.037 -11.360 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -13.772 -8.918 -9.627 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -15.619 -10.249 -10.233 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -16.345 -8.654 -10.246 1.00 0.00 H new ATOM 2551 N CYS B 68 -12.810 -5.903 -9.193 1.00 0.00 N ATOM 2552 CA CYS B 68 -11.500 -5.307 -8.769 1.00 0.00 C ATOM 2553 C CYS B 68 -10.862 -6.200 -7.699 1.00 0.00 C ATOM 2554 O CYS B 68 -11.485 -6.550 -6.716 1.00 0.00 O ATOM 2555 CB CYS B 68 -11.739 -3.912 -8.186 1.00 0.00 C ATOM 2556 SG CYS B 68 -12.595 -2.886 -9.406 1.00 0.00 S ATOM 0 H CYS B 68 -13.570 -5.789 -8.522 1.00 0.00 H new ATOM 0 HA CYS B 68 -10.837 -5.233 -9.631 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -12.333 -3.984 -7.275 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -10.789 -3.453 -7.912 1.00 0.00 H new ATOM 0 HG CYS B 68 -13.405 -3.626 -10.103 1.00 0.00 H new ATOM 2562 N ASP B 69 -9.625 -6.582 -7.886 1.00 0.00 N ATOM 2563 CA ASP B 69 -8.947 -7.463 -6.885 1.00 0.00 C ATOM 2564 C ASP B 69 -8.329 -6.616 -5.768 1.00 0.00 C ATOM 2565 O ASP B 69 -8.521 -5.418 -5.701 1.00 0.00 O ATOM 2566 CB ASP B 69 -7.845 -8.262 -7.580 1.00 0.00 C ATOM 2567 CG ASP B 69 -8.427 -8.982 -8.798 1.00 0.00 C ATOM 2568 OD1 ASP B 69 -9.305 -8.420 -9.431 1.00 0.00 O ATOM 2569 OD2 ASP B 69 -7.984 -10.084 -9.077 1.00 0.00 O ATOM 0 H ASP B 69 -9.053 -6.322 -8.690 1.00 0.00 H new ATOM 0 HA ASP B 69 -9.682 -8.141 -6.452 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -7.038 -7.597 -7.889 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -7.414 -8.986 -6.888 1.00 0.00 H new ATOM 2574 N PHE B 70 -7.576 -7.235 -4.896 1.00 0.00 N ATOM 2575 CA PHE B 70 -6.930 -6.473 -3.786 1.00 0.00 C ATOM 2576 C PHE B 70 -5.765 -5.660 -4.354 1.00 0.00 C ATOM 2577 O PHE B 70 -5.515 -4.549 -3.932 1.00 0.00 O ATOM 2578 CB PHE B 70 -6.418 -7.455 -2.725 1.00 0.00 C ATOM 2579 CG PHE B 70 -5.915 -6.706 -1.509 1.00 0.00 C ATOM 2580 CD1 PHE B 70 -4.675 -6.051 -1.545 1.00 0.00 C ATOM 2581 CD2 PHE B 70 -6.686 -6.675 -0.340 1.00 0.00 C ATOM 2582 CE1 PHE B 70 -4.212 -5.366 -0.414 1.00 0.00 C ATOM 2583 CE2 PHE B 70 -6.222 -5.991 0.789 1.00 0.00 C ATOM 2584 CZ PHE B 70 -4.985 -5.336 0.752 1.00 0.00 C ATOM 0 H PHE B 70 -7.380 -8.236 -4.905 1.00 0.00 H new ATOM 0 HA PHE B 70 -7.652 -5.799 -3.325 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -7.218 -8.136 -2.435 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -5.616 -8.064 -3.142 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -4.077 -6.075 -2.444 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -7.640 -7.180 -0.310 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -3.258 -4.861 -0.442 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -6.818 -5.968 1.689 1.00 0.00 H new ATOM 0 HZ PHE B 70 -4.627 -4.808 1.623 1.00 0.00 H new ATOM 2594 N GLN B 71 -5.053 -6.191 -5.306 1.00 0.00 N ATOM 2595 CA GLN B 71 -3.917 -5.422 -5.883 1.00 0.00 C ATOM 2596 C GLN B 71 -4.434 -4.062 -6.358 1.00 0.00 C ATOM 2597 O GLN B 71 -3.770 -3.053 -6.223 1.00 0.00 O ATOM 2598 CB GLN B 71 -3.327 -6.192 -7.067 1.00 0.00 C ATOM 2599 CG GLN B 71 -2.019 -5.533 -7.508 1.00 0.00 C ATOM 2600 CD GLN B 71 -1.533 -6.182 -8.806 1.00 0.00 C ATOM 2601 OE1 GLN B 71 -2.326 -6.537 -9.655 1.00 0.00 O ATOM 2602 NE2 GLN B 71 -0.254 -6.352 -8.996 1.00 0.00 N ATOM 0 H GLN B 71 -5.206 -7.116 -5.707 1.00 0.00 H new ATOM 0 HA GLN B 71 -3.142 -5.280 -5.129 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -3.146 -7.229 -6.785 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -4.036 -6.205 -7.895 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -2.170 -4.464 -7.658 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -1.264 -5.642 -6.729 1.00 0.00 H new ATOM 0 HE21 GLN B 71 0.412 -6.054 -8.283 1.00 0.00 H new ATOM 0 HE22 GLN B 71 0.081 -6.783 -9.858 1.00 0.00 H new ATOM 2611 N GLU B 72 -5.619 -4.025 -6.904 1.00 0.00 N ATOM 2612 CA GLU B 72 -6.184 -2.729 -7.378 1.00 0.00 C ATOM 2613 C GLU B 72 -6.588 -1.869 -6.174 1.00 0.00 C ATOM 2614 O GLU B 72 -6.590 -0.659 -6.236 1.00 0.00 O ATOM 2615 CB GLU B 72 -7.402 -2.986 -8.267 1.00 0.00 C ATOM 2616 CG GLU B 72 -7.089 -4.120 -9.246 1.00 0.00 C ATOM 2617 CD GLU B 72 -8.192 -4.200 -10.303 1.00 0.00 C ATOM 2618 OE1 GLU B 72 -9.194 -3.526 -10.137 1.00 0.00 O ATOM 2619 OE2 GLU B 72 -8.014 -4.935 -11.261 1.00 0.00 O ATOM 0 H GLU B 72 -6.221 -4.837 -7.043 1.00 0.00 H new ATOM 0 HA GLU B 72 -5.428 -2.200 -7.958 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -8.264 -3.248 -7.654 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -7.664 -2.080 -8.814 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -6.125 -3.947 -9.724 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -7.014 -5.067 -8.711 1.00 0.00 H new ATOM 2626 N PHE B 73 -6.881 -2.487 -5.064 1.00 0.00 N ATOM 2627 CA PHE B 73 -7.237 -1.710 -3.840 1.00 0.00 C ATOM 2628 C PHE B 73 -5.959 -1.106 -3.256 1.00 0.00 C ATOM 2629 O PHE B 73 -5.958 0.018 -2.802 1.00 0.00 O ATOM 2630 CB PHE B 73 -7.932 -2.622 -2.820 1.00 0.00 C ATOM 2631 CG PHE B 73 -8.059 -1.918 -1.486 1.00 0.00 C ATOM 2632 CD1 PHE B 73 -9.068 -0.968 -1.286 1.00 0.00 C ATOM 2633 CD2 PHE B 73 -7.174 -2.226 -0.444 1.00 0.00 C ATOM 2634 CE1 PHE B 73 -9.191 -0.325 -0.048 1.00 0.00 C ATOM 2635 CE2 PHE B 73 -7.298 -1.585 0.794 1.00 0.00 C ATOM 2636 CZ PHE B 73 -8.306 -0.634 0.993 1.00 0.00 C ATOM 0 H PHE B 73 -6.890 -3.501 -4.950 1.00 0.00 H new ATOM 0 HA PHE B 73 -7.930 -0.907 -4.093 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -8.920 -2.902 -3.186 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -7.363 -3.544 -2.700 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -9.752 -0.731 -2.087 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -6.395 -2.959 -0.596 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -9.968 0.409 0.104 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -6.616 -1.824 1.596 1.00 0.00 H new ATOM 0 HZ PHE B 73 -8.401 -0.139 1.948 1.00 0.00 H new ATOM 2646 N MET B 74 -4.869 -1.809 -3.274 1.00 0.00 N ATOM 2647 CA MET B 74 -3.624 -1.203 -2.725 1.00 0.00 C ATOM 2648 C MET B 74 -3.173 -0.068 -3.658 1.00 0.00 C ATOM 2649 O MET B 74 -2.951 1.040 -3.212 1.00 0.00 O ATOM 2650 CB MET B 74 -2.525 -2.272 -2.605 1.00 0.00 C ATOM 2651 CG MET B 74 -1.516 -1.868 -1.523 1.00 0.00 C ATOM 2652 SD MET B 74 -2.195 -2.269 0.113 1.00 0.00 S ATOM 2653 CE MET B 74 -2.244 -0.591 0.796 1.00 0.00 C ATOM 0 H MET B 74 -4.781 -2.758 -3.636 1.00 0.00 H new ATOM 0 HA MET B 74 -3.815 -0.800 -1.730 1.00 0.00 H new ATOM 0 HB2 MET B 74 -2.969 -3.236 -2.358 1.00 0.00 H new ATOM 0 HB3 MET B 74 -2.016 -2.392 -3.562 1.00 0.00 H new ATOM 0 HG2 MET B 74 -0.572 -2.392 -1.676 1.00 0.00 H new ATOM 0 HG3 MET B 74 -1.303 -0.801 -1.589 1.00 0.00 H new ATOM 0 HE1 MET B 74 -2.414 -0.641 1.872 1.00 0.00 H new ATOM 0 HE2 MET B 74 -1.295 -0.091 0.601 1.00 0.00 H new ATOM 0 HE3 MET B 74 -3.053 -0.031 0.327 1.00 0.00 H new ATOM 2663 N ALA B 75 -3.029 -0.306 -4.931 1.00 0.00 N ATOM 2664 CA ALA B 75 -2.587 0.788 -5.848 1.00 0.00 C ATOM 2665 C ALA B 75 -3.540 1.988 -5.791 1.00 0.00 C ATOM 2666 O ALA B 75 -3.112 3.108 -5.593 1.00 0.00 O ATOM 2667 CB ALA B 75 -2.545 0.253 -7.280 1.00 0.00 C ATOM 0 H ALA B 75 -3.197 -1.207 -5.378 1.00 0.00 H new ATOM 0 HA ALA B 75 -1.599 1.121 -5.531 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -2.223 1.046 -7.955 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -1.843 -0.579 -7.337 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -3.538 -0.089 -7.570 1.00 0.00 H new ATOM 2673 N PHE B 76 -4.814 1.791 -5.983 1.00 0.00 N ATOM 2674 CA PHE B 76 -5.740 2.967 -5.955 1.00 0.00 C ATOM 2675 C PHE B 76 -5.700 3.625 -4.570 1.00 0.00 C ATOM 2676 O PHE B 76 -5.824 4.827 -4.440 1.00 0.00 O ATOM 2677 CB PHE B 76 -7.180 2.523 -6.293 1.00 0.00 C ATOM 2678 CG PHE B 76 -7.379 2.507 -7.800 1.00 0.00 C ATOM 2679 CD1 PHE B 76 -7.240 3.693 -8.537 1.00 0.00 C ATOM 2680 CD2 PHE B 76 -7.693 1.311 -8.459 1.00 0.00 C ATOM 2681 CE1 PHE B 76 -7.413 3.678 -9.925 1.00 0.00 C ATOM 2682 CE2 PHE B 76 -7.868 1.300 -9.848 1.00 0.00 C ATOM 2683 CZ PHE B 76 -7.726 2.483 -10.580 1.00 0.00 C ATOM 0 H PHE B 76 -5.252 0.886 -6.155 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.416 3.691 -6.703 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.369 1.531 -5.882 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.897 3.202 -5.830 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -6.999 4.617 -8.033 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -7.800 0.396 -7.895 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -7.305 4.591 -10.492 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -8.113 0.378 -10.354 1.00 0.00 H new ATOM 0 HZ PHE B 76 -7.858 2.474 -11.652 1.00 0.00 H new ATOM 2693 N VAL B 77 -5.520 2.851 -3.542 1.00 0.00 N ATOM 2694 CA VAL B 77 -5.463 3.442 -2.174 1.00 0.00 C ATOM 2695 C VAL B 77 -4.184 4.279 -2.042 1.00 0.00 C ATOM 2696 O VAL B 77 -4.159 5.288 -1.366 1.00 0.00 O ATOM 2697 CB VAL B 77 -5.473 2.313 -1.133 1.00 0.00 C ATOM 2698 CG1 VAL B 77 -5.046 2.853 0.240 1.00 0.00 C ATOM 2699 CG2 VAL B 77 -6.890 1.722 -1.033 1.00 0.00 C ATOM 0 H VAL B 77 -5.410 1.838 -3.585 1.00 0.00 H new ATOM 0 HA VAL B 77 -6.328 4.084 -2.006 1.00 0.00 H new ATOM 0 HB VAL B 77 -4.771 1.538 -1.443 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -5.057 2.043 0.969 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -4.039 3.266 0.172 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -5.738 3.634 0.555 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -6.899 0.920 -0.294 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -7.589 2.502 -0.730 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -7.188 1.325 -2.003 1.00 0.00 H new ATOM 2709 N SER B 78 -3.124 3.869 -2.683 1.00 0.00 N ATOM 2710 CA SER B 78 -1.853 4.643 -2.594 1.00 0.00 C ATOM 2711 C SER B 78 -2.036 6.018 -3.247 1.00 0.00 C ATOM 2712 O SER B 78 -1.634 7.027 -2.703 1.00 0.00 O ATOM 2713 CB SER B 78 -0.745 3.881 -3.320 1.00 0.00 C ATOM 2714 OG SER B 78 0.516 4.432 -2.965 1.00 0.00 O ATOM 0 H SER B 78 -3.083 3.032 -3.264 1.00 0.00 H new ATOM 0 HA SER B 78 -1.584 4.775 -1.546 1.00 0.00 H new ATOM 0 HB2 SER B 78 -0.781 2.824 -3.054 1.00 0.00 H new ATOM 0 HB3 SER B 78 -0.891 3.944 -4.398 1.00 0.00 H new ATOM 0 HG SER B 78 1.228 3.944 -3.428 1.00 0.00 H new ATOM 2720 N MET B 79 -2.617 6.070 -4.414 1.00 0.00 N ATOM 2721 CA MET B 79 -2.795 7.382 -5.100 1.00 0.00 C ATOM 2722 C MET B 79 -3.545 8.356 -4.194 1.00 0.00 C ATOM 2723 O MET B 79 -3.099 9.457 -3.949 1.00 0.00 O ATOM 2724 CB MET B 79 -3.596 7.174 -6.389 1.00 0.00 C ATOM 2725 CG MET B 79 -2.716 6.503 -7.448 1.00 0.00 C ATOM 2726 SD MET B 79 -1.663 7.749 -8.232 1.00 0.00 S ATOM 2727 CE MET B 79 -2.828 8.256 -9.521 1.00 0.00 C ATOM 0 H MET B 79 -2.976 5.262 -4.922 1.00 0.00 H new ATOM 0 HA MET B 79 -1.814 7.796 -5.332 1.00 0.00 H new ATOM 0 HB2 MET B 79 -4.472 6.557 -6.188 1.00 0.00 H new ATOM 0 HB3 MET B 79 -3.960 8.132 -6.760 1.00 0.00 H new ATOM 0 HG2 MET B 79 -2.102 5.729 -6.989 1.00 0.00 H new ATOM 0 HG3 MET B 79 -3.338 6.014 -8.197 1.00 0.00 H new ATOM 0 HE1 MET B 79 -2.375 9.034 -10.135 1.00 0.00 H new ATOM 0 HE2 MET B 79 -3.075 7.398 -10.146 1.00 0.00 H new ATOM 0 HE3 MET B 79 -3.737 8.642 -9.059 1.00 0.00 H new ATOM 2737 N VAL B 80 -4.690 7.972 -3.711 1.00 0.00 N ATOM 2738 CA VAL B 80 -5.469 8.900 -2.839 1.00 0.00 C ATOM 2739 C VAL B 80 -4.592 9.362 -1.673 1.00 0.00 C ATOM 2740 O VAL B 80 -4.638 10.506 -1.266 1.00 0.00 O ATOM 2741 CB VAL B 80 -6.703 8.183 -2.286 1.00 0.00 C ATOM 2742 CG1 VAL B 80 -7.441 9.112 -1.319 1.00 0.00 C ATOM 2743 CG2 VAL B 80 -7.639 7.807 -3.437 1.00 0.00 C ATOM 0 H VAL B 80 -5.121 7.063 -3.878 1.00 0.00 H new ATOM 0 HA VAL B 80 -5.784 9.761 -3.428 1.00 0.00 H new ATOM 0 HB VAL B 80 -6.390 7.280 -1.762 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -8.320 8.602 -0.924 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -6.778 9.382 -0.497 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -7.751 10.014 -1.846 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -8.517 7.297 -3.040 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -7.951 8.710 -3.962 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -7.117 7.146 -4.129 1.00 0.00 H new ATOM 2753 N THR B 81 -3.783 8.489 -1.141 1.00 0.00 N ATOM 2754 CA THR B 81 -2.896 8.890 -0.014 1.00 0.00 C ATOM 2755 C THR B 81 -1.839 9.865 -0.539 1.00 0.00 C ATOM 2756 O THR B 81 -1.634 10.931 0.006 1.00 0.00 O ATOM 2757 CB THR B 81 -2.211 7.648 0.561 1.00 0.00 C ATOM 2758 OG1 THR B 81 -3.171 6.614 0.726 1.00 0.00 O ATOM 2759 CG2 THR B 81 -1.587 7.987 1.914 1.00 0.00 C ATOM 0 H THR B 81 -3.698 7.517 -1.437 1.00 0.00 H new ATOM 0 HA THR B 81 -3.483 9.370 0.769 1.00 0.00 H new ATOM 0 HB THR B 81 -1.430 7.314 -0.123 1.00 0.00 H new ATOM 0 HG1 THR B 81 -3.306 6.154 -0.129 1.00 0.00 H new ATOM 0 HG21 THR B 81 -1.100 7.101 2.322 1.00 0.00 H new ATOM 0 HG22 THR B 81 -0.850 8.780 1.786 1.00 0.00 H new ATOM 0 HG23 THR B 81 -2.365 8.321 2.600 1.00 0.00 H new ATOM 2767 N THR B 82 -1.171 9.503 -1.600 1.00 0.00 N ATOM 2768 CA THR B 82 -0.128 10.398 -2.179 1.00 0.00 C ATOM 2769 C THR B 82 -0.796 11.594 -2.862 1.00 0.00 C ATOM 2770 O THR B 82 -0.175 12.610 -3.102 1.00 0.00 O ATOM 2771 CB THR B 82 0.700 9.623 -3.205 1.00 0.00 C ATOM 2772 OG1 THR B 82 -0.168 9.039 -4.165 1.00 0.00 O ATOM 2773 CG2 THR B 82 1.498 8.525 -2.498 1.00 0.00 C ATOM 0 H THR B 82 -1.303 8.620 -2.094 1.00 0.00 H new ATOM 0 HA THR B 82 0.523 10.755 -1.381 1.00 0.00 H new ATOM 0 HB THR B 82 1.390 10.303 -3.704 1.00 0.00 H new ATOM 0 HG1 THR B 82 -0.598 8.247 -3.779 1.00 0.00 H new ATOM 0 HG21 THR B 82 2.087 7.974 -3.231 1.00 0.00 H new ATOM 0 HG22 THR B 82 2.164 8.976 -1.762 1.00 0.00 H new ATOM 0 HG23 THR B 82 0.812 7.842 -1.997 1.00 0.00 H new ATOM 2781 N ALA B 83 -2.058 11.483 -3.176 1.00 0.00 N ATOM 2782 CA ALA B 83 -2.763 12.614 -3.842 1.00 0.00 C ATOM 2783 C ALA B 83 -2.605 13.872 -2.989 1.00 0.00 C ATOM 2784 O ALA B 83 -2.644 14.981 -3.483 1.00 0.00 O ATOM 2785 CB ALA B 83 -4.248 12.278 -3.987 1.00 0.00 C ATOM 0 H ALA B 83 -2.631 10.658 -3.000 1.00 0.00 H new ATOM 0 HA ALA B 83 -2.335 12.783 -4.830 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -4.763 13.106 -4.474 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -4.360 11.376 -4.589 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -4.681 12.112 -3.001 1.00 0.00 H new