USER MOD reduce.3.24.130724 H: found=0, std=0, add=1047, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1047 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 39 THR OG1 : rot -104:sc= 1.12 USER MOD Set 1.2: A 131 GLN : amide:sc= 0.657 K(o=1.8,f=-1.1) USER MOD Set 2.1: A 14 LYS NZ :NH3+ 172:sc= 1.22 (180deg=0) USER MOD Set 2.2: A 125 THR OG1 : rot -150:sc= 0.987 USER MOD Set 3.1: A 100 GLN : amide:sc=-0.00582 K(o=1.5,f=-2.9!) USER MOD Set 3.2: A 119 HIS : no HE2:sc= 0.394 K(o=1.5,f=-1.5) USER MOD Set 3.3: A 121 THR OG1 : rot 100:sc= 1.09 USER MOD Set 4.1: A 103 SER OG : rot 170:sc= 0.547 USER MOD Set 4.2: A 118 THR OG1 : rot 180:sc= 0.00393 USER MOD Set 5.1: A 93 HIS : no HD1:sc= 0.632 K(o=0.35,f=-7.2!) USER MOD Set 5.2: A 95 GLN : amide:sc= -0.286 K(o=0.35,f=-6.4!) USER MOD Set 6.1: A 53 THR OG1 : rot 126:sc= 1.2 USER MOD Set 6.2: A 60 THR OG1 : rot 180:sc= 1.02 USER MOD Set 7.1: A 40 THR OG1 : rot 148:sc= 1.38 USER MOD Set 7.2: A 128 TYR OH : rot 180:sc= 0.931 USER MOD Single : A 1 VAL N :NH3+ -177:sc=-7.27e-05 (180deg=-0.0118) USER MOD Single : A 7 THR OG1 : rot 132:sc= 1.02 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot -56:sc= 0.631 USER MOD Single : A 15 ASN : amide:sc= 1.14 K(o=1.1,f=-0.4) USER MOD Single : A 19 TYR OH : rot 15:sc=-0.00158 USER MOD Single : A 20 MET CE :methyl -168:sc= -0.0571 (180deg=-0.32) USER MOD Single : A 21 LYS NZ :NH3+ 172:sc= 1.24 (180deg=1.08) USER MOD Single : A 22 SER OG : rot -81:sc= 0.854 USER MOD Single : A 29 THR OG1 : rot -19:sc= 0.676 USER MOD Single : A 31 GLN : amide:sc= 0.169 K(o=0.17,f=-1.3) USER MOD Single : A 34 ASN :FLIP amide:sc= -0.149 F(o=-1.3,f=-0.15) USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ -178:sc= 1.31 (180deg=1.25) USER MOD Single : A 45 ASN : amide:sc= -0.0207 K(o=-0.021,f=-1.8) USER MOD Single : A 48 THR OG1 : rot -77:sc= 1.31 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN :FLIP amide:sc= -0.103 F(o=-1.4,f=-0.1) USER MOD Single : A 55 SER OG : rot -133:sc= 0.158 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.115 USER MOD Single : A 58 LYS NZ :NH3+ 164:sc= 0.503 (180deg=0.0455) USER MOD Single : A 59 ASN : amide:sc= -0.695 K(o=-0.7,f=-6.3!) USER MOD Single : A 63 SER OG : rot 180:sc= 0.0535 USER MOD Single : A 65 LYS NZ :NH3+ -163:sc= 1.24 (180deg=1.17) USER MOD Single : A 73 THR OG1 : rot 68:sc= 1.26 USER MOD Single : A 74 THR OG1 : rot -89:sc= 1.24 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ -163:sc= 1.07 (180deg=-0.344) USER MOD Single : A 82 SER OG : rot 139:sc= 1.93 USER MOD Single : A 85 THR OG1 : rot 180:sc=-0.00264 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ -172:sc= 0.963 (180deg=0.807) USER MOD Single : A 98 ASN : amide:sc= -1.66 K(o=-1.7,f=-3.4) USER MOD Single : A 102 THR OG1 : rot 180:sc= -0.119 USER MOD Single : A 108 MET CE :methyl 173:sc= 0 (180deg=-0.0232) USER MOD Single : A 112 LYS NZ :NH3+ -142:sc= 0.945 (180deg=0.494) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 CYS SG : rot 57:sc= -0.207 USER MOD Single : A 127 THR OG1 : rot -2:sc= 0.211 USER MOD Single : A 130 LYS NZ :NH3+ -156:sc= 2.31 (180deg=2.15) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 10.000 -12.589 -3.647 1.00 0.00 N ATOM 2 CA VAL A 1 10.109 -11.934 -2.353 1.00 0.00 C ATOM 3 C VAL A 1 11.447 -11.192 -2.225 1.00 0.00 C ATOM 4 O VAL A 1 11.461 -10.022 -1.831 1.00 0.00 O ATOM 5 CB VAL A 1 9.797 -12.937 -1.226 1.00 0.00 C ATOM 6 CG1 VAL A 1 10.808 -14.081 -1.106 1.00 0.00 C ATOM 7 CG2 VAL A 1 9.658 -12.240 0.131 1.00 0.00 C ATOM 0 H1 VAL A 1 9.067 -13.041 -3.730 1.00 0.00 H new ATOM 0 H2 VAL A 1 10.112 -11.884 -4.403 1.00 0.00 H new ATOM 0 H3 VAL A 1 10.743 -13.311 -3.734 1.00 0.00 H new ATOM 0 HA VAL A 1 9.357 -11.151 -2.258 1.00 0.00 H new ATOM 0 HB VAL A 1 8.844 -13.380 -1.513 1.00 0.00 H new ATOM 0 HG11 VAL A 1 10.515 -14.741 -0.290 1.00 0.00 H new ATOM 0 HG12 VAL A 1 10.831 -14.645 -2.038 1.00 0.00 H new ATOM 0 HG13 VAL A 1 11.798 -13.672 -0.905 1.00 0.00 H new ATOM 0 HG21 VAL A 1 9.438 -12.981 0.900 1.00 0.00 H new ATOM 0 HG22 VAL A 1 10.590 -11.729 0.375 1.00 0.00 H new ATOM 0 HG23 VAL A 1 8.847 -11.513 0.085 1.00 0.00 H new ATOM 19 N ASP A 2 12.552 -11.846 -2.610 1.00 0.00 N ATOM 20 CA ASP A 2 13.924 -11.332 -2.590 1.00 0.00 C ATOM 21 C ASP A 2 14.134 -10.237 -3.644 1.00 0.00 C ATOM 22 O ASP A 2 14.957 -10.357 -4.550 1.00 0.00 O ATOM 23 CB ASP A 2 14.911 -12.488 -2.828 1.00 0.00 C ATOM 24 CG ASP A 2 14.602 -13.713 -1.989 1.00 0.00 C ATOM 25 OD1 ASP A 2 13.603 -14.372 -2.353 1.00 0.00 O ATOM 26 OD2 ASP A 2 15.338 -13.949 -1.008 1.00 0.00 O ATOM 0 H ASP A 2 12.507 -12.802 -2.963 1.00 0.00 H new ATOM 0 HA ASP A 2 14.105 -10.887 -1.611 1.00 0.00 H new ATOM 0 HB2 ASP A 2 14.893 -12.763 -3.883 1.00 0.00 H new ATOM 0 HB3 ASP A 2 15.922 -12.147 -2.605 1.00 0.00 H new ATOM 31 N ALA A 3 13.381 -9.150 -3.521 1.00 0.00 N ATOM 32 CA ALA A 3 13.333 -8.054 -4.471 1.00 0.00 C ATOM 33 C ALA A 3 12.673 -6.873 -3.774 1.00 0.00 C ATOM 34 O ALA A 3 13.237 -5.779 -3.722 1.00 0.00 O ATOM 35 CB ALA A 3 12.538 -8.471 -5.715 1.00 0.00 C ATOM 0 H ALA A 3 12.763 -9.006 -2.722 1.00 0.00 H new ATOM 0 HA ALA A 3 14.335 -7.780 -4.800 1.00 0.00 H new ATOM 0 HB1 ALA A 3 12.507 -7.642 -6.422 1.00 0.00 H new ATOM 0 HB2 ALA A 3 13.019 -9.330 -6.183 1.00 0.00 H new ATOM 0 HB3 ALA A 3 11.522 -8.738 -5.425 1.00 0.00 H new ATOM 41 N PHE A 4 11.493 -7.119 -3.203 1.00 0.00 N ATOM 42 CA PHE A 4 10.654 -6.120 -2.564 1.00 0.00 C ATOM 43 C PHE A 4 11.395 -5.439 -1.415 1.00 0.00 C ATOM 44 O PHE A 4 11.528 -4.216 -1.432 1.00 0.00 O ATOM 45 CB PHE A 4 9.351 -6.803 -2.117 1.00 0.00 C ATOM 46 CG PHE A 4 8.620 -7.546 -3.227 1.00 0.00 C ATOM 47 CD1 PHE A 4 8.660 -7.073 -4.555 1.00 0.00 C ATOM 48 CD2 PHE A 4 8.050 -8.806 -2.966 1.00 0.00 C ATOM 49 CE1 PHE A 4 8.255 -7.898 -5.614 1.00 0.00 C ATOM 50 CE2 PHE A 4 7.621 -9.624 -4.027 1.00 0.00 C ATOM 51 CZ PHE A 4 7.759 -9.183 -5.354 1.00 0.00 C ATOM 0 H PHE A 4 11.086 -8.054 -3.175 1.00 0.00 H new ATOM 0 HA PHE A 4 10.404 -5.323 -3.264 1.00 0.00 H new ATOM 0 HB2 PHE A 4 9.579 -7.505 -1.315 1.00 0.00 H new ATOM 0 HB3 PHE A 4 8.684 -6.049 -1.700 1.00 0.00 H new ATOM 0 HD1 PHE A 4 9.005 -6.070 -4.757 1.00 0.00 H new ATOM 0 HD2 PHE A 4 7.941 -9.146 -1.947 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.325 -7.543 -6.632 1.00 0.00 H new ATOM 0 HE2 PHE A 4 7.186 -10.591 -3.822 1.00 0.00 H new ATOM 0 HZ PHE A 4 7.484 -9.833 -6.172 1.00 0.00 H new ATOM 61 N VAL A 5 11.896 -6.263 -0.486 1.00 0.00 N ATOM 62 CA VAL A 5 12.692 -5.956 0.705 1.00 0.00 C ATOM 63 C VAL A 5 13.222 -4.515 0.736 1.00 0.00 C ATOM 64 O VAL A 5 14.329 -4.273 0.249 1.00 0.00 O ATOM 65 CB VAL A 5 13.850 -6.981 0.790 1.00 0.00 C ATOM 66 CG1 VAL A 5 14.826 -6.666 1.936 1.00 0.00 C ATOM 67 CG2 VAL A 5 13.358 -8.422 0.986 1.00 0.00 C ATOM 0 H VAL A 5 11.735 -7.268 -0.560 1.00 0.00 H new ATOM 0 HA VAL A 5 12.043 -6.035 1.577 1.00 0.00 H new ATOM 0 HB VAL A 5 14.359 -6.896 -0.170 1.00 0.00 H new ATOM 0 HG11 VAL A 5 15.620 -7.413 1.954 1.00 0.00 H new ATOM 0 HG12 VAL A 5 15.261 -5.678 1.783 1.00 0.00 H new ATOM 0 HG13 VAL A 5 14.290 -6.683 2.885 1.00 0.00 H new ATOM 0 HG21 VAL A 5 14.214 -9.095 1.038 1.00 0.00 H new ATOM 0 HG22 VAL A 5 12.787 -8.489 1.912 1.00 0.00 H new ATOM 0 HG23 VAL A 5 12.723 -8.707 0.147 1.00 0.00 H new ATOM 77 N GLY A 6 12.459 -3.562 1.278 1.00 0.00 N ATOM 78 CA GLY A 6 12.940 -2.220 1.576 1.00 0.00 C ATOM 79 C GLY A 6 12.023 -1.139 1.006 1.00 0.00 C ATOM 80 O GLY A 6 10.835 -1.111 1.313 1.00 0.00 O ATOM 0 H GLY A 6 11.480 -3.707 1.523 1.00 0.00 H new ATOM 0 HA2 GLY A 6 13.018 -2.095 2.656 1.00 0.00 H new ATOM 0 HA3 GLY A 6 13.943 -2.096 1.167 1.00 0.00 H new ATOM 84 N THR A 7 12.586 -0.221 0.213 1.00 0.00 N ATOM 85 CA THR A 7 11.992 1.083 -0.065 1.00 0.00 C ATOM 86 C THR A 7 11.960 1.349 -1.568 1.00 0.00 C ATOM 87 O THR A 7 13.013 1.352 -2.215 1.00 0.00 O ATOM 88 CB THR A 7 12.825 2.158 0.641 1.00 0.00 C ATOM 89 OG1 THR A 7 13.156 1.762 1.954 1.00 0.00 O ATOM 90 CG2 THR A 7 12.113 3.507 0.692 1.00 0.00 C ATOM 0 H THR A 7 13.479 -0.369 -0.258 1.00 0.00 H new ATOM 0 HA THR A 7 10.966 1.102 0.303 1.00 0.00 H new ATOM 0 HB THR A 7 13.734 2.273 0.051 1.00 0.00 H new ATOM 0 HG1 THR A 7 14.113 1.907 2.108 1.00 0.00 H new ATOM 0 HG21 THR A 7 12.746 4.233 1.202 1.00 0.00 H new ATOM 0 HG22 THR A 7 11.912 3.851 -0.323 1.00 0.00 H new ATOM 0 HG23 THR A 7 11.173 3.402 1.233 1.00 0.00 H new ATOM 98 N TRP A 8 10.765 1.577 -2.117 1.00 0.00 N ATOM 99 CA TRP A 8 10.547 1.860 -3.525 1.00 0.00 C ATOM 100 C TRP A 8 10.220 3.349 -3.684 1.00 0.00 C ATOM 101 O TRP A 8 9.374 3.866 -2.958 1.00 0.00 O ATOM 102 CB TRP A 8 9.395 1.001 -4.061 1.00 0.00 C ATOM 103 CG TRP A 8 9.285 -0.449 -3.678 1.00 0.00 C ATOM 104 CD1 TRP A 8 10.218 -1.225 -3.077 1.00 0.00 C ATOM 105 CD2 TRP A 8 8.147 -1.330 -3.923 1.00 0.00 C ATOM 106 NE1 TRP A 8 9.717 -2.493 -2.877 1.00 0.00 N ATOM 107 CE2 TRP A 8 8.453 -2.625 -3.414 1.00 0.00 C ATOM 108 CE3 TRP A 8 6.899 -1.168 -4.565 1.00 0.00 C ATOM 109 CZ2 TRP A 8 7.561 -3.702 -3.529 1.00 0.00 C ATOM 110 CZ3 TRP A 8 6.011 -2.252 -4.713 1.00 0.00 C ATOM 111 CH2 TRP A 8 6.347 -3.519 -4.207 1.00 0.00 C ATOM 0 H TRP A 8 9.902 1.568 -1.573 1.00 0.00 H new ATOM 0 HA TRP A 8 11.445 1.621 -4.094 1.00 0.00 H new ATOM 0 HB2 TRP A 8 8.466 1.485 -3.761 1.00 0.00 H new ATOM 0 HB3 TRP A 8 9.440 1.044 -5.149 1.00 0.00 H new ATOM 0 HD1 TRP A 8 11.208 -0.898 -2.796 1.00 0.00 H new ATOM 0 HE1 TRP A 8 10.217 -3.239 -2.393 1.00 0.00 H new ATOM 0 HE3 TRP A 8 6.621 -0.197 -4.949 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 7.807 -4.662 -3.100 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 5.067 -2.108 -5.218 1.00 0.00 H new ATOM 0 HH2 TRP A 8 5.671 -4.351 -4.340 1.00 0.00 H new ATOM 122 N LYS A 9 10.874 4.029 -4.628 1.00 0.00 N ATOM 123 CA LYS A 9 10.639 5.421 -4.986 1.00 0.00 C ATOM 124 C LYS A 9 9.892 5.456 -6.317 1.00 0.00 C ATOM 125 O LYS A 9 10.341 4.833 -7.279 1.00 0.00 O ATOM 126 CB LYS A 9 11.999 6.112 -5.127 1.00 0.00 C ATOM 127 CG LYS A 9 11.892 7.639 -5.183 1.00 0.00 C ATOM 128 CD LYS A 9 13.308 8.219 -5.102 1.00 0.00 C ATOM 129 CE LYS A 9 13.292 9.748 -5.220 1.00 0.00 C ATOM 130 NZ LYS A 9 14.651 10.318 -5.110 1.00 0.00 N ATOM 0 H LYS A 9 11.613 3.602 -5.186 1.00 0.00 H new ATOM 0 HA LYS A 9 10.047 5.931 -4.226 1.00 0.00 H new ATOM 0 HB2 LYS A 9 12.633 5.828 -4.287 1.00 0.00 H new ATOM 0 HB3 LYS A 9 12.490 5.754 -6.032 1.00 0.00 H new ATOM 0 HG2 LYS A 9 11.404 7.953 -6.106 1.00 0.00 H new ATOM 0 HG3 LYS A 9 11.282 8.008 -4.359 1.00 0.00 H new ATOM 0 HD2 LYS A 9 13.768 7.930 -4.157 1.00 0.00 H new ATOM 0 HD3 LYS A 9 13.922 7.797 -5.898 1.00 0.00 H new ATOM 0 HE2 LYS A 9 12.853 10.035 -6.176 1.00 0.00 H new ATOM 0 HE3 LYS A 9 12.657 10.167 -4.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 14.601 11.353 -5.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 15.060 10.065 -4.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 15.250 9.937 -5.870 1.00 0.00 H new ATOM 144 N LEU A 10 8.741 6.129 -6.385 1.00 0.00 N ATOM 145 CA LEU A 10 7.950 6.135 -7.609 1.00 0.00 C ATOM 146 C LEU A 10 8.603 7.019 -8.679 1.00 0.00 C ATOM 147 O LEU A 10 9.162 8.062 -8.339 1.00 0.00 O ATOM 148 CB LEU A 10 6.525 6.578 -7.281 1.00 0.00 C ATOM 149 CG LEU A 10 5.610 6.395 -8.501 1.00 0.00 C ATOM 150 CD1 LEU A 10 4.243 5.824 -8.111 1.00 0.00 C ATOM 151 CD2 LEU A 10 5.443 7.734 -9.225 1.00 0.00 C ATOM 0 H LEU A 10 8.343 6.669 -5.616 1.00 0.00 H new ATOM 0 HA LEU A 10 7.908 5.129 -8.026 1.00 0.00 H new ATOM 0 HB2 LEU A 10 6.142 5.998 -6.441 1.00 0.00 H new ATOM 0 HB3 LEU A 10 6.525 7.623 -6.973 1.00 0.00 H new ATOM 0 HG LEU A 10 6.081 5.674 -9.170 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.628 5.711 -9.004 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.377 4.852 -7.637 1.00 0.00 H new ATOM 0 HD13 LEU A 10 3.750 6.503 -7.415 1.00 0.00 H new ATOM 0 HD21 LEU A 10 4.793 7.601 -10.090 1.00 0.00 H new ATOM 0 HD22 LEU A 10 4.999 8.462 -8.546 1.00 0.00 H new ATOM 0 HD23 LEU A 10 6.418 8.093 -9.555 1.00 0.00 H new ATOM 163 N VAL A 11 8.505 6.642 -9.965 1.00 0.00 N ATOM 164 CA VAL A 11 9.046 7.434 -11.069 1.00 0.00 C ATOM 165 C VAL A 11 8.296 7.168 -12.390 1.00 0.00 C ATOM 166 O VAL A 11 8.856 6.597 -13.321 1.00 0.00 O ATOM 167 CB VAL A 11 10.577 7.227 -11.142 1.00 0.00 C ATOM 168 CG1 VAL A 11 11.011 5.792 -11.476 1.00 0.00 C ATOM 169 CG2 VAL A 11 11.245 8.225 -12.097 1.00 0.00 C ATOM 0 H VAL A 11 8.048 5.780 -10.262 1.00 0.00 H new ATOM 0 HA VAL A 11 8.879 8.495 -10.883 1.00 0.00 H new ATOM 0 HB VAL A 11 10.925 7.419 -10.127 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.099 5.739 -11.507 1.00 0.00 H new ATOM 0 HG12 VAL A 11 10.636 5.111 -10.712 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.606 5.506 -12.447 1.00 0.00 H new ATOM 0 HG21 VAL A 11 12.320 8.045 -12.118 1.00 0.00 H new ATOM 0 HG22 VAL A 11 10.836 8.099 -13.099 1.00 0.00 H new ATOM 0 HG23 VAL A 11 11.055 9.241 -11.753 1.00 0.00 H new ATOM 179 N ASP A 12 7.035 7.618 -12.487 1.00 0.00 N ATOM 180 CA ASP A 12 6.224 7.606 -13.710 1.00 0.00 C ATOM 181 C ASP A 12 5.026 8.547 -13.494 1.00 0.00 C ATOM 182 O ASP A 12 4.872 9.091 -12.395 1.00 0.00 O ATOM 183 CB ASP A 12 5.782 6.167 -14.022 1.00 0.00 C ATOM 184 CG ASP A 12 5.378 5.899 -15.469 1.00 0.00 C ATOM 185 OD1 ASP A 12 4.874 6.835 -16.125 1.00 0.00 O ATOM 186 OD2 ASP A 12 5.538 4.729 -15.874 1.00 0.00 O ATOM 0 H ASP A 12 6.538 8.013 -11.689 1.00 0.00 H new ATOM 0 HA ASP A 12 6.796 7.958 -14.568 1.00 0.00 H new ATOM 0 HB2 ASP A 12 6.596 5.491 -13.760 1.00 0.00 H new ATOM 0 HB3 ASP A 12 4.940 5.917 -13.377 1.00 0.00 H new ATOM 191 N SER A 13 4.145 8.729 -14.481 1.00 0.00 N ATOM 192 CA SER A 13 3.078 9.721 -14.445 1.00 0.00 C ATOM 193 C SER A 13 1.971 9.430 -15.471 1.00 0.00 C ATOM 194 O SER A 13 1.679 10.288 -16.303 1.00 0.00 O ATOM 195 CB SER A 13 3.697 11.115 -14.652 1.00 0.00 C ATOM 196 OG SER A 13 2.705 12.122 -14.654 1.00 0.00 O ATOM 0 H SER A 13 4.157 8.180 -15.340 1.00 0.00 H new ATOM 0 HA SER A 13 2.590 9.679 -13.471 1.00 0.00 H new ATOM 0 HB2 SER A 13 4.420 11.315 -13.861 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.242 11.137 -15.596 1.00 0.00 H new ATOM 0 HG SER A 13 2.030 11.915 -15.334 1.00 0.00 H new ATOM 202 N LYS A 14 1.306 8.269 -15.382 1.00 0.00 N ATOM 203 CA LYS A 14 0.160 7.935 -16.227 1.00 0.00 C ATOM 204 C LYS A 14 -1.088 7.662 -15.374 1.00 0.00 C ATOM 205 O LYS A 14 -1.126 6.689 -14.614 1.00 0.00 O ATOM 206 CB LYS A 14 0.493 6.737 -17.124 1.00 0.00 C ATOM 207 CG LYS A 14 1.771 6.980 -17.946 1.00 0.00 C ATOM 208 CD LYS A 14 2.186 5.768 -18.792 1.00 0.00 C ATOM 209 CE LYS A 14 1.186 5.444 -19.914 1.00 0.00 C ATOM 210 NZ LYS A 14 0.742 4.036 -19.871 1.00 0.00 N ATOM 0 H LYS A 14 1.552 7.535 -14.718 1.00 0.00 H new ATOM 0 HA LYS A 14 -0.060 8.789 -16.868 1.00 0.00 H new ATOM 0 HB2 LYS A 14 0.620 5.846 -16.509 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -0.342 6.543 -17.798 1.00 0.00 H new ATOM 0 HG2 LYS A 14 1.616 7.837 -18.602 1.00 0.00 H new ATOM 0 HG3 LYS A 14 2.586 7.239 -17.270 1.00 0.00 H new ATOM 0 HD2 LYS A 14 3.166 5.957 -19.230 1.00 0.00 H new ATOM 0 HD3 LYS A 14 2.289 4.898 -18.143 1.00 0.00 H new ATOM 0 HE2 LYS A 14 0.320 6.100 -19.828 1.00 0.00 H new ATOM 0 HE3 LYS A 14 1.647 5.649 -20.880 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -0.029 3.894 -20.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 1.539 3.413 -20.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 0.403 3.808 -18.915 1.00 0.00 H new ATOM 224 N ASN A 15 -2.102 8.526 -15.515 1.00 0.00 N ATOM 225 CA ASN A 15 -3.468 8.389 -14.997 1.00 0.00 C ATOM 226 C ASN A 15 -3.513 8.083 -13.498 1.00 0.00 C ATOM 227 O ASN A 15 -4.412 7.399 -13.018 1.00 0.00 O ATOM 228 CB ASN A 15 -4.239 7.308 -15.777 1.00 0.00 C ATOM 229 CG ASN A 15 -4.192 7.471 -17.294 1.00 0.00 C ATOM 230 OD1 ASN A 15 -3.907 8.546 -17.812 1.00 0.00 O ATOM 231 ND2 ASN A 15 -4.426 6.384 -18.025 1.00 0.00 N ATOM 0 H ASN A 15 -1.980 9.398 -16.029 1.00 0.00 H new ATOM 0 HA ASN A 15 -3.948 9.357 -15.140 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -3.834 6.330 -15.516 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -5.280 7.318 -15.455 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -4.370 6.432 -19.042 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -4.661 5.503 -17.568 1.00 0.00 H new ATOM 238 N PHE A 16 -2.511 8.519 -12.739 1.00 0.00 N ATOM 239 CA PHE A 16 -2.321 8.065 -11.368 1.00 0.00 C ATOM 240 C PHE A 16 -3.223 8.821 -10.403 1.00 0.00 C ATOM 241 O PHE A 16 -3.800 8.217 -9.498 1.00 0.00 O ATOM 242 CB PHE A 16 -0.842 8.152 -10.981 1.00 0.00 C ATOM 243 CG PHE A 16 -0.287 9.559 -11.003 1.00 0.00 C ATOM 244 CD1 PHE A 16 0.111 10.124 -12.228 1.00 0.00 C ATOM 245 CD2 PHE A 16 -0.448 10.383 -9.876 1.00 0.00 C ATOM 246 CE1 PHE A 16 0.219 11.515 -12.357 1.00 0.00 C ATOM 247 CE2 PHE A 16 -0.405 11.777 -10.022 1.00 0.00 C ATOM 248 CZ PHE A 16 -0.098 12.344 -11.270 1.00 0.00 C ATOM 0 H PHE A 16 -1.813 9.192 -13.056 1.00 0.00 H new ATOM 0 HA PHE A 16 -2.615 7.017 -11.302 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -0.712 7.736 -9.982 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -0.261 7.531 -11.663 1.00 0.00 H new ATOM 0 HD1 PHE A 16 0.334 9.485 -13.070 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -0.604 9.944 -8.901 1.00 0.00 H new ATOM 0 HE1 PHE A 16 0.545 11.948 -13.291 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -0.608 12.415 -9.175 1.00 0.00 H new ATOM 0 HZ PHE A 16 -0.106 13.417 -11.393 1.00 0.00 H new ATOM 258 N ASP A 17 -3.316 10.135 -10.575 1.00 0.00 N ATOM 259 CA ASP A 17 -4.231 10.971 -9.838 1.00 0.00 C ATOM 260 C ASP A 17 -5.631 10.670 -10.341 1.00 0.00 C ATOM 261 O ASP A 17 -6.454 10.285 -9.530 1.00 0.00 O ATOM 262 CB ASP A 17 -3.874 12.455 -9.959 1.00 0.00 C ATOM 263 CG ASP A 17 -3.562 12.930 -11.369 1.00 0.00 C ATOM 264 OD1 ASP A 17 -3.615 12.093 -12.302 1.00 0.00 O ATOM 265 OD2 ASP A 17 -3.237 14.129 -11.461 1.00 0.00 O ATOM 0 H ASP A 17 -2.744 10.649 -11.244 1.00 0.00 H new ATOM 0 HA ASP A 17 -4.168 10.750 -8.773 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -4.703 13.045 -9.568 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -3.011 12.658 -9.325 1.00 0.00 H new ATOM 270 N ASP A 18 -5.882 10.784 -11.647 1.00 0.00 N ATOM 271 CA ASP A 18 -7.145 10.422 -12.297 1.00 0.00 C ATOM 272 C ASP A 18 -7.796 9.180 -11.667 1.00 0.00 C ATOM 273 O ASP A 18 -8.874 9.260 -11.069 1.00 0.00 O ATOM 274 CB ASP A 18 -6.882 10.196 -13.789 1.00 0.00 C ATOM 275 CG ASP A 18 -8.036 9.452 -14.445 1.00 0.00 C ATOM 276 OD1 ASP A 18 -9.139 10.036 -14.467 1.00 0.00 O ATOM 277 OD2 ASP A 18 -7.792 8.298 -14.860 1.00 0.00 O ATOM 0 H ASP A 18 -5.189 11.143 -12.304 1.00 0.00 H new ATOM 0 HA ASP A 18 -7.850 11.241 -12.157 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -6.736 11.156 -14.285 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -5.960 9.628 -13.917 1.00 0.00 H new ATOM 282 N TYR A 19 -7.102 8.042 -11.760 1.00 0.00 N ATOM 283 CA TYR A 19 -7.530 6.769 -11.195 1.00 0.00 C ATOM 284 C TYR A 19 -7.967 6.943 -9.740 1.00 0.00 C ATOM 285 O TYR A 19 -9.040 6.502 -9.340 1.00 0.00 O ATOM 286 CB TYR A 19 -6.356 5.792 -11.324 1.00 0.00 C ATOM 287 CG TYR A 19 -6.599 4.344 -10.947 1.00 0.00 C ATOM 288 CD1 TYR A 19 -6.493 3.922 -9.608 1.00 0.00 C ATOM 289 CD2 TYR A 19 -6.651 3.383 -11.971 1.00 0.00 C ATOM 290 CE1 TYR A 19 -6.456 2.548 -9.299 1.00 0.00 C ATOM 291 CE2 TYR A 19 -6.594 2.018 -11.660 1.00 0.00 C ATOM 292 CZ TYR A 19 -6.520 1.598 -10.327 1.00 0.00 C ATOM 293 OH TYR A 19 -6.469 0.267 -10.045 1.00 0.00 O ATOM 0 H TYR A 19 -6.206 7.984 -12.243 1.00 0.00 H new ATOM 0 HA TYR A 19 -8.395 6.378 -11.731 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -6.012 5.816 -12.358 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -5.539 6.166 -10.707 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -6.440 4.654 -8.815 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -6.735 3.698 -13.001 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -6.378 2.227 -8.271 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -6.607 1.286 -12.454 1.00 0.00 H new ATOM 0 HH TYR A 19 -6.627 0.129 -9.088 1.00 0.00 H new ATOM 303 N MET A 20 -7.127 7.596 -8.936 1.00 0.00 N ATOM 304 CA MET A 20 -7.402 7.829 -7.529 1.00 0.00 C ATOM 305 C MET A 20 -8.574 8.809 -7.354 1.00 0.00 C ATOM 306 O MET A 20 -9.380 8.667 -6.435 1.00 0.00 O ATOM 307 CB MET A 20 -6.115 8.315 -6.844 1.00 0.00 C ATOM 308 CG MET A 20 -5.045 7.218 -6.791 1.00 0.00 C ATOM 309 SD MET A 20 -3.342 7.816 -6.601 1.00 0.00 S ATOM 310 CE MET A 20 -3.387 8.604 -4.973 1.00 0.00 C ATOM 0 H MET A 20 -6.234 7.977 -9.250 1.00 0.00 H new ATOM 0 HA MET A 20 -7.712 6.900 -7.050 1.00 0.00 H new ATOM 0 HB2 MET A 20 -5.723 9.179 -7.380 1.00 0.00 H new ATOM 0 HB3 MET A 20 -6.346 8.646 -5.831 1.00 0.00 H new ATOM 0 HG2 MET A 20 -5.274 6.548 -5.962 1.00 0.00 H new ATOM 0 HG3 MET A 20 -5.107 6.627 -7.705 1.00 0.00 H new ATOM 0 HE1 MET A 20 -2.480 9.191 -4.828 1.00 0.00 H new ATOM 0 HE2 MET A 20 -4.257 9.258 -4.909 1.00 0.00 H new ATOM 0 HE3 MET A 20 -3.452 7.838 -4.200 1.00 0.00 H new ATOM 320 N LYS A 21 -8.709 9.806 -8.227 1.00 0.00 N ATOM 321 CA LYS A 21 -9.691 10.885 -8.173 1.00 0.00 C ATOM 322 C LYS A 21 -11.019 10.415 -8.776 1.00 0.00 C ATOM 323 O LYS A 21 -11.690 11.154 -9.502 1.00 0.00 O ATOM 324 CB LYS A 21 -9.138 12.101 -8.936 1.00 0.00 C ATOM 325 CG LYS A 21 -9.811 13.405 -8.478 1.00 0.00 C ATOM 326 CD LYS A 21 -9.728 14.512 -9.538 1.00 0.00 C ATOM 327 CE LYS A 21 -10.447 14.197 -10.862 1.00 0.00 C ATOM 328 NZ LYS A 21 -11.784 13.598 -10.664 1.00 0.00 N ATOM 0 H LYS A 21 -8.098 9.886 -9.040 1.00 0.00 H new ATOM 0 HA LYS A 21 -9.876 11.170 -7.137 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -8.062 12.171 -8.780 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -9.297 11.964 -10.006 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -10.857 13.208 -8.244 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -9.339 13.751 -7.558 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -10.150 15.426 -9.121 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -8.678 14.713 -9.751 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -10.548 15.115 -11.442 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -9.833 13.515 -11.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -12.274 13.533 -11.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -11.681 12.646 -10.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -12.338 14.193 -10.016 1.00 0.00 H new ATOM 342 N SER A 22 -11.381 9.177 -8.458 1.00 0.00 N ATOM 343 CA SER A 22 -12.532 8.450 -8.955 1.00 0.00 C ATOM 344 C SER A 22 -12.665 7.180 -8.107 1.00 0.00 C ATOM 345 O SER A 22 -13.757 6.863 -7.648 1.00 0.00 O ATOM 346 CB SER A 22 -12.402 8.174 -10.461 1.00 0.00 C ATOM 347 OG SER A 22 -11.160 7.581 -10.776 1.00 0.00 O ATOM 0 H SER A 22 -10.836 8.620 -7.799 1.00 0.00 H new ATOM 0 HA SER A 22 -13.447 9.035 -8.858 1.00 0.00 H new ATOM 0 HB2 SER A 22 -13.211 7.518 -10.782 1.00 0.00 H new ATOM 0 HB3 SER A 22 -12.510 9.108 -11.013 1.00 0.00 H new ATOM 0 HG SER A 22 -10.470 8.275 -10.830 1.00 0.00 H new ATOM 353 N LEU A 23 -11.542 6.507 -7.814 1.00 0.00 N ATOM 354 CA LEU A 23 -11.480 5.526 -6.728 1.00 0.00 C ATOM 355 C LEU A 23 -11.975 6.127 -5.405 1.00 0.00 C ATOM 356 O LEU A 23 -12.734 5.492 -4.675 1.00 0.00 O ATOM 357 CB LEU A 23 -10.042 5.013 -6.548 1.00 0.00 C ATOM 358 CG LEU A 23 -9.955 3.487 -6.519 1.00 0.00 C ATOM 359 CD1 LEU A 23 -10.336 2.916 -7.891 1.00 0.00 C ATOM 360 CD2 LEU A 23 -8.522 3.083 -6.168 1.00 0.00 C ATOM 0 H LEU A 23 -10.663 6.627 -8.318 1.00 0.00 H new ATOM 0 HA LEU A 23 -12.132 4.695 -6.999 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.422 5.392 -7.360 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.632 5.413 -5.621 1.00 0.00 H new ATOM 0 HG LEU A 23 -10.644 3.092 -5.773 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.272 1.828 -7.863 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -11.355 3.213 -8.138 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.652 3.300 -8.648 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -8.446 1.996 -6.144 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.838 3.478 -6.919 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -8.259 3.487 -5.190 1.00 0.00 H new ATOM 372 N GLY A 24 -11.508 7.342 -5.098 1.00 0.00 N ATOM 373 CA GLY A 24 -11.864 8.101 -3.904 1.00 0.00 C ATOM 374 C GLY A 24 -10.636 8.385 -3.038 1.00 0.00 C ATOM 375 O GLY A 24 -10.672 8.175 -1.828 1.00 0.00 O ATOM 0 H GLY A 24 -10.849 7.838 -5.698 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -12.332 9.042 -4.195 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -12.600 7.545 -3.323 1.00 0.00 H new ATOM 379 N VAL A 25 -9.546 8.847 -3.662 1.00 0.00 N ATOM 380 CA VAL A 25 -8.258 9.060 -3.007 1.00 0.00 C ATOM 381 C VAL A 25 -7.351 10.070 -3.744 1.00 0.00 C ATOM 382 O VAL A 25 -6.287 10.431 -3.246 1.00 0.00 O ATOM 383 CB VAL A 25 -7.599 7.692 -2.700 1.00 0.00 C ATOM 384 CG1 VAL A 25 -7.861 6.634 -3.780 1.00 0.00 C ATOM 385 CG2 VAL A 25 -6.094 7.746 -2.428 1.00 0.00 C ATOM 0 H VAL A 25 -9.538 9.086 -4.654 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.430 9.553 -2.050 1.00 0.00 H new ATOM 0 HB VAL A 25 -8.094 7.399 -1.774 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -7.371 5.701 -3.502 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -8.934 6.467 -3.873 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -7.464 6.982 -4.734 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -5.725 6.741 -2.224 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -5.581 8.151 -3.300 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -5.903 8.385 -1.566 1.00 0.00 H new ATOM 395 N GLY A 26 -7.730 10.578 -4.922 1.00 0.00 N ATOM 396 CA GLY A 26 -6.860 11.468 -5.701 1.00 0.00 C ATOM 397 C GLY A 26 -6.886 12.916 -5.202 1.00 0.00 C ATOM 398 O GLY A 26 -7.096 13.834 -5.995 1.00 0.00 O ATOM 0 H GLY A 26 -8.633 10.389 -5.357 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -5.837 11.094 -5.661 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -7.167 11.444 -6.746 1.00 0.00 H new ATOM 402 N PHE A 27 -6.668 13.106 -3.894 1.00 0.00 N ATOM 403 CA PHE A 27 -7.053 14.296 -3.141 1.00 0.00 C ATOM 404 C PHE A 27 -6.595 15.596 -3.803 1.00 0.00 C ATOM 405 O PHE A 27 -7.409 16.463 -4.099 1.00 0.00 O ATOM 406 CB PHE A 27 -6.521 14.226 -1.697 1.00 0.00 C ATOM 407 CG PHE A 27 -6.769 12.916 -0.969 1.00 0.00 C ATOM 408 CD1 PHE A 27 -8.075 12.544 -0.600 1.00 0.00 C ATOM 409 CD2 PHE A 27 -5.701 12.031 -0.727 1.00 0.00 C ATOM 410 CE1 PHE A 27 -8.318 11.277 -0.042 1.00 0.00 C ATOM 411 CE2 PHE A 27 -5.946 10.762 -0.177 1.00 0.00 C ATOM 412 CZ PHE A 27 -7.260 10.371 0.134 1.00 0.00 C ATOM 0 H PHE A 27 -6.202 12.407 -3.315 1.00 0.00 H new ATOM 0 HA PHE A 27 -8.143 14.308 -3.127 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -5.447 14.413 -1.715 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -6.976 15.032 -1.122 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -8.893 13.234 -0.746 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -4.690 12.329 -0.965 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -9.320 11.000 0.252 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -5.124 10.086 0.007 1.00 0.00 H new ATOM 0 HZ PHE A 27 -7.455 9.377 0.507 1.00 0.00 H new ATOM 422 N ALA A 28 -5.279 15.748 -3.971 1.00 0.00 N ATOM 423 CA ALA A 28 -4.688 17.012 -4.389 1.00 0.00 C ATOM 424 C ALA A 28 -4.750 17.185 -5.908 1.00 0.00 C ATOM 425 O ALA A 28 -4.847 18.314 -6.382 1.00 0.00 O ATOM 426 CB ALA A 28 -3.265 17.122 -3.834 1.00 0.00 C ATOM 0 H ALA A 28 -4.601 15.001 -3.821 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.270 17.835 -3.975 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -2.824 18.068 -4.148 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -3.295 17.079 -2.745 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -2.662 16.297 -4.213 1.00 0.00 H new ATOM 432 N THR A 29 -4.672 16.068 -6.645 1.00 0.00 N ATOM 433 CA THR A 29 -4.733 15.989 -8.102 1.00 0.00 C ATOM 434 C THR A 29 -3.546 16.693 -8.780 1.00 0.00 C ATOM 435 O THR A 29 -3.297 17.874 -8.564 1.00 0.00 O ATOM 436 CB THR A 29 -6.086 16.494 -8.625 1.00 0.00 C ATOM 437 OG1 THR A 29 -7.157 15.964 -7.866 1.00 0.00 O ATOM 438 CG2 THR A 29 -6.288 16.044 -10.071 1.00 0.00 C ATOM 0 H THR A 29 -4.559 15.151 -6.214 1.00 0.00 H new ATOM 0 HA THR A 29 -4.649 14.936 -8.373 1.00 0.00 H new ATOM 0 HB THR A 29 -6.077 17.581 -8.549 1.00 0.00 H new ATOM 0 HG1 THR A 29 -6.851 15.170 -7.379 1.00 0.00 H new ATOM 0 HG21 THR A 29 -7.250 16.406 -10.434 1.00 0.00 H new ATOM 0 HG22 THR A 29 -5.490 16.449 -10.693 1.00 0.00 H new ATOM 0 HG23 THR A 29 -6.269 14.955 -10.119 1.00 0.00 H new ATOM 446 N ARG A 30 -2.781 15.962 -9.595 1.00 0.00 N ATOM 447 CA ARG A 30 -1.575 16.454 -10.252 1.00 0.00 C ATOM 448 C ARG A 30 -0.585 17.078 -9.258 1.00 0.00 C ATOM 449 O ARG A 30 0.138 18.017 -9.574 1.00 0.00 O ATOM 450 CB ARG A 30 -1.944 17.361 -11.436 1.00 0.00 C ATOM 451 CG ARG A 30 -0.798 17.457 -12.453 1.00 0.00 C ATOM 452 CD ARG A 30 -1.258 18.184 -13.722 1.00 0.00 C ATOM 453 NE ARG A 30 -0.159 18.346 -14.688 1.00 0.00 N ATOM 454 CZ ARG A 30 0.338 17.377 -15.476 1.00 0.00 C ATOM 455 NH1 ARG A 30 -0.176 16.143 -15.421 1.00 0.00 N ATOM 456 NH2 ARG A 30 1.350 17.646 -16.307 1.00 0.00 N ATOM 0 H ARG A 30 -2.991 14.989 -9.819 1.00 0.00 H new ATOM 0 HA ARG A 30 -1.033 15.607 -10.672 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -2.836 16.973 -11.928 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -2.190 18.357 -11.069 1.00 0.00 H new ATOM 0 HG2 ARG A 30 0.045 17.987 -12.010 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -0.447 16.457 -12.708 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -2.071 17.626 -14.186 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -1.655 19.163 -13.456 1.00 0.00 H new ATOM 0 HE ARG A 30 0.261 19.272 -14.766 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -0.944 15.938 -14.782 1.00 0.00 H new ATOM 0 HH12 ARG A 30 0.200 15.407 -16.018 1.00 0.00 H new ATOM 0 HH21 ARG A 30 1.744 18.586 -16.343 1.00 0.00 H new ATOM 0 HH22 ARG A 30 1.728 16.911 -16.905 1.00 0.00 H new ATOM 470 N GLN A 31 -0.514 16.493 -8.059 1.00 0.00 N ATOM 471 CA GLN A 31 0.496 16.797 -7.051 1.00 0.00 C ATOM 472 C GLN A 31 0.691 15.561 -6.172 1.00 0.00 C ATOM 473 O GLN A 31 1.812 15.072 -6.001 1.00 0.00 O ATOM 474 CB GLN A 31 0.132 18.048 -6.220 1.00 0.00 C ATOM 475 CG GLN A 31 -1.263 18.626 -6.504 1.00 0.00 C ATOM 476 CD GLN A 31 -1.616 19.828 -5.639 1.00 0.00 C ATOM 477 OE1 GLN A 31 -0.758 20.416 -4.988 1.00 0.00 O ATOM 478 NE2 GLN A 31 -2.894 20.192 -5.619 1.00 0.00 N ATOM 0 H GLN A 31 -1.176 15.777 -7.758 1.00 0.00 H new ATOM 0 HA GLN A 31 1.436 17.040 -7.546 1.00 0.00 H new ATOM 0 HB2 GLN A 31 0.197 17.795 -5.162 1.00 0.00 H new ATOM 0 HB3 GLN A 31 0.876 18.822 -6.409 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -1.320 18.916 -7.553 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -2.008 17.846 -6.348 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -3.579 19.679 -6.174 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -3.190 20.985 -5.049 1.00 0.00 H new ATOM 487 N VAL A 32 -0.442 15.055 -5.667 1.00 0.00 N ATOM 488 CA VAL A 32 -0.601 13.965 -4.708 1.00 0.00 C ATOM 489 C VAL A 32 0.425 12.837 -4.850 1.00 0.00 C ATOM 490 O VAL A 32 0.909 12.320 -3.850 1.00 0.00 O ATOM 491 CB VAL A 32 -2.056 13.450 -4.769 1.00 0.00 C ATOM 492 CG1 VAL A 32 -2.416 12.768 -6.094 1.00 0.00 C ATOM 493 CG2 VAL A 32 -2.382 12.506 -3.610 1.00 0.00 C ATOM 0 H VAL A 32 -1.347 15.434 -5.946 1.00 0.00 H new ATOM 0 HA VAL A 32 -0.396 14.371 -3.718 1.00 0.00 H new ATOM 0 HB VAL A 32 -2.666 14.349 -4.686 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -3.453 12.433 -6.061 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -2.289 13.475 -6.914 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -1.763 11.910 -6.251 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -3.415 12.169 -3.695 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -1.716 11.644 -3.644 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -2.248 13.031 -2.664 1.00 0.00 H new ATOM 503 N GLY A 33 0.751 12.440 -6.083 1.00 0.00 N ATOM 504 CA GLY A 33 1.677 11.350 -6.337 1.00 0.00 C ATOM 505 C GLY A 33 2.660 11.707 -7.443 1.00 0.00 C ATOM 506 O GLY A 33 2.873 10.893 -8.344 1.00 0.00 O ATOM 0 H GLY A 33 0.376 12.870 -6.929 1.00 0.00 H new ATOM 0 HA2 GLY A 33 2.223 11.114 -5.424 1.00 0.00 H new ATOM 0 HA3 GLY A 33 1.121 10.455 -6.616 1.00 0.00 H new ATOM 510 N ASN A 34 3.242 12.908 -7.383 1.00 0.00 N ATOM 511 CA ASN A 34 4.259 13.365 -8.335 1.00 0.00 C ATOM 512 C ASN A 34 5.022 14.587 -7.821 1.00 0.00 C ATOM 513 O ASN A 34 6.226 14.690 -8.057 1.00 0.00 O ATOM 514 CB ASN A 34 3.661 13.671 -9.714 1.00 0.00 C ATOM 515 CG ASN A 34 2.591 14.747 -9.621 1.00 0.00 C ATOM 516 OD1 ASN A 34 1.361 14.322 -9.367 1.00 0.00 O flip ATOM 517 ND2 ASN A 34 2.867 15.934 -9.734 1.00 0.00 N flip ATOM 0 H ASN A 34 3.018 13.597 -6.665 1.00 0.00 H new ATOM 0 HA ASN A 34 4.962 12.539 -8.439 1.00 0.00 H new ATOM 0 HB2 ASN A 34 4.450 13.996 -10.392 1.00 0.00 H new ATOM 0 HB3 ASN A 34 3.232 12.763 -10.137 1.00 0.00 H new ATOM 0 HD21 ASN A 34 3.827 16.218 -9.930 1.00 0.00 H new ATOM 0 HD22 ASN A 34 2.137 16.639 -9.632 1.00 0.00 H new ATOM 524 N MET A 35 4.354 15.513 -7.126 1.00 0.00 N ATOM 525 CA MET A 35 5.011 16.676 -6.547 1.00 0.00 C ATOM 526 C MET A 35 5.744 16.236 -5.281 1.00 0.00 C ATOM 527 O MET A 35 6.949 16.434 -5.161 1.00 0.00 O ATOM 528 CB MET A 35 3.967 17.771 -6.269 1.00 0.00 C ATOM 529 CG MET A 35 4.562 19.077 -5.723 1.00 0.00 C ATOM 530 SD MET A 35 5.569 20.031 -6.896 1.00 0.00 S ATOM 531 CE MET A 35 5.987 21.458 -5.862 1.00 0.00 C ATOM 0 H MET A 35 3.350 15.473 -6.953 1.00 0.00 H new ATOM 0 HA MET A 35 5.743 17.098 -7.236 1.00 0.00 H new ATOM 0 HB2 MET A 35 3.428 17.987 -7.191 1.00 0.00 H new ATOM 0 HB3 MET A 35 3.237 17.390 -5.555 1.00 0.00 H new ATOM 0 HG2 MET A 35 3.746 19.709 -5.374 1.00 0.00 H new ATOM 0 HG3 MET A 35 5.175 18.840 -4.854 1.00 0.00 H new ATOM 0 HE1 MET A 35 6.608 22.150 -6.431 1.00 0.00 H new ATOM 0 HE2 MET A 35 5.072 21.962 -5.551 1.00 0.00 H new ATOM 0 HE3 MET A 35 6.533 21.121 -4.981 1.00 0.00 H new ATOM 541 N THR A 36 4.996 15.637 -4.352 1.00 0.00 N ATOM 542 CA THR A 36 5.487 15.234 -3.038 1.00 0.00 C ATOM 543 C THR A 36 6.573 14.152 -3.122 1.00 0.00 C ATOM 544 O THR A 36 7.438 14.104 -2.255 1.00 0.00 O ATOM 545 CB THR A 36 4.293 14.822 -2.157 1.00 0.00 C ATOM 546 OG1 THR A 36 4.690 14.462 -0.850 1.00 0.00 O ATOM 547 CG2 THR A 36 3.507 13.645 -2.736 1.00 0.00 C ATOM 0 H THR A 36 4.011 15.415 -4.498 1.00 0.00 H new ATOM 0 HA THR A 36 5.981 16.085 -2.570 1.00 0.00 H new ATOM 0 HB THR A 36 3.658 15.708 -2.127 1.00 0.00 H new ATOM 0 HG1 THR A 36 3.901 14.210 -0.326 1.00 0.00 H new ATOM 0 HG21 THR A 36 2.678 13.399 -2.072 1.00 0.00 H new ATOM 0 HG22 THR A 36 3.118 13.915 -3.718 1.00 0.00 H new ATOM 0 HG23 THR A 36 4.164 12.780 -2.831 1.00 0.00 H new ATOM 555 N LYS A 37 6.529 13.312 -4.165 1.00 0.00 N ATOM 556 CA LYS A 37 7.394 12.148 -4.360 1.00 0.00 C ATOM 557 C LYS A 37 6.986 11.024 -3.399 1.00 0.00 C ATOM 558 O LYS A 37 7.579 10.889 -2.332 1.00 0.00 O ATOM 559 CB LYS A 37 8.898 12.482 -4.252 1.00 0.00 C ATOM 560 CG LYS A 37 9.341 13.724 -5.038 1.00 0.00 C ATOM 561 CD LYS A 37 8.957 13.633 -6.518 1.00 0.00 C ATOM 562 CE LYS A 37 9.421 14.881 -7.278 1.00 0.00 C ATOM 563 NZ LYS A 37 8.843 14.930 -8.635 1.00 0.00 N ATOM 0 H LYS A 37 5.861 13.433 -4.926 1.00 0.00 H new ATOM 0 HA LYS A 37 7.250 11.804 -5.384 1.00 0.00 H new ATOM 0 HB2 LYS A 37 9.149 12.626 -3.201 1.00 0.00 H new ATOM 0 HB3 LYS A 37 9.472 11.624 -4.602 1.00 0.00 H new ATOM 0 HG2 LYS A 37 8.886 14.612 -4.599 1.00 0.00 H new ATOM 0 HG3 LYS A 37 10.421 13.843 -4.950 1.00 0.00 H new ATOM 0 HD2 LYS A 37 9.406 12.744 -6.961 1.00 0.00 H new ATOM 0 HD3 LYS A 37 7.876 13.525 -6.612 1.00 0.00 H new ATOM 0 HE2 LYS A 37 9.131 15.774 -6.725 1.00 0.00 H new ATOM 0 HE3 LYS A 37 10.509 14.885 -7.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 9.203 15.768 -9.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 9.112 14.072 -9.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 7.807 14.984 -8.569 1.00 0.00 H new ATOM 577 N PRO A 38 5.974 10.212 -3.747 1.00 0.00 N ATOM 578 CA PRO A 38 5.535 9.137 -2.880 1.00 0.00 C ATOM 579 C PRO A 38 6.603 8.041 -2.855 1.00 0.00 C ATOM 580 O PRO A 38 7.134 7.651 -3.900 1.00 0.00 O ATOM 581 CB PRO A 38 4.205 8.657 -3.463 1.00 0.00 C ATOM 582 CG PRO A 38 4.362 8.942 -4.957 1.00 0.00 C ATOM 583 CD PRO A 38 5.221 10.209 -4.993 1.00 0.00 C ATOM 0 HA PRO A 38 5.394 9.447 -1.845 1.00 0.00 H new ATOM 0 HB2 PRO A 38 4.038 7.597 -3.270 1.00 0.00 H new ATOM 0 HB3 PRO A 38 3.359 9.196 -3.036 1.00 0.00 H new ATOM 0 HG2 PRO A 38 4.847 8.114 -5.474 1.00 0.00 H new ATOM 0 HG3 PRO A 38 3.397 9.098 -5.439 1.00 0.00 H new ATOM 0 HD2 PRO A 38 5.889 10.204 -5.854 1.00 0.00 H new ATOM 0 HD3 PRO A 38 4.600 11.101 -5.077 1.00 0.00 H new ATOM 591 N THR A 39 6.900 7.555 -1.652 1.00 0.00 N ATOM 592 CA THR A 39 7.809 6.453 -1.404 1.00 0.00 C ATOM 593 C THR A 39 6.995 5.346 -0.742 1.00 0.00 C ATOM 594 O THR A 39 6.091 5.619 0.042 1.00 0.00 O ATOM 595 CB THR A 39 8.970 6.938 -0.522 1.00 0.00 C ATOM 596 OG1 THR A 39 9.880 7.697 -1.296 1.00 0.00 O ATOM 597 CG2 THR A 39 9.752 5.788 0.116 1.00 0.00 C ATOM 0 H THR A 39 6.496 7.936 -0.796 1.00 0.00 H new ATOM 0 HA THR A 39 8.253 6.069 -2.322 1.00 0.00 H new ATOM 0 HB THR A 39 8.521 7.536 0.271 1.00 0.00 H new ATOM 0 HG1 THR A 39 10.675 7.157 -1.489 1.00 0.00 H new ATOM 0 HG21 THR A 39 10.559 6.192 0.727 1.00 0.00 H new ATOM 0 HG22 THR A 39 9.084 5.197 0.742 1.00 0.00 H new ATOM 0 HG23 THR A 39 10.171 5.155 -0.666 1.00 0.00 H new ATOM 605 N THR A 40 7.312 4.096 -1.053 1.00 0.00 N ATOM 606 CA THR A 40 6.566 2.943 -0.591 1.00 0.00 C ATOM 607 C THR A 40 7.556 1.998 0.076 1.00 0.00 C ATOM 608 O THR A 40 8.375 1.381 -0.605 1.00 0.00 O ATOM 609 CB THR A 40 5.842 2.350 -1.802 1.00 0.00 C ATOM 610 OG1 THR A 40 4.942 3.328 -2.273 1.00 0.00 O ATOM 611 CG2 THR A 40 5.036 1.100 -1.472 1.00 0.00 C ATOM 0 H THR A 40 8.108 3.856 -1.643 1.00 0.00 H new ATOM 0 HA THR A 40 5.802 3.177 0.151 1.00 0.00 H new ATOM 0 HB THR A 40 6.597 2.067 -2.535 1.00 0.00 H new ATOM 0 HG1 THR A 40 4.845 3.243 -3.245 1.00 0.00 H new ATOM 0 HG21 THR A 40 4.549 0.732 -2.375 1.00 0.00 H new ATOM 0 HG22 THR A 40 5.701 0.331 -1.080 1.00 0.00 H new ATOM 0 HG23 THR A 40 4.280 1.341 -0.725 1.00 0.00 H new ATOM 619 N ILE A 41 7.508 1.913 1.409 1.00 0.00 N ATOM 620 CA ILE A 41 8.308 0.945 2.145 1.00 0.00 C ATOM 621 C ILE A 41 7.526 -0.361 2.112 1.00 0.00 C ATOM 622 O ILE A 41 6.410 -0.399 2.622 1.00 0.00 O ATOM 623 CB ILE A 41 8.604 1.431 3.577 1.00 0.00 C ATOM 624 CG1 ILE A 41 9.536 2.654 3.525 1.00 0.00 C ATOM 625 CG2 ILE A 41 9.249 0.312 4.410 1.00 0.00 C ATOM 626 CD1 ILE A 41 9.823 3.270 4.898 1.00 0.00 C ATOM 0 H ILE A 41 6.921 2.506 1.996 1.00 0.00 H new ATOM 0 HA ILE A 41 9.290 0.807 1.692 1.00 0.00 H new ATOM 0 HB ILE A 41 7.664 1.711 4.052 1.00 0.00 H new ATOM 0 HG12 ILE A 41 10.479 2.361 3.064 1.00 0.00 H new ATOM 0 HG13 ILE A 41 9.089 3.413 2.883 1.00 0.00 H new ATOM 0 HG21 ILE A 41 9.449 0.677 5.417 1.00 0.00 H new ATOM 0 HG22 ILE A 41 8.571 -0.540 4.461 1.00 0.00 H new ATOM 0 HG23 ILE A 41 10.185 0.004 3.943 1.00 0.00 H new ATOM 0 HD11 ILE A 41 10.487 4.127 4.781 1.00 0.00 H new ATOM 0 HD12 ILE A 41 8.888 3.595 5.354 1.00 0.00 H new ATOM 0 HD13 ILE A 41 10.299 2.527 5.538 1.00 0.00 H new ATOM 638 N ILE A 42 8.088 -1.407 1.506 1.00 0.00 N ATOM 639 CA ILE A 42 7.547 -2.754 1.535 1.00 0.00 C ATOM 640 C ILE A 42 8.645 -3.669 2.059 1.00 0.00 C ATOM 641 O ILE A 42 9.647 -3.879 1.374 1.00 0.00 O ATOM 642 CB ILE A 42 7.000 -3.163 0.157 1.00 0.00 C ATOM 643 CG1 ILE A 42 5.639 -2.468 -0.008 1.00 0.00 C ATOM 644 CG2 ILE A 42 6.787 -4.682 0.073 1.00 0.00 C ATOM 645 CD1 ILE A 42 5.091 -2.481 -1.429 1.00 0.00 C ATOM 0 H ILE A 42 8.953 -1.333 0.970 1.00 0.00 H new ATOM 0 HA ILE A 42 6.687 -2.825 2.201 1.00 0.00 H new ATOM 0 HB ILE A 42 7.708 -2.876 -0.620 1.00 0.00 H new ATOM 0 HG12 ILE A 42 4.917 -2.950 0.651 1.00 0.00 H new ATOM 0 HG13 ILE A 42 5.731 -1.434 0.323 1.00 0.00 H new ATOM 0 HG21 ILE A 42 6.400 -4.941 -0.912 1.00 0.00 H new ATOM 0 HG22 ILE A 42 7.736 -5.192 0.235 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.073 -4.992 0.836 1.00 0.00 H new ATOM 0 HD11 ILE A 42 4.129 -1.970 -1.453 1.00 0.00 H new ATOM 0 HD12 ILE A 42 5.789 -1.971 -2.093 1.00 0.00 H new ATOM 0 HD13 ILE A 42 4.962 -3.512 -1.760 1.00 0.00 H new ATOM 657 N GLU A 43 8.451 -4.198 3.271 1.00 0.00 N ATOM 658 CA GLU A 43 9.404 -5.093 3.911 1.00 0.00 C ATOM 659 C GLU A 43 8.749 -6.448 4.171 1.00 0.00 C ATOM 660 O GLU A 43 7.533 -6.525 4.353 1.00 0.00 O ATOM 661 CB GLU A 43 9.972 -4.433 5.180 1.00 0.00 C ATOM 662 CG GLU A 43 11.140 -5.218 5.794 1.00 0.00 C ATOM 663 CD GLU A 43 12.216 -5.522 4.761 1.00 0.00 C ATOM 664 OE1 GLU A 43 13.073 -4.641 4.544 1.00 0.00 O ATOM 665 OE2 GLU A 43 12.102 -6.609 4.151 1.00 0.00 O ATOM 0 H GLU A 43 7.621 -4.012 3.834 1.00 0.00 H new ATOM 0 HA GLU A 43 10.252 -5.279 3.252 1.00 0.00 H new ATOM 0 HB2 GLU A 43 10.307 -3.424 4.939 1.00 0.00 H new ATOM 0 HB3 GLU A 43 9.177 -4.337 5.920 1.00 0.00 H new ATOM 0 HG2 GLU A 43 11.573 -4.645 6.614 1.00 0.00 H new ATOM 0 HG3 GLU A 43 10.769 -6.151 6.219 1.00 0.00 H new ATOM 672 N VAL A 44 9.547 -7.516 4.125 1.00 0.00 N ATOM 673 CA VAL A 44 9.068 -8.889 4.135 1.00 0.00 C ATOM 674 C VAL A 44 9.066 -9.420 5.572 1.00 0.00 C ATOM 675 O VAL A 44 10.111 -9.648 6.177 1.00 0.00 O ATOM 676 CB VAL A 44 9.845 -9.751 3.117 1.00 0.00 C ATOM 677 CG1 VAL A 44 9.872 -9.041 1.753 1.00 0.00 C ATOM 678 CG2 VAL A 44 11.278 -10.109 3.534 1.00 0.00 C ATOM 0 H VAL A 44 10.563 -7.444 4.079 1.00 0.00 H new ATOM 0 HA VAL A 44 8.033 -8.938 3.797 1.00 0.00 H new ATOM 0 HB VAL A 44 9.306 -10.697 3.064 1.00 0.00 H new ATOM 0 HG11 VAL A 44 10.421 -9.651 1.036 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.852 -8.895 1.399 1.00 0.00 H new ATOM 0 HG13 VAL A 44 10.363 -8.073 1.856 1.00 0.00 H new ATOM 0 HG21 VAL A 44 11.743 -10.715 2.756 1.00 0.00 H new ATOM 0 HG22 VAL A 44 11.855 -9.195 3.675 1.00 0.00 H new ATOM 0 HG23 VAL A 44 11.256 -10.671 4.467 1.00 0.00 H new ATOM 688 N ASN A 45 7.881 -9.650 6.133 1.00 0.00 N ATOM 689 CA ASN A 45 7.721 -10.219 7.464 1.00 0.00 C ATOM 690 C ASN A 45 7.838 -11.741 7.346 1.00 0.00 C ATOM 691 O ASN A 45 6.938 -12.484 7.730 1.00 0.00 O ATOM 692 CB ASN A 45 6.375 -9.788 8.070 1.00 0.00 C ATOM 693 CG ASN A 45 6.330 -8.321 8.492 1.00 0.00 C ATOM 694 OD1 ASN A 45 6.951 -7.456 7.885 1.00 0.00 O ATOM 695 ND2 ASN A 45 5.577 -8.018 9.546 1.00 0.00 N ATOM 0 H ASN A 45 6.997 -9.443 5.669 1.00 0.00 H new ATOM 0 HA ASN A 45 8.497 -9.855 8.137 1.00 0.00 H new ATOM 0 HB2 ASN A 45 5.584 -9.971 7.342 1.00 0.00 H new ATOM 0 HB3 ASN A 45 6.161 -10.413 8.937 1.00 0.00 H new ATOM 0 HD21 ASN A 45 5.509 -7.051 9.863 1.00 0.00 H new ATOM 0 HD22 ASN A 45 5.068 -8.753 10.037 1.00 0.00 H new ATOM 702 N GLY A 46 8.963 -12.211 6.800 1.00 0.00 N ATOM 703 CA GLY A 46 9.226 -13.623 6.570 1.00 0.00 C ATOM 704 C GLY A 46 8.208 -14.254 5.616 1.00 0.00 C ATOM 705 O GLY A 46 8.481 -14.396 4.426 1.00 0.00 O ATOM 0 H GLY A 46 9.727 -11.604 6.502 1.00 0.00 H new ATOM 0 HA2 GLY A 46 10.228 -13.742 6.159 1.00 0.00 H new ATOM 0 HA3 GLY A 46 9.207 -14.154 7.522 1.00 0.00 H new ATOM 709 N ASP A 47 7.051 -14.656 6.148 1.00 0.00 N ATOM 710 CA ASP A 47 5.957 -15.262 5.398 1.00 0.00 C ATOM 711 C ASP A 47 5.020 -14.179 4.856 1.00 0.00 C ATOM 712 O ASP A 47 4.461 -14.308 3.767 1.00 0.00 O ATOM 713 CB ASP A 47 5.204 -16.260 6.295 1.00 0.00 C ATOM 714 CG ASP A 47 4.139 -15.608 7.173 1.00 0.00 C ATOM 715 OD1 ASP A 47 4.473 -14.635 7.883 1.00 0.00 O ATOM 716 OD2 ASP A 47 2.985 -16.083 7.080 1.00 0.00 O ATOM 0 H ASP A 47 6.847 -14.564 7.143 1.00 0.00 H new ATOM 0 HA ASP A 47 6.360 -15.807 4.544 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.733 -17.016 5.667 1.00 0.00 H new ATOM 0 HB3 ASP A 47 5.922 -16.777 6.932 1.00 0.00 H new ATOM 721 N THR A 48 4.835 -13.131 5.653 1.00 0.00 N ATOM 722 CA THR A 48 3.970 -11.997 5.412 1.00 0.00 C ATOM 723 C THR A 48 4.824 -10.869 4.831 1.00 0.00 C ATOM 724 O THR A 48 6.041 -10.994 4.695 1.00 0.00 O ATOM 725 CB THR A 48 3.300 -11.608 6.748 1.00 0.00 C ATOM 726 OG1 THR A 48 4.097 -11.974 7.857 1.00 0.00 O ATOM 727 CG2 THR A 48 1.967 -12.318 6.953 1.00 0.00 C ATOM 0 H THR A 48 5.323 -13.053 6.545 1.00 0.00 H new ATOM 0 HA THR A 48 3.178 -12.222 4.698 1.00 0.00 H new ATOM 0 HB THR A 48 3.164 -10.528 6.689 1.00 0.00 H new ATOM 0 HG1 THR A 48 4.020 -12.939 8.011 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.535 -12.012 7.906 1.00 0.00 H new ATOM 0 HG22 THR A 48 1.286 -12.054 6.144 1.00 0.00 H new ATOM 0 HG23 THR A 48 2.126 -13.396 6.956 1.00 0.00 H new ATOM 735 N VAL A 49 4.202 -9.748 4.480 1.00 0.00 N ATOM 736 CA VAL A 49 4.882 -8.596 3.921 1.00 0.00 C ATOM 737 C VAL A 49 4.058 -7.367 4.290 1.00 0.00 C ATOM 738 O VAL A 49 2.829 -7.440 4.303 1.00 0.00 O ATOM 739 CB VAL A 49 5.099 -8.821 2.413 1.00 0.00 C ATOM 740 CG1 VAL A 49 3.850 -9.375 1.719 1.00 0.00 C ATOM 741 CG2 VAL A 49 5.569 -7.560 1.683 1.00 0.00 C ATOM 0 H VAL A 49 3.195 -9.617 4.580 1.00 0.00 H new ATOM 0 HA VAL A 49 5.882 -8.441 4.326 1.00 0.00 H new ATOM 0 HB VAL A 49 5.893 -9.565 2.352 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.056 -9.516 0.658 1.00 0.00 H new ATOM 0 HG12 VAL A 49 3.579 -10.332 2.166 1.00 0.00 H new ATOM 0 HG13 VAL A 49 3.025 -8.672 1.839 1.00 0.00 H new ATOM 0 HG21 VAL A 49 5.704 -7.782 0.624 1.00 0.00 H new ATOM 0 HG22 VAL A 49 4.822 -6.774 1.797 1.00 0.00 H new ATOM 0 HG23 VAL A 49 6.515 -7.225 2.108 1.00 0.00 H new ATOM 751 N ILE A 50 4.721 -6.276 4.679 1.00 0.00 N ATOM 752 CA ILE A 50 4.073 -5.084 5.205 1.00 0.00 C ATOM 753 C ILE A 50 4.401 -3.892 4.318 1.00 0.00 C ATOM 754 O ILE A 50 5.575 -3.647 4.046 1.00 0.00 O ATOM 755 CB ILE A 50 4.433 -4.878 6.690 1.00 0.00 C ATOM 756 CG1 ILE A 50 3.534 -3.792 7.307 1.00 0.00 C ATOM 757 CG2 ILE A 50 5.917 -4.551 6.906 1.00 0.00 C ATOM 758 CD1 ILE A 50 3.724 -3.659 8.821 1.00 0.00 C ATOM 0 H ILE A 50 5.737 -6.200 4.635 1.00 0.00 H new ATOM 0 HA ILE A 50 2.990 -5.203 5.182 1.00 0.00 H new ATOM 0 HB ILE A 50 4.253 -5.825 7.198 1.00 0.00 H new ATOM 0 HG12 ILE A 50 3.749 -2.835 6.832 1.00 0.00 H new ATOM 0 HG13 ILE A 50 2.491 -4.026 7.095 1.00 0.00 H new ATOM 0 HG21 ILE A 50 6.109 -4.417 7.971 1.00 0.00 H new ATOM 0 HG22 ILE A 50 6.529 -5.370 6.527 1.00 0.00 H new ATOM 0 HG23 ILE A 50 6.169 -3.634 6.374 1.00 0.00 H new ATOM 0 HD11 ILE A 50 3.066 -2.879 9.203 1.00 0.00 H new ATOM 0 HD12 ILE A 50 3.482 -4.606 9.303 1.00 0.00 H new ATOM 0 HD13 ILE A 50 4.760 -3.397 9.036 1.00 0.00 H new ATOM 770 N ILE A 51 3.361 -3.183 3.864 1.00 0.00 N ATOM 771 CA ILE A 51 3.462 -1.968 3.071 1.00 0.00 C ATOM 772 C ILE A 51 3.222 -0.767 3.981 1.00 0.00 C ATOM 773 O ILE A 51 2.327 -0.814 4.826 1.00 0.00 O ATOM 774 CB ILE A 51 2.492 -2.012 1.866 1.00 0.00 C ATOM 775 CG1 ILE A 51 2.605 -0.768 0.962 1.00 0.00 C ATOM 776 CG2 ILE A 51 1.032 -2.318 2.225 1.00 0.00 C ATOM 777 CD1 ILE A 51 1.649 0.383 1.296 1.00 0.00 C ATOM 0 H ILE A 51 2.396 -3.455 4.049 1.00 0.00 H new ATOM 0 HA ILE A 51 4.462 -1.878 2.646 1.00 0.00 H new ATOM 0 HB ILE A 51 2.832 -2.872 1.289 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.628 -0.394 1.015 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.431 -1.074 -0.070 1.00 0.00 H new ATOM 0 HG21 ILE A 51 0.429 -2.328 1.317 1.00 0.00 H new ATOM 0 HG22 ILE A 51 0.973 -3.292 2.711 1.00 0.00 H new ATOM 0 HG23 ILE A 51 0.656 -1.552 2.903 1.00 0.00 H new ATOM 0 HD11 ILE A 51 1.813 1.206 0.600 1.00 0.00 H new ATOM 0 HD12 ILE A 51 0.619 0.036 1.212 1.00 0.00 H new ATOM 0 HD13 ILE A 51 1.835 0.726 2.314 1.00 0.00 H new ATOM 789 N LYS A 52 4.011 0.297 3.796 1.00 0.00 N ATOM 790 CA LYS A 52 3.767 1.629 4.323 1.00 0.00 C ATOM 791 C LYS A 52 3.905 2.651 3.187 1.00 0.00 C ATOM 792 O LYS A 52 4.979 2.767 2.590 1.00 0.00 O ATOM 793 CB LYS A 52 4.750 1.965 5.448 1.00 0.00 C ATOM 794 CG LYS A 52 4.700 0.992 6.629 1.00 0.00 C ATOM 795 CD LYS A 52 4.914 1.779 7.931 1.00 0.00 C ATOM 796 CE LYS A 52 4.750 0.906 9.182 1.00 0.00 C ATOM 797 NZ LYS A 52 5.913 0.040 9.438 1.00 0.00 N ATOM 0 H LYS A 52 4.871 0.243 3.251 1.00 0.00 H new ATOM 0 HA LYS A 52 2.759 1.664 4.736 1.00 0.00 H new ATOM 0 HB2 LYS A 52 5.761 1.976 5.042 1.00 0.00 H new ATOM 0 HB3 LYS A 52 4.541 2.972 5.811 1.00 0.00 H new ATOM 0 HG2 LYS A 52 3.739 0.477 6.653 1.00 0.00 H new ATOM 0 HG3 LYS A 52 5.469 0.227 6.520 1.00 0.00 H new ATOM 0 HD2 LYS A 52 5.912 2.217 7.926 1.00 0.00 H new ATOM 0 HD3 LYS A 52 4.204 2.605 7.973 1.00 0.00 H new ATOM 0 HE2 LYS A 52 4.585 1.548 10.047 1.00 0.00 H new ATOM 0 HE3 LYS A 52 3.860 0.286 9.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 5.743 -0.525 10.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 6.058 -0.595 8.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 6.760 0.628 9.573 1.00 0.00 H new ATOM 811 N THR A 53 2.828 3.387 2.907 1.00 0.00 N ATOM 812 CA THR A 53 2.772 4.457 1.924 1.00 0.00 C ATOM 813 C THR A 53 3.358 5.730 2.550 1.00 0.00 C ATOM 814 O THR A 53 2.660 6.449 3.268 1.00 0.00 O ATOM 815 CB THR A 53 1.308 4.666 1.480 1.00 0.00 C ATOM 816 OG1 THR A 53 0.604 3.437 1.443 1.00 0.00 O ATOM 817 CG2 THR A 53 1.239 5.305 0.092 1.00 0.00 C ATOM 0 H THR A 53 1.937 3.243 3.382 1.00 0.00 H new ATOM 0 HA THR A 53 3.358 4.203 1.040 1.00 0.00 H new ATOM 0 HB THR A 53 0.848 5.329 2.212 1.00 0.00 H new ATOM 0 HG1 THR A 53 -0.210 3.510 1.983 1.00 0.00 H new ATOM 0 HG21 THR A 53 0.196 5.440 -0.195 1.00 0.00 H new ATOM 0 HG22 THR A 53 1.738 6.274 0.112 1.00 0.00 H new ATOM 0 HG23 THR A 53 1.733 4.657 -0.632 1.00 0.00 H new ATOM 825 N GLN A 54 4.637 6.013 2.292 1.00 0.00 N ATOM 826 CA GLN A 54 5.276 7.250 2.714 1.00 0.00 C ATOM 827 C GLN A 54 4.885 8.373 1.755 1.00 0.00 C ATOM 828 O GLN A 54 5.355 8.451 0.619 1.00 0.00 O ATOM 829 CB GLN A 54 6.800 7.086 2.840 1.00 0.00 C ATOM 830 CG GLN A 54 7.216 6.976 4.311 1.00 0.00 C ATOM 831 CD GLN A 54 6.496 5.845 5.034 1.00 0.00 C ATOM 832 OE1 GLN A 54 6.650 4.622 4.548 1.00 0.00 O flip ATOM 833 NE2 GLN A 54 5.796 6.069 6.015 1.00 0.00 N flip ATOM 0 H GLN A 54 5.257 5.384 1.782 1.00 0.00 H new ATOM 0 HA GLN A 54 4.923 7.514 3.711 1.00 0.00 H new ATOM 0 HB2 GLN A 54 7.120 6.195 2.299 1.00 0.00 H new ATOM 0 HB3 GLN A 54 7.301 7.937 2.378 1.00 0.00 H new ATOM 0 HG2 GLN A 54 8.292 6.815 4.370 1.00 0.00 H new ATOM 0 HG3 GLN A 54 7.006 7.919 4.817 1.00 0.00 H new ATOM 0 HE21 GLN A 54 5.698 7.022 6.365 1.00 0.00 H new ATOM 0 HE22 GLN A 54 5.312 5.302 6.482 1.00 0.00 H new ATOM 842 N SER A 55 4.021 9.240 2.272 1.00 0.00 N ATOM 843 CA SER A 55 3.439 10.401 1.637 1.00 0.00 C ATOM 844 C SER A 55 3.581 11.584 2.602 1.00 0.00 C ATOM 845 O SER A 55 4.157 11.450 3.686 1.00 0.00 O ATOM 846 CB SER A 55 1.967 10.066 1.376 1.00 0.00 C ATOM 847 OG SER A 55 1.849 9.179 0.283 1.00 0.00 O ATOM 0 H SER A 55 3.686 9.132 3.229 1.00 0.00 H new ATOM 0 HA SER A 55 3.926 10.663 0.698 1.00 0.00 H new ATOM 0 HB2 SER A 55 1.527 9.617 2.266 1.00 0.00 H new ATOM 0 HB3 SER A 55 1.410 10.981 1.172 1.00 0.00 H new ATOM 0 HG SER A 55 1.145 9.496 -0.321 1.00 0.00 H new ATOM 853 N THR A 56 3.046 12.747 2.226 1.00 0.00 N ATOM 854 CA THR A 56 2.981 13.911 3.099 1.00 0.00 C ATOM 855 C THR A 56 1.684 14.660 2.796 1.00 0.00 C ATOM 856 O THR A 56 1.689 15.784 2.300 1.00 0.00 O ATOM 857 CB THR A 56 4.253 14.761 2.942 1.00 0.00 C ATOM 858 OG1 THR A 56 5.386 13.919 2.982 1.00 0.00 O ATOM 859 CG2 THR A 56 4.398 15.767 4.085 1.00 0.00 C ATOM 0 H THR A 56 2.645 12.904 1.302 1.00 0.00 H new ATOM 0 HA THR A 56 2.954 13.626 4.151 1.00 0.00 H new ATOM 0 HB THR A 56 4.177 15.292 1.993 1.00 0.00 H new ATOM 0 HG1 THR A 56 6.198 14.458 2.881 1.00 0.00 H new ATOM 0 HG21 THR A 56 5.307 16.351 3.943 1.00 0.00 H new ATOM 0 HG22 THR A 56 3.536 16.434 4.094 1.00 0.00 H new ATOM 0 HG23 THR A 56 4.454 15.234 5.034 1.00 0.00 H new ATOM 867 N PHE A 57 0.563 13.989 3.070 1.00 0.00 N ATOM 868 CA PHE A 57 -0.795 14.506 2.914 1.00 0.00 C ATOM 869 C PHE A 57 -1.768 13.525 3.570 1.00 0.00 C ATOM 870 O PHE A 57 -2.660 13.922 4.315 1.00 0.00 O ATOM 871 CB PHE A 57 -1.146 14.757 1.434 1.00 0.00 C ATOM 872 CG PHE A 57 -1.022 13.551 0.518 1.00 0.00 C ATOM 873 CD1 PHE A 57 -2.094 12.649 0.389 1.00 0.00 C ATOM 874 CD2 PHE A 57 0.193 13.283 -0.139 1.00 0.00 C ATOM 875 CE1 PHE A 57 -1.916 11.432 -0.291 1.00 0.00 C ATOM 876 CE2 PHE A 57 0.352 12.088 -0.860 1.00 0.00 C ATOM 877 CZ PHE A 57 -0.692 11.152 -0.915 1.00 0.00 C ATOM 0 H PHE A 57 0.579 13.031 3.421 1.00 0.00 H new ATOM 0 HA PHE A 57 -0.871 15.475 3.408 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -2.169 15.129 1.380 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -0.499 15.548 1.054 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -3.057 12.893 0.814 1.00 0.00 H new ATOM 0 HD2 PHE A 57 1.003 13.996 -0.089 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -2.721 10.713 -0.333 1.00 0.00 H new ATOM 0 HE2 PHE A 57 1.281 11.889 -1.374 1.00 0.00 H new ATOM 0 HZ PHE A 57 -0.553 10.217 -1.437 1.00 0.00 H new ATOM 887 N LYS A 58 -1.579 12.234 3.294 1.00 0.00 N ATOM 888 CA LYS A 58 -2.271 11.122 3.913 1.00 0.00 C ATOM 889 C LYS A 58 -1.370 9.911 3.686 1.00 0.00 C ATOM 890 O LYS A 58 -0.891 9.723 2.569 1.00 0.00 O ATOM 891 CB LYS A 58 -3.653 10.942 3.269 1.00 0.00 C ATOM 892 CG LYS A 58 -4.504 9.918 4.033 1.00 0.00 C ATOM 893 CD LYS A 58 -5.815 9.561 3.316 1.00 0.00 C ATOM 894 CE LYS A 58 -6.974 10.556 3.509 1.00 0.00 C ATOM 895 NZ LYS A 58 -6.758 11.864 2.855 1.00 0.00 N ATOM 0 H LYS A 58 -0.902 11.929 2.595 1.00 0.00 H new ATOM 0 HA LYS A 58 -2.450 11.275 4.977 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -4.171 11.901 3.245 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.534 10.618 2.235 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -3.920 9.010 4.182 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -4.735 10.314 5.022 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -5.611 9.471 2.249 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -6.141 8.580 3.662 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -7.889 10.112 3.117 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -7.128 10.716 4.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -7.662 12.374 2.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -6.083 12.424 3.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -6.376 11.715 1.899 1.00 0.00 H new ATOM 909 N ASN A 59 -1.110 9.138 4.741 1.00 0.00 N ATOM 910 CA ASN A 59 -0.198 8.002 4.732 1.00 0.00 C ATOM 911 C ASN A 59 -0.991 6.808 5.260 1.00 0.00 C ATOM 912 O ASN A 59 -1.996 7.004 5.945 1.00 0.00 O ATOM 913 CB ASN A 59 1.036 8.285 5.611 1.00 0.00 C ATOM 914 CG ASN A 59 1.892 9.468 5.139 1.00 0.00 C ATOM 915 OD1 ASN A 59 1.395 10.461 4.612 1.00 0.00 O ATOM 916 ND2 ASN A 59 3.208 9.394 5.322 1.00 0.00 N ATOM 0 H ASN A 59 -1.543 9.293 5.651 1.00 0.00 H new ATOM 0 HA ASN A 59 0.177 7.804 3.728 1.00 0.00 H new ATOM 0 HB2 ASN A 59 0.704 8.477 6.631 1.00 0.00 H new ATOM 0 HB3 ASN A 59 1.659 7.391 5.641 1.00 0.00 H new ATOM 0 HD21 ASN A 59 3.808 10.163 5.025 1.00 0.00 H new ATOM 0 HD22 ASN A 59 3.616 8.568 5.760 1.00 0.00 H new ATOM 923 N THR A 60 -0.574 5.588 4.925 1.00 0.00 N ATOM 924 CA THR A 60 -1.314 4.363 5.204 1.00 0.00 C ATOM 925 C THR A 60 -0.302 3.236 5.379 1.00 0.00 C ATOM 926 O THR A 60 0.788 3.320 4.810 1.00 0.00 O ATOM 927 CB THR A 60 -2.254 4.046 4.026 1.00 0.00 C ATOM 928 OG1 THR A 60 -1.592 4.300 2.802 1.00 0.00 O ATOM 929 CG2 THR A 60 -3.525 4.895 4.059 1.00 0.00 C ATOM 0 H THR A 60 0.308 5.422 4.441 1.00 0.00 H new ATOM 0 HA THR A 60 -1.915 4.475 6.106 1.00 0.00 H new ATOM 0 HB THR A 60 -2.530 2.995 4.114 1.00 0.00 H new ATOM 0 HG1 THR A 60 -2.194 4.095 2.056 1.00 0.00 H new ATOM 0 HG21 THR A 60 -4.157 4.637 3.209 1.00 0.00 H new ATOM 0 HG22 THR A 60 -4.066 4.704 4.986 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.259 5.951 4.006 1.00 0.00 H new ATOM 937 N GLU A 61 -0.657 2.188 6.127 1.00 0.00 N ATOM 938 CA GLU A 61 0.176 1.011 6.293 1.00 0.00 C ATOM 939 C GLU A 61 -0.696 -0.220 6.534 1.00 0.00 C ATOM 940 O GLU A 61 -1.699 -0.120 7.237 1.00 0.00 O ATOM 941 CB GLU A 61 1.200 1.233 7.413 1.00 0.00 C ATOM 942 CG GLU A 61 0.617 1.744 8.736 1.00 0.00 C ATOM 943 CD GLU A 61 1.727 1.880 9.768 1.00 0.00 C ATOM 944 OE1 GLU A 61 2.389 2.937 9.760 1.00 0.00 O ATOM 945 OE2 GLU A 61 1.969 0.883 10.484 1.00 0.00 O ATOM 0 H GLU A 61 -1.540 2.140 6.636 1.00 0.00 H new ATOM 0 HA GLU A 61 0.740 0.834 5.378 1.00 0.00 H new ATOM 0 HB2 GLU A 61 1.719 0.293 7.601 1.00 0.00 H new ATOM 0 HB3 GLU A 61 1.948 1.945 7.064 1.00 0.00 H new ATOM 0 HG2 GLU A 61 0.131 2.707 8.582 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -0.147 1.056 9.098 1.00 0.00 H new ATOM 952 N ILE A 62 -0.339 -1.357 5.922 1.00 0.00 N ATOM 953 CA ILE A 62 -1.102 -2.602 5.985 1.00 0.00 C ATOM 954 C ILE A 62 -0.133 -3.780 5.843 1.00 0.00 C ATOM 955 O ILE A 62 0.853 -3.689 5.109 1.00 0.00 O ATOM 956 CB ILE A 62 -2.181 -2.641 4.874 1.00 0.00 C ATOM 957 CG1 ILE A 62 -3.301 -1.592 5.020 1.00 0.00 C ATOM 958 CG2 ILE A 62 -2.814 -4.036 4.758 1.00 0.00 C ATOM 959 CD1 ILE A 62 -4.220 -1.813 6.230 1.00 0.00 C ATOM 0 H ILE A 62 0.507 -1.434 5.358 1.00 0.00 H new ATOM 0 HA ILE A 62 -1.617 -2.667 6.944 1.00 0.00 H new ATOM 0 HB ILE A 62 -1.635 -2.391 3.964 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -2.849 -0.603 5.098 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -3.906 -1.595 4.113 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -3.567 -4.030 3.970 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -2.042 -4.767 4.517 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -3.283 -4.303 5.705 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -4.979 -1.031 6.258 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -4.704 -2.786 6.146 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.630 -1.779 7.146 1.00 0.00 H new ATOM 971 N SER A 63 -0.415 -4.890 6.532 1.00 0.00 N ATOM 972 CA SER A 63 0.256 -6.169 6.372 1.00 0.00 C ATOM 973 C SER A 63 -0.567 -7.071 5.446 1.00 0.00 C ATOM 974 O SER A 63 -1.794 -7.003 5.439 1.00 0.00 O ATOM 975 CB SER A 63 0.447 -6.788 7.759 1.00 0.00 C ATOM 976 OG SER A 63 -0.732 -6.618 8.526 1.00 0.00 O ATOM 0 H SER A 63 -1.147 -4.916 7.242 1.00 0.00 H new ATOM 0 HA SER A 63 1.235 -6.043 5.910 1.00 0.00 H new ATOM 0 HB2 SER A 63 0.681 -7.848 7.665 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.291 -6.319 8.264 1.00 0.00 H new ATOM 0 HG SER A 63 -0.606 -7.017 9.412 1.00 0.00 H new ATOM 982 N PHE A 64 0.098 -7.906 4.644 1.00 0.00 N ATOM 983 CA PHE A 64 -0.539 -8.840 3.729 1.00 0.00 C ATOM 984 C PHE A 64 0.366 -10.056 3.533 1.00 0.00 C ATOM 985 O PHE A 64 1.447 -10.128 4.119 1.00 0.00 O ATOM 986 CB PHE A 64 -0.879 -8.128 2.408 1.00 0.00 C ATOM 987 CG PHE A 64 0.301 -7.697 1.556 1.00 0.00 C ATOM 988 CD1 PHE A 64 0.921 -6.454 1.779 1.00 0.00 C ATOM 989 CD2 PHE A 64 0.747 -8.514 0.502 1.00 0.00 C ATOM 990 CE1 PHE A 64 1.944 -6.014 0.923 1.00 0.00 C ATOM 991 CE2 PHE A 64 1.718 -8.041 -0.398 1.00 0.00 C ATOM 992 CZ PHE A 64 2.322 -6.792 -0.184 1.00 0.00 C ATOM 0 H PHE A 64 1.117 -7.948 4.616 1.00 0.00 H new ATOM 0 HA PHE A 64 -1.480 -9.200 4.145 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -1.507 -8.791 1.813 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.476 -7.245 2.638 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.610 -5.837 2.609 1.00 0.00 H new ATOM 0 HD2 PHE A 64 0.342 -9.508 0.383 1.00 0.00 H new ATOM 0 HE1 PHE A 64 2.441 -5.075 1.116 1.00 0.00 H new ATOM 0 HE2 PHE A 64 1.999 -8.638 -1.253 1.00 0.00 H new ATOM 0 HZ PHE A 64 3.075 -6.430 -0.868 1.00 0.00 H new ATOM 1002 N LYS A 65 -0.083 -11.020 2.723 1.00 0.00 N ATOM 1003 CA LYS A 65 0.659 -12.231 2.418 1.00 0.00 C ATOM 1004 C LYS A 65 0.314 -12.690 1.006 1.00 0.00 C ATOM 1005 O LYS A 65 -0.815 -12.529 0.545 1.00 0.00 O ATOM 1006 CB LYS A 65 0.322 -13.310 3.453 1.00 0.00 C ATOM 1007 CG LYS A 65 1.038 -14.639 3.180 1.00 0.00 C ATOM 1008 CD LYS A 65 0.944 -15.550 4.408 1.00 0.00 C ATOM 1009 CE LYS A 65 1.721 -16.852 4.173 1.00 0.00 C ATOM 1010 NZ LYS A 65 1.767 -17.678 5.395 1.00 0.00 N ATOM 0 H LYS A 65 -0.989 -10.973 2.257 1.00 0.00 H new ATOM 0 HA LYS A 65 1.731 -12.039 2.464 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.595 -12.953 4.446 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.755 -13.477 3.459 1.00 0.00 H new ATOM 0 HG2 LYS A 65 0.590 -15.132 2.317 1.00 0.00 H new ATOM 0 HG3 LYS A 65 2.084 -14.454 2.934 1.00 0.00 H new ATOM 0 HD2 LYS A 65 1.343 -15.034 5.282 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -0.101 -15.777 4.621 1.00 0.00 H new ATOM 0 HE2 LYS A 65 1.252 -17.417 3.367 1.00 0.00 H new ATOM 0 HE3 LYS A 65 2.736 -16.619 3.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 2.519 -18.391 5.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 1.963 -17.071 6.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 0.852 -18.155 5.526 1.00 0.00 H new ATOM 1024 N LEU A 66 1.301 -13.277 0.332 1.00 0.00 N ATOM 1025 CA LEU A 66 1.174 -13.866 -0.990 1.00 0.00 C ATOM 1026 C LEU A 66 0.338 -15.154 -0.945 1.00 0.00 C ATOM 1027 O LEU A 66 0.861 -16.240 -1.172 1.00 0.00 O ATOM 1028 CB LEU A 66 2.582 -14.103 -1.567 1.00 0.00 C ATOM 1029 CG LEU A 66 3.517 -14.870 -0.604 1.00 0.00 C ATOM 1030 CD1 LEU A 66 4.201 -16.054 -1.293 1.00 0.00 C ATOM 1031 CD2 LEU A 66 4.609 -13.945 -0.056 1.00 0.00 C ATOM 0 H LEU A 66 2.245 -13.356 0.710 1.00 0.00 H new ATOM 0 HA LEU A 66 0.640 -13.181 -1.649 1.00 0.00 H new ATOM 0 HB2 LEU A 66 2.496 -14.661 -2.499 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.033 -13.141 -1.811 1.00 0.00 H new ATOM 0 HG LEU A 66 2.889 -15.240 0.206 1.00 0.00 H new ATOM 0 HD11 LEU A 66 4.849 -16.565 -0.581 1.00 0.00 H new ATOM 0 HD12 LEU A 66 3.445 -16.749 -1.659 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.797 -15.693 -2.131 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.255 -14.505 0.619 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.201 -13.552 -0.882 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.148 -13.119 0.485 1.00 0.00 H new ATOM 1043 N GLY A 67 -0.966 -15.031 -0.686 1.00 0.00 N ATOM 1044 CA GLY A 67 -1.918 -16.129 -0.823 1.00 0.00 C ATOM 1045 C GLY A 67 -2.973 -16.090 0.277 1.00 0.00 C ATOM 1046 O GLY A 67 -3.167 -17.091 0.963 1.00 0.00 O ATOM 0 H GLY A 67 -1.391 -14.158 -0.373 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -2.404 -16.072 -1.797 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.387 -17.080 -0.786 1.00 0.00 H new ATOM 1050 N VAL A 68 -3.632 -14.941 0.471 1.00 0.00 N ATOM 1051 CA VAL A 68 -4.613 -14.742 1.537 1.00 0.00 C ATOM 1052 C VAL A 68 -5.701 -13.781 1.046 1.00 0.00 C ATOM 1053 O VAL A 68 -5.397 -12.799 0.365 1.00 0.00 O ATOM 1054 CB VAL A 68 -3.915 -14.220 2.814 1.00 0.00 C ATOM 1055 CG1 VAL A 68 -4.873 -14.000 3.996 1.00 0.00 C ATOM 1056 CG2 VAL A 68 -2.858 -15.211 3.313 1.00 0.00 C ATOM 0 H VAL A 68 -3.496 -14.117 -0.115 1.00 0.00 H new ATOM 0 HA VAL A 68 -5.085 -15.691 1.793 1.00 0.00 H new ATOM 0 HB VAL A 68 -3.479 -13.268 2.510 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -4.312 -13.634 4.856 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -5.631 -13.268 3.718 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -5.356 -14.943 4.253 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -2.385 -14.816 4.212 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -3.333 -16.165 3.542 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -2.103 -15.358 2.540 1.00 0.00 H new ATOM 1066 N GLU A 69 -6.955 -14.070 1.414 1.00 0.00 N ATOM 1067 CA GLU A 69 -8.098 -13.175 1.301 1.00 0.00 C ATOM 1068 C GLU A 69 -8.403 -12.669 2.711 1.00 0.00 C ATOM 1069 O GLU A 69 -8.440 -13.478 3.640 1.00 0.00 O ATOM 1070 CB GLU A 69 -9.288 -13.943 0.699 1.00 0.00 C ATOM 1071 CG GLU A 69 -10.473 -13.024 0.360 1.00 0.00 C ATOM 1072 CD GLU A 69 -11.617 -13.087 1.359 1.00 0.00 C ATOM 1073 OE1 GLU A 69 -11.387 -12.814 2.557 1.00 0.00 O ATOM 1074 OE2 GLU A 69 -12.782 -13.250 0.930 1.00 0.00 O ATOM 0 H GLU A 69 -7.205 -14.974 1.815 1.00 0.00 H new ATOM 0 HA GLU A 69 -7.895 -12.330 0.644 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -8.963 -14.459 -0.204 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -9.616 -14.708 1.403 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -10.115 -11.996 0.299 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -10.853 -13.289 -0.627 1.00 0.00 H new ATOM 1081 N PHE A 70 -8.537 -11.353 2.896 1.00 0.00 N ATOM 1082 CA PHE A 70 -8.824 -10.764 4.198 1.00 0.00 C ATOM 1083 C PHE A 70 -9.318 -9.326 4.010 1.00 0.00 C ATOM 1084 O PHE A 70 -9.226 -8.797 2.902 1.00 0.00 O ATOM 1085 CB PHE A 70 -7.580 -10.832 5.104 1.00 0.00 C ATOM 1086 CG PHE A 70 -6.384 -10.021 4.635 1.00 0.00 C ATOM 1087 CD1 PHE A 70 -5.629 -10.431 3.519 1.00 0.00 C ATOM 1088 CD2 PHE A 70 -6.016 -8.854 5.331 1.00 0.00 C ATOM 1089 CE1 PHE A 70 -4.537 -9.665 3.083 1.00 0.00 C ATOM 1090 CE2 PHE A 70 -4.935 -8.080 4.885 1.00 0.00 C ATOM 1091 CZ PHE A 70 -4.215 -8.470 3.746 1.00 0.00 C ATOM 0 H PHE A 70 -8.449 -10.669 2.144 1.00 0.00 H new ATOM 0 HA PHE A 70 -9.613 -11.331 4.693 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -7.859 -10.492 6.101 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -7.276 -11.875 5.197 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -5.892 -11.339 2.996 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -6.567 -8.554 6.210 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -3.946 -9.993 2.241 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -4.657 -7.183 5.419 1.00 0.00 H new ATOM 0 HZ PHE A 70 -3.411 -7.850 3.378 1.00 0.00 H new ATOM 1101 N ASP A 71 -9.854 -8.706 5.071 1.00 0.00 N ATOM 1102 CA ASP A 71 -10.291 -7.312 5.049 1.00 0.00 C ATOM 1103 C ASP A 71 -9.090 -6.378 5.202 1.00 0.00 C ATOM 1104 O ASP A 71 -8.215 -6.608 6.036 1.00 0.00 O ATOM 1105 CB ASP A 71 -11.334 -7.031 6.139 1.00 0.00 C ATOM 1106 CG ASP A 71 -11.858 -5.598 6.039 1.00 0.00 C ATOM 1107 OD1 ASP A 71 -11.152 -4.686 6.524 1.00 0.00 O ATOM 1108 OD2 ASP A 71 -12.959 -5.432 5.470 1.00 0.00 O ATOM 0 H ASP A 71 -9.995 -9.164 5.971 1.00 0.00 H new ATOM 0 HA ASP A 71 -10.764 -7.125 4.085 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -12.163 -7.733 6.044 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -10.891 -7.192 7.122 1.00 0.00 H new ATOM 1113 N GLU A 72 -9.079 -5.330 4.386 1.00 0.00 N ATOM 1114 CA GLU A 72 -8.131 -4.241 4.363 1.00 0.00 C ATOM 1115 C GLU A 72 -8.956 -2.956 4.482 1.00 0.00 C ATOM 1116 O GLU A 72 -9.415 -2.388 3.493 1.00 0.00 O ATOM 1117 CB GLU A 72 -7.306 -4.364 3.074 1.00 0.00 C ATOM 1118 CG GLU A 72 -6.347 -3.205 2.778 1.00 0.00 C ATOM 1119 CD GLU A 72 -5.445 -3.538 1.598 1.00 0.00 C ATOM 1120 OE1 GLU A 72 -5.990 -3.989 0.567 1.00 0.00 O ATOM 1121 OE2 GLU A 72 -4.211 -3.407 1.725 1.00 0.00 O ATOM 0 H GLU A 72 -9.795 -5.219 3.668 1.00 0.00 H new ATOM 0 HA GLU A 72 -7.410 -4.246 5.181 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.726 -5.286 3.123 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -7.993 -4.464 2.234 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -6.917 -2.301 2.562 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -5.739 -2.996 3.658 1.00 0.00 H new ATOM 1128 N THR A 73 -9.169 -2.513 5.721 1.00 0.00 N ATOM 1129 CA THR A 73 -9.736 -1.209 6.017 1.00 0.00 C ATOM 1130 C THR A 73 -8.597 -0.192 6.050 1.00 0.00 C ATOM 1131 O THR A 73 -7.765 -0.243 6.953 1.00 0.00 O ATOM 1132 CB THR A 73 -10.535 -1.275 7.326 1.00 0.00 C ATOM 1133 OG1 THR A 73 -11.621 -2.166 7.179 1.00 0.00 O ATOM 1134 CG2 THR A 73 -11.133 0.086 7.686 1.00 0.00 C ATOM 0 H THR A 73 -8.948 -3.060 6.553 1.00 0.00 H new ATOM 0 HA THR A 73 -10.442 -0.894 5.248 1.00 0.00 H new ATOM 0 HB THR A 73 -9.845 -1.601 8.104 1.00 0.00 H new ATOM 0 HG1 THR A 73 -11.283 -3.082 7.093 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.692 0.003 8.618 1.00 0.00 H new ATOM 0 HG22 THR A 73 -10.332 0.815 7.807 1.00 0.00 H new ATOM 0 HG23 THR A 73 -11.802 0.412 6.890 1.00 0.00 H new ATOM 1142 N THR A 74 -8.545 0.711 5.067 1.00 0.00 N ATOM 1143 CA THR A 74 -7.452 1.658 4.906 1.00 0.00 C ATOM 1144 C THR A 74 -7.973 3.010 4.405 1.00 0.00 C ATOM 1145 O THR A 74 -9.091 3.115 3.903 1.00 0.00 O ATOM 1146 CB THR A 74 -6.384 1.046 3.990 1.00 0.00 C ATOM 1147 OG1 THR A 74 -5.312 1.952 3.835 1.00 0.00 O ATOM 1148 CG2 THR A 74 -6.963 0.626 2.635 1.00 0.00 C ATOM 0 H THR A 74 -9.271 0.801 4.356 1.00 0.00 H new ATOM 0 HA THR A 74 -6.984 1.857 5.870 1.00 0.00 H new ATOM 0 HB THR A 74 -6.011 0.137 4.461 1.00 0.00 H new ATOM 0 HG1 THR A 74 -5.493 2.546 3.077 1.00 0.00 H new ATOM 0 HG21 THR A 74 -6.173 0.198 2.018 1.00 0.00 H new ATOM 0 HG22 THR A 74 -7.746 -0.117 2.788 1.00 0.00 H new ATOM 0 HG23 THR A 74 -7.383 1.498 2.133 1.00 0.00 H new ATOM 1156 N ALA A 75 -7.175 4.065 4.583 1.00 0.00 N ATOM 1157 CA ALA A 75 -7.607 5.447 4.400 1.00 0.00 C ATOM 1158 C ALA A 75 -7.485 5.929 2.951 1.00 0.00 C ATOM 1159 O ALA A 75 -7.983 7.007 2.624 1.00 0.00 O ATOM 1160 CB ALA A 75 -6.836 6.355 5.363 1.00 0.00 C ATOM 0 H ALA A 75 -6.198 3.979 4.862 1.00 0.00 H new ATOM 0 HA ALA A 75 -8.671 5.495 4.632 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -7.158 7.387 5.227 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -7.032 6.046 6.390 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -5.768 6.278 5.159 1.00 0.00 H new ATOM 1166 N ASP A 76 -6.819 5.155 2.093 1.00 0.00 N ATOM 1167 CA ASP A 76 -6.729 5.363 0.659 1.00 0.00 C ATOM 1168 C ASP A 76 -7.846 4.571 -0.021 1.00 0.00 C ATOM 1169 O ASP A 76 -8.677 5.156 -0.724 1.00 0.00 O ATOM 1170 CB ASP A 76 -5.327 4.960 0.158 1.00 0.00 C ATOM 1171 CG ASP A 76 -4.869 3.555 0.534 1.00 0.00 C ATOM 1172 OD1 ASP A 76 -5.516 2.967 1.433 1.00 0.00 O ATOM 1173 OD2 ASP A 76 -3.886 3.098 -0.081 1.00 0.00 O ATOM 0 H ASP A 76 -6.306 4.329 2.400 1.00 0.00 H new ATOM 0 HA ASP A 76 -6.862 6.416 0.410 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -5.310 5.049 -0.928 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -4.603 5.675 0.548 1.00 0.00 H new ATOM 1178 N ASP A 77 -7.882 3.249 0.196 1.00 0.00 N ATOM 1179 CA ASP A 77 -8.816 2.353 -0.482 1.00 0.00 C ATOM 1180 C ASP A 77 -10.083 1.983 0.296 1.00 0.00 C ATOM 1181 O ASP A 77 -10.883 1.176 -0.178 1.00 0.00 O ATOM 1182 CB ASP A 77 -8.123 1.215 -1.257 1.00 0.00 C ATOM 1183 CG ASP A 77 -8.285 1.283 -2.785 1.00 0.00 C ATOM 1184 OD1 ASP A 77 -9.130 2.066 -3.292 1.00 0.00 O ATOM 1185 OD2 ASP A 77 -7.559 0.521 -3.454 1.00 0.00 O ATOM 0 H ASP A 77 -7.260 2.774 0.850 1.00 0.00 H new ATOM 0 HA ASP A 77 -9.255 2.967 -1.268 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -7.060 1.226 -1.018 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.519 0.262 -0.906 1.00 0.00 H new ATOM 1190 N ARG A 78 -10.337 2.667 1.418 1.00 0.00 N ATOM 1191 CA ARG A 78 -11.563 2.555 2.204 1.00 0.00 C ATOM 1192 C ARG A 78 -11.634 1.152 2.832 1.00 0.00 C ATOM 1193 O ARG A 78 -10.595 0.538 3.069 1.00 0.00 O ATOM 1194 CB ARG A 78 -12.816 2.970 1.396 1.00 0.00 C ATOM 1195 CG ARG A 78 -12.847 4.442 0.929 1.00 0.00 C ATOM 1196 CD ARG A 78 -12.023 4.782 -0.323 1.00 0.00 C ATOM 1197 NE ARG A 78 -12.359 3.905 -1.457 1.00 0.00 N ATOM 1198 CZ ARG A 78 -11.509 3.566 -2.439 1.00 0.00 C ATOM 1199 NH1 ARG A 78 -10.411 4.282 -2.698 1.00 0.00 N ATOM 1200 NH2 ARG A 78 -11.691 2.432 -3.118 1.00 0.00 N ATOM 0 H ARG A 78 -9.672 3.333 1.813 1.00 0.00 H new ATOM 0 HA ARG A 78 -11.542 3.270 3.026 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -12.891 2.327 0.519 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -13.699 2.782 2.006 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -13.884 4.718 0.740 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -12.495 5.068 1.749 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -12.200 5.821 -0.603 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -10.961 4.689 -0.095 1.00 0.00 H new ATOM 0 HE ARG A 78 -13.306 3.528 -1.499 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -10.200 5.111 -2.143 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -9.784 3.999 -3.451 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -12.476 1.822 -2.891 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -11.045 2.175 -3.864 1.00 0.00 H new ATOM 1214 N LYS A 79 -12.835 0.642 3.136 1.00 0.00 N ATOM 1215 CA LYS A 79 -13.007 -0.744 3.545 1.00 0.00 C ATOM 1216 C LYS A 79 -13.085 -1.596 2.288 1.00 0.00 C ATOM 1217 O LYS A 79 -14.037 -1.462 1.519 1.00 0.00 O ATOM 1218 CB LYS A 79 -14.248 -0.916 4.428 1.00 0.00 C ATOM 1219 CG LYS A 79 -14.327 -2.366 4.940 1.00 0.00 C ATOM 1220 CD LYS A 79 -15.383 -2.552 6.033 1.00 0.00 C ATOM 1221 CE LYS A 79 -16.806 -2.400 5.475 1.00 0.00 C ATOM 1222 NZ LYS A 79 -17.827 -2.571 6.527 1.00 0.00 N ATOM 0 H LYS A 79 -13.702 1.178 3.104 1.00 0.00 H new ATOM 0 HA LYS A 79 -12.160 -1.063 4.152 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -14.205 -0.225 5.270 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -15.146 -0.672 3.861 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -14.554 -3.029 4.105 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -13.353 -2.663 5.328 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -15.272 -3.538 6.484 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -15.222 -1.820 6.824 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -16.915 -1.416 5.019 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -16.968 -3.136 4.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -18.774 -2.461 6.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -17.739 -3.519 6.945 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -17.688 -1.853 7.266 1.00 0.00 H new ATOM 1236 N VAL A 80 -12.095 -2.460 2.081 1.00 0.00 N ATOM 1237 CA VAL A 80 -12.010 -3.295 0.902 1.00 0.00 C ATOM 1238 C VAL A 80 -11.466 -4.658 1.320 1.00 0.00 C ATOM 1239 O VAL A 80 -10.775 -4.741 2.328 1.00 0.00 O ATOM 1240 CB VAL A 80 -11.116 -2.566 -0.113 1.00 0.00 C ATOM 1241 CG1 VAL A 80 -9.716 -2.237 0.419 1.00 0.00 C ATOM 1242 CG2 VAL A 80 -11.017 -3.366 -1.403 1.00 0.00 C ATOM 0 H VAL A 80 -11.326 -2.596 2.737 1.00 0.00 H new ATOM 0 HA VAL A 80 -12.978 -3.469 0.431 1.00 0.00 H new ATOM 0 HB VAL A 80 -11.599 -1.608 -0.307 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -9.144 -1.723 -0.354 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -9.801 -1.594 1.295 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -9.206 -3.160 0.695 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -10.380 -2.836 -2.112 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -10.588 -4.346 -1.192 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -12.012 -3.490 -1.831 1.00 0.00 H new ATOM 1252 N LYS A 81 -11.755 -5.729 0.575 1.00 0.00 N ATOM 1253 CA LYS A 81 -11.049 -6.985 0.761 1.00 0.00 C ATOM 1254 C LYS A 81 -9.769 -7.001 -0.073 1.00 0.00 C ATOM 1255 O LYS A 81 -9.789 -6.781 -1.287 1.00 0.00 O ATOM 1256 CB LYS A 81 -11.926 -8.200 0.448 1.00 0.00 C ATOM 1257 CG LYS A 81 -12.876 -8.534 1.608 1.00 0.00 C ATOM 1258 CD LYS A 81 -13.245 -10.019 1.522 1.00 0.00 C ATOM 1259 CE LYS A 81 -14.010 -10.529 2.751 1.00 0.00 C ATOM 1260 NZ LYS A 81 -13.813 -11.985 2.917 1.00 0.00 N ATOM 0 H LYS A 81 -12.468 -5.745 -0.155 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.784 -7.057 1.816 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -12.508 -8.006 -0.453 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -11.292 -9.061 0.238 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -12.398 -8.317 2.563 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -13.773 -7.917 1.553 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -13.851 -10.184 0.631 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -12.334 -10.606 1.401 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -13.666 -10.006 3.643 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -15.072 -10.310 2.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -14.542 -12.364 3.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -13.886 -12.453 1.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -12.872 -12.164 3.323 1.00 0.00 H new ATOM 1274 N SER A 82 -8.664 -7.296 0.605 1.00 0.00 N ATOM 1275 CA SER A 82 -7.375 -7.617 0.040 1.00 0.00 C ATOM 1276 C SER A 82 -7.380 -9.100 -0.308 1.00 0.00 C ATOM 1277 O SER A 82 -7.455 -9.933 0.597 1.00 0.00 O ATOM 1278 CB SER A 82 -6.323 -7.332 1.114 1.00 0.00 C ATOM 1279 OG SER A 82 -6.859 -7.597 2.395 1.00 0.00 O ATOM 0 H SER A 82 -8.653 -7.316 1.625 1.00 0.00 H new ATOM 0 HA SER A 82 -7.159 -7.033 -0.854 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.441 -7.950 0.944 1.00 0.00 H new ATOM 0 HB3 SER A 82 -6.001 -6.293 1.053 1.00 0.00 H new ATOM 0 HG SER A 82 -6.185 -8.049 2.944 1.00 0.00 H new ATOM 1285 N ILE A 83 -7.293 -9.418 -1.600 1.00 0.00 N ATOM 1286 CA ILE A 83 -7.169 -10.767 -2.124 1.00 0.00 C ATOM 1287 C ILE A 83 -5.777 -10.843 -2.749 1.00 0.00 C ATOM 1288 O ILE A 83 -5.584 -10.395 -3.879 1.00 0.00 O ATOM 1289 CB ILE A 83 -8.292 -11.042 -3.144 1.00 0.00 C ATOM 1290 CG1 ILE A 83 -9.670 -10.656 -2.576 1.00 0.00 C ATOM 1291 CG2 ILE A 83 -8.244 -12.518 -3.565 1.00 0.00 C ATOM 1292 CD1 ILE A 83 -10.835 -10.992 -3.510 1.00 0.00 C ATOM 0 H ILE A 83 -7.308 -8.710 -2.334 1.00 0.00 H new ATOM 0 HA ILE A 83 -7.275 -11.529 -1.352 1.00 0.00 H new ATOM 0 HB ILE A 83 -8.134 -10.421 -4.026 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.818 -11.169 -1.625 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -9.680 -9.586 -2.366 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.037 -12.717 -4.286 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -7.277 -12.736 -4.019 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -8.384 -13.151 -2.689 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -11.773 -10.692 -3.044 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -10.711 -10.459 -4.452 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -10.851 -12.065 -3.700 1.00 0.00 H new ATOM 1304 N VAL A 84 -4.783 -11.325 -1.996 1.00 0.00 N ATOM 1305 CA VAL A 84 -3.382 -11.167 -2.367 1.00 0.00 C ATOM 1306 C VAL A 84 -2.722 -12.519 -2.615 1.00 0.00 C ATOM 1307 O VAL A 84 -2.991 -13.482 -1.897 1.00 0.00 O ATOM 1308 CB VAL A 84 -2.637 -10.329 -1.320 1.00 0.00 C ATOM 1309 CG1 VAL A 84 -1.303 -9.840 -1.894 1.00 0.00 C ATOM 1310 CG2 VAL A 84 -3.466 -9.123 -0.872 1.00 0.00 C ATOM 0 H VAL A 84 -4.929 -11.830 -1.122 1.00 0.00 H new ATOM 0 HA VAL A 84 -3.330 -10.621 -3.309 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.459 -10.965 -0.453 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.780 -9.246 -1.144 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.689 -10.698 -2.170 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -1.489 -9.228 -2.777 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -2.907 -8.553 -0.130 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -3.680 -8.489 -1.732 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -4.403 -9.468 -0.434 1.00 0.00 H new ATOM 1320 N THR A 85 -1.891 -12.604 -3.657 1.00 0.00 N ATOM 1321 CA THR A 85 -1.207 -13.803 -4.141 1.00 0.00 C ATOM 1322 C THR A 85 0.025 -13.319 -4.922 1.00 0.00 C ATOM 1323 O THR A 85 0.176 -12.110 -5.107 1.00 0.00 O ATOM 1324 CB THR A 85 -2.206 -14.624 -4.985 1.00 0.00 C ATOM 1325 OG1 THR A 85 -3.202 -15.165 -4.138 1.00 0.00 O ATOM 1326 CG2 THR A 85 -1.608 -15.813 -5.742 1.00 0.00 C ATOM 0 H THR A 85 -1.664 -11.784 -4.220 1.00 0.00 H new ATOM 0 HA THR A 85 -0.863 -14.465 -3.346 1.00 0.00 H new ATOM 0 HB THR A 85 -2.583 -13.914 -5.721 1.00 0.00 H new ATOM 0 HG1 THR A 85 -3.838 -15.685 -4.672 1.00 0.00 H new ATOM 0 HG21 THR A 85 -2.394 -16.320 -6.302 1.00 0.00 H new ATOM 0 HG22 THR A 85 -0.843 -15.457 -6.432 1.00 0.00 H new ATOM 0 HG23 THR A 85 -1.161 -16.509 -5.032 1.00 0.00 H new ATOM 1334 N LEU A 86 0.914 -14.212 -5.374 1.00 0.00 N ATOM 1335 CA LEU A 86 1.860 -13.894 -6.433 1.00 0.00 C ATOM 1336 C LEU A 86 1.824 -14.959 -7.522 1.00 0.00 C ATOM 1337 O LEU A 86 1.774 -16.153 -7.227 1.00 0.00 O ATOM 1338 CB LEU A 86 3.260 -13.574 -5.875 1.00 0.00 C ATOM 1339 CG LEU A 86 4.111 -14.722 -5.305 1.00 0.00 C ATOM 1340 CD1 LEU A 86 4.893 -15.479 -6.385 1.00 0.00 C ATOM 1341 CD2 LEU A 86 5.167 -14.111 -4.374 1.00 0.00 C ATOM 0 H LEU A 86 0.992 -15.164 -5.016 1.00 0.00 H new ATOM 0 HA LEU A 86 1.554 -12.969 -6.922 1.00 0.00 H new ATOM 0 HB2 LEU A 86 3.834 -13.103 -6.673 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.139 -12.830 -5.087 1.00 0.00 H new ATOM 0 HG LEU A 86 3.428 -15.411 -4.809 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.474 -16.277 -5.922 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.196 -15.909 -7.105 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.565 -14.791 -6.897 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.786 -14.905 -3.955 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.795 -13.421 -4.939 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.672 -13.572 -3.566 1.00 0.00 H new ATOM 1353 N ASP A 87 1.809 -14.519 -8.781 1.00 0.00 N ATOM 1354 CA ASP A 87 1.528 -15.376 -9.923 1.00 0.00 C ATOM 1355 C ASP A 87 2.844 -15.976 -10.397 1.00 0.00 C ATOM 1356 O ASP A 87 3.315 -15.683 -11.495 1.00 0.00 O ATOM 1357 CB ASP A 87 0.835 -14.579 -11.040 1.00 0.00 C ATOM 1358 CG ASP A 87 -0.547 -14.048 -10.680 1.00 0.00 C ATOM 1359 OD1 ASP A 87 -1.029 -14.356 -9.568 1.00 0.00 O ATOM 1360 OD2 ASP A 87 -1.089 -13.320 -11.538 1.00 0.00 O ATOM 0 H ASP A 87 1.994 -13.548 -9.034 1.00 0.00 H new ATOM 0 HA ASP A 87 0.846 -16.177 -9.638 1.00 0.00 H new ATOM 0 HB2 ASP A 87 1.472 -13.738 -11.317 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.747 -15.215 -11.921 1.00 0.00 H new ATOM 1365 N GLY A 88 3.495 -16.752 -9.531 1.00 0.00 N ATOM 1366 CA GLY A 88 4.782 -17.376 -9.817 1.00 0.00 C ATOM 1367 C GLY A 88 5.959 -16.389 -9.839 1.00 0.00 C ATOM 1368 O GLY A 88 7.060 -16.751 -9.429 1.00 0.00 O ATOM 0 H GLY A 88 3.137 -16.966 -8.600 1.00 0.00 H new ATOM 0 HA2 GLY A 88 4.978 -18.143 -9.068 1.00 0.00 H new ATOM 0 HA3 GLY A 88 4.724 -17.880 -10.782 1.00 0.00 H new ATOM 1372 N GLY A 89 5.750 -15.156 -10.313 1.00 0.00 N ATOM 1373 CA GLY A 89 6.788 -14.143 -10.418 1.00 0.00 C ATOM 1374 C GLY A 89 6.160 -12.784 -10.717 1.00 0.00 C ATOM 1375 O GLY A 89 6.420 -12.208 -11.771 1.00 0.00 O ATOM 0 H GLY A 89 4.838 -14.836 -10.638 1.00 0.00 H new ATOM 0 HA2 GLY A 89 7.356 -14.094 -9.489 1.00 0.00 H new ATOM 0 HA3 GLY A 89 7.490 -14.410 -11.207 1.00 0.00 H new ATOM 1379 N LYS A 90 5.292 -12.331 -9.804 1.00 0.00 N ATOM 1380 CA LYS A 90 4.702 -10.995 -9.726 1.00 0.00 C ATOM 1381 C LYS A 90 3.626 -11.021 -8.652 1.00 0.00 C ATOM 1382 O LYS A 90 2.747 -11.880 -8.724 1.00 0.00 O ATOM 1383 CB LYS A 90 4.134 -10.494 -11.067 1.00 0.00 C ATOM 1384 CG LYS A 90 3.135 -11.463 -11.718 1.00 0.00 C ATOM 1385 CD LYS A 90 3.110 -11.299 -13.241 1.00 0.00 C ATOM 1386 CE LYS A 90 2.721 -9.875 -13.662 1.00 0.00 C ATOM 1387 NZ LYS A 90 2.756 -9.713 -15.128 1.00 0.00 N ATOM 0 H LYS A 90 4.963 -12.933 -9.049 1.00 0.00 H new ATOM 0 HA LYS A 90 5.490 -10.286 -9.471 1.00 0.00 H new ATOM 0 HB2 LYS A 90 3.643 -9.534 -10.907 1.00 0.00 H new ATOM 0 HB3 LYS A 90 4.959 -10.319 -11.758 1.00 0.00 H new ATOM 0 HG2 LYS A 90 3.403 -12.489 -11.465 1.00 0.00 H new ATOM 0 HG3 LYS A 90 2.138 -11.286 -11.315 1.00 0.00 H new ATOM 0 HD2 LYS A 90 4.092 -11.541 -13.647 1.00 0.00 H new ATOM 0 HD3 LYS A 90 2.403 -12.009 -13.670 1.00 0.00 H new ATOM 0 HE2 LYS A 90 1.721 -9.647 -13.294 1.00 0.00 H new ATOM 0 HE3 LYS A 90 3.402 -9.160 -13.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 2.488 -8.739 -15.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 3.717 -9.907 -15.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 2.088 -10.379 -15.567 1.00 0.00 H new ATOM 1401 N LEU A 91 3.690 -10.132 -7.651 1.00 0.00 N ATOM 1402 CA LEU A 91 2.692 -10.139 -6.589 1.00 0.00 C ATOM 1403 C LEU A 91 1.460 -9.355 -7.025 1.00 0.00 C ATOM 1404 O LEU A 91 1.571 -8.227 -7.511 1.00 0.00 O ATOM 1405 CB LEU A 91 3.255 -9.896 -5.174 1.00 0.00 C ATOM 1406 CG LEU A 91 3.425 -8.474 -4.624 1.00 0.00 C ATOM 1407 CD1 LEU A 91 4.309 -7.628 -5.529 1.00 0.00 C ATOM 1408 CD2 LEU A 91 2.101 -7.760 -4.324 1.00 0.00 C ATOM 0 H LEU A 91 4.410 -9.415 -7.560 1.00 0.00 H new ATOM 0 HA LEU A 91 2.329 -11.156 -6.443 1.00 0.00 H new ATOM 0 HB2 LEU A 91 2.611 -10.433 -4.478 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.234 -10.373 -5.134 1.00 0.00 H new ATOM 0 HG LEU A 91 3.924 -8.594 -3.662 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.408 -6.627 -5.109 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.294 -8.087 -5.608 1.00 0.00 H new ATOM 0 HD13 LEU A 91 3.859 -7.563 -6.520 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.305 -6.761 -3.939 1.00 0.00 H new ATOM 0 HD22 LEU A 91 1.514 -7.683 -5.239 1.00 0.00 H new ATOM 0 HD23 LEU A 91 1.542 -8.328 -3.580 1.00 0.00 H new ATOM 1420 N VAL A 92 0.296 -10.001 -6.917 1.00 0.00 N ATOM 1421 CA VAL A 92 -0.996 -9.482 -7.310 1.00 0.00 C ATOM 1422 C VAL A 92 -1.791 -9.254 -6.031 1.00 0.00 C ATOM 1423 O VAL A 92 -2.143 -10.202 -5.331 1.00 0.00 O ATOM 1424 CB VAL A 92 -1.692 -10.412 -8.329 1.00 0.00 C ATOM 1425 CG1 VAL A 92 -0.739 -10.745 -9.482 1.00 0.00 C ATOM 1426 CG2 VAL A 92 -2.235 -11.732 -7.760 1.00 0.00 C ATOM 0 H VAL A 92 0.237 -10.944 -6.534 1.00 0.00 H new ATOM 0 HA VAL A 92 -0.903 -8.533 -7.839 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.558 -9.840 -8.663 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -1.242 -11.401 -10.192 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -0.442 -9.825 -9.985 1.00 0.00 H new ATOM 0 HG13 VAL A 92 0.146 -11.246 -9.090 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -2.703 -12.307 -8.559 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.415 -12.308 -7.330 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.973 -11.519 -6.987 1.00 0.00 H new ATOM 1436 N HIS A 93 -2.027 -7.986 -5.691 1.00 0.00 N ATOM 1437 CA HIS A 93 -2.933 -7.598 -4.627 1.00 0.00 C ATOM 1438 C HIS A 93 -4.236 -7.222 -5.329 1.00 0.00 C ATOM 1439 O HIS A 93 -4.408 -6.079 -5.746 1.00 0.00 O ATOM 1440 CB HIS A 93 -2.265 -6.474 -3.814 1.00 0.00 C ATOM 1441 CG HIS A 93 -2.967 -6.019 -2.555 1.00 0.00 C ATOM 1442 ND1 HIS A 93 -2.397 -6.005 -1.291 1.00 0.00 N ATOM 1443 CD2 HIS A 93 -4.162 -5.353 -2.485 1.00 0.00 C ATOM 1444 CE1 HIS A 93 -3.237 -5.350 -0.470 1.00 0.00 C ATOM 1445 NE2 HIS A 93 -4.308 -4.941 -1.172 1.00 0.00 N ATOM 0 H HIS A 93 -1.585 -7.194 -6.158 1.00 0.00 H new ATOM 0 HA HIS A 93 -3.158 -8.376 -3.897 1.00 0.00 H new ATOM 0 HB2 HIS A 93 -1.263 -6.805 -3.541 1.00 0.00 H new ATOM 0 HB3 HIS A 93 -2.148 -5.609 -4.467 1.00 0.00 H new ATOM 0 HD2 HIS A 93 -4.855 -5.183 -3.296 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -3.077 -5.180 0.584 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -5.098 -4.414 -0.799 1.00 0.00 H new ATOM 1454 N VAL A 94 -5.126 -8.195 -5.533 1.00 0.00 N ATOM 1455 CA VAL A 94 -6.449 -7.916 -6.068 1.00 0.00 C ATOM 1456 C VAL A 94 -7.249 -7.275 -4.933 1.00 0.00 C ATOM 1457 O VAL A 94 -7.079 -7.629 -3.765 1.00 0.00 O ATOM 1458 CB VAL A 94 -7.091 -9.192 -6.639 1.00 0.00 C ATOM 1459 CG1 VAL A 94 -8.546 -8.929 -7.052 1.00 0.00 C ATOM 1460 CG2 VAL A 94 -6.318 -9.711 -7.857 1.00 0.00 C ATOM 0 H VAL A 94 -4.950 -9.180 -5.334 1.00 0.00 H new ATOM 0 HA VAL A 94 -6.414 -7.228 -6.912 1.00 0.00 H new ATOM 0 HB VAL A 94 -7.061 -9.945 -5.852 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.981 -9.844 -7.453 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -9.118 -8.606 -6.182 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.573 -8.150 -7.814 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -6.798 -10.613 -8.235 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -6.312 -8.949 -8.636 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -5.293 -9.940 -7.567 1.00 0.00 H new ATOM 1470 N GLN A 95 -8.038 -6.259 -5.273 1.00 0.00 N ATOM 1471 CA GLN A 95 -8.533 -5.272 -4.334 1.00 0.00 C ATOM 1472 C GLN A 95 -10.042 -5.144 -4.559 1.00 0.00 C ATOM 1473 O GLN A 95 -10.455 -4.440 -5.477 1.00 0.00 O ATOM 1474 CB GLN A 95 -7.745 -3.990 -4.656 1.00 0.00 C ATOM 1475 CG GLN A 95 -7.837 -2.858 -3.635 1.00 0.00 C ATOM 1476 CD GLN A 95 -7.093 -3.196 -2.348 1.00 0.00 C ATOM 1477 OE1 GLN A 95 -5.930 -2.843 -2.183 1.00 0.00 O ATOM 1478 NE2 GLN A 95 -7.711 -3.941 -1.440 1.00 0.00 N ATOM 0 H GLN A 95 -8.354 -6.101 -6.230 1.00 0.00 H new ATOM 0 HA GLN A 95 -8.395 -5.519 -3.281 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -6.695 -4.256 -4.776 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -8.090 -3.610 -5.618 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -7.424 -1.946 -4.065 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -8.884 -2.657 -3.408 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -8.678 -4.228 -1.589 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -7.219 -4.226 -0.594 1.00 0.00 H new ATOM 1487 N LYS A 96 -10.863 -5.876 -3.793 1.00 0.00 N ATOM 1488 CA LYS A 96 -12.289 -6.051 -4.075 1.00 0.00 C ATOM 1489 C LYS A 96 -13.147 -5.472 -2.959 1.00 0.00 C ATOM 1490 O LYS A 96 -13.113 -5.985 -1.845 1.00 0.00 O ATOM 1491 CB LYS A 96 -12.589 -7.545 -4.281 1.00 0.00 C ATOM 1492 CG LYS A 96 -14.067 -7.777 -4.640 1.00 0.00 C ATOM 1493 CD LYS A 96 -14.308 -9.240 -5.038 1.00 0.00 C ATOM 1494 CE LYS A 96 -15.784 -9.509 -5.378 1.00 0.00 C ATOM 1495 NZ LYS A 96 -16.175 -8.934 -6.683 1.00 0.00 N ATOM 0 H LYS A 96 -10.551 -6.366 -2.955 1.00 0.00 H new ATOM 0 HA LYS A 96 -12.537 -5.508 -4.987 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.954 -7.939 -5.075 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -12.343 -8.096 -3.373 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.697 -7.518 -3.789 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -14.354 -7.120 -5.461 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -13.687 -9.489 -5.898 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -13.999 -9.893 -4.222 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -15.961 -10.584 -5.390 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -16.417 -9.090 -4.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -17.204 -9.022 -6.807 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -15.907 -7.930 -6.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -15.690 -9.446 -7.447 1.00 0.00 H new ATOM 1509 N TRP A 97 -13.929 -4.424 -3.243 1.00 0.00 N ATOM 1510 CA TRP A 97 -14.813 -3.838 -2.241 1.00 0.00 C ATOM 1511 C TRP A 97 -16.204 -4.454 -2.343 1.00 0.00 C ATOM 1512 O TRP A 97 -16.695 -5.015 -1.366 1.00 0.00 O ATOM 1513 CB TRP A 97 -14.812 -2.303 -2.296 1.00 0.00 C ATOM 1514 CG TRP A 97 -14.581 -1.652 -3.623 1.00 0.00 C ATOM 1515 CD1 TRP A 97 -15.508 -1.459 -4.586 1.00 0.00 C ATOM 1516 CD2 TRP A 97 -13.346 -1.077 -4.145 1.00 0.00 C ATOM 1517 NE1 TRP A 97 -14.931 -0.812 -5.656 1.00 0.00 N ATOM 1518 CE2 TRP A 97 -13.595 -0.562 -5.446 1.00 0.00 C ATOM 1519 CE3 TRP A 97 -12.043 -0.917 -3.637 1.00 0.00 C ATOM 1520 CZ2 TRP A 97 -12.601 0.065 -6.212 1.00 0.00 C ATOM 1521 CZ3 TRP A 97 -11.014 -0.381 -4.428 1.00 0.00 C ATOM 1522 CH2 TRP A 97 -11.296 0.143 -5.698 1.00 0.00 C ATOM 0 H TRP A 97 -13.965 -3.969 -4.155 1.00 0.00 H new ATOM 0 HA TRP A 97 -14.429 -4.081 -1.250 1.00 0.00 H new ATOM 0 HB2 TRP A 97 -15.771 -1.954 -1.914 1.00 0.00 H new ATOM 0 HB3 TRP A 97 -14.046 -1.944 -1.609 1.00 0.00 H new ATOM 0 HD1 TRP A 97 -16.542 -1.765 -4.526 1.00 0.00 H new ATOM 0 HE1 TRP A 97 -15.434 -0.549 -6.503 1.00 0.00 H new ATOM 0 HE3 TRP A 97 -11.831 -1.212 -2.620 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 -12.835 0.481 -7.181 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 -10.000 -0.372 -4.056 1.00 0.00 H new ATOM 0 HH2 TRP A 97 -10.512 0.605 -6.279 1.00 0.00 H new ATOM 1533 N ASN A 98 -16.838 -4.379 -3.517 1.00 0.00 N ATOM 1534 CA ASN A 98 -18.192 -4.895 -3.693 1.00 0.00 C ATOM 1535 C ASN A 98 -18.576 -4.962 -5.170 1.00 0.00 C ATOM 1536 O ASN A 98 -18.399 -6.005 -5.795 1.00 0.00 O ATOM 1537 CB ASN A 98 -19.232 -4.157 -2.819 1.00 0.00 C ATOM 1538 CG ASN A 98 -19.234 -2.634 -2.959 1.00 0.00 C ATOM 1539 OD1 ASN A 98 -18.281 -1.960 -2.587 1.00 0.00 O ATOM 1540 ND2 ASN A 98 -20.293 -2.068 -3.531 1.00 0.00 N ATOM 0 H ASN A 98 -16.433 -3.966 -4.357 1.00 0.00 H new ATOM 0 HA ASN A 98 -18.197 -5.922 -3.326 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -20.225 -4.531 -3.070 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -19.051 -4.410 -1.774 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -20.320 -1.057 -3.666 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -21.078 -2.645 -3.835 1.00 0.00 H new ATOM 1547 N GLY A 99 -19.106 -3.872 -5.734 1.00 0.00 N ATOM 1548 CA GLY A 99 -19.639 -3.872 -7.086 1.00 0.00 C ATOM 1549 C GLY A 99 -18.532 -3.982 -8.125 1.00 0.00 C ATOM 1550 O GLY A 99 -18.783 -4.397 -9.252 1.00 0.00 O ATOM 0 H GLY A 99 -19.174 -2.971 -5.262 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -20.333 -4.704 -7.204 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -20.207 -2.957 -7.254 1.00 0.00 H new ATOM 1554 N GLN A 100 -17.319 -3.560 -7.759 1.00 0.00 N ATOM 1555 CA GLN A 100 -16.140 -3.714 -8.582 1.00 0.00 C ATOM 1556 C GLN A 100 -14.954 -4.060 -7.684 1.00 0.00 C ATOM 1557 O GLN A 100 -15.037 -3.975 -6.450 1.00 0.00 O ATOM 1558 CB GLN A 100 -15.842 -2.462 -9.437 1.00 0.00 C ATOM 1559 CG GLN A 100 -16.939 -1.388 -9.511 1.00 0.00 C ATOM 1560 CD GLN A 100 -16.950 -0.520 -8.259 1.00 0.00 C ATOM 1561 OE1 GLN A 100 -16.017 0.248 -8.040 1.00 0.00 O ATOM 1562 NE2 GLN A 100 -17.956 -0.646 -7.397 1.00 0.00 N ATOM 0 H GLN A 100 -17.137 -3.097 -6.869 1.00 0.00 H new ATOM 0 HA GLN A 100 -16.321 -4.523 -9.290 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -14.937 -1.995 -9.049 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -15.621 -2.791 -10.453 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -16.779 -0.762 -10.389 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -17.911 -1.866 -9.633 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -18.722 -1.289 -7.597 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -17.961 -0.099 -6.536 1.00 0.00 H new ATOM 1571 N GLU A 101 -13.851 -4.380 -8.357 1.00 0.00 N ATOM 1572 CA GLU A 101 -12.544 -4.667 -7.816 1.00 0.00 C ATOM 1573 C GLU A 101 -11.528 -3.930 -8.681 1.00 0.00 C ATOM 1574 O GLU A 101 -11.869 -3.443 -9.763 1.00 0.00 O ATOM 1575 CB GLU A 101 -12.262 -6.185 -7.812 1.00 0.00 C ATOM 1576 CG GLU A 101 -12.944 -6.995 -8.928 1.00 0.00 C ATOM 1577 CD GLU A 101 -14.228 -7.652 -8.438 1.00 0.00 C ATOM 1578 OE1 GLU A 101 -15.107 -6.952 -7.889 1.00 0.00 O ATOM 1579 OE2 GLU A 101 -14.322 -8.897 -8.487 1.00 0.00 O ATOM 0 H GLU A 101 -13.859 -4.448 -9.375 1.00 0.00 H new ATOM 0 HA GLU A 101 -12.482 -4.335 -6.780 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -11.185 -6.336 -7.886 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -12.576 -6.591 -6.850 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -13.168 -6.339 -9.770 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -12.259 -7.760 -9.294 1.00 0.00 H new ATOM 1586 N THR A 102 -10.286 -3.853 -8.205 1.00 0.00 N ATOM 1587 CA THR A 102 -9.163 -3.359 -8.978 1.00 0.00 C ATOM 1588 C THR A 102 -7.978 -4.301 -8.812 1.00 0.00 C ATOM 1589 O THR A 102 -7.892 -5.031 -7.821 1.00 0.00 O ATOM 1590 CB THR A 102 -8.827 -1.915 -8.577 1.00 0.00 C ATOM 1591 OG1 THR A 102 -8.318 -1.804 -7.267 1.00 0.00 O ATOM 1592 CG2 THR A 102 -10.085 -1.056 -8.631 1.00 0.00 C ATOM 0 H THR A 102 -10.035 -4.137 -7.258 1.00 0.00 H new ATOM 0 HA THR A 102 -9.424 -3.337 -10.036 1.00 0.00 H new ATOM 0 HB THR A 102 -8.065 -1.583 -9.282 1.00 0.00 H new ATOM 0 HG1 THR A 102 -8.122 -0.864 -7.071 1.00 0.00 H new ATOM 0 HG21 THR A 102 -9.840 -0.033 -8.345 1.00 0.00 H new ATOM 0 HG22 THR A 102 -10.487 -1.063 -9.644 1.00 0.00 H new ATOM 0 HG23 THR A 102 -10.829 -1.456 -7.942 1.00 0.00 H new ATOM 1600 N SER A 103 -7.054 -4.273 -9.770 1.00 0.00 N ATOM 1601 CA SER A 103 -5.770 -4.929 -9.629 1.00 0.00 C ATOM 1602 C SER A 103 -4.806 -3.942 -8.977 1.00 0.00 C ATOM 1603 O SER A 103 -4.786 -2.770 -9.349 1.00 0.00 O ATOM 1604 CB SER A 103 -5.264 -5.337 -11.016 1.00 0.00 C ATOM 1605 OG SER A 103 -5.281 -4.209 -11.869 1.00 0.00 O ATOM 0 H SER A 103 -7.180 -3.794 -10.662 1.00 0.00 H new ATOM 0 HA SER A 103 -5.851 -5.823 -9.011 1.00 0.00 H new ATOM 0 HB2 SER A 103 -4.253 -5.738 -10.944 1.00 0.00 H new ATOM 0 HB3 SER A 103 -5.892 -6.128 -11.427 1.00 0.00 H new ATOM 0 HG SER A 103 -4.812 -4.422 -12.702 1.00 0.00 H new ATOM 1611 N LEU A 104 -3.988 -4.410 -8.033 1.00 0.00 N ATOM 1612 CA LEU A 104 -2.765 -3.734 -7.639 1.00 0.00 C ATOM 1613 C LEU A 104 -1.637 -4.761 -7.792 1.00 0.00 C ATOM 1614 O LEU A 104 -1.296 -5.453 -6.831 1.00 0.00 O ATOM 1615 CB LEU A 104 -2.883 -3.191 -6.203 1.00 0.00 C ATOM 1616 CG LEU A 104 -4.014 -2.179 -5.949 1.00 0.00 C ATOM 1617 CD1 LEU A 104 -4.106 -1.873 -4.450 1.00 0.00 C ATOM 1618 CD2 LEU A 104 -3.784 -0.846 -6.671 1.00 0.00 C ATOM 0 H LEU A 104 -4.162 -5.275 -7.521 1.00 0.00 H new ATOM 0 HA LEU A 104 -2.561 -2.864 -8.263 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -3.021 -4.036 -5.528 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -1.937 -2.721 -5.936 1.00 0.00 H new ATOM 0 HG LEU A 104 -4.929 -2.635 -6.328 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -4.908 -1.156 -4.274 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -4.315 -2.793 -3.903 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -3.161 -1.453 -4.106 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.611 -0.169 -6.458 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -2.852 -0.400 -6.324 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -3.725 -1.020 -7.745 1.00 0.00 H new ATOM 1630 N VAL A 105 -1.094 -4.905 -9.008 1.00 0.00 N ATOM 1631 CA VAL A 105 -0.056 -5.889 -9.316 1.00 0.00 C ATOM 1632 C VAL A 105 1.295 -5.193 -9.483 1.00 0.00 C ATOM 1633 O VAL A 105 1.353 -4.061 -9.970 1.00 0.00 O ATOM 1634 CB VAL A 105 -0.451 -6.744 -10.538 1.00 0.00 C ATOM 1635 CG1 VAL A 105 -0.849 -5.889 -11.740 1.00 0.00 C ATOM 1636 CG2 VAL A 105 0.678 -7.683 -10.987 1.00 0.00 C ATOM 0 H VAL A 105 -1.367 -4.336 -9.809 1.00 0.00 H new ATOM 0 HA VAL A 105 0.043 -6.582 -8.481 1.00 0.00 H new ATOM 0 HB VAL A 105 -1.306 -7.331 -10.202 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -1.118 -6.537 -12.574 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -1.702 -5.264 -11.476 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -0.011 -5.255 -12.029 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.348 -8.262 -11.850 1.00 0.00 H new ATOM 0 HG22 VAL A 105 1.554 -7.094 -11.258 1.00 0.00 H new ATOM 0 HG23 VAL A 105 0.934 -8.360 -10.172 1.00 0.00 H new ATOM 1646 N ARG A 106 2.374 -5.856 -9.053 1.00 0.00 N ATOM 1647 CA ARG A 106 3.726 -5.334 -9.181 1.00 0.00 C ATOM 1648 C ARG A 106 4.755 -6.461 -9.303 1.00 0.00 C ATOM 1649 O ARG A 106 4.496 -7.589 -8.882 1.00 0.00 O ATOM 1650 CB ARG A 106 4.081 -4.375 -8.025 1.00 0.00 C ATOM 1651 CG ARG A 106 3.284 -4.519 -6.713 1.00 0.00 C ATOM 1652 CD ARG A 106 2.234 -3.414 -6.546 1.00 0.00 C ATOM 1653 NE ARG A 106 1.612 -3.464 -5.212 1.00 0.00 N ATOM 1654 CZ ARG A 106 0.741 -2.553 -4.744 1.00 0.00 C ATOM 1655 NH1 ARG A 106 0.330 -1.561 -5.540 1.00 0.00 N ATOM 1656 NH2 ARG A 106 0.290 -2.632 -3.487 1.00 0.00 N ATOM 0 H ARG A 106 2.327 -6.772 -8.606 1.00 0.00 H new ATOM 0 HA ARG A 106 3.759 -4.756 -10.105 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.138 -4.504 -7.793 1.00 0.00 H new ATOM 0 HB3 ARG A 106 3.956 -3.354 -8.384 1.00 0.00 H new ATOM 0 HG2 ARG A 106 2.791 -5.491 -6.695 1.00 0.00 H new ATOM 0 HG3 ARG A 106 3.972 -4.494 -5.868 1.00 0.00 H new ATOM 0 HD2 ARG A 106 2.701 -2.440 -6.696 1.00 0.00 H new ATOM 0 HD3 ARG A 106 1.466 -3.521 -7.312 1.00 0.00 H new ATOM 0 HE ARG A 106 1.859 -4.243 -4.601 1.00 0.00 H new ATOM 0 HH11 ARG A 106 0.677 -1.498 -6.497 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -0.331 -0.867 -5.190 1.00 0.00 H new ATOM 0 HH21 ARG A 106 0.607 -3.386 -2.878 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -0.371 -1.938 -3.138 1.00 0.00 H new ATOM 1670 N GLU A 107 5.924 -6.131 -9.869 1.00 0.00 N ATOM 1671 CA GLU A 107 7.120 -6.967 -9.855 1.00 0.00 C ATOM 1672 C GLU A 107 8.326 -6.122 -10.259 1.00 0.00 C ATOM 1673 O GLU A 107 8.149 -5.138 -10.982 1.00 0.00 O ATOM 1674 CB GLU A 107 6.967 -8.158 -10.814 1.00 0.00 C ATOM 1675 CG GLU A 107 8.094 -9.202 -10.709 1.00 0.00 C ATOM 1676 CD GLU A 107 8.388 -9.639 -9.276 1.00 0.00 C ATOM 1677 OE1 GLU A 107 9.130 -8.883 -8.613 1.00 0.00 O ATOM 1678 OE2 GLU A 107 7.845 -10.683 -8.859 1.00 0.00 O ATOM 0 H GLU A 107 6.062 -5.249 -10.362 1.00 0.00 H new ATOM 0 HA GLU A 107 7.265 -7.360 -8.849 1.00 0.00 H new ATOM 0 HB2 GLU A 107 6.014 -8.648 -10.617 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.928 -7.784 -11.837 1.00 0.00 H new ATOM 0 HG2 GLU A 107 7.823 -10.078 -11.299 1.00 0.00 H new ATOM 0 HG3 GLU A 107 9.002 -8.790 -11.148 1.00 0.00 H new ATOM 1685 N MET A 108 9.527 -6.508 -9.811 1.00 0.00 N ATOM 1686 CA MET A 108 10.799 -5.953 -10.242 1.00 0.00 C ATOM 1687 C MET A 108 11.611 -7.019 -10.967 1.00 0.00 C ATOM 1688 O MET A 108 11.960 -8.046 -10.392 1.00 0.00 O ATOM 1689 CB MET A 108 11.600 -5.416 -9.047 1.00 0.00 C ATOM 1690 CG MET A 108 12.864 -4.654 -9.483 1.00 0.00 C ATOM 1691 SD MET A 108 14.353 -4.950 -8.494 1.00 0.00 S ATOM 1692 CE MET A 108 14.733 -6.662 -8.947 1.00 0.00 C ATOM 0 H MET A 108 9.635 -7.243 -9.112 1.00 0.00 H new ATOM 0 HA MET A 108 10.596 -5.124 -10.920 1.00 0.00 H new ATOM 0 HB2 MET A 108 10.966 -4.755 -8.456 1.00 0.00 H new ATOM 0 HB3 MET A 108 11.884 -6.247 -8.401 1.00 0.00 H new ATOM 0 HG2 MET A 108 13.082 -4.915 -10.518 1.00 0.00 H new ATOM 0 HG3 MET A 108 12.645 -3.586 -9.463 1.00 0.00 H new ATOM 0 HE1 MET A 108 15.693 -6.948 -8.516 1.00 0.00 H new ATOM 0 HE2 MET A 108 13.953 -7.321 -8.565 1.00 0.00 H new ATOM 0 HE3 MET A 108 14.782 -6.749 -10.032 1.00 0.00 H new ATOM 1702 N VAL A 109 12.014 -6.697 -12.192 1.00 0.00 N ATOM 1703 CA VAL A 109 13.141 -7.314 -12.868 1.00 0.00 C ATOM 1704 C VAL A 109 13.993 -6.155 -13.377 1.00 0.00 C ATOM 1705 O VAL A 109 13.636 -5.000 -13.132 1.00 0.00 O ATOM 1706 CB VAL A 109 12.667 -8.278 -13.969 1.00 0.00 C ATOM 1707 CG1 VAL A 109 11.925 -9.470 -13.352 1.00 0.00 C ATOM 1708 CG2 VAL A 109 11.774 -7.587 -15.006 1.00 0.00 C ATOM 0 H VAL A 109 11.552 -5.981 -12.753 1.00 0.00 H new ATOM 0 HA VAL A 109 13.736 -7.945 -12.208 1.00 0.00 H new ATOM 0 HB VAL A 109 13.558 -8.631 -14.488 1.00 0.00 H new ATOM 0 HG11 VAL A 109 11.596 -10.143 -14.144 1.00 0.00 H new ATOM 0 HG12 VAL A 109 12.593 -10.004 -12.676 1.00 0.00 H new ATOM 0 HG13 VAL A 109 11.058 -9.111 -12.797 1.00 0.00 H new ATOM 0 HG21 VAL A 109 11.466 -8.310 -15.761 1.00 0.00 H new ATOM 0 HG22 VAL A 109 10.891 -7.180 -14.513 1.00 0.00 H new ATOM 0 HG23 VAL A 109 12.328 -6.779 -15.483 1.00 0.00 H new ATOM 1718 N ASP A 110 15.119 -6.447 -14.034 1.00 0.00 N ATOM 1719 CA ASP A 110 16.077 -5.422 -14.422 1.00 0.00 C ATOM 1720 C ASP A 110 16.437 -4.606 -13.167 1.00 0.00 C ATOM 1721 O ASP A 110 16.997 -5.168 -12.226 1.00 0.00 O ATOM 1722 CB ASP A 110 15.507 -4.631 -15.614 1.00 0.00 C ATOM 1723 CG ASP A 110 16.370 -3.445 -16.006 1.00 0.00 C ATOM 1724 OD1 ASP A 110 17.392 -3.671 -16.683 1.00 0.00 O ATOM 1725 OD2 ASP A 110 15.988 -2.337 -15.566 1.00 0.00 O ATOM 0 H ASP A 110 15.386 -7.393 -14.307 1.00 0.00 H new ATOM 0 HA ASP A 110 17.021 -5.826 -14.788 1.00 0.00 H new ATOM 0 HB2 ASP A 110 15.405 -5.298 -16.470 1.00 0.00 H new ATOM 0 HB3 ASP A 110 14.506 -4.278 -15.364 1.00 0.00 H new ATOM 1730 N GLY A 111 16.055 -3.332 -13.095 1.00 0.00 N ATOM 1731 CA GLY A 111 16.284 -2.468 -11.951 1.00 0.00 C ATOM 1732 C GLY A 111 15.141 -1.472 -11.781 1.00 0.00 C ATOM 1733 O GLY A 111 15.355 -0.381 -11.258 1.00 0.00 O ATOM 0 H GLY A 111 15.564 -2.864 -13.856 1.00 0.00 H new ATOM 0 HA2 GLY A 111 16.382 -3.072 -11.049 1.00 0.00 H new ATOM 0 HA3 GLY A 111 17.224 -1.930 -12.079 1.00 0.00 H new ATOM 1737 N LYS A 112 13.921 -1.844 -12.182 1.00 0.00 N ATOM 1738 CA LYS A 112 12.724 -1.042 -11.967 1.00 0.00 C ATOM 1739 C LYS A 112 11.576 -1.983 -11.628 1.00 0.00 C ATOM 1740 O LYS A 112 11.645 -3.174 -11.926 1.00 0.00 O ATOM 1741 CB LYS A 112 12.401 -0.177 -13.192 1.00 0.00 C ATOM 1742 CG LYS A 112 13.426 0.948 -13.388 1.00 0.00 C ATOM 1743 CD LYS A 112 12.936 1.900 -14.489 1.00 0.00 C ATOM 1744 CE LYS A 112 13.922 3.041 -14.777 1.00 0.00 C ATOM 1745 NZ LYS A 112 14.065 3.975 -13.642 1.00 0.00 N ATOM 0 H LYS A 112 13.741 -2.721 -12.670 1.00 0.00 H new ATOM 0 HA LYS A 112 12.887 -0.351 -11.140 1.00 0.00 H new ATOM 0 HB2 LYS A 112 12.377 -0.805 -14.083 1.00 0.00 H new ATOM 0 HB3 LYS A 112 11.406 0.254 -13.079 1.00 0.00 H new ATOM 0 HG2 LYS A 112 13.565 1.494 -12.455 1.00 0.00 H new ATOM 0 HG3 LYS A 112 14.395 0.529 -13.659 1.00 0.00 H new ATOM 0 HD2 LYS A 112 12.768 1.332 -15.404 1.00 0.00 H new ATOM 0 HD3 LYS A 112 11.975 2.323 -14.195 1.00 0.00 H new ATOM 0 HE2 LYS A 112 14.897 2.619 -15.020 1.00 0.00 H new ATOM 0 HE3 LYS A 112 13.586 3.592 -15.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 14.154 4.947 -14.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 13.227 3.907 -13.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 14.915 3.729 -13.095 1.00 0.00 H new ATOM 1759 N LEU A 113 10.558 -1.455 -10.947 1.00 0.00 N ATOM 1760 CA LEU A 113 9.475 -2.223 -10.362 1.00 0.00 C ATOM 1761 C LEU A 113 8.157 -1.717 -10.944 1.00 0.00 C ATOM 1762 O LEU A 113 7.732 -0.604 -10.643 1.00 0.00 O ATOM 1763 CB LEU A 113 9.594 -2.135 -8.834 1.00 0.00 C ATOM 1764 CG LEU A 113 8.616 -3.030 -8.060 1.00 0.00 C ATOM 1765 CD1 LEU A 113 9.153 -3.253 -6.645 1.00 0.00 C ATOM 1766 CD2 LEU A 113 7.222 -2.410 -7.939 1.00 0.00 C ATOM 0 H LEU A 113 10.468 -0.452 -10.787 1.00 0.00 H new ATOM 0 HA LEU A 113 9.520 -3.284 -10.606 1.00 0.00 H new ATOM 0 HB2 LEU A 113 10.612 -2.400 -8.547 1.00 0.00 H new ATOM 0 HB3 LEU A 113 9.436 -1.100 -8.530 1.00 0.00 H new ATOM 0 HG LEU A 113 8.530 -3.965 -8.614 1.00 0.00 H new ATOM 0 HD11 LEU A 113 8.463 -3.888 -6.090 1.00 0.00 H new ATOM 0 HD12 LEU A 113 10.128 -3.737 -6.698 1.00 0.00 H new ATOM 0 HD13 LEU A 113 9.251 -2.293 -6.138 1.00 0.00 H new ATOM 0 HD21 LEU A 113 6.571 -3.084 -7.383 1.00 0.00 H new ATOM 0 HD22 LEU A 113 7.292 -1.458 -7.413 1.00 0.00 H new ATOM 0 HD23 LEU A 113 6.809 -2.246 -8.934 1.00 0.00 H new ATOM 1778 N ILE A 114 7.533 -2.523 -11.806 1.00 0.00 N ATOM 1779 CA ILE A 114 6.371 -2.125 -12.592 1.00 0.00 C ATOM 1780 C ILE A 114 5.154 -1.992 -11.675 1.00 0.00 C ATOM 1781 O ILE A 114 4.992 -2.807 -10.767 1.00 0.00 O ATOM 1782 CB ILE A 114 6.120 -3.158 -13.710 1.00 0.00 C ATOM 1783 CG1 ILE A 114 7.375 -3.469 -14.550 1.00 0.00 C ATOM 1784 CG2 ILE A 114 4.964 -2.713 -14.620 1.00 0.00 C ATOM 1785 CD1 ILE A 114 8.034 -2.239 -15.181 1.00 0.00 C ATOM 0 H ILE A 114 7.828 -3.484 -11.978 1.00 0.00 H new ATOM 0 HA ILE A 114 6.554 -1.158 -13.060 1.00 0.00 H new ATOM 0 HB ILE A 114 5.845 -4.085 -13.206 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.105 -3.973 -13.917 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.104 -4.167 -15.342 1.00 0.00 H new ATOM 0 HG21 ILE A 114 4.807 -3.458 -15.400 1.00 0.00 H new ATOM 0 HG22 ILE A 114 4.054 -2.610 -14.028 1.00 0.00 H new ATOM 0 HG23 ILE A 114 5.210 -1.755 -15.078 1.00 0.00 H new ATOM 0 HD11 ILE A 114 8.908 -2.548 -15.754 1.00 0.00 H new ATOM 0 HD12 ILE A 114 7.323 -1.745 -15.843 1.00 0.00 H new ATOM 0 HD13 ILE A 114 8.340 -1.547 -14.396 1.00 0.00 H new ATOM 1797 N LEU A 115 4.299 -0.990 -11.916 1.00 0.00 N ATOM 1798 CA LEU A 115 3.093 -0.731 -11.141 1.00 0.00 C ATOM 1799 C LEU A 115 1.885 -0.614 -12.074 1.00 0.00 C ATOM 1800 O LEU A 115 1.494 0.493 -12.451 1.00 0.00 O ATOM 1801 CB LEU A 115 3.297 0.556 -10.324 1.00 0.00 C ATOM 1802 CG LEU A 115 2.168 0.800 -9.315 1.00 0.00 C ATOM 1803 CD1 LEU A 115 2.234 -0.240 -8.193 1.00 0.00 C ATOM 1804 CD2 LEU A 115 2.252 2.224 -8.758 1.00 0.00 C ATOM 0 H LEU A 115 4.436 -0.324 -12.676 1.00 0.00 H new ATOM 0 HA LEU A 115 2.901 -1.557 -10.456 1.00 0.00 H new ATOM 0 HB2 LEU A 115 4.247 0.498 -9.793 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.362 1.406 -11.003 1.00 0.00 H new ATOM 0 HG LEU A 115 1.208 0.695 -9.820 1.00 0.00 H new ATOM 0 HD11 LEU A 115 1.429 -0.059 -7.481 1.00 0.00 H new ATOM 0 HD12 LEU A 115 2.127 -1.239 -8.616 1.00 0.00 H new ATOM 0 HD13 LEU A 115 3.194 -0.164 -7.682 1.00 0.00 H new ATOM 0 HD21 LEU A 115 1.445 2.383 -8.043 1.00 0.00 H new ATOM 0 HD22 LEU A 115 3.211 2.364 -8.259 1.00 0.00 H new ATOM 0 HD23 LEU A 115 2.160 2.940 -9.575 1.00 0.00 H new ATOM 1816 N THR A 116 1.264 -1.743 -12.419 1.00 0.00 N ATOM 1817 CA THR A 116 0.052 -1.757 -13.228 1.00 0.00 C ATOM 1818 C THR A 116 -1.153 -1.835 -12.292 1.00 0.00 C ATOM 1819 O THR A 116 -1.351 -2.845 -11.615 1.00 0.00 O ATOM 1820 CB THR A 116 0.100 -2.910 -14.240 1.00 0.00 C ATOM 1821 OG1 THR A 116 1.238 -2.732 -15.063 1.00 0.00 O ATOM 1822 CG2 THR A 116 -1.156 -2.942 -15.121 1.00 0.00 C ATOM 0 H THR A 116 1.589 -2.670 -12.144 1.00 0.00 H new ATOM 0 HA THR A 116 -0.034 -0.842 -13.815 1.00 0.00 H new ATOM 0 HB THR A 116 0.151 -3.852 -13.694 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.287 -3.461 -15.716 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.086 -3.771 -15.825 1.00 0.00 H new ATOM 0 HG22 THR A 116 -2.038 -3.072 -14.493 1.00 0.00 H new ATOM 0 HG23 THR A 116 -1.238 -2.005 -15.672 1.00 0.00 H new ATOM 1830 N LEU A 117 -1.936 -0.756 -12.232 1.00 0.00 N ATOM 1831 CA LEU A 117 -3.161 -0.686 -11.456 1.00 0.00 C ATOM 1832 C LEU A 117 -4.320 -0.569 -12.447 1.00 0.00 C ATOM 1833 O LEU A 117 -4.336 0.382 -13.231 1.00 0.00 O ATOM 1834 CB LEU A 117 -3.131 0.529 -10.512 1.00 0.00 C ATOM 1835 CG LEU A 117 -1.776 0.866 -9.867 1.00 0.00 C ATOM 1836 CD1 LEU A 117 -1.984 2.023 -8.883 1.00 0.00 C ATOM 1837 CD2 LEU A 117 -1.179 -0.326 -9.116 1.00 0.00 C ATOM 0 H LEU A 117 -1.726 0.107 -12.734 1.00 0.00 H new ATOM 0 HA LEU A 117 -3.276 -1.576 -10.837 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -3.470 1.402 -11.070 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -3.855 0.359 -9.715 1.00 0.00 H new ATOM 0 HG LEU A 117 -1.079 1.137 -10.660 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -1.033 2.277 -8.414 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -2.369 2.891 -9.418 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -2.698 1.724 -8.116 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -0.223 -0.039 -8.678 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -1.862 -0.637 -8.325 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -1.027 -1.153 -9.809 1.00 0.00 H new ATOM 1849 N THR A 118 -5.267 -1.511 -12.443 1.00 0.00 N ATOM 1850 CA THR A 118 -6.415 -1.493 -13.345 1.00 0.00 C ATOM 1851 C THR A 118 -7.703 -1.424 -12.527 1.00 0.00 C ATOM 1852 O THR A 118 -7.928 -2.274 -11.665 1.00 0.00 O ATOM 1853 CB THR A 118 -6.408 -2.730 -14.261 1.00 0.00 C ATOM 1854 OG1 THR A 118 -5.078 -3.070 -14.627 1.00 0.00 O ATOM 1855 CG2 THR A 118 -7.231 -2.453 -15.525 1.00 0.00 C ATOM 0 H THR A 118 -5.256 -2.310 -11.810 1.00 0.00 H new ATOM 0 HA THR A 118 -6.355 -0.612 -13.983 1.00 0.00 H new ATOM 0 HB THR A 118 -6.850 -3.564 -13.716 1.00 0.00 H new ATOM 0 HG1 THR A 118 -5.090 -3.859 -15.208 1.00 0.00 H new ATOM 0 HG21 THR A 118 -7.220 -3.334 -16.167 1.00 0.00 H new ATOM 0 HG22 THR A 118 -8.259 -2.220 -15.246 1.00 0.00 H new ATOM 0 HG23 THR A 118 -6.800 -1.608 -16.062 1.00 0.00 H new ATOM 1863 N HIS A 119 -8.548 -0.428 -12.813 1.00 0.00 N ATOM 1864 CA HIS A 119 -9.890 -0.265 -12.278 1.00 0.00 C ATOM 1865 C HIS A 119 -10.836 -0.193 -13.472 1.00 0.00 C ATOM 1866 O HIS A 119 -10.455 0.358 -14.498 1.00 0.00 O ATOM 1867 CB HIS A 119 -9.939 1.035 -11.454 1.00 0.00 C ATOM 1868 CG HIS A 119 -11.323 1.533 -11.087 1.00 0.00 C ATOM 1869 ND1 HIS A 119 -12.237 0.920 -10.244 1.00 0.00 N ATOM 1870 CD2 HIS A 119 -11.891 2.689 -11.552 1.00 0.00 C ATOM 1871 CE1 HIS A 119 -13.343 1.690 -10.208 1.00 0.00 C ATOM 1872 NE2 HIS A 119 -13.159 2.761 -11.008 1.00 0.00 N ATOM 0 H HIS A 119 -8.295 0.321 -13.458 1.00 0.00 H new ATOM 0 HA HIS A 119 -10.177 -1.090 -11.626 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -9.373 0.882 -10.535 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -9.429 1.818 -12.015 1.00 0.00 H new ATOM 0 HD1 HIS A 119 -12.098 0.044 -9.741 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -11.435 3.407 -12.217 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -14.233 1.483 -9.632 1.00 0.00 H new ATOM 1881 N GLY A 120 -12.059 -0.716 -13.336 1.00 0.00 N ATOM 1882 CA GLY A 120 -13.054 -0.768 -14.406 1.00 0.00 C ATOM 1883 C GLY A 120 -13.031 0.461 -15.321 1.00 0.00 C ATOM 1884 O GLY A 120 -12.937 0.336 -16.538 1.00 0.00 O ATOM 0 H GLY A 120 -12.389 -1.122 -12.461 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -12.884 -1.662 -15.007 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -14.046 -0.864 -13.965 1.00 0.00 H new ATOM 1888 N THR A 121 -13.107 1.653 -14.725 1.00 0.00 N ATOM 1889 CA THR A 121 -13.125 2.912 -15.451 1.00 0.00 C ATOM 1890 C THR A 121 -11.749 3.344 -15.974 1.00 0.00 C ATOM 1891 O THR A 121 -11.682 4.044 -16.980 1.00 0.00 O ATOM 1892 CB THR A 121 -13.665 4.006 -14.517 1.00 0.00 C ATOM 1893 OG1 THR A 121 -14.487 3.448 -13.504 1.00 0.00 O ATOM 1894 CG2 THR A 121 -14.466 5.038 -15.313 1.00 0.00 C ATOM 0 H THR A 121 -13.158 1.766 -13.713 1.00 0.00 H new ATOM 0 HA THR A 121 -13.761 2.767 -16.324 1.00 0.00 H new ATOM 0 HB THR A 121 -12.812 4.495 -14.047 1.00 0.00 H new ATOM 0 HG1 THR A 121 -13.975 3.372 -12.672 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.842 5.806 -14.638 1.00 0.00 H new ATOM 0 HG22 THR A 121 -13.823 5.498 -16.064 1.00 0.00 H new ATOM 0 HG23 THR A 121 -15.305 4.546 -15.806 1.00 0.00 H new ATOM 1902 N ALA A 122 -10.671 3.043 -15.237 1.00 0.00 N ATOM 1903 CA ALA A 122 -9.397 3.741 -15.364 1.00 0.00 C ATOM 1904 C ALA A 122 -8.238 2.753 -15.265 1.00 0.00 C ATOM 1905 O ALA A 122 -8.196 1.926 -14.356 1.00 0.00 O ATOM 1906 CB ALA A 122 -9.282 4.813 -14.273 1.00 0.00 C ATOM 0 H ALA A 122 -10.665 2.304 -14.534 1.00 0.00 H new ATOM 0 HA ALA A 122 -9.353 4.224 -16.340 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -8.329 5.332 -14.372 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -10.097 5.529 -14.379 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -9.338 4.341 -13.292 1.00 0.00 H new ATOM 1912 N VAL A 123 -7.280 2.866 -16.185 1.00 0.00 N ATOM 1913 CA VAL A 123 -6.067 2.065 -16.219 1.00 0.00 C ATOM 1914 C VAL A 123 -4.878 2.979 -15.916 1.00 0.00 C ATOM 1915 O VAL A 123 -4.660 3.976 -16.602 1.00 0.00 O ATOM 1916 CB VAL A 123 -5.970 1.335 -17.570 1.00 0.00 C ATOM 1917 CG1 VAL A 123 -6.220 2.252 -18.776 1.00 0.00 C ATOM 1918 CG2 VAL A 123 -4.634 0.599 -17.725 1.00 0.00 C ATOM 0 H VAL A 123 -7.333 3.540 -16.949 1.00 0.00 H new ATOM 0 HA VAL A 123 -6.074 1.284 -15.458 1.00 0.00 H new ATOM 0 HB VAL A 123 -6.774 0.599 -17.559 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -6.137 1.674 -19.696 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -7.220 2.681 -18.706 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -5.481 3.054 -18.783 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -4.605 0.097 -18.692 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -3.815 1.315 -17.664 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -4.531 -0.139 -16.930 1.00 0.00 H new ATOM 1928 N CYS A 124 -4.125 2.662 -14.861 1.00 0.00 N ATOM 1929 CA CYS A 124 -3.006 3.452 -14.377 1.00 0.00 C ATOM 1930 C CYS A 124 -1.743 2.594 -14.382 1.00 0.00 C ATOM 1931 O CYS A 124 -1.587 1.725 -13.530 1.00 0.00 O ATOM 1932 CB CYS A 124 -3.333 3.955 -12.971 1.00 0.00 C ATOM 1933 SG CYS A 124 -1.823 4.554 -12.188 1.00 0.00 S ATOM 0 H CYS A 124 -4.287 1.821 -14.307 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.832 4.312 -15.023 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -4.072 4.754 -13.021 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -3.771 3.152 -12.377 1.00 0.00 H new ATOM 0 HG CYS A 124 -1.285 5.476 -12.931 1.00 0.00 H new ATOM 1939 N THR A 125 -0.819 2.892 -15.292 1.00 0.00 N ATOM 1940 CA THR A 125 0.414 2.150 -15.500 1.00 0.00 C ATOM 1941 C THR A 125 1.583 3.044 -15.095 1.00 0.00 C ATOM 1942 O THR A 125 1.894 3.981 -15.821 1.00 0.00 O ATOM 1943 CB THR A 125 0.478 1.756 -16.987 1.00 0.00 C ATOM 1944 OG1 THR A 125 -0.232 2.688 -17.796 1.00 0.00 O ATOM 1945 CG2 THR A 125 -0.190 0.396 -17.196 1.00 0.00 C ATOM 0 H THR A 125 -0.915 3.686 -15.925 1.00 0.00 H new ATOM 0 HA THR A 125 0.458 1.242 -14.898 1.00 0.00 H new ATOM 0 HB THR A 125 1.531 1.733 -17.268 1.00 0.00 H new ATOM 0 HG1 THR A 125 -0.589 2.230 -18.586 1.00 0.00 H new ATOM 0 HG21 THR A 125 -0.141 0.125 -18.250 1.00 0.00 H new ATOM 0 HG22 THR A 125 0.327 -0.358 -16.603 1.00 0.00 H new ATOM 0 HG23 THR A 125 -1.233 0.451 -16.884 1.00 0.00 H new ATOM 1953 N ARG A 126 2.189 2.801 -13.931 1.00 0.00 N ATOM 1954 CA ARG A 126 3.350 3.542 -13.453 1.00 0.00 C ATOM 1955 C ARG A 126 4.512 2.581 -13.190 1.00 0.00 C ATOM 1956 O ARG A 126 4.379 1.374 -13.403 1.00 0.00 O ATOM 1957 CB ARG A 126 2.959 4.361 -12.206 1.00 0.00 C ATOM 1958 CG ARG A 126 2.037 5.537 -12.578 1.00 0.00 C ATOM 1959 CD ARG A 126 2.495 6.879 -11.986 1.00 0.00 C ATOM 1960 NE ARG A 126 2.168 7.067 -10.567 1.00 0.00 N ATOM 1961 CZ ARG A 126 2.339 8.235 -9.920 1.00 0.00 C ATOM 1962 NH1 ARG A 126 2.946 9.275 -10.500 1.00 0.00 N ATOM 1963 NH2 ARG A 126 1.925 8.380 -8.662 1.00 0.00 N ATOM 0 H ARG A 126 1.880 2.073 -13.287 1.00 0.00 H new ATOM 0 HA ARG A 126 3.688 4.247 -14.213 1.00 0.00 H new ATOM 0 HB2 ARG A 126 2.456 3.715 -11.486 1.00 0.00 H new ATOM 0 HB3 ARG A 126 3.858 4.740 -11.720 1.00 0.00 H new ATOM 0 HG2 ARG A 126 1.990 5.624 -13.664 1.00 0.00 H new ATOM 0 HG3 ARG A 126 1.026 5.321 -12.232 1.00 0.00 H new ATOM 0 HD2 ARG A 126 3.574 6.966 -12.111 1.00 0.00 H new ATOM 0 HD3 ARG A 126 2.041 7.687 -12.560 1.00 0.00 H new ATOM 0 HE ARG A 126 1.793 6.274 -10.046 1.00 0.00 H new ATOM 0 HH11 ARG A 126 3.293 9.195 -11.456 1.00 0.00 H new ATOM 0 HH12 ARG A 126 3.062 10.149 -9.987 1.00 0.00 H new ATOM 0 HH21 ARG A 126 1.474 7.602 -8.181 1.00 0.00 H new ATOM 0 HH22 ARG A 126 2.059 9.269 -8.180 1.00 0.00 H new ATOM 1977 N THR A 127 5.643 3.101 -12.704 1.00 0.00 N ATOM 1978 CA THR A 127 6.780 2.292 -12.300 1.00 0.00 C ATOM 1979 C THR A 127 7.478 2.939 -11.102 1.00 0.00 C ATOM 1980 O THR A 127 7.373 4.150 -10.883 1.00 0.00 O ATOM 1981 CB THR A 127 7.717 2.046 -13.498 1.00 0.00 C ATOM 1982 OG1 THR A 127 8.437 0.853 -13.295 1.00 0.00 O ATOM 1983 CG2 THR A 127 8.757 3.141 -13.739 1.00 0.00 C ATOM 0 H THR A 127 5.789 4.103 -12.582 1.00 0.00 H new ATOM 0 HA THR A 127 6.442 1.309 -11.973 1.00 0.00 H new ATOM 0 HB THR A 127 7.056 2.014 -14.364 1.00 0.00 H new ATOM 0 HG1 THR A 127 8.203 0.474 -12.422 1.00 0.00 H new ATOM 0 HG21 THR A 127 9.369 2.878 -14.602 1.00 0.00 H new ATOM 0 HG22 THR A 127 8.251 4.088 -13.927 1.00 0.00 H new ATOM 0 HG23 THR A 127 9.393 3.238 -12.859 1.00 0.00 H new ATOM 1991 N TYR A 128 8.173 2.109 -10.327 1.00 0.00 N ATOM 1992 CA TYR A 128 9.009 2.475 -9.199 1.00 0.00 C ATOM 1993 C TYR A 128 10.458 2.107 -9.514 1.00 0.00 C ATOM 1994 O TYR A 128 10.728 1.309 -10.412 1.00 0.00 O ATOM 1995 CB TYR A 128 8.568 1.695 -7.952 1.00 0.00 C ATOM 1996 CG TYR A 128 7.322 2.168 -7.232 1.00 0.00 C ATOM 1997 CD1 TYR A 128 7.448 3.015 -6.116 1.00 0.00 C ATOM 1998 CD2 TYR A 128 6.094 1.530 -7.474 1.00 0.00 C ATOM 1999 CE1 TYR A 128 6.333 3.325 -5.324 1.00 0.00 C ATOM 2000 CE2 TYR A 128 4.997 1.779 -6.632 1.00 0.00 C ATOM 2001 CZ TYR A 128 5.099 2.718 -5.598 1.00 0.00 C ATOM 2002 OH TYR A 128 4.013 2.983 -4.818 1.00 0.00 O ATOM 0 H TYR A 128 8.163 1.101 -10.485 1.00 0.00 H new ATOM 0 HA TYR A 128 8.918 3.546 -9.016 1.00 0.00 H new ATOM 0 HB2 TYR A 128 8.414 0.656 -8.243 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.393 1.707 -7.239 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.413 3.431 -5.867 1.00 0.00 H new ATOM 0 HD2 TYR A 128 5.993 0.849 -8.306 1.00 0.00 H new ATOM 0 HE1 TYR A 128 6.424 4.027 -4.508 1.00 0.00 H new ATOM 0 HE2 TYR A 128 4.071 1.244 -6.783 1.00 0.00 H new ATOM 0 HH TYR A 128 3.241 2.479 -5.150 1.00 0.00 H new ATOM 2012 N GLU A 129 11.380 2.654 -8.724 1.00 0.00 N ATOM 2013 CA GLU A 129 12.779 2.274 -8.686 1.00 0.00 C ATOM 2014 C GLU A 129 13.139 2.048 -7.218 1.00 0.00 C ATOM 2015 O GLU A 129 12.689 2.793 -6.350 1.00 0.00 O ATOM 2016 CB GLU A 129 13.595 3.393 -9.333 1.00 0.00 C ATOM 2017 CG GLU A 129 15.074 3.038 -9.490 1.00 0.00 C ATOM 2018 CD GLU A 129 15.749 4.071 -10.375 1.00 0.00 C ATOM 2019 OE1 GLU A 129 15.566 3.939 -11.606 1.00 0.00 O ATOM 2020 OE2 GLU A 129 16.362 5.002 -9.818 1.00 0.00 O ATOM 0 H GLU A 129 11.157 3.404 -8.069 1.00 0.00 H new ATOM 0 HA GLU A 129 12.990 1.359 -9.239 1.00 0.00 H new ATOM 0 HB2 GLU A 129 13.176 3.621 -10.313 1.00 0.00 H new ATOM 0 HB3 GLU A 129 13.506 4.296 -8.730 1.00 0.00 H new ATOM 0 HG2 GLU A 129 15.558 3.008 -8.514 1.00 0.00 H new ATOM 0 HG3 GLU A 129 15.177 2.045 -9.928 1.00 0.00 H new ATOM 2027 N LYS A 130 13.885 0.985 -6.915 1.00 0.00 N ATOM 2028 CA LYS A 130 14.186 0.623 -5.540 1.00 0.00 C ATOM 2029 C LYS A 130 15.249 1.565 -4.969 1.00 0.00 C ATOM 2030 O LYS A 130 16.412 1.475 -5.350 1.00 0.00 O ATOM 2031 CB LYS A 130 14.606 -0.851 -5.469 1.00 0.00 C ATOM 2032 CG LYS A 130 14.730 -1.281 -4.005 1.00 0.00 C ATOM 2033 CD LYS A 130 14.977 -2.787 -3.898 1.00 0.00 C ATOM 2034 CE LYS A 130 14.983 -3.173 -2.416 1.00 0.00 C ATOM 2035 NZ LYS A 130 15.146 -4.622 -2.212 1.00 0.00 N ATOM 0 H LYS A 130 14.291 0.360 -7.611 1.00 0.00 H new ATOM 0 HA LYS A 130 13.295 0.736 -4.923 1.00 0.00 H new ATOM 0 HB2 LYS A 130 13.872 -1.474 -5.980 1.00 0.00 H new ATOM 0 HB3 LYS A 130 15.557 -0.993 -5.982 1.00 0.00 H new ATOM 0 HG2 LYS A 130 15.548 -0.739 -3.531 1.00 0.00 H new ATOM 0 HG3 LYS A 130 13.820 -1.018 -3.466 1.00 0.00 H new ATOM 0 HD2 LYS A 130 14.201 -3.337 -4.430 1.00 0.00 H new ATOM 0 HD3 LYS A 130 15.928 -3.049 -4.362 1.00 0.00 H new ATOM 0 HE2 LYS A 130 15.791 -2.645 -1.909 1.00 0.00 H new ATOM 0 HE3 LYS A 130 14.051 -2.847 -1.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 14.751 -4.889 -1.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 14.645 -5.137 -2.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 16.157 -4.865 -2.240 1.00 0.00 H new ATOM 2049 N GLN A 131 14.862 2.439 -4.033 1.00 0.00 N ATOM 2050 CA GLN A 131 15.793 3.355 -3.381 1.00 0.00 C ATOM 2051 C GLN A 131 16.432 2.720 -2.142 1.00 0.00 C ATOM 2052 O GLN A 131 17.499 3.149 -1.714 1.00 0.00 O ATOM 2053 CB GLN A 131 15.123 4.701 -3.066 1.00 0.00 C ATOM 2054 CG GLN A 131 13.965 4.607 -2.059 1.00 0.00 C ATOM 2055 CD GLN A 131 13.381 5.969 -1.689 1.00 0.00 C ATOM 2056 OE1 GLN A 131 12.186 6.211 -1.837 1.00 0.00 O ATOM 2057 NE2 GLN A 131 14.215 6.877 -1.191 1.00 0.00 N ATOM 0 H GLN A 131 13.899 2.528 -3.710 1.00 0.00 H new ATOM 0 HA GLN A 131 16.603 3.560 -4.081 1.00 0.00 H new ATOM 0 HB2 GLN A 131 15.875 5.386 -2.675 1.00 0.00 H new ATOM 0 HB3 GLN A 131 14.749 5.134 -3.994 1.00 0.00 H new ATOM 0 HG2 GLN A 131 13.177 3.982 -2.478 1.00 0.00 H new ATOM 0 HG3 GLN A 131 14.317 4.111 -1.154 1.00 0.00 H new ATOM 0 HE21 GLN A 131 15.204 6.653 -1.077 1.00 0.00 H new ATOM 0 HE22 GLN A 131 13.866 7.797 -0.923 1.00 0.00 H new ATOM 2066 N ALA A 132 15.777 1.720 -1.540 1.00 0.00 N ATOM 2067 CA ALA A 132 16.259 1.051 -0.333 1.00 0.00 C ATOM 2068 C ALA A 132 16.633 2.060 0.757 1.00 0.00 C ATOM 2069 O ALA A 132 15.776 2.461 1.543 1.00 0.00 O ATOM 2070 CB ALA A 132 17.430 0.122 -0.666 1.00 0.00 C ATOM 2071 OXT ALA A 132 17.930 2.519 0.857 1.00 0.00 O ATOM 0 H ALA A 132 14.890 1.352 -1.883 1.00 0.00 H new ATOM 0 HA ALA A 132 15.447 0.441 0.063 1.00 0.00 H new ATOM 0 HB1 ALA A 132 17.776 -0.368 0.244 1.00 0.00 H new ATOM 0 HB2 ALA A 132 17.104 -0.632 -1.382 1.00 0.00 H new ATOM 0 HB3 ALA A 132 18.245 0.704 -1.097 1.00 0.00 H new