USER MOD reduce.3.24.130724 H: found=0, std=0, add=1096, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1096 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 131 THR OG1 : rot -45:sc= 0.532 USER MOD Set 1.2: A 134 ASN : amide:sc= 0 X(o=0.53,f=0.18) USER MOD Set 2.1: A 40 THR OG1 : rot -130:sc= 0.479 USER MOD Set 2.2: A 127 LYS NZ :NH3+ -140:sc= 0.995 (180deg=-0.533!) USER MOD Set 3.1: A 90 LYS NZ :NH3+ 158:sc= 1.47 (180deg=-1.97!) USER MOD Set 3.2: A 108 GLN : amide:sc= -0.424! C(o=1!,f=-6.8!) USER MOD Set 4.1: A 32 SER OG : rot 180:sc= -0.0151 USER MOD Set 4.2: A 37 HIS :FLIP no HE2:sc= -3.45! C(o=-4.3!,f=-3.5!) USER MOD Set 5.1: A 13 ASN : amide:sc= 0.59 K(o=2.7,f=0.51) USER MOD Set 5.2: A 15 TYR OH : rot 44:sc= 2.07 USER MOD Single : A 1 MET CE :methyl -136:sc= -0.291 (180deg=-0.752) USER MOD Single : A 1 MET N :NH3+ -168:sc= 2.64 (180deg=2.23) USER MOD Single : A 11 GLN : amide:sc= 0.334 X(o=0.33,f=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc= 0.981 K(o=0.98,f=-0.58) USER MOD Single : A 22 LYS NZ :NH3+ -163:sc= 0.345 (180deg=-0.668!) USER MOD Single : A 23 THR OG1 : rot 180:sc= -0.545 USER MOD Single : A 27 SER OG : rot -79:sc= -0.304 USER MOD Single : A 30 ASN : amide:sc= 0.176 K(o=0.18,f=-9.4!) USER MOD Single : A 34 MET CE :methyl -166:sc= -0.165 (180deg=-0.463) USER MOD Single : A 39 MET CE :methyl -135:sc= -0.277 (180deg=-4.75!) USER MOD Single : A 42 SER OG : rot 84:sc= 1.35 USER MOD Single : A 43 THR OG1 : rot -81:sc= 1.84 USER MOD Single : A 47 GLN : amide:sc=-0.00973 X(o=-0.0097,f=-0.5) USER MOD Single : A 48 ASN :FLIP amide:sc= -5.15! C(o=-5.7!,f=-5.2!) USER MOD Single : A 52 GLN : amide:sc= -0.129 K(o=-0.13,f=-0.82) USER MOD Single : A 59 SER OG : rot 180:sc= -0.315 USER MOD Single : A 60 TYR OH : rot 180:sc= 0.415 USER MOD Single : A 68 ASN : amide:sc= -0.3 X(o=-0.3,f=-0.11) USER MOD Single : A 70 LYS NZ :NH3+ -170:sc= 1.16 (180deg=0.96) USER MOD Single : A 72 GLN : amide:sc= -0.0956 K(o=-0.096,f=-0.91) USER MOD Single : A 78 GLN : amide:sc= -0.0442 X(o=-0.044,f=-0.49) USER MOD Single : A 79 THR OG1 : rot 75:sc= 0.455 USER MOD Single : A 82 ASN : amide:sc= 0 X(o=0,f=-0.084) USER MOD Single : A 89 HIS : +bothHN:sc= -3.31! C(o=-3.3!,f=-7.5!) USER MOD Single : A 91 ASN : amide:sc= -0.166 K(o=-0.17,f=-5.7!) USER MOD Single : A 95 ASN : amide:sc= -0.012 X(o=-0.012,f=-0.064) USER MOD Single : A 96 SER OG : rot 169:sc= 1.29 USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 100 ASN : amide:sc= -2.72! C(o=-2.7!,f=-3.8!) USER MOD Single : A 106 TYR OH : rot -161:sc= 2.31 USER MOD Single : A 107 ASN : amide:sc= -0.561 K(o=-0.56,f=-7!) USER MOD Single : A 110 LYS NZ :NH3+ 177:sc= 1.26 (180deg=1.21) USER MOD Single : A 114 ASN : amide:sc= -2.35! C(o=-2.3!,f=-3.5!) USER MOD Single : A 119 ASN : amide:sc= 1.12 K(o=1.1,f=-0.37) USER MOD Single : A 123 SER OG : rot 90:sc= 0 USER MOD Single : A 132 THR OG1 : rot 160:sc= 1.27 USER MOD Single : A 137 ASN : amide:sc= 1.12 K(o=1.1,f=-0.19) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 GLN :FLIP amide:sc= -0.209 F(o=-1.1,f=-0.21) USER MOD Single : A 142 SER OG : rot 180:sc= -3.65! USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 20.352 63.820 -14.940 1.00 0.00 N ATOM 2 CA MET A 1 19.041 64.517 -14.943 1.00 0.00 C ATOM 3 C MET A 1 17.997 63.664 -14.227 1.00 0.00 C ATOM 4 O MET A 1 17.238 64.165 -13.406 1.00 0.00 O ATOM 5 CB MET A 1 18.588 64.852 -16.379 1.00 0.00 C ATOM 6 CG MET A 1 18.209 63.645 -17.231 1.00 0.00 C ATOM 7 SD MET A 1 19.590 62.520 -17.518 1.00 0.00 S ATOM 8 CE MET A 1 20.587 63.495 -18.645 1.00 0.00 C ATOM 0 H1 MET A 1 21.097 64.480 -15.242 1.00 0.00 H new ATOM 0 H2 MET A 1 20.561 63.477 -13.981 1.00 0.00 H new ATOM 0 H3 MET A 1 20.318 63.013 -15.596 1.00 0.00 H new ATOM 0 HA MET A 1 19.151 65.460 -14.408 1.00 0.00 H new ATOM 0 HB2 MET A 1 17.732 65.525 -16.327 1.00 0.00 H new ATOM 0 HB3 MET A 1 19.390 65.395 -16.880 1.00 0.00 H new ATOM 0 HG2 MET A 1 17.401 63.101 -16.741 1.00 0.00 H new ATOM 0 HG3 MET A 1 17.825 63.991 -18.190 1.00 0.00 H new ATOM 0 HE1 MET A 1 20.939 62.862 -19.460 1.00 0.00 H new ATOM 0 HE2 MET A 1 19.986 64.309 -19.051 1.00 0.00 H new ATOM 0 HE3 MET A 1 21.442 63.908 -18.110 1.00 0.00 H new ATOM 20 N VAL A 2 17.960 62.373 -14.539 1.00 0.00 N ATOM 21 CA VAL A 2 17.153 61.437 -13.778 1.00 0.00 C ATOM 22 C VAL A 2 18.070 60.627 -12.872 1.00 0.00 C ATOM 23 O VAL A 2 18.971 59.936 -13.346 1.00 0.00 O ATOM 24 CB VAL A 2 16.321 60.504 -14.699 1.00 0.00 C ATOM 25 CG1 VAL A 2 17.201 59.799 -15.725 1.00 0.00 C ATOM 26 CG2 VAL A 2 15.536 59.492 -13.874 1.00 0.00 C ATOM 0 H VAL A 2 18.479 61.956 -15.312 1.00 0.00 H new ATOM 0 HA VAL A 2 16.437 61.998 -13.177 1.00 0.00 H new ATOM 0 HB VAL A 2 15.613 61.127 -15.246 1.00 0.00 H new ATOM 0 HG11 VAL A 2 16.584 59.155 -16.352 1.00 0.00 H new ATOM 0 HG12 VAL A 2 17.700 60.541 -16.348 1.00 0.00 H new ATOM 0 HG13 VAL A 2 17.949 59.196 -15.210 1.00 0.00 H new ATOM 0 HG21 VAL A 2 14.960 58.849 -14.539 1.00 0.00 H new ATOM 0 HG22 VAL A 2 16.227 58.884 -13.290 1.00 0.00 H new ATOM 0 HG23 VAL A 2 14.858 60.018 -13.202 1.00 0.00 H new ATOM 36 N CYS A 3 17.864 60.740 -11.571 1.00 0.00 N ATOM 37 CA CYS A 3 18.769 60.132 -10.606 1.00 0.00 C ATOM 38 C CYS A 3 18.012 59.703 -9.351 1.00 0.00 C ATOM 39 O CYS A 3 16.936 60.226 -9.061 1.00 0.00 O ATOM 40 CB CYS A 3 19.898 61.113 -10.266 1.00 0.00 C ATOM 41 SG CYS A 3 20.964 61.518 -11.686 1.00 0.00 S ATOM 0 H CYS A 3 17.080 61.246 -11.158 1.00 0.00 H new ATOM 0 HA CYS A 3 19.209 59.237 -11.045 1.00 0.00 H new ATOM 0 HB2 CYS A 3 19.463 62.033 -9.875 1.00 0.00 H new ATOM 0 HB3 CYS A 3 20.511 60.687 -9.472 1.00 0.00 H new ATOM 46 N PRO A 4 18.560 58.728 -8.603 1.00 0.00 N ATOM 47 CA PRO A 4 17.865 58.117 -7.465 1.00 0.00 C ATOM 48 C PRO A 4 17.768 59.005 -6.221 1.00 0.00 C ATOM 49 O PRO A 4 18.760 59.554 -5.744 1.00 0.00 O ATOM 50 CB PRO A 4 18.711 56.878 -7.162 1.00 0.00 C ATOM 51 CG PRO A 4 20.079 57.224 -7.638 1.00 0.00 C ATOM 52 CD PRO A 4 19.893 58.130 -8.823 1.00 0.00 C ATOM 0 HA PRO A 4 16.824 57.915 -7.718 1.00 0.00 H new ATOM 0 HB2 PRO A 4 18.709 56.649 -6.096 1.00 0.00 H new ATOM 0 HB3 PRO A 4 18.324 55.999 -7.677 1.00 0.00 H new ATOM 0 HG2 PRO A 4 20.650 57.721 -6.854 1.00 0.00 H new ATOM 0 HG3 PRO A 4 20.633 56.327 -7.916 1.00 0.00 H new ATOM 0 HD2 PRO A 4 20.671 58.892 -8.870 1.00 0.00 H new ATOM 0 HD3 PRO A 4 19.933 57.576 -9.761 1.00 0.00 H new ATOM 60 N ILE A 5 16.544 59.133 -5.722 1.00 0.00 N ATOM 61 CA ILE A 5 16.259 59.707 -4.405 1.00 0.00 C ATOM 62 C ILE A 5 16.623 61.191 -4.287 1.00 0.00 C ATOM 63 O ILE A 5 15.862 62.052 -4.722 1.00 0.00 O ATOM 64 CB ILE A 5 16.940 58.904 -3.265 1.00 0.00 C ATOM 65 CG1 ILE A 5 16.664 57.405 -3.428 1.00 0.00 C ATOM 66 CG2 ILE A 5 16.439 59.380 -1.903 1.00 0.00 C ATOM 67 CD1 ILE A 5 17.383 56.537 -2.415 1.00 0.00 C ATOM 0 H ILE A 5 15.707 58.838 -6.225 1.00 0.00 H new ATOM 0 HA ILE A 5 15.177 59.634 -4.296 1.00 0.00 H new ATOM 0 HB ILE A 5 18.015 59.073 -3.323 1.00 0.00 H new ATOM 0 HG12 ILE A 5 15.591 57.231 -3.345 1.00 0.00 H new ATOM 0 HG13 ILE A 5 16.960 57.098 -4.431 1.00 0.00 H new ATOM 0 HG21 ILE A 5 16.927 58.806 -1.115 1.00 0.00 H new ATOM 0 HG22 ILE A 5 16.672 60.438 -1.779 1.00 0.00 H new ATOM 0 HG23 ILE A 5 15.360 59.236 -1.842 1.00 0.00 H new ATOM 0 HD11 ILE A 5 17.138 55.490 -2.594 1.00 0.00 H new ATOM 0 HD12 ILE A 5 18.459 56.680 -2.512 1.00 0.00 H new ATOM 0 HD13 ILE A 5 17.069 56.816 -1.409 1.00 0.00 H new ATOM 79 N ASP A 6 17.789 61.484 -3.722 1.00 0.00 N ATOM 80 CA ASP A 6 18.088 62.840 -3.267 1.00 0.00 C ATOM 81 C ASP A 6 19.227 63.470 -4.067 1.00 0.00 C ATOM 82 O ASP A 6 19.728 64.541 -3.728 1.00 0.00 O ATOM 83 CB ASP A 6 18.424 62.814 -1.769 1.00 0.00 C ATOM 84 CG ASP A 6 18.340 64.184 -1.118 1.00 0.00 C ATOM 85 OD1 ASP A 6 17.245 64.791 -1.142 1.00 0.00 O ATOM 86 OD2 ASP A 6 19.357 64.657 -0.576 1.00 0.00 O ATOM 0 H ASP A 6 18.538 60.809 -3.568 1.00 0.00 H new ATOM 0 HA ASP A 6 17.206 63.459 -3.430 1.00 0.00 H new ATOM 0 HB2 ASP A 6 17.741 62.134 -1.261 1.00 0.00 H new ATOM 0 HB3 ASP A 6 19.429 62.415 -1.635 1.00 0.00 H new ATOM 91 N TRP A 7 19.628 62.815 -5.146 1.00 0.00 N ATOM 92 CA TRP A 7 20.641 63.386 -6.028 1.00 0.00 C ATOM 93 C TRP A 7 20.068 64.611 -6.742 1.00 0.00 C ATOM 94 O TRP A 7 19.080 64.506 -7.469 1.00 0.00 O ATOM 95 CB TRP A 7 21.130 62.353 -7.052 1.00 0.00 C ATOM 96 CG TRP A 7 22.021 61.286 -6.476 1.00 0.00 C ATOM 97 CD1 TRP A 7 21.641 60.204 -5.737 1.00 0.00 C ATOM 98 CD2 TRP A 7 23.447 61.193 -6.612 1.00 0.00 C ATOM 99 NE1 TRP A 7 22.738 59.446 -5.405 1.00 0.00 N ATOM 100 CE2 TRP A 7 23.859 60.031 -5.930 1.00 0.00 C ATOM 101 CE3 TRP A 7 24.413 61.979 -7.244 1.00 0.00 C ATOM 102 CZ2 TRP A 7 25.197 59.638 -5.864 1.00 0.00 C ATOM 103 CZ3 TRP A 7 25.737 61.589 -7.176 1.00 0.00 C ATOM 104 CH2 TRP A 7 26.118 60.428 -6.493 1.00 0.00 C ATOM 0 H TRP A 7 19.276 61.901 -5.431 1.00 0.00 H new ATOM 0 HA TRP A 7 21.497 63.686 -5.423 1.00 0.00 H new ATOM 0 HB2 TRP A 7 20.264 61.878 -7.513 1.00 0.00 H new ATOM 0 HB3 TRP A 7 21.669 62.871 -7.845 1.00 0.00 H new ATOM 0 HD1 TRP A 7 20.624 59.976 -5.454 1.00 0.00 H new ATOM 0 HE1 TRP A 7 22.720 58.586 -4.856 1.00 0.00 H new ATOM 0 HE3 TRP A 7 24.130 62.875 -7.776 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 25.493 58.744 -5.336 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 26.492 62.191 -7.659 1.00 0.00 H new ATOM 0 HH2 TRP A 7 27.161 60.151 -6.462 1.00 0.00 H new ATOM 115 N ARG A 8 20.686 65.771 -6.532 1.00 0.00 N ATOM 116 CA ARG A 8 20.171 67.022 -7.083 1.00 0.00 C ATOM 117 C ARG A 8 20.397 67.083 -8.583 1.00 0.00 C ATOM 118 O ARG A 8 21.533 67.168 -9.043 1.00 0.00 O ATOM 119 CB ARG A 8 20.850 68.231 -6.430 1.00 0.00 C ATOM 120 CG ARG A 8 20.706 68.283 -4.920 1.00 0.00 C ATOM 121 CD ARG A 8 19.256 68.428 -4.497 1.00 0.00 C ATOM 122 NE ARG A 8 19.124 68.424 -3.043 1.00 0.00 N ATOM 123 CZ ARG A 8 18.479 67.476 -2.366 1.00 0.00 C ATOM 124 NH1 ARG A 8 17.790 66.548 -3.009 1.00 0.00 N ATOM 125 NH2 ARG A 8 18.501 67.463 -1.041 1.00 0.00 N ATOM 0 H ARG A 8 21.542 65.871 -5.986 1.00 0.00 H new ATOM 0 HA ARG A 8 19.102 67.053 -6.874 1.00 0.00 H new ATOM 0 HB2 ARG A 8 21.910 68.219 -6.683 1.00 0.00 H new ATOM 0 HB3 ARG A 8 20.431 69.143 -6.856 1.00 0.00 H new ATOM 0 HG2 ARG A 8 21.123 67.375 -4.484 1.00 0.00 H new ATOM 0 HG3 ARG A 8 21.284 69.120 -4.528 1.00 0.00 H new ATOM 0 HD2 ARG A 8 18.849 69.356 -4.899 1.00 0.00 H new ATOM 0 HD3 ARG A 8 18.668 67.613 -4.920 1.00 0.00 H new ATOM 0 HE ARG A 8 19.549 69.188 -2.518 1.00 0.00 H new ATOM 0 HH11 ARG A 8 17.751 66.556 -4.028 1.00 0.00 H new ATOM 0 HH12 ARG A 8 17.298 65.824 -2.486 1.00 0.00 H new ATOM 0 HH21 ARG A 8 19.015 68.183 -0.532 1.00 0.00 H new ATOM 0 HH22 ARG A 8 18.004 66.733 -0.530 1.00 0.00 H new ATOM 139 N ALA A 9 19.314 67.033 -9.336 1.00 0.00 N ATOM 140 CA ALA A 9 19.393 67.107 -10.783 1.00 0.00 C ATOM 141 C ALA A 9 19.612 68.543 -11.236 1.00 0.00 C ATOM 142 O ALA A 9 18.817 69.430 -10.926 1.00 0.00 O ATOM 143 CB ALA A 9 18.131 66.538 -11.409 1.00 0.00 C ATOM 0 H ALA A 9 18.367 66.941 -8.968 1.00 0.00 H new ATOM 0 HA ALA A 9 20.244 66.512 -11.113 1.00 0.00 H new ATOM 0 HB1 ALA A 9 18.204 66.600 -12.495 1.00 0.00 H new ATOM 0 HB2 ALA A 9 18.015 65.496 -11.112 1.00 0.00 H new ATOM 0 HB3 ALA A 9 17.267 67.110 -11.070 1.00 0.00 H new ATOM 149 N PHE A 10 20.698 68.766 -11.955 1.00 0.00 N ATOM 150 CA PHE A 10 21.003 70.078 -12.495 1.00 0.00 C ATOM 151 C PHE A 10 21.558 69.930 -13.907 1.00 0.00 C ATOM 152 O PHE A 10 22.562 69.247 -14.120 1.00 0.00 O ATOM 153 CB PHE A 10 21.995 70.815 -11.588 1.00 0.00 C ATOM 154 CG PHE A 10 22.276 72.226 -12.018 1.00 0.00 C ATOM 155 CD1 PHE A 10 21.348 73.229 -11.793 1.00 0.00 C ATOM 156 CD2 PHE A 10 23.465 72.549 -12.651 1.00 0.00 C ATOM 157 CE1 PHE A 10 21.600 74.527 -12.191 1.00 0.00 C ATOM 158 CE2 PHE A 10 23.722 73.845 -13.052 1.00 0.00 C ATOM 159 CZ PHE A 10 22.789 74.835 -12.823 1.00 0.00 C ATOM 0 H PHE A 10 21.388 68.049 -12.179 1.00 0.00 H new ATOM 0 HA PHE A 10 20.090 70.671 -12.538 1.00 0.00 H new ATOM 0 HB2 PHE A 10 21.604 70.826 -10.571 1.00 0.00 H new ATOM 0 HB3 PHE A 10 22.932 70.259 -11.563 1.00 0.00 H new ATOM 0 HD1 PHE A 10 20.416 72.993 -11.300 1.00 0.00 H new ATOM 0 HD2 PHE A 10 24.199 71.778 -12.833 1.00 0.00 H new ATOM 0 HE1 PHE A 10 20.869 75.300 -12.008 1.00 0.00 H new ATOM 0 HE2 PHE A 10 24.653 74.084 -13.545 1.00 0.00 H new ATOM 0 HZ PHE A 10 22.988 75.849 -13.137 1.00 0.00 H new ATOM 169 N GLN A 11 20.882 70.564 -14.863 1.00 0.00 N ATOM 170 CA GLN A 11 21.196 70.424 -16.285 1.00 0.00 C ATOM 171 C GLN A 11 21.057 68.966 -16.720 1.00 0.00 C ATOM 172 O GLN A 11 19.951 68.478 -16.944 1.00 0.00 O ATOM 173 CB GLN A 11 22.601 70.946 -16.618 1.00 0.00 C ATOM 174 CG GLN A 11 22.795 72.422 -16.319 1.00 0.00 C ATOM 175 CD GLN A 11 24.141 72.938 -16.790 1.00 0.00 C ATOM 176 OE1 GLN A 11 24.274 73.410 -17.917 1.00 0.00 O ATOM 177 NE2 GLN A 11 25.152 72.845 -15.940 1.00 0.00 N ATOM 0 H GLN A 11 20.100 71.191 -14.674 1.00 0.00 H new ATOM 0 HA GLN A 11 20.480 71.033 -16.837 1.00 0.00 H new ATOM 0 HB2 GLN A 11 23.335 70.371 -16.053 1.00 0.00 H new ATOM 0 HB3 GLN A 11 22.803 70.770 -17.675 1.00 0.00 H new ATOM 0 HG2 GLN A 11 22.002 72.994 -16.800 1.00 0.00 H new ATOM 0 HG3 GLN A 11 22.701 72.587 -15.246 1.00 0.00 H new ATOM 0 HE21 GLN A 11 25.004 72.447 -15.013 1.00 0.00 H new ATOM 0 HE22 GLN A 11 26.079 73.171 -16.213 1.00 0.00 H new ATOM 186 N SER A 12 22.178 68.267 -16.805 1.00 0.00 N ATOM 187 CA SER A 12 22.172 66.860 -17.165 1.00 0.00 C ATOM 188 C SER A 12 22.782 66.022 -16.050 1.00 0.00 C ATOM 189 O SER A 12 22.652 64.797 -16.035 1.00 0.00 O ATOM 190 CB SER A 12 22.945 66.645 -18.467 1.00 0.00 C ATOM 191 OG SER A 12 22.374 67.395 -19.525 1.00 0.00 O ATOM 0 H SER A 12 23.105 68.653 -16.629 1.00 0.00 H new ATOM 0 HA SER A 12 21.139 66.545 -17.311 1.00 0.00 H new ATOM 0 HB2 SER A 12 23.986 66.938 -18.329 1.00 0.00 H new ATOM 0 HB3 SER A 12 22.943 65.586 -18.725 1.00 0.00 H new ATOM 0 HG SER A 12 22.886 67.243 -20.347 1.00 0.00 H new ATOM 197 N ASN A 13 23.416 66.694 -15.101 1.00 0.00 N ATOM 198 CA ASN A 13 24.143 66.021 -14.037 1.00 0.00 C ATOM 199 C ASN A 13 23.294 65.920 -12.779 1.00 0.00 C ATOM 200 O ASN A 13 22.187 66.458 -12.717 1.00 0.00 O ATOM 201 CB ASN A 13 25.429 66.784 -13.722 1.00 0.00 C ATOM 202 CG ASN A 13 26.313 66.965 -14.938 1.00 0.00 C ATOM 203 OD1 ASN A 13 26.363 66.110 -15.822 1.00 0.00 O ATOM 204 ND2 ASN A 13 27.011 68.086 -14.993 1.00 0.00 N ATOM 0 H ASN A 13 23.441 67.712 -15.047 1.00 0.00 H new ATOM 0 HA ASN A 13 24.387 65.014 -14.376 1.00 0.00 H new ATOM 0 HB2 ASN A 13 25.176 67.762 -13.313 1.00 0.00 H new ATOM 0 HB3 ASN A 13 25.984 66.250 -12.951 1.00 0.00 H new ATOM 0 HD21 ASN A 13 27.620 68.269 -15.790 1.00 0.00 H new ATOM 0 HD22 ASN A 13 26.940 68.768 -14.238 1.00 0.00 H new ATOM 211 N CYS A 14 23.817 65.218 -11.789 1.00 0.00 N ATOM 212 CA CYS A 14 23.169 65.108 -10.491 1.00 0.00 C ATOM 213 C CYS A 14 24.211 65.235 -9.391 1.00 0.00 C ATOM 214 O CYS A 14 25.254 64.586 -9.439 1.00 0.00 O ATOM 215 CB CYS A 14 22.427 63.779 -10.361 1.00 0.00 C ATOM 216 SG CYS A 14 21.109 63.529 -11.592 1.00 0.00 S ATOM 0 H CYS A 14 24.699 64.710 -11.860 1.00 0.00 H new ATOM 0 HA CYS A 14 22.439 65.912 -10.396 1.00 0.00 H new ATOM 0 HB2 CYS A 14 23.147 62.965 -10.447 1.00 0.00 H new ATOM 0 HB3 CYS A 14 21.992 63.716 -9.363 1.00 0.00 H new ATOM 221 N TYR A 15 23.934 66.078 -8.412 1.00 0.00 N ATOM 222 CA TYR A 15 24.900 66.381 -7.368 1.00 0.00 C ATOM 223 C TYR A 15 24.347 66.019 -5.995 1.00 0.00 C ATOM 224 O TYR A 15 23.275 66.479 -5.607 1.00 0.00 O ATOM 225 CB TYR A 15 25.263 67.869 -7.421 1.00 0.00 C ATOM 226 CG TYR A 15 25.710 68.328 -8.794 1.00 0.00 C ATOM 227 CD1 TYR A 15 24.784 68.732 -9.750 1.00 0.00 C ATOM 228 CD2 TYR A 15 27.052 68.334 -9.142 1.00 0.00 C ATOM 229 CE1 TYR A 15 25.187 69.127 -11.012 1.00 0.00 C ATOM 230 CE2 TYR A 15 27.462 68.735 -10.400 1.00 0.00 C ATOM 231 CZ TYR A 15 26.525 69.128 -11.330 1.00 0.00 C ATOM 232 OH TYR A 15 26.927 69.508 -12.591 1.00 0.00 O ATOM 0 H TYR A 15 23.044 66.567 -8.317 1.00 0.00 H new ATOM 0 HA TYR A 15 25.797 65.785 -7.537 1.00 0.00 H new ATOM 0 HB2 TYR A 15 24.399 68.458 -7.112 1.00 0.00 H new ATOM 0 HB3 TYR A 15 26.058 68.068 -6.702 1.00 0.00 H new ATOM 0 HD1 TYR A 15 23.733 68.737 -9.502 1.00 0.00 H new ATOM 0 HD2 TYR A 15 27.790 68.020 -8.418 1.00 0.00 H new ATOM 0 HE1 TYR A 15 24.455 69.433 -11.744 1.00 0.00 H new ATOM 0 HE2 TYR A 15 28.512 68.740 -10.652 1.00 0.00 H new ATOM 0 HH TYR A 15 26.432 70.308 -12.865 1.00 0.00 H new ATOM 242 N PHE A 16 25.070 65.183 -5.272 1.00 0.00 N ATOM 243 CA PHE A 16 24.667 64.784 -3.931 1.00 0.00 C ATOM 244 C PHE A 16 25.720 65.217 -2.914 1.00 0.00 C ATOM 245 O PHE A 16 26.872 64.782 -2.982 1.00 0.00 O ATOM 246 CB PHE A 16 24.459 63.268 -3.867 1.00 0.00 C ATOM 247 CG PHE A 16 23.918 62.782 -2.551 1.00 0.00 C ATOM 248 CD1 PHE A 16 22.571 62.907 -2.253 1.00 0.00 C ATOM 249 CD2 PHE A 16 24.756 62.197 -1.615 1.00 0.00 C ATOM 250 CE1 PHE A 16 22.070 62.459 -1.047 1.00 0.00 C ATOM 251 CE2 PHE A 16 24.259 61.747 -0.406 1.00 0.00 C ATOM 252 CZ PHE A 16 22.915 61.879 -0.122 1.00 0.00 C ATOM 0 H PHE A 16 25.944 64.764 -5.591 1.00 0.00 H new ATOM 0 HA PHE A 16 23.724 65.275 -3.689 1.00 0.00 H new ATOM 0 HB2 PHE A 16 23.775 62.971 -4.662 1.00 0.00 H new ATOM 0 HB3 PHE A 16 25.410 62.772 -4.063 1.00 0.00 H new ATOM 0 HD1 PHE A 16 21.905 63.360 -2.972 1.00 0.00 H new ATOM 0 HD2 PHE A 16 25.809 62.092 -1.832 1.00 0.00 H new ATOM 0 HE1 PHE A 16 21.018 62.562 -0.827 1.00 0.00 H new ATOM 0 HE2 PHE A 16 24.922 61.293 0.315 1.00 0.00 H new ATOM 0 HZ PHE A 16 22.525 61.529 0.822 1.00 0.00 H new ATOM 262 N PRO A 17 25.347 66.105 -1.981 1.00 0.00 N ATOM 263 CA PRO A 17 26.240 66.582 -0.932 1.00 0.00 C ATOM 264 C PRO A 17 26.269 65.648 0.275 1.00 0.00 C ATOM 265 O PRO A 17 25.230 65.180 0.736 1.00 0.00 O ATOM 266 CB PRO A 17 25.642 67.943 -0.537 1.00 0.00 C ATOM 267 CG PRO A 17 24.368 68.092 -1.319 1.00 0.00 C ATOM 268 CD PRO A 17 24.033 66.737 -1.877 1.00 0.00 C ATOM 0 HA PRO A 17 27.272 66.639 -1.277 1.00 0.00 H new ATOM 0 HB2 PRO A 17 25.447 67.985 0.535 1.00 0.00 H new ATOM 0 HB3 PRO A 17 26.335 68.753 -0.766 1.00 0.00 H new ATOM 0 HG2 PRO A 17 23.563 68.455 -0.680 1.00 0.00 H new ATOM 0 HG3 PRO A 17 24.491 68.820 -2.121 1.00 0.00 H new ATOM 0 HD2 PRO A 17 23.366 66.181 -1.219 1.00 0.00 H new ATOM 0 HD3 PRO A 17 23.539 66.808 -2.846 1.00 0.00 H new ATOM 276 N LEU A 18 27.464 65.375 0.778 1.00 0.00 N ATOM 277 CA LEU A 18 27.624 64.547 1.964 1.00 0.00 C ATOM 278 C LEU A 18 28.382 65.323 3.034 1.00 0.00 C ATOM 279 O LEU A 18 29.339 66.040 2.733 1.00 0.00 O ATOM 280 CB LEU A 18 28.372 63.245 1.642 1.00 0.00 C ATOM 281 CG LEU A 18 27.752 62.368 0.549 1.00 0.00 C ATOM 282 CD1 LEU A 18 28.275 62.761 -0.825 1.00 0.00 C ATOM 283 CD2 LEU A 18 28.028 60.899 0.826 1.00 0.00 C ATOM 0 H LEU A 18 28.340 65.716 0.382 1.00 0.00 H new ATOM 0 HA LEU A 18 26.631 64.285 2.330 1.00 0.00 H new ATOM 0 HB2 LEU A 18 29.390 63.498 1.344 1.00 0.00 H new ATOM 0 HB3 LEU A 18 28.445 62.655 2.556 1.00 0.00 H new ATOM 0 HG LEU A 18 26.673 62.526 0.558 1.00 0.00 H new ATOM 0 HD11 LEU A 18 27.820 62.124 -1.583 1.00 0.00 H new ATOM 0 HD12 LEU A 18 28.022 63.802 -1.026 1.00 0.00 H new ATOM 0 HD13 LEU A 18 29.358 62.639 -0.851 1.00 0.00 H new ATOM 0 HD21 LEU A 18 27.581 60.290 0.040 1.00 0.00 H new ATOM 0 HD22 LEU A 18 29.104 60.729 0.848 1.00 0.00 H new ATOM 0 HD23 LEU A 18 27.597 60.623 1.788 1.00 0.00 H new ATOM 295 N THR A 19 27.950 65.183 4.276 1.00 0.00 N ATOM 296 CA THR A 19 28.567 65.889 5.387 1.00 0.00 C ATOM 297 C THR A 19 29.370 64.936 6.266 1.00 0.00 C ATOM 298 O THR A 19 29.623 65.219 7.437 1.00 0.00 O ATOM 299 CB THR A 19 27.501 66.597 6.243 1.00 0.00 C ATOM 300 OG1 THR A 19 26.427 65.690 6.529 1.00 0.00 O ATOM 301 CG2 THR A 19 26.958 67.828 5.533 1.00 0.00 C ATOM 0 H THR A 19 27.169 64.583 4.542 1.00 0.00 H new ATOM 0 HA THR A 19 29.242 66.634 4.966 1.00 0.00 H new ATOM 0 HB THR A 19 27.968 66.917 7.174 1.00 0.00 H new ATOM 0 HG1 THR A 19 25.752 66.144 7.075 1.00 0.00 H new ATOM 0 HG21 THR A 19 26.207 68.308 6.160 1.00 0.00 H new ATOM 0 HG22 THR A 19 27.772 68.527 5.342 1.00 0.00 H new ATOM 0 HG23 THR A 19 26.505 67.532 4.587 1.00 0.00 H new ATOM 309 N ASP A 20 29.777 63.813 5.691 1.00 0.00 N ATOM 310 CA ASP A 20 30.533 62.809 6.427 1.00 0.00 C ATOM 311 C ASP A 20 32.023 63.122 6.361 1.00 0.00 C ATOM 312 O ASP A 20 32.443 64.012 5.621 1.00 0.00 O ATOM 313 CB ASP A 20 30.254 61.404 5.873 1.00 0.00 C ATOM 314 CG ASP A 20 30.787 61.191 4.465 1.00 0.00 C ATOM 315 OD1 ASP A 20 30.583 62.067 3.599 1.00 0.00 O ATOM 316 OD2 ASP A 20 31.405 60.136 4.216 1.00 0.00 O ATOM 0 H ASP A 20 29.596 63.574 4.716 1.00 0.00 H new ATOM 0 HA ASP A 20 30.215 62.832 7.469 1.00 0.00 H new ATOM 0 HB2 ASP A 20 30.700 60.665 6.538 1.00 0.00 H new ATOM 0 HB3 ASP A 20 29.178 61.228 5.876 1.00 0.00 H new ATOM 321 N ASN A 21 32.814 62.408 7.148 1.00 0.00 N ATOM 322 CA ASN A 21 34.253 62.630 7.181 1.00 0.00 C ATOM 323 C ASN A 21 34.963 61.648 6.258 1.00 0.00 C ATOM 324 O ASN A 21 34.903 60.434 6.451 1.00 0.00 O ATOM 325 CB ASN A 21 34.793 62.526 8.619 1.00 0.00 C ATOM 326 CG ASN A 21 34.583 61.159 9.251 1.00 0.00 C ATOM 327 OD1 ASN A 21 33.498 60.854 9.747 1.00 0.00 O ATOM 328 ND2 ASN A 21 35.627 60.341 9.277 1.00 0.00 N ATOM 0 H ASN A 21 32.485 61.671 7.772 1.00 0.00 H new ATOM 0 HA ASN A 21 34.453 63.640 6.824 1.00 0.00 H new ATOM 0 HB2 ASN A 21 35.859 62.755 8.615 1.00 0.00 H new ATOM 0 HB3 ASN A 21 34.306 63.281 9.236 1.00 0.00 H new ATOM 0 HD21 ASN A 21 35.546 59.425 9.718 1.00 0.00 H new ATOM 0 HD22 ASN A 21 36.510 60.628 8.856 1.00 0.00 H new ATOM 335 N LYS A 22 35.601 62.183 5.230 1.00 0.00 N ATOM 336 CA LYS A 22 36.342 61.377 4.270 1.00 0.00 C ATOM 337 C LYS A 22 37.523 62.155 3.735 1.00 0.00 C ATOM 338 O LYS A 22 37.459 63.374 3.603 1.00 0.00 O ATOM 339 CB LYS A 22 35.447 60.963 3.106 1.00 0.00 C ATOM 340 CG LYS A 22 34.532 59.793 3.419 1.00 0.00 C ATOM 341 CD LYS A 22 35.281 58.471 3.366 1.00 0.00 C ATOM 342 CE LYS A 22 35.307 57.759 4.711 1.00 0.00 C ATOM 343 NZ LYS A 22 36.383 58.269 5.609 1.00 0.00 N ATOM 0 H LYS A 22 35.621 63.184 5.037 1.00 0.00 H new ATOM 0 HA LYS A 22 36.695 60.483 4.784 1.00 0.00 H new ATOM 0 HB2 LYS A 22 34.839 61.817 2.806 1.00 0.00 H new ATOM 0 HB3 LYS A 22 36.074 60.703 2.253 1.00 0.00 H new ATOM 0 HG2 LYS A 22 34.095 59.926 4.409 1.00 0.00 H new ATOM 0 HG3 LYS A 22 33.707 59.774 2.707 1.00 0.00 H new ATOM 0 HD2 LYS A 22 34.814 57.823 2.625 1.00 0.00 H new ATOM 0 HD3 LYS A 22 36.304 58.650 3.034 1.00 0.00 H new ATOM 0 HE2 LYS A 22 34.341 57.881 5.201 1.00 0.00 H new ATOM 0 HE3 LYS A 22 35.450 56.690 4.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 36.550 57.584 6.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 37.258 58.399 5.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 36.091 59.180 6.018 1.00 0.00 H new ATOM 357 N THR A 23 38.601 61.452 3.446 1.00 0.00 N ATOM 358 CA THR A 23 39.728 62.052 2.758 1.00 0.00 C ATOM 359 C THR A 23 39.359 62.249 1.297 1.00 0.00 C ATOM 360 O THR A 23 38.354 61.703 0.832 1.00 0.00 O ATOM 361 CB THR A 23 40.990 61.170 2.845 1.00 0.00 C ATOM 362 OG1 THR A 23 40.686 59.840 2.408 1.00 0.00 O ATOM 363 CG2 THR A 23 41.540 61.129 4.261 1.00 0.00 C ATOM 0 H THR A 23 38.720 60.466 3.677 1.00 0.00 H new ATOM 0 HA THR A 23 39.952 63.005 3.237 1.00 0.00 H new ATOM 0 HB THR A 23 41.750 61.606 2.197 1.00 0.00 H new ATOM 0 HG1 THR A 23 41.492 59.285 2.464 1.00 0.00 H new ATOM 0 HG21 THR A 23 42.429 60.499 4.288 1.00 0.00 H new ATOM 0 HG22 THR A 23 41.801 62.138 4.579 1.00 0.00 H new ATOM 0 HG23 THR A 23 40.785 60.720 4.933 1.00 0.00 H new ATOM 371 N TRP A 24 40.153 63.010 0.563 1.00 0.00 N ATOM 372 CA TRP A 24 39.883 63.197 -0.852 1.00 0.00 C ATOM 373 C TRP A 24 40.062 61.870 -1.581 1.00 0.00 C ATOM 374 O TRP A 24 39.324 61.548 -2.510 1.00 0.00 O ATOM 375 CB TRP A 24 40.795 64.265 -1.450 1.00 0.00 C ATOM 376 CG TRP A 24 40.341 64.722 -2.799 1.00 0.00 C ATOM 377 CD1 TRP A 24 39.456 65.723 -3.064 1.00 0.00 C ATOM 378 CD2 TRP A 24 40.738 64.190 -4.066 1.00 0.00 C ATOM 379 NE1 TRP A 24 39.279 65.850 -4.417 1.00 0.00 N ATOM 380 CE2 TRP A 24 40.055 64.921 -5.055 1.00 0.00 C ATOM 381 CE3 TRP A 24 41.607 63.170 -4.461 1.00 0.00 C ATOM 382 CZ2 TRP A 24 40.211 64.663 -6.411 1.00 0.00 C ATOM 383 CZ3 TRP A 24 41.761 62.915 -5.808 1.00 0.00 C ATOM 384 CH2 TRP A 24 41.067 63.659 -6.769 1.00 0.00 C ATOM 0 H TRP A 24 40.975 63.500 0.915 1.00 0.00 H new ATOM 0 HA TRP A 24 38.855 63.539 -0.971 1.00 0.00 H new ATOM 0 HB2 TRP A 24 40.836 65.121 -0.776 1.00 0.00 H new ATOM 0 HB3 TRP A 24 41.808 63.870 -1.527 1.00 0.00 H new ATOM 0 HD1 TRP A 24 38.965 66.329 -2.316 1.00 0.00 H new ATOM 0 HE1 TRP A 24 38.668 66.527 -4.874 1.00 0.00 H new ATOM 0 HE3 TRP A 24 42.148 62.592 -3.726 1.00 0.00 H new ATOM 0 HZ2 TRP A 24 39.676 65.234 -7.155 1.00 0.00 H new ATOM 0 HZ3 TRP A 24 42.428 62.128 -6.126 1.00 0.00 H new ATOM 0 HH2 TRP A 24 41.211 63.435 -7.816 1.00 0.00 H new ATOM 395 N ALA A 25 41.027 61.086 -1.116 1.00 0.00 N ATOM 396 CA ALA A 25 41.286 59.773 -1.684 1.00 0.00 C ATOM 397 C ALA A 25 40.091 58.845 -1.482 1.00 0.00 C ATOM 398 O ALA A 25 39.702 58.115 -2.388 1.00 0.00 O ATOM 399 CB ALA A 25 42.540 59.171 -1.068 1.00 0.00 C ATOM 0 H ALA A 25 41.644 61.340 -0.344 1.00 0.00 H new ATOM 0 HA ALA A 25 41.444 59.889 -2.756 1.00 0.00 H new ATOM 0 HB1 ALA A 25 42.723 58.188 -1.502 1.00 0.00 H new ATOM 0 HB2 ALA A 25 43.392 59.820 -1.269 1.00 0.00 H new ATOM 0 HB3 ALA A 25 42.405 59.073 0.009 1.00 0.00 H new ATOM 405 N GLU A 26 39.499 58.880 -0.291 1.00 0.00 N ATOM 406 CA GLU A 26 38.364 58.016 0.005 1.00 0.00 C ATOM 407 C GLU A 26 37.079 58.528 -0.631 1.00 0.00 C ATOM 408 O GLU A 26 36.212 57.738 -0.986 1.00 0.00 O ATOM 409 CB GLU A 26 38.153 57.861 1.506 1.00 0.00 C ATOM 410 CG GLU A 26 39.219 57.036 2.198 1.00 0.00 C ATOM 411 CD GLU A 26 38.765 56.574 3.563 1.00 0.00 C ATOM 412 OE1 GLU A 26 38.600 57.432 4.451 1.00 0.00 O ATOM 413 OE2 GLU A 26 38.533 55.357 3.732 1.00 0.00 O ATOM 0 H GLU A 26 39.783 59.490 0.475 1.00 0.00 H new ATOM 0 HA GLU A 26 38.603 57.043 -0.423 1.00 0.00 H new ATOM 0 HB2 GLU A 26 38.122 58.851 1.962 1.00 0.00 H new ATOM 0 HB3 GLU A 26 37.181 57.399 1.680 1.00 0.00 H new ATOM 0 HG2 GLU A 26 39.466 56.170 1.584 1.00 0.00 H new ATOM 0 HG3 GLU A 26 40.130 57.627 2.297 1.00 0.00 H new ATOM 420 N SER A 27 36.940 59.838 -0.760 1.00 0.00 N ATOM 421 CA SER A 27 35.759 60.396 -1.405 1.00 0.00 C ATOM 422 C SER A 27 35.757 60.068 -2.900 1.00 0.00 C ATOM 423 O SER A 27 34.711 59.739 -3.462 1.00 0.00 O ATOM 424 CB SER A 27 35.662 61.904 -1.156 1.00 0.00 C ATOM 425 OG SER A 27 36.908 62.540 -1.339 1.00 0.00 O ATOM 0 H SER A 27 37.618 60.527 -0.433 1.00 0.00 H new ATOM 0 HA SER A 27 34.874 59.937 -0.964 1.00 0.00 H new ATOM 0 HB2 SER A 27 34.927 62.339 -1.834 1.00 0.00 H new ATOM 0 HB3 SER A 27 35.306 62.084 -0.142 1.00 0.00 H new ATOM 0 HG SER A 27 37.463 62.408 -0.542 1.00 0.00 H new ATOM 431 N GLU A 28 36.931 60.132 -3.529 1.00 0.00 N ATOM 432 CA GLU A 28 37.086 59.704 -4.919 1.00 0.00 C ATOM 433 C GLU A 28 36.855 58.195 -5.029 1.00 0.00 C ATOM 434 O GLU A 28 36.326 57.705 -6.025 1.00 0.00 O ATOM 435 CB GLU A 28 38.488 60.062 -5.431 1.00 0.00 C ATOM 436 CG GLU A 28 38.734 59.678 -6.884 1.00 0.00 C ATOM 437 CD GLU A 28 40.180 59.867 -7.307 1.00 0.00 C ATOM 438 OE1 GLU A 28 41.021 59.013 -6.964 1.00 0.00 O ATOM 439 OE2 GLU A 28 40.486 60.870 -7.990 1.00 0.00 O ATOM 0 H GLU A 28 37.789 60.476 -3.097 1.00 0.00 H new ATOM 0 HA GLU A 28 36.348 60.221 -5.532 1.00 0.00 H new ATOM 0 HB2 GLU A 28 38.641 61.135 -5.319 1.00 0.00 H new ATOM 0 HB3 GLU A 28 39.230 59.567 -4.804 1.00 0.00 H new ATOM 0 HG2 GLU A 28 38.450 58.636 -7.032 1.00 0.00 H new ATOM 0 HG3 GLU A 28 38.091 60.278 -7.527 1.00 0.00 H new ATOM 446 N ARG A 29 37.251 57.480 -3.979 1.00 0.00 N ATOM 447 CA ARG A 29 37.121 56.032 -3.903 1.00 0.00 C ATOM 448 C ARG A 29 35.668 55.594 -3.691 1.00 0.00 C ATOM 449 O ARG A 29 35.213 54.619 -4.287 1.00 0.00 O ATOM 450 CB ARG A 29 38.004 55.529 -2.760 1.00 0.00 C ATOM 451 CG ARG A 29 37.749 54.096 -2.344 1.00 0.00 C ATOM 452 CD ARG A 29 38.713 53.677 -1.248 1.00 0.00 C ATOM 453 NE ARG A 29 38.135 52.685 -0.340 1.00 0.00 N ATOM 454 CZ ARG A 29 38.112 52.834 0.987 1.00 0.00 C ATOM 455 NH1 ARG A 29 38.650 53.916 1.532 1.00 0.00 N ATOM 456 NH2 ARG A 29 37.561 51.906 1.763 1.00 0.00 N ATOM 0 H ARG A 29 37.675 57.896 -3.150 1.00 0.00 H new ATOM 0 HA ARG A 29 37.441 55.600 -4.851 1.00 0.00 H new ATOM 0 HB2 ARG A 29 39.048 55.626 -3.057 1.00 0.00 H new ATOM 0 HB3 ARG A 29 37.857 56.175 -1.895 1.00 0.00 H new ATOM 0 HG2 ARG A 29 36.723 53.991 -1.992 1.00 0.00 H new ATOM 0 HG3 ARG A 29 37.860 53.437 -3.205 1.00 0.00 H new ATOM 0 HD2 ARG A 29 39.616 53.268 -1.700 1.00 0.00 H new ATOM 0 HD3 ARG A 29 39.013 54.556 -0.677 1.00 0.00 H new ATOM 0 HE ARG A 29 37.730 51.839 -0.740 1.00 0.00 H new ATOM 0 HH11 ARG A 29 39.077 54.627 0.939 1.00 0.00 H new ATOM 0 HH12 ARG A 29 38.637 54.037 2.545 1.00 0.00 H new ATOM 0 HH21 ARG A 29 37.151 51.070 1.346 1.00 0.00 H new ATOM 0 HH22 ARG A 29 37.549 52.029 2.775 1.00 0.00 H new ATOM 470 N ASN A 30 34.952 56.299 -2.821 1.00 0.00 N ATOM 471 CA ASN A 30 33.554 55.976 -2.546 1.00 0.00 C ATOM 472 C ASN A 30 32.677 56.420 -3.712 1.00 0.00 C ATOM 473 O ASN A 30 31.660 55.797 -4.020 1.00 0.00 O ATOM 474 CB ASN A 30 33.090 56.632 -1.240 1.00 0.00 C ATOM 475 CG ASN A 30 31.675 56.232 -0.849 1.00 0.00 C ATOM 476 OD1 ASN A 30 30.947 57.015 -0.244 1.00 0.00 O ATOM 477 ND2 ASN A 30 31.279 55.011 -1.178 1.00 0.00 N ATOM 0 H ASN A 30 35.314 57.095 -2.295 1.00 0.00 H new ATOM 0 HA ASN A 30 33.463 54.896 -2.430 1.00 0.00 H new ATOM 0 HB2 ASN A 30 33.775 56.358 -0.438 1.00 0.00 H new ATOM 0 HB3 ASN A 30 33.140 57.716 -1.345 1.00 0.00 H new ATOM 0 HD21 ASN A 30 30.342 54.694 -0.929 1.00 0.00 H new ATOM 0 HD22 ASN A 30 31.911 54.388 -1.681 1.00 0.00 H new ATOM 484 N CYS A 31 33.085 57.495 -4.363 1.00 0.00 N ATOM 485 CA CYS A 31 32.467 57.907 -5.608 1.00 0.00 C ATOM 486 C CYS A 31 33.123 57.140 -6.750 1.00 0.00 C ATOM 487 O CYS A 31 33.997 56.313 -6.506 1.00 0.00 O ATOM 488 CB CYS A 31 32.586 59.422 -5.813 1.00 0.00 C ATOM 489 SG CYS A 31 31.552 60.405 -4.682 1.00 0.00 S ATOM 0 H CYS A 31 33.844 58.099 -4.048 1.00 0.00 H new ATOM 0 HA CYS A 31 31.402 57.678 -5.580 1.00 0.00 H new ATOM 0 HB2 CYS A 31 33.628 59.715 -5.684 1.00 0.00 H new ATOM 0 HB3 CYS A 31 32.312 59.662 -6.840 1.00 0.00 H new ATOM 494 N SER A 32 32.656 57.361 -7.974 1.00 0.00 N ATOM 495 CA SER A 32 33.164 56.655 -9.157 1.00 0.00 C ATOM 496 C SER A 32 32.629 55.226 -9.215 1.00 0.00 C ATOM 497 O SER A 32 32.179 54.772 -10.265 1.00 0.00 O ATOM 498 CB SER A 32 34.697 56.677 -9.210 1.00 0.00 C ATOM 499 OG SER A 32 35.188 58.012 -9.191 1.00 0.00 O ATOM 0 H SER A 32 31.916 58.032 -8.180 1.00 0.00 H new ATOM 0 HA SER A 32 32.800 57.184 -10.038 1.00 0.00 H new ATOM 0 HB2 SER A 32 35.102 56.125 -8.362 1.00 0.00 H new ATOM 0 HB3 SER A 32 35.041 56.172 -10.113 1.00 0.00 H new ATOM 0 HG SER A 32 36.167 58.001 -9.224 1.00 0.00 H new ATOM 505 N GLY A 33 32.657 54.532 -8.083 1.00 0.00 N ATOM 506 CA GLY A 33 32.049 53.216 -7.995 1.00 0.00 C ATOM 507 C GLY A 33 30.549 53.267 -8.226 1.00 0.00 C ATOM 508 O GLY A 33 29.938 52.279 -8.623 1.00 0.00 O ATOM 0 H GLY A 33 33.092 54.859 -7.220 1.00 0.00 H new ATOM 0 HA2 GLY A 33 32.507 52.555 -8.731 1.00 0.00 H new ATOM 0 HA3 GLY A 33 32.250 52.788 -7.013 1.00 0.00 H new ATOM 512 N MET A 34 29.958 54.433 -7.979 1.00 0.00 N ATOM 513 CA MET A 34 28.532 54.645 -8.223 1.00 0.00 C ATOM 514 C MET A 34 28.302 55.177 -9.634 1.00 0.00 C ATOM 515 O MET A 34 27.189 55.556 -9.987 1.00 0.00 O ATOM 516 CB MET A 34 27.946 55.641 -7.213 1.00 0.00 C ATOM 517 CG MET A 34 27.975 55.162 -5.771 1.00 0.00 C ATOM 518 SD MET A 34 27.214 56.337 -4.633 1.00 0.00 S ATOM 519 CE MET A 34 28.335 57.726 -4.777 1.00 0.00 C ATOM 0 H MET A 34 30.446 55.249 -7.609 1.00 0.00 H new ATOM 0 HA MET A 34 28.033 53.683 -8.110 1.00 0.00 H new ATOM 0 HB2 MET A 34 28.498 56.578 -7.283 1.00 0.00 H new ATOM 0 HB3 MET A 34 26.914 55.857 -7.491 1.00 0.00 H new ATOM 0 HG2 MET A 34 27.457 54.206 -5.699 1.00 0.00 H new ATOM 0 HG3 MET A 34 29.008 54.988 -5.471 1.00 0.00 H new ATOM 0 HE1 MET A 34 28.151 58.428 -3.964 1.00 0.00 H new ATOM 0 HE2 MET A 34 29.364 57.370 -4.723 1.00 0.00 H new ATOM 0 HE3 MET A 34 28.174 58.226 -5.732 1.00 0.00 H new ATOM 529 N GLY A 35 29.364 55.214 -10.432 1.00 0.00 N ATOM 530 CA GLY A 35 29.278 55.801 -11.758 1.00 0.00 C ATOM 531 C GLY A 35 29.395 57.311 -11.704 1.00 0.00 C ATOM 532 O GLY A 35 29.297 57.997 -12.719 1.00 0.00 O ATOM 0 H GLY A 35 30.283 54.848 -10.185 1.00 0.00 H new ATOM 0 HA2 GLY A 35 30.069 55.396 -12.389 1.00 0.00 H new ATOM 0 HA3 GLY A 35 28.330 55.524 -12.219 1.00 0.00 H new ATOM 536 N ALA A 36 29.616 57.820 -10.501 1.00 0.00 N ATOM 537 CA ALA A 36 29.699 59.250 -10.266 1.00 0.00 C ATOM 538 C ALA A 36 31.150 59.700 -10.138 1.00 0.00 C ATOM 539 O ALA A 36 32.068 58.914 -10.318 1.00 0.00 O ATOM 540 CB ALA A 36 28.923 59.609 -9.008 1.00 0.00 C ATOM 0 H ALA A 36 29.742 57.253 -9.663 1.00 0.00 H new ATOM 0 HA ALA A 36 29.261 59.767 -11.120 1.00 0.00 H new ATOM 0 HB1 ALA A 36 28.988 60.683 -8.835 1.00 0.00 H new ATOM 0 HB2 ALA A 36 27.878 59.323 -9.131 1.00 0.00 H new ATOM 0 HB3 ALA A 36 29.346 59.078 -8.155 1.00 0.00 H new ATOM 546 N HIS A 37 31.340 60.972 -9.849 1.00 0.00 N ATOM 547 CA HIS A 37 32.655 61.540 -9.580 1.00 0.00 C ATOM 548 C HIS A 37 32.504 62.593 -8.501 1.00 0.00 C ATOM 549 O HIS A 37 31.388 62.921 -8.130 1.00 0.00 O ATOM 550 CB HIS A 37 33.268 62.180 -10.830 1.00 0.00 C ATOM 551 CG HIS A 37 33.595 61.217 -11.929 1.00 0.00 C ATOM 552 ND1 HIS A 37 33.336 61.279 -13.255 1.00 0.00 N flip ATOM 553 CD2 HIS A 37 34.270 60.029 -11.727 1.00 0.00 C flip ATOM 554 CE1 HIS A 37 33.850 60.141 -13.826 1.00 0.00 C flip ATOM 555 NE2 HIS A 37 34.410 59.406 -12.882 1.00 0.00 N flip ATOM 0 H HIS A 37 30.581 61.651 -9.793 1.00 0.00 H new ATOM 0 HA HIS A 37 33.322 60.739 -9.261 1.00 0.00 H new ATOM 0 HB2 HIS A 37 32.576 62.929 -11.215 1.00 0.00 H new ATOM 0 HB3 HIS A 37 34.179 62.706 -10.543 1.00 0.00 H new ATOM 0 HD1 HIS A 37 32.849 62.032 -13.741 1.00 0.00 H new ATOM 0 HD2 HIS A 37 34.627 59.667 -10.774 1.00 0.00 H new ATOM 0 HE1 HIS A 37 33.804 59.888 -14.875 1.00 0.00 H new ATOM 564 N LEU A 38 33.602 63.101 -7.973 1.00 0.00 N ATOM 565 CA LEU A 38 33.518 64.194 -7.015 1.00 0.00 C ATOM 566 C LEU A 38 33.029 65.464 -7.704 1.00 0.00 C ATOM 567 O LEU A 38 33.047 65.552 -8.934 1.00 0.00 O ATOM 568 CB LEU A 38 34.866 64.433 -6.339 1.00 0.00 C ATOM 569 CG LEU A 38 35.293 63.336 -5.365 1.00 0.00 C ATOM 570 CD1 LEU A 38 36.634 63.674 -4.742 1.00 0.00 C ATOM 571 CD2 LEU A 38 34.238 63.147 -4.286 1.00 0.00 C ATOM 0 H LEU A 38 34.548 62.783 -8.184 1.00 0.00 H new ATOM 0 HA LEU A 38 32.800 63.918 -6.243 1.00 0.00 H new ATOM 0 HB2 LEU A 38 35.631 64.535 -7.109 1.00 0.00 H new ATOM 0 HB3 LEU A 38 34.826 65.381 -5.803 1.00 0.00 H new ATOM 0 HG LEU A 38 35.395 62.402 -5.917 1.00 0.00 H new ATOM 0 HD11 LEU A 38 36.924 62.883 -4.051 1.00 0.00 H new ATOM 0 HD12 LEU A 38 37.386 63.765 -5.525 1.00 0.00 H new ATOM 0 HD13 LEU A 38 36.557 64.617 -4.202 1.00 0.00 H new ATOM 0 HD21 LEU A 38 34.556 62.362 -3.600 1.00 0.00 H new ATOM 0 HD22 LEU A 38 34.109 64.079 -3.736 1.00 0.00 H new ATOM 0 HD23 LEU A 38 33.292 62.864 -4.748 1.00 0.00 H new ATOM 583 N MET A 39 32.578 66.428 -6.905 1.00 0.00 N ATOM 584 CA MET A 39 32.019 67.676 -7.421 1.00 0.00 C ATOM 585 C MET A 39 32.973 68.367 -8.383 1.00 0.00 C ATOM 586 O MET A 39 33.947 69.001 -7.973 1.00 0.00 O ATOM 587 CB MET A 39 31.674 68.626 -6.274 1.00 0.00 C ATOM 588 CG MET A 39 31.145 69.974 -6.743 1.00 0.00 C ATOM 589 SD MET A 39 29.698 69.818 -7.804 1.00 0.00 S ATOM 590 CE MET A 39 29.400 71.531 -8.231 1.00 0.00 C ATOM 0 H MET A 39 32.589 66.367 -5.887 1.00 0.00 H new ATOM 0 HA MET A 39 31.111 67.419 -7.966 1.00 0.00 H new ATOM 0 HB2 MET A 39 30.929 68.155 -5.634 1.00 0.00 H new ATOM 0 HB3 MET A 39 32.563 68.785 -5.664 1.00 0.00 H new ATOM 0 HG2 MET A 39 30.891 70.582 -5.875 1.00 0.00 H new ATOM 0 HG3 MET A 39 31.932 70.501 -7.283 1.00 0.00 H new ATOM 0 HE1 MET A 39 28.336 71.749 -8.140 1.00 0.00 H new ATOM 0 HE2 MET A 39 29.961 72.177 -7.556 1.00 0.00 H new ATOM 0 HE3 MET A 39 29.721 71.711 -9.257 1.00 0.00 H new ATOM 600 N THR A 40 32.691 68.236 -9.660 1.00 0.00 N ATOM 601 CA THR A 40 33.496 68.861 -10.678 1.00 0.00 C ATOM 602 C THR A 40 32.766 70.063 -11.258 1.00 0.00 C ATOM 603 O THR A 40 31.799 69.924 -12.005 1.00 0.00 O ATOM 604 CB THR A 40 33.872 67.850 -11.775 1.00 0.00 C ATOM 605 OG1 THR A 40 32.713 67.117 -12.191 1.00 0.00 O ATOM 606 CG2 THR A 40 34.920 66.879 -11.253 1.00 0.00 C ATOM 0 H THR A 40 31.902 67.697 -10.017 1.00 0.00 H new ATOM 0 HA THR A 40 34.423 69.212 -10.225 1.00 0.00 H new ATOM 0 HB THR A 40 34.277 68.398 -12.626 1.00 0.00 H new ATOM 0 HG1 THR A 40 32.912 66.157 -12.180 1.00 0.00 H new ATOM 0 HG21 THR A 40 35.179 66.168 -12.037 1.00 0.00 H new ATOM 0 HG22 THR A 40 35.811 67.431 -10.955 1.00 0.00 H new ATOM 0 HG23 THR A 40 34.521 66.341 -10.393 1.00 0.00 H new ATOM 614 N ILE A 41 33.216 71.246 -10.863 1.00 0.00 N ATOM 615 CA ILE A 41 32.570 72.485 -11.258 1.00 0.00 C ATOM 616 C ILE A 41 32.880 72.820 -12.712 1.00 0.00 C ATOM 617 O ILE A 41 33.928 73.387 -13.028 1.00 0.00 O ATOM 618 CB ILE A 41 32.992 73.654 -10.340 1.00 0.00 C ATOM 619 CG1 ILE A 41 32.615 73.342 -8.887 1.00 0.00 C ATOM 620 CG2 ILE A 41 32.349 74.958 -10.791 1.00 0.00 C ATOM 621 CD1 ILE A 41 32.953 74.449 -7.912 1.00 0.00 C ATOM 0 H ILE A 41 34.033 71.371 -10.265 1.00 0.00 H new ATOM 0 HA ILE A 41 31.494 72.341 -11.155 1.00 0.00 H new ATOM 0 HB ILE A 41 34.074 73.773 -10.406 1.00 0.00 H new ATOM 0 HG12 ILE A 41 31.545 73.140 -8.835 1.00 0.00 H new ATOM 0 HG13 ILE A 41 33.126 72.431 -8.577 1.00 0.00 H new ATOM 0 HG21 ILE A 41 32.661 75.766 -10.129 1.00 0.00 H new ATOM 0 HG22 ILE A 41 32.660 75.184 -11.811 1.00 0.00 H new ATOM 0 HG23 ILE A 41 31.264 74.860 -10.756 1.00 0.00 H new ATOM 0 HD11 ILE A 41 32.655 74.152 -6.906 1.00 0.00 H new ATOM 0 HD12 ILE A 41 34.027 74.636 -7.932 1.00 0.00 H new ATOM 0 HD13 ILE A 41 32.421 75.357 -8.194 1.00 0.00 H new ATOM 633 N SER A 42 31.974 72.426 -13.592 1.00 0.00 N ATOM 634 CA SER A 42 32.100 72.718 -15.005 1.00 0.00 C ATOM 635 C SER A 42 31.705 74.163 -15.299 1.00 0.00 C ATOM 636 O SER A 42 32.358 74.850 -16.090 1.00 0.00 O ATOM 637 CB SER A 42 31.240 71.739 -15.805 1.00 0.00 C ATOM 638 OG SER A 42 30.108 71.326 -15.053 1.00 0.00 O ATOM 0 H SER A 42 31.137 71.898 -13.346 1.00 0.00 H new ATOM 0 HA SER A 42 33.142 72.598 -15.303 1.00 0.00 H new ATOM 0 HB2 SER A 42 30.913 72.210 -16.732 1.00 0.00 H new ATOM 0 HB3 SER A 42 31.835 70.869 -16.082 1.00 0.00 H new ATOM 0 HG SER A 42 29.395 71.992 -15.142 1.00 0.00 H new ATOM 644 N THR A 43 30.640 74.630 -14.661 1.00 0.00 N ATOM 645 CA THR A 43 30.195 75.994 -14.864 1.00 0.00 C ATOM 646 C THR A 43 30.121 76.763 -13.551 1.00 0.00 C ATOM 647 O THR A 43 30.060 76.188 -12.461 1.00 0.00 O ATOM 648 CB THR A 43 28.813 76.060 -15.548 1.00 0.00 C ATOM 649 OG1 THR A 43 27.810 75.532 -14.677 1.00 0.00 O ATOM 650 CG2 THR A 43 28.808 75.292 -16.862 1.00 0.00 C ATOM 0 H THR A 43 30.076 74.088 -14.006 1.00 0.00 H new ATOM 0 HA THR A 43 30.938 76.453 -15.516 1.00 0.00 H new ATOM 0 HB THR A 43 28.596 77.106 -15.764 1.00 0.00 H new ATOM 0 HG1 THR A 43 27.812 74.554 -14.731 1.00 0.00 H new ATOM 0 HG21 THR A 43 27.820 75.358 -17.318 1.00 0.00 H new ATOM 0 HG22 THR A 43 29.549 75.721 -17.537 1.00 0.00 H new ATOM 0 HG23 THR A 43 29.051 74.246 -16.673 1.00 0.00 H new ATOM 658 N GLU A 44 30.108 78.075 -13.676 1.00 0.00 N ATOM 659 CA GLU A 44 29.935 78.965 -12.545 1.00 0.00 C ATOM 660 C GLU A 44 28.528 78.810 -11.973 1.00 0.00 C ATOM 661 O GLU A 44 28.247 79.212 -10.845 1.00 0.00 O ATOM 662 CB GLU A 44 30.210 80.386 -13.023 1.00 0.00 C ATOM 663 CG GLU A 44 29.305 80.814 -14.163 1.00 0.00 C ATOM 664 CD GLU A 44 29.931 81.890 -15.019 1.00 0.00 C ATOM 665 OE1 GLU A 44 30.075 83.036 -14.552 1.00 0.00 O ATOM 666 OE2 GLU A 44 30.331 81.562 -16.158 1.00 0.00 O ATOM 0 H GLU A 44 30.218 78.556 -14.569 1.00 0.00 H new ATOM 0 HA GLU A 44 30.630 78.723 -11.741 1.00 0.00 H new ATOM 0 HB2 GLU A 44 30.084 81.075 -12.188 1.00 0.00 H new ATOM 0 HB3 GLU A 44 31.249 80.461 -13.344 1.00 0.00 H new ATOM 0 HG2 GLU A 44 29.072 79.949 -14.784 1.00 0.00 H new ATOM 0 HG3 GLU A 44 28.361 81.179 -13.757 1.00 0.00 H new ATOM 673 N ALA A 45 27.648 78.202 -12.765 1.00 0.00 N ATOM 674 CA ALA A 45 26.313 77.874 -12.308 1.00 0.00 C ATOM 675 C ALA A 45 26.342 76.611 -11.468 1.00 0.00 C ATOM 676 O ALA A 45 25.635 76.516 -10.468 1.00 0.00 O ATOM 677 CB ALA A 45 25.361 77.735 -13.475 1.00 0.00 C ATOM 0 H ALA A 45 27.843 77.929 -13.728 1.00 0.00 H new ATOM 0 HA ALA A 45 25.949 78.690 -11.684 1.00 0.00 H new ATOM 0 HB1 ALA A 45 24.366 77.489 -13.105 1.00 0.00 H new ATOM 0 HB2 ALA A 45 25.321 78.675 -14.026 1.00 0.00 H new ATOM 0 HB3 ALA A 45 25.709 76.941 -14.136 1.00 0.00 H new ATOM 683 N GLU A 46 27.173 75.649 -11.871 1.00 0.00 N ATOM 684 CA GLU A 46 27.445 74.478 -11.042 1.00 0.00 C ATOM 685 C GLU A 46 27.771 74.930 -9.627 1.00 0.00 C ATOM 686 O GLU A 46 27.200 74.438 -8.655 1.00 0.00 O ATOM 687 CB GLU A 46 28.633 73.679 -11.589 1.00 0.00 C ATOM 688 CG GLU A 46 28.272 72.329 -12.184 1.00 0.00 C ATOM 689 CD GLU A 46 27.533 72.437 -13.499 1.00 0.00 C ATOM 690 OE1 GLU A 46 28.106 73.004 -14.457 1.00 0.00 O ATOM 691 OE2 GLU A 46 26.387 71.950 -13.580 1.00 0.00 O ATOM 0 H GLU A 46 27.667 75.659 -12.763 1.00 0.00 H new ATOM 0 HA GLU A 46 26.560 73.842 -11.048 1.00 0.00 H new ATOM 0 HB2 GLU A 46 29.133 74.275 -12.352 1.00 0.00 H new ATOM 0 HB3 GLU A 46 29.351 73.525 -10.784 1.00 0.00 H new ATOM 0 HG2 GLU A 46 29.183 71.749 -12.333 1.00 0.00 H new ATOM 0 HG3 GLU A 46 27.656 71.778 -11.473 1.00 0.00 H new ATOM 698 N GLN A 47 28.680 75.894 -9.530 1.00 0.00 N ATOM 699 CA GLN A 47 29.091 76.428 -8.238 1.00 0.00 C ATOM 700 C GLN A 47 27.953 77.179 -7.544 1.00 0.00 C ATOM 701 O GLN A 47 27.582 76.847 -6.418 1.00 0.00 O ATOM 702 CB GLN A 47 30.286 77.368 -8.391 1.00 0.00 C ATOM 703 CG GLN A 47 30.764 77.942 -7.066 1.00 0.00 C ATOM 704 CD GLN A 47 31.785 79.043 -7.239 1.00 0.00 C ATOM 705 OE1 GLN A 47 31.779 79.755 -8.238 1.00 0.00 O ATOM 706 NE2 GLN A 47 32.662 79.197 -6.259 1.00 0.00 N ATOM 0 H GLN A 47 29.146 76.321 -10.331 1.00 0.00 H new ATOM 0 HA GLN A 47 29.373 75.574 -7.622 1.00 0.00 H new ATOM 0 HB2 GLN A 47 31.107 76.829 -8.864 1.00 0.00 H new ATOM 0 HB3 GLN A 47 30.015 78.186 -9.058 1.00 0.00 H new ATOM 0 HG2 GLN A 47 29.908 78.330 -6.513 1.00 0.00 H new ATOM 0 HG3 GLN A 47 31.197 77.143 -6.464 1.00 0.00 H new ATOM 0 HE21 GLN A 47 32.631 78.582 -5.446 1.00 0.00 H new ATOM 0 HE22 GLN A 47 33.368 79.930 -6.317 1.00 0.00 H new ATOM 715 N ASN A 48 27.396 78.183 -8.218 1.00 0.00 N ATOM 716 CA ASN A 48 26.451 79.100 -7.574 1.00 0.00 C ATOM 717 C ASN A 48 25.161 78.397 -7.168 1.00 0.00 C ATOM 718 O ASN A 48 24.473 78.832 -6.246 1.00 0.00 O ATOM 719 CB ASN A 48 26.160 80.317 -8.471 1.00 0.00 C ATOM 720 CG ASN A 48 24.995 80.153 -9.429 1.00 0.00 C ATOM 721 OD1 ASN A 48 25.309 80.124 -10.710 1.00 0.00 O flip ATOM 722 ND2 ASN A 48 23.831 80.134 -9.033 1.00 0.00 N flip ATOM 0 H ASN A 48 27.579 78.383 -9.201 1.00 0.00 H new ATOM 0 HA ASN A 48 26.924 79.459 -6.660 1.00 0.00 H new ATOM 0 HB2 ASN A 48 25.966 81.179 -7.833 1.00 0.00 H new ATOM 0 HB3 ASN A 48 27.056 80.544 -9.050 1.00 0.00 H new ATOM 0 HD21 ASN A 48 23.632 80.158 -8.033 1.00 0.00 H new ATOM 0 HD22 ASN A 48 23.064 80.094 -9.705 1.00 0.00 H new ATOM 729 N PHE A 49 24.838 77.313 -7.848 1.00 0.00 N ATOM 730 CA PHE A 49 23.647 76.544 -7.511 1.00 0.00 C ATOM 731 C PHE A 49 23.924 75.496 -6.434 1.00 0.00 C ATOM 732 O PHE A 49 23.070 75.242 -5.587 1.00 0.00 O ATOM 733 CB PHE A 49 23.042 75.889 -8.756 1.00 0.00 C ATOM 734 CG PHE A 49 22.204 76.832 -9.574 1.00 0.00 C ATOM 735 CD1 PHE A 49 20.860 77.004 -9.286 1.00 0.00 C ATOM 736 CD2 PHE A 49 22.756 77.546 -10.625 1.00 0.00 C ATOM 737 CE1 PHE A 49 20.082 77.870 -10.031 1.00 0.00 C ATOM 738 CE2 PHE A 49 21.983 78.412 -11.374 1.00 0.00 C ATOM 739 CZ PHE A 49 20.645 78.575 -11.077 1.00 0.00 C ATOM 0 H PHE A 49 25.377 76.944 -8.632 1.00 0.00 H new ATOM 0 HA PHE A 49 22.922 77.248 -7.103 1.00 0.00 H new ATOM 0 HB2 PHE A 49 23.846 75.495 -9.378 1.00 0.00 H new ATOM 0 HB3 PHE A 49 22.430 75.041 -8.451 1.00 0.00 H new ATOM 0 HD1 PHE A 49 20.415 76.455 -8.470 1.00 0.00 H new ATOM 0 HD2 PHE A 49 23.803 77.424 -10.862 1.00 0.00 H new ATOM 0 HE1 PHE A 49 19.035 77.995 -9.796 1.00 0.00 H new ATOM 0 HE2 PHE A 49 22.426 78.961 -12.192 1.00 0.00 H new ATOM 0 HZ PHE A 49 20.040 79.252 -11.661 1.00 0.00 H new ATOM 749 N ILE A 50 25.113 74.898 -6.436 1.00 0.00 N ATOM 750 CA ILE A 50 25.409 73.843 -5.468 1.00 0.00 C ATOM 751 C ILE A 50 25.573 74.416 -4.057 1.00 0.00 C ATOM 752 O ILE A 50 25.212 73.770 -3.071 1.00 0.00 O ATOM 753 CB ILE A 50 26.661 73.013 -5.854 1.00 0.00 C ATOM 754 CG1 ILE A 50 26.726 71.729 -5.022 1.00 0.00 C ATOM 755 CG2 ILE A 50 27.940 73.819 -5.669 1.00 0.00 C ATOM 756 CD1 ILE A 50 25.534 70.816 -5.220 1.00 0.00 C ATOM 0 H ILE A 50 25.872 75.118 -7.081 1.00 0.00 H new ATOM 0 HA ILE A 50 24.553 73.169 -5.480 1.00 0.00 H new ATOM 0 HB ILE A 50 26.574 72.752 -6.909 1.00 0.00 H new ATOM 0 HG12 ILE A 50 27.635 71.186 -5.278 1.00 0.00 H new ATOM 0 HG13 ILE A 50 26.799 71.993 -3.967 1.00 0.00 H new ATOM 0 HG21 ILE A 50 28.799 73.208 -5.948 1.00 0.00 H new ATOM 0 HG22 ILE A 50 27.905 74.707 -6.301 1.00 0.00 H new ATOM 0 HG23 ILE A 50 28.033 74.120 -4.625 1.00 0.00 H new ATOM 0 HD11 ILE A 50 25.649 69.927 -4.599 1.00 0.00 H new ATOM 0 HD12 ILE A 50 24.622 71.341 -4.936 1.00 0.00 H new ATOM 0 HD13 ILE A 50 25.471 70.521 -6.268 1.00 0.00 H new ATOM 768 N ILE A 51 26.071 75.647 -3.961 1.00 0.00 N ATOM 769 CA ILE A 51 26.288 76.282 -2.664 1.00 0.00 C ATOM 770 C ILE A 51 24.962 76.660 -2.008 1.00 0.00 C ATOM 771 O ILE A 51 24.930 77.130 -0.872 1.00 0.00 O ATOM 772 CB ILE A 51 27.184 77.533 -2.779 1.00 0.00 C ATOM 773 CG1 ILE A 51 26.551 78.568 -3.716 1.00 0.00 C ATOM 774 CG2 ILE A 51 28.572 77.139 -3.266 1.00 0.00 C ATOM 775 CD1 ILE A 51 27.337 79.858 -3.823 1.00 0.00 C ATOM 0 H ILE A 51 26.331 76.222 -4.762 1.00 0.00 H new ATOM 0 HA ILE A 51 26.800 75.551 -2.039 1.00 0.00 H new ATOM 0 HB ILE A 51 27.279 77.987 -1.793 1.00 0.00 H new ATOM 0 HG12 ILE A 51 26.451 78.131 -4.710 1.00 0.00 H new ATOM 0 HG13 ILE A 51 25.545 78.795 -3.364 1.00 0.00 H new ATOM 0 HG21 ILE A 51 29.197 78.029 -3.344 1.00 0.00 H new ATOM 0 HG22 ILE A 51 29.021 76.441 -2.559 1.00 0.00 H new ATOM 0 HG23 ILE A 51 28.493 76.664 -4.244 1.00 0.00 H new ATOM 0 HD11 ILE A 51 26.827 80.540 -4.503 1.00 0.00 H new ATOM 0 HD12 ILE A 51 27.415 80.319 -2.838 1.00 0.00 H new ATOM 0 HD13 ILE A 51 28.336 79.645 -4.205 1.00 0.00 H new ATOM 787 N GLN A 52 23.873 76.450 -2.737 1.00 0.00 N ATOM 788 CA GLN A 52 22.537 76.668 -2.205 1.00 0.00 C ATOM 789 C GLN A 52 22.055 75.406 -1.496 1.00 0.00 C ATOM 790 O GLN A 52 21.137 75.446 -0.680 1.00 0.00 O ATOM 791 CB GLN A 52 21.575 77.041 -3.334 1.00 0.00 C ATOM 792 CG GLN A 52 22.027 78.244 -4.141 1.00 0.00 C ATOM 793 CD GLN A 52 21.067 78.587 -5.259 1.00 0.00 C ATOM 794 OE1 GLN A 52 19.861 78.369 -5.152 1.00 0.00 O ATOM 795 NE2 GLN A 52 21.595 79.115 -6.348 1.00 0.00 N ATOM 0 H GLN A 52 23.891 76.127 -3.704 1.00 0.00 H new ATOM 0 HA GLN A 52 22.567 77.489 -1.489 1.00 0.00 H new ATOM 0 HB2 GLN A 52 21.462 76.187 -4.002 1.00 0.00 H new ATOM 0 HB3 GLN A 52 20.592 77.246 -2.910 1.00 0.00 H new ATOM 0 HG2 GLN A 52 22.130 79.104 -3.479 1.00 0.00 H new ATOM 0 HG3 GLN A 52 23.013 78.046 -4.561 1.00 0.00 H new ATOM 0 HE21 GLN A 52 22.600 79.281 -6.399 1.00 0.00 H new ATOM 0 HE22 GLN A 52 20.998 79.357 -7.139 1.00 0.00 H new ATOM 804 N PHE A 53 22.689 74.284 -1.821 1.00 0.00 N ATOM 805 CA PHE A 53 22.367 73.010 -1.200 1.00 0.00 C ATOM 806 C PHE A 53 23.380 72.684 -0.111 1.00 0.00 C ATOM 807 O PHE A 53 23.146 71.819 0.732 1.00 0.00 O ATOM 808 CB PHE A 53 22.371 71.889 -2.241 1.00 0.00 C ATOM 809 CG PHE A 53 21.416 72.103 -3.379 1.00 0.00 C ATOM 810 CD1 PHE A 53 20.051 71.973 -3.189 1.00 0.00 C ATOM 811 CD2 PHE A 53 21.887 72.424 -4.640 1.00 0.00 C ATOM 812 CE1 PHE A 53 19.172 72.162 -4.239 1.00 0.00 C ATOM 813 CE2 PHE A 53 21.015 72.615 -5.693 1.00 0.00 C ATOM 814 CZ PHE A 53 19.656 72.484 -5.492 1.00 0.00 C ATOM 0 H PHE A 53 23.434 74.235 -2.516 1.00 0.00 H new ATOM 0 HA PHE A 53 21.372 73.089 -0.761 1.00 0.00 H new ATOM 0 HB2 PHE A 53 23.379 71.784 -2.642 1.00 0.00 H new ATOM 0 HB3 PHE A 53 22.125 70.949 -1.747 1.00 0.00 H new ATOM 0 HD1 PHE A 53 19.669 71.721 -2.211 1.00 0.00 H new ATOM 0 HD2 PHE A 53 22.950 72.526 -4.802 1.00 0.00 H new ATOM 0 HE1 PHE A 53 18.109 72.058 -4.080 1.00 0.00 H new ATOM 0 HE2 PHE A 53 21.396 72.866 -6.672 1.00 0.00 H new ATOM 0 HZ PHE A 53 18.971 72.633 -6.314 1.00 0.00 H new ATOM 824 N LEU A 54 24.516 73.365 -0.158 1.00 0.00 N ATOM 825 CA LEU A 54 25.584 73.139 0.805 1.00 0.00 C ATOM 826 C LEU A 54 25.338 73.911 2.095 1.00 0.00 C ATOM 827 O LEU A 54 24.820 75.030 2.075 1.00 0.00 O ATOM 828 CB LEU A 54 26.929 73.555 0.210 1.00 0.00 C ATOM 829 CG LEU A 54 27.307 72.859 -1.096 1.00 0.00 C ATOM 830 CD1 LEU A 54 28.678 73.317 -1.563 1.00 0.00 C ATOM 831 CD2 LEU A 54 27.272 71.348 -0.925 1.00 0.00 C ATOM 0 H LEU A 54 24.722 74.081 -0.855 1.00 0.00 H new ATOM 0 HA LEU A 54 25.601 72.074 1.038 1.00 0.00 H new ATOM 0 HB2 LEU A 54 26.915 74.631 0.038 1.00 0.00 H new ATOM 0 HB3 LEU A 54 27.709 73.360 0.946 1.00 0.00 H new ATOM 0 HG LEU A 54 26.577 73.132 -1.858 1.00 0.00 H new ATOM 0 HD11 LEU A 54 28.933 72.812 -2.495 1.00 0.00 H new ATOM 0 HD12 LEU A 54 28.666 74.395 -1.726 1.00 0.00 H new ATOM 0 HD13 LEU A 54 29.421 73.074 -0.804 1.00 0.00 H new ATOM 0 HD21 LEU A 54 27.544 70.869 -1.866 1.00 0.00 H new ATOM 0 HD22 LEU A 54 27.979 71.053 -0.150 1.00 0.00 H new ATOM 0 HD23 LEU A 54 26.268 71.038 -0.637 1.00 0.00 H new ATOM 843 N ASP A 55 25.717 73.308 3.213 1.00 0.00 N ATOM 844 CA ASP A 55 25.598 73.959 4.510 1.00 0.00 C ATOM 845 C ASP A 55 26.696 75.000 4.672 1.00 0.00 C ATOM 846 O ASP A 55 27.866 74.727 4.398 1.00 0.00 O ATOM 847 CB ASP A 55 25.679 72.929 5.637 1.00 0.00 C ATOM 848 CG ASP A 55 25.615 73.562 7.014 1.00 0.00 C ATOM 849 OD1 ASP A 55 26.676 73.940 7.543 1.00 0.00 O ATOM 850 OD2 ASP A 55 24.509 73.670 7.580 1.00 0.00 O ATOM 0 H ASP A 55 26.110 72.367 3.248 1.00 0.00 H new ATOM 0 HA ASP A 55 24.628 74.454 4.563 1.00 0.00 H new ATOM 0 HB2 ASP A 55 24.862 72.216 5.531 1.00 0.00 H new ATOM 0 HB3 ASP A 55 26.608 72.366 5.543 1.00 0.00 H new ATOM 855 N ARG A 56 26.314 76.187 5.129 1.00 0.00 N ATOM 856 CA ARG A 56 27.238 77.313 5.255 1.00 0.00 C ATOM 857 C ARG A 56 28.152 77.164 6.473 1.00 0.00 C ATOM 858 O ARG A 56 28.251 78.073 7.297 1.00 0.00 O ATOM 859 CB ARG A 56 26.449 78.623 5.354 1.00 0.00 C ATOM 860 CG ARG A 56 25.757 79.019 4.060 1.00 0.00 C ATOM 861 CD ARG A 56 24.753 80.142 4.281 1.00 0.00 C ATOM 862 NE ARG A 56 25.354 81.332 4.890 1.00 0.00 N ATOM 863 CZ ARG A 56 24.725 82.127 5.760 1.00 0.00 C ATOM 864 NH1 ARG A 56 23.479 81.852 6.138 1.00 0.00 N ATOM 865 NH2 ARG A 56 25.345 83.192 6.253 1.00 0.00 N ATOM 0 H ARG A 56 25.360 76.398 5.422 1.00 0.00 H new ATOM 0 HA ARG A 56 27.869 77.328 4.366 1.00 0.00 H new ATOM 0 HB2 ARG A 56 25.701 78.528 6.141 1.00 0.00 H new ATOM 0 HB3 ARG A 56 27.126 79.423 5.653 1.00 0.00 H new ATOM 0 HG2 ARG A 56 26.502 79.335 3.330 1.00 0.00 H new ATOM 0 HG3 ARG A 56 25.247 78.152 3.640 1.00 0.00 H new ATOM 0 HD2 ARG A 56 24.305 80.416 3.326 1.00 0.00 H new ATOM 0 HD3 ARG A 56 23.946 79.781 4.919 1.00 0.00 H new ATOM 0 HE ARG A 56 26.313 81.568 4.633 1.00 0.00 H new ATOM 0 HH11 ARG A 56 23.002 81.032 5.763 1.00 0.00 H new ATOM 0 HH12 ARG A 56 23.001 82.461 6.802 1.00 0.00 H new ATOM 0 HH21 ARG A 56 26.301 83.403 5.968 1.00 0.00 H new ATOM 0 HH22 ARG A 56 24.865 83.799 6.917 1.00 0.00 H new ATOM 879 N ARG A 57 28.827 76.025 6.566 1.00 0.00 N ATOM 880 CA ARG A 57 29.735 75.755 7.676 1.00 0.00 C ATOM 881 C ARG A 57 30.692 74.607 7.342 1.00 0.00 C ATOM 882 O ARG A 57 31.833 74.588 7.807 1.00 0.00 O ATOM 883 CB ARG A 57 28.922 75.459 8.947 1.00 0.00 C ATOM 884 CG ARG A 57 29.296 74.178 9.677 1.00 0.00 C ATOM 885 CD ARG A 57 28.254 73.834 10.729 1.00 0.00 C ATOM 886 NE ARG A 57 26.917 73.734 10.145 1.00 0.00 N ATOM 887 CZ ARG A 57 25.800 73.535 10.839 1.00 0.00 C ATOM 888 NH1 ARG A 57 25.848 73.391 12.160 1.00 0.00 N ATOM 889 NH2 ARG A 57 24.633 73.480 10.208 1.00 0.00 N ATOM 0 H ARG A 57 28.763 75.270 5.883 1.00 0.00 H new ATOM 0 HA ARG A 57 30.349 76.638 7.853 1.00 0.00 H new ATOM 0 HB2 ARG A 57 29.038 76.296 9.635 1.00 0.00 H new ATOM 0 HB3 ARG A 57 27.866 75.410 8.680 1.00 0.00 H new ATOM 0 HG2 ARG A 57 29.383 73.359 8.963 1.00 0.00 H new ATOM 0 HG3 ARG A 57 30.272 74.294 10.149 1.00 0.00 H new ATOM 0 HD2 ARG A 57 28.515 72.890 11.207 1.00 0.00 H new ATOM 0 HD3 ARG A 57 28.256 74.596 11.508 1.00 0.00 H new ATOM 0 HE ARG A 57 26.835 73.823 9.132 1.00 0.00 H new ATOM 0 HH11 ARG A 57 26.744 73.433 12.645 1.00 0.00 H new ATOM 0 HH12 ARG A 57 24.989 73.239 12.688 1.00 0.00 H new ATOM 0 HH21 ARG A 57 24.595 73.590 9.195 1.00 0.00 H new ATOM 0 HH22 ARG A 57 23.774 73.328 10.737 1.00 0.00 H new ATOM 903 N LEU A 58 30.238 73.657 6.533 1.00 0.00 N ATOM 904 CA LEU A 58 31.078 72.524 6.160 1.00 0.00 C ATOM 905 C LEU A 58 31.930 72.846 4.935 1.00 0.00 C ATOM 906 O LEU A 58 31.623 73.756 4.166 1.00 0.00 O ATOM 907 CB LEU A 58 30.241 71.265 5.888 1.00 0.00 C ATOM 908 CG LEU A 58 29.644 70.572 7.120 1.00 0.00 C ATOM 909 CD1 LEU A 58 30.669 70.486 8.241 1.00 0.00 C ATOM 910 CD2 LEU A 58 28.387 71.281 7.591 1.00 0.00 C ATOM 0 H LEU A 58 29.303 73.647 6.126 1.00 0.00 H new ATOM 0 HA LEU A 58 31.736 72.328 7.007 1.00 0.00 H new ATOM 0 HB2 LEU A 58 29.425 71.534 5.217 1.00 0.00 H new ATOM 0 HB3 LEU A 58 30.866 70.545 5.359 1.00 0.00 H new ATOM 0 HG LEU A 58 29.368 69.557 6.833 1.00 0.00 H new ATOM 0 HD11 LEU A 58 30.224 69.991 9.104 1.00 0.00 H new ATOM 0 HD12 LEU A 58 31.533 69.915 7.901 1.00 0.00 H new ATOM 0 HD13 LEU A 58 30.986 71.490 8.522 1.00 0.00 H new ATOM 0 HD21 LEU A 58 27.986 70.768 8.465 1.00 0.00 H new ATOM 0 HD22 LEU A 58 28.627 72.311 7.853 1.00 0.00 H new ATOM 0 HD23 LEU A 58 27.644 71.273 6.793 1.00 0.00 H new ATOM 922 N SER A 59 33.009 72.093 4.772 1.00 0.00 N ATOM 923 CA SER A 59 33.879 72.227 3.613 1.00 0.00 C ATOM 924 C SER A 59 33.736 70.990 2.732 1.00 0.00 C ATOM 925 O SER A 59 33.973 69.873 3.189 1.00 0.00 O ATOM 926 CB SER A 59 35.328 72.391 4.072 1.00 0.00 C ATOM 927 OG SER A 59 35.422 73.371 5.091 1.00 0.00 O ATOM 0 H SER A 59 33.304 71.376 5.435 1.00 0.00 H new ATOM 0 HA SER A 59 33.595 73.108 3.038 1.00 0.00 H new ATOM 0 HB2 SER A 59 35.708 71.438 4.441 1.00 0.00 H new ATOM 0 HB3 SER A 59 35.953 72.678 3.226 1.00 0.00 H new ATOM 0 HG SER A 59 36.356 73.461 5.373 1.00 0.00 H new ATOM 933 N TYR A 60 33.335 71.189 1.483 1.00 0.00 N ATOM 934 CA TYR A 60 33.026 70.075 0.592 1.00 0.00 C ATOM 935 C TYR A 60 34.100 69.896 -0.479 1.00 0.00 C ATOM 936 O TYR A 60 34.395 70.826 -1.227 1.00 0.00 O ATOM 937 CB TYR A 60 31.669 70.301 -0.075 1.00 0.00 C ATOM 938 CG TYR A 60 30.514 70.423 0.897 1.00 0.00 C ATOM 939 CD1 TYR A 60 30.191 71.646 1.474 1.00 0.00 C ATOM 940 CD2 TYR A 60 29.741 69.317 1.231 1.00 0.00 C ATOM 941 CE1 TYR A 60 29.134 71.763 2.354 1.00 0.00 C ATOM 942 CE2 TYR A 60 28.680 69.428 2.109 1.00 0.00 C ATOM 943 CZ TYR A 60 28.382 70.653 2.668 1.00 0.00 C ATOM 944 OH TYR A 60 27.324 70.769 3.540 1.00 0.00 O ATOM 0 H TYR A 60 33.216 72.111 1.063 1.00 0.00 H new ATOM 0 HA TYR A 60 32.995 69.167 1.195 1.00 0.00 H new ATOM 0 HB2 TYR A 60 31.719 71.208 -0.678 1.00 0.00 H new ATOM 0 HB3 TYR A 60 31.470 69.475 -0.757 1.00 0.00 H new ATOM 0 HD1 TYR A 60 30.777 72.519 1.229 1.00 0.00 H new ATOM 0 HD2 TYR A 60 29.973 68.356 0.797 1.00 0.00 H new ATOM 0 HE1 TYR A 60 28.898 72.721 2.794 1.00 0.00 H new ATOM 0 HE2 TYR A 60 28.087 68.560 2.356 1.00 0.00 H new ATOM 0 HH TYR A 60 26.897 69.894 3.654 1.00 0.00 H new ATOM 954 N PHE A 61 34.672 68.697 -0.542 1.00 0.00 N ATOM 955 CA PHE A 61 35.699 68.369 -1.533 1.00 0.00 C ATOM 956 C PHE A 61 35.210 68.568 -2.961 1.00 0.00 C ATOM 957 O PHE A 61 34.079 68.209 -3.304 1.00 0.00 O ATOM 958 CB PHE A 61 36.170 66.921 -1.375 1.00 0.00 C ATOM 959 CG PHE A 61 37.096 66.703 -0.219 1.00 0.00 C ATOM 960 CD1 PHE A 61 38.396 67.180 -0.259 1.00 0.00 C ATOM 961 CD2 PHE A 61 36.674 66.015 0.900 1.00 0.00 C ATOM 962 CE1 PHE A 61 39.255 66.977 0.800 1.00 0.00 C ATOM 963 CE2 PHE A 61 37.527 65.810 1.962 1.00 0.00 C ATOM 964 CZ PHE A 61 38.819 66.291 1.912 1.00 0.00 C ATOM 0 H PHE A 61 34.440 67.928 0.087 1.00 0.00 H new ATOM 0 HA PHE A 61 36.527 69.054 -1.350 1.00 0.00 H new ATOM 0 HB2 PHE A 61 35.298 66.278 -1.255 1.00 0.00 H new ATOM 0 HB3 PHE A 61 36.671 66.611 -2.292 1.00 0.00 H new ATOM 0 HD1 PHE A 61 38.741 67.717 -1.130 1.00 0.00 H new ATOM 0 HD2 PHE A 61 35.665 65.633 0.944 1.00 0.00 H new ATOM 0 HE1 PHE A 61 40.266 67.354 0.758 1.00 0.00 H new ATOM 0 HE2 PHE A 61 37.184 65.273 2.834 1.00 0.00 H new ATOM 0 HZ PHE A 61 39.488 66.130 2.744 1.00 0.00 H new ATOM 974 N LEU A 62 36.078 69.137 -3.784 1.00 0.00 N ATOM 975 CA LEU A 62 35.822 69.266 -5.207 1.00 0.00 C ATOM 976 C LEU A 62 36.665 68.248 -5.963 1.00 0.00 C ATOM 977 O LEU A 62 37.624 67.709 -5.419 1.00 0.00 O ATOM 978 CB LEU A 62 36.150 70.681 -5.689 1.00 0.00 C ATOM 979 CG LEU A 62 35.369 71.800 -5.000 1.00 0.00 C ATOM 980 CD1 LEU A 62 35.784 73.153 -5.550 1.00 0.00 C ATOM 981 CD2 LEU A 62 33.873 71.590 -5.171 1.00 0.00 C ATOM 0 H LEU A 62 36.975 69.520 -3.484 1.00 0.00 H new ATOM 0 HA LEU A 62 34.765 69.079 -5.396 1.00 0.00 H new ATOM 0 HB2 LEU A 62 37.215 70.860 -5.543 1.00 0.00 H new ATOM 0 HB3 LEU A 62 35.962 70.735 -6.761 1.00 0.00 H new ATOM 0 HG LEU A 62 35.599 71.776 -3.935 1.00 0.00 H new ATOM 0 HD11 LEU A 62 35.218 73.939 -5.049 1.00 0.00 H new ATOM 0 HD12 LEU A 62 36.849 73.305 -5.376 1.00 0.00 H new ATOM 0 HD13 LEU A 62 35.583 73.188 -6.621 1.00 0.00 H new ATOM 0 HD21 LEU A 62 33.333 72.396 -4.674 1.00 0.00 H new ATOM 0 HD22 LEU A 62 33.625 71.588 -6.232 1.00 0.00 H new ATOM 0 HD23 LEU A 62 33.587 70.635 -4.729 1.00 0.00 H new ATOM 993 N GLY A 63 36.319 67.999 -7.213 1.00 0.00 N ATOM 994 CA GLY A 63 37.006 66.981 -7.984 1.00 0.00 C ATOM 995 C GLY A 63 38.305 67.462 -8.606 1.00 0.00 C ATOM 996 O GLY A 63 38.843 66.806 -9.492 1.00 0.00 O ATOM 0 H GLY A 63 35.573 68.483 -7.712 1.00 0.00 H new ATOM 0 HA2 GLY A 63 37.216 66.128 -7.338 1.00 0.00 H new ATOM 0 HA3 GLY A 63 36.344 66.627 -8.774 1.00 0.00 H new ATOM 1000 N LEU A 64 38.812 68.601 -8.152 1.00 0.00 N ATOM 1001 CA LEU A 64 40.068 69.127 -8.672 1.00 0.00 C ATOM 1002 C LEU A 64 41.245 68.460 -7.976 1.00 0.00 C ATOM 1003 O LEU A 64 41.420 68.599 -6.764 1.00 0.00 O ATOM 1004 CB LEU A 64 40.148 70.643 -8.484 1.00 0.00 C ATOM 1005 CG LEU A 64 40.243 71.458 -9.775 1.00 0.00 C ATOM 1006 CD1 LEU A 64 40.432 72.933 -9.463 1.00 0.00 C ATOM 1007 CD2 LEU A 64 41.375 70.952 -10.650 1.00 0.00 C ATOM 0 H LEU A 64 38.377 69.175 -7.430 1.00 0.00 H new ATOM 0 HA LEU A 64 40.109 68.909 -9.739 1.00 0.00 H new ATOM 0 HB2 LEU A 64 39.268 70.971 -7.931 1.00 0.00 H new ATOM 0 HB3 LEU A 64 41.016 70.870 -7.866 1.00 0.00 H new ATOM 0 HG LEU A 64 39.308 71.337 -10.322 1.00 0.00 H new ATOM 0 HD11 LEU A 64 40.497 73.496 -10.394 1.00 0.00 H new ATOM 0 HD12 LEU A 64 39.584 73.293 -8.880 1.00 0.00 H new ATOM 0 HD13 LEU A 64 41.350 73.069 -8.891 1.00 0.00 H new ATOM 0 HD21 LEU A 64 41.423 71.547 -11.562 1.00 0.00 H new ATOM 0 HD22 LEU A 64 42.318 71.038 -10.110 1.00 0.00 H new ATOM 0 HD23 LEU A 64 41.198 69.908 -10.907 1.00 0.00 H new ATOM 1019 N ARG A 65 42.045 67.740 -8.745 1.00 0.00 N ATOM 1020 CA ARG A 65 43.169 67.001 -8.193 1.00 0.00 C ATOM 1021 C ARG A 65 44.508 67.553 -8.652 1.00 0.00 C ATOM 1022 O ARG A 65 44.756 67.686 -9.853 1.00 0.00 O ATOM 1023 CB ARG A 65 43.116 65.530 -8.617 1.00 0.00 C ATOM 1024 CG ARG A 65 44.376 64.765 -8.228 1.00 0.00 C ATOM 1025 CD ARG A 65 44.573 63.508 -9.060 1.00 0.00 C ATOM 1026 NE ARG A 65 43.646 62.435 -8.702 1.00 0.00 N ATOM 1027 CZ ARG A 65 43.949 61.140 -8.785 1.00 0.00 C ATOM 1028 NH1 ARG A 65 45.159 60.766 -9.197 1.00 0.00 N ATOM 1029 NH2 ARG A 65 43.049 60.223 -8.460 1.00 0.00 N ATOM 0 H ARG A 65 41.937 67.651 -9.755 1.00 0.00 H new ATOM 0 HA ARG A 65 43.086 67.101 -7.111 1.00 0.00 H new ATOM 0 HB2 ARG A 65 42.249 65.054 -8.158 1.00 0.00 H new ATOM 0 HB3 ARG A 65 42.978 65.471 -9.697 1.00 0.00 H new ATOM 0 HG2 ARG A 65 45.243 65.415 -8.346 1.00 0.00 H new ATOM 0 HG3 ARG A 65 44.322 64.494 -7.174 1.00 0.00 H new ATOM 0 HD2 ARG A 65 44.446 63.753 -10.114 1.00 0.00 H new ATOM 0 HD3 ARG A 65 45.596 63.153 -8.936 1.00 0.00 H new ATOM 0 HE ARG A 65 42.716 62.692 -8.370 1.00 0.00 H new ATOM 0 HH11 ARG A 65 45.852 61.470 -9.449 1.00 0.00 H new ATOM 0 HH12 ARG A 65 45.392 59.775 -9.261 1.00 0.00 H new ATOM 0 HH21 ARG A 65 42.121 60.508 -8.145 1.00 0.00 H new ATOM 0 HH22 ARG A 65 43.284 59.233 -8.525 1.00 0.00 H new ATOM 1043 N ASP A 66 45.363 67.859 -7.694 1.00 0.00 N ATOM 1044 CA ASP A 66 46.791 67.902 -7.942 1.00 0.00 C ATOM 1045 C ASP A 66 47.453 66.957 -6.954 1.00 0.00 C ATOM 1046 O ASP A 66 46.995 66.813 -5.821 1.00 0.00 O ATOM 1047 CB ASP A 66 47.380 69.303 -7.830 1.00 0.00 C ATOM 1048 CG ASP A 66 48.840 69.318 -8.240 1.00 0.00 C ATOM 1049 OD1 ASP A 66 49.694 68.891 -7.438 1.00 0.00 O ATOM 1050 OD2 ASP A 66 49.141 69.720 -9.378 1.00 0.00 O ATOM 0 H ASP A 66 45.093 68.082 -6.736 1.00 0.00 H new ATOM 0 HA ASP A 66 46.978 67.594 -8.971 1.00 0.00 H new ATOM 0 HB2 ASP A 66 46.815 69.989 -8.461 1.00 0.00 H new ATOM 0 HB3 ASP A 66 47.284 69.660 -6.805 1.00 0.00 H new ATOM 1055 N GLU A 67 48.521 66.314 -7.374 1.00 0.00 N ATOM 1056 CA GLU A 67 49.010 65.140 -6.673 1.00 0.00 C ATOM 1057 C GLU A 67 50.442 65.287 -6.159 1.00 0.00 C ATOM 1058 O GLU A 67 51.002 64.322 -5.644 1.00 0.00 O ATOM 1059 CB GLU A 67 48.898 63.941 -7.614 1.00 0.00 C ATOM 1060 CG GLU A 67 49.286 64.281 -9.045 1.00 0.00 C ATOM 1061 CD GLU A 67 49.028 63.153 -10.017 1.00 0.00 C ATOM 1062 OE1 GLU A 67 47.860 62.979 -10.433 1.00 0.00 O ATOM 1063 OE2 GLU A 67 50.000 62.468 -10.390 1.00 0.00 O ATOM 0 H GLU A 67 49.067 66.580 -8.193 1.00 0.00 H new ATOM 0 HA GLU A 67 48.395 65.000 -5.784 1.00 0.00 H new ATOM 0 HB2 GLU A 67 49.537 63.137 -7.250 1.00 0.00 H new ATOM 0 HB3 GLU A 67 47.875 63.566 -7.598 1.00 0.00 H new ATOM 0 HG2 GLU A 67 48.730 65.162 -9.365 1.00 0.00 H new ATOM 0 HG3 GLU A 67 50.344 64.543 -9.075 1.00 0.00 H new ATOM 1070 N ASN A 68 51.033 66.477 -6.283 1.00 0.00 N ATOM 1071 CA ASN A 68 52.410 66.686 -5.807 1.00 0.00 C ATOM 1072 C ASN A 68 52.863 68.122 -6.062 1.00 0.00 C ATOM 1073 O ASN A 68 54.053 68.375 -6.245 1.00 0.00 O ATOM 1074 CB ASN A 68 53.368 65.714 -6.518 1.00 0.00 C ATOM 1075 CG ASN A 68 54.605 65.352 -5.703 1.00 0.00 C ATOM 1076 OD1 ASN A 68 55.114 64.238 -5.808 1.00 0.00 O ATOM 1077 ND2 ASN A 68 55.115 66.285 -4.913 1.00 0.00 N ATOM 0 H ASN A 68 50.594 67.298 -6.700 1.00 0.00 H new ATOM 0 HA ASN A 68 52.428 66.498 -4.733 1.00 0.00 H new ATOM 0 HB2 ASN A 68 52.826 64.800 -6.762 1.00 0.00 H new ATOM 0 HB3 ASN A 68 53.685 66.158 -7.462 1.00 0.00 H new ATOM 0 HD21 ASN A 68 55.955 66.089 -4.369 1.00 0.00 H new ATOM 0 HD22 ASN A 68 54.668 67.199 -4.849 1.00 0.00 H new ATOM 1084 N ALA A 69 51.916 69.055 -6.052 1.00 0.00 N ATOM 1085 CA ALA A 69 52.197 70.450 -6.389 1.00 0.00 C ATOM 1086 C ALA A 69 52.745 70.529 -7.812 1.00 0.00 C ATOM 1087 O ALA A 69 53.620 71.335 -8.120 1.00 0.00 O ATOM 1088 CB ALA A 69 53.166 71.069 -5.382 1.00 0.00 C ATOM 0 H ALA A 69 50.942 68.871 -5.813 1.00 0.00 H new ATOM 0 HA ALA A 69 51.272 71.024 -6.340 1.00 0.00 H new ATOM 0 HB1 ALA A 69 53.360 72.107 -5.654 1.00 0.00 H new ATOM 0 HB2 ALA A 69 52.728 71.031 -4.385 1.00 0.00 H new ATOM 0 HB3 ALA A 69 54.103 70.512 -5.388 1.00 0.00 H new ATOM 1094 N LYS A 70 52.180 69.694 -8.681 1.00 0.00 N ATOM 1095 CA LYS A 70 52.675 69.529 -10.042 1.00 0.00 C ATOM 1096 C LYS A 70 52.151 70.632 -10.953 1.00 0.00 C ATOM 1097 O LYS A 70 52.734 70.917 -11.999 1.00 0.00 O ATOM 1098 CB LYS A 70 52.247 68.163 -10.598 1.00 0.00 C ATOM 1099 CG LYS A 70 52.785 66.974 -9.816 1.00 0.00 C ATOM 1100 CD LYS A 70 52.275 65.649 -10.376 1.00 0.00 C ATOM 1101 CE LYS A 70 52.923 64.462 -9.675 1.00 0.00 C ATOM 1102 NZ LYS A 70 52.493 63.159 -10.253 1.00 0.00 N ATOM 0 H LYS A 70 51.369 69.116 -8.461 1.00 0.00 H new ATOM 0 HA LYS A 70 53.763 69.588 -10.012 1.00 0.00 H new ATOM 0 HB2 LYS A 70 51.158 68.113 -10.609 1.00 0.00 H new ATOM 0 HB3 LYS A 70 52.581 68.084 -11.633 1.00 0.00 H new ATOM 0 HG2 LYS A 70 53.875 66.984 -9.843 1.00 0.00 H new ATOM 0 HG3 LYS A 70 52.491 67.064 -8.770 1.00 0.00 H new ATOM 0 HD2 LYS A 70 51.193 65.596 -10.259 1.00 0.00 H new ATOM 0 HD3 LYS A 70 52.483 65.600 -11.445 1.00 0.00 H new ATOM 0 HE2 LYS A 70 54.007 64.548 -9.747 1.00 0.00 H new ATOM 0 HE3 LYS A 70 52.671 64.487 -8.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 52.822 62.383 -9.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 51.455 63.133 -10.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 52.901 63.049 -11.203 1.00 0.00 H new ATOM 1116 N GLY A 71 51.039 71.232 -10.559 1.00 0.00 N ATOM 1117 CA GLY A 71 50.401 72.227 -11.392 1.00 0.00 C ATOM 1118 C GLY A 71 49.468 71.573 -12.383 1.00 0.00 C ATOM 1119 O GLY A 71 49.088 72.166 -13.392 1.00 0.00 O ATOM 0 H GLY A 71 50.566 71.047 -9.674 1.00 0.00 H new ATOM 0 HA2 GLY A 71 49.845 72.928 -10.769 1.00 0.00 H new ATOM 0 HA3 GLY A 71 51.158 72.804 -11.923 1.00 0.00 H new ATOM 1123 N GLN A 72 49.087 70.344 -12.072 1.00 0.00 N ATOM 1124 CA GLN A 72 48.269 69.537 -12.960 1.00 0.00 C ATOM 1125 C GLN A 72 46.820 69.564 -12.509 1.00 0.00 C ATOM 1126 O GLN A 72 46.256 68.537 -12.124 1.00 0.00 O ATOM 1127 CB GLN A 72 48.789 68.098 -12.996 1.00 0.00 C ATOM 1128 CG GLN A 72 50.145 67.961 -13.665 1.00 0.00 C ATOM 1129 CD GLN A 72 50.090 68.270 -15.147 1.00 0.00 C ATOM 1130 OE1 GLN A 72 49.081 68.026 -15.807 1.00 0.00 O ATOM 1131 NE2 GLN A 72 51.169 68.820 -15.678 1.00 0.00 N ATOM 0 H GLN A 72 49.336 69.880 -11.199 1.00 0.00 H new ATOM 0 HA GLN A 72 48.328 69.954 -13.966 1.00 0.00 H new ATOM 0 HB2 GLN A 72 48.856 67.718 -11.976 1.00 0.00 H new ATOM 0 HB3 GLN A 72 48.068 67.473 -13.522 1.00 0.00 H new ATOM 0 HG2 GLN A 72 50.855 68.633 -13.182 1.00 0.00 H new ATOM 0 HG3 GLN A 72 50.517 66.947 -13.521 1.00 0.00 H new ATOM 0 HE21 GLN A 72 51.986 69.006 -15.096 1.00 0.00 H new ATOM 0 HE22 GLN A 72 51.185 69.058 -16.670 1.00 0.00 H new ATOM 1140 N TRP A 73 46.229 70.746 -12.550 1.00 0.00 N ATOM 1141 CA TRP A 73 44.855 70.928 -12.118 1.00 0.00 C ATOM 1142 C TRP A 73 43.891 70.266 -13.096 1.00 0.00 C ATOM 1143 O TRP A 73 43.645 70.768 -14.193 1.00 0.00 O ATOM 1144 CB TRP A 73 44.535 72.417 -11.977 1.00 0.00 C ATOM 1145 CG TRP A 73 45.381 73.112 -10.952 1.00 0.00 C ATOM 1146 CD1 TRP A 73 46.536 73.805 -11.175 1.00 0.00 C ATOM 1147 CD2 TRP A 73 45.142 73.176 -9.540 1.00 0.00 C ATOM 1148 NE1 TRP A 73 47.027 74.298 -9.991 1.00 0.00 N ATOM 1149 CE2 TRP A 73 46.189 73.925 -8.973 1.00 0.00 C ATOM 1150 CE3 TRP A 73 44.143 72.673 -8.701 1.00 0.00 C ATOM 1151 CZ2 TRP A 73 46.265 74.185 -7.607 1.00 0.00 C ATOM 1152 CZ3 TRP A 73 44.220 72.931 -7.346 1.00 0.00 C ATOM 1153 CH2 TRP A 73 45.273 73.681 -6.810 1.00 0.00 C ATOM 0 H TRP A 73 46.683 71.598 -12.880 1.00 0.00 H new ATOM 0 HA TRP A 73 44.734 70.452 -11.145 1.00 0.00 H new ATOM 0 HB2 TRP A 73 44.673 72.904 -12.942 1.00 0.00 H new ATOM 0 HB3 TRP A 73 43.485 72.532 -11.709 1.00 0.00 H new ATOM 0 HD1 TRP A 73 46.996 73.945 -12.142 1.00 0.00 H new ATOM 0 HE1 TRP A 73 47.877 74.852 -9.886 1.00 0.00 H new ATOM 0 HE3 TRP A 73 43.326 72.093 -9.105 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 47.077 74.763 -7.192 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 43.454 72.547 -6.689 1.00 0.00 H new ATOM 0 HH2 TRP A 73 45.303 73.866 -5.746 1.00 0.00 H new ATOM 1164 N ARG A 74 43.363 69.123 -12.688 1.00 0.00 N ATOM 1165 CA ARG A 74 42.430 68.360 -13.505 1.00 0.00 C ATOM 1166 C ARG A 74 41.253 67.920 -12.650 1.00 0.00 C ATOM 1167 O ARG A 74 41.437 67.566 -11.484 1.00 0.00 O ATOM 1168 CB ARG A 74 43.125 67.122 -14.078 1.00 0.00 C ATOM 1169 CG ARG A 74 44.343 67.430 -14.934 1.00 0.00 C ATOM 1170 CD ARG A 74 45.382 66.327 -14.819 1.00 0.00 C ATOM 1171 NE ARG A 74 45.880 66.209 -13.447 1.00 0.00 N ATOM 1172 CZ ARG A 74 46.420 65.107 -12.926 1.00 0.00 C ATOM 1173 NH1 ARG A 74 46.575 64.016 -13.667 1.00 0.00 N ATOM 1174 NH2 ARG A 74 46.813 65.106 -11.659 1.00 0.00 N ATOM 0 H ARG A 74 43.568 68.698 -11.784 1.00 0.00 H new ATOM 0 HA ARG A 74 42.080 68.988 -14.324 1.00 0.00 H new ATOM 0 HB2 ARG A 74 43.428 66.476 -13.254 1.00 0.00 H new ATOM 0 HB3 ARG A 74 42.407 66.561 -14.676 1.00 0.00 H new ATOM 0 HG2 ARG A 74 44.041 67.543 -15.975 1.00 0.00 H new ATOM 0 HG3 ARG A 74 44.779 68.379 -14.624 1.00 0.00 H new ATOM 0 HD2 ARG A 74 44.946 65.379 -15.133 1.00 0.00 H new ATOM 0 HD3 ARG A 74 46.213 66.535 -15.494 1.00 0.00 H new ATOM 0 HE ARG A 74 45.809 67.030 -12.846 1.00 0.00 H new ATOM 0 HH11 ARG A 74 46.280 64.016 -14.643 1.00 0.00 H new ATOM 0 HH12 ARG A 74 46.989 63.178 -13.260 1.00 0.00 H new ATOM 0 HH21 ARG A 74 46.701 65.945 -11.090 1.00 0.00 H new ATOM 0 HH22 ARG A 74 47.227 64.266 -11.254 1.00 0.00 H new ATOM 1188 N TRP A 75 40.050 67.951 -13.206 1.00 0.00 N ATOM 1189 CA TRP A 75 38.889 67.465 -12.483 1.00 0.00 C ATOM 1190 C TRP A 75 38.715 65.973 -12.737 1.00 0.00 C ATOM 1191 O TRP A 75 38.662 65.540 -13.890 1.00 0.00 O ATOM 1192 CB TRP A 75 37.626 68.217 -12.910 1.00 0.00 C ATOM 1193 CG TRP A 75 37.686 69.701 -12.683 1.00 0.00 C ATOM 1194 CD1 TRP A 75 38.191 70.640 -13.535 1.00 0.00 C ATOM 1195 CD2 TRP A 75 37.211 70.418 -11.536 1.00 0.00 C ATOM 1196 NE1 TRP A 75 38.060 71.892 -12.990 1.00 0.00 N ATOM 1197 CE2 TRP A 75 37.461 71.784 -11.764 1.00 0.00 C ATOM 1198 CE3 TRP A 75 36.599 70.039 -10.339 1.00 0.00 C ATOM 1199 CZ2 TRP A 75 37.120 72.768 -10.841 1.00 0.00 C ATOM 1200 CZ3 TRP A 75 36.261 71.017 -9.423 1.00 0.00 C ATOM 1201 CH2 TRP A 75 36.521 72.368 -9.678 1.00 0.00 C ATOM 0 H TRP A 75 39.856 68.303 -14.143 1.00 0.00 H new ATOM 0 HA TRP A 75 39.046 67.638 -11.418 1.00 0.00 H new ATOM 0 HB2 TRP A 75 37.446 68.030 -13.969 1.00 0.00 H new ATOM 0 HB3 TRP A 75 36.774 67.812 -12.365 1.00 0.00 H new ATOM 0 HD1 TRP A 75 38.630 70.428 -14.499 1.00 0.00 H new ATOM 0 HE1 TRP A 75 38.360 72.763 -13.428 1.00 0.00 H new ATOM 0 HE3 TRP A 75 36.393 68.999 -10.133 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 37.321 73.811 -11.036 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 35.788 70.734 -8.494 1.00 0.00 H new ATOM 0 HH2 TRP A 75 36.244 73.109 -8.943 1.00 0.00 H new ATOM 1212 N VAL A 76 38.652 65.187 -11.665 1.00 0.00 N ATOM 1213 CA VAL A 76 38.445 63.749 -11.785 1.00 0.00 C ATOM 1214 C VAL A 76 37.014 63.454 -12.244 1.00 0.00 C ATOM 1215 O VAL A 76 36.110 63.194 -11.447 1.00 0.00 O ATOM 1216 CB VAL A 76 38.784 62.996 -10.468 1.00 0.00 C ATOM 1217 CG1 VAL A 76 38.006 63.550 -9.281 1.00 0.00 C ATOM 1218 CG2 VAL A 76 38.544 61.499 -10.624 1.00 0.00 C ATOM 0 H VAL A 76 38.741 65.522 -10.706 1.00 0.00 H new ATOM 0 HA VAL A 76 39.135 63.377 -12.542 1.00 0.00 H new ATOM 0 HB VAL A 76 39.843 63.156 -10.264 1.00 0.00 H new ATOM 0 HG11 VAL A 76 38.272 62.996 -8.381 1.00 0.00 H new ATOM 0 HG12 VAL A 76 38.251 64.603 -9.145 1.00 0.00 H new ATOM 0 HG13 VAL A 76 36.937 63.448 -9.467 1.00 0.00 H new ATOM 0 HG21 VAL A 76 38.788 60.992 -9.690 1.00 0.00 H new ATOM 0 HG22 VAL A 76 37.497 61.322 -10.870 1.00 0.00 H new ATOM 0 HG23 VAL A 76 39.175 61.111 -11.423 1.00 0.00 H new ATOM 1228 N ASP A 77 36.821 63.542 -13.549 1.00 0.00 N ATOM 1229 CA ASP A 77 35.508 63.411 -14.162 1.00 0.00 C ATOM 1230 C ASP A 77 35.652 63.385 -15.673 1.00 0.00 C ATOM 1231 O ASP A 77 35.304 62.398 -16.320 1.00 0.00 O ATOM 1232 CB ASP A 77 34.620 64.583 -13.717 1.00 0.00 C ATOM 1233 CG ASP A 77 33.397 64.814 -14.582 1.00 0.00 C ATOM 1234 OD1 ASP A 77 32.348 64.189 -14.319 1.00 0.00 O ATOM 1235 OD2 ASP A 77 33.467 65.670 -15.491 1.00 0.00 O ATOM 0 H ASP A 77 37.574 63.707 -14.217 1.00 0.00 H new ATOM 0 HA ASP A 77 35.040 62.479 -13.845 1.00 0.00 H new ATOM 0 HB2 ASP A 77 34.295 64.406 -12.692 1.00 0.00 H new ATOM 0 HB3 ASP A 77 35.220 65.493 -13.709 1.00 0.00 H new ATOM 1240 N GLN A 78 36.221 64.469 -16.188 1.00 0.00 N ATOM 1241 CA GLN A 78 36.425 64.694 -17.618 1.00 0.00 C ATOM 1242 C GLN A 78 36.705 66.173 -17.815 1.00 0.00 C ATOM 1243 O GLN A 78 37.450 66.580 -18.708 1.00 0.00 O ATOM 1244 CB GLN A 78 35.191 64.294 -18.445 1.00 0.00 C ATOM 1245 CG GLN A 78 35.301 64.645 -19.922 1.00 0.00 C ATOM 1246 CD GLN A 78 36.499 64.002 -20.599 1.00 0.00 C ATOM 1247 OE1 GLN A 78 36.914 62.900 -20.249 1.00 0.00 O ATOM 1248 NE2 GLN A 78 37.078 64.704 -21.562 1.00 0.00 N ATOM 0 H GLN A 78 36.563 65.236 -15.609 1.00 0.00 H new ATOM 0 HA GLN A 78 37.257 64.078 -17.960 1.00 0.00 H new ATOM 0 HB2 GLN A 78 35.032 63.220 -18.347 1.00 0.00 H new ATOM 0 HB3 GLN A 78 34.312 64.785 -18.029 1.00 0.00 H new ATOM 0 HG2 GLN A 78 34.391 64.331 -20.433 1.00 0.00 H new ATOM 0 HG3 GLN A 78 35.369 65.728 -20.028 1.00 0.00 H new ATOM 0 HE21 GLN A 78 36.703 65.616 -21.824 1.00 0.00 H new ATOM 0 HE22 GLN A 78 37.898 64.333 -22.041 1.00 0.00 H new ATOM 1257 N THR A 79 36.092 66.963 -16.947 1.00 0.00 N ATOM 1258 CA THR A 79 36.216 68.408 -16.976 1.00 0.00 C ATOM 1259 C THR A 79 37.672 68.862 -16.801 1.00 0.00 C ATOM 1260 O THR A 79 38.331 68.541 -15.803 1.00 0.00 O ATOM 1261 CB THR A 79 35.339 69.035 -15.872 1.00 0.00 C ATOM 1262 OG1 THR A 79 33.998 68.524 -15.965 1.00 0.00 O ATOM 1263 CG2 THR A 79 35.311 70.553 -15.988 1.00 0.00 C ATOM 0 H THR A 79 35.492 66.615 -16.199 1.00 0.00 H new ATOM 0 HA THR A 79 35.877 68.747 -17.955 1.00 0.00 H new ATOM 0 HB THR A 79 35.770 68.770 -14.907 1.00 0.00 H new ATOM 0 HG1 THR A 79 33.974 67.604 -15.628 1.00 0.00 H new ATOM 0 HG21 THR A 79 34.685 70.967 -15.197 1.00 0.00 H new ATOM 0 HG22 THR A 79 36.324 70.944 -15.892 1.00 0.00 H new ATOM 0 HG23 THR A 79 34.904 70.836 -16.959 1.00 0.00 H new ATOM 1271 N PRO A 80 38.205 69.584 -17.799 1.00 0.00 N ATOM 1272 CA PRO A 80 39.526 70.207 -17.715 1.00 0.00 C ATOM 1273 C PRO A 80 39.496 71.453 -16.834 1.00 0.00 C ATOM 1274 O PRO A 80 38.423 71.929 -16.457 1.00 0.00 O ATOM 1275 CB PRO A 80 39.846 70.583 -19.174 1.00 0.00 C ATOM 1276 CG PRO A 80 38.787 69.920 -19.997 1.00 0.00 C ATOM 1277 CD PRO A 80 37.587 69.823 -19.105 1.00 0.00 C ATOM 0 HA PRO A 80 40.270 69.546 -17.270 1.00 0.00 H new ATOM 0 HB2 PRO A 80 39.832 71.664 -19.313 1.00 0.00 H new ATOM 0 HB3 PRO A 80 40.839 70.237 -19.460 1.00 0.00 H new ATOM 0 HG2 PRO A 80 38.565 70.501 -20.892 1.00 0.00 H new ATOM 0 HG3 PRO A 80 39.109 68.933 -20.330 1.00 0.00 H new ATOM 0 HD2 PRO A 80 36.994 70.738 -19.116 1.00 0.00 H new ATOM 0 HD3 PRO A 80 36.924 69.010 -19.399 1.00 0.00 H new ATOM 1285 N PHE A 81 40.669 71.974 -16.504 1.00 0.00 N ATOM 1286 CA PHE A 81 40.764 73.158 -15.663 1.00 0.00 C ATOM 1287 C PHE A 81 40.155 74.365 -16.371 1.00 0.00 C ATOM 1288 O PHE A 81 40.529 74.687 -17.498 1.00 0.00 O ATOM 1289 CB PHE A 81 42.223 73.438 -15.295 1.00 0.00 C ATOM 1290 CG PHE A 81 42.398 74.581 -14.335 1.00 0.00 C ATOM 1291 CD1 PHE A 81 41.922 74.490 -13.036 1.00 0.00 C ATOM 1292 CD2 PHE A 81 43.039 75.744 -14.730 1.00 0.00 C ATOM 1293 CE1 PHE A 81 42.082 75.537 -12.150 1.00 0.00 C ATOM 1294 CE2 PHE A 81 43.202 76.795 -13.847 1.00 0.00 C ATOM 1295 CZ PHE A 81 42.723 76.690 -12.556 1.00 0.00 C ATOM 0 H PHE A 81 41.567 71.596 -16.805 1.00 0.00 H new ATOM 0 HA PHE A 81 40.204 72.975 -14.746 1.00 0.00 H new ATOM 0 HB2 PHE A 81 42.657 72.539 -14.857 1.00 0.00 H new ATOM 0 HB3 PHE A 81 42.783 73.651 -16.205 1.00 0.00 H new ATOM 0 HD1 PHE A 81 41.420 73.590 -12.713 1.00 0.00 H new ATOM 0 HD2 PHE A 81 43.415 75.830 -15.739 1.00 0.00 H new ATOM 0 HE1 PHE A 81 41.706 75.454 -11.141 1.00 0.00 H new ATOM 0 HE2 PHE A 81 43.703 77.697 -14.166 1.00 0.00 H new ATOM 0 HZ PHE A 81 42.850 77.510 -11.864 1.00 0.00 H new ATOM 1305 N ASN A 82 39.208 75.014 -15.707 1.00 0.00 N ATOM 1306 CA ASN A 82 38.539 76.187 -16.260 1.00 0.00 C ATOM 1307 C ASN A 82 39.399 77.433 -16.091 1.00 0.00 C ATOM 1308 O ASN A 82 39.580 77.915 -14.977 1.00 0.00 O ATOM 1309 CB ASN A 82 37.187 76.405 -15.573 1.00 0.00 C ATOM 1310 CG ASN A 82 36.016 75.830 -16.349 1.00 0.00 C ATOM 1311 OD1 ASN A 82 35.408 76.518 -17.170 1.00 0.00 O ATOM 1312 ND2 ASN A 82 35.681 74.576 -16.088 1.00 0.00 N ATOM 0 H ASN A 82 38.883 74.746 -14.778 1.00 0.00 H new ATOM 0 HA ASN A 82 38.380 76.010 -17.324 1.00 0.00 H new ATOM 0 HB2 ASN A 82 37.214 75.952 -14.582 1.00 0.00 H new ATOM 0 HB3 ASN A 82 37.029 77.474 -15.430 1.00 0.00 H new ATOM 0 HD21 ASN A 82 34.894 74.147 -16.574 1.00 0.00 H new ATOM 0 HD22 ASN A 82 36.210 74.039 -15.401 1.00 0.00 H new ATOM 1319 N PRO A 83 39.934 77.978 -17.197 1.00 0.00 N ATOM 1320 CA PRO A 83 40.783 79.173 -17.160 1.00 0.00 C ATOM 1321 C PRO A 83 39.994 80.434 -16.816 1.00 0.00 C ATOM 1322 O PRO A 83 40.515 81.358 -16.199 1.00 0.00 O ATOM 1323 CB PRO A 83 41.346 79.272 -18.587 1.00 0.00 C ATOM 1324 CG PRO A 83 41.005 77.977 -19.248 1.00 0.00 C ATOM 1325 CD PRO A 83 39.766 77.477 -18.566 1.00 0.00 C ATOM 0 HA PRO A 83 41.552 79.093 -16.392 1.00 0.00 H new ATOM 0 HB2 PRO A 83 40.907 80.113 -19.124 1.00 0.00 H new ATOM 0 HB3 PRO A 83 42.424 79.432 -18.572 1.00 0.00 H new ATOM 0 HG2 PRO A 83 40.833 78.117 -20.315 1.00 0.00 H new ATOM 0 HG3 PRO A 83 41.821 77.261 -19.148 1.00 0.00 H new ATOM 0 HD2 PRO A 83 38.861 77.866 -19.032 1.00 0.00 H new ATOM 0 HD3 PRO A 83 39.697 76.390 -18.595 1.00 0.00 H new ATOM 1333 N ARG A 84 38.730 80.460 -17.221 1.00 0.00 N ATOM 1334 CA ARG A 84 37.871 81.616 -16.990 1.00 0.00 C ATOM 1335 C ARG A 84 37.147 81.487 -15.647 1.00 0.00 C ATOM 1336 O ARG A 84 36.558 82.445 -15.148 1.00 0.00 O ATOM 1337 CB ARG A 84 36.868 81.745 -18.154 1.00 0.00 C ATOM 1338 CG ARG A 84 35.909 82.922 -18.064 1.00 0.00 C ATOM 1339 CD ARG A 84 34.607 82.491 -17.428 1.00 0.00 C ATOM 1340 NE ARG A 84 33.581 83.534 -17.455 1.00 0.00 N ATOM 1341 CZ ARG A 84 32.671 83.695 -16.491 1.00 0.00 C ATOM 1342 NH1 ARG A 84 32.792 83.038 -15.346 1.00 0.00 N ATOM 1343 NH2 ARG A 84 31.669 84.550 -16.647 1.00 0.00 N ATOM 0 H ARG A 84 38.275 79.691 -17.713 1.00 0.00 H new ATOM 0 HA ARG A 84 38.480 82.519 -16.949 1.00 0.00 H new ATOM 0 HB2 ARG A 84 37.428 81.825 -19.086 1.00 0.00 H new ATOM 0 HB3 ARG A 84 36.284 80.826 -18.211 1.00 0.00 H new ATOM 0 HG2 ARG A 84 36.360 83.723 -17.478 1.00 0.00 H new ATOM 0 HG3 ARG A 84 35.720 83.323 -19.060 1.00 0.00 H new ATOM 0 HD2 ARG A 84 34.232 81.608 -17.945 1.00 0.00 H new ATOM 0 HD3 ARG A 84 34.794 82.200 -16.394 1.00 0.00 H new ATOM 0 HE ARG A 84 33.560 84.171 -18.251 1.00 0.00 H new ATOM 0 HH11 ARG A 84 33.581 82.408 -15.200 1.00 0.00 H new ATOM 0 HH12 ARG A 84 32.096 83.162 -14.611 1.00 0.00 H new ATOM 0 HH21 ARG A 84 31.589 85.091 -17.508 1.00 0.00 H new ATOM 0 HH22 ARG A 84 30.978 84.667 -15.906 1.00 0.00 H new ATOM 1357 N ARG A 85 37.205 80.305 -15.053 1.00 0.00 N ATOM 1358 CA ARG A 85 36.479 80.047 -13.819 1.00 0.00 C ATOM 1359 C ARG A 85 37.396 79.475 -12.748 1.00 0.00 C ATOM 1360 O ARG A 85 37.447 78.266 -12.539 1.00 0.00 O ATOM 1361 CB ARG A 85 35.302 79.101 -14.075 1.00 0.00 C ATOM 1362 CG ARG A 85 34.219 79.707 -14.950 1.00 0.00 C ATOM 1363 CD ARG A 85 33.141 78.695 -15.296 1.00 0.00 C ATOM 1364 NE ARG A 85 32.061 79.299 -16.077 1.00 0.00 N ATOM 1365 CZ ARG A 85 31.461 78.713 -17.110 1.00 0.00 C ATOM 1366 NH1 ARG A 85 31.832 77.498 -17.507 1.00 0.00 N ATOM 1367 NH2 ARG A 85 30.482 79.352 -17.738 1.00 0.00 N ATOM 0 H ARG A 85 37.744 79.513 -15.403 1.00 0.00 H new ATOM 0 HA ARG A 85 36.091 80.998 -13.456 1.00 0.00 H new ATOM 0 HB2 ARG A 85 35.673 78.191 -14.547 1.00 0.00 H new ATOM 0 HB3 ARG A 85 34.866 78.809 -13.120 1.00 0.00 H new ATOM 0 HG2 ARG A 85 33.769 80.556 -14.435 1.00 0.00 H new ATOM 0 HG3 ARG A 85 34.665 80.091 -15.867 1.00 0.00 H new ATOM 0 HD2 ARG A 85 33.582 77.873 -15.860 1.00 0.00 H new ATOM 0 HD3 ARG A 85 32.733 78.270 -14.379 1.00 0.00 H new ATOM 0 HE ARG A 85 31.747 80.232 -15.812 1.00 0.00 H new ATOM 0 HH11 ARG A 85 32.582 77.009 -17.018 1.00 0.00 H new ATOM 0 HH12 ARG A 85 31.367 77.056 -18.300 1.00 0.00 H new ATOM 0 HH21 ARG A 85 30.198 80.281 -17.427 1.00 0.00 H new ATOM 0 HH22 ARG A 85 30.014 78.914 -18.531 1.00 0.00 H new ATOM 1381 N VAL A 86 38.142 80.356 -12.097 1.00 0.00 N ATOM 1382 CA VAL A 86 38.998 79.969 -10.987 1.00 0.00 C ATOM 1383 C VAL A 86 38.594 80.756 -9.746 1.00 0.00 C ATOM 1384 O VAL A 86 38.969 81.917 -9.586 1.00 0.00 O ATOM 1385 CB VAL A 86 40.491 80.224 -11.286 1.00 0.00 C ATOM 1386 CG1 VAL A 86 41.362 79.584 -10.221 1.00 0.00 C ATOM 1387 CG2 VAL A 86 40.871 79.711 -12.666 1.00 0.00 C ATOM 0 H VAL A 86 38.171 81.351 -12.321 1.00 0.00 H new ATOM 0 HA VAL A 86 38.870 78.899 -10.826 1.00 0.00 H new ATOM 0 HB VAL A 86 40.658 81.301 -11.272 1.00 0.00 H new ATOM 0 HG11 VAL A 86 42.411 79.773 -10.447 1.00 0.00 H new ATOM 0 HG12 VAL A 86 41.118 80.009 -9.248 1.00 0.00 H new ATOM 0 HG13 VAL A 86 41.183 78.509 -10.202 1.00 0.00 H new ATOM 0 HG21 VAL A 86 41.928 79.905 -12.848 1.00 0.00 H new ATOM 0 HG22 VAL A 86 40.684 78.638 -12.720 1.00 0.00 H new ATOM 0 HG23 VAL A 86 40.273 80.222 -13.421 1.00 0.00 H new ATOM 1397 N PHE A 87 37.814 80.130 -8.881 1.00 0.00 N ATOM 1398 CA PHE A 87 37.222 80.833 -7.752 1.00 0.00 C ATOM 1399 C PHE A 87 38.017 80.602 -6.472 1.00 0.00 C ATOM 1400 O PHE A 87 37.545 79.929 -5.556 1.00 0.00 O ATOM 1401 CB PHE A 87 35.774 80.380 -7.548 1.00 0.00 C ATOM 1402 CG PHE A 87 34.958 80.363 -8.811 1.00 0.00 C ATOM 1403 CD1 PHE A 87 34.394 81.526 -9.309 1.00 0.00 C ATOM 1404 CD2 PHE A 87 34.751 79.175 -9.496 1.00 0.00 C ATOM 1405 CE1 PHE A 87 33.639 81.504 -10.467 1.00 0.00 C ATOM 1406 CE2 PHE A 87 33.999 79.147 -10.653 1.00 0.00 C ATOM 1407 CZ PHE A 87 33.441 80.312 -11.139 1.00 0.00 C ATOM 0 H PHE A 87 37.576 79.140 -8.937 1.00 0.00 H new ATOM 0 HA PHE A 87 37.242 81.899 -7.978 1.00 0.00 H new ATOM 0 HB2 PHE A 87 35.774 79.380 -7.113 1.00 0.00 H new ATOM 0 HB3 PHE A 87 35.295 81.041 -6.826 1.00 0.00 H new ATOM 0 HD1 PHE A 87 34.546 82.459 -8.787 1.00 0.00 H new ATOM 0 HD2 PHE A 87 35.184 78.260 -9.119 1.00 0.00 H new ATOM 0 HE1 PHE A 87 33.204 82.417 -10.846 1.00 0.00 H new ATOM 0 HE2 PHE A 87 33.847 78.215 -11.177 1.00 0.00 H new ATOM 0 HZ PHE A 87 32.850 80.293 -12.043 1.00 0.00 H new ATOM 1417 N TRP A 88 39.223 81.153 -6.411 1.00 0.00 N ATOM 1418 CA TRP A 88 40.053 81.031 -5.216 1.00 0.00 C ATOM 1419 C TRP A 88 39.424 81.761 -4.038 1.00 0.00 C ATOM 1420 O TRP A 88 38.705 82.751 -4.214 1.00 0.00 O ATOM 1421 CB TRP A 88 41.462 81.578 -5.461 1.00 0.00 C ATOM 1422 CG TRP A 88 42.317 80.687 -6.305 1.00 0.00 C ATOM 1423 CD1 TRP A 88 42.945 81.017 -7.469 1.00 0.00 C ATOM 1424 CD2 TRP A 88 42.638 79.314 -6.049 1.00 0.00 C ATOM 1425 NE1 TRP A 88 43.641 79.935 -7.952 1.00 0.00 N ATOM 1426 CE2 TRP A 88 43.465 78.877 -7.100 1.00 0.00 C ATOM 1427 CE3 TRP A 88 42.307 78.412 -5.034 1.00 0.00 C ATOM 1428 CZ2 TRP A 88 43.965 77.580 -7.165 1.00 0.00 C ATOM 1429 CZ3 TRP A 88 42.804 77.124 -5.100 1.00 0.00 C ATOM 1430 CH2 TRP A 88 43.625 76.719 -6.158 1.00 0.00 C ATOM 0 H TRP A 88 39.648 81.686 -7.170 1.00 0.00 H new ATOM 0 HA TRP A 88 40.124 79.969 -4.980 1.00 0.00 H new ATOM 0 HB2 TRP A 88 41.385 82.553 -5.942 1.00 0.00 H new ATOM 0 HB3 TRP A 88 41.953 81.734 -4.501 1.00 0.00 H new ATOM 0 HD1 TRP A 88 42.902 81.987 -7.942 1.00 0.00 H new ATOM 0 HE1 TRP A 88 44.198 79.922 -8.806 1.00 0.00 H new ATOM 0 HE3 TRP A 88 41.674 78.716 -4.213 1.00 0.00 H new ATOM 0 HZ2 TRP A 88 44.598 77.265 -7.981 1.00 0.00 H new ATOM 0 HZ3 TRP A 88 42.554 76.418 -4.322 1.00 0.00 H new ATOM 0 HH2 TRP A 88 43.998 75.706 -6.180 1.00 0.00 H new ATOM 1441 N HIS A 89 39.683 81.263 -2.837 1.00 0.00 N ATOM 1442 CA HIS A 89 39.187 81.905 -1.633 1.00 0.00 C ATOM 1443 C HIS A 89 39.830 83.281 -1.488 1.00 0.00 C ATOM 1444 O HIS A 89 39.137 84.289 -1.315 1.00 0.00 O ATOM 1445 CB HIS A 89 39.467 81.039 -0.399 1.00 0.00 C ATOM 1446 CG HIS A 89 38.508 81.301 0.715 1.00 0.00 C ATOM 1447 ND1 HIS A 89 38.824 82.043 1.831 1.00 0.00 N ATOM 1448 CD2 HIS A 89 37.203 80.967 0.844 1.00 0.00 C ATOM 1449 CE1 HIS A 89 37.746 82.166 2.587 1.00 0.00 C ATOM 1450 NE2 HIS A 89 36.752 81.520 2.010 1.00 0.00 N ATOM 0 H HIS A 89 40.232 80.419 -2.673 1.00 0.00 H new ATOM 0 HA HIS A 89 38.107 82.025 -1.714 1.00 0.00 H new ATOM 0 HB2 HIS A 89 39.415 79.987 -0.679 1.00 0.00 H new ATOM 0 HB3 HIS A 89 40.483 81.226 -0.051 1.00 0.00 H new ATOM 0 HD1 HIS A 89 39.742 82.435 2.041 1.00 0.00 H new ATOM 0 HD2 HIS A 89 36.624 80.373 0.153 1.00 0.00 H new ATOM 0 HE1 HIS A 89 37.689 82.705 3.521 1.00 0.00 H new ATOM 0 HE2 HIS A 89 35.802 81.445 2.374 1.00 0.00 H new ATOM 1459 N LYS A 90 41.155 83.291 -1.581 1.00 0.00 N ATOM 1460 CA LYS A 90 41.968 84.504 -1.596 1.00 0.00 C ATOM 1461 C LYS A 90 43.429 84.075 -1.607 1.00 0.00 C ATOM 1462 O LYS A 90 43.728 82.945 -1.992 1.00 0.00 O ATOM 1463 CB LYS A 90 41.686 85.411 -0.384 1.00 0.00 C ATOM 1464 CG LYS A 90 42.131 84.843 0.956 1.00 0.00 C ATOM 1465 CD LYS A 90 42.127 85.918 2.031 1.00 0.00 C ATOM 1466 CE LYS A 90 42.787 85.439 3.313 1.00 0.00 C ATOM 1467 NZ LYS A 90 41.984 84.399 4.003 1.00 0.00 N ATOM 0 H LYS A 90 41.708 82.436 -1.650 1.00 0.00 H new ATOM 0 HA LYS A 90 41.722 85.090 -2.481 1.00 0.00 H new ATOM 0 HB2 LYS A 90 42.184 86.368 -0.540 1.00 0.00 H new ATOM 0 HB3 LYS A 90 40.616 85.612 -0.340 1.00 0.00 H new ATOM 0 HG2 LYS A 90 41.468 84.029 1.248 1.00 0.00 H new ATOM 0 HG3 LYS A 90 43.132 84.421 0.862 1.00 0.00 H new ATOM 0 HD2 LYS A 90 42.648 86.802 1.663 1.00 0.00 H new ATOM 0 HD3 LYS A 90 41.100 86.218 2.241 1.00 0.00 H new ATOM 0 HE2 LYS A 90 43.775 85.040 3.084 1.00 0.00 H new ATOM 0 HE3 LYS A 90 42.933 86.286 3.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 42.600 83.845 4.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 41.236 84.854 4.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 41.553 83.768 3.297 1.00 0.00 H new ATOM 1481 N ASN A 91 44.331 84.958 -1.204 1.00 0.00 N ATOM 1482 CA ASN A 91 45.710 84.561 -0.956 1.00 0.00 C ATOM 1483 C ASN A 91 45.760 83.739 0.332 1.00 0.00 C ATOM 1484 O ASN A 91 46.169 84.218 1.390 1.00 0.00 O ATOM 1485 CB ASN A 91 46.648 85.780 -0.879 1.00 0.00 C ATOM 1486 CG ASN A 91 46.215 86.829 0.138 1.00 0.00 C ATOM 1487 OD1 ASN A 91 45.025 87.043 0.375 1.00 0.00 O ATOM 1488 ND2 ASN A 91 47.186 87.494 0.746 1.00 0.00 N ATOM 0 H ASN A 91 44.136 85.946 -1.043 1.00 0.00 H new ATOM 0 HA ASN A 91 46.062 83.953 -1.790 1.00 0.00 H new ATOM 0 HB2 ASN A 91 47.652 85.438 -0.629 1.00 0.00 H new ATOM 0 HB3 ASN A 91 46.706 86.245 -1.863 1.00 0.00 H new ATOM 0 HD21 ASN A 91 46.959 88.210 1.436 1.00 0.00 H new ATOM 0 HD22 ASN A 91 48.160 87.290 0.524 1.00 0.00 H new ATOM 1495 N GLU A 92 45.301 82.503 0.227 1.00 0.00 N ATOM 1496 CA GLU A 92 45.078 81.656 1.384 1.00 0.00 C ATOM 1497 C GLU A 92 46.317 80.819 1.690 1.00 0.00 C ATOM 1498 O GLU A 92 46.783 80.061 0.843 1.00 0.00 O ATOM 1499 CB GLU A 92 43.874 80.747 1.115 1.00 0.00 C ATOM 1500 CG GLU A 92 43.091 80.372 2.360 1.00 0.00 C ATOM 1501 CD GLU A 92 42.501 81.581 3.054 1.00 0.00 C ATOM 1502 OE1 GLU A 92 41.460 82.113 2.584 1.00 0.00 O ATOM 1503 OE2 GLU A 92 43.076 82.025 4.067 1.00 0.00 O ATOM 0 H GLU A 92 45.073 82.060 -0.663 1.00 0.00 H new ATOM 0 HA GLU A 92 44.876 82.283 2.252 1.00 0.00 H new ATOM 0 HB2 GLU A 92 43.205 81.246 0.414 1.00 0.00 H new ATOM 0 HB3 GLU A 92 44.222 79.835 0.629 1.00 0.00 H new ATOM 0 HG2 GLU A 92 42.290 79.684 2.089 1.00 0.00 H new ATOM 0 HG3 GLU A 92 43.745 79.842 3.052 1.00 0.00 H new ATOM 1510 N PRO A 93 46.887 80.978 2.896 1.00 0.00 N ATOM 1511 CA PRO A 93 48.029 80.180 3.343 1.00 0.00 C ATOM 1512 C PRO A 93 47.624 78.742 3.654 1.00 0.00 C ATOM 1513 O PRO A 93 48.253 77.799 3.179 1.00 0.00 O ATOM 1514 CB PRO A 93 48.506 80.892 4.619 1.00 0.00 C ATOM 1515 CG PRO A 93 47.753 82.183 4.671 1.00 0.00 C ATOM 1516 CD PRO A 93 46.481 81.958 3.907 1.00 0.00 C ATOM 0 HA PRO A 93 48.802 80.110 2.578 1.00 0.00 H new ATOM 0 HB2 PRO A 93 48.305 80.286 5.503 1.00 0.00 H new ATOM 0 HB3 PRO A 93 49.581 81.067 4.590 1.00 0.00 H new ATOM 0 HG2 PRO A 93 47.542 82.469 5.701 1.00 0.00 H new ATOM 0 HG3 PRO A 93 48.335 82.991 4.228 1.00 0.00 H new ATOM 0 HD2 PRO A 93 45.686 81.575 4.547 1.00 0.00 H new ATOM 0 HD3 PRO A 93 46.111 82.878 3.455 1.00 0.00 H new ATOM 1524 N ASP A 94 46.571 78.603 4.464 1.00 0.00 N ATOM 1525 CA ASP A 94 46.004 77.300 4.830 1.00 0.00 C ATOM 1526 C ASP A 94 47.057 76.368 5.437 1.00 0.00 C ATOM 1527 O ASP A 94 47.388 76.476 6.621 1.00 0.00 O ATOM 1528 CB ASP A 94 45.336 76.640 3.613 1.00 0.00 C ATOM 1529 CG ASP A 94 44.608 75.353 3.960 1.00 0.00 C ATOM 1530 OD1 ASP A 94 43.422 75.427 4.341 1.00 0.00 O ATOM 1531 OD2 ASP A 94 45.221 74.269 3.843 1.00 0.00 O ATOM 0 H ASP A 94 46.085 79.394 4.887 1.00 0.00 H new ATOM 0 HA ASP A 94 45.247 77.478 5.594 1.00 0.00 H new ATOM 0 HB2 ASP A 94 44.630 77.341 3.168 1.00 0.00 H new ATOM 0 HB3 ASP A 94 46.094 76.430 2.859 1.00 0.00 H new ATOM 1536 N ASN A 95 47.602 75.493 4.601 1.00 0.00 N ATOM 1537 CA ASN A 95 48.547 74.462 5.021 1.00 0.00 C ATOM 1538 C ASN A 95 48.880 73.579 3.823 1.00 0.00 C ATOM 1539 O ASN A 95 49.762 72.725 3.890 1.00 0.00 O ATOM 1540 CB ASN A 95 47.956 73.602 6.149 1.00 0.00 C ATOM 1541 CG ASN A 95 49.000 72.758 6.861 1.00 0.00 C ATOM 1542 OD1 ASN A 95 49.256 71.610 6.497 1.00 0.00 O ATOM 1543 ND2 ASN A 95 49.607 73.324 7.892 1.00 0.00 N ATOM 0 H ASN A 95 47.399 75.478 3.601 1.00 0.00 H new ATOM 0 HA ASN A 95 49.450 74.942 5.398 1.00 0.00 H new ATOM 0 HB2 ASN A 95 47.465 74.251 6.874 1.00 0.00 H new ATOM 0 HB3 ASN A 95 47.188 72.948 5.736 1.00 0.00 H new ATOM 0 HD21 ASN A 95 50.314 72.807 8.415 1.00 0.00 H new ATOM 0 HD22 ASN A 95 49.368 74.278 8.164 1.00 0.00 H new ATOM 1550 N SER A 96 48.134 73.799 2.741 1.00 0.00 N ATOM 1551 CA SER A 96 48.302 73.086 1.478 1.00 0.00 C ATOM 1552 C SER A 96 49.774 72.901 1.101 1.00 0.00 C ATOM 1553 O SER A 96 50.519 73.867 0.921 1.00 0.00 O ATOM 1554 CB SER A 96 47.573 73.853 0.375 1.00 0.00 C ATOM 1555 OG SER A 96 47.593 73.154 -0.855 1.00 0.00 O ATOM 0 H SER A 96 47.384 74.490 2.718 1.00 0.00 H new ATOM 0 HA SER A 96 47.878 72.089 1.596 1.00 0.00 H new ATOM 0 HB2 SER A 96 46.540 74.028 0.676 1.00 0.00 H new ATOM 0 HB3 SER A 96 48.037 74.831 0.245 1.00 0.00 H new ATOM 0 HG SER A 96 46.972 73.579 -1.483 1.00 0.00 H new ATOM 1561 N GLN A 97 50.173 71.640 0.996 1.00 0.00 N ATOM 1562 CA GLN A 97 51.524 71.267 0.609 1.00 0.00 C ATOM 1563 C GLN A 97 51.535 69.796 0.223 1.00 0.00 C ATOM 1564 O GLN A 97 50.747 69.015 0.750 1.00 0.00 O ATOM 1565 CB GLN A 97 52.511 71.528 1.750 1.00 0.00 C ATOM 1566 CG GLN A 97 52.135 70.830 3.047 1.00 0.00 C ATOM 1567 CD GLN A 97 53.057 71.182 4.193 1.00 0.00 C ATOM 1568 OE1 GLN A 97 54.246 71.434 4.000 1.00 0.00 O ATOM 1569 NE2 GLN A 97 52.509 71.222 5.397 1.00 0.00 N ATOM 0 H GLN A 97 49.563 70.843 1.179 1.00 0.00 H new ATOM 0 HA GLN A 97 51.835 71.873 -0.242 1.00 0.00 H new ATOM 0 HB2 GLN A 97 53.504 71.199 1.444 1.00 0.00 H new ATOM 0 HB3 GLN A 97 52.572 72.602 1.929 1.00 0.00 H new ATOM 0 HG2 GLN A 97 51.113 71.097 3.314 1.00 0.00 H new ATOM 0 HG3 GLN A 97 52.152 69.751 2.892 1.00 0.00 H new ATOM 0 HE21 GLN A 97 51.519 71.006 5.514 1.00 0.00 H new ATOM 0 HE22 GLN A 97 53.077 71.469 6.208 1.00 0.00 H new ATOM 1578 N GLY A 98 52.413 69.423 -0.697 1.00 0.00 N ATOM 1579 CA GLY A 98 52.413 68.061 -1.192 1.00 0.00 C ATOM 1580 C GLY A 98 51.283 67.849 -2.171 1.00 0.00 C ATOM 1581 O GLY A 98 51.302 68.403 -3.272 1.00 0.00 O ATOM 0 H GLY A 98 53.120 70.033 -1.107 1.00 0.00 H new ATOM 0 HA2 GLY A 98 53.365 67.845 -1.676 1.00 0.00 H new ATOM 0 HA3 GLY A 98 52.314 67.366 -0.358 1.00 0.00 H new ATOM 1585 N GLU A 99 50.288 67.074 -1.776 1.00 0.00 N ATOM 1586 CA GLU A 99 49.100 66.907 -2.588 1.00 0.00 C ATOM 1587 C GLU A 99 48.094 67.995 -2.222 1.00 0.00 C ATOM 1588 O GLU A 99 47.919 68.325 -1.047 1.00 0.00 O ATOM 1589 CB GLU A 99 48.485 65.508 -2.409 1.00 0.00 C ATOM 1590 CG GLU A 99 47.784 65.282 -1.073 1.00 0.00 C ATOM 1591 CD GLU A 99 48.709 64.867 0.055 1.00 0.00 C ATOM 1592 OE1 GLU A 99 49.742 65.531 0.268 1.00 0.00 O ATOM 1593 OE2 GLU A 99 48.372 63.888 0.753 1.00 0.00 O ATOM 0 H GLU A 99 50.281 66.552 -0.900 1.00 0.00 H new ATOM 0 HA GLU A 99 49.374 67.000 -3.639 1.00 0.00 H new ATOM 0 HB2 GLU A 99 47.769 65.336 -3.212 1.00 0.00 H new ATOM 0 HB3 GLU A 99 49.273 64.763 -2.520 1.00 0.00 H new ATOM 0 HG2 GLU A 99 47.269 66.199 -0.786 1.00 0.00 H new ATOM 0 HG3 GLU A 99 47.020 64.515 -1.202 1.00 0.00 H new ATOM 1600 N ASN A 100 47.445 68.567 -3.221 1.00 0.00 N ATOM 1601 CA ASN A 100 46.540 69.679 -2.983 1.00 0.00 C ATOM 1602 C ASN A 100 45.223 69.477 -3.718 1.00 0.00 C ATOM 1603 O ASN A 100 45.186 69.280 -4.934 1.00 0.00 O ATOM 1604 CB ASN A 100 47.199 71.011 -3.372 1.00 0.00 C ATOM 1605 CG ASN A 100 47.723 71.029 -4.795 1.00 0.00 C ATOM 1606 OD1 ASN A 100 47.038 71.457 -5.717 1.00 0.00 O ATOM 1607 ND2 ASN A 100 48.950 70.560 -4.982 1.00 0.00 N ATOM 0 H ASN A 100 47.526 68.283 -4.197 1.00 0.00 H new ATOM 0 HA ASN A 100 46.319 69.715 -1.916 1.00 0.00 H new ATOM 0 HB2 ASN A 100 46.475 71.816 -3.249 1.00 0.00 H new ATOM 0 HB3 ASN A 100 48.022 71.215 -2.687 1.00 0.00 H new ATOM 0 HD21 ASN A 100 49.354 70.547 -5.919 1.00 0.00 H new ATOM 0 HD22 ASN A 100 49.489 70.212 -4.189 1.00 0.00 H new ATOM 1614 N CYS A 101 44.146 69.490 -2.953 1.00 0.00 N ATOM 1615 CA CYS A 101 42.811 69.304 -3.490 1.00 0.00 C ATOM 1616 C CYS A 101 41.898 70.411 -2.976 1.00 0.00 C ATOM 1617 O CYS A 101 41.825 70.653 -1.769 1.00 0.00 O ATOM 1618 CB CYS A 101 42.268 67.927 -3.084 1.00 0.00 C ATOM 1619 SG CYS A 101 43.214 66.516 -3.741 1.00 0.00 S ATOM 0 H CYS A 101 44.173 69.630 -1.943 1.00 0.00 H new ATOM 0 HA CYS A 101 42.848 69.352 -4.578 1.00 0.00 H new ATOM 0 HB2 CYS A 101 42.254 67.863 -1.996 1.00 0.00 H new ATOM 0 HB3 CYS A 101 41.235 67.844 -3.422 1.00 0.00 H new ATOM 1624 N VAL A 102 41.217 71.096 -3.886 1.00 0.00 N ATOM 1625 CA VAL A 102 40.385 72.232 -3.508 1.00 0.00 C ATOM 1626 C VAL A 102 39.024 71.783 -2.993 1.00 0.00 C ATOM 1627 O VAL A 102 38.473 70.773 -3.438 1.00 0.00 O ATOM 1628 CB VAL A 102 40.185 73.227 -4.674 1.00 0.00 C ATOM 1629 CG1 VAL A 102 41.521 73.760 -5.158 1.00 0.00 C ATOM 1630 CG2 VAL A 102 39.419 72.586 -5.819 1.00 0.00 C ATOM 0 H VAL A 102 41.224 70.887 -4.884 1.00 0.00 H new ATOM 0 HA VAL A 102 40.921 72.742 -2.708 1.00 0.00 H new ATOM 0 HB VAL A 102 39.593 74.063 -4.302 1.00 0.00 H new ATOM 0 HG11 VAL A 102 41.358 74.459 -5.979 1.00 0.00 H new ATOM 0 HG12 VAL A 102 42.026 74.273 -4.340 1.00 0.00 H new ATOM 0 HG13 VAL A 102 42.140 72.932 -5.504 1.00 0.00 H new ATOM 0 HG21 VAL A 102 39.294 73.310 -6.624 1.00 0.00 H new ATOM 0 HG22 VAL A 102 39.973 71.724 -6.190 1.00 0.00 H new ATOM 0 HG23 VAL A 102 38.439 72.264 -5.466 1.00 0.00 H new ATOM 1640 N VAL A 103 38.504 72.527 -2.032 1.00 0.00 N ATOM 1641 CA VAL A 103 37.179 72.278 -1.494 1.00 0.00 C ATOM 1642 C VAL A 103 36.357 73.560 -1.519 1.00 0.00 C ATOM 1643 O VAL A 103 36.914 74.660 -1.534 1.00 0.00 O ATOM 1644 CB VAL A 103 37.236 71.746 -0.040 1.00 0.00 C ATOM 1645 CG1 VAL A 103 38.073 70.483 0.043 1.00 0.00 C ATOM 1646 CG2 VAL A 103 37.775 72.801 0.917 1.00 0.00 C ATOM 0 H VAL A 103 38.987 73.317 -1.605 1.00 0.00 H new ATOM 0 HA VAL A 103 36.713 71.517 -2.120 1.00 0.00 H new ATOM 0 HB VAL A 103 36.216 71.507 0.260 1.00 0.00 H new ATOM 0 HG11 VAL A 103 38.097 70.130 1.074 1.00 0.00 H new ATOM 0 HG12 VAL A 103 37.636 69.714 -0.594 1.00 0.00 H new ATOM 0 HG13 VAL A 103 39.088 70.697 -0.291 1.00 0.00 H new ATOM 0 HG21 VAL A 103 37.802 72.395 1.928 1.00 0.00 H new ATOM 0 HG22 VAL A 103 38.782 73.087 0.614 1.00 0.00 H new ATOM 0 HG23 VAL A 103 37.127 73.677 0.895 1.00 0.00 H new ATOM 1656 N LEU A 104 35.042 73.418 -1.548 1.00 0.00 N ATOM 1657 CA LEU A 104 34.155 74.556 -1.394 1.00 0.00 C ATOM 1658 C LEU A 104 33.914 74.798 0.081 1.00 0.00 C ATOM 1659 O LEU A 104 33.209 74.032 0.740 1.00 0.00 O ATOM 1660 CB LEU A 104 32.821 74.337 -2.114 1.00 0.00 C ATOM 1661 CG LEU A 104 32.852 74.546 -3.628 1.00 0.00 C ATOM 1662 CD1 LEU A 104 31.474 74.313 -4.225 1.00 0.00 C ATOM 1663 CD2 LEU A 104 33.343 75.947 -3.959 1.00 0.00 C ATOM 0 H LEU A 104 34.566 72.525 -1.677 1.00 0.00 H new ATOM 0 HA LEU A 104 34.630 75.427 -1.846 1.00 0.00 H new ATOM 0 HB2 LEU A 104 32.480 73.322 -1.911 1.00 0.00 H new ATOM 0 HB3 LEU A 104 32.081 75.013 -1.686 1.00 0.00 H new ATOM 0 HG LEU A 104 33.543 73.824 -4.063 1.00 0.00 H new ATOM 0 HD11 LEU A 104 31.514 74.466 -5.303 1.00 0.00 H new ATOM 0 HD12 LEU A 104 31.154 73.292 -4.015 1.00 0.00 H new ATOM 0 HD13 LEU A 104 30.764 75.013 -3.785 1.00 0.00 H new ATOM 0 HD21 LEU A 104 33.360 76.081 -5.041 1.00 0.00 H new ATOM 0 HD22 LEU A 104 32.673 76.682 -3.513 1.00 0.00 H new ATOM 0 HD23 LEU A 104 34.349 76.084 -3.561 1.00 0.00 H new ATOM 1675 N VAL A 105 34.532 75.838 0.602 1.00 0.00 N ATOM 1676 CA VAL A 105 34.413 76.155 2.009 1.00 0.00 C ATOM 1677 C VAL A 105 33.745 77.509 2.204 1.00 0.00 C ATOM 1678 O VAL A 105 33.966 78.452 1.425 1.00 0.00 O ATOM 1679 CB VAL A 105 35.793 76.137 2.711 1.00 0.00 C ATOM 1680 CG1 VAL A 105 36.750 77.119 2.056 1.00 0.00 C ATOM 1681 CG2 VAL A 105 35.658 76.434 4.199 1.00 0.00 C ATOM 0 H VAL A 105 35.122 76.478 0.071 1.00 0.00 H new ATOM 0 HA VAL A 105 33.789 75.386 2.465 1.00 0.00 H new ATOM 0 HB VAL A 105 36.205 75.134 2.602 1.00 0.00 H new ATOM 0 HG11 VAL A 105 37.712 77.086 2.568 1.00 0.00 H new ATOM 0 HG12 VAL A 105 36.887 76.850 1.009 1.00 0.00 H new ATOM 0 HG13 VAL A 105 36.338 78.126 2.121 1.00 0.00 H new ATOM 0 HG21 VAL A 105 36.643 76.414 4.665 1.00 0.00 H new ATOM 0 HG22 VAL A 105 35.212 77.419 4.334 1.00 0.00 H new ATOM 0 HG23 VAL A 105 35.022 75.681 4.664 1.00 0.00 H new ATOM 1691 N TYR A 106 32.901 77.576 3.224 1.00 0.00 N ATOM 1692 CA TYR A 106 32.281 78.818 3.634 1.00 0.00 C ATOM 1693 C TYR A 106 33.129 79.460 4.723 1.00 0.00 C ATOM 1694 O TYR A 106 33.039 79.100 5.894 1.00 0.00 O ATOM 1695 CB TYR A 106 30.863 78.554 4.147 1.00 0.00 C ATOM 1696 CG TYR A 106 30.057 79.804 4.426 1.00 0.00 C ATOM 1697 CD1 TYR A 106 29.279 80.380 3.434 1.00 0.00 C ATOM 1698 CD2 TYR A 106 30.059 80.396 5.684 1.00 0.00 C ATOM 1699 CE1 TYR A 106 28.529 81.509 3.680 1.00 0.00 C ATOM 1700 CE2 TYR A 106 29.306 81.526 5.940 1.00 0.00 C ATOM 1701 CZ TYR A 106 28.544 82.078 4.933 1.00 0.00 C ATOM 1702 OH TYR A 106 27.781 83.193 5.178 1.00 0.00 O ATOM 0 H TYR A 106 32.630 76.770 3.787 1.00 0.00 H new ATOM 0 HA TYR A 106 32.215 79.494 2.782 1.00 0.00 H new ATOM 0 HB2 TYR A 106 30.331 77.949 3.413 1.00 0.00 H new ATOM 0 HB3 TYR A 106 30.924 77.964 5.062 1.00 0.00 H new ATOM 0 HD1 TYR A 106 29.260 79.935 2.450 1.00 0.00 H new ATOM 0 HD2 TYR A 106 30.658 79.966 6.473 1.00 0.00 H new ATOM 0 HE1 TYR A 106 27.932 81.946 2.893 1.00 0.00 H new ATOM 0 HE2 TYR A 106 29.315 81.974 6.923 1.00 0.00 H new ATOM 0 HH TYR A 106 28.114 83.648 5.980 1.00 0.00 H new ATOM 1712 N ASN A 107 33.977 80.385 4.321 1.00 0.00 N ATOM 1713 CA ASN A 107 34.862 81.068 5.253 1.00 0.00 C ATOM 1714 C ASN A 107 34.905 82.540 4.880 1.00 0.00 C ATOM 1715 O ASN A 107 34.914 82.869 3.693 1.00 0.00 O ATOM 1716 CB ASN A 107 36.266 80.444 5.209 1.00 0.00 C ATOM 1717 CG ASN A 107 37.162 80.882 6.359 1.00 0.00 C ATOM 1718 OD1 ASN A 107 37.034 81.982 6.888 1.00 0.00 O ATOM 1719 ND2 ASN A 107 38.084 80.015 6.749 1.00 0.00 N ATOM 0 H ASN A 107 34.075 80.685 3.351 1.00 0.00 H new ATOM 0 HA ASN A 107 34.490 80.964 6.272 1.00 0.00 H new ATOM 0 HB2 ASN A 107 36.173 79.358 5.225 1.00 0.00 H new ATOM 0 HB3 ASN A 107 36.743 80.709 4.266 1.00 0.00 H new ATOM 0 HD21 ASN A 107 38.717 80.253 7.513 1.00 0.00 H new ATOM 0 HD22 ASN A 107 38.161 79.110 6.286 1.00 0.00 H new ATOM 1726 N GLN A 108 34.914 83.414 5.886 1.00 0.00 N ATOM 1727 CA GLN A 108 34.789 84.859 5.673 1.00 0.00 C ATOM 1728 C GLN A 108 33.450 85.164 5.014 1.00 0.00 C ATOM 1729 O GLN A 108 33.311 86.150 4.292 1.00 0.00 O ATOM 1730 CB GLN A 108 35.930 85.399 4.804 1.00 0.00 C ATOM 1731 CG GLN A 108 37.315 85.173 5.387 1.00 0.00 C ATOM 1732 CD GLN A 108 38.401 85.840 4.566 1.00 0.00 C ATOM 1733 OE1 GLN A 108 39.526 85.349 4.486 1.00 0.00 O ATOM 1734 NE2 GLN A 108 38.077 86.972 3.957 1.00 0.00 N ATOM 0 H GLN A 108 35.007 83.145 6.865 1.00 0.00 H new ATOM 0 HA GLN A 108 34.845 85.351 6.644 1.00 0.00 H new ATOM 0 HB2 GLN A 108 35.879 84.927 3.823 1.00 0.00 H new ATOM 0 HB3 GLN A 108 35.782 86.468 4.652 1.00 0.00 H new ATOM 0 HG2 GLN A 108 37.345 85.558 6.406 1.00 0.00 H new ATOM 0 HG3 GLN A 108 37.512 84.103 5.445 1.00 0.00 H new ATOM 0 HE21 GLN A 108 37.133 87.348 4.047 1.00 0.00 H new ATOM 0 HE22 GLN A 108 38.772 87.467 3.398 1.00 0.00 H new ATOM 1743 N ASP A 109 32.484 84.282 5.270 1.00 0.00 N ATOM 1744 CA ASP A 109 31.138 84.376 4.705 1.00 0.00 C ATOM 1745 C ASP A 109 31.146 84.281 3.182 1.00 0.00 C ATOM 1746 O ASP A 109 30.160 84.614 2.527 1.00 0.00 O ATOM 1747 CB ASP A 109 30.429 85.653 5.165 1.00 0.00 C ATOM 1748 CG ASP A 109 29.889 85.522 6.575 1.00 0.00 C ATOM 1749 OD1 ASP A 109 28.773 84.974 6.731 1.00 0.00 O ATOM 1750 OD2 ASP A 109 30.580 85.945 7.523 1.00 0.00 O ATOM 0 H ASP A 109 32.615 83.475 5.880 1.00 0.00 H new ATOM 0 HA ASP A 109 30.578 83.520 5.082 1.00 0.00 H new ATOM 0 HB2 ASP A 109 31.124 86.491 5.119 1.00 0.00 H new ATOM 0 HB3 ASP A 109 29.610 85.880 4.482 1.00 0.00 H new ATOM 1755 N LYS A 110 32.243 83.791 2.614 1.00 0.00 N ATOM 1756 CA LYS A 110 32.299 83.591 1.177 1.00 0.00 C ATOM 1757 C LYS A 110 32.586 82.137 0.832 1.00 0.00 C ATOM 1758 O LYS A 110 33.472 81.499 1.415 1.00 0.00 O ATOM 1759 CB LYS A 110 33.338 84.505 0.509 1.00 0.00 C ATOM 1760 CG LYS A 110 34.775 84.163 0.854 1.00 0.00 C ATOM 1761 CD LYS A 110 35.770 84.980 0.039 1.00 0.00 C ATOM 1762 CE LYS A 110 35.688 84.640 -1.445 1.00 0.00 C ATOM 1763 NZ LYS A 110 36.739 85.336 -2.241 1.00 0.00 N ATOM 0 H LYS A 110 33.090 83.530 3.119 1.00 0.00 H new ATOM 0 HA LYS A 110 31.316 83.856 0.787 1.00 0.00 H new ATOM 0 HB2 LYS A 110 33.212 84.451 -0.572 1.00 0.00 H new ATOM 0 HB3 LYS A 110 33.141 85.536 0.802 1.00 0.00 H new ATOM 0 HG2 LYS A 110 34.945 84.341 1.916 1.00 0.00 H new ATOM 0 HG3 LYS A 110 34.947 83.101 0.677 1.00 0.00 H new ATOM 0 HD2 LYS A 110 35.573 86.043 0.181 1.00 0.00 H new ATOM 0 HD3 LYS A 110 36.781 84.792 0.401 1.00 0.00 H new ATOM 0 HE2 LYS A 110 35.790 83.563 -1.575 1.00 0.00 H new ATOM 0 HE3 LYS A 110 34.704 84.916 -1.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 36.677 85.036 -3.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 36.597 86.364 -2.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 37.677 85.094 -1.864 1.00 0.00 H new ATOM 1777 N TRP A 111 31.810 81.622 -0.106 1.00 0.00 N ATOM 1778 CA TRP A 111 32.058 80.311 -0.686 1.00 0.00 C ATOM 1779 C TRP A 111 33.153 80.429 -1.726 1.00 0.00 C ATOM 1780 O TRP A 111 33.049 81.246 -2.643 1.00 0.00 O ATOM 1781 CB TRP A 111 30.804 79.753 -1.368 1.00 0.00 C ATOM 1782 CG TRP A 111 29.752 79.241 -0.436 1.00 0.00 C ATOM 1783 CD1 TRP A 111 28.582 79.857 -0.097 1.00 0.00 C ATOM 1784 CD2 TRP A 111 29.765 77.989 0.256 1.00 0.00 C ATOM 1785 NE1 TRP A 111 27.865 79.060 0.762 1.00 0.00 N ATOM 1786 CE2 TRP A 111 28.573 77.911 0.998 1.00 0.00 C ATOM 1787 CE3 TRP A 111 30.672 76.927 0.320 1.00 0.00 C ATOM 1788 CZ2 TRP A 111 28.265 76.812 1.793 1.00 0.00 C ATOM 1789 CZ3 TRP A 111 30.364 75.838 1.110 1.00 0.00 C ATOM 1790 CH2 TRP A 111 29.170 75.787 1.837 1.00 0.00 C ATOM 0 H TRP A 111 30.992 82.098 -0.487 1.00 0.00 H new ATOM 0 HA TRP A 111 32.350 79.636 0.119 1.00 0.00 H new ATOM 0 HB2 TRP A 111 30.368 80.535 -1.989 1.00 0.00 H new ATOM 0 HB3 TRP A 111 31.101 78.944 -2.036 1.00 0.00 H new ATOM 0 HD1 TRP A 111 28.267 80.827 -0.452 1.00 0.00 H new ATOM 0 HE1 TRP A 111 26.953 79.287 1.160 1.00 0.00 H new ATOM 0 HE3 TRP A 111 31.596 76.958 -0.238 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 27.344 76.769 2.356 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 31.057 75.011 1.168 1.00 0.00 H new ATOM 0 HH2 TRP A 111 28.958 74.920 2.446 1.00 0.00 H new ATOM 1801 N ALA A 112 34.205 79.642 -1.589 1.00 0.00 N ATOM 1802 CA ALA A 112 35.270 79.658 -2.583 1.00 0.00 C ATOM 1803 C ALA A 112 36.160 78.436 -2.467 1.00 0.00 C ATOM 1804 O ALA A 112 36.058 77.672 -1.504 1.00 0.00 O ATOM 1805 CB ALA A 112 36.093 80.932 -2.465 1.00 0.00 C ATOM 0 H ALA A 112 34.347 78.993 -0.815 1.00 0.00 H new ATOM 0 HA ALA A 112 34.803 79.634 -3.567 1.00 0.00 H new ATOM 0 HB1 ALA A 112 36.883 80.925 -3.216 1.00 0.00 H new ATOM 0 HB2 ALA A 112 35.449 81.797 -2.624 1.00 0.00 H new ATOM 0 HB3 ALA A 112 36.537 80.988 -1.471 1.00 0.00 H new ATOM 1811 N TRP A 113 37.027 78.266 -3.457 1.00 0.00 N ATOM 1812 CA TRP A 113 37.940 77.138 -3.497 1.00 0.00 C ATOM 1813 C TRP A 113 39.048 77.323 -2.477 1.00 0.00 C ATOM 1814 O TRP A 113 39.720 78.357 -2.453 1.00 0.00 O ATOM 1815 CB TRP A 113 38.572 76.984 -4.886 1.00 0.00 C ATOM 1816 CG TRP A 113 37.597 76.758 -6.005 1.00 0.00 C ATOM 1817 CD1 TRP A 113 36.238 76.663 -5.920 1.00 0.00 C ATOM 1818 CD2 TRP A 113 37.922 76.600 -7.391 1.00 0.00 C ATOM 1819 NE1 TRP A 113 35.700 76.457 -7.167 1.00 0.00 N ATOM 1820 CE2 TRP A 113 36.714 76.413 -8.086 1.00 0.00 C ATOM 1821 CE3 TRP A 113 39.121 76.599 -8.110 1.00 0.00 C ATOM 1822 CZ2 TRP A 113 36.670 76.228 -9.465 1.00 0.00 C ATOM 1823 CZ3 TRP A 113 39.076 76.415 -9.478 1.00 0.00 C ATOM 1824 CH2 TRP A 113 37.858 76.232 -10.143 1.00 0.00 C ATOM 0 H TRP A 113 37.115 78.903 -4.249 1.00 0.00 H new ATOM 0 HA TRP A 113 37.364 76.242 -3.266 1.00 0.00 H new ATOM 0 HB2 TRP A 113 39.153 77.880 -5.106 1.00 0.00 H new ATOM 0 HB3 TRP A 113 39.272 76.149 -4.860 1.00 0.00 H new ATOM 0 HD1 TRP A 113 35.669 76.739 -5.005 1.00 0.00 H new ATOM 0 HE1 TRP A 113 34.707 76.354 -7.375 1.00 0.00 H new ATOM 0 HE3 TRP A 113 40.065 76.740 -7.605 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 35.732 76.086 -9.981 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 39.996 76.412 -10.044 1.00 0.00 H new ATOM 0 HH2 TRP A 113 37.856 76.091 -11.214 1.00 0.00 H new ATOM 1835 N ASN A 114 39.213 76.335 -1.625 1.00 0.00 N ATOM 1836 CA ASN A 114 40.330 76.300 -0.702 1.00 0.00 C ATOM 1837 C ASN A 114 41.070 74.993 -0.904 1.00 0.00 C ATOM 1838 O ASN A 114 40.479 73.923 -0.757 1.00 0.00 O ATOM 1839 CB ASN A 114 39.822 76.396 0.738 1.00 0.00 C ATOM 1840 CG ASN A 114 40.905 76.765 1.733 1.00 0.00 C ATOM 1841 OD1 ASN A 114 41.114 77.943 2.017 1.00 0.00 O ATOM 1842 ND2 ASN A 114 41.585 75.767 2.274 1.00 0.00 N ATOM 0 H ASN A 114 38.582 75.537 -1.551 1.00 0.00 H new ATOM 0 HA ASN A 114 40.997 77.142 -0.888 1.00 0.00 H new ATOM 0 HB2 ASN A 114 39.026 77.139 0.786 1.00 0.00 H new ATOM 0 HB3 ASN A 114 39.384 75.440 1.026 1.00 0.00 H new ATOM 0 HD21 ASN A 114 42.317 75.960 2.957 1.00 0.00 H new ATOM 0 HD22 ASN A 114 41.377 74.805 2.008 1.00 0.00 H new ATOM 1849 N ASP A 115 42.339 75.062 -1.259 1.00 0.00 N ATOM 1850 CA ASP A 115 43.102 73.855 -1.513 1.00 0.00 C ATOM 1851 C ASP A 115 43.761 73.368 -0.236 1.00 0.00 C ATOM 1852 O ASP A 115 44.461 74.109 0.446 1.00 0.00 O ATOM 1853 CB ASP A 115 44.133 74.064 -2.631 1.00 0.00 C ATOM 1854 CG ASP A 115 45.094 75.204 -2.366 1.00 0.00 C ATOM 1855 OD1 ASP A 115 44.628 76.360 -2.264 1.00 0.00 O ATOM 1856 OD2 ASP A 115 46.313 74.944 -2.294 1.00 0.00 O ATOM 0 H ASP A 115 42.859 75.932 -1.377 1.00 0.00 H new ATOM 0 HA ASP A 115 42.412 73.084 -1.856 1.00 0.00 H new ATOM 0 HB2 ASP A 115 44.702 73.144 -2.765 1.00 0.00 H new ATOM 0 HB3 ASP A 115 43.608 74.253 -3.567 1.00 0.00 H new ATOM 1861 N VAL A 116 43.485 72.120 0.095 1.00 0.00 N ATOM 1862 CA VAL A 116 44.000 71.506 1.306 1.00 0.00 C ATOM 1863 C VAL A 116 44.648 70.171 0.976 1.00 0.00 C ATOM 1864 O VAL A 116 44.380 69.601 -0.088 1.00 0.00 O ATOM 1865 CB VAL A 116 42.879 71.275 2.350 1.00 0.00 C ATOM 1866 CG1 VAL A 116 42.319 72.597 2.848 1.00 0.00 C ATOM 1867 CG2 VAL A 116 41.766 70.412 1.769 1.00 0.00 C ATOM 0 H VAL A 116 42.898 71.504 -0.467 1.00 0.00 H new ATOM 0 HA VAL A 116 44.736 72.188 1.732 1.00 0.00 H new ATOM 0 HB VAL A 116 43.316 70.748 3.198 1.00 0.00 H new ATOM 0 HG11 VAL A 116 41.534 72.407 3.580 1.00 0.00 H new ATOM 0 HG12 VAL A 116 43.116 73.177 3.313 1.00 0.00 H new ATOM 0 HG13 VAL A 116 41.905 73.156 2.009 1.00 0.00 H new ATOM 0 HG21 VAL A 116 40.991 70.264 2.521 1.00 0.00 H new ATOM 0 HG22 VAL A 116 41.337 70.909 0.898 1.00 0.00 H new ATOM 0 HG23 VAL A 116 42.173 69.445 1.472 1.00 0.00 H new ATOM 1877 N PRO A 117 45.530 69.668 1.858 1.00 0.00 N ATOM 1878 CA PRO A 117 46.087 68.322 1.732 1.00 0.00 C ATOM 1879 C PRO A 117 44.980 67.297 1.509 1.00 0.00 C ATOM 1880 O PRO A 117 44.006 67.250 2.259 1.00 0.00 O ATOM 1881 CB PRO A 117 46.788 68.080 3.081 1.00 0.00 C ATOM 1882 CG PRO A 117 46.409 69.234 3.955 1.00 0.00 C ATOM 1883 CD PRO A 117 46.062 70.366 3.033 1.00 0.00 C ATOM 0 HA PRO A 117 46.764 68.227 0.883 1.00 0.00 H new ATOM 0 HB2 PRO A 117 46.470 67.135 3.522 1.00 0.00 H new ATOM 0 HB3 PRO A 117 47.869 68.025 2.955 1.00 0.00 H new ATOM 0 HG2 PRO A 117 45.562 68.978 4.592 1.00 0.00 H new ATOM 0 HG3 PRO A 117 47.232 69.509 4.615 1.00 0.00 H new ATOM 0 HD2 PRO A 117 45.325 71.037 3.474 1.00 0.00 H new ATOM 0 HD3 PRO A 117 46.935 70.970 2.785 1.00 0.00 H new ATOM 1891 N CYS A 118 45.128 66.478 0.482 1.00 0.00 N ATOM 1892 CA CYS A 118 44.066 65.559 0.084 1.00 0.00 C ATOM 1893 C CYS A 118 43.948 64.385 1.058 1.00 0.00 C ATOM 1894 O CYS A 118 43.049 63.548 0.936 1.00 0.00 O ATOM 1895 CB CYS A 118 44.317 65.065 -1.342 1.00 0.00 C ATOM 1896 SG CYS A 118 44.789 66.391 -2.488 1.00 0.00 S ATOM 0 H CYS A 118 45.969 66.428 -0.092 1.00 0.00 H new ATOM 0 HA CYS A 118 43.118 66.095 0.111 1.00 0.00 H new ATOM 0 HB2 CYS A 118 45.104 64.312 -1.325 1.00 0.00 H new ATOM 0 HB3 CYS A 118 43.416 64.576 -1.714 1.00 0.00 H new ATOM 1901 N ASN A 119 44.852 64.334 2.033 1.00 0.00 N ATOM 1902 CA ASN A 119 44.789 63.330 3.091 1.00 0.00 C ATOM 1903 C ASN A 119 43.973 63.848 4.274 1.00 0.00 C ATOM 1904 O ASN A 119 43.808 63.157 5.277 1.00 0.00 O ATOM 1905 CB ASN A 119 46.193 62.929 3.561 1.00 0.00 C ATOM 1906 CG ASN A 119 47.006 64.101 4.088 1.00 0.00 C ATOM 1907 OD1 ASN A 119 46.877 64.491 5.247 1.00 0.00 O ATOM 1908 ND2 ASN A 119 47.875 64.649 3.252 1.00 0.00 N ATOM 0 H ASN A 119 45.639 64.978 2.112 1.00 0.00 H new ATOM 0 HA ASN A 119 44.299 62.447 2.680 1.00 0.00 H new ATOM 0 HB2 ASN A 119 46.106 62.175 4.343 1.00 0.00 H new ATOM 0 HB3 ASN A 119 46.729 62.467 2.732 1.00 0.00 H new ATOM 0 HD21 ASN A 119 48.465 65.421 3.563 1.00 0.00 H new ATOM 0 HD22 ASN A 119 47.954 64.299 2.297 1.00 0.00 H new ATOM 1915 N PHE A 120 43.469 65.067 4.147 1.00 0.00 N ATOM 1916 CA PHE A 120 42.617 65.662 5.168 1.00 0.00 C ATOM 1917 C PHE A 120 41.178 65.186 4.985 1.00 0.00 C ATOM 1918 O PHE A 120 40.716 65.035 3.854 1.00 0.00 O ATOM 1919 CB PHE A 120 42.700 67.192 5.073 1.00 0.00 C ATOM 1920 CG PHE A 120 41.805 67.936 6.023 1.00 0.00 C ATOM 1921 CD1 PHE A 120 42.074 67.954 7.381 1.00 0.00 C ATOM 1922 CD2 PHE A 120 40.698 68.626 5.553 1.00 0.00 C ATOM 1923 CE1 PHE A 120 41.255 68.645 8.254 1.00 0.00 C ATOM 1924 CE2 PHE A 120 39.876 69.319 6.419 1.00 0.00 C ATOM 1925 CZ PHE A 120 40.154 69.328 7.772 1.00 0.00 C ATOM 0 H PHE A 120 43.637 65.668 3.340 1.00 0.00 H new ATOM 0 HA PHE A 120 42.957 65.352 6.156 1.00 0.00 H new ATOM 0 HB2 PHE A 120 43.731 67.497 5.254 1.00 0.00 H new ATOM 0 HB3 PHE A 120 42.453 67.492 4.055 1.00 0.00 H new ATOM 0 HD1 PHE A 120 42.933 67.422 7.762 1.00 0.00 H new ATOM 0 HD2 PHE A 120 40.476 68.621 4.496 1.00 0.00 H new ATOM 0 HE1 PHE A 120 41.475 68.651 9.311 1.00 0.00 H new ATOM 0 HE2 PHE A 120 39.017 69.853 6.039 1.00 0.00 H new ATOM 0 HZ PHE A 120 39.512 69.868 8.452 1.00 0.00 H new ATOM 1935 N GLU A 121 40.483 64.921 6.086 1.00 0.00 N ATOM 1936 CA GLU A 121 39.085 64.514 6.014 1.00 0.00 C ATOM 1937 C GLU A 121 38.158 65.712 6.137 1.00 0.00 C ATOM 1938 O GLU A 121 38.315 66.549 7.026 1.00 0.00 O ATOM 1939 CB GLU A 121 38.730 63.492 7.094 1.00 0.00 C ATOM 1940 CG GLU A 121 39.357 62.127 6.880 1.00 0.00 C ATOM 1941 CD GLU A 121 38.448 61.002 7.330 1.00 0.00 C ATOM 1942 OE1 GLU A 121 38.151 60.917 8.537 1.00 0.00 O ATOM 1943 OE2 GLU A 121 38.004 60.216 6.467 1.00 0.00 O ATOM 0 H GLU A 121 40.861 64.980 7.031 1.00 0.00 H new ATOM 0 HA GLU A 121 38.949 64.049 5.038 1.00 0.00 H new ATOM 0 HB2 GLU A 121 39.046 63.878 8.063 1.00 0.00 H new ATOM 0 HB3 GLU A 121 37.646 63.381 7.133 1.00 0.00 H new ATOM 0 HG2 GLU A 121 39.594 62.000 5.824 1.00 0.00 H new ATOM 0 HG3 GLU A 121 40.298 62.072 7.427 1.00 0.00 H new ATOM 1950 N ALA A 122 37.193 65.777 5.238 1.00 0.00 N ATOM 1951 CA ALA A 122 36.195 66.832 5.241 1.00 0.00 C ATOM 1952 C ALA A 122 34.918 66.319 4.595 1.00 0.00 C ATOM 1953 O ALA A 122 34.806 65.124 4.310 1.00 0.00 O ATOM 1954 CB ALA A 122 36.714 68.062 4.507 1.00 0.00 C ATOM 0 H ALA A 122 37.079 65.099 4.484 1.00 0.00 H new ATOM 0 HA ALA A 122 35.982 67.122 6.270 1.00 0.00 H new ATOM 0 HB1 ALA A 122 35.952 68.842 4.520 1.00 0.00 H new ATOM 0 HB2 ALA A 122 37.615 68.427 5.000 1.00 0.00 H new ATOM 0 HB3 ALA A 122 36.946 67.799 3.475 1.00 0.00 H new ATOM 1960 N SER A 123 33.969 67.216 4.362 1.00 0.00 N ATOM 1961 CA SER A 123 32.726 66.855 3.703 1.00 0.00 C ATOM 1962 C SER A 123 32.944 66.811 2.193 1.00 0.00 C ATOM 1963 O SER A 123 33.987 67.242 1.701 1.00 0.00 O ATOM 1964 CB SER A 123 31.633 67.857 4.070 1.00 0.00 C ATOM 1965 OG SER A 123 31.472 67.930 5.478 1.00 0.00 O ATOM 0 H SER A 123 34.039 68.200 4.621 1.00 0.00 H new ATOM 0 HA SER A 123 32.407 65.867 4.036 1.00 0.00 H new ATOM 0 HB2 SER A 123 31.888 68.841 3.677 1.00 0.00 H new ATOM 0 HB3 SER A 123 30.692 67.562 3.606 1.00 0.00 H new ATOM 0 HG SER A 123 32.067 68.620 5.840 1.00 0.00 H new ATOM 1971 N ARG A 124 31.973 66.310 1.450 1.00 0.00 N ATOM 1972 CA ARG A 124 32.181 66.064 0.031 1.00 0.00 C ATOM 1973 C ARG A 124 30.903 66.224 -0.776 1.00 0.00 C ATOM 1974 O ARG A 124 29.801 66.175 -0.238 1.00 0.00 O ATOM 1975 CB ARG A 124 32.733 64.652 -0.158 1.00 0.00 C ATOM 1976 CG ARG A 124 31.955 63.603 0.619 1.00 0.00 C ATOM 1977 CD ARG A 124 32.507 62.212 0.390 1.00 0.00 C ATOM 1978 NE ARG A 124 31.890 61.229 1.274 1.00 0.00 N ATOM 1979 CZ ARG A 124 31.521 60.012 0.894 1.00 0.00 C ATOM 1980 NH1 ARG A 124 31.605 59.650 -0.382 1.00 0.00 N ATOM 1981 NH2 ARG A 124 31.050 59.158 1.790 1.00 0.00 N ATOM 0 H ARG A 124 31.045 66.068 1.797 1.00 0.00 H new ATOM 0 HA ARG A 124 32.891 66.806 -0.335 1.00 0.00 H new ATOM 0 HB2 ARG A 124 32.715 64.399 -1.218 1.00 0.00 H new ATOM 0 HB3 ARG A 124 33.776 64.630 0.157 1.00 0.00 H new ATOM 0 HG2 ARG A 124 31.990 63.838 1.683 1.00 0.00 H new ATOM 0 HG3 ARG A 124 30.907 63.632 0.321 1.00 0.00 H new ATOM 0 HD2 ARG A 124 32.341 61.922 -0.647 1.00 0.00 H new ATOM 0 HD3 ARG A 124 33.585 62.218 0.551 1.00 0.00 H new ATOM 0 HE ARG A 124 31.732 61.494 2.246 1.00 0.00 H new ATOM 0 HH11 ARG A 124 31.955 60.309 -1.077 1.00 0.00 H new ATOM 0 HH12 ARG A 124 31.319 58.713 -0.666 1.00 0.00 H new ATOM 0 HH21 ARG A 124 30.972 59.436 2.768 1.00 0.00 H new ATOM 0 HH22 ARG A 124 30.765 58.222 1.502 1.00 0.00 H new ATOM 1995 N ILE A 125 31.068 66.429 -2.072 1.00 0.00 N ATOM 1996 CA ILE A 125 29.952 66.427 -3.002 1.00 0.00 C ATOM 1997 C ILE A 125 30.224 65.393 -4.081 1.00 0.00 C ATOM 1998 O ILE A 125 31.328 65.341 -4.624 1.00 0.00 O ATOM 1999 CB ILE A 125 29.750 67.800 -3.678 1.00 0.00 C ATOM 2000 CG1 ILE A 125 29.712 68.920 -2.641 1.00 0.00 C ATOM 2001 CG2 ILE A 125 28.467 67.800 -4.502 1.00 0.00 C ATOM 2002 CD1 ILE A 125 29.732 70.304 -3.253 1.00 0.00 C ATOM 0 H ILE A 125 31.974 66.601 -2.507 1.00 0.00 H new ATOM 0 HA ILE A 125 29.048 66.194 -2.439 1.00 0.00 H new ATOM 0 HB ILE A 125 30.596 67.979 -4.341 1.00 0.00 H new ATOM 0 HG12 ILE A 125 28.814 68.812 -2.033 1.00 0.00 H new ATOM 0 HG13 ILE A 125 30.565 68.814 -1.971 1.00 0.00 H new ATOM 0 HG21 ILE A 125 28.337 68.774 -4.973 1.00 0.00 H new ATOM 0 HG22 ILE A 125 28.529 67.030 -5.271 1.00 0.00 H new ATOM 0 HG23 ILE A 125 27.617 67.595 -3.851 1.00 0.00 H new ATOM 0 HD11 ILE A 125 29.703 71.052 -2.461 1.00 0.00 H new ATOM 0 HD12 ILE A 125 30.643 70.430 -3.838 1.00 0.00 H new ATOM 0 HD13 ILE A 125 28.864 70.428 -3.901 1.00 0.00 H new ATOM 2014 N CYS A 126 29.246 64.559 -4.373 1.00 0.00 N ATOM 2015 CA CYS A 126 29.404 63.566 -5.417 1.00 0.00 C ATOM 2016 C CYS A 126 28.481 63.902 -6.586 1.00 0.00 C ATOM 2017 O CYS A 126 27.296 64.175 -6.398 1.00 0.00 O ATOM 2018 CB CYS A 126 29.118 62.163 -4.873 1.00 0.00 C ATOM 2019 SG CYS A 126 29.924 60.824 -5.804 1.00 0.00 S ATOM 0 H CYS A 126 28.339 64.548 -3.906 1.00 0.00 H new ATOM 0 HA CYS A 126 30.435 63.578 -5.772 1.00 0.00 H new ATOM 0 HB2 CYS A 126 29.444 62.115 -3.834 1.00 0.00 H new ATOM 0 HB3 CYS A 126 28.041 61.996 -4.878 1.00 0.00 H new ATOM 2024 N LYS A 127 29.042 63.907 -7.779 1.00 0.00 N ATOM 2025 CA LYS A 127 28.325 64.271 -8.990 1.00 0.00 C ATOM 2026 C LYS A 127 28.228 63.081 -9.935 1.00 0.00 C ATOM 2027 O LYS A 127 29.243 62.509 -10.322 1.00 0.00 O ATOM 2028 CB LYS A 127 29.061 65.413 -9.694 1.00 0.00 C ATOM 2029 CG LYS A 127 28.651 65.606 -11.145 1.00 0.00 C ATOM 2030 CD LYS A 127 29.823 66.089 -11.979 1.00 0.00 C ATOM 2031 CE LYS A 127 29.486 66.132 -13.459 1.00 0.00 C ATOM 2032 NZ LYS A 127 30.696 66.386 -14.291 1.00 0.00 N ATOM 0 H LYS A 127 30.018 63.656 -7.939 1.00 0.00 H new ATOM 0 HA LYS A 127 27.318 64.587 -8.716 1.00 0.00 H new ATOM 0 HB2 LYS A 127 28.880 66.340 -9.149 1.00 0.00 H new ATOM 0 HB3 LYS A 127 30.133 65.222 -9.652 1.00 0.00 H new ATOM 0 HG2 LYS A 127 28.275 64.666 -11.549 1.00 0.00 H new ATOM 0 HG3 LYS A 127 27.836 66.327 -11.204 1.00 0.00 H new ATOM 0 HD2 LYS A 127 30.120 67.083 -11.646 1.00 0.00 H new ATOM 0 HD3 LYS A 127 30.677 65.431 -11.820 1.00 0.00 H new ATOM 0 HE2 LYS A 127 29.031 65.187 -13.757 1.00 0.00 H new ATOM 0 HE3 LYS A 127 28.748 66.913 -13.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 30.455 67.038 -15.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 31.440 66.809 -13.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 31.038 65.488 -14.689 1.00 0.00 H new ATOM 2046 N ILE A 128 27.019 62.718 -10.318 1.00 0.00 N ATOM 2047 CA ILE A 128 26.830 61.649 -11.284 1.00 0.00 C ATOM 2048 C ILE A 128 26.229 62.213 -12.570 1.00 0.00 C ATOM 2049 O ILE A 128 25.345 63.073 -12.527 1.00 0.00 O ATOM 2050 CB ILE A 128 25.935 60.510 -10.723 1.00 0.00 C ATOM 2051 CG1 ILE A 128 25.969 59.290 -11.651 1.00 0.00 C ATOM 2052 CG2 ILE A 128 24.501 60.982 -10.532 1.00 0.00 C ATOM 2053 CD1 ILE A 128 25.164 58.113 -11.144 1.00 0.00 C ATOM 0 H ILE A 128 26.157 63.144 -9.978 1.00 0.00 H new ATOM 0 HA ILE A 128 27.807 61.216 -11.498 1.00 0.00 H new ATOM 0 HB ILE A 128 26.333 60.223 -9.750 1.00 0.00 H new ATOM 0 HG12 ILE A 128 25.592 59.581 -12.631 1.00 0.00 H new ATOM 0 HG13 ILE A 128 27.004 58.978 -11.788 1.00 0.00 H new ATOM 0 HG21 ILE A 128 23.898 60.164 -10.138 1.00 0.00 H new ATOM 0 HG22 ILE A 128 24.483 61.816 -9.831 1.00 0.00 H new ATOM 0 HG23 ILE A 128 24.094 61.305 -11.490 1.00 0.00 H new ATOM 0 HD11 ILE A 128 25.237 57.289 -11.854 1.00 0.00 H new ATOM 0 HD12 ILE A 128 25.554 57.794 -10.177 1.00 0.00 H new ATOM 0 HD13 ILE A 128 24.120 58.406 -11.035 1.00 0.00 H new ATOM 2065 N PRO A 129 26.749 61.796 -13.732 1.00 0.00 N ATOM 2066 CA PRO A 129 26.162 62.147 -15.024 1.00 0.00 C ATOM 2067 C PRO A 129 24.803 61.481 -15.206 1.00 0.00 C ATOM 2068 O PRO A 129 24.440 60.584 -14.445 1.00 0.00 O ATOM 2069 CB PRO A 129 27.167 61.604 -16.052 1.00 0.00 C ATOM 2070 CG PRO A 129 28.408 61.305 -15.277 1.00 0.00 C ATOM 2071 CD PRO A 129 27.958 60.975 -13.885 1.00 0.00 C ATOM 0 HA PRO A 129 25.991 63.219 -15.123 1.00 0.00 H new ATOM 0 HB2 PRO A 129 26.784 60.708 -16.540 1.00 0.00 H new ATOM 0 HB3 PRO A 129 27.361 62.336 -16.836 1.00 0.00 H new ATOM 0 HG2 PRO A 129 28.952 60.470 -15.719 1.00 0.00 H new ATOM 0 HG3 PRO A 129 29.083 62.161 -15.276 1.00 0.00 H new ATOM 0 HD2 PRO A 129 27.743 59.913 -13.770 1.00 0.00 H new ATOM 0 HD3 PRO A 129 28.716 61.229 -13.144 1.00 0.00 H new ATOM 2079 N GLY A 130 24.049 61.920 -16.206 1.00 0.00 N ATOM 2080 CA GLY A 130 22.766 61.302 -16.492 1.00 0.00 C ATOM 2081 C GLY A 130 22.922 59.941 -17.147 1.00 0.00 C ATOM 2082 O GLY A 130 22.352 59.680 -18.204 1.00 0.00 O ATOM 0 H GLY A 130 24.301 62.691 -16.824 1.00 0.00 H new ATOM 0 HA2 GLY A 130 22.201 61.196 -15.566 1.00 0.00 H new ATOM 0 HA3 GLY A 130 22.187 61.955 -17.146 1.00 0.00 H new ATOM 2086 N THR A 131 23.684 59.070 -16.501 1.00 0.00 N ATOM 2087 CA THR A 131 24.004 57.766 -17.050 1.00 0.00 C ATOM 2088 C THR A 131 22.943 56.736 -16.671 1.00 0.00 C ATOM 2089 O THR A 131 23.054 55.560 -17.016 1.00 0.00 O ATOM 2090 CB THR A 131 25.395 57.290 -16.570 1.00 0.00 C ATOM 2091 OG1 THR A 131 25.766 56.083 -17.249 1.00 0.00 O ATOM 2092 CG2 THR A 131 25.408 57.059 -15.064 1.00 0.00 C ATOM 0 H THR A 131 24.095 59.249 -15.585 1.00 0.00 H new ATOM 0 HA THR A 131 24.023 57.863 -18.136 1.00 0.00 H new ATOM 0 HB THR A 131 26.117 58.073 -16.803 1.00 0.00 H new ATOM 0 HG1 THR A 131 25.006 55.465 -17.256 1.00 0.00 H new ATOM 0 HG21 THR A 131 26.399 56.725 -14.756 1.00 0.00 H new ATOM 0 HG22 THR A 131 25.163 57.989 -14.551 1.00 0.00 H new ATOM 0 HG23 THR A 131 24.672 56.297 -14.806 1.00 0.00 H new ATOM 2100 N THR A 132 21.911 57.186 -15.967 1.00 0.00 N ATOM 2101 CA THR A 132 20.802 56.322 -15.591 1.00 0.00 C ATOM 2102 C THR A 132 20.094 55.789 -16.835 1.00 0.00 C ATOM 2103 O THR A 132 19.515 54.705 -16.819 1.00 0.00 O ATOM 2104 CB THR A 132 19.798 57.080 -14.707 1.00 0.00 C ATOM 2105 OG1 THR A 132 20.511 57.817 -13.706 1.00 0.00 O ATOM 2106 CG2 THR A 132 18.825 56.119 -14.037 1.00 0.00 C ATOM 0 H THR A 132 21.821 58.149 -15.644 1.00 0.00 H new ATOM 0 HA THR A 132 21.205 55.483 -15.025 1.00 0.00 H new ATOM 0 HB THR A 132 19.226 57.761 -15.337 1.00 0.00 H new ATOM 0 HG1 THR A 132 19.939 58.531 -13.356 1.00 0.00 H new ATOM 0 HG21 THR A 132 18.126 56.682 -13.418 1.00 0.00 H new ATOM 0 HG22 THR A 132 18.273 55.570 -14.800 1.00 0.00 H new ATOM 0 HG23 THR A 132 19.378 55.417 -13.413 1.00 0.00 H new ATOM 2114 N LEU A 133 20.178 56.552 -17.921 1.00 0.00 N ATOM 2115 CA LEU A 133 19.601 56.146 -19.196 1.00 0.00 C ATOM 2116 C LEU A 133 20.359 54.949 -19.763 1.00 0.00 C ATOM 2117 O LEU A 133 19.793 54.115 -20.461 1.00 0.00 O ATOM 2118 CB LEU A 133 19.649 57.312 -20.187 1.00 0.00 C ATOM 2119 CG LEU A 133 18.942 58.589 -19.725 1.00 0.00 C ATOM 2120 CD1 LEU A 133 19.133 59.701 -20.745 1.00 0.00 C ATOM 2121 CD2 LEU A 133 17.461 58.327 -19.492 1.00 0.00 C ATOM 0 H LEU A 133 20.643 57.460 -17.942 1.00 0.00 H new ATOM 0 HA LEU A 133 18.562 55.858 -19.034 1.00 0.00 H new ATOM 0 HB2 LEU A 133 20.693 57.548 -20.395 1.00 0.00 H new ATOM 0 HB3 LEU A 133 19.202 56.988 -21.127 1.00 0.00 H new ATOM 0 HG LEU A 133 19.386 58.906 -18.781 1.00 0.00 H new ATOM 0 HD11 LEU A 133 18.624 60.602 -20.401 1.00 0.00 H new ATOM 0 HD12 LEU A 133 20.197 59.908 -20.863 1.00 0.00 H new ATOM 0 HD13 LEU A 133 18.715 59.392 -21.703 1.00 0.00 H new ATOM 0 HD21 LEU A 133 16.976 59.246 -19.164 1.00 0.00 H new ATOM 0 HD22 LEU A 133 17.002 57.985 -20.420 1.00 0.00 H new ATOM 0 HD23 LEU A 133 17.343 57.561 -18.725 1.00 0.00 H new ATOM 2133 N ASN A 134 21.645 54.875 -19.441 1.00 0.00 N ATOM 2134 CA ASN A 134 22.500 53.787 -19.903 1.00 0.00 C ATOM 2135 C ASN A 134 22.425 52.613 -18.937 1.00 0.00 C ATOM 2136 O ASN A 134 22.862 51.507 -19.241 1.00 0.00 O ATOM 2137 CB ASN A 134 23.955 54.256 -20.000 1.00 0.00 C ATOM 2138 CG ASN A 134 24.133 55.499 -20.853 1.00 0.00 C ATOM 2139 OD1 ASN A 134 23.398 55.728 -21.809 1.00 0.00 O ATOM 2140 ND2 ASN A 134 25.111 56.321 -20.498 1.00 0.00 N ATOM 0 H ASN A 134 22.122 55.562 -18.857 1.00 0.00 H new ATOM 0 HA ASN A 134 22.151 53.476 -20.888 1.00 0.00 H new ATOM 0 HB2 ASN A 134 24.332 54.456 -18.997 1.00 0.00 H new ATOM 0 HB3 ASN A 134 24.562 53.451 -20.414 1.00 0.00 H new ATOM 0 HD21 ASN A 134 25.273 57.179 -21.026 1.00 0.00 H new ATOM 0 HD22 ASN A 134 25.701 56.096 -19.697 1.00 0.00 H new ATOM 2147 N ALA A 135 21.883 52.872 -17.756 1.00 0.00 N ATOM 2148 CA ALA A 135 21.839 51.877 -16.697 1.00 0.00 C ATOM 2149 C ALA A 135 20.560 51.048 -16.747 1.00 0.00 C ATOM 2150 O ALA A 135 20.178 50.437 -15.750 1.00 0.00 O ATOM 2151 CB ALA A 135 21.979 52.554 -15.341 1.00 0.00 C ATOM 0 H ALA A 135 21.465 53.769 -17.507 1.00 0.00 H new ATOM 0 HA ALA A 135 22.675 51.194 -16.848 1.00 0.00 H new ATOM 0 HB1 ALA A 135 21.945 51.801 -14.553 1.00 0.00 H new ATOM 0 HB2 ALA A 135 22.930 53.084 -15.295 1.00 0.00 H new ATOM 0 HB3 ALA A 135 21.162 53.262 -15.202 1.00 0.00 H new ATOM 2157 N GLU A 136 19.920 50.996 -17.907 1.00 0.00 N ATOM 2158 CA GLU A 136 18.647 50.292 -18.037 1.00 0.00 C ATOM 2159 C GLU A 136 18.811 48.786 -17.788 1.00 0.00 C ATOM 2160 O GLU A 136 18.259 48.249 -16.827 1.00 0.00 O ATOM 2161 CB GLU A 136 17.967 50.583 -19.395 1.00 0.00 C ATOM 2162 CG GLU A 136 18.906 50.935 -20.551 1.00 0.00 C ATOM 2163 CD GLU A 136 19.712 49.758 -21.051 1.00 0.00 C ATOM 2164 OE1 GLU A 136 20.783 49.481 -20.481 1.00 0.00 O ATOM 2165 OE2 GLU A 136 19.255 49.084 -21.995 1.00 0.00 O ATOM 0 H GLU A 136 20.256 51.429 -18.767 1.00 0.00 H new ATOM 0 HA GLU A 136 17.982 50.676 -17.263 1.00 0.00 H new ATOM 0 HB2 GLU A 136 17.382 49.709 -19.681 1.00 0.00 H new ATOM 0 HB3 GLU A 136 17.265 51.406 -19.259 1.00 0.00 H new ATOM 0 HG2 GLU A 136 18.319 51.340 -21.375 1.00 0.00 H new ATOM 0 HG3 GLU A 136 19.588 51.722 -20.228 1.00 0.00 H new ATOM 2172 N ASN A 137 19.574 48.114 -18.634 1.00 0.00 N ATOM 2173 CA ASN A 137 19.875 46.701 -18.440 1.00 0.00 C ATOM 2174 C ASN A 137 21.065 46.543 -17.512 1.00 0.00 C ATOM 2175 O ASN A 137 21.234 45.508 -16.870 1.00 0.00 O ATOM 2176 CB ASN A 137 20.157 46.002 -19.774 1.00 0.00 C ATOM 2177 CG ASN A 137 18.896 45.690 -20.556 1.00 0.00 C ATOM 2178 OD1 ASN A 137 18.291 44.633 -20.381 1.00 0.00 O ATOM 2179 ND2 ASN A 137 18.497 46.593 -21.435 1.00 0.00 N ATOM 0 H ASN A 137 19.999 48.524 -19.466 1.00 0.00 H new ATOM 0 HA ASN A 137 19.000 46.231 -17.990 1.00 0.00 H new ATOM 0 HB2 ASN A 137 20.806 46.634 -20.379 1.00 0.00 H new ATOM 0 HB3 ASN A 137 20.700 45.076 -19.585 1.00 0.00 H new ATOM 0 HD21 ASN A 137 17.662 46.425 -21.996 1.00 0.00 H new ATOM 0 HD22 ASN A 137 19.024 47.458 -21.553 1.00 0.00 H new ATOM 2186 N LEU A 138 21.888 47.585 -17.448 1.00 0.00 N ATOM 2187 CA LEU A 138 23.068 47.582 -16.594 1.00 0.00 C ATOM 2188 C LEU A 138 22.657 47.366 -15.139 1.00 0.00 C ATOM 2189 O LEU A 138 23.123 46.432 -14.491 1.00 0.00 O ATOM 2190 CB LEU A 138 23.837 48.905 -16.758 1.00 0.00 C ATOM 2191 CG LEU A 138 25.298 48.916 -16.275 1.00 0.00 C ATOM 2192 CD1 LEU A 138 25.386 48.924 -14.755 1.00 0.00 C ATOM 2193 CD2 LEU A 138 26.058 47.727 -16.845 1.00 0.00 C ATOM 0 H LEU A 138 21.757 48.445 -17.980 1.00 0.00 H new ATOM 0 HA LEU A 138 23.726 46.764 -16.889 1.00 0.00 H new ATOM 0 HB2 LEU A 138 23.825 49.178 -17.813 1.00 0.00 H new ATOM 0 HB3 LEU A 138 23.295 49.683 -16.221 1.00 0.00 H new ATOM 0 HG LEU A 138 25.758 49.835 -16.639 1.00 0.00 H new ATOM 0 HD11 LEU A 138 26.433 48.932 -14.451 1.00 0.00 H new ATOM 0 HD12 LEU A 138 24.889 49.813 -14.366 1.00 0.00 H new ATOM 0 HD13 LEU A 138 24.899 48.033 -14.358 1.00 0.00 H new ATOM 0 HD21 LEU A 138 27.089 47.751 -16.493 1.00 0.00 H new ATOM 0 HD22 LEU A 138 25.584 46.802 -16.517 1.00 0.00 H new ATOM 0 HD23 LEU A 138 26.045 47.775 -17.934 1.00 0.00 H new ATOM 2205 N TYR A 139 21.757 48.211 -14.646 1.00 0.00 N ATOM 2206 CA TYR A 139 21.296 48.116 -13.265 1.00 0.00 C ATOM 2207 C TYR A 139 20.324 46.949 -13.109 1.00 0.00 C ATOM 2208 O TYR A 139 20.098 46.458 -12.011 1.00 0.00 O ATOM 2209 CB TYR A 139 20.637 49.430 -12.830 1.00 0.00 C ATOM 2210 CG TYR A 139 20.334 49.506 -11.349 1.00 0.00 C ATOM 2211 CD1 TYR A 139 21.323 49.858 -10.439 1.00 0.00 C ATOM 2212 CD2 TYR A 139 19.063 49.228 -10.862 1.00 0.00 C ATOM 2213 CE1 TYR A 139 21.054 49.930 -9.086 1.00 0.00 C ATOM 2214 CE2 TYR A 139 18.786 49.298 -9.511 1.00 0.00 C ATOM 2215 CZ TYR A 139 19.785 49.649 -8.627 1.00 0.00 C ATOM 2216 OH TYR A 139 19.513 49.718 -7.280 1.00 0.00 O ATOM 0 H TYR A 139 21.333 48.968 -15.181 1.00 0.00 H new ATOM 0 HA TYR A 139 22.157 47.935 -12.622 1.00 0.00 H new ATOM 0 HB2 TYR A 139 21.291 50.259 -13.100 1.00 0.00 H new ATOM 0 HB3 TYR A 139 19.710 49.561 -13.387 1.00 0.00 H new ATOM 0 HD1 TYR A 139 22.318 50.079 -10.795 1.00 0.00 H new ATOM 0 HD2 TYR A 139 18.279 48.953 -11.551 1.00 0.00 H new ATOM 0 HE1 TYR A 139 21.834 50.205 -8.391 1.00 0.00 H new ATOM 0 HE2 TYR A 139 17.792 49.079 -9.148 1.00 0.00 H new ATOM 0 HH TYR A 139 18.572 49.492 -7.124 1.00 0.00 H new ATOM 2226 N PHE A 140 19.746 46.513 -14.223 1.00 0.00 N ATOM 2227 CA PHE A 140 18.882 45.339 -14.223 1.00 0.00 C ATOM 2228 C PHE A 140 19.702 44.091 -13.896 1.00 0.00 C ATOM 2229 O PHE A 140 19.187 43.111 -13.359 1.00 0.00 O ATOM 2230 CB PHE A 140 18.194 45.189 -15.584 1.00 0.00 C ATOM 2231 CG PHE A 140 17.260 44.015 -15.672 1.00 0.00 C ATOM 2232 CD1 PHE A 140 16.019 44.050 -15.056 1.00 0.00 C ATOM 2233 CD2 PHE A 140 17.622 42.878 -16.377 1.00 0.00 C ATOM 2234 CE1 PHE A 140 15.158 42.972 -15.139 1.00 0.00 C ATOM 2235 CE2 PHE A 140 16.765 41.798 -16.464 1.00 0.00 C ATOM 2236 CZ PHE A 140 15.532 41.845 -15.844 1.00 0.00 C ATOM 0 H PHE A 140 19.860 46.954 -15.136 1.00 0.00 H new ATOM 0 HA PHE A 140 18.113 45.462 -13.461 1.00 0.00 H new ATOM 0 HB2 PHE A 140 17.636 46.100 -15.800 1.00 0.00 H new ATOM 0 HB3 PHE A 140 18.957 45.092 -16.356 1.00 0.00 H new ATOM 0 HD1 PHE A 140 15.721 44.930 -14.505 1.00 0.00 H new ATOM 0 HD2 PHE A 140 18.585 42.836 -16.864 1.00 0.00 H new ATOM 0 HE1 PHE A 140 14.194 43.011 -14.653 1.00 0.00 H new ATOM 0 HE2 PHE A 140 17.059 40.918 -17.016 1.00 0.00 H new ATOM 0 HZ PHE A 140 14.861 41.001 -15.910 1.00 0.00 H new ATOM 2246 N GLN A 141 20.980 44.141 -14.246 1.00 0.00 N ATOM 2247 CA GLN A 141 21.911 43.064 -13.942 1.00 0.00 C ATOM 2248 C GLN A 141 22.527 43.228 -12.562 1.00 0.00 C ATOM 2249 O GLN A 141 22.889 42.244 -11.915 1.00 0.00 O ATOM 2250 CB GLN A 141 23.036 43.032 -14.973 1.00 0.00 C ATOM 2251 CG GLN A 141 22.673 42.326 -16.271 1.00 0.00 C ATOM 2252 CD GLN A 141 22.264 40.875 -16.068 1.00 0.00 C ATOM 2253 OE1 GLN A 141 22.796 40.242 -15.032 1.00 0.00 O flip ATOM 2254 NE2 GLN A 141 21.474 40.329 -16.837 1.00 0.00 N flip ATOM 0 H GLN A 141 21.399 44.925 -14.746 1.00 0.00 H new ATOM 0 HA GLN A 141 21.345 42.133 -13.968 1.00 0.00 H new ATOM 0 HB2 GLN A 141 23.334 44.055 -15.200 1.00 0.00 H new ATOM 0 HB3 GLN A 141 23.902 42.538 -14.534 1.00 0.00 H new ATOM 0 HG2 GLN A 141 21.856 42.863 -16.753 1.00 0.00 H new ATOM 0 HG3 GLN A 141 23.525 42.365 -16.949 1.00 0.00 H new ATOM 0 HE21 GLN A 141 21.086 40.850 -17.624 1.00 0.00 H new ATOM 0 HE22 GLN A 141 21.207 39.356 -16.688 1.00 0.00 H new ATOM 2263 N SER A 142 22.682 44.472 -12.148 1.00 0.00 N ATOM 2264 CA SER A 142 23.415 44.793 -10.943 1.00 0.00 C ATOM 2265 C SER A 142 22.475 44.976 -9.747 1.00 0.00 C ATOM 2266 O SER A 142 22.287 44.003 -8.988 1.00 0.00 O ATOM 2267 CB SER A 142 24.243 46.052 -11.194 1.00 0.00 C ATOM 2268 OG SER A 142 23.410 47.167 -11.439 1.00 0.00 O ATOM 0 H SER A 142 22.304 45.283 -12.637 1.00 0.00 H new ATOM 0 HA SER A 142 24.079 43.965 -10.694 1.00 0.00 H new ATOM 0 HB2 SER A 142 24.879 46.251 -10.331 1.00 0.00 H new ATOM 0 HB3 SER A 142 24.903 45.893 -12.046 1.00 0.00 H new ATOM 0 HG SER A 142 23.963 47.961 -11.595 1.00 0.00 H new TER 2274 SER A 142