USER MOD reduce.3.24.130724 H: found=0, std=0, add=1288, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1275 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 97 TYR OH : rot -92:sc= 0.0213 USER MOD Set 1.2: A 134 HIS : no HD1:sc= -0.169 X(o=-0.15,f=-0.0033) USER MOD Set 2.1: A 94 GLN : amide:sc= -0.391 K(o=0.0067,f=-1.7) USER MOD Set 2.2: A 96 HIS : no HD1:sc= 0.397 K(o=0.0067,f=-2.3!) USER MOD Set 3.1: A 81 THR OG1 : rot 180:sc= -0.0338 USER MOD Set 3.2: A 135 HIS : no HD1:sc= -0.0286 X(o=-0.062,f=0) USER MOD Set 4.1: A 64 GLN : amide:sc= 0.103 X(o=0.21,f=0.26) USER MOD Set 4.2: A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.3: A 145 TYR OH : rot -116:sc= 0.107 USER MOD Set 5.1: A 1 HIS N :NH3+ -178:sc= 0.775 (180deg=0.617) USER MOD Set 5.2: A 90 HIS : no HE2:sc= -0.0144 K(o=0.76,f=-1.6!) USER MOD Single : A 1 HIS : no HE2:sc= -0.136 K(o=-0.14,f=-1.3) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 84:sc= 1.21 USER MOD Single : A 22 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 ASN : amide:sc= -0.0163 X(o=-0.016,f=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 MET CE :methyl -163:sc= -0.205 (180deg=-0.814) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -1.3! C(o=-1.3!,f=-5.6!) USER MOD Single : A 34 SER OG : rot -64:sc= 0.215 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HE2:sc= 0.676 K(o=0.68,f=-2.1!) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= -0.117 X(o=-0.12,f=-0.12) USER MOD Single : A 53 SER OG : rot 180:sc= -0.29 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0.193 USER MOD Single : A 68 ASN : amide:sc= -0.0522 K(o=-0.052,f=-0.71) USER MOD Single : A 72 LYS NZ :NH3+ 150:sc= 1.21 (180deg=0.477) USER MOD Single : A 73 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 75 MET CE :methyl -146:sc= 0 (180deg=-0.0158) USER MOD Single : A 76 THR OG1 : rot -140:sc= 0 USER MOD Single : A 80 HIS : no HD1:sc= 0.782 K(o=0.78,f=-2.4!) USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.234 USER MOD Single : A 85 THR OG1 : rot 59:sc= 0.0185 USER MOD Single : A 86 TYR OH : rot 50:sc= 1.36 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 ASN : amide:sc= -0.131 X(o=-0.13,f=-0.33) USER MOD Single : A 92 THR OG1 : rot 170:sc= 0.23 USER MOD Single : A 93 SER OG : rot -170:sc= 0.0123 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 60:sc= 1.28 USER MOD Single : A 101 LYS NZ :NH3+ 157:sc= 0.505 (180deg=0.264) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 126 SER OG : rot 180:sc= -0.0159 USER MOD Single : A 129 SER OG : rot -78:sc= 1.14 USER MOD Single : A 131 ASN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 HIS : no HE2:sc= 0.16 K(o=0.16,f=-2.3!) USER MOD Single : A 157 THR OG1 : rot 80:sc= 0.602 USER MOD Single : A 159 ASN : amide:sc= -0.0172 X(o=-0.017,f=-0.26) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 163 GLN : amide:sc=-0.00915 X(o=-0.0091,f=-0.29) USER MOD Single : A 171 ASN : amide:sc= -0.0938 X(o=-0.094,f=0) USER MOD Single : A 172 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A 1 0.206 3.224 -2.248 1.00 25.00 N ATOM 2 CA HIS A 1 0.638 4.655 -2.379 1.00 25.00 C ATOM 3 C HIS A 1 0.634 5.116 -3.872 1.00 25.00 C ATOM 4 O HIS A 1 0.686 6.318 -4.184 1.00 25.00 O ATOM 5 CB HIS A 1 1.979 4.903 -1.738 1.00 0.00 C ATOM 6 CG HIS A 1 3.014 3.878 -2.043 1.00 0.00 C ATOM 7 ND1 HIS A 1 3.188 2.751 -1.271 1.00 0.00 N ATOM 8 CD2 HIS A 1 3.799 3.754 -3.144 1.00 0.00 C ATOM 9 CE1 HIS A 1 4.181 2.023 -1.913 1.00 0.00 C ATOM 10 NE2 HIS A 1 4.545 2.571 -3.039 1.00 0.00 N ATOM 0 H1 HIS A 1 0.186 2.958 -1.243 1.00 25.00 H new ATOM 0 H2 HIS A 1 -0.744 3.110 -2.655 1.00 25.00 H new ATOM 0 H3 HIS A 1 0.876 2.611 -2.755 1.00 25.00 H new ATOM 0 HA HIS A 1 -0.093 5.257 -1.839 1.00 25.00 H new ATOM 0 HB2 HIS A 1 2.346 5.877 -2.061 1.00 0.00 H new ATOM 0 HB3 HIS A 1 1.846 4.955 -0.657 1.00 0.00 H new ATOM 0 HD1 HIS A 1 2.694 2.504 -0.413 1.00 0.00 H new ATOM 0 HD2 HIS A 1 3.842 4.453 -3.967 1.00 0.00 H new ATOM 0 HE1 HIS A 1 4.603 1.108 -1.524 1.00 0.00 H new ATOM 17 N GLY A 2 0.483 4.156 -4.776 1.00 25.00 N ATOM 18 CA GLY A 2 0.369 4.554 -6.185 1.00 25.00 C ATOM 19 C GLY A 2 1.611 5.092 -6.845 1.00 25.00 C ATOM 20 O GLY A 2 2.700 5.252 -6.217 1.00 25.00 O ATOM 0 H GLY A 2 0.438 3.155 -4.585 1.00 25.00 H new ATOM 0 HA2 GLY A 2 0.030 3.689 -6.755 1.00 25.00 H new ATOM 0 HA3 GLY A 2 -0.411 5.312 -6.261 1.00 25.00 H new ATOM 24 N PHE A 3 1.541 5.459 -8.134 1.00 25.00 N ATOM 25 CA PHE A 3 2.721 6.073 -8.761 1.00 25.00 C ATOM 26 C PHE A 3 2.319 7.013 -9.911 1.00 25.00 C ATOM 27 O PHE A 3 1.243 6.899 -10.427 1.00 25.00 O ATOM 28 CB PHE A 3 3.722 5.035 -9.300 1.00 25.00 C ATOM 29 CG PHE A 3 3.083 4.063 -10.282 1.00 25.00 C ATOM 30 CD1 PHE A 3 3.192 4.347 -11.657 1.00 50.00 C ATOM 31 CD2 PHE A 3 2.502 2.885 -9.849 1.00 50.00 C ATOM 32 CE1 PHE A 3 2.679 3.418 -12.639 1.00 25.00 C ATOM 33 CE2 PHE A 3 2.033 1.924 -10.750 1.00 25.00 C ATOM 34 CZ PHE A 3 2.151 2.179 -12.148 1.00 25.00 C ATOM 0 H PHE A 3 0.725 5.350 -8.736 1.00 25.00 H new ATOM 0 HA PHE A 3 3.209 6.641 -7.969 1.00 25.00 H new ATOM 0 HB2 PHE A 3 4.547 5.552 -9.790 1.00 25.00 H new ATOM 0 HB3 PHE A 3 4.146 4.477 -8.465 1.00 25.00 H new ATOM 0 HD1 PHE A 3 3.662 5.264 -11.980 1.00 50.00 H new ATOM 0 HD2 PHE A 3 2.408 2.703 -8.789 1.00 50.00 H new ATOM 0 HE1 PHE A 3 2.693 3.647 -13.694 1.00 25.00 H new ATOM 0 HE2 PHE A 3 1.590 1.006 -10.394 1.00 25.00 H new ATOM 0 HZ PHE A 3 1.836 1.423 -12.852 1.00 25.00 H new ATOM 44 N ILE A 4 3.136 8.004 -10.222 1.00 25.00 N ATOM 45 CA ILE A 4 2.705 9.111 -11.025 1.00 25.00 C ATOM 46 C ILE A 4 2.614 8.625 -12.439 1.00 25.00 C ATOM 47 O ILE A 4 3.615 8.097 -12.988 1.00 25.00 O ATOM 48 CB ILE A 4 3.721 10.271 -11.027 1.00 25.00 C ATOM 49 CG1 ILE A 4 3.982 10.832 -9.616 1.00 25.00 C ATOM 50 CG2 ILE A 4 3.301 11.433 -11.946 1.00 25.00 C ATOM 51 CD1 ILE A 4 2.797 11.336 -8.776 1.00 25.00 C ATOM 0 H ILE A 4 4.110 8.055 -9.922 1.00 25.00 H new ATOM 0 HA ILE A 4 1.760 9.473 -10.620 1.00 25.00 H new ATOM 0 HB ILE A 4 4.640 9.829 -11.413 1.00 25.00 H new ATOM 0 HG12 ILE A 4 4.483 10.053 -9.041 1.00 25.00 H new ATOM 0 HG13 ILE A 4 4.687 11.657 -9.717 1.00 25.00 H new ATOM 0 HG21 ILE A 4 4.055 12.219 -11.906 1.00 25.00 H new ATOM 0 HG22 ILE A 4 3.208 11.072 -12.970 1.00 25.00 H new ATOM 0 HG23 ILE A 4 2.343 11.832 -11.613 1.00 25.00 H new ATOM 0 HD11 ILE A 4 3.160 11.695 -7.813 1.00 25.00 H new ATOM 0 HD12 ILE A 4 2.298 12.150 -9.302 1.00 25.00 H new ATOM 0 HD13 ILE A 4 2.091 10.521 -8.616 1.00 25.00 H new ATOM 63 N GLU A 5 1.543 8.931 -13.120 1.00 25.00 N ATOM 64 CA GLU A 5 1.410 8.405 -14.501 1.00 25.00 C ATOM 65 C GLU A 5 1.289 9.520 -15.517 1.00 25.00 C ATOM 66 O GLU A 5 1.693 9.354 -16.650 1.00 25.00 O ATOM 67 CB GLU A 5 0.179 7.512 -14.675 1.00 25.00 C ATOM 68 CG GLU A 5 0.476 6.069 -14.197 1.00 25.00 C ATOM 69 CD GLU A 5 1.117 5.244 -15.315 1.00 25.00 C ATOM 70 OE1 GLU A 5 0.481 4.354 -15.876 1.00 25.00 O ATOM 71 OE2 GLU A 5 2.306 5.488 -15.695 1.00 25.00 O1- ATOM 0 H GLU A 5 0.772 9.510 -12.786 1.00 25.00 H new ATOM 0 HA GLU A 5 2.318 7.825 -14.667 1.00 25.00 H new ATOM 0 HB2 GLU A 5 -0.657 7.923 -14.109 1.00 25.00 H new ATOM 0 HB3 GLU A 5 -0.121 7.499 -15.723 1.00 25.00 H new ATOM 0 HG2 GLU A 5 1.141 6.097 -13.334 1.00 25.00 H new ATOM 0 HG3 GLU A 5 -0.449 5.592 -13.872 1.00 25.00 H new ATOM 78 N LYS A 6 0.726 10.649 -15.158 1.00 25.00 N ATOM 79 CA LYS A 6 1.141 11.882 -15.845 1.00 25.00 C ATOM 80 C LYS A 6 1.061 13.043 -14.798 1.00 25.00 C ATOM 81 O LYS A 6 0.427 12.963 -13.726 1.00 25.00 O ATOM 82 CB LYS A 6 0.170 12.074 -17.019 1.00 25.00 C ATOM 83 CG LYS A 6 -1.037 12.918 -16.944 1.00 25.00 C ATOM 84 CD LYS A 6 -1.839 12.826 -18.158 1.00 25.00 C ATOM 85 CE LYS A 6 -3.156 13.535 -18.088 1.00 25.00 C ATOM 86 NZ LYS A 6 -3.700 13.865 -19.468 1.00 25.00 N1+ ATOM 0 H LYS A 6 0.015 10.757 -14.435 1.00 25.00 H new ATOM 0 HA LYS A 6 2.158 11.852 -16.236 1.00 25.00 H new ATOM 0 HB2 LYS A 6 0.763 12.459 -17.849 1.00 25.00 H new ATOM 0 HB3 LYS A 6 -0.169 11.078 -17.304 1.00 25.00 H new ATOM 0 HG2 LYS A 6 -1.639 12.616 -16.087 1.00 25.00 H new ATOM 0 HG3 LYS A 6 -0.745 13.955 -16.779 1.00 25.00 H new ATOM 0 HD2 LYS A 6 -1.265 13.235 -18.989 1.00 25.00 H new ATOM 0 HD3 LYS A 6 -2.018 11.774 -18.381 1.00 25.00 H new ATOM 0 HE2 LYS A 6 -3.875 12.913 -17.555 1.00 25.00 H new ATOM 0 HE3 LYS A 6 -3.042 14.455 -17.514 1.00 25.00 H new ATOM 0 HZ1 LYS A 6 -4.612 14.355 -19.373 1.00 25.00 H new ATOM 0 HZ2 LYS A 6 -3.027 14.480 -19.969 1.00 25.00 H new ATOM 0 HZ3 LYS A 6 -3.833 12.986 -20.008 1.00 25.00 H new ATOM 100 N PRO A 7 1.740 14.187 -15.100 1.00 25.00 N ATOM 101 CA PRO A 7 2.443 14.490 -16.383 1.00 25.00 C ATOM 102 C PRO A 7 3.781 13.789 -16.482 1.00 25.00 C ATOM 103 O PRO A 7 4.446 13.475 -15.514 1.00 25.00 O ATOM 104 CB PRO A 7 2.524 16.023 -16.293 1.00 25.00 C ATOM 105 CG PRO A 7 2.660 16.248 -14.932 1.00 25.00 C ATOM 106 CD PRO A 7 1.726 15.344 -14.215 1.00 25.00 C ATOM 0 HA PRO A 7 1.948 14.138 -17.288 1.00 25.00 H new ATOM 0 HB2 PRO A 7 3.372 16.416 -16.854 1.00 25.00 H new ATOM 0 HB3 PRO A 7 1.629 16.499 -16.693 1.00 25.00 H new ATOM 0 HG2 PRO A 7 3.687 16.061 -14.617 1.00 25.00 H new ATOM 0 HG3 PRO A 7 2.438 17.289 -14.695 1.00 25.00 H new ATOM 0 HD2 PRO A 7 2.074 15.101 -13.211 1.00 25.00 H new ATOM 0 HD3 PRO A 7 0.730 15.775 -14.112 1.00 25.00 H new ATOM 114 N GLY A 8 4.188 13.447 -17.684 1.00 25.00 N ATOM 115 CA GLY A 8 5.514 12.871 -17.941 1.00 25.00 C ATOM 116 C GLY A 8 5.647 11.332 -17.715 1.00 25.00 C ATOM 117 O GLY A 8 4.754 10.571 -17.259 1.00 25.00 O ATOM 0 H GLY A 8 3.616 13.556 -18.522 1.00 25.00 H new ATOM 0 HA2 GLY A 8 5.791 13.092 -18.972 1.00 25.00 H new ATOM 0 HA3 GLY A 8 6.238 13.376 -17.301 1.00 25.00 H new ATOM 121 N SER A 9 6.909 10.910 -17.883 1.00 25.00 N ATOM 122 CA SER A 9 7.368 9.596 -17.568 1.00 25.00 C ATOM 123 C SER A 9 8.426 9.691 -16.471 1.00 25.00 C ATOM 124 O SER A 9 9.552 10.098 -16.786 1.00 25.00 O ATOM 125 CB SER A 9 7.896 8.929 -18.851 1.00 25.00 C ATOM 126 OG SER A 9 8.349 7.629 -18.651 1.00 25.00 O ATOM 0 H SER A 9 7.644 11.512 -18.255 1.00 25.00 H new ATOM 0 HA SER A 9 6.559 8.973 -17.187 1.00 25.00 H new ATOM 0 HB2 SER A 9 7.103 8.919 -19.599 1.00 25.00 H new ATOM 0 HB3 SER A 9 8.709 9.531 -19.257 1.00 25.00 H new ATOM 0 HG SER A 9 8.669 7.260 -19.500 1.00 25.00 H new ATOM 132 N ARG A 10 8.065 9.389 -15.210 1.00 25.00 N ATOM 133 CA ARG A 10 8.919 9.658 -14.067 1.00 25.00 C ATOM 134 C ARG A 10 10.243 8.982 -14.203 1.00 25.00 C ATOM 135 O ARG A 10 11.226 9.458 -13.754 1.00 25.00 O ATOM 136 CB ARG A 10 8.178 9.247 -12.787 1.00 25.00 C ATOM 137 CG ARG A 10 7.592 7.798 -12.951 1.00 25.00 C ATOM 138 CD ARG A 10 7.253 7.291 -11.557 1.00 25.00 C ATOM 139 NE ARG A 10 6.979 5.815 -11.617 1.00 25.00 N ATOM 140 CZ ARG A 10 7.053 4.974 -10.591 1.00 25.00 C ATOM 141 NH1 ARG A 10 7.491 5.382 -9.429 1.00 25.00 N1+ ATOM 142 NH2 ARG A 10 6.760 3.690 -10.728 1.00 25.00 N ATOM 0 H ARG A 10 7.175 8.954 -14.969 1.00 25.00 H new ATOM 0 HA ARG A 10 9.136 10.725 -14.015 1.00 25.00 H new ATOM 0 HB2 ARG A 10 8.858 9.280 -11.936 1.00 25.00 H new ATOM 0 HB3 ARG A 10 7.374 9.953 -12.579 1.00 25.00 H new ATOM 0 HG2 ARG A 10 6.704 7.811 -13.582 1.00 25.00 H new ATOM 0 HG3 ARG A 10 8.316 7.142 -13.434 1.00 25.00 H new ATOM 0 HD2 ARG A 10 8.079 7.492 -10.874 1.00 25.00 H new ATOM 0 HD3 ARG A 10 6.382 7.818 -11.168 1.00 25.00 H new ATOM 0 HE ARG A 10 6.714 5.426 -12.522 1.00 25.00 H new ATOM 0 HH11 ARG A 10 7.779 6.353 -9.305 1.00 25.00 H new ATOM 0 HH12 ARG A 10 7.545 4.730 -8.647 1.00 25.00 H new ATOM 0 HH21 ARG A 10 6.470 3.327 -11.636 1.00 25.00 H new ATOM 0 HH22 ARG A 10 6.824 3.064 -9.925 1.00 25.00 H new ATOM 156 N ALA A 11 10.341 7.794 -14.857 1.00 25.00 N ATOM 157 CA ALA A 11 11.646 7.174 -14.984 1.00 25.00 C ATOM 158 C ALA A 11 12.545 7.917 -16.017 1.00 25.00 C ATOM 159 O ALA A 11 13.743 8.050 -15.792 1.00 25.00 O ATOM 160 CB ALA A 11 11.538 5.737 -15.342 1.00 25.00 C ATOM 0 H ALA A 11 9.564 7.284 -15.278 1.00 25.00 H new ATOM 0 HA ALA A 11 12.120 7.250 -14.005 1.00 25.00 H new ATOM 0 HB1 ALA A 11 12.536 5.307 -15.428 1.00 25.00 H new ATOM 0 HB2 ALA A 11 10.982 5.210 -14.567 1.00 25.00 H new ATOM 0 HB3 ALA A 11 11.017 5.637 -16.294 1.00 25.00 H new ATOM 166 N ALA A 12 11.930 8.463 -17.069 1.00 25.00 N ATOM 167 CA ALA A 12 12.753 9.132 -18.084 1.00 25.00 C ATOM 168 C ALA A 12 13.160 10.466 -17.500 1.00 25.00 C ATOM 169 O ALA A 12 14.182 11.006 -17.908 1.00 25.00 O ATOM 170 CB ALA A 12 11.924 9.301 -19.380 1.00 25.00 C ATOM 0 H ALA A 12 10.924 8.460 -17.239 1.00 25.00 H new ATOM 0 HA ALA A 12 13.642 8.556 -18.342 1.00 25.00 H new ATOM 0 HB1 ALA A 12 12.530 9.797 -20.138 1.00 25.00 H new ATOM 0 HB2 ALA A 12 11.617 8.321 -19.746 1.00 25.00 H new ATOM 0 HB3 ALA A 12 11.040 9.904 -19.171 1.00 25.00 H new ATOM 176 N LEU A 13 12.417 10.993 -16.506 1.00 25.00 N ATOM 177 CA LEU A 13 12.750 12.253 -15.864 1.00 25.00 C ATOM 178 C LEU A 13 13.914 12.168 -14.912 1.00 25.00 C ATOM 179 O LEU A 13 14.720 13.125 -14.788 1.00 25.00 O ATOM 180 CB LEU A 13 11.456 12.776 -15.178 1.00 25.00 C ATOM 181 CG LEU A 13 10.433 13.315 -16.165 1.00 25.00 C ATOM 182 CD1 LEU A 13 9.085 13.463 -15.523 1.00 75.00 C ATOM 183 CD2 LEU A 13 10.785 14.667 -16.737 1.00 75.00 C ATOM 0 H LEU A 13 11.576 10.550 -16.137 1.00 25.00 H new ATOM 0 HA LEU A 13 13.096 12.957 -16.621 1.00 25.00 H new ATOM 0 HB2 LEU A 13 11.005 11.968 -14.602 1.00 25.00 H new ATOM 0 HB3 LEU A 13 11.719 13.563 -14.471 1.00 25.00 H new ATOM 0 HG LEU A 13 10.424 12.579 -16.969 1.00 25.00 H new ATOM 0 HD11 LEU A 13 8.375 13.850 -16.253 1.00 75.00 H new ATOM 0 HD12 LEU A 13 8.744 12.492 -15.165 1.00 75.00 H new ATOM 0 HD13 LEU A 13 9.156 14.155 -14.684 1.00 75.00 H new ATOM 0 HD21 LEU A 13 10.006 14.982 -17.432 1.00 75.00 H new ATOM 0 HD22 LEU A 13 10.866 15.394 -15.929 1.00 75.00 H new ATOM 0 HD23 LEU A 13 11.737 14.602 -17.264 1.00 75.00 H new ATOM 195 N CYS A 14 14.025 11.014 -14.268 1.00 25.00 N ATOM 196 CA CYS A 14 15.183 10.779 -13.406 1.00 25.00 C ATOM 197 C CYS A 14 16.462 10.428 -14.180 1.00 25.00 C ATOM 198 O CYS A 14 17.516 11.035 -13.996 1.00 25.00 O ATOM 199 CB CYS A 14 14.837 9.668 -12.443 1.00 25.00 C ATOM 200 SG CYS A 14 15.576 9.875 -10.768 1.00 25.00 S ATOM 0 H CYS A 14 13.354 10.247 -14.319 1.00 25.00 H new ATOM 0 HA CYS A 14 15.400 11.708 -12.879 1.00 25.00 H new ATOM 0 HB2 CYS A 14 13.753 9.609 -12.346 1.00 25.00 H new ATOM 0 HB3 CYS A 14 15.172 8.719 -12.862 1.00 25.00 H new ATOM 205 N SER A 15 16.350 9.450 -15.112 1.00 25.00 N ATOM 206 CA SER A 15 17.475 8.794 -15.880 1.00 25.00 C ATOM 207 C SER A 15 18.271 9.743 -16.754 1.00 25.00 C ATOM 208 O SER A 15 17.821 10.897 -17.063 1.00 25.00 O ATOM 209 CB SER A 15 16.955 7.632 -16.719 1.00 25.00 C ATOM 210 OG SER A 15 16.180 6.797 -15.887 1.00 25.00 O ATOM 0 H SER A 15 15.440 9.069 -15.372 1.00 25.00 H new ATOM 0 HA SER A 15 18.164 8.428 -15.119 1.00 25.00 H new ATOM 0 HB2 SER A 15 16.355 8.002 -17.550 1.00 25.00 H new ATOM 0 HB3 SER A 15 17.786 7.073 -17.150 1.00 25.00 H new ATOM 0 HG SER A 15 15.266 7.147 -15.832 1.00 25.00 H new ATOM 216 N GLU A 16 19.450 9.270 -17.148 1.00 25.00 N ATOM 217 CA GLU A 16 20.409 10.164 -17.736 1.00 25.00 C ATOM 218 C GLU A 16 19.976 10.678 -19.120 1.00 25.00 C ATOM 219 O GLU A 16 19.884 11.945 -19.325 1.00 25.00 O ATOM 220 CB GLU A 16 21.713 9.343 -17.800 1.00 25.00 C ATOM 221 CG GLU A 16 22.889 10.146 -18.236 1.00 25.00 C ATOM 222 CD GLU A 16 24.226 9.439 -18.088 1.00 25.00 C ATOM 223 OE1 GLU A 16 25.325 10.038 -17.899 1.00 25.00 O ATOM 224 OE2 GLU A 16 24.213 8.215 -18.055 1.00 25.00 O1- ATOM 0 H GLU A 16 19.748 8.298 -17.069 1.00 25.00 H new ATOM 0 HA GLU A 16 20.524 11.074 -17.146 1.00 25.00 H new ATOM 0 HB2 GLU A 16 21.916 8.917 -16.817 1.00 25.00 H new ATOM 0 HB3 GLU A 16 21.576 8.508 -18.487 1.00 25.00 H new ATOM 0 HG2 GLU A 16 22.754 10.426 -19.281 1.00 25.00 H new ATOM 0 HG3 GLU A 16 22.916 11.070 -17.659 1.00 25.00 H new ATOM 231 N ALA A 17 19.540 9.713 -19.955 1.00 25.00 N ATOM 232 CA ALA A 17 19.133 9.981 -21.339 1.00 25.00 C ATOM 233 C ALA A 17 18.812 8.680 -22.106 1.00 25.00 C ATOM 234 O ALA A 17 17.926 8.688 -22.917 1.00 25.00 O ATOM 235 CB ALA A 17 20.275 10.681 -22.079 1.00 25.00 C ATOM 0 H ALA A 17 19.462 8.732 -19.685 1.00 25.00 H new ATOM 0 HA ALA A 17 18.239 10.603 -21.298 1.00 25.00 H new ATOM 0 HB1 ALA A 17 19.974 10.881 -23.107 1.00 25.00 H new ATOM 0 HB2 ALA A 17 20.509 11.622 -21.580 1.00 25.00 H new ATOM 0 HB3 ALA A 17 21.157 10.040 -22.077 1.00 25.00 H new ATOM 241 N PHE A 18 19.557 7.633 -21.887 1.00 25.00 N ATOM 242 CA PHE A 18 19.816 6.554 -22.832 1.00 25.00 C ATOM 243 C PHE A 18 18.817 5.444 -22.743 1.00 25.00 C ATOM 244 O PHE A 18 19.145 4.352 -23.155 1.00 25.00 O ATOM 245 CB PHE A 18 21.185 6.006 -22.582 1.00 25.00 C ATOM 246 CG PHE A 18 22.250 7.027 -22.664 1.00 25.00 C ATOM 247 CD1 PHE A 18 22.532 7.707 -23.830 1.00 50.00 C ATOM 248 CD2 PHE A 18 23.046 7.345 -21.521 1.00 50.00 C ATOM 249 CE1 PHE A 18 23.470 8.697 -23.938 1.00 25.00 C ATOM 250 CE2 PHE A 18 24.037 8.367 -21.614 1.00 25.00 C ATOM 251 CZ PHE A 18 24.266 9.057 -22.817 1.00 25.00 C ATOM 0 H PHE A 18 20.033 7.490 -20.996 1.00 25.00 H new ATOM 0 HA PHE A 18 19.736 6.975 -23.834 1.00 25.00 H new ATOM 0 HB2 PHE A 18 21.209 5.545 -21.594 1.00 25.00 H new ATOM 0 HB3 PHE A 18 21.391 5.218 -23.307 1.00 25.00 H new ATOM 0 HD1 PHE A 18 21.976 7.440 -24.716 1.00 50.00 H new ATOM 0 HD2 PHE A 18 22.898 6.815 -20.592 1.00 50.00 H new ATOM 0 HE1 PHE A 18 23.606 9.208 -24.880 1.00 25.00 H new ATOM 0 HE2 PHE A 18 24.624 8.616 -20.742 1.00 25.00 H new ATOM 0 HZ PHE A 18 25.017 9.830 -22.887 1.00 25.00 H new ATOM 261 N GLY A 19 17.679 5.666 -22.149 1.00 25.00 N ATOM 262 CA GLY A 19 16.763 4.557 -21.960 1.00 25.00 C ATOM 263 C GLY A 19 16.958 3.829 -20.713 1.00 25.00 C ATOM 264 O GLY A 19 16.695 2.590 -20.800 1.00 25.00 O ATOM 0 H GLY A 19 17.362 6.569 -21.795 1.00 25.00 H new ATOM 0 HA2 GLY A 19 15.741 4.935 -21.991 1.00 25.00 H new ATOM 0 HA3 GLY A 19 16.872 3.864 -22.794 1.00 25.00 H new ATOM 268 N PHE A 20 17.423 4.454 -19.660 1.00 25.00 N ATOM 269 CA PHE A 20 17.814 3.829 -18.355 1.00 25.00 C ATOM 270 C PHE A 20 18.359 2.430 -18.454 1.00 25.00 C ATOM 271 O PHE A 20 17.936 1.506 -17.797 1.00 25.00 O ATOM 272 CB PHE A 20 16.448 3.890 -17.604 1.00 25.00 C ATOM 273 CG PHE A 20 16.504 3.407 -16.210 1.00 25.00 C ATOM 274 CD1 PHE A 20 15.646 2.364 -15.770 1.00 50.00 C ATOM 275 CD2 PHE A 20 17.401 3.948 -15.286 1.00 50.00 C ATOM 276 CE1 PHE A 20 15.903 1.722 -14.531 1.00 25.00 C ATOM 277 CE2 PHE A 20 17.585 3.410 -13.974 1.00 25.00 C ATOM 278 CZ PHE A 20 16.812 2.342 -13.544 1.00 25.00 C ATOM 0 H PHE A 20 17.558 5.465 -19.657 1.00 25.00 H new ATOM 0 HA PHE A 20 18.645 4.337 -17.866 1.00 25.00 H new ATOM 0 HB2 PHE A 20 16.090 4.920 -17.606 1.00 25.00 H new ATOM 0 HB3 PHE A 20 15.717 3.297 -18.153 1.00 25.00 H new ATOM 0 HD1 PHE A 20 14.804 2.062 -16.374 1.00 50.00 H new ATOM 0 HD2 PHE A 20 17.982 4.811 -15.576 1.00 50.00 H new ATOM 0 HE1 PHE A 20 15.432 0.776 -14.308 1.00 25.00 H new ATOM 0 HE2 PHE A 20 18.328 3.837 -13.316 1.00 25.00 H new ATOM 0 HZ PHE A 20 16.872 1.978 -12.529 1.00 25.00 H new ATOM 288 N LEU A 21 19.289 2.215 -19.372 1.00 25.00 N ATOM 289 CA LEU A 21 19.846 0.899 -19.676 1.00 25.00 C ATOM 290 C LEU A 21 20.808 0.614 -18.534 1.00 25.00 C ATOM 291 O LEU A 21 21.156 -0.526 -18.282 1.00 25.00 O ATOM 292 CB LEU A 21 20.578 0.933 -21.042 1.00 25.00 C ATOM 293 CG LEU A 21 19.706 1.164 -22.302 1.00 25.00 C ATOM 294 CD1 LEU A 21 20.595 1.384 -23.544 1.00 50.00 C ATOM 295 CD2 LEU A 21 18.755 -0.025 -22.555 1.00 50.00 C ATOM 0 H LEU A 21 19.688 2.963 -19.939 1.00 25.00 H new ATOM 0 HA LEU A 21 19.083 0.124 -19.758 1.00 25.00 H new ATOM 0 HB2 LEU A 21 21.332 1.719 -21.003 1.00 25.00 H new ATOM 0 HB3 LEU A 21 21.108 -0.011 -21.166 1.00 25.00 H new ATOM 0 HG LEU A 21 19.106 2.056 -22.123 1.00 25.00 H new ATOM 0 HD11 LEU A 21 19.965 1.544 -24.419 1.00 50.00 H new ATOM 0 HD12 LEU A 21 21.228 2.257 -23.388 1.00 50.00 H new ATOM 0 HD13 LEU A 21 21.221 0.506 -23.704 1.00 50.00 H new ATOM 0 HD21 LEU A 21 18.158 0.170 -23.446 1.00 50.00 H new ATOM 0 HD22 LEU A 21 19.339 -0.934 -22.701 1.00 50.00 H new ATOM 0 HD23 LEU A 21 18.095 -0.152 -21.697 1.00 50.00 H new ATOM 307 N ASN A 22 21.352 1.663 -17.926 1.00 25.00 N ATOM 308 CA ASN A 22 22.185 1.566 -16.699 1.00 25.00 C ATOM 309 C ASN A 22 21.567 2.450 -15.615 1.00 25.00 C ATOM 310 O ASN A 22 20.840 3.466 -15.965 1.00 25.00 O ATOM 311 CB ASN A 22 23.595 2.065 -17.020 1.00 25.00 C ATOM 312 CG ASN A 22 24.193 1.543 -18.336 1.00 25.00 C ATOM 313 OD1 ASN A 22 24.561 2.341 -19.137 1.00 25.00 O ATOM 314 ND2 ASN A 22 24.381 0.272 -18.493 1.00 25.00 N ATOM 0 H ASN A 22 21.235 2.619 -18.262 1.00 25.00 H new ATOM 0 HA ASN A 22 22.231 0.534 -16.351 1.00 25.00 H new ATOM 0 HB2 ASN A 22 23.578 3.154 -17.055 1.00 25.00 H new ATOM 0 HB3 ASN A 22 24.258 1.783 -16.202 1.00 25.00 H new ATOM 0 HD21 ASN A 22 24.859 -0.074 -19.325 1.00 25.00 H new ATOM 0 HD22 ASN A 22 24.051 -0.384 -17.785 1.00 25.00 H new ATOM 321 N LEU A 23 21.954 2.153 -14.383 1.00 25.00 N ATOM 322 CA LEU A 23 21.550 2.999 -13.284 1.00 25.00 C ATOM 323 C LEU A 23 22.355 4.257 -13.378 1.00 25.00 C ATOM 324 O LEU A 23 23.513 4.250 -13.831 1.00 25.00 O ATOM 325 CB LEU A 23 21.881 2.290 -11.924 1.00 25.00 C ATOM 326 CG LEU A 23 21.059 1.110 -11.484 1.00 25.00 C ATOM 327 CD1 LEU A 23 21.029 -0.125 -12.333 1.00 50.00 C ATOM 328 CD2 LEU A 23 21.520 0.737 -10.081 1.00 50.00 C ATOM 0 H LEU A 23 22.533 1.352 -14.129 1.00 25.00 H new ATOM 0 HA LEU A 23 20.480 3.204 -13.329 1.00 25.00 H new ATOM 0 HB2 LEU A 23 22.920 1.965 -11.970 1.00 25.00 H new ATOM 0 HB3 LEU A 23 21.817 3.043 -11.139 1.00 25.00 H new ATOM 0 HG LEU A 23 20.030 1.462 -11.561 1.00 25.00 H new ATOM 0 HD11 LEU A 23 20.388 -0.873 -11.865 1.00 50.00 H new ATOM 0 HD12 LEU A 23 20.638 0.121 -13.320 1.00 50.00 H new ATOM 0 HD13 LEU A 23 22.039 -0.523 -12.432 1.00 50.00 H new ATOM 0 HD21 LEU A 23 20.946 -0.118 -9.725 1.00 50.00 H new ATOM 0 HD22 LEU A 23 22.579 0.479 -10.102 1.00 50.00 H new ATOM 0 HD23 LEU A 23 21.366 1.582 -9.411 1.00 50.00 H new ATOM 340 N ASN A 24 21.904 5.274 -12.669 1.00 25.00 N ATOM 341 CA ASN A 24 22.517 6.622 -12.650 1.00 25.00 C ATOM 342 C ASN A 24 21.802 7.603 -11.731 1.00 25.00 C ATOM 343 O ASN A 24 22.450 8.523 -11.143 1.00 25.00 O ATOM 344 CB ASN A 24 22.435 7.276 -14.028 1.00 25.00 C ATOM 345 CG ASN A 24 23.484 8.301 -14.233 1.00 25.00 C ATOM 346 OD1 ASN A 24 24.648 8.071 -14.255 1.00 25.00 O ATOM 347 ND2 ASN A 24 23.003 9.565 -14.425 1.00 25.00 N ATOM 0 H ASN A 24 21.082 5.201 -12.070 1.00 25.00 H new ATOM 0 HA ASN A 24 23.538 6.445 -12.311 1.00 25.00 H new ATOM 0 HB2 ASN A 24 22.526 6.509 -14.797 1.00 25.00 H new ATOM 0 HB3 ASN A 24 21.454 7.735 -14.151 1.00 25.00 H new ATOM 0 HD21 ASN A 24 23.649 10.337 -14.592 1.00 25.00 H new ATOM 0 HD22 ASN A 24 21.998 9.737 -14.401 1.00 25.00 H new ATOM 354 N CYS A 25 20.542 7.422 -11.419 1.00 25.00 N ATOM 355 CA CYS A 25 19.714 8.356 -10.593 1.00 25.00 C ATOM 356 C CYS A 25 19.537 8.082 -9.074 1.00 25.00 C ATOM 357 O CYS A 25 18.944 8.875 -8.371 1.00 25.00 O ATOM 358 CB CYS A 25 18.285 8.413 -11.235 1.00 25.00 C ATOM 359 SG CYS A 25 17.562 10.093 -10.964 1.00 25.00 S ATOM 0 H CYS A 25 20.020 6.602 -11.729 1.00 25.00 H new ATOM 0 HA CYS A 25 20.287 9.283 -10.613 1.00 25.00 H new ATOM 0 HB2 CYS A 25 18.344 8.197 -12.302 1.00 25.00 H new ATOM 0 HB3 CYS A 25 17.643 7.652 -10.791 1.00 25.00 H new ATOM 364 N GLY A 26 20.023 6.955 -8.557 1.00 25.00 N ATOM 365 CA GLY A 26 19.793 6.636 -7.176 1.00 25.00 C ATOM 366 C GLY A 26 18.588 5.770 -7.097 1.00 25.00 C ATOM 367 O GLY A 26 17.501 6.053 -7.647 1.00 25.00 O ATOM 0 H GLY A 26 20.568 6.266 -9.075 1.00 25.00 H new ATOM 0 HA2 GLY A 26 20.658 6.124 -6.754 1.00 25.00 H new ATOM 0 HA3 GLY A 26 19.647 7.546 -6.594 1.00 25.00 H new ATOM 371 N SER A 27 18.784 4.615 -6.407 1.00 25.00 N ATOM 372 CA SER A 27 17.803 3.528 -6.322 1.00 25.00 C ATOM 373 C SER A 27 16.492 3.963 -5.690 1.00 25.00 C ATOM 374 O SER A 27 15.503 3.237 -5.775 1.00 25.00 O ATOM 375 CB SER A 27 18.392 2.344 -5.583 1.00 25.00 C ATOM 376 OG SER A 27 19.538 2.074 -6.348 1.00 25.00 O ATOM 0 H SER A 27 19.643 4.422 -5.892 1.00 25.00 H new ATOM 0 HA SER A 27 17.568 3.231 -7.344 1.00 25.00 H new ATOM 0 HB2 SER A 27 18.638 2.587 -4.549 1.00 25.00 H new ATOM 0 HB3 SER A 27 17.708 1.496 -5.557 1.00 25.00 H new ATOM 0 HG SER A 27 20.017 1.312 -5.961 1.00 25.00 H new ATOM 382 N VAL A 28 16.519 5.108 -5.025 1.00 25.00 N ATOM 383 CA VAL A 28 15.328 5.624 -4.311 1.00 25.00 C ATOM 384 C VAL A 28 14.223 6.015 -5.333 1.00 25.00 C ATOM 385 O VAL A 28 13.039 5.961 -4.999 1.00 25.00 O ATOM 386 CB VAL A 28 15.706 6.787 -3.344 1.00 25.00 C ATOM 387 CG1 VAL A 28 14.609 7.005 -2.238 1.00 50.00 C ATOM 388 CG2 VAL A 28 16.967 6.496 -2.620 1.00 50.00 C ATOM 0 H VAL A 28 17.342 5.706 -4.956 1.00 25.00 H new ATOM 0 HA VAL A 28 14.920 4.835 -3.680 1.00 25.00 H new ATOM 0 HB VAL A 28 15.805 7.672 -3.973 1.00 25.00 H new ATOM 0 HG11 VAL A 28 14.909 7.824 -1.584 1.00 50.00 H new ATOM 0 HG12 VAL A 28 13.658 7.249 -2.712 1.00 50.00 H new ATOM 0 HG13 VAL A 28 14.498 6.094 -1.651 1.00 50.00 H new ATOM 0 HG21 VAL A 28 17.204 7.326 -1.954 1.00 50.00 H new ATOM 0 HG22 VAL A 28 16.849 5.584 -2.036 1.00 50.00 H new ATOM 0 HG23 VAL A 28 17.777 6.365 -3.338 1.00 50.00 H new ATOM 398 N MET A 29 14.629 6.251 -6.594 1.00 25.00 N ATOM 399 CA MET A 29 13.700 6.446 -7.742 1.00 25.00 C ATOM 400 C MET A 29 12.690 5.295 -7.896 1.00 25.00 C ATOM 401 O MET A 29 11.662 5.425 -8.583 1.00 25.00 O ATOM 402 CB MET A 29 14.425 6.643 -9.090 1.00 25.00 C ATOM 403 CG MET A 29 15.210 5.369 -9.622 1.00 25.00 C ATOM 404 SD MET A 29 15.922 5.463 -11.280 1.00 25.00 S ATOM 405 CE MET A 29 14.521 5.792 -12.169 1.00 25.00 C ATOM 0 H MET A 29 15.613 6.314 -6.855 1.00 25.00 H new ATOM 0 HA MET A 29 13.166 7.363 -7.494 1.00 25.00 H new ATOM 0 HB2 MET A 29 13.692 6.939 -9.840 1.00 25.00 H new ATOM 0 HB3 MET A 29 15.129 7.469 -8.990 1.00 25.00 H new ATOM 0 HG2 MET A 29 16.016 5.153 -8.921 1.00 25.00 H new ATOM 0 HG3 MET A 29 14.529 4.518 -9.596 1.00 25.00 H new ATOM 0 HE1 MET A 29 14.703 5.588 -13.224 1.00 25.00 H new ATOM 0 HE2 MET A 29 13.707 5.161 -11.812 1.00 25.00 H new ATOM 0 HE3 MET A 29 14.249 6.840 -12.044 1.00 25.00 H new ATOM 415 N TYR A 30 12.953 4.109 -7.384 1.00 25.00 N ATOM 416 CA TYR A 30 12.035 2.983 -7.473 1.00 25.00 C ATOM 417 C TYR A 30 10.672 3.314 -6.847 1.00 25.00 C ATOM 418 O TYR A 30 9.635 3.262 -7.506 1.00 25.00 O ATOM 419 CB TYR A 30 12.603 1.673 -6.774 1.00 25.00 C ATOM 420 CG TYR A 30 11.620 0.501 -6.726 1.00 25.00 C ATOM 421 CD1 TYR A 30 11.084 -0.008 -7.979 1.00 50.00 C ATOM 422 CD2 TYR A 30 11.210 -0.095 -5.546 1.00 50.00 C ATOM 423 CE1 TYR A 30 10.152 -1.110 -7.954 1.00 25.00 C ATOM 424 CE2 TYR A 30 10.304 -1.189 -5.505 1.00 25.00 C ATOM 425 CZ TYR A 30 9.801 -1.690 -6.716 1.00 25.00 C ATOM 426 OH TYR A 30 8.858 -2.706 -6.645 1.00 25.00 O ATOM 0 H TYR A 30 13.818 3.894 -6.889 1.00 25.00 H new ATOM 0 HA TYR A 30 11.917 2.789 -8.539 1.00 25.00 H new ATOM 0 HB2 TYR A 30 13.502 1.355 -7.303 1.00 25.00 H new ATOM 0 HB3 TYR A 30 12.903 1.921 -5.756 1.00 25.00 H new ATOM 0 HD1 TYR A 30 11.380 0.434 -8.919 1.00 50.00 H new ATOM 0 HD2 TYR A 30 11.596 0.289 -4.613 1.00 50.00 H new ATOM 0 HE1 TYR A 30 9.728 -1.487 -8.873 1.00 25.00 H new ATOM 0 HE2 TYR A 30 10.009 -1.626 -4.562 1.00 25.00 H new ATOM 0 HH TYR A 30 8.745 -2.983 -5.712 1.00 25.00 H new ATOM 436 N GLU A 31 10.618 3.770 -5.602 1.00 25.00 N ATOM 437 CA GLU A 31 9.420 4.238 -4.932 1.00 25.00 C ATOM 438 C GLU A 31 9.589 5.521 -4.050 1.00 25.00 C ATOM 439 O GLU A 31 9.501 5.426 -2.798 1.00 25.00 O ATOM 440 CB GLU A 31 8.839 3.052 -4.165 1.00 25.00 C ATOM 441 CG GLU A 31 9.759 2.303 -3.148 1.00 25.00 C ATOM 442 CD GLU A 31 9.003 1.317 -2.292 1.00 25.00 C ATOM 443 OE1 GLU A 31 9.436 1.261 -1.070 1.00 25.00 O ATOM 444 OE2 GLU A 31 8.063 0.558 -2.696 1.00 25.00 O1- ATOM 0 H GLU A 31 11.446 3.824 -5.009 1.00 25.00 H new ATOM 0 HA GLU A 31 8.723 4.591 -5.692 1.00 25.00 H new ATOM 0 HB2 GLU A 31 7.962 3.405 -3.622 1.00 25.00 H new ATOM 0 HB3 GLU A 31 8.489 2.323 -4.896 1.00 25.00 H new ATOM 0 HG2 GLU A 31 10.543 1.778 -3.693 1.00 25.00 H new ATOM 0 HG3 GLU A 31 10.252 3.032 -2.505 1.00 25.00 H new ATOM 451 N PRO A 32 9.853 6.687 -4.687 1.00 25.00 N ATOM 452 CA PRO A 32 10.057 7.976 -4.011 1.00 25.00 C ATOM 453 C PRO A 32 8.900 8.528 -3.209 1.00 25.00 C ATOM 454 O PRO A 32 9.031 9.470 -2.467 1.00 25.00 O ATOM 455 CB PRO A 32 10.342 8.924 -5.146 1.00 25.00 C ATOM 456 CG PRO A 32 9.711 8.399 -6.298 1.00 25.00 C ATOM 457 CD PRO A 32 9.946 6.848 -6.150 1.00 25.00 C ATOM 0 HA PRO A 32 10.839 7.847 -3.263 1.00 25.00 H new ATOM 0 HB2 PRO A 32 9.962 9.920 -4.920 1.00 25.00 H new ATOM 0 HB3 PRO A 32 11.416 9.021 -5.306 1.00 25.00 H new ATOM 0 HG2 PRO A 32 8.650 8.646 -6.326 1.00 25.00 H new ATOM 0 HG3 PRO A 32 10.153 8.789 -7.215 1.00 25.00 H new ATOM 0 HD2 PRO A 32 9.192 6.265 -6.678 1.00 25.00 H new ATOM 0 HD3 PRO A 32 10.917 6.539 -6.538 1.00 25.00 H new ATOM 465 N GLN A 33 7.749 7.918 -3.386 1.00 25.00 N ATOM 466 CA GLN A 33 6.539 8.328 -2.661 1.00 25.00 C ATOM 467 C GLN A 33 6.241 7.496 -1.421 1.00 25.00 C ATOM 468 O GLN A 33 5.325 7.736 -0.752 1.00 25.00 O ATOM 469 CB GLN A 33 5.311 8.338 -3.552 1.00 25.00 C ATOM 470 CG GLN A 33 4.801 6.905 -4.045 1.00 25.00 C ATOM 471 CD GLN A 33 5.764 6.130 -4.880 1.00 25.00 C ATOM 472 OE1 GLN A 33 6.570 5.368 -4.378 1.00 25.00 O ATOM 473 NE2 GLN A 33 5.666 6.247 -6.153 1.00 25.00 N ATOM 0 H GLN A 33 7.612 7.134 -4.024 1.00 25.00 H new ATOM 0 HA GLN A 33 6.764 9.342 -2.331 1.00 25.00 H new ATOM 0 HB2 GLN A 33 4.499 8.827 -3.015 1.00 25.00 H new ATOM 0 HB3 GLN A 33 5.526 8.948 -4.429 1.00 25.00 H new ATOM 0 HG2 GLN A 33 4.546 6.309 -3.169 1.00 25.00 H new ATOM 0 HG3 GLN A 33 3.882 7.043 -4.615 1.00 25.00 H new ATOM 0 HE21 GLN A 33 4.985 6.891 -6.555 1.00 25.00 H new ATOM 0 HE22 GLN A 33 6.269 5.696 -6.764 1.00 25.00 H new ATOM 482 N SER A 34 6.964 6.417 -1.202 1.00 25.00 N ATOM 483 CA SER A 34 6.776 5.604 -0.036 1.00 25.00 C ATOM 484 C SER A 34 7.205 6.152 1.354 1.00 25.00 C ATOM 485 O SER A 34 7.875 5.477 2.154 1.00 25.00 O ATOM 486 CB SER A 34 7.419 4.226 -0.242 1.00 25.00 C ATOM 487 OG SER A 34 6.850 3.310 0.681 1.00 25.00 O ATOM 0 H SER A 34 7.695 6.086 -1.831 1.00 25.00 H new ATOM 0 HA SER A 34 5.689 5.576 0.034 1.00 25.00 H new ATOM 0 HB2 SER A 34 7.255 3.883 -1.263 1.00 25.00 H new ATOM 0 HB3 SER A 34 8.497 4.288 -0.096 1.00 25.00 H new ATOM 0 HG SER A 34 7.080 3.581 1.594 1.00 25.00 H new ATOM 493 N LEU A 35 6.738 7.355 1.632 1.00 25.00 N ATOM 494 CA LEU A 35 7.034 7.985 2.909 1.00 25.00 C ATOM 495 C LEU A 35 5.831 7.824 3.768 1.00 25.00 C ATOM 496 O LEU A 35 4.747 7.976 3.268 1.00 25.00 O ATOM 497 CB LEU A 35 7.446 9.444 2.662 1.00 25.00 C ATOM 498 CG LEU A 35 8.751 9.718 1.862 1.00 25.00 C ATOM 499 CD1 LEU A 35 9.002 11.218 1.717 1.00 50.00 C ATOM 500 CD2 LEU A 35 9.991 9.155 2.580 1.00 50.00 C ATOM 0 H LEU A 35 6.160 7.911 1.002 1.00 25.00 H new ATOM 0 HA LEU A 35 7.874 7.524 3.429 1.00 25.00 H new ATOM 0 HB2 LEU A 35 6.626 9.937 2.139 1.00 25.00 H new ATOM 0 HB3 LEU A 35 7.543 9.931 3.633 1.00 25.00 H new ATOM 0 HG LEU A 35 8.608 9.237 0.894 1.00 25.00 H new ATOM 0 HD11 LEU A 35 9.921 11.380 1.154 1.00 50.00 H new ATOM 0 HD12 LEU A 35 8.166 11.677 1.189 1.00 50.00 H new ATOM 0 HD13 LEU A 35 9.098 11.668 2.705 1.00 50.00 H new ATOM 0 HD21 LEU A 35 10.882 9.367 1.989 1.00 50.00 H new ATOM 0 HD22 LEU A 35 10.087 9.621 3.560 1.00 50.00 H new ATOM 0 HD23 LEU A 35 9.884 8.077 2.700 1.00 50.00 H new ATOM 512 N GLU A 36 5.946 7.397 5.039 1.00 25.00 N ATOM 513 CA GLU A 36 4.823 7.279 5.932 1.00 25.00 C ATOM 514 C GLU A 36 5.009 8.163 7.138 1.00 25.00 C ATOM 515 O GLU A 36 6.136 8.605 7.437 1.00 25.00 O ATOM 516 CB GLU A 36 4.673 5.842 6.414 1.00 25.00 C ATOM 517 CG GLU A 36 4.433 4.816 5.326 1.00 25.00 C ATOM 518 CD GLU A 36 4.206 3.445 5.969 1.00 25.00 C ATOM 519 OE1 GLU A 36 3.118 2.771 5.713 1.00 25.00 O ATOM 520 OE2 GLU A 36 5.060 2.979 6.766 1.00 25.00 O1- ATOM 0 H GLU A 36 6.835 7.127 5.460 1.00 25.00 H new ATOM 0 HA GLU A 36 3.932 7.583 5.383 1.00 25.00 H new ATOM 0 HB2 GLU A 36 5.574 5.564 6.961 1.00 25.00 H new ATOM 0 HB3 GLU A 36 3.845 5.798 7.121 1.00 25.00 H new ATOM 0 HG2 GLU A 36 3.567 5.098 4.728 1.00 25.00 H new ATOM 0 HG3 GLU A 36 5.288 4.777 4.651 1.00 25.00 H new ATOM 527 N ALA A 37 3.908 8.427 7.831 1.00 25.00 N ATOM 528 CA ALA A 37 3.970 8.918 9.194 1.00 25.00 C ATOM 529 C ALA A 37 2.885 8.186 10.024 1.00 25.00 C ATOM 530 O ALA A 37 1.810 7.956 9.423 1.00 25.00 O ATOM 531 CB ALA A 37 3.839 10.461 9.324 1.00 25.00 C ATOM 0 H ALA A 37 2.963 8.308 7.467 1.00 25.00 H new ATOM 0 HA ALA A 37 4.966 8.699 9.580 1.00 25.00 H new ATOM 0 HB1 ALA A 37 3.896 10.744 10.375 1.00 25.00 H new ATOM 0 HB2 ALA A 37 4.648 10.942 8.775 1.00 25.00 H new ATOM 0 HB3 ALA A 37 2.881 10.781 8.913 1.00 25.00 H new ATOM 537 N LYS A 38 3.073 7.865 11.308 1.00 25.00 N ATOM 538 CA LYS A 38 2.065 7.297 12.186 1.00 25.00 C ATOM 539 C LYS A 38 1.635 8.238 13.299 1.00 25.00 C ATOM 540 O LYS A 38 2.424 8.863 13.952 1.00 25.00 O ATOM 541 CB LYS A 38 2.688 6.129 12.818 1.00 25.00 C ATOM 542 CG LYS A 38 1.697 5.050 13.379 1.00 25.00 C ATOM 543 CD LYS A 38 2.494 3.928 14.082 1.00 25.00 C ATOM 544 CE LYS A 38 1.664 2.835 14.655 1.00 25.00 C ATOM 545 NZ LYS A 38 2.516 1.764 15.371 1.00 25.00 N1+ ATOM 0 H LYS A 38 3.969 8.002 11.775 1.00 25.00 H new ATOM 0 HA LYS A 38 1.179 7.070 11.593 1.00 25.00 H new ATOM 0 HB2 LYS A 38 3.343 5.651 12.090 1.00 25.00 H new ATOM 0 HB3 LYS A 38 3.320 6.475 13.636 1.00 25.00 H new ATOM 0 HG2 LYS A 38 1.002 5.510 14.081 1.00 25.00 H new ATOM 0 HG3 LYS A 38 1.101 4.633 12.568 1.00 25.00 H new ATOM 0 HD2 LYS A 38 3.194 3.496 13.366 1.00 25.00 H new ATOM 0 HD3 LYS A 38 3.088 4.371 14.881 1.00 25.00 H new ATOM 0 HE2 LYS A 38 0.948 3.257 15.360 1.00 25.00 H new ATOM 0 HE3 LYS A 38 1.087 2.364 13.859 1.00 25.00 H new ATOM 0 HZ1 LYS A 38 1.894 1.024 15.753 1.00 25.00 H new ATOM 0 HZ2 LYS A 38 3.182 1.340 14.694 1.00 25.00 H new ATOM 0 HZ3 LYS A 38 3.047 2.206 16.149 1.00 25.00 H new ATOM 559 N LYS A 39 0.386 8.252 13.671 1.00 25.00 N ATOM 560 CA LYS A 39 -0.065 9.171 14.746 1.00 25.00 C ATOM 561 C LYS A 39 0.417 8.510 16.043 1.00 25.00 C ATOM 562 O LYS A 39 0.563 7.286 16.133 1.00 25.00 O ATOM 563 CB LYS A 39 -1.601 9.286 14.898 1.00 25.00 C ATOM 564 CG LYS A 39 -2.264 10.131 13.836 1.00 25.00 C ATOM 565 CD LYS A 39 -3.728 10.195 14.035 1.00 25.00 C ATOM 566 CE LYS A 39 -4.442 11.119 13.003 1.00 25.00 C ATOM 567 NZ LYS A 39 -4.418 10.652 11.595 1.00 25.00 N1+ ATOM 0 H LYS A 39 -0.344 7.662 13.273 1.00 25.00 H new ATOM 0 HA LYS A 39 0.317 10.167 14.522 1.00 25.00 H new ATOM 0 HB2 LYS A 39 -2.034 8.286 14.874 1.00 25.00 H new ATOM 0 HB3 LYS A 39 -1.828 9.708 15.877 1.00 25.00 H new ATOM 0 HG2 LYS A 39 -1.848 11.138 13.858 1.00 25.00 H new ATOM 0 HG3 LYS A 39 -2.047 9.717 12.851 1.00 25.00 H new ATOM 0 HD2 LYS A 39 -4.143 9.190 13.963 1.00 25.00 H new ATOM 0 HD3 LYS A 39 -3.937 10.555 15.042 1.00 25.00 H new ATOM 0 HE2 LYS A 39 -5.481 11.239 13.309 1.00 25.00 H new ATOM 0 HE3 LYS A 39 -3.981 12.106 13.047 1.00 25.00 H new ATOM 0 HZ1 LYS A 39 -4.919 11.337 10.994 1.00 25.00 H new ATOM 0 HZ2 LYS A 39 -3.432 10.566 11.275 1.00 25.00 H new ATOM 0 HZ3 LYS A 39 -4.886 9.726 11.528 1.00 25.00 H new ATOM 581 N GLY A 40 0.705 9.322 17.050 1.00 25.00 N ATOM 582 CA GLY A 40 1.073 8.743 18.334 1.00 25.00 C ATOM 583 C GLY A 40 1.557 9.909 19.208 1.00 25.00 C ATOM 584 O GLY A 40 2.178 10.861 18.741 1.00 25.00 O ATOM 0 H GLY A 40 0.693 10.341 17.010 1.00 25.00 H new ATOM 0 HA2 GLY A 40 0.221 8.240 18.793 1.00 25.00 H new ATOM 0 HA3 GLY A 40 1.857 7.996 18.213 1.00 25.00 H new ATOM 588 N PHE A 41 1.333 9.773 20.504 1.00 25.00 N ATOM 589 CA PHE A 41 1.522 10.880 21.419 1.00 25.00 C ATOM 590 C PHE A 41 2.296 10.436 22.706 1.00 25.00 C ATOM 591 O PHE A 41 2.090 9.287 23.145 1.00 25.00 O ATOM 592 CB PHE A 41 0.186 11.494 21.788 1.00 25.00 C ATOM 593 CG PHE A 41 -0.496 12.184 20.590 1.00 25.00 C ATOM 594 CD1 PHE A 41 -1.563 11.492 19.911 1.00 25.00 C ATOM 595 CD2 PHE A 41 -0.039 13.405 20.039 1.00 25.00 C ATOM 596 CE1 PHE A 41 -2.121 12.018 18.696 1.00 25.00 C ATOM 597 CE2 PHE A 41 -0.706 13.972 18.854 1.00 25.00 C ATOM 598 CZ PHE A 41 -1.719 13.284 18.290 1.00 25.00 C ATOM 0 H PHE A 41 1.021 8.907 20.944 1.00 25.00 H new ATOM 0 HA PHE A 41 2.127 11.632 20.912 1.00 25.00 H new ATOM 0 HB2 PHE A 41 -0.472 10.718 22.179 1.00 25.00 H new ATOM 0 HB3 PHE A 41 0.332 12.221 22.587 1.00 25.00 H new ATOM 0 HD1 PHE A 41 -1.947 10.569 20.320 1.00 25.00 H new ATOM 0 HD2 PHE A 41 0.798 13.920 20.487 1.00 25.00 H new ATOM 0 HE1 PHE A 41 -2.831 11.447 18.116 1.00 25.00 H new ATOM 0 HE2 PHE A 41 -0.390 14.920 18.445 1.00 25.00 H new ATOM 0 HZ PHE A 41 -2.251 13.746 17.472 1.00 25.00 H new ATOM 608 N PRO A 42 3.157 11.255 23.357 1.00 25.00 N ATOM 609 CA PRO A 42 3.565 12.547 22.783 1.00 25.00 C ATOM 610 C PRO A 42 4.385 12.414 21.508 1.00 25.00 C ATOM 611 O PRO A 42 4.397 13.334 20.704 1.00 25.00 O ATOM 612 CB PRO A 42 4.318 13.207 23.894 1.00 25.00 C ATOM 613 CG PRO A 42 4.920 12.034 24.797 1.00 25.00 C ATOM 614 CD PRO A 42 3.755 10.966 24.672 1.00 25.00 C ATOM 0 HA PRO A 42 2.708 13.134 22.453 1.00 25.00 H new ATOM 0 HB2 PRO A 42 5.113 13.840 23.501 1.00 25.00 H new ATOM 0 HB3 PRO A 42 3.660 13.849 24.480 1.00 25.00 H new ATOM 0 HG2 PRO A 42 5.871 11.661 24.416 1.00 25.00 H new ATOM 0 HG3 PRO A 42 5.090 12.347 25.827 1.00 25.00 H new ATOM 0 HD2 PRO A 42 4.139 9.947 24.722 1.00 25.00 H new ATOM 0 HD3 PRO A 42 3.026 11.072 25.476 1.00 25.00 H new ATOM 622 N HIS A 43 4.962 11.214 21.300 1.00 25.00 N ATOM 623 CA HIS A 43 5.385 10.901 19.910 1.00 25.00 C ATOM 624 C HIS A 43 5.211 9.453 19.549 1.00 25.00 C ATOM 625 O HIS A 43 4.945 9.086 18.412 1.00 25.00 O ATOM 626 CB HIS A 43 6.824 11.380 19.644 1.00 25.00 C ATOM 627 CG HIS A 43 7.926 10.880 20.515 1.00 25.00 C ATOM 628 ND1 HIS A 43 8.689 9.753 20.257 1.00 25.00 N ATOM 629 CD2 HIS A 43 8.428 11.378 21.665 1.00 25.00 C ATOM 630 CE1 HIS A 43 9.604 9.630 21.179 1.00 25.00 C ATOM 631 NE2 HIS A 43 9.500 10.640 22.029 1.00 25.00 N ATOM 0 H HIS A 43 5.138 10.497 22.004 1.00 25.00 H new ATOM 0 HA HIS A 43 4.714 11.456 19.254 1.00 25.00 H new ATOM 0 HB2 HIS A 43 7.073 11.118 18.616 1.00 25.00 H new ATOM 0 HB3 HIS A 43 6.825 12.468 19.705 1.00 25.00 H new ATOM 0 HD1 HIS A 43 8.556 9.119 19.469 1.00 25.00 H new ATOM 0 HD2 HIS A 43 8.037 12.227 22.206 1.00 25.00 H new ATOM 0 HE1 HIS A 43 10.330 8.832 21.239 1.00 25.00 H new ATOM 639 N SER A 44 5.267 8.555 20.536 1.00 25.00 N ATOM 640 CA SER A 44 5.388 7.102 20.370 1.00 25.00 C ATOM 641 C SER A 44 6.536 6.694 19.455 1.00 25.00 C ATOM 642 O SER A 44 7.686 6.585 19.922 1.00 25.00 O ATOM 643 CB SER A 44 3.998 6.483 20.032 1.00 25.00 C ATOM 644 OG SER A 44 2.879 7.072 20.698 1.00 25.00 O ATOM 0 H SER A 44 5.228 8.832 21.517 1.00 25.00 H new ATOM 0 HA SER A 44 5.686 6.662 21.322 1.00 25.00 H new ATOM 0 HB2 SER A 44 3.839 6.559 18.956 1.00 25.00 H new ATOM 0 HB3 SER A 44 4.025 5.421 20.276 1.00 25.00 H new ATOM 0 HG SER A 44 2.056 6.618 20.420 1.00 25.00 H new ATOM 650 N GLY A 45 6.289 6.615 18.151 1.00 25.00 N ATOM 651 CA GLY A 45 7.284 6.326 17.134 1.00 25.00 C ATOM 652 C GLY A 45 8.197 7.531 16.957 1.00 25.00 C ATOM 653 O GLY A 45 8.069 8.531 17.677 1.00 25.00 O ATOM 0 H GLY A 45 5.356 6.756 17.764 1.00 25.00 H new ATOM 0 HA2 GLY A 45 7.869 5.452 17.421 1.00 25.00 H new ATOM 0 HA3 GLY A 45 6.795 6.086 16.190 1.00 25.00 H new ATOM 657 N PRO A 46 9.104 7.577 15.969 1.00 25.00 N ATOM 658 CA PRO A 46 9.898 8.791 15.716 1.00 25.00 C ATOM 659 C PRO A 46 9.119 10.054 15.254 1.00 25.00 C ATOM 660 O PRO A 46 8.003 9.940 14.753 1.00 25.00 O ATOM 661 CB PRO A 46 10.923 8.333 14.639 1.00 25.00 C ATOM 662 CG PRO A 46 10.208 7.283 13.867 1.00 25.00 C ATOM 663 CD PRO A 46 9.535 6.519 15.045 1.00 25.00 C ATOM 0 HA PRO A 46 10.334 9.141 16.651 1.00 25.00 H new ATOM 0 HB2 PRO A 46 11.222 9.162 13.998 1.00 25.00 H new ATOM 0 HB3 PRO A 46 11.831 7.940 15.097 1.00 25.00 H new ATOM 0 HG2 PRO A 46 9.483 7.697 13.167 1.00 25.00 H new ATOM 0 HG3 PRO A 46 10.884 6.653 13.290 1.00 25.00 H new ATOM 0 HD2 PRO A 46 8.689 5.924 14.701 1.00 25.00 H new ATOM 0 HD3 PRO A 46 10.234 5.833 15.524 1.00 25.00 H new ATOM 671 N ALA A 47 9.705 11.229 15.460 1.00 25.00 N ATOM 672 CA ALA A 47 9.011 12.488 15.168 1.00 25.00 C ATOM 673 C ALA A 47 8.820 12.764 13.674 1.00 25.00 C ATOM 674 O ALA A 47 9.721 13.253 13.042 1.00 25.00 O ATOM 675 CB ALA A 47 9.812 13.721 15.778 1.00 25.00 C ATOM 0 H ALA A 47 10.651 11.341 15.825 1.00 25.00 H new ATOM 0 HA ALA A 47 8.027 12.376 15.623 1.00 25.00 H new ATOM 0 HB1 ALA A 47 9.283 14.647 15.552 1.00 25.00 H new ATOM 0 HB2 ALA A 47 9.892 13.604 16.859 1.00 25.00 H new ATOM 0 HB3 ALA A 47 10.810 13.758 15.342 1.00 25.00 H new ATOM 681 N ASP A 48 7.688 12.350 13.084 1.00 25.00 N ATOM 682 CA ASP A 48 7.327 12.598 11.696 1.00 25.00 C ATOM 683 C ASP A 48 6.011 13.293 11.858 1.00 25.00 C ATOM 684 O ASP A 48 5.328 13.180 12.908 1.00 25.00 O ATOM 685 CB ASP A 48 7.189 11.291 10.914 1.00 25.00 C ATOM 686 CG ASP A 48 8.458 10.512 10.800 1.00 25.00 C ATOM 687 OD1 ASP A 48 9.470 11.041 10.256 1.00 25.00 O ATOM 688 OD2 ASP A 48 8.464 9.334 11.197 1.00 25.00 O1- ATOM 0 H ASP A 48 6.979 11.815 13.586 1.00 25.00 H new ATOM 0 HA ASP A 48 8.064 13.171 11.133 1.00 25.00 H new ATOM 0 HB2 ASP A 48 6.435 10.669 11.397 1.00 25.00 H new ATOM 0 HB3 ASP A 48 6.822 11.516 9.913 1.00 25.00 H new ATOM 693 N GLY A 49 5.739 14.005 10.755 1.00 25.00 N ATOM 694 CA GLY A 49 4.490 14.796 10.685 1.00 25.00 C ATOM 695 C GLY A 49 4.742 16.226 11.187 1.00 25.00 C ATOM 696 O GLY A 49 3.781 16.947 11.424 1.00 25.00 O ATOM 0 H GLY A 49 6.335 14.054 9.929 1.00 25.00 H new ATOM 0 HA2 GLY A 49 4.124 14.822 9.659 1.00 25.00 H new ATOM 0 HA3 GLY A 49 3.716 14.322 11.288 1.00 25.00 H new ATOM 700 N GLN A 50 6.015 16.576 11.351 1.00 25.00 N ATOM 701 CA GLN A 50 6.363 17.857 11.873 1.00 25.00 C ATOM 702 C GLN A 50 6.198 19.074 10.984 1.00 25.00 C ATOM 703 O GLN A 50 6.029 20.207 11.430 1.00 25.00 O ATOM 704 CB GLN A 50 7.782 17.816 12.459 1.00 25.00 C ATOM 705 CG GLN A 50 7.975 16.885 13.660 1.00 25.00 C ATOM 706 CD GLN A 50 6.903 16.958 14.692 1.00 25.00 C ATOM 707 OE1 GLN A 50 6.053 16.030 14.783 1.00 25.00 O ATOM 708 NE2 GLN A 50 6.888 17.945 15.555 1.00 25.00 N ATOM 0 H GLN A 50 6.809 15.977 11.124 1.00 25.00 H new ATOM 0 HA GLN A 50 5.601 18.020 12.635 1.00 25.00 H new ATOM 0 HB2 GLN A 50 8.472 17.512 11.672 1.00 25.00 H new ATOM 0 HB3 GLN A 50 8.062 18.826 12.756 1.00 25.00 H new ATOM 0 HG2 GLN A 50 8.041 15.859 13.298 1.00 25.00 H new ATOM 0 HG3 GLN A 50 8.929 17.119 14.132 1.00 25.00 H new ATOM 0 HE21 GLN A 50 7.574 18.696 15.483 1.00 25.00 H new ATOM 0 HE22 GLN A 50 6.190 17.962 16.298 1.00 25.00 H new ATOM 717 N ILE A 51 6.201 18.799 9.685 1.00 25.00 N ATOM 718 CA ILE A 51 5.981 19.828 8.651 1.00 25.00 C ATOM 719 C ILE A 51 4.474 19.971 8.417 1.00 25.00 C ATOM 720 O ILE A 51 3.954 21.036 8.421 1.00 25.00 O ATOM 721 CB ILE A 51 6.707 19.458 7.375 1.00 25.00 C ATOM 722 CG1 ILE A 51 8.206 19.378 7.648 1.00 25.00 C ATOM 723 CG2 ILE A 51 6.378 20.375 6.207 1.00 25.00 C ATOM 724 CD1 ILE A 51 8.954 20.700 8.043 1.00 25.00 C ATOM 0 H ILE A 51 6.355 17.863 9.310 1.00 25.00 H new ATOM 0 HA ILE A 51 6.382 20.786 8.984 1.00 25.00 H new ATOM 0 HB ILE A 51 6.353 18.476 7.061 1.00 25.00 H new ATOM 0 HG12 ILE A 51 8.362 18.654 8.448 1.00 25.00 H new ATOM 0 HG13 ILE A 51 8.687 18.976 6.756 1.00 25.00 H new ATOM 0 HG21 ILE A 51 6.932 20.054 5.325 1.00 25.00 H new ATOM 0 HG22 ILE A 51 5.309 20.331 6.000 1.00 25.00 H new ATOM 0 HG23 ILE A 51 6.657 21.398 6.458 1.00 25.00 H new ATOM 0 HD11 ILE A 51 10.010 20.486 8.205 1.00 25.00 H new ATOM 0 HD12 ILE A 51 8.851 21.430 7.240 1.00 25.00 H new ATOM 0 HD13 ILE A 51 8.521 21.104 8.958 1.00 25.00 H new ATOM 736 N ALA A 52 3.793 18.847 8.480 1.00 25.00 N ATOM 737 CA ALA A 52 2.346 18.922 8.478 1.00 25.00 C ATOM 738 C ALA A 52 1.777 19.653 9.671 1.00 25.00 C ATOM 739 O ALA A 52 0.849 20.414 9.483 1.00 25.00 O ATOM 740 CB ALA A 52 1.771 17.531 8.316 1.00 25.00 C ATOM 0 H ALA A 52 4.193 17.910 8.531 1.00 25.00 H new ATOM 0 HA ALA A 52 2.044 19.529 7.625 1.00 25.00 H new ATOM 0 HB1 ALA A 52 0.682 17.585 8.314 1.00 25.00 H new ATOM 0 HB2 ALA A 52 2.114 17.103 7.374 1.00 25.00 H new ATOM 0 HB3 ALA A 52 2.102 16.902 9.143 1.00 25.00 H new ATOM 746 N SER A 53 2.253 19.342 10.891 1.00 25.00 N ATOM 747 CA SER A 53 1.870 20.084 12.121 1.00 25.00 C ATOM 748 C SER A 53 2.451 21.471 12.156 1.00 25.00 C ATOM 749 O SER A 53 2.150 22.228 13.015 1.00 25.00 O ATOM 750 CB SER A 53 2.332 19.308 13.314 1.00 25.00 C ATOM 751 OG SER A 53 3.808 19.417 13.382 1.00 25.00 O ATOM 0 H SER A 53 2.908 18.578 11.058 1.00 25.00 H new ATOM 0 HA SER A 53 0.785 20.193 12.129 1.00 25.00 H new ATOM 0 HB2 SER A 53 1.878 19.700 14.224 1.00 25.00 H new ATOM 0 HB3 SER A 53 2.030 18.264 13.231 1.00 25.00 H new ATOM 0 HG SER A 53 4.138 18.917 14.158 1.00 25.00 H new ATOM 757 N ALA A 54 3.329 21.817 11.174 1.00 25.00 N ATOM 758 CA ALA A 54 4.046 23.078 11.211 1.00 25.00 C ATOM 759 C ALA A 54 4.793 23.651 12.414 1.00 25.00 C ATOM 760 O ALA A 54 5.085 24.863 12.514 1.00 25.00 O ATOM 761 CB ALA A 54 3.096 24.147 10.509 1.00 25.00 C ATOM 0 H ALA A 54 3.541 21.233 10.365 1.00 25.00 H new ATOM 0 HA ALA A 54 4.976 22.804 10.714 1.00 25.00 H new ATOM 0 HB1 ALA A 54 3.584 25.122 10.507 1.00 25.00 H new ATOM 0 HB2 ALA A 54 2.897 23.838 9.483 1.00 25.00 H new ATOM 0 HB3 ALA A 54 2.156 24.214 11.057 1.00 25.00 H new ATOM 767 N GLY A 55 5.185 22.724 13.279 1.00 25.00 N ATOM 768 CA GLY A 55 6.102 23.026 14.352 1.00 25.00 C ATOM 769 C GLY A 55 7.578 22.915 13.947 1.00 25.00 C ATOM 770 O GLY A 55 8.501 23.444 14.583 1.00 25.00 O ATOM 0 H GLY A 55 4.875 21.753 13.251 1.00 25.00 H new ATOM 0 HA2 GLY A 55 5.907 24.036 14.712 1.00 25.00 H new ATOM 0 HA3 GLY A 55 5.910 22.349 15.184 1.00 25.00 H new ATOM 774 N GLY A 56 7.804 22.168 12.882 1.00 25.00 N ATOM 775 CA GLY A 56 9.159 21.831 12.424 1.00 25.00 C ATOM 776 C GLY A 56 9.696 22.614 11.296 1.00 25.00 C ATOM 777 O GLY A 56 10.680 22.148 10.738 1.00 25.00 O ATOM 0 H GLY A 56 7.062 21.774 12.304 1.00 25.00 H new ATOM 0 HA2 GLY A 56 9.840 21.942 13.268 1.00 25.00 H new ATOM 0 HA3 GLY A 56 9.170 20.778 12.142 1.00 25.00 H new ATOM 781 N LEU A 57 9.163 23.750 10.915 1.00 25.00 N ATOM 782 CA LEU A 57 9.487 24.246 9.541 1.00 25.00 C ATOM 783 C LEU A 57 10.815 24.997 9.352 1.00 25.00 C ATOM 784 O LEU A 57 11.356 25.101 8.266 1.00 25.00 O ATOM 785 CB LEU A 57 8.449 25.321 9.172 1.00 25.00 C ATOM 786 CG LEU A 57 6.985 24.925 9.171 1.00 25.00 C ATOM 787 CD1 LEU A 57 6.016 26.101 8.835 1.00 50.00 C ATOM 788 CD2 LEU A 57 6.774 23.725 8.259 1.00 50.00 C ATOM 0 H LEU A 57 8.541 24.336 11.471 1.00 25.00 H new ATOM 0 HA LEU A 57 9.516 23.332 8.947 1.00 25.00 H new ATOM 0 HB2 LEU A 57 8.569 26.154 9.865 1.00 25.00 H new ATOM 0 HB3 LEU A 57 8.695 25.695 8.178 1.00 25.00 H new ATOM 0 HG LEU A 57 6.727 24.641 10.191 1.00 25.00 H new ATOM 0 HD11 LEU A 57 4.987 25.741 8.853 1.00 50.00 H new ATOM 0 HD12 LEU A 57 6.136 26.894 9.573 1.00 50.00 H new ATOM 0 HD13 LEU A 57 6.247 26.490 7.843 1.00 50.00 H new ATOM 0 HD21 LEU A 57 5.720 23.446 8.263 1.00 50.00 H new ATOM 0 HD22 LEU A 57 7.078 23.982 7.244 1.00 50.00 H new ATOM 0 HD23 LEU A 57 7.373 22.887 8.616 1.00 50.00 H new ATOM 800 N PHE A 58 11.314 25.475 10.502 1.00 25.00 N ATOM 801 CA PHE A 58 12.552 26.220 10.466 1.00 25.00 C ATOM 802 C PHE A 58 13.595 25.151 10.350 1.00 25.00 C ATOM 803 O PHE A 58 14.659 25.335 9.753 1.00 25.00 O ATOM 804 CB PHE A 58 12.832 27.053 11.751 1.00 25.00 C ATOM 805 CG PHE A 58 11.711 28.043 12.035 1.00 25.00 C ATOM 806 CD1 PHE A 58 11.040 28.073 13.275 1.00 50.00 C ATOM 807 CD2 PHE A 58 11.275 28.957 10.993 1.00 50.00 C ATOM 808 CE1 PHE A 58 9.989 28.941 13.432 1.00 25.00 C ATOM 809 CE2 PHE A 58 10.191 29.802 11.181 1.00 25.00 C ATOM 810 CZ PHE A 58 9.575 29.845 12.430 1.00 25.00 C ATOM 0 H PHE A 58 10.892 25.360 11.423 1.00 25.00 H new ATOM 0 HA PHE A 58 12.531 26.948 9.655 1.00 25.00 H new ATOM 0 HB2 PHE A 58 12.949 26.382 12.602 1.00 25.00 H new ATOM 0 HB3 PHE A 58 13.773 27.591 11.638 1.00 25.00 H new ATOM 0 HD1 PHE A 58 11.347 27.426 14.084 1.00 50.00 H new ATOM 0 HD2 PHE A 58 11.806 28.979 10.053 1.00 50.00 H new ATOM 0 HE1 PHE A 58 9.452 28.932 14.369 1.00 25.00 H new ATOM 0 HE2 PHE A 58 9.830 30.418 10.371 1.00 25.00 H new ATOM 0 HZ PHE A 58 8.791 30.561 12.629 1.00 25.00 H new ATOM 820 N GLY A 59 13.258 23.977 10.826 1.00 25.00 N ATOM 821 CA GLY A 59 14.112 22.825 10.657 1.00 25.00 C ATOM 822 C GLY A 59 13.893 22.121 9.309 1.00 25.00 C ATOM 823 O GLY A 59 14.679 21.373 8.776 1.00 25.00 O ATOM 0 H GLY A 59 12.394 23.793 11.336 1.00 25.00 H new ATOM 0 HA2 GLY A 59 15.154 23.135 10.736 1.00 25.00 H new ATOM 0 HA3 GLY A 59 13.927 22.118 11.466 1.00 25.00 H new ATOM 827 N GLY A 60 12.751 22.408 8.677 1.00 25.00 N ATOM 828 CA GLY A 60 12.434 21.906 7.369 1.00 25.00 C ATOM 829 C GLY A 60 13.393 22.480 6.279 1.00 25.00 C ATOM 830 O GLY A 60 13.662 21.812 5.242 1.00 25.00 O ATOM 0 H GLY A 60 12.025 23.002 9.077 1.00 25.00 H new ATOM 0 HA2 GLY A 60 12.497 20.818 7.372 1.00 25.00 H new ATOM 0 HA3 GLY A 60 11.405 22.165 7.120 1.00 25.00 H new ATOM 834 N ILE A 61 13.951 23.652 6.564 1.00 25.00 N ATOM 835 CA ILE A 61 14.977 24.262 5.638 1.00 25.00 C ATOM 836 C ILE A 61 16.224 23.419 5.681 1.00 25.00 C ATOM 837 O ILE A 61 16.863 23.251 4.653 1.00 25.00 O ATOM 838 CB ILE A 61 15.283 25.716 6.123 1.00 25.00 C ATOM 839 CG1 ILE A 61 14.024 26.584 5.929 1.00 25.00 C ATOM 840 CG2 ILE A 61 16.410 26.350 5.296 1.00 25.00 C ATOM 841 CD1 ILE A 61 14.002 27.792 6.725 1.00 25.00 C ATOM 0 H ILE A 61 13.739 24.206 7.394 1.00 25.00 H new ATOM 0 HA ILE A 61 14.606 24.298 4.614 1.00 25.00 H new ATOM 0 HB ILE A 61 15.582 25.667 7.170 1.00 25.00 H new ATOM 0 HG12 ILE A 61 13.944 26.856 4.876 1.00 25.00 H new ATOM 0 HG13 ILE A 61 13.145 25.987 6.172 1.00 25.00 H new ATOM 0 HG21 ILE A 61 16.601 27.361 5.656 1.00 25.00 H new ATOM 0 HG22 ILE A 61 17.316 25.752 5.396 1.00 25.00 H new ATOM 0 HG23 ILE A 61 16.115 26.388 4.247 1.00 25.00 H new ATOM 0 HD11 ILE A 61 13.082 28.342 6.527 1.00 25.00 H new ATOM 0 HD12 ILE A 61 14.048 27.532 7.782 1.00 25.00 H new ATOM 0 HD13 ILE A 61 14.859 28.414 6.466 1.00 25.00 H new ATOM 853 N LEU A 62 16.625 22.880 6.849 1.00 25.00 N ATOM 854 CA LEU A 62 17.898 22.216 6.945 1.00 25.00 C ATOM 855 C LEU A 62 17.699 20.860 6.213 1.00 25.00 C ATOM 856 O LEU A 62 18.574 20.357 5.567 1.00 25.00 O ATOM 857 CB LEU A 62 18.292 21.929 8.405 1.00 25.00 C ATOM 858 CG LEU A 62 19.174 22.997 9.130 1.00 25.00 C ATOM 859 CD1 LEU A 62 18.349 24.341 9.418 1.00 75.00 C ATOM 860 CD2 LEU A 62 19.718 22.421 10.480 1.00 75.00 C ATOM 0 H LEU A 62 16.083 22.900 7.713 1.00 25.00 H new ATOM 0 HA LEU A 62 18.685 22.838 6.518 1.00 25.00 H new ATOM 0 HB2 LEU A 62 17.377 21.798 8.982 1.00 25.00 H new ATOM 0 HB3 LEU A 62 18.824 20.978 8.431 1.00 25.00 H new ATOM 0 HG LEU A 62 20.008 23.239 8.471 1.00 25.00 H new ATOM 0 HD11 LEU A 62 18.992 25.062 9.923 1.00 75.00 H new ATOM 0 HD12 LEU A 62 18.001 24.763 8.475 1.00 75.00 H new ATOM 0 HD13 LEU A 62 17.492 24.113 10.052 1.00 75.00 H new ATOM 0 HD21 LEU A 62 20.331 23.174 10.976 1.00 75.00 H new ATOM 0 HD22 LEU A 62 18.881 22.152 11.124 1.00 75.00 H new ATOM 0 HD23 LEU A 62 20.321 21.535 10.281 1.00 75.00 H new ATOM 872 N ASP A 63 16.491 20.342 6.302 1.00 25.00 N ATOM 873 CA ASP A 63 16.198 19.117 5.628 1.00 25.00 C ATOM 874 C ASP A 63 16.171 19.160 4.105 1.00 25.00 C ATOM 875 O ASP A 63 16.570 18.182 3.411 1.00 25.00 O ATOM 876 CB ASP A 63 14.807 18.626 6.094 1.00 25.00 C ATOM 877 CG ASP A 63 14.524 17.168 5.653 1.00 25.00 C ATOM 878 OD1 ASP A 63 13.317 16.855 5.448 1.00 50.00 O ATOM 879 OD2 ASP A 63 15.373 16.279 5.561 1.00 50.00 O1- ATOM 0 H ASP A 63 15.717 20.749 6.827 1.00 25.00 H new ATOM 0 HA ASP A 63 17.025 18.457 5.891 1.00 25.00 H new ATOM 0 HB2 ASP A 63 14.744 18.694 7.180 1.00 25.00 H new ATOM 0 HB3 ASP A 63 14.037 19.283 5.689 1.00 25.00 H new ATOM 884 N GLN A 64 15.719 20.265 3.502 1.00 25.00 N ATOM 885 CA GLN A 64 15.609 20.448 2.034 1.00 25.00 C ATOM 886 C GLN A 64 16.970 20.735 1.305 1.00 25.00 C ATOM 887 O GLN A 64 17.096 21.220 0.182 1.00 25.00 O ATOM 888 CB GLN A 64 14.580 21.521 1.644 1.00 25.00 C ATOM 889 CG GLN A 64 14.902 22.888 2.061 1.00 25.00 C ATOM 890 CD GLN A 64 13.885 23.934 1.646 1.00 25.00 C ATOM 891 OE1 GLN A 64 12.652 23.807 1.845 1.00 25.00 O ATOM 892 NE2 GLN A 64 14.342 24.988 1.064 1.00 25.00 N ATOM 0 H GLN A 64 15.409 21.083 4.027 1.00 25.00 H new ATOM 0 HA GLN A 64 15.261 19.476 1.685 1.00 25.00 H new ATOM 0 HB2 GLN A 64 14.462 21.509 0.560 1.00 25.00 H new ATOM 0 HB3 GLN A 64 13.616 21.247 2.073 1.00 25.00 H new ATOM 0 HG2 GLN A 64 15.001 22.908 3.146 1.00 25.00 H new ATOM 0 HG3 GLN A 64 15.873 23.160 1.647 1.00 25.00 H new ATOM 0 HE21 GLN A 64 15.344 25.088 0.904 1.00 25.00 H new ATOM 0 HE22 GLN A 64 13.702 25.723 0.763 1.00 25.00 H new ATOM 901 N GLN A 65 18.071 20.441 2.017 1.00 25.00 N ATOM 902 CA GLN A 65 19.429 20.547 1.492 1.00 25.00 C ATOM 903 C GLN A 65 19.980 19.172 1.772 1.00 25.00 C ATOM 904 O GLN A 65 20.518 18.939 2.881 1.00 25.00 O ATOM 905 CB GLN A 65 20.284 21.683 2.116 1.00 25.00 C ATOM 906 CG GLN A 65 21.602 22.093 1.378 1.00 25.00 C ATOM 907 CD GLN A 65 22.212 23.409 1.821 1.00 25.00 C ATOM 908 OE1 GLN A 65 22.427 23.676 2.995 1.00 25.00 O ATOM 909 NE2 GLN A 65 22.522 24.266 0.871 1.00 25.00 N ATOM 0 H GLN A 65 18.035 20.120 2.984 1.00 25.00 H new ATOM 0 HA GLN A 65 19.445 20.828 0.439 1.00 25.00 H new ATOM 0 HB2 GLN A 65 19.655 22.570 2.197 1.00 25.00 H new ATOM 0 HB3 GLN A 65 20.547 21.385 3.131 1.00 25.00 H new ATOM 0 HG2 GLN A 65 22.340 21.303 1.521 1.00 25.00 H new ATOM 0 HG3 GLN A 65 21.398 22.148 0.309 1.00 25.00 H new ATOM 0 HE21 GLN A 65 22.339 24.034 -0.105 1.00 25.00 H new ATOM 0 HE22 GLN A 65 22.946 25.162 1.111 1.00 25.00 H new ATOM 918 N SER A 66 19.682 18.230 0.888 1.00 25.00 N ATOM 919 CA SER A 66 20.044 16.826 1.124 1.00 25.00 C ATOM 920 C SER A 66 19.983 16.026 -0.118 1.00 25.00 C ATOM 921 O SER A 66 19.398 16.483 -1.136 1.00 25.00 O ATOM 922 CB SER A 66 19.085 16.209 2.112 1.00 25.00 C ATOM 923 OG SER A 66 19.296 14.824 2.406 1.00 25.00 O ATOM 0 H SER A 66 19.196 18.402 0.008 1.00 25.00 H new ATOM 0 HA SER A 66 21.065 16.820 1.506 1.00 25.00 H new ATOM 0 HB2 SER A 66 19.142 16.771 3.044 1.00 25.00 H new ATOM 0 HB3 SER A 66 18.072 16.329 1.729 1.00 25.00 H new ATOM 0 HG SER A 66 18.627 14.522 3.055 1.00 25.00 H new ATOM 929 N GLU A 67 20.514 14.821 -0.211 1.00 25.00 N ATOM 930 CA GLU A 67 20.265 14.016 -1.368 1.00 25.00 C ATOM 931 C GLU A 67 18.832 13.639 -1.424 1.00 25.00 C ATOM 932 O GLU A 67 18.233 13.512 -2.451 1.00 25.00 O ATOM 933 CB GLU A 67 21.093 12.731 -1.336 1.00 25.00 C ATOM 934 CG GLU A 67 21.120 12.003 -2.644 1.00 25.00 C ATOM 935 CD GLU A 67 21.913 12.829 -3.683 1.00 25.00 C ATOM 936 OE1 GLU A 67 22.971 13.406 -3.408 1.00 25.00 O ATOM 937 OE2 GLU A 67 21.344 12.929 -4.820 1.00 25.00 O1- ATOM 0 H GLU A 67 21.111 14.392 0.496 1.00 25.00 H new ATOM 0 HA GLU A 67 20.542 14.604 -2.243 1.00 25.00 H new ATOM 0 HB2 GLU A 67 22.115 12.974 -1.044 1.00 25.00 H new ATOM 0 HB3 GLU A 67 20.691 12.069 -0.569 1.00 25.00 H new ATOM 0 HG2 GLU A 67 21.580 11.023 -2.516 1.00 25.00 H new ATOM 0 HG3 GLU A 67 20.103 11.834 -2.999 1.00 25.00 H new ATOM 944 N ASN A 68 18.265 13.550 -0.203 1.00 25.00 N ATOM 945 CA ASN A 68 16.821 13.242 -0.126 1.00 25.00 C ATOM 946 C ASN A 68 15.930 14.497 -0.330 1.00 25.00 C ATOM 947 O ASN A 68 14.722 14.440 -0.230 1.00 25.00 O ATOM 948 CB ASN A 68 16.477 12.425 1.115 1.00 25.00 C ATOM 949 CG ASN A 68 16.953 11.027 1.044 1.00 25.00 C ATOM 950 OD1 ASN A 68 16.805 10.398 0.010 1.00 25.00 O ATOM 951 ND2 ASN A 68 17.626 10.563 2.071 1.00 25.00 N ATOM 0 H ASN A 68 18.745 13.677 0.688 1.00 25.00 H new ATOM 0 HA ASN A 68 16.583 12.597 -0.972 1.00 25.00 H new ATOM 0 HB2 ASN A 68 16.913 12.906 1.991 1.00 25.00 H new ATOM 0 HB3 ASN A 68 15.396 12.427 1.255 1.00 25.00 H new ATOM 0 HD21 ASN A 68 18.053 9.638 2.025 1.00 25.00 H new ATOM 0 HD22 ASN A 68 17.722 11.128 2.915 1.00 25.00 H new ATOM 958 N ARG A 69 16.518 15.491 -0.966 1.00 25.00 N ATOM 959 CA ARG A 69 15.799 16.504 -1.640 1.00 25.00 C ATOM 960 C ARG A 69 15.225 15.951 -2.925 1.00 25.00 C ATOM 961 O ARG A 69 15.802 15.714 -3.916 1.00 25.00 O ATOM 962 CB ARG A 69 16.588 17.773 -1.919 1.00 25.00 C ATOM 963 CG ARG A 69 15.777 18.920 -2.471 1.00 25.00 C ATOM 964 CD ARG A 69 16.709 20.065 -2.932 1.00 25.00 C ATOM 965 NE ARG A 69 17.605 19.619 -4.050 1.00 25.00 N ATOM 966 CZ ARG A 69 18.523 20.268 -4.710 1.00 25.00 C ATOM 967 NH1 ARG A 69 18.697 21.563 -4.612 1.00 25.00 N1+ ATOM 968 NH2 ARG A 69 19.323 19.605 -5.544 1.00 25.00 N ATOM 0 H ARG A 69 17.531 15.601 -1.018 1.00 25.00 H new ATOM 0 HA ARG A 69 15.005 16.808 -0.958 1.00 25.00 H new ATOM 0 HB2 ARG A 69 17.065 18.097 -0.994 1.00 25.00 H new ATOM 0 HB3 ARG A 69 17.386 17.539 -2.624 1.00 25.00 H new ATOM 0 HG2 ARG A 69 15.171 18.575 -3.309 1.00 25.00 H new ATOM 0 HG3 ARG A 69 15.089 19.287 -1.710 1.00 25.00 H new ATOM 0 HD2 ARG A 69 16.110 20.915 -3.259 1.00 25.00 H new ATOM 0 HD3 ARG A 69 17.314 20.406 -2.092 1.00 25.00 H new ATOM 0 HE ARG A 69 17.475 18.650 -4.341 1.00 25.00 H new ATOM 0 HH11 ARG A 69 18.098 22.113 -3.996 1.00 25.00 H new ATOM 0 HH12 ARG A 69 19.431 22.021 -5.152 1.00 25.00 H new ATOM 0 HH21 ARG A 69 19.214 18.598 -5.662 1.00 25.00 H new ATOM 0 HH22 ARG A 69 20.044 20.105 -6.064 1.00 25.00 H new ATOM 982 N TRP A 70 13.978 15.618 -2.689 1.00 25.00 N ATOM 983 CA TRP A 70 12.908 15.406 -3.616 1.00 25.00 C ATOM 984 C TRP A 70 13.058 16.247 -4.878 1.00 25.00 C ATOM 985 O TRP A 70 13.455 17.398 -4.843 1.00 25.00 O ATOM 986 CB TRP A 70 11.640 15.670 -2.852 1.00 25.00 C ATOM 987 CG TRP A 70 11.773 16.922 -2.010 1.00 25.00 C ATOM 988 CD1 TRP A 70 11.874 18.226 -2.388 1.00 25.00 C ATOM 989 CD2 TRP A 70 11.776 16.915 -0.565 1.00 25.00 C ATOM 990 NE1 TRP A 70 11.922 19.063 -1.292 1.00 25.00 N ATOM 991 CE2 TRP A 70 11.968 18.288 -0.149 1.00 25.00 C ATOM 992 CE3 TRP A 70 11.721 15.910 0.408 1.00 25.00 C ATOM 993 CZ2 TRP A 70 12.143 18.641 1.188 1.00 25.00 C ATOM 994 CZ3 TRP A 70 11.920 16.253 1.785 1.00 25.00 C ATOM 995 CH2 TRP A 70 12.176 17.637 2.163 1.00 25.00 C ATOM 0 H TRP A 70 13.660 15.475 -1.730 1.00 25.00 H new ATOM 0 HA TRP A 70 12.905 14.385 -3.998 1.00 25.00 H new ATOM 0 HB2 TRP A 70 10.807 15.780 -3.547 1.00 25.00 H new ATOM 0 HB3 TRP A 70 11.411 14.818 -2.212 1.00 25.00 H new ATOM 0 HD1 TRP A 70 11.912 18.562 -3.414 1.00 25.00 H new ATOM 0 HE1 TRP A 70 11.923 20.083 -1.321 1.00 25.00 H new ATOM 0 HE3 TRP A 70 11.530 14.886 0.123 1.00 25.00 H new ATOM 0 HZ2 TRP A 70 12.252 19.678 1.469 1.00 25.00 H new ATOM 0 HZ3 TRP A 70 11.880 15.485 2.543 1.00 25.00 H new ATOM 0 HH2 TRP A 70 12.390 17.887 3.192 1.00 25.00 H new ATOM 1006 N PHE A 71 12.818 15.570 -5.983 1.00 25.00 N ATOM 1007 CA PHE A 71 13.080 16.108 -7.310 1.00 25.00 C ATOM 1008 C PHE A 71 12.291 17.308 -7.703 1.00 25.00 C ATOM 1009 O PHE A 71 11.148 17.587 -7.231 1.00 25.00 O ATOM 1010 CB PHE A 71 12.989 14.977 -8.346 1.00 25.00 C ATOM 1011 CG PHE A 71 11.617 14.317 -8.425 1.00 25.00 C ATOM 1012 CD1 PHE A 71 11.298 13.099 -7.771 1.00 50.00 C ATOM 1013 CD2 PHE A 71 10.597 14.983 -9.177 1.00 50.00 C ATOM 1014 CE1 PHE A 71 10.040 12.558 -7.962 1.00 25.00 C ATOM 1015 CE2 PHE A 71 9.306 14.403 -9.341 1.00 25.00 C ATOM 1016 CZ PHE A 71 9.074 13.151 -8.828 1.00 25.00 C ATOM 0 H PHE A 71 12.433 14.625 -5.989 1.00 25.00 H new ATOM 0 HA PHE A 71 14.095 16.504 -7.275 1.00 25.00 H new ATOM 0 HB2 PHE A 71 13.246 15.376 -9.327 1.00 25.00 H new ATOM 0 HB3 PHE A 71 13.733 14.217 -8.106 1.00 25.00 H new ATOM 0 HD1 PHE A 71 12.021 12.606 -7.138 1.00 50.00 H new ATOM 0 HD2 PHE A 71 10.810 15.941 -9.628 1.00 50.00 H new ATOM 0 HE1 PHE A 71 9.779 11.652 -7.435 1.00 25.00 H new ATOM 0 HE2 PHE A 71 8.524 14.938 -9.859 1.00 25.00 H new ATOM 0 HZ PHE A 71 8.168 12.619 -9.078 1.00 25.00 H new ATOM 1026 N LYS A 72 12.909 18.082 -8.581 1.00 25.00 N ATOM 1027 CA LYS A 72 12.310 19.312 -9.047 1.00 25.00 C ATOM 1028 C LYS A 72 11.712 19.151 -10.390 1.00 25.00 C ATOM 1029 O LYS A 72 12.118 18.238 -11.111 1.00 25.00 O ATOM 1030 CB LYS A 72 13.348 20.412 -8.934 1.00 25.00 C ATOM 1031 CG LYS A 72 14.025 20.645 -7.564 1.00 25.00 C ATOM 1032 CD LYS A 72 15.059 21.780 -7.563 1.00 25.00 C ATOM 1033 CE LYS A 72 14.486 23.228 -7.732 1.00 25.00 C ATOM 1034 NZ LYS A 72 13.826 23.647 -6.488 1.00 25.00 N1+ ATOM 0 H LYS A 72 13.824 17.876 -8.982 1.00 25.00 H new ATOM 0 HA LYS A 72 11.463 19.598 -8.424 1.00 25.00 H new ATOM 0 HB2 LYS A 72 14.133 20.204 -9.661 1.00 25.00 H new ATOM 0 HB3 LYS A 72 12.875 21.347 -9.234 1.00 25.00 H new ATOM 0 HG2 LYS A 72 13.256 20.867 -6.824 1.00 25.00 H new ATOM 0 HG3 LYS A 72 14.513 19.722 -7.250 1.00 25.00 H new ATOM 0 HD2 LYS A 72 15.616 21.737 -6.627 1.00 25.00 H new ATOM 0 HD3 LYS A 72 15.772 21.596 -8.367 1.00 25.00 H new ATOM 0 HE2 LYS A 72 15.290 23.921 -7.980 1.00 25.00 H new ATOM 0 HE3 LYS A 72 13.776 23.255 -8.559 1.00 25.00 H new ATOM 0 HZ1 LYS A 72 13.900 24.679 -6.386 1.00 25.00 H new ATOM 0 HZ2 LYS A 72 12.823 23.373 -6.518 1.00 25.00 H new ATOM 0 HZ3 LYS A 72 14.287 23.186 -5.678 1.00 25.00 H new ATOM 1048 N HIS A 73 10.824 20.044 -10.812 1.00 25.00 N ATOM 1049 CA HIS A 73 10.379 20.202 -12.268 1.00 25.00 C ATOM 1050 C HIS A 73 9.920 21.620 -12.512 1.00 25.00 C ATOM 1051 O HIS A 73 9.324 22.255 -11.603 1.00 25.00 O ATOM 1052 CB HIS A 73 9.304 19.164 -12.632 1.00 25.00 C ATOM 1053 CG HIS A 73 9.127 18.949 -14.084 1.00 25.00 C ATOM 1054 ND1 HIS A 73 9.979 18.265 -14.973 1.00 25.00 N ATOM 1055 CD2 HIS A 73 8.076 19.314 -14.911 1.00 25.00 C ATOM 1056 CE1 HIS A 73 9.436 18.200 -16.169 1.00 25.00 C ATOM 1057 NE2 HIS A 73 8.292 18.772 -16.161 1.00 25.00 N ATOM 0 H HIS A 73 10.366 20.702 -10.181 1.00 25.00 H new ATOM 0 HA HIS A 73 11.227 20.011 -12.926 1.00 25.00 H new ATOM 0 HB2 HIS A 73 9.562 18.213 -12.165 1.00 25.00 H new ATOM 0 HB3 HIS A 73 8.352 19.480 -12.206 1.00 25.00 H new ATOM 0 HD2 HIS A 73 7.230 19.921 -14.625 1.00 25.00 H new ATOM 0 HE1 HIS A 73 9.889 17.733 -17.031 1.00 25.00 H new ATOM 0 HE2 HIS A 73 7.646 18.820 -16.949 1.00 25.00 H new ATOM 1065 N ILE A 74 10.148 22.144 -13.727 1.00 25.00 N ATOM 1066 CA ILE A 74 9.617 23.511 -14.041 1.00 25.00 C ATOM 1067 C ILE A 74 8.123 23.337 -14.342 1.00 25.00 C ATOM 1068 O ILE A 74 7.784 22.420 -15.086 1.00 25.00 O ATOM 1069 CB ILE A 74 10.416 24.243 -15.111 1.00 25.00 C ATOM 1070 CG1 ILE A 74 11.847 24.440 -14.567 1.00 25.00 C ATOM 1071 CG2 ILE A 74 9.802 25.580 -15.471 1.00 25.00 C ATOM 1072 CD1 ILE A 74 12.864 24.767 -15.750 1.00 25.00 C ATOM 0 H ILE A 74 10.664 21.687 -14.479 1.00 25.00 H new ATOM 0 HA ILE A 74 9.735 24.182 -13.190 1.00 25.00 H new ATOM 0 HB ILE A 74 10.419 23.650 -16.026 1.00 25.00 H new ATOM 0 HG12 ILE A 74 11.856 25.252 -13.840 1.00 25.00 H new ATOM 0 HG13 ILE A 74 12.169 23.540 -14.044 1.00 25.00 H new ATOM 0 HG21 ILE A 74 10.407 26.064 -16.238 1.00 25.00 H new ATOM 0 HG22 ILE A 74 8.792 25.426 -15.850 1.00 25.00 H new ATOM 0 HG23 ILE A 74 9.765 26.214 -14.585 1.00 25.00 H new ATOM 0 HD11 ILE A 74 13.866 24.902 -15.342 1.00 25.00 H new ATOM 0 HD12 ILE A 74 12.870 23.942 -16.463 1.00 25.00 H new ATOM 0 HD13 ILE A 74 12.552 25.681 -16.256 1.00 25.00 H new ATOM 1084 N MET A 75 7.272 24.196 -13.801 1.00 25.00 N ATOM 1085 CA MET A 75 5.833 24.164 -14.128 1.00 25.00 C ATOM 1086 C MET A 75 5.333 25.594 -14.323 1.00 25.00 C ATOM 1087 O MET A 75 5.949 26.546 -13.802 1.00 25.00 O ATOM 1088 CB MET A 75 5.079 23.516 -12.998 1.00 25.00 C ATOM 1089 CG MET A 75 5.205 21.993 -13.014 1.00 25.00 C ATOM 1090 SD MET A 75 3.868 21.193 -11.935 1.00 25.00 S ATOM 1091 CE MET A 75 2.482 21.250 -13.112 1.00 25.00 C ATOM 0 H MET A 75 7.539 24.923 -13.137 1.00 25.00 H new ATOM 0 HA MET A 75 5.674 23.593 -15.043 1.00 25.00 H new ATOM 0 HB2 MET A 75 5.452 23.899 -12.048 1.00 25.00 H new ATOM 0 HB3 MET A 75 4.026 23.792 -13.061 1.00 25.00 H new ATOM 0 HG2 MET A 75 5.119 21.628 -14.037 1.00 25.00 H new ATOM 0 HG3 MET A 75 6.192 21.702 -12.653 1.00 25.00 H new ATOM 0 HE1 MET A 75 1.550 21.411 -12.570 1.00 25.00 H new ATOM 0 HE2 MET A 75 2.637 22.066 -13.817 1.00 25.00 H new ATOM 0 HE3 MET A 75 2.427 20.307 -13.655 1.00 25.00 H new ATOM 1101 N THR A 76 4.231 25.746 -15.031 1.00 25.00 N ATOM 1102 CA THR A 76 3.626 27.047 -15.356 1.00 25.00 C ATOM 1103 C THR A 76 2.253 26.940 -14.732 1.00 25.00 C ATOM 1104 O THR A 76 1.816 25.838 -14.402 1.00 25.00 O ATOM 1105 CB THR A 76 3.540 27.368 -16.788 1.00 25.00 C ATOM 1106 OG1 THR A 76 2.951 26.300 -17.523 1.00 25.00 O ATOM 1107 CG2 THR A 76 4.914 27.621 -17.403 1.00 25.00 C ATOM 0 H THR A 76 3.710 24.956 -15.411 1.00 25.00 H new ATOM 0 HA THR A 76 4.242 27.864 -14.979 1.00 25.00 H new ATOM 0 HB THR A 76 2.929 28.268 -16.850 1.00 25.00 H new ATOM 0 HG1 THR A 76 3.422 26.191 -18.376 1.00 25.00 H new ATOM 0 HG21 THR A 76 4.801 27.854 -18.462 1.00 25.00 H new ATOM 0 HG22 THR A 76 5.391 28.459 -16.895 1.00 25.00 H new ATOM 0 HG23 THR A 76 5.532 26.730 -17.292 1.00 25.00 H new ATOM 1115 N GLY A 77 1.522 28.016 -14.604 1.00 25.00 N ATOM 1116 CA GLY A 77 0.237 27.942 -13.921 1.00 25.00 C ATOM 1117 C GLY A 77 -0.868 27.547 -14.854 1.00 25.00 C ATOM 1118 O GLY A 77 -0.596 26.991 -15.958 1.00 25.00 O ATOM 0 H GLY A 77 1.778 28.940 -14.952 1.00 25.00 H new ATOM 0 HA2 GLY A 77 0.300 27.221 -13.106 1.00 25.00 H new ATOM 0 HA3 GLY A 77 0.007 28.909 -13.474 1.00 25.00 H new ATOM 1122 N GLY A 78 -2.090 27.737 -14.442 1.00 25.00 N ATOM 1123 CA GLY A 78 -3.195 27.321 -15.237 1.00 25.00 C ATOM 1124 C GLY A 78 -3.676 25.944 -14.825 1.00 25.00 C ATOM 1125 O GLY A 78 -3.254 25.434 -13.817 1.00 25.00 O ATOM 0 H GLY A 78 -2.339 28.179 -13.557 1.00 25.00 H new ATOM 0 HA2 GLY A 78 -4.009 28.039 -15.138 1.00 25.00 H new ATOM 0 HA3 GLY A 78 -2.907 27.310 -16.288 1.00 25.00 H new ATOM 1129 N GLU A 79 -4.637 25.366 -15.581 1.00 25.00 N ATOM 1130 CA GLU A 79 -5.152 24.046 -15.286 1.00 25.00 C ATOM 1131 C GLU A 79 -4.222 22.960 -15.850 1.00 25.00 C ATOM 1132 O GLU A 79 -3.693 23.003 -17.015 1.00 25.00 O ATOM 1133 CB GLU A 79 -6.519 23.798 -15.912 1.00 25.00 C ATOM 1134 CG GLU A 79 -7.620 24.796 -15.607 1.00 25.00 C ATOM 1135 CD GLU A 79 -8.948 24.345 -16.082 1.00 25.00 C ATOM 1136 OE1 GLU A 79 -9.144 24.226 -17.295 1.00 25.00 O ATOM 1137 OE2 GLU A 79 -9.858 24.118 -15.231 1.00 25.00 O1- ATOM 0 H GLU A 79 -5.060 25.809 -16.397 1.00 25.00 H new ATOM 0 HA GLU A 79 -5.223 23.999 -14.199 1.00 25.00 H new ATOM 0 HB2 GLU A 79 -6.391 23.758 -16.994 1.00 25.00 H new ATOM 0 HB3 GLU A 79 -6.861 22.813 -15.595 1.00 25.00 H new ATOM 0 HG2 GLU A 79 -7.662 24.967 -14.531 1.00 25.00 H new ATOM 0 HG3 GLU A 79 -7.378 25.752 -16.072 1.00 25.00 H new ATOM 1144 N HIS A 80 -4.126 21.934 -15.036 1.00 25.00 N ATOM 1145 CA HIS A 80 -3.317 20.779 -15.337 1.00 25.00 C ATOM 1146 C HIS A 80 -4.187 19.581 -14.888 1.00 25.00 C ATOM 1147 O HIS A 80 -4.854 19.644 -13.905 1.00 25.00 O ATOM 1148 CB HIS A 80 -2.072 20.843 -14.494 1.00 25.00 C ATOM 1149 CG HIS A 80 -1.133 21.973 -14.872 1.00 25.00 C ATOM 1150 ND1 HIS A 80 -0.130 21.894 -15.800 1.00 25.00 N ATOM 1151 CD2 HIS A 80 -1.002 23.187 -14.371 1.00 25.00 C ATOM 1152 CE1 HIS A 80 0.543 23.019 -15.863 1.00 25.00 C ATOM 1153 NE2 HIS A 80 0.012 23.829 -15.046 1.00 25.00 N ATOM 0 H HIS A 80 -4.611 21.879 -14.140 1.00 25.00 H new ATOM 0 HA HIS A 80 -3.024 20.711 -16.385 1.00 25.00 H new ATOM 0 HB2 HIS A 80 -2.358 20.956 -13.448 1.00 25.00 H new ATOM 0 HB3 HIS A 80 -1.538 19.896 -14.578 1.00 25.00 H new ATOM 0 HD2 HIS A 80 -1.590 23.606 -13.568 1.00 25.00 H new ATOM 0 HE1 HIS A 80 1.395 23.218 -16.496 1.00 25.00 H new ATOM 0 HE2 HIS A 80 0.291 24.801 -14.910 1.00 25.00 H new ATOM 1161 N THR A 81 -4.088 18.553 -15.645 1.00 25.00 N ATOM 1162 CA THR A 81 -4.688 17.300 -15.292 1.00 25.00 C ATOM 1163 C THR A 81 -3.582 16.454 -14.688 1.00 25.00 C ATOM 1164 O THR A 81 -2.516 16.319 -15.342 1.00 25.00 O ATOM 1165 CB THR A 81 -5.241 16.571 -16.555 1.00 25.00 C ATOM 1166 OG1 THR A 81 -6.070 17.453 -17.321 1.00 25.00 O ATOM 1167 CG2 THR A 81 -6.067 15.313 -16.132 1.00 25.00 C ATOM 0 H THR A 81 -3.588 18.546 -16.534 1.00 25.00 H new ATOM 0 HA THR A 81 -5.518 17.458 -14.603 1.00 25.00 H new ATOM 0 HB THR A 81 -4.396 16.258 -17.168 1.00 25.00 H new ATOM 0 HG1 THR A 81 -6.408 16.981 -18.111 1.00 25.00 H new ATOM 0 HG21 THR A 81 -6.448 14.812 -17.022 1.00 25.00 H new ATOM 0 HG22 THR A 81 -5.427 14.628 -15.576 1.00 25.00 H new ATOM 0 HG23 THR A 81 -6.902 15.621 -15.503 1.00 25.00 H new ATOM 1175 N PHE A 82 -3.734 15.911 -13.493 1.00 25.00 N ATOM 1176 CA PHE A 82 -2.720 14.999 -12.886 1.00 25.00 C ATOM 1177 C PHE A 82 -3.356 13.618 -12.858 1.00 25.00 C ATOM 1178 O PHE A 82 -4.586 13.587 -12.770 1.00 25.00 O ATOM 1179 CB PHE A 82 -2.417 15.453 -11.468 1.00 25.00 C ATOM 1180 CG PHE A 82 -1.559 16.694 -11.436 1.00 25.00 C ATOM 1181 CD1 PHE A 82 -0.161 16.529 -11.253 1.00 50.00 C ATOM 1182 CD2 PHE A 82 -2.136 17.967 -11.478 1.00 50.00 C ATOM 1183 CE1 PHE A 82 0.672 17.716 -11.036 1.00 25.00 C ATOM 1184 CE2 PHE A 82 -1.322 19.138 -11.248 1.00 25.00 C ATOM 1185 CZ PHE A 82 0.059 19.002 -11.035 1.00 25.00 C ATOM 0 H PHE A 82 -4.549 16.074 -12.902 1.00 25.00 H new ATOM 0 HA PHE A 82 -1.788 14.997 -13.452 1.00 25.00 H new ATOM 0 HB2 PHE A 82 -3.352 15.647 -10.943 1.00 25.00 H new ATOM 0 HB3 PHE A 82 -1.911 14.650 -10.932 1.00 25.00 H new ATOM 0 HD1 PHE A 82 0.282 15.544 -11.273 1.00 50.00 H new ATOM 0 HD2 PHE A 82 -3.191 18.075 -11.683 1.00 50.00 H new ATOM 0 HE1 PHE A 82 1.736 17.617 -10.879 1.00 25.00 H new ATOM 0 HE2 PHE A 82 -1.776 20.118 -11.240 1.00 25.00 H new ATOM 0 HZ PHE A 82 0.663 19.882 -10.869 1.00 25.00 H new ATOM 1195 N THR A 83 -2.589 12.557 -12.937 1.00 25.00 N ATOM 1196 CA THR A 83 -3.079 11.196 -12.697 1.00 25.00 C ATOM 1197 C THR A 83 -2.000 10.217 -12.206 1.00 25.00 C ATOM 1198 O THR A 83 -0.830 10.463 -12.499 1.00 25.00 O ATOM 1199 CB THR A 83 -3.828 10.684 -13.939 1.00 25.00 C ATOM 1200 OG1 THR A 83 -4.687 9.609 -13.597 1.00 25.00 O ATOM 1201 CG2 THR A 83 -3.003 10.201 -15.077 1.00 25.00 C ATOM 0 H THR A 83 -1.597 12.601 -13.171 1.00 25.00 H new ATOM 0 HA THR A 83 -3.780 11.249 -11.864 1.00 25.00 H new ATOM 0 HB THR A 83 -4.349 11.580 -14.277 1.00 25.00 H new ATOM 0 HG1 THR A 83 -5.156 9.297 -14.399 1.00 25.00 H new ATOM 0 HG21 THR A 83 -3.656 9.870 -15.885 1.00 25.00 H new ATOM 0 HG22 THR A 83 -2.366 11.010 -15.434 1.00 25.00 H new ATOM 0 HG23 THR A 83 -2.381 9.368 -14.748 1.00 25.00 H new ATOM 1209 N TRP A 84 -2.412 9.116 -11.580 1.00 25.00 N ATOM 1210 CA TRP A 84 -1.546 8.056 -11.026 1.00 25.00 C ATOM 1211 C TRP A 84 -2.286 6.759 -11.432 1.00 25.00 C ATOM 1212 O TRP A 84 -3.413 6.813 -11.796 1.00 25.00 O ATOM 1213 CB TRP A 84 -1.576 8.045 -9.538 1.00 25.00 C ATOM 1214 CG TRP A 84 -1.276 9.289 -8.782 1.00 25.00 C ATOM 1215 CD1 TRP A 84 -0.848 10.540 -9.237 1.00 25.00 C ATOM 1216 CD2 TRP A 84 -1.249 9.336 -7.291 1.00 25.00 C ATOM 1217 NE1 TRP A 84 -0.746 11.378 -8.154 1.00 25.00 N ATOM 1218 CE2 TRP A 84 -0.917 10.675 -6.962 1.00 25.00 C ATOM 1219 CE3 TRP A 84 -1.399 8.406 -6.244 1.00 25.00 C ATOM 1220 CZ2 TRP A 84 -0.953 11.111 -5.632 1.00 25.00 C ATOM 1221 CZ3 TRP A 84 -1.399 8.816 -4.919 1.00 25.00 C ATOM 1222 CH2 TRP A 84 -1.190 10.210 -4.616 1.00 25.00 C ATOM 0 H TRP A 84 -3.403 8.922 -11.434 1.00 25.00 H new ATOM 0 HA TRP A 84 -0.518 8.177 -11.369 1.00 25.00 H new ATOM 0 HB2 TRP A 84 -2.569 7.713 -9.236 1.00 25.00 H new ATOM 0 HB3 TRP A 84 -0.870 7.284 -9.205 1.00 25.00 H new ATOM 0 HD1 TRP A 84 -0.635 10.802 -10.263 1.00 25.00 H new ATOM 0 HE1 TRP A 84 -0.569 12.381 -8.214 1.00 25.00 H new ATOM 0 HE3 TRP A 84 -1.516 7.358 -6.476 1.00 25.00 H new ATOM 0 HZ2 TRP A 84 -0.795 12.154 -5.402 1.00 25.00 H new ATOM 0 HZ3 TRP A 84 -1.553 8.101 -4.125 1.00 25.00 H new ATOM 0 HH2 TRP A 84 -1.219 10.549 -3.591 1.00 25.00 H new ATOM 1233 N THR A 85 -1.606 5.630 -11.196 1.00 25.00 N ATOM 1234 CA THR A 85 -2.325 4.361 -10.966 1.00 25.00 C ATOM 1235 C THR A 85 -1.675 3.661 -9.771 1.00 25.00 C ATOM 1236 O THR A 85 -0.495 3.887 -9.462 1.00 25.00 O ATOM 1237 CB THR A 85 -2.348 3.358 -12.183 1.00 25.00 C ATOM 1238 OG1 THR A 85 -1.028 3.113 -12.700 1.00 25.00 O ATOM 1239 CG2 THR A 85 -3.173 3.984 -13.406 1.00 25.00 C ATOM 0 H THR A 85 -0.589 5.563 -11.159 1.00 25.00 H new ATOM 0 HA THR A 85 -3.367 4.633 -10.796 1.00 25.00 H new ATOM 0 HB THR A 85 -2.796 2.439 -11.806 1.00 25.00 H new ATOM 0 HG1 THR A 85 -0.461 2.746 -11.990 1.00 25.00 H new ATOM 0 HG21 THR A 85 -3.180 3.280 -14.238 1.00 25.00 H new ATOM 0 HG22 THR A 85 -4.197 4.183 -13.090 1.00 25.00 H new ATOM 0 HG23 THR A 85 -2.704 4.916 -13.722 1.00 25.00 H new ATOM 1247 N TYR A 86 -2.446 2.823 -9.102 1.00 25.00 N ATOM 1248 CA TYR A 86 -1.946 1.897 -8.077 1.00 25.00 C ATOM 1249 C TYR A 86 -1.653 0.527 -8.734 1.00 25.00 C ATOM 1250 O TYR A 86 -2.118 0.220 -9.816 1.00 25.00 O ATOM 1251 CB TYR A 86 -2.952 1.666 -6.976 1.00 25.00 C ATOM 1252 CG TYR A 86 -3.037 2.801 -5.981 1.00 25.00 C ATOM 1253 CD1 TYR A 86 -3.486 4.111 -6.341 1.00 50.00 C ATOM 1254 CD2 TYR A 86 -2.610 2.550 -4.639 1.00 50.00 C ATOM 1255 CE1 TYR A 86 -3.480 5.141 -5.404 1.00 25.00 C ATOM 1256 CE2 TYR A 86 -2.615 3.594 -3.671 1.00 25.00 C ATOM 1257 CZ TYR A 86 -2.977 4.895 -4.132 1.00 25.00 C ATOM 1258 OH TYR A 86 -2.826 5.820 -3.207 1.00 25.00 O ATOM 0 H TYR A 86 -3.453 2.758 -9.251 1.00 25.00 H new ATOM 0 HA TYR A 86 -1.050 2.344 -7.647 1.00 25.00 H new ATOM 0 HB2 TYR A 86 -3.935 1.511 -7.421 1.00 25.00 H new ATOM 0 HB3 TYR A 86 -2.693 0.749 -6.446 1.00 25.00 H new ATOM 0 HD1 TYR A 86 -3.832 4.302 -7.346 1.00 50.00 H new ATOM 0 HD2 TYR A 86 -2.281 1.560 -4.358 1.00 50.00 H new ATOM 0 HE1 TYR A 86 -3.861 6.118 -5.662 1.00 25.00 H new ATOM 0 HE2 TYR A 86 -2.357 3.410 -2.638 1.00 25.00 H new ATOM 0 HH TYR A 86 -3.659 6.328 -3.113 1.00 25.00 H new ATOM 1268 N THR A 87 -0.718 -0.266 -8.134 1.00 25.00 N ATOM 1269 CA THR A 87 -0.474 -1.636 -8.595 1.00 25.00 C ATOM 1270 C THR A 87 -1.426 -2.610 -7.967 1.00 25.00 C ATOM 1271 O THR A 87 -1.801 -3.533 -8.585 1.00 25.00 O ATOM 1272 CB THR A 87 0.986 -2.151 -8.239 1.00 25.00 C ATOM 1273 OG1 THR A 87 1.115 -2.259 -6.802 1.00 25.00 O ATOM 1274 CG2 THR A 87 2.022 -1.232 -8.819 1.00 25.00 C ATOM 0 H THR A 87 -0.139 0.026 -7.347 1.00 25.00 H new ATOM 0 HA THR A 87 -0.607 -1.592 -9.676 1.00 25.00 H new ATOM 0 HB THR A 87 1.146 -3.136 -8.677 1.00 25.00 H new ATOM 0 HG1 THR A 87 2.014 -2.578 -6.577 1.00 25.00 H new ATOM 0 HG21 THR A 87 3.017 -1.599 -8.566 1.00 25.00 H new ATOM 0 HG22 THR A 87 1.913 -1.198 -9.903 1.00 25.00 H new ATOM 0 HG23 THR A 87 1.890 -0.230 -8.410 1.00 25.00 H new ATOM 1282 N ALA A 88 -1.919 -2.308 -6.797 1.00 25.00 N ATOM 1283 CA ALA A 88 -2.940 -3.041 -6.052 1.00 25.00 C ATOM 1284 C ALA A 88 -3.546 -1.981 -5.216 1.00 25.00 C ATOM 1285 O ALA A 88 -2.773 -1.124 -4.789 1.00 25.00 O ATOM 1286 CB ALA A 88 -2.223 -4.108 -5.197 1.00 25.00 C ATOM 0 H ALA A 88 -1.602 -1.482 -6.290 1.00 25.00 H new ATOM 0 HA ALA A 88 -3.685 -3.562 -6.654 1.00 25.00 H new ATOM 0 HB1 ALA A 88 -2.960 -4.674 -4.627 1.00 25.00 H new ATOM 0 HB2 ALA A 88 -1.670 -4.785 -5.848 1.00 25.00 H new ATOM 0 HB3 ALA A 88 -1.531 -3.620 -4.511 1.00 25.00 H new ATOM 1292 N PRO A 89 -4.899 -1.964 -4.983 1.00 25.00 N ATOM 1293 CA PRO A 89 -5.496 -0.799 -4.324 1.00 25.00 C ATOM 1294 C PRO A 89 -5.235 -0.740 -2.846 1.00 25.00 C ATOM 1295 O PRO A 89 -4.775 -1.699 -2.187 1.00 25.00 O ATOM 1296 CB PRO A 89 -7.001 -1.044 -4.476 1.00 25.00 C ATOM 1297 CG PRO A 89 -7.150 -2.471 -4.593 1.00 25.00 C ATOM 1298 CD PRO A 89 -5.985 -2.845 -5.439 1.00 25.00 C ATOM 0 HA PRO A 89 -5.095 0.116 -4.759 1.00 25.00 H new ATOM 0 HB2 PRO A 89 -7.549 -0.662 -3.615 1.00 25.00 H new ATOM 0 HB3 PRO A 89 -7.394 -0.535 -5.356 1.00 25.00 H new ATOM 0 HG2 PRO A 89 -7.121 -2.964 -3.621 1.00 25.00 H new ATOM 0 HG3 PRO A 89 -8.096 -2.744 -5.061 1.00 25.00 H new ATOM 0 HD2 PRO A 89 -5.723 -3.895 -5.312 1.00 25.00 H new ATOM 0 HD3 PRO A 89 -6.199 -2.696 -6.497 1.00 25.00 H new ATOM 1306 N HIS A 90 -5.456 0.480 -2.322 1.00 25.00 N ATOM 1307 CA HIS A 90 -5.418 0.716 -0.901 1.00 25.00 C ATOM 1308 C HIS A 90 -6.771 1.145 -0.513 1.00 25.00 C ATOM 1309 O HIS A 90 -7.561 1.684 -1.289 1.00 25.00 O ATOM 1310 CB HIS A 90 -4.359 1.753 -0.510 1.00 0.00 C ATOM 1311 CG HIS A 90 -2.967 1.200 -0.437 1.00 0.00 C ATOM 1312 ND1 HIS A 90 -2.570 -0.012 -0.980 1.00 0.00 N ATOM 1313 CD2 HIS A 90 -1.788 1.659 0.128 1.00 0.00 C ATOM 1314 CE1 HIS A 90 -1.268 -0.224 -0.693 1.00 0.00 C ATOM 1315 NE2 HIS A 90 -0.748 0.761 -0.030 1.00 0.00 N ATOM 0 H HIS A 90 -5.662 1.309 -2.880 1.00 25.00 H new ATOM 0 HA HIS A 90 -5.130 -0.193 -0.373 1.00 25.00 H new ATOM 0 HB2 HIS A 90 -4.378 2.568 -1.233 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -4.622 2.179 0.458 1.00 0.00 H new ATOM 0 HD1 HIS A 90 -3.168 -0.644 -1.513 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -1.692 2.609 0.634 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -0.723 -1.111 -0.982 1.00 0.00 H new ATOM 1323 N ASN A 91 -7.084 0.761 0.717 1.00 25.00 N ATOM 1324 CA ASN A 91 -8.422 1.078 1.325 1.00 25.00 C ATOM 1325 C ASN A 91 -8.389 2.503 1.865 1.00 25.00 C ATOM 1326 O ASN A 91 -7.773 2.790 2.875 1.00 25.00 O ATOM 1327 CB ASN A 91 -8.705 0.135 2.492 1.00 25.00 C ATOM 1328 CG ASN A 91 -9.013 -1.277 2.005 1.00 25.00 C ATOM 1329 OD1 ASN A 91 -9.644 -1.553 1.005 1.00 25.00 O ATOM 1330 ND2 ASN A 91 -8.525 -2.187 2.768 1.00 25.00 N ATOM 0 H ASN A 91 -6.457 0.236 1.327 1.00 25.00 H new ATOM 0 HA ASN A 91 -9.195 0.965 0.565 1.00 25.00 H new ATOM 0 HB2 ASN A 91 -7.844 0.111 3.160 1.00 25.00 H new ATOM 0 HB3 ASN A 91 -9.547 0.513 3.071 1.00 25.00 H new ATOM 0 HD21 ASN A 91 -8.663 -3.172 2.540 1.00 25.00 H new ATOM 0 HD22 ASN A 91 -7.999 -1.925 3.602 1.00 25.00 H new ATOM 1337 N THR A 92 -8.897 3.465 1.068 1.00 25.00 N ATOM 1338 CA THR A 92 -8.778 4.835 1.319 1.00 25.00 C ATOM 1339 C THR A 92 -9.780 5.428 2.241 1.00 25.00 C ATOM 1340 O THR A 92 -10.957 5.250 2.065 1.00 25.00 O ATOM 1341 CB THR A 92 -8.945 5.544 -0.077 1.00 25.00 C ATOM 1342 OG1 THR A 92 -7.942 5.025 -0.943 1.00 25.00 O ATOM 1343 CG2 THR A 92 -8.740 7.016 0.001 1.00 25.00 C ATOM 0 H THR A 92 -9.412 3.256 0.213 1.00 25.00 H new ATOM 0 HA THR A 92 -7.817 4.980 1.813 1.00 25.00 H new ATOM 0 HB THR A 92 -9.959 5.358 -0.430 1.00 25.00 H new ATOM 0 HG1 THR A 92 -8.116 5.323 -1.860 1.00 25.00 H new ATOM 0 HG21 THR A 92 -8.867 7.454 -0.989 1.00 25.00 H new ATOM 0 HG22 THR A 92 -9.469 7.449 0.686 1.00 25.00 H new ATOM 0 HG23 THR A 92 -7.733 7.224 0.364 1.00 25.00 H new ATOM 1351 N SER A 93 -9.339 6.144 3.278 1.00 25.00 N ATOM 1352 CA SER A 93 -10.327 6.823 4.127 1.00 25.00 C ATOM 1353 C SER A 93 -10.644 8.197 3.576 1.00 25.00 C ATOM 1354 O SER A 93 -11.781 8.641 3.545 1.00 25.00 O ATOM 1355 CB SER A 93 -9.893 6.924 5.565 1.00 25.00 C ATOM 1356 OG SER A 93 -8.495 7.127 5.459 1.00 25.00 O ATOM 0 H SER A 93 -8.362 6.267 3.543 1.00 25.00 H new ATOM 0 HA SER A 93 -11.227 6.209 4.111 1.00 25.00 H new ATOM 0 HB2 SER A 93 -10.384 7.751 6.078 1.00 25.00 H new ATOM 0 HB3 SER A 93 -10.129 6.018 6.123 1.00 25.00 H new ATOM 0 HG SER A 93 -8.085 7.050 6.346 1.00 25.00 H new ATOM 1362 N GLN A 94 -9.589 8.863 3.154 1.00 25.00 N ATOM 1363 CA GLN A 94 -9.664 10.090 2.340 1.00 25.00 C ATOM 1364 C GLN A 94 -8.295 10.429 1.794 1.00 25.00 C ATOM 1365 O GLN A 94 -7.314 9.967 2.384 1.00 25.00 O ATOM 1366 CB GLN A 94 -10.195 11.261 3.218 1.00 25.00 C ATOM 1367 CG GLN A 94 -9.330 11.608 4.383 1.00 25.00 C ATOM 1368 CD GLN A 94 -10.038 12.635 5.254 1.00 25.00 C ATOM 1369 OE1 GLN A 94 -10.334 13.748 4.815 1.00 25.00 O ATOM 1370 NE2 GLN A 94 -10.326 12.199 6.456 1.00 25.00 N ATOM 0 H GLN A 94 -8.633 8.574 3.363 1.00 25.00 H new ATOM 0 HA GLN A 94 -10.345 9.931 1.504 1.00 25.00 H new ATOM 0 HB2 GLN A 94 -10.308 12.145 2.591 1.00 25.00 H new ATOM 0 HB3 GLN A 94 -11.188 11.001 3.585 1.00 25.00 H new ATOM 0 HG2 GLN A 94 -9.109 10.713 4.965 1.00 25.00 H new ATOM 0 HG3 GLN A 94 -8.377 12.006 4.036 1.00 25.00 H new ATOM 0 HE21 GLN A 94 -10.043 11.261 6.740 1.00 25.00 H new ATOM 0 HE22 GLN A 94 -10.833 12.798 7.108 1.00 25.00 H new ATOM 1379 N TRP A 95 -8.097 11.328 0.864 1.00 25.00 N ATOM 1380 CA TRP A 95 -6.744 11.872 0.608 1.00 25.00 C ATOM 1381 C TRP A 95 -6.805 13.406 0.310 1.00 25.00 C ATOM 1382 O TRP A 95 -7.903 13.992 0.110 1.00 25.00 O ATOM 1383 CB TRP A 95 -5.997 11.006 -0.428 1.00 25.00 C ATOM 1384 CG TRP A 95 -6.674 10.833 -1.751 1.00 25.00 C ATOM 1385 CD1 TRP A 95 -7.660 9.877 -2.119 1.00 25.00 C ATOM 1386 CD2 TRP A 95 -6.419 11.537 -2.979 1.00 25.00 C ATOM 1387 NE1 TRP A 95 -8.014 9.982 -3.429 1.00 25.00 N ATOM 1388 CE2 TRP A 95 -7.187 10.896 -4.028 1.00 25.00 C ATOM 1389 CE3 TRP A 95 -5.451 12.504 -3.374 1.00 25.00 C ATOM 1390 CZ2 TRP A 95 -6.991 11.201 -5.395 1.00 25.00 C ATOM 1391 CZ3 TRP A 95 -5.154 12.711 -4.724 1.00 25.00 C ATOM 1392 CH2 TRP A 95 -5.973 12.081 -5.735 1.00 25.00 C ATOM 0 H TRP A 95 -8.831 11.709 0.267 1.00 25.00 H new ATOM 0 HA TRP A 95 -6.132 11.804 1.507 1.00 25.00 H new ATOM 0 HB2 TRP A 95 -5.015 11.447 -0.600 1.00 25.00 H new ATOM 0 HB3 TRP A 95 -5.832 10.019 0.005 1.00 25.00 H new ATOM 0 HD1 TRP A 95 -8.080 9.151 -1.438 1.00 25.00 H new ATOM 0 HE1 TRP A 95 -8.767 9.468 -3.887 1.00 25.00 H new ATOM 0 HE3 TRP A 95 -4.940 13.085 -2.621 1.00 25.00 H new ATOM 0 HZ2 TRP A 95 -7.618 10.760 -6.156 1.00 25.00 H new ATOM 0 HZ3 TRP A 95 -4.320 13.336 -5.009 1.00 25.00 H new ATOM 0 HH2 TRP A 95 -5.789 12.300 -6.776 1.00 25.00 H new ATOM 1403 N HIS A 96 -5.646 14.020 0.386 1.00 25.00 N ATOM 1404 CA HIS A 96 -5.487 15.498 0.349 1.00 25.00 C ATOM 1405 C HIS A 96 -4.287 15.925 -0.473 1.00 25.00 C ATOM 1406 O HIS A 96 -3.353 15.088 -0.526 1.00 25.00 O ATOM 1407 CB HIS A 96 -5.359 16.126 1.772 1.00 25.00 C ATOM 1408 CG HIS A 96 -6.006 15.372 2.912 1.00 25.00 C ATOM 1409 ND1 HIS A 96 -7.237 15.718 3.556 1.00 25.00 N ATOM 1410 CD2 HIS A 96 -5.596 14.302 3.632 1.00 25.00 C ATOM 1411 CE1 HIS A 96 -7.511 14.855 4.478 1.00 25.00 C ATOM 1412 NE2 HIS A 96 -6.488 14.055 4.600 1.00 25.00 N ATOM 0 H HIS A 96 -4.761 13.521 0.477 1.00 25.00 H new ATOM 0 HA HIS A 96 -6.399 15.867 -0.120 1.00 25.00 H new ATOM 0 HB2 HIS A 96 -4.299 16.240 1.999 1.00 25.00 H new ATOM 0 HB3 HIS A 96 -5.788 17.128 1.741 1.00 25.00 H new ATOM 0 HD2 HIS A 96 -4.693 13.737 3.454 1.00 25.00 H new ATOM 0 HE1 HIS A 96 -8.427 14.805 5.048 1.00 25.00 H new ATOM 0 HE2 HIS A 96 -6.383 13.346 5.326 1.00 25.00 H new ATOM 1420 N TYR A 97 -4.225 17.157 -0.940 1.00 25.00 N ATOM 1421 CA TYR A 97 -3.027 17.736 -1.540 1.00 25.00 C ATOM 1422 C TYR A 97 -2.976 19.230 -1.367 1.00 25.00 C ATOM 1423 O TYR A 97 -4.056 19.848 -1.300 1.00 25.00 O ATOM 1424 CB TYR A 97 -2.925 17.365 -3.043 1.00 25.00 C ATOM 1425 CG TYR A 97 -4.238 17.208 -3.753 1.00 25.00 C ATOM 1426 CD1 TYR A 97 -5.077 16.108 -3.549 1.00 50.00 C ATOM 1427 CD2 TYR A 97 -4.619 18.120 -4.749 1.00 50.00 C ATOM 1428 CE1 TYR A 97 -6.352 16.004 -4.227 1.00 25.00 C ATOM 1429 CE2 TYR A 97 -5.910 18.030 -5.460 1.00 25.00 C ATOM 1430 CZ TYR A 97 -6.736 16.989 -5.212 1.00 25.00 C ATOM 1431 OH TYR A 97 -7.996 16.919 -5.821 1.00 25.00 O ATOM 0 H TYR A 97 -5.017 17.799 -0.915 1.00 25.00 H new ATOM 0 HA TYR A 97 -2.171 17.312 -1.015 1.00 25.00 H new ATOM 0 HB2 TYR A 97 -2.345 18.134 -3.552 1.00 25.00 H new ATOM 0 HB3 TYR A 97 -2.367 16.433 -3.134 1.00 25.00 H new ATOM 0 HD1 TYR A 97 -4.769 15.323 -2.874 1.00 50.00 H new ATOM 0 HD2 TYR A 97 -3.941 18.920 -5.006 1.00 50.00 H new ATOM 0 HE1 TYR A 97 -7.019 15.187 -3.996 1.00 25.00 H new ATOM 0 HE2 TYR A 97 -6.192 18.790 -6.173 1.00 25.00 H new ATOM 0 HH TYR A 97 -7.931 16.399 -6.649 1.00 25.00 H new ATOM 1441 N TYR A 98 -1.814 19.841 -1.182 1.00 25.00 N ATOM 1442 CA TYR A 98 -1.678 21.246 -0.844 1.00 25.00 C ATOM 1443 C TYR A 98 -0.465 21.764 -1.684 1.00 25.00 C ATOM 1444 O TYR A 98 0.292 21.005 -2.267 1.00 25.00 O ATOM 1445 CB TYR A 98 -1.240 21.375 0.640 1.00 25.00 C ATOM 1446 CG TYR A 98 -2.102 20.677 1.735 1.00 25.00 C ATOM 1447 CD1 TYR A 98 -1.895 19.303 2.104 1.00 50.00 C ATOM 1448 CD2 TYR A 98 -3.108 21.496 2.426 1.00 50.00 C ATOM 1449 CE1 TYR A 98 -2.810 18.718 3.113 1.00 25.00 C ATOM 1450 CE2 TYR A 98 -3.930 20.867 3.470 1.00 25.00 C ATOM 1451 CZ TYR A 98 -3.793 19.527 3.694 1.00 25.00 C ATOM 1452 OH TYR A 98 -4.627 19.014 4.684 1.00 25.00 O ATOM 0 H TYR A 98 -0.919 19.359 -1.266 1.00 25.00 H new ATOM 0 HA TYR A 98 -2.610 21.781 -1.024 1.00 25.00 H new ATOM 0 HB2 TYR A 98 -0.225 20.987 0.721 1.00 25.00 H new ATOM 0 HB3 TYR A 98 -1.195 22.437 0.881 1.00 25.00 H new ATOM 0 HD1 TYR A 98 -1.102 18.718 1.662 1.00 50.00 H new ATOM 0 HD2 TYR A 98 -3.240 22.537 2.172 1.00 50.00 H new ATOM 0 HE1 TYR A 98 -2.719 17.680 3.396 1.00 25.00 H new ATOM 0 HE2 TYR A 98 -4.629 21.453 4.048 1.00 25.00 H new ATOM 0 HH TYR A 98 -5.251 19.710 4.979 1.00 25.00 H new ATOM 1462 N ILE A 99 -0.287 23.075 -1.694 1.00 25.00 N ATOM 1463 CA ILE A 99 0.971 23.655 -2.095 1.00 25.00 C ATOM 1464 C ILE A 99 1.421 24.559 -0.962 1.00 25.00 C ATOM 1465 O ILE A 99 0.643 25.027 -0.087 1.00 25.00 O ATOM 1466 CB ILE A 99 0.975 24.460 -3.397 1.00 25.00 C ATOM 1467 CG1 ILE A 99 0.005 25.670 -3.320 1.00 25.00 C ATOM 1468 CG2 ILE A 99 0.565 23.567 -4.510 1.00 25.00 C ATOM 1469 CD1 ILE A 99 0.248 26.780 -4.337 1.00 25.00 C ATOM 0 H ILE A 99 -1.002 23.752 -1.428 1.00 25.00 H new ATOM 0 HA ILE A 99 1.638 22.817 -2.298 1.00 25.00 H new ATOM 0 HB ILE A 99 1.980 24.847 -3.564 1.00 25.00 H new ATOM 0 HG12 ILE A 99 -1.014 25.304 -3.446 1.00 25.00 H new ATOM 0 HG13 ILE A 99 0.068 26.099 -2.320 1.00 25.00 H new ATOM 0 HG21 ILE A 99 0.563 24.128 -5.445 1.00 25.00 H new ATOM 0 HG22 ILE A 99 1.266 22.736 -4.587 1.00 25.00 H new ATOM 0 HG23 ILE A 99 -0.436 23.181 -4.317 1.00 25.00 H new ATOM 0 HD11 ILE A 99 -0.486 27.573 -4.192 1.00 25.00 H new ATOM 0 HD12 ILE A 99 1.251 27.185 -4.201 1.00 25.00 H new ATOM 0 HD13 ILE A 99 0.153 26.377 -5.345 1.00 25.00 H new ATOM 1481 N THR A 100 2.781 24.777 -0.801 1.00 25.00 N ATOM 1482 CA THR A 100 3.268 25.685 0.171 1.00 25.00 C ATOM 1483 C THR A 100 3.155 27.018 -0.607 1.00 25.00 C ATOM 1484 O THR A 100 3.215 27.028 -1.833 1.00 25.00 O ATOM 1485 CB THR A 100 4.630 25.384 0.848 1.00 25.00 C ATOM 1486 OG1 THR A 100 5.094 26.598 1.460 1.00 25.00 O ATOM 1487 CG2 THR A 100 5.699 25.006 -0.078 1.00 25.00 C ATOM 0 H THR A 100 3.505 24.315 -1.352 1.00 25.00 H new ATOM 0 HA THR A 100 2.698 25.653 1.100 1.00 25.00 H new ATOM 0 HB THR A 100 4.444 24.555 1.531 1.00 25.00 H new ATOM 0 HG1 THR A 100 4.441 26.899 2.126 1.00 25.00 H new ATOM 0 HG21 THR A 100 6.614 24.814 0.482 1.00 25.00 H new ATOM 0 HG22 THR A 100 5.409 24.106 -0.620 1.00 25.00 H new ATOM 0 HG23 THR A 100 5.870 25.817 -0.786 1.00 25.00 H new ATOM 1495 N LYS A 101 2.799 28.059 0.122 1.00 25.00 N ATOM 1496 CA LYS A 101 2.497 29.347 -0.471 1.00 25.00 C ATOM 1497 C LYS A 101 3.792 30.080 -0.187 1.00 25.00 C ATOM 1498 O LYS A 101 4.276 30.022 0.891 1.00 25.00 O ATOM 1499 CB LYS A 101 1.318 29.940 0.246 1.00 25.00 C ATOM 1500 CG LYS A 101 0.875 31.160 -0.520 1.00 25.00 C ATOM 1501 CD LYS A 101 -0.163 31.995 0.261 1.00 25.00 C ATOM 1502 CE LYS A 101 -0.714 33.201 -0.555 1.00 25.00 C ATOM 1503 NZ LYS A 101 -1.650 32.891 -1.717 1.00 25.00 N1+ ATOM 0 H LYS A 101 2.711 28.036 1.138 1.00 25.00 H new ATOM 0 HA LYS A 101 2.224 29.357 -1.526 1.00 25.00 H new ATOM 0 HB2 LYS A 101 0.507 29.215 0.311 1.00 25.00 H new ATOM 0 HB3 LYS A 101 1.588 30.208 1.267 1.00 25.00 H new ATOM 0 HG2 LYS A 101 1.743 31.780 -0.745 1.00 25.00 H new ATOM 0 HG3 LYS A 101 0.447 30.852 -1.474 1.00 25.00 H new ATOM 0 HD2 LYS A 101 -0.993 31.352 0.553 1.00 25.00 H new ATOM 0 HD3 LYS A 101 0.293 32.363 1.180 1.00 25.00 H new ATOM 0 HE2 LYS A 101 -1.240 33.862 0.134 1.00 25.00 H new ATOM 0 HE3 LYS A 101 0.136 33.760 -0.947 1.00 25.00 H new ATOM 0 HZ1 LYS A 101 -2.237 33.725 -1.922 1.00 25.00 H new ATOM 0 HZ2 LYS A 101 -1.090 32.647 -2.558 1.00 25.00 H new ATOM 0 HZ3 LYS A 101 -2.263 32.090 -1.465 1.00 25.00 H new ATOM 1517 N LYS A 102 4.304 30.754 -1.228 1.00 25.00 N ATOM 1518 CA LYS A 102 5.701 31.185 -1.179 1.00 25.00 C ATOM 1519 C LYS A 102 5.706 32.529 -1.942 1.00 25.00 C ATOM 1520 O LYS A 102 4.851 32.780 -2.789 1.00 25.00 O ATOM 1521 CB LYS A 102 6.598 30.119 -1.869 1.00 25.00 C ATOM 1522 CG LYS A 102 6.819 28.744 -1.121 1.00 25.00 C ATOM 1523 CD LYS A 102 7.558 28.977 0.269 1.00 25.00 C ATOM 1524 CE LYS A 102 8.351 27.745 0.677 1.00 25.00 C ATOM 1525 NZ LYS A 102 9.436 28.046 1.736 1.00 25.00 N1+ ATOM 0 H LYS A 102 3.795 31.002 -2.077 1.00 25.00 H new ATOM 0 HA LYS A 102 6.091 31.300 -0.168 1.00 25.00 H new ATOM 0 HB2 LYS A 102 6.168 29.903 -2.847 1.00 25.00 H new ATOM 0 HB3 LYS A 102 7.577 30.567 -2.043 1.00 25.00 H new ATOM 0 HG2 LYS A 102 5.859 28.257 -0.952 1.00 25.00 H new ATOM 0 HG3 LYS A 102 7.410 28.074 -1.746 1.00 25.00 H new ATOM 0 HD2 LYS A 102 8.226 29.835 0.191 1.00 25.00 H new ATOM 0 HD3 LYS A 102 6.825 29.214 1.040 1.00 25.00 H new ATOM 0 HE2 LYS A 102 7.667 26.993 1.070 1.00 25.00 H new ATOM 0 HE3 LYS A 102 8.823 27.315 -0.206 1.00 25.00 H new ATOM 0 HZ1 LYS A 102 9.942 27.169 1.973 1.00 25.00 H new ATOM 0 HZ2 LYS A 102 10.109 28.742 1.356 1.00 25.00 H new ATOM 0 HZ3 LYS A 102 8.988 28.430 2.592 1.00 25.00 H new ATOM 1539 N GLY A 103 6.643 33.329 -1.534 1.00 25.00 N ATOM 1540 CA GLY A 103 6.725 34.722 -2.034 1.00 25.00 C ATOM 1541 C GLY A 103 5.837 35.646 -1.192 1.00 25.00 C ATOM 1542 O GLY A 103 5.207 36.576 -1.619 1.00 25.00 O ATOM 0 H GLY A 103 7.368 33.072 -0.864 1.00 25.00 H new ATOM 0 HA2 GLY A 103 7.758 35.068 -1.998 1.00 25.00 H new ATOM 0 HA3 GLY A 103 6.413 34.759 -3.078 1.00 25.00 H new ATOM 1546 N TRP A 104 5.841 35.326 0.084 1.00 25.00 N ATOM 1547 CA TRP A 104 4.987 35.840 1.093 1.00 25.00 C ATOM 1548 C TRP A 104 5.158 37.264 1.378 1.00 25.00 C ATOM 1549 O TRP A 104 6.220 37.903 1.108 1.00 25.00 O ATOM 1550 CB TRP A 104 5.215 35.040 2.454 1.00 25.00 C ATOM 1551 CG TRP A 104 6.657 35.065 2.782 1.00 25.00 C ATOM 1552 CD1 TRP A 104 7.421 36.107 3.079 1.00 25.00 C ATOM 1553 CD2 TRP A 104 7.502 33.912 2.883 1.00 25.00 C ATOM 1554 NE1 TRP A 104 8.667 35.719 3.509 1.00 25.00 N ATOM 1555 CE2 TRP A 104 8.812 34.363 3.338 1.00 25.00 C ATOM 1556 CE3 TRP A 104 7.299 32.530 2.780 1.00 25.00 C ATOM 1557 CZ2 TRP A 104 9.879 33.524 3.474 1.00 25.00 C ATOM 1558 CZ3 TRP A 104 8.367 31.663 2.902 1.00 25.00 C ATOM 1559 CH2 TRP A 104 9.685 32.177 3.181 1.00 25.00 C ATOM 0 H TRP A 104 6.501 34.643 0.456 1.00 25.00 H new ATOM 0 HA TRP A 104 3.979 35.711 0.699 1.00 25.00 H new ATOM 0 HB2 TRP A 104 4.636 35.492 3.260 1.00 25.00 H new ATOM 0 HB3 TRP A 104 4.869 34.012 2.351 1.00 25.00 H new ATOM 0 HD1 TRP A 104 7.103 37.135 2.993 1.00 25.00 H new ATOM 0 HE1 TRP A 104 9.376 36.342 3.896 1.00 25.00 H new ATOM 0 HE3 TRP A 104 6.306 32.142 2.605 1.00 25.00 H new ATOM 0 HZ2 TRP A 104 10.841 33.892 3.798 1.00 25.00 H new ATOM 0 HZ3 TRP A 104 8.215 30.600 2.788 1.00 25.00 H new ATOM 0 HH2 TRP A 104 10.533 31.508 3.162 1.00 25.00 H new ATOM 1570 N ASP A 105 4.178 37.987 1.947 1.00 25.00 N ATOM 1571 CA ASP A 105 4.456 39.215 2.703 1.00 25.00 C ATOM 1572 C ASP A 105 5.078 38.847 4.018 1.00 25.00 C ATOM 1573 O ASP A 105 4.572 37.960 4.715 1.00 25.00 O ATOM 1574 CB ASP A 105 3.108 39.814 3.010 1.00 25.00 C ATOM 1575 CG ASP A 105 3.221 41.215 3.591 1.00 25.00 C ATOM 1576 OD1 ASP A 105 3.813 41.344 4.673 1.00 25.00 O ATOM 1577 OD2 ASP A 105 2.618 42.180 3.051 1.00 25.00 O1- ATOM 0 H ASP A 105 3.189 37.741 1.897 1.00 25.00 H new ATOM 0 HA ASP A 105 5.112 39.886 2.149 1.00 25.00 H new ATOM 0 HB2 ASP A 105 2.511 39.847 2.099 1.00 25.00 H new ATOM 0 HB3 ASP A 105 2.579 39.172 3.714 1.00 25.00 H new ATOM 1582 N PRO A 106 6.256 39.344 4.335 1.00 25.00 N ATOM 1583 CA PRO A 106 6.881 38.749 5.517 1.00 25.00 C ATOM 1584 C PRO A 106 6.121 38.832 6.806 1.00 25.00 C ATOM 1585 O PRO A 106 6.520 38.153 7.767 1.00 25.00 O ATOM 1586 CB PRO A 106 8.124 39.600 5.686 1.00 25.00 C ATOM 1587 CG PRO A 106 8.460 40.156 4.365 1.00 25.00 C ATOM 1588 CD PRO A 106 7.161 40.401 3.739 1.00 25.00 C ATOM 0 HA PRO A 106 7.000 37.679 5.346 1.00 25.00 H new ATOM 0 HB2 PRO A 106 7.947 40.400 6.405 1.00 25.00 H new ATOM 0 HB3 PRO A 106 8.949 39.002 6.072 1.00 25.00 H new ATOM 0 HG2 PRO A 106 9.039 41.075 4.455 1.00 25.00 H new ATOM 0 HG3 PRO A 106 9.059 39.458 3.780 1.00 25.00 H new ATOM 0 HD2 PRO A 106 6.797 41.405 3.956 1.00 25.00 H new ATOM 0 HD3 PRO A 106 7.218 40.311 2.654 1.00 25.00 H new ATOM 1596 N ASP A 107 5.224 39.804 6.973 1.00 25.00 N ATOM 1597 CA ASP A 107 4.498 40.058 8.258 1.00 25.00 C ATOM 1598 C ASP A 107 3.378 39.062 8.541 1.00 25.00 C ATOM 1599 O ASP A 107 2.754 39.001 9.608 1.00 25.00 O ATOM 1600 CB ASP A 107 3.919 41.498 8.291 1.00 25.00 C ATOM 1601 CG ASP A 107 3.523 41.961 9.688 1.00 25.00 C ATOM 1602 OD1 ASP A 107 2.392 42.466 9.837 1.00 75.00 O ATOM 1603 OD2 ASP A 107 4.329 41.677 10.643 1.00 75.00 O1- ATOM 0 H ASP A 107 4.966 40.451 6.228 1.00 25.00 H new ATOM 0 HA ASP A 107 5.246 39.932 9.041 1.00 25.00 H new ATOM 0 HB2 ASP A 107 4.658 42.188 7.884 1.00 25.00 H new ATOM 0 HB3 ASP A 107 3.046 41.545 7.640 1.00 25.00 H new ATOM 1608 N LYS A 108 3.169 38.227 7.531 1.00 25.00 N ATOM 1609 CA LYS A 108 2.130 37.194 7.577 1.00 25.00 C ATOM 1610 C LYS A 108 2.290 36.248 8.811 1.00 25.00 C ATOM 1611 O LYS A 108 3.366 36.154 9.384 1.00 25.00 O ATOM 1612 CB LYS A 108 2.132 36.420 6.293 1.00 25.00 C ATOM 1613 CG LYS A 108 1.157 36.977 5.348 1.00 25.00 C ATOM 1614 CD LYS A 108 1.274 36.151 4.052 1.00 25.00 C ATOM 1615 CE LYS A 108 -0.019 36.057 3.223 1.00 25.00 C ATOM 1616 NZ LYS A 108 -0.497 37.386 2.576 1.00 25.00 N1+ ATOM 0 H LYS A 108 3.706 38.242 6.664 1.00 25.00 H new ATOM 0 HA LYS A 108 1.166 37.689 7.694 1.00 25.00 H new ATOM 0 HB2 LYS A 108 3.128 36.443 5.851 1.00 25.00 H new ATOM 0 HB3 LYS A 108 1.896 35.375 6.493 1.00 25.00 H new ATOM 0 HG2 LYS A 108 0.147 36.918 5.754 1.00 25.00 H new ATOM 0 HG3 LYS A 108 1.363 38.030 5.156 1.00 25.00 H new ATOM 0 HD2 LYS A 108 2.056 36.587 3.430 1.00 25.00 H new ATOM 0 HD3 LYS A 108 1.597 35.142 4.310 1.00 25.00 H new ATOM 0 HE2 LYS A 108 0.130 35.321 2.433 1.00 25.00 H new ATOM 0 HE3 LYS A 108 -0.815 35.679 3.865 1.00 25.00 H new ATOM 0 HZ1 LYS A 108 -1.373 37.216 2.041 1.00 25.00 H new ATOM 0 HZ2 LYS A 108 -0.677 38.090 3.320 1.00 25.00 H new ATOM 0 HZ3 LYS A 108 0.238 37.743 1.933 1.00 25.00 H new ATOM 1630 N PRO A 109 1.207 35.509 9.172 1.00 25.00 N ATOM 1631 CA PRO A 109 1.414 34.343 10.024 1.00 25.00 C ATOM 1632 C PRO A 109 1.956 33.138 9.285 1.00 25.00 C ATOM 1633 O PRO A 109 1.370 32.145 9.061 1.00 25.00 O ATOM 1634 CB PRO A 109 0.051 34.166 10.601 1.00 25.00 C ATOM 1635 CG PRO A 109 -0.906 34.518 9.445 1.00 25.00 C ATOM 1636 CD PRO A 109 -0.174 35.591 8.703 1.00 25.00 C ATOM 0 HA PRO A 109 2.187 34.471 10.782 1.00 25.00 H new ATOM 0 HB2 PRO A 109 -0.104 33.144 10.947 1.00 25.00 H new ATOM 0 HB3 PRO A 109 -0.105 34.820 11.459 1.00 25.00 H new ATOM 0 HG2 PRO A 109 -1.104 33.654 8.810 1.00 25.00 H new ATOM 0 HG3 PRO A 109 -1.869 34.870 9.814 1.00 25.00 H new ATOM 0 HD2 PRO A 109 -0.234 35.435 7.626 1.00 25.00 H new ATOM 0 HD3 PRO A 109 -0.601 36.573 8.907 1.00 25.00 H new ATOM 1644 N LEU A 110 3.206 33.348 8.930 1.00 25.00 N ATOM 1645 CA LEU A 110 3.958 32.464 7.969 1.00 25.00 C ATOM 1646 C LEU A 110 3.807 30.975 8.256 1.00 25.00 C ATOM 1647 O LEU A 110 3.672 30.203 7.284 1.00 25.00 O ATOM 1648 CB LEU A 110 5.451 32.837 7.920 1.00 25.00 C ATOM 1649 CG LEU A 110 5.952 34.215 7.579 1.00 25.00 C ATOM 1650 CD1 LEU A 110 7.329 34.649 8.046 1.00 50.00 C ATOM 1651 CD2 LEU A 110 5.727 34.509 6.086 1.00 50.00 C ATOM 0 H LEU A 110 3.759 34.129 9.282 1.00 25.00 H new ATOM 0 HA LEU A 110 3.503 32.646 6.995 1.00 25.00 H new ATOM 0 HB2 LEU A 110 5.860 32.596 8.901 1.00 25.00 H new ATOM 0 HB3 LEU A 110 5.914 32.156 7.206 1.00 25.00 H new ATOM 0 HG LEU A 110 5.331 34.850 8.211 1.00 25.00 H new ATOM 0 HD11 LEU A 110 7.523 35.668 7.711 1.00 50.00 H new ATOM 0 HD12 LEU A 110 7.373 34.611 9.134 1.00 50.00 H new ATOM 0 HD13 LEU A 110 8.082 33.980 7.629 1.00 50.00 H new ATOM 0 HD21 LEU A 110 6.094 35.509 5.853 1.00 50.00 H new ATOM 0 HD22 LEU A 110 6.265 33.776 5.486 1.00 50.00 H new ATOM 0 HD23 LEU A 110 4.662 34.451 5.860 1.00 50.00 H new ATOM 1663 N LYS A 111 3.819 30.455 9.507 1.00 25.00 N ATOM 1664 CA LYS A 111 3.688 29.042 9.717 1.00 25.00 C ATOM 1665 C LYS A 111 2.342 28.450 9.343 1.00 25.00 C ATOM 1666 O LYS A 111 2.281 27.227 9.189 1.00 25.00 O ATOM 1667 CB LYS A 111 4.105 28.623 11.157 1.00 25.00 C ATOM 1668 CG LYS A 111 5.509 29.118 11.526 1.00 25.00 C ATOM 1669 CD LYS A 111 5.928 28.617 12.915 1.00 25.00 C ATOM 1670 CE LYS A 111 5.189 29.476 13.952 1.00 25.00 C ATOM 1671 NZ LYS A 111 5.801 29.237 15.254 1.00 25.00 N1+ ATOM 0 H LYS A 111 3.918 31.007 10.359 1.00 25.00 H new ATOM 0 HA LYS A 111 4.392 28.608 9.007 1.00 25.00 H new ATOM 0 HB2 LYS A 111 3.383 29.020 11.871 1.00 25.00 H new ATOM 0 HB3 LYS A 111 4.072 27.537 11.240 1.00 25.00 H new ATOM 0 HG2 LYS A 111 6.226 28.774 10.781 1.00 25.00 H new ATOM 0 HG3 LYS A 111 5.529 30.208 11.508 1.00 25.00 H new ATOM 0 HD2 LYS A 111 5.674 27.564 13.037 1.00 25.00 H new ATOM 0 HD3 LYS A 111 7.007 28.701 13.045 1.00 25.00 H new ATOM 0 HE2 LYS A 111 5.254 30.532 13.688 1.00 25.00 H new ATOM 0 HE3 LYS A 111 4.130 29.218 13.976 1.00 25.00 H new ATOM 0 HZ1 LYS A 111 5.317 29.809 15.975 1.00 25.00 H new ATOM 0 HZ2 LYS A 111 5.717 28.229 15.497 1.00 25.00 H new ATOM 0 HZ3 LYS A 111 6.806 29.502 15.219 1.00 25.00 H new ATOM 1685 N ARG A 112 1.405 29.306 9.135 1.00 25.00 N ATOM 1686 CA ARG A 112 0.059 28.933 8.701 1.00 25.00 C ATOM 1687 C ARG A 112 -0.285 29.542 7.304 1.00 25.00 C ATOM 1688 O ARG A 112 -0.806 28.824 6.434 1.00 25.00 O ATOM 1689 CB ARG A 112 -0.983 29.544 9.659 1.00 25.00 C ATOM 1690 CG ARG A 112 -0.965 29.030 11.061 1.00 25.00 C ATOM 1691 CD ARG A 112 -1.996 29.808 11.894 1.00 25.00 C ATOM 1692 NE ARG A 112 -2.246 29.063 13.139 1.00 25.00 N ATOM 1693 CZ ARG A 112 -3.034 29.452 14.144 1.00 25.00 C ATOM 1694 NH1 ARG A 112 -3.764 30.542 14.171 1.00 25.00 N1+ ATOM 1695 NH2 ARG A 112 -3.040 28.697 15.253 1.00 25.00 N ATOM 0 H ARG A 112 1.531 30.311 9.258 1.00 25.00 H new ATOM 0 HA ARG A 112 0.034 27.844 8.676 1.00 25.00 H new ATOM 0 HB2 ARG A 112 -0.833 30.623 9.687 1.00 25.00 H new ATOM 0 HB3 ARG A 112 -1.975 29.371 9.243 1.00 25.00 H new ATOM 0 HG2 ARG A 112 -1.197 27.965 11.074 1.00 25.00 H new ATOM 0 HG3 ARG A 112 0.030 29.145 11.491 1.00 25.00 H new ATOM 0 HD2 ARG A 112 -1.625 30.808 12.119 1.00 25.00 H new ATOM 0 HD3 ARG A 112 -2.922 29.930 11.333 1.00 25.00 H new ATOM 0 HE ARG A 112 -1.773 28.165 13.243 1.00 25.00 H new ATOM 0 HH11 ARG A 112 -3.760 31.179 13.374 1.00 25.00 H new ATOM 0 HH12 ARG A 112 -4.336 30.753 14.989 1.00 25.00 H new ATOM 0 HH21 ARG A 112 -2.457 27.862 15.305 1.00 25.00 H new ATOM 0 HH22 ARG A 112 -3.628 28.958 16.045 1.00 25.00 H new ATOM 1709 N ALA A 113 0.085 30.784 7.099 1.00 25.00 N ATOM 1710 CA ALA A 113 -0.079 31.446 5.804 1.00 25.00 C ATOM 1711 C ALA A 113 0.768 30.838 4.676 1.00 25.00 C ATOM 1712 O ALA A 113 0.434 31.022 3.495 1.00 25.00 O ATOM 1713 CB ALA A 113 0.370 32.930 5.912 1.00 25.00 C ATOM 0 H ALA A 113 0.508 31.372 7.817 1.00 25.00 H new ATOM 0 HA ALA A 113 -1.135 31.328 5.560 1.00 25.00 H new ATOM 0 HB1 ALA A 113 0.246 33.419 4.946 1.00 25.00 H new ATOM 0 HB2 ALA A 113 -0.239 33.441 6.658 1.00 25.00 H new ATOM 0 HB3 ALA A 113 1.418 32.972 6.208 1.00 25.00 H new ATOM 1719 N ASP A 114 1.798 30.068 4.955 1.00 25.00 N ATOM 1720 CA ASP A 114 2.602 29.496 3.896 1.00 25.00 C ATOM 1721 C ASP A 114 2.209 28.106 3.473 1.00 25.00 C ATOM 1722 O ASP A 114 3.036 27.338 3.021 1.00 25.00 O ATOM 1723 CB ASP A 114 4.133 29.517 4.157 1.00 25.00 C ATOM 1724 CG ASP A 114 4.635 30.995 4.460 1.00 25.00 C ATOM 1725 OD1 ASP A 114 5.778 31.124 4.989 1.00 25.00 O ATOM 1726 OD2 ASP A 114 3.975 31.973 3.996 1.00 25.00 O1- ATOM 0 H ASP A 114 2.097 29.825 5.899 1.00 25.00 H new ATOM 0 HA ASP A 114 2.378 30.178 3.076 1.00 25.00 H new ATOM 0 HB2 ASP A 114 4.372 28.867 4.999 1.00 25.00 H new ATOM 0 HB3 ASP A 114 4.660 29.120 3.289 1.00 25.00 H new ATOM 1731 N PHE A 115 0.919 27.793 3.524 1.00 25.00 N ATOM 1732 CA PHE A 115 0.322 26.568 2.928 1.00 25.00 C ATOM 1733 C PHE A 115 -1.014 26.926 2.337 1.00 25.00 C ATOM 1734 O PHE A 115 -1.742 27.697 2.959 1.00 25.00 O ATOM 1735 CB PHE A 115 0.126 25.486 3.993 1.00 25.00 C ATOM 1736 CG PHE A 115 1.479 24.882 4.502 1.00 25.00 C ATOM 1737 CD1 PHE A 115 1.915 25.198 5.806 1.00 50.00 C ATOM 1738 CD2 PHE A 115 2.215 24.032 3.727 1.00 50.00 C ATOM 1739 CE1 PHE A 115 3.086 24.527 6.336 1.00 25.00 C ATOM 1740 CE2 PHE A 115 3.378 23.402 4.211 1.00 25.00 C ATOM 1741 CZ PHE A 115 3.756 23.619 5.514 1.00 25.00 C ATOM 0 H PHE A 115 0.231 28.386 3.987 1.00 25.00 H new ATOM 0 HA PHE A 115 0.993 26.181 2.161 1.00 25.00 H new ATOM 0 HB2 PHE A 115 -0.418 25.908 4.838 1.00 25.00 H new ATOM 0 HB3 PHE A 115 -0.492 24.687 3.583 1.00 25.00 H new ATOM 0 HD1 PHE A 115 1.385 25.928 6.400 1.00 50.00 H new ATOM 0 HD2 PHE A 115 1.896 23.837 2.714 1.00 50.00 H new ATOM 0 HE1 PHE A 115 3.431 24.724 7.340 1.00 25.00 H new ATOM 0 HE2 PHE A 115 3.962 22.760 3.569 1.00 25.00 H new ATOM 0 HZ PHE A 115 4.596 23.071 5.914 1.00 25.00 H new ATOM 1751 N GLU A 116 -1.432 26.311 1.230 1.00 25.00 N ATOM 1752 CA GLU A 116 -2.824 26.323 0.778 1.00 25.00 C ATOM 1753 C GLU A 116 -3.401 24.971 0.427 1.00 25.00 C ATOM 1754 O GLU A 116 -2.693 24.132 -0.149 1.00 25.00 O ATOM 1755 CB GLU A 116 -2.862 27.171 -0.535 1.00 25.00 C ATOM 1756 CG GLU A 116 -2.510 28.646 -0.351 1.00 25.00 C ATOM 1757 CD GLU A 116 -2.954 29.523 -1.547 1.00 25.00 C ATOM 1758 OE1 GLU A 116 -3.597 30.586 -1.374 1.00 25.00 O ATOM 1759 OE2 GLU A 116 -2.654 29.135 -2.694 1.00 25.00 O1- ATOM 0 H GLU A 116 -0.809 25.786 0.617 1.00 25.00 H new ATOM 0 HA GLU A 116 -3.415 26.714 1.606 1.00 25.00 H new ATOM 0 HB2 GLU A 116 -2.170 26.733 -1.255 1.00 25.00 H new ATOM 0 HB3 GLU A 116 -3.860 27.101 -0.968 1.00 25.00 H new ATOM 0 HG2 GLU A 116 -2.981 29.016 0.560 1.00 25.00 H new ATOM 0 HG3 GLU A 116 -1.433 28.743 -0.215 1.00 25.00 H new ATOM 1766 N LEU A 117 -4.654 24.672 0.709 1.00 25.00 N ATOM 1767 CA LEU A 117 -5.185 23.363 0.347 1.00 25.00 C ATOM 1768 C LEU A 117 -5.414 23.590 -1.145 1.00 25.00 C ATOM 1769 O LEU A 117 -5.922 24.666 -1.435 1.00 25.00 O ATOM 1770 CB LEU A 117 -6.564 23.051 0.941 1.00 25.00 C ATOM 1771 CG LEU A 117 -7.233 21.705 0.628 1.00 25.00 C ATOM 1772 CD1 LEU A 117 -6.536 20.486 1.300 1.00 50.00 C ATOM 1773 CD2 LEU A 117 -8.656 21.888 1.110 1.00 50.00 C ATOM 0 H LEU A 117 -5.312 25.296 1.175 1.00 25.00 H new ATOM 0 HA LEU A 117 -4.529 22.556 0.674 1.00 25.00 H new ATOM 0 HB2 LEU A 117 -6.479 23.129 2.025 1.00 25.00 H new ATOM 0 HB3 LEU A 117 -7.245 23.838 0.617 1.00 25.00 H new ATOM 0 HG LEU A 117 -7.170 21.466 -0.434 1.00 25.00 H new ATOM 0 HD11 LEU A 117 -7.065 19.571 1.033 1.00 50.00 H new ATOM 0 HD12 LEU A 117 -5.504 20.422 0.956 1.00 50.00 H new ATOM 0 HD13 LEU A 117 -6.550 20.610 2.383 1.00 50.00 H new ATOM 0 HD21 LEU A 117 -9.222 20.974 0.930 1.00 50.00 H new ATOM 0 HD22 LEU A 117 -8.653 22.108 2.177 1.00 50.00 H new ATOM 0 HD23 LEU A 117 -9.120 22.714 0.570 1.00 50.00 H new ATOM 1785 N ILE A 118 -5.085 22.630 -1.974 1.00 25.00 N ATOM 1786 CA ILE A 118 -5.315 22.786 -3.362 1.00 25.00 C ATOM 1787 C ILE A 118 -6.167 21.613 -3.859 1.00 25.00 C ATOM 1788 O ILE A 118 -6.614 21.561 -4.991 1.00 25.00 O ATOM 1789 CB ILE A 118 -3.946 22.966 -4.109 1.00 25.00 C ATOM 1790 CG1 ILE A 118 -4.210 23.675 -5.456 1.00 25.00 C ATOM 1791 CG2 ILE A 118 -3.180 21.606 -4.353 1.00 25.00 C ATOM 1792 CD1 ILE A 118 -3.050 24.156 -6.295 1.00 25.00 C ATOM 0 H ILE A 118 -4.661 21.744 -1.700 1.00 25.00 H new ATOM 0 HA ILE A 118 -5.884 23.691 -3.576 1.00 25.00 H new ATOM 0 HB ILE A 118 -3.298 23.566 -3.470 1.00 25.00 H new ATOM 0 HG12 ILE A 118 -4.795 22.993 -6.072 1.00 25.00 H new ATOM 0 HG13 ILE A 118 -4.841 24.539 -5.249 1.00 25.00 H new ATOM 0 HG21 ILE A 118 -2.243 21.804 -4.873 1.00 25.00 H new ATOM 0 HG22 ILE A 118 -2.970 21.130 -3.395 1.00 25.00 H new ATOM 0 HG23 ILE A 118 -3.798 20.944 -4.959 1.00 25.00 H new ATOM 0 HD11 ILE A 118 -3.428 24.628 -7.202 1.00 25.00 H new ATOM 0 HD12 ILE A 118 -2.465 24.879 -5.727 1.00 25.00 H new ATOM 0 HD13 ILE A 118 -2.418 23.309 -6.563 1.00 25.00 H new ATOM 1804 N GLY A 119 -6.414 20.677 -2.979 1.00 25.00 N ATOM 1805 CA GLY A 119 -7.595 19.835 -3.099 1.00 25.00 C ATOM 1806 C GLY A 119 -7.755 18.692 -2.137 1.00 25.00 C ATOM 1807 O GLY A 119 -6.770 18.355 -1.404 1.00 25.00 O ATOM 0 H GLY A 119 -5.823 20.473 -2.173 1.00 25.00 H new ATOM 0 HA2 GLY A 119 -8.471 20.476 -3.003 1.00 25.00 H new ATOM 0 HA3 GLY A 119 -7.610 19.424 -4.109 1.00 25.00 H new ATOM 1811 N ALA A 120 -8.920 18.050 -2.121 1.00 25.00 N ATOM 1812 CA ALA A 120 -9.019 16.775 -1.321 1.00 25.00 C ATOM 1813 C ALA A 120 -10.107 15.900 -1.947 1.00 25.00 C ATOM 1814 O ALA A 120 -11.127 16.370 -2.546 1.00 25.00 O ATOM 1815 CB ALA A 120 -9.358 17.050 0.164 1.00 25.00 C ATOM 0 H ALA A 120 -9.768 18.342 -2.606 1.00 25.00 H new ATOM 0 HA ALA A 120 -8.053 16.271 -1.343 1.00 25.00 H new ATOM 0 HB1 ALA A 120 -9.420 16.105 0.704 1.00 25.00 H new ATOM 0 HB2 ALA A 120 -8.579 17.670 0.606 1.00 25.00 H new ATOM 0 HB3 ALA A 120 -10.315 17.568 0.229 1.00 25.00 H new ATOM 1821 N VAL A 121 -9.886 14.578 -1.897 1.00 25.00 N ATOM 1822 CA VAL A 121 -10.860 13.557 -2.362 1.00 25.00 C ATOM 1823 C VAL A 121 -11.283 12.633 -1.210 1.00 25.00 C ATOM 1824 O VAL A 121 -10.459 11.790 -0.809 1.00 25.00 O ATOM 1825 CB VAL A 121 -10.248 12.715 -3.561 1.00 25.00 C ATOM 1826 CG1 VAL A 121 -11.319 11.864 -4.176 1.00 50.00 C ATOM 1827 CG2 VAL A 121 -9.640 13.654 -4.624 1.00 50.00 C ATOM 0 H VAL A 121 -9.023 14.176 -1.532 1.00 25.00 H new ATOM 0 HA VAL A 121 -11.750 14.074 -2.720 1.00 25.00 H new ATOM 0 HB VAL A 121 -9.456 12.073 -3.175 1.00 25.00 H new ATOM 0 HG11 VAL A 121 -10.897 11.287 -4.999 1.00 50.00 H new ATOM 0 HG12 VAL A 121 -11.720 11.184 -3.424 1.00 50.00 H new ATOM 0 HG13 VAL A 121 -12.119 12.502 -4.553 1.00 50.00 H new ATOM 0 HG21 VAL A 121 -9.225 13.061 -5.439 1.00 50.00 H new ATOM 0 HG22 VAL A 121 -10.416 14.313 -5.014 1.00 50.00 H new ATOM 0 HG23 VAL A 121 -8.849 14.252 -4.171 1.00 50.00 H new ATOM 1837 N PRO A 122 -12.428 12.810 -0.592 1.00 25.00 N ATOM 1838 CA PRO A 122 -12.876 11.944 0.518 1.00 25.00 C ATOM 1839 C PRO A 122 -13.395 10.603 -0.083 1.00 25.00 C ATOM 1840 O PRO A 122 -13.530 10.399 -1.312 1.00 25.00 O ATOM 1841 CB PRO A 122 -13.997 12.672 1.171 1.00 25.00 C ATOM 1842 CG PRO A 122 -14.605 13.367 0.000 1.00 25.00 C ATOM 1843 CD PRO A 122 -13.448 13.850 -0.818 1.00 25.00 C ATOM 0 HA PRO A 122 -12.079 11.725 1.228 1.00 25.00 H new ATOM 0 HB2 PRO A 122 -14.699 11.996 1.659 1.00 25.00 H new ATOM 0 HB3 PRO A 122 -13.648 13.372 1.930 1.00 25.00 H new ATOM 0 HG2 PRO A 122 -15.237 12.690 -0.574 1.00 25.00 H new ATOM 0 HG3 PRO A 122 -15.235 14.197 0.319 1.00 25.00 H new ATOM 0 HD2 PRO A 122 -13.708 13.938 -1.873 1.00 25.00 H new ATOM 0 HD3 PRO A 122 -13.104 14.831 -0.491 1.00 25.00 H new ATOM 1851 N HIS A 123 -13.676 9.708 0.836 1.00 25.00 N ATOM 1852 CA HIS A 123 -14.134 8.375 0.475 1.00 25.00 C ATOM 1853 C HIS A 123 -15.336 8.025 1.352 1.00 25.00 C ATOM 1854 O HIS A 123 -15.381 6.977 1.969 1.00 25.00 O ATOM 1855 CB HIS A 123 -12.995 7.343 0.522 1.00 25.00 C ATOM 1856 CG HIS A 123 -13.235 6.111 -0.327 1.00 25.00 C ATOM 1857 ND1 HIS A 123 -14.004 4.984 0.094 1.00 25.00 N ATOM 1858 CD2 HIS A 123 -12.903 5.824 -1.618 1.00 25.00 C ATOM 1859 CE1 HIS A 123 -14.180 4.189 -0.912 1.00 25.00 C ATOM 1860 NE2 HIS A 123 -13.506 4.628 -1.936 1.00 25.00 N ATOM 0 H HIS A 123 -13.597 9.873 1.839 1.00 25.00 H new ATOM 0 HA HIS A 123 -14.462 8.355 -0.564 1.00 25.00 H new ATOM 0 HB2 HIS A 123 -12.073 7.822 0.194 1.00 25.00 H new ATOM 0 HB3 HIS A 123 -12.843 7.034 1.556 1.00 25.00 H new ATOM 0 HD2 HIS A 123 -12.283 6.423 -2.269 1.00 25.00 H new ATOM 0 HE1 HIS A 123 -14.792 3.299 -0.903 1.00 25.00 H new ATOM 0 HE2 HIS A 123 -13.435 4.157 -2.838 1.00 25.00 H new ATOM 1868 N ASP A 124 -16.314 8.928 1.468 1.00 25.00 N ATOM 1869 CA ASP A 124 -17.517 8.533 2.252 1.00 25.00 C ATOM 1870 C ASP A 124 -18.403 7.683 1.396 1.00 25.00 C ATOM 1871 O ASP A 124 -19.330 7.023 1.859 1.00 25.00 O ATOM 1872 CB ASP A 124 -18.253 9.789 2.741 1.00 25.00 C ATOM 1873 CG ASP A 124 -18.943 10.553 1.628 1.00 25.00 C ATOM 1874 OD1 ASP A 124 -20.194 10.656 1.660 1.00 50.00 O ATOM 1875 OD2 ASP A 124 -18.272 11.061 0.693 1.00 50.00 O1- ATOM 0 H ASP A 124 -16.318 9.867 1.070 1.00 25.00 H new ATOM 0 HA ASP A 124 -17.221 7.955 3.127 1.00 25.00 H new ATOM 0 HB2 ASP A 124 -18.993 9.500 3.487 1.00 25.00 H new ATOM 0 HB3 ASP A 124 -17.541 10.448 3.237 1.00 25.00 H new ATOM 1880 N GLY A 125 -18.138 7.630 0.131 1.00 25.00 N ATOM 1881 CA GLY A 125 -18.983 6.909 -0.783 1.00 25.00 C ATOM 1882 C GLY A 125 -19.119 7.588 -2.125 1.00 25.00 C ATOM 1883 O GLY A 125 -18.406 8.564 -2.328 1.00 25.00 O ATOM 0 H GLY A 125 -17.333 8.082 -0.303 1.00 25.00 H new ATOM 0 HA2 GLY A 125 -18.579 5.907 -0.929 1.00 25.00 H new ATOM 0 HA3 GLY A 125 -19.972 6.793 -0.339 1.00 25.00 H new ATOM 1887 N SER A 126 -20.011 7.090 -2.983 1.00 25.00 N ATOM 1888 CA SER A 126 -20.314 7.511 -4.314 1.00 25.00 C ATOM 1889 C SER A 126 -19.199 7.345 -5.327 1.00 25.00 C ATOM 1890 O SER A 126 -18.000 7.406 -5.050 1.00 25.00 O ATOM 1891 CB SER A 126 -20.808 8.958 -4.329 1.00 25.00 C ATOM 1892 OG SER A 126 -21.419 9.248 -3.128 1.00 25.00 O ATOM 0 H SER A 126 -20.591 6.296 -2.713 1.00 25.00 H new ATOM 0 HA SER A 126 -21.101 6.828 -4.633 1.00 25.00 H new ATOM 0 HB2 SER A 126 -19.972 9.637 -4.497 1.00 25.00 H new ATOM 0 HB3 SER A 126 -21.509 9.106 -5.151 1.00 25.00 H new ATOM 0 HG SER A 126 -21.734 10.176 -3.137 1.00 25.00 H new ATOM 1898 N PRO A 127 -19.530 7.207 -6.636 1.00 25.00 N ATOM 1899 CA PRO A 127 -18.386 6.862 -7.467 1.00 25.00 C ATOM 1900 C PRO A 127 -17.496 8.008 -7.966 1.00 25.00 C ATOM 1901 O PRO A 127 -16.531 7.794 -8.615 1.00 25.00 O ATOM 1902 CB PRO A 127 -19.060 6.243 -8.674 1.00 25.00 C ATOM 1903 CG PRO A 127 -20.365 6.962 -8.796 1.00 25.00 C ATOM 1904 CD PRO A 127 -20.781 7.078 -7.370 1.00 25.00 C ATOM 0 HA PRO A 127 -17.696 6.253 -6.883 1.00 25.00 H new ATOM 0 HB2 PRO A 127 -18.455 6.368 -9.572 1.00 25.00 H new ATOM 0 HB3 PRO A 127 -19.210 5.172 -8.537 1.00 25.00 H new ATOM 0 HG2 PRO A 127 -20.252 7.937 -9.270 1.00 25.00 H new ATOM 0 HG3 PRO A 127 -21.088 6.401 -9.389 1.00 25.00 H new ATOM 0 HD2 PRO A 127 -21.425 7.944 -7.213 1.00 25.00 H new ATOM 0 HD3 PRO A 127 -21.342 6.201 -7.047 1.00 25.00 H new ATOM 1912 N ALA A 128 -17.687 9.214 -7.451 1.00 25.00 N ATOM 1913 CA ALA A 128 -16.770 10.316 -7.689 1.00 25.00 C ATOM 1914 C ALA A 128 -15.484 10.069 -6.921 1.00 25.00 C ATOM 1915 O ALA A 128 -14.420 10.571 -7.219 1.00 25.00 O ATOM 1916 CB ALA A 128 -17.448 11.702 -7.306 1.00 25.00 C ATOM 0 H ALA A 128 -18.481 9.455 -6.858 1.00 25.00 H new ATOM 0 HA ALA A 128 -16.525 10.373 -8.750 1.00 25.00 H new ATOM 0 HB1 ALA A 128 -16.745 12.514 -7.491 1.00 25.00 H new ATOM 0 HB2 ALA A 128 -18.342 11.850 -7.912 1.00 25.00 H new ATOM 0 HB3 ALA A 128 -17.723 11.694 -6.251 1.00 25.00 H new ATOM 1922 N SER A 129 -15.590 9.316 -5.857 1.00 25.00 N ATOM 1923 CA SER A 129 -14.468 9.010 -4.916 1.00 25.00 C ATOM 1924 C SER A 129 -13.446 8.060 -5.545 1.00 25.00 C ATOM 1925 O SER A 129 -12.293 7.946 -5.158 1.00 25.00 O ATOM 1926 CB SER A 129 -14.996 8.393 -3.602 1.00 25.00 C ATOM 1927 OG SER A 129 -15.496 7.058 -3.879 1.00 25.00 O ATOM 0 H SER A 129 -16.468 8.873 -5.587 1.00 25.00 H new ATOM 0 HA SER A 129 -13.975 9.957 -4.696 1.00 25.00 H new ATOM 0 HB2 SER A 129 -14.200 8.351 -2.858 1.00 25.00 H new ATOM 0 HB3 SER A 129 -15.789 9.014 -3.185 1.00 25.00 H new ATOM 0 HG SER A 129 -16.382 7.120 -4.294 1.00 25.00 H new ATOM 1933 N ARG A 130 -13.967 7.405 -6.596 1.00 25.00 N ATOM 1934 CA ARG A 130 -13.166 6.448 -7.389 1.00 25.00 C ATOM 1935 C ARG A 130 -12.155 7.207 -8.236 1.00 25.00 C ATOM 1936 O ARG A 130 -11.049 6.786 -8.566 1.00 25.00 O ATOM 1937 CB ARG A 130 -13.954 5.586 -8.289 1.00 25.00 C ATOM 1938 CG ARG A 130 -13.295 4.292 -8.601 1.00 25.00 C ATOM 1939 CD ARG A 130 -14.136 3.480 -9.513 1.00 25.00 C ATOM 1940 NE ARG A 130 -13.631 2.117 -9.799 1.00 25.00 N ATOM 1941 CZ ARG A 130 -14.117 1.221 -10.649 1.00 25.00 C ATOM 1942 NH1 ARG A 130 -15.306 1.402 -11.303 1.00 25.00 N1+ ATOM 1943 NH2 ARG A 130 -13.472 0.174 -10.938 1.00 25.00 N ATOM 0 H ARG A 130 -14.929 7.516 -6.917 1.00 25.00 H new ATOM 0 HA ARG A 130 -12.688 5.797 -6.657 1.00 25.00 H new ATOM 0 HB2 ARG A 130 -14.924 5.389 -7.833 1.00 25.00 H new ATOM 0 HB3 ARG A 130 -14.142 6.122 -9.219 1.00 25.00 H new ATOM 0 HG2 ARG A 130 -12.324 4.475 -9.061 1.00 25.00 H new ATOM 0 HG3 ARG A 130 -13.112 3.740 -7.679 1.00 25.00 H new ATOM 0 HD2 ARG A 130 -15.134 3.396 -9.082 1.00 25.00 H new ATOM 0 HD3 ARG A 130 -14.241 4.016 -10.457 1.00 25.00 H new ATOM 0 HE ARG A 130 -12.804 1.830 -9.276 1.00 25.00 H new ATOM 0 HH11 ARG A 130 -15.852 2.249 -11.144 1.00 25.00 H new ATOM 0 HH12 ARG A 130 -15.646 0.690 -11.949 1.00 25.00 H new ATOM 0 HH21 ARG A 130 -12.559 0.004 -10.516 1.00 25.00 H new ATOM 0 HH22 ARG A 130 -13.864 -0.502 -11.594 1.00 25.00 H new ATOM 1957 N ASN A 131 -12.480 8.479 -8.507 1.00 25.00 N ATOM 1958 CA ASN A 131 -11.688 9.276 -9.481 1.00 25.00 C ATOM 1959 C ASN A 131 -10.316 9.607 -8.907 1.00 25.00 C ATOM 1960 O ASN A 131 -10.158 10.370 -7.974 1.00 25.00 O ATOM 1961 CB ASN A 131 -12.384 10.636 -9.769 1.00 25.00 C ATOM 1962 CG ASN A 131 -13.710 10.464 -10.446 1.00 25.00 C ATOM 1963 OD1 ASN A 131 -13.983 9.449 -11.065 1.00 25.00 O ATOM 1964 ND2 ASN A 131 -14.457 11.557 -10.460 1.00 25.00 N ATOM 0 H ASN A 131 -13.263 8.976 -8.083 1.00 25.00 H new ATOM 0 HA ASN A 131 -11.602 8.679 -10.389 1.00 25.00 H new ATOM 0 HB2 ASN A 131 -12.524 11.176 -8.832 1.00 25.00 H new ATOM 0 HB3 ASN A 131 -11.735 11.248 -10.396 1.00 25.00 H new ATOM 0 HD21 ASN A 131 -15.315 11.581 -11.011 1.00 25.00 H new ATOM 0 HD22 ASN A 131 -14.174 12.375 -9.920 1.00 25.00 H new ATOM 1971 N LEU A 132 -9.256 9.003 -9.444 1.00 25.00 N ATOM 1972 CA LEU A 132 -7.880 9.218 -9.050 1.00 25.00 C ATOM 1973 C LEU A 132 -7.278 10.349 -9.901 1.00 25.00 C ATOM 1974 O LEU A 132 -6.500 11.204 -9.356 1.00 25.00 O ATOM 1975 CB LEU A 132 -7.151 7.891 -9.307 1.00 25.00 C ATOM 1976 CG LEU A 132 -5.638 7.729 -8.980 1.00 25.00 C ATOM 1977 CD1 LEU A 132 -5.305 8.378 -7.629 1.00 75.00 C ATOM 1978 CD2 LEU A 132 -5.419 6.192 -8.843 1.00 75.00 C ATOM 0 H LEU A 132 -9.346 8.322 -10.198 1.00 25.00 H new ATOM 0 HA LEU A 132 -7.791 9.510 -8.004 1.00 25.00 H new ATOM 0 HB2 LEU A 132 -7.682 7.122 -8.747 1.00 25.00 H new ATOM 0 HB3 LEU A 132 -7.275 7.659 -10.365 1.00 25.00 H new ATOM 0 HG LEU A 132 -5.017 8.193 -9.746 1.00 25.00 H new ATOM 0 HD11 LEU A 132 -4.243 8.254 -7.418 1.00 75.00 H new ATOM 0 HD12 LEU A 132 -5.546 9.440 -7.666 1.00 75.00 H new ATOM 0 HD13 LEU A 132 -5.889 7.901 -6.842 1.00 75.00 H new ATOM 0 HD21 LEU A 132 -4.373 5.993 -8.612 1.00 75.00 H new ATOM 0 HD22 LEU A 132 -6.048 5.805 -8.041 1.00 75.00 H new ATOM 0 HD23 LEU A 132 -5.683 5.702 -9.780 1.00 75.00 H new ATOM 1990 N SER A 133 -7.665 10.425 -11.187 1.00 25.00 N ATOM 1991 CA SER A 133 -7.288 11.482 -12.081 1.00 25.00 C ATOM 1992 C SER A 133 -8.048 12.751 -11.738 1.00 25.00 C ATOM 1993 O SER A 133 -9.274 12.687 -11.521 1.00 25.00 O ATOM 1994 CB SER A 133 -7.618 10.998 -13.469 1.00 25.00 C ATOM 1995 OG SER A 133 -7.355 11.938 -14.491 1.00 25.00 O ATOM 0 H SER A 133 -8.264 9.724 -11.623 1.00 25.00 H new ATOM 0 HA SER A 133 -6.228 11.722 -12.003 1.00 25.00 H new ATOM 0 HB2 SER A 133 -7.048 10.091 -13.670 1.00 25.00 H new ATOM 0 HB3 SER A 133 -8.673 10.726 -13.505 1.00 25.00 H new ATOM 0 HG SER A 133 -7.592 11.552 -15.360 1.00 25.00 H new ATOM 2001 N HIS A 134 -7.370 13.871 -11.630 1.00 25.00 N ATOM 2002 CA HIS A 134 -8.025 15.096 -11.156 1.00 25.00 C ATOM 2003 C HIS A 134 -7.524 16.274 -11.961 1.00 25.00 C ATOM 2004 O HIS A 134 -6.436 16.222 -12.624 1.00 25.00 O ATOM 2005 CB HIS A 134 -7.874 15.350 -9.676 1.00 25.00 C ATOM 2006 CG HIS A 134 -9.078 14.955 -8.875 1.00 25.00 C ATOM 2007 ND1 HIS A 134 -9.823 15.893 -8.166 1.00 25.00 N ATOM 2008 CD2 HIS A 134 -9.693 13.769 -8.638 1.00 25.00 C ATOM 2009 CE1 HIS A 134 -10.785 15.280 -7.541 1.00 25.00 C ATOM 2010 NE2 HIS A 134 -10.799 14.008 -7.822 1.00 25.00 N ATOM 0 H HIS A 134 -6.381 13.972 -11.857 1.00 25.00 H new ATOM 0 HA HIS A 134 -9.095 14.959 -11.309 1.00 25.00 H new ATOM 0 HB2 HIS A 134 -7.007 14.802 -9.308 1.00 25.00 H new ATOM 0 HB3 HIS A 134 -7.673 16.409 -9.516 1.00 25.00 H new ATOM 0 HD2 HIS A 134 -9.380 12.807 -9.016 1.00 25.00 H new ATOM 0 HE1 HIS A 134 -11.483 15.764 -6.874 1.00 25.00 H new ATOM 0 HE2 HIS A 134 -11.484 13.321 -7.507 1.00 25.00 H new ATOM 2018 N HIS A 135 -8.280 17.337 -11.918 1.00 25.00 N ATOM 2019 CA HIS A 135 -7.918 18.578 -12.538 1.00 25.00 C ATOM 2020 C HIS A 135 -7.583 19.577 -11.456 1.00 25.00 C ATOM 2021 O HIS A 135 -8.275 19.690 -10.465 1.00 25.00 O ATOM 2022 CB HIS A 135 -9.049 19.090 -13.409 1.00 25.00 C ATOM 2023 CG HIS A 135 -9.286 18.241 -14.621 1.00 25.00 C ATOM 2024 ND1 HIS A 135 -8.674 18.479 -15.817 1.00 25.00 N ATOM 2025 CD2 HIS A 135 -10.083 17.130 -14.876 1.00 25.00 C ATOM 2026 CE1 HIS A 135 -9.052 17.534 -16.694 1.00 25.00 C ATOM 2027 NE2 HIS A 135 -9.898 16.715 -16.135 1.00 25.00 N ATOM 0 H HIS A 135 -9.181 17.363 -11.442 1.00 25.00 H new ATOM 0 HA HIS A 135 -7.050 18.429 -13.180 1.00 25.00 H new ATOM 0 HB2 HIS A 135 -9.964 19.133 -12.818 1.00 25.00 H new ATOM 0 HB3 HIS A 135 -8.825 20.109 -13.724 1.00 25.00 H new ATOM 0 HD2 HIS A 135 -10.752 16.670 -14.164 1.00 25.00 H new ATOM 0 HE1 HIS A 135 -8.705 17.463 -17.714 1.00 25.00 H new ATOM 0 HE2 HIS A 135 -10.338 15.907 -16.576 1.00 25.00 H new ATOM 2035 N ILE A 136 -6.473 20.234 -11.618 1.00 25.00 N ATOM 2036 CA ILE A 136 -5.946 21.177 -10.650 1.00 25.00 C ATOM 2037 C ILE A 136 -5.600 22.416 -11.441 1.00 25.00 C ATOM 2038 O ILE A 136 -4.721 22.373 -12.322 1.00 25.00 O ATOM 2039 CB ILE A 136 -4.732 20.544 -9.882 1.00 25.00 C ATOM 2040 CG1 ILE A 136 -5.138 19.427 -8.878 1.00 25.00 C ATOM 2041 CG2 ILE A 136 -4.119 21.634 -8.950 1.00 25.00 C ATOM 2042 CD1 ILE A 136 -4.989 17.931 -9.387 1.00 25.00 C ATOM 0 H ILE A 136 -5.886 20.133 -12.446 1.00 25.00 H new ATOM 0 HA ILE A 136 -6.659 21.437 -9.867 1.00 25.00 H new ATOM 0 HB ILE A 136 -4.074 20.150 -10.656 1.00 25.00 H new ATOM 0 HG12 ILE A 136 -4.536 19.543 -7.977 1.00 25.00 H new ATOM 0 HG13 ILE A 136 -6.177 19.588 -8.590 1.00 25.00 H new ATOM 0 HG21 ILE A 136 -3.273 21.214 -8.406 1.00 25.00 H new ATOM 0 HG22 ILE A 136 -3.781 22.478 -9.551 1.00 25.00 H new ATOM 0 HG23 ILE A 136 -4.874 21.973 -8.240 1.00 25.00 H new ATOM 0 HD11 ILE A 136 -5.302 17.246 -8.599 1.00 25.00 H new ATOM 0 HD12 ILE A 136 -5.614 17.782 -10.267 1.00 25.00 H new ATOM 0 HD13 ILE A 136 -3.948 17.736 -9.644 1.00 25.00 H new ATOM 2054 N TYR A 137 -6.285 23.494 -11.087 1.00 25.00 N ATOM 2055 CA TYR A 137 -5.833 24.873 -11.381 1.00 25.00 C ATOM 2056 C TYR A 137 -4.720 25.189 -10.409 1.00 25.00 C ATOM 2057 O TYR A 137 -4.863 25.007 -9.219 1.00 25.00 O ATOM 2058 CB TYR A 137 -6.957 25.897 -11.241 1.00 25.00 C ATOM 2059 CG TYR A 137 -6.464 27.312 -11.511 1.00 25.00 C ATOM 2060 CD1 TYR A 137 -6.133 28.158 -10.457 1.00 50.00 C ATOM 2061 CD2 TYR A 137 -6.344 27.795 -12.840 1.00 50.00 C ATOM 2062 CE1 TYR A 137 -5.634 29.464 -10.750 1.00 25.00 C ATOM 2063 CE2 TYR A 137 -5.726 29.100 -13.088 1.00 25.00 C ATOM 2064 CZ TYR A 137 -5.436 29.912 -12.027 1.00 25.00 C ATOM 2065 OH TYR A 137 -4.966 31.218 -12.122 1.00 25.00 O ATOM 0 H TYR A 137 -7.173 23.452 -10.587 1.00 25.00 H new ATOM 0 HA TYR A 137 -5.495 24.930 -12.416 1.00 25.00 H new ATOM 0 HB2 TYR A 137 -7.761 25.653 -11.935 1.00 25.00 H new ATOM 0 HB3 TYR A 137 -7.376 25.843 -10.236 1.00 25.00 H new ATOM 0 HD1 TYR A 137 -6.251 27.833 -9.434 1.00 50.00 H new ATOM 0 HD2 TYR A 137 -6.707 27.202 -13.666 1.00 50.00 H new ATOM 0 HE1 TYR A 137 -5.403 30.126 -9.928 1.00 25.00 H new ATOM 0 HE2 TYR A 137 -5.502 29.417 -14.096 1.00 25.00 H new ATOM 0 HH TYR A 137 -4.852 31.457 -13.066 1.00 25.00 H new ATOM 2075 N ILE A 138 -3.641 25.765 -10.913 1.00 25.00 N ATOM 2076 CA ILE A 138 -2.431 26.181 -10.163 1.00 25.00 C ATOM 2077 C ILE A 138 -2.285 27.649 -10.534 1.00 25.00 C ATOM 2078 O ILE A 138 -2.106 27.904 -11.719 1.00 25.00 O ATOM 2079 CB ILE A 138 -1.114 25.366 -10.572 1.00 25.00 C ATOM 2080 CG1 ILE A 138 -1.296 23.853 -10.450 1.00 25.00 C ATOM 2081 CG2 ILE A 138 0.004 25.813 -9.638 1.00 25.00 C ATOM 2082 CD1 ILE A 138 -0.070 23.025 -10.627 1.00 25.00 C ATOM 0 H ILE A 138 -3.565 25.973 -11.909 1.00 25.00 H new ATOM 0 HA ILE A 138 -2.540 25.994 -9.095 1.00 25.00 H new ATOM 0 HB ILE A 138 -0.885 25.573 -11.617 1.00 25.00 H new ATOM 0 HG12 ILE A 138 -1.716 23.637 -9.468 1.00 25.00 H new ATOM 0 HG13 ILE A 138 -2.033 23.536 -11.188 1.00 25.00 H new ATOM 0 HG21 ILE A 138 0.921 25.278 -9.886 1.00 25.00 H new ATOM 0 HG22 ILE A 138 0.167 26.885 -9.752 1.00 25.00 H new ATOM 0 HG23 ILE A 138 -0.275 25.596 -8.607 1.00 25.00 H new ATOM 0 HD11 ILE A 138 -0.324 21.971 -10.519 1.00 25.00 H new ATOM 0 HD12 ILE A 138 0.346 23.198 -11.620 1.00 25.00 H new ATOM 0 HD13 ILE A 138 0.667 23.300 -9.872 1.00 25.00 H new ATOM 2094 N PRO A 139 -2.339 28.588 -9.555 1.00 25.00 N ATOM 2095 CA PRO A 139 -2.188 30.014 -9.959 1.00 25.00 C ATOM 2096 C PRO A 139 -0.777 30.340 -10.408 1.00 25.00 C ATOM 2097 O PRO A 139 0.185 29.687 -10.048 1.00 25.00 O ATOM 2098 CB PRO A 139 -2.528 30.731 -8.736 1.00 25.00 C ATOM 2099 CG PRO A 139 -2.168 29.810 -7.535 1.00 25.00 C ATOM 2100 CD PRO A 139 -2.423 28.417 -8.090 1.00 25.00 C ATOM 0 HA PRO A 139 -2.813 30.277 -10.813 1.00 25.00 H new ATOM 0 HB2 PRO A 139 -1.977 31.670 -8.677 1.00 25.00 H new ATOM 0 HB3 PRO A 139 -3.589 30.982 -8.722 1.00 25.00 H new ATOM 0 HG2 PRO A 139 -1.131 29.938 -7.224 1.00 25.00 H new ATOM 0 HG3 PRO A 139 -2.790 30.019 -6.665 1.00 25.00 H new ATOM 0 HD2 PRO A 139 -1.682 27.703 -7.730 1.00 25.00 H new ATOM 0 HD3 PRO A 139 -3.401 28.041 -7.789 1.00 25.00 H new ATOM 2108 N GLU A 140 -0.670 31.327 -11.251 1.00 25.00 N ATOM 2109 CA GLU A 140 0.643 31.749 -11.824 1.00 25.00 C ATOM 2110 C GLU A 140 1.104 33.018 -11.156 1.00 25.00 C ATOM 2111 O GLU A 140 1.419 34.013 -11.769 1.00 25.00 O ATOM 2112 CB GLU A 140 0.494 31.853 -13.387 1.00 25.00 C ATOM 2113 CG GLU A 140 1.836 31.736 -14.106 1.00 25.00 C ATOM 2114 CD GLU A 140 1.766 31.549 -15.636 1.00 25.00 C ATOM 2115 OE1 GLU A 140 1.972 32.559 -16.345 1.00 25.00 O ATOM 2116 OE2 GLU A 140 1.468 30.421 -16.167 1.00 25.00 O1- ATOM 0 H GLU A 140 -1.463 31.878 -11.579 1.00 25.00 H new ATOM 0 HA GLU A 140 1.425 31.016 -11.629 1.00 25.00 H new ATOM 0 HB2 GLU A 140 -0.174 31.067 -13.739 1.00 25.00 H new ATOM 0 HB3 GLU A 140 0.029 32.805 -13.643 1.00 25.00 H new ATOM 0 HG2 GLU A 140 2.419 32.633 -13.895 1.00 25.00 H new ATOM 0 HG3 GLU A 140 2.382 30.894 -13.681 1.00 25.00 H new ATOM 2123 N ASP A 141 1.118 33.047 -9.827 1.00 25.00 N ATOM 2124 CA ASP A 141 1.282 34.326 -9.122 1.00 25.00 C ATOM 2125 C ASP A 141 2.615 35.021 -9.191 1.00 25.00 C ATOM 2126 O ASP A 141 2.653 36.249 -9.120 1.00 25.00 O ATOM 2127 CB ASP A 141 0.781 34.195 -7.708 1.00 25.00 C ATOM 2128 CG ASP A 141 1.751 33.552 -6.761 1.00 25.00 C ATOM 2129 OD1 ASP A 141 2.164 32.374 -6.985 1.00 50.00 O ATOM 2130 OD2 ASP A 141 2.034 34.163 -5.732 1.00 50.00 O1- ATOM 0 H ASP A 141 1.021 32.229 -9.226 1.00 25.00 H new ATOM 0 HA ASP A 141 0.667 35.017 -9.698 1.00 25.00 H new ATOM 0 HB2 ASP A 141 0.529 35.187 -7.332 1.00 25.00 H new ATOM 0 HB3 ASP A 141 -0.141 33.613 -7.715 1.00 25.00 H new ATOM 2135 N ARG A 142 3.665 34.218 -9.206 1.00 25.00 N ATOM 2136 CA ARG A 142 5.099 34.627 -9.145 1.00 25.00 C ATOM 2137 C ARG A 142 6.026 33.605 -9.753 1.00 25.00 C ATOM 2138 O ARG A 142 5.628 32.457 -9.985 1.00 25.00 O ATOM 2139 CB ARG A 142 5.461 34.758 -7.704 1.00 25.00 C ATOM 2140 CG ARG A 142 5.134 36.041 -7.026 1.00 25.00 C ATOM 2141 CD ARG A 142 5.544 36.124 -5.620 1.00 25.00 C ATOM 2142 NE ARG A 142 5.038 37.318 -4.975 1.00 25.00 N ATOM 2143 CZ ARG A 142 5.697 38.438 -4.786 1.00 25.00 C ATOM 2144 NH1 ARG A 142 5.054 39.472 -4.275 1.00 25.00 N1+ ATOM 2145 NH2 ARG A 142 6.924 38.692 -5.171 1.00 25.00 N ATOM 0 H ARG A 142 3.558 33.205 -9.264 1.00 25.00 H new ATOM 0 HA ARG A 142 5.210 35.555 -9.706 1.00 25.00 H new ATOM 0 HB2 ARG A 142 4.966 33.954 -7.159 1.00 25.00 H new ATOM 0 HB3 ARG A 142 6.534 34.593 -7.611 1.00 25.00 H new ATOM 0 HG2 ARG A 142 5.607 36.855 -7.575 1.00 25.00 H new ATOM 0 HG3 ARG A 142 4.057 36.201 -7.084 1.00 25.00 H new ATOM 0 HD2 ARG A 142 5.186 35.244 -5.086 1.00 25.00 H new ATOM 0 HD3 ARG A 142 6.632 36.113 -5.559 1.00 25.00 H new ATOM 0 HE ARG A 142 4.077 37.286 -4.635 1.00 25.00 H new ATOM 0 HH11 ARG A 142 4.066 39.391 -4.036 1.00 25.00 H new ATOM 0 HH12 ARG A 142 5.546 40.352 -4.119 1.00 25.00 H new ATOM 0 HH21 ARG A 142 7.459 37.981 -5.670 1.00 25.00 H new ATOM 0 HH22 ARG A 142 7.343 39.600 -4.972 1.00 25.00 H new ATOM 2159 N LEU A 143 7.268 34.011 -9.984 1.00 25.00 N ATOM 2160 CA LEU A 143 8.361 33.019 -10.276 1.00 25.00 C ATOM 2161 C LEU A 143 8.960 32.476 -8.999 1.00 25.00 C ATOM 2162 O LEU A 143 9.261 33.205 -8.105 1.00 25.00 O ATOM 2163 CB LEU A 143 9.476 33.730 -11.079 1.00 25.00 C ATOM 2164 CG LEU A 143 9.299 33.988 -12.574 1.00 25.00 C ATOM 2165 CD1 LEU A 143 8.341 35.193 -12.885 1.00 50.00 C ATOM 2166 CD2 LEU A 143 10.605 34.291 -13.147 1.00 50.00 C ATOM 0 H LEU A 143 7.565 34.987 -9.981 1.00 25.00 H new ATOM 0 HA LEU A 143 7.935 32.191 -10.843 1.00 25.00 H new ATOM 0 HB2 LEU A 143 9.653 34.695 -10.603 1.00 25.00 H new ATOM 0 HB3 LEU A 143 10.386 33.143 -10.958 1.00 25.00 H new ATOM 0 HG LEU A 143 8.853 33.092 -13.005 1.00 25.00 H new ATOM 0 HD11 LEU A 143 8.258 35.323 -13.964 1.00 50.00 H new ATOM 0 HD12 LEU A 143 7.355 34.991 -12.467 1.00 50.00 H new ATOM 0 HD13 LEU A 143 8.744 36.103 -12.440 1.00 50.00 H new ATOM 0 HD21 LEU A 143 10.499 34.478 -14.216 1.00 50.00 H new ATOM 0 HD22 LEU A 143 11.018 35.176 -12.663 1.00 50.00 H new ATOM 0 HD23 LEU A 143 11.275 33.446 -12.992 1.00 50.00 H new ATOM 2178 N GLY A 144 9.121 31.162 -8.963 1.00 25.00 N ATOM 2179 CA GLY A 144 9.851 30.590 -7.839 1.00 25.00 C ATOM 2180 C GLY A 144 9.283 29.265 -7.310 1.00 25.00 C ATOM 2181 O GLY A 144 8.231 28.872 -7.693 1.00 25.00 O ATOM 0 H GLY A 144 8.777 30.500 -9.658 1.00 25.00 H new ATOM 0 HA2 GLY A 144 10.887 30.431 -8.140 1.00 25.00 H new ATOM 0 HA3 GLY A 144 9.863 31.315 -7.025 1.00 25.00 H new ATOM 2185 N TYR A 145 10.069 28.596 -6.531 1.00 25.00 N ATOM 2186 CA TYR A 145 9.814 27.228 -6.049 1.00 25.00 C ATOM 2187 C TYR A 145 8.722 26.997 -4.979 1.00 25.00 C ATOM 2188 O TYR A 145 8.546 27.810 -4.074 1.00 25.00 O ATOM 2189 CB TYR A 145 11.143 26.559 -5.626 1.00 25.00 C ATOM 2190 CG TYR A 145 11.233 26.297 -4.162 1.00 25.00 C ATOM 2191 CD1 TYR A 145 11.623 27.272 -3.266 1.00 50.00 C ATOM 2192 CD2 TYR A 145 10.790 25.011 -3.665 1.00 50.00 C ATOM 2193 CE1 TYR A 145 11.495 27.058 -1.805 1.00 25.00 C ATOM 2194 CE2 TYR A 145 10.667 24.775 -2.257 1.00 25.00 C ATOM 2195 CZ TYR A 145 11.029 25.805 -1.354 1.00 25.00 C ATOM 2196 OH TYR A 145 10.968 25.730 0.016 1.00 25.00 O ATOM 0 H TYR A 145 10.948 28.980 -6.185 1.00 25.00 H new ATOM 0 HA TYR A 145 9.368 26.753 -6.923 1.00 25.00 H new ATOM 0 HB2 TYR A 145 11.255 25.617 -6.164 1.00 25.00 H new ATOM 0 HB3 TYR A 145 11.974 27.198 -5.925 1.00 25.00 H new ATOM 0 HD1 TYR A 145 12.027 28.203 -3.635 1.00 50.00 H new ATOM 0 HD2 TYR A 145 10.550 24.222 -4.362 1.00 50.00 H new ATOM 0 HE1 TYR A 145 11.751 27.840 -1.105 1.00 25.00 H new ATOM 0 HE2 TYR A 145 10.304 23.826 -1.890 1.00 25.00 H new ATOM 0 HH TYR A 145 11.596 25.048 0.335 1.00 25.00 H new ATOM 2206 N HIS A 146 8.045 25.856 -5.079 1.00 25.00 N ATOM 2207 CA HIS A 146 6.979 25.475 -4.176 1.00 25.00 C ATOM 2208 C HIS A 146 7.178 23.995 -4.029 1.00 25.00 C ATOM 2209 O HIS A 146 7.716 23.370 -4.902 1.00 25.00 O ATOM 2210 CB HIS A 146 5.573 25.686 -4.789 1.00 25.00 C ATOM 2211 CG HIS A 146 5.284 27.135 -5.079 1.00 25.00 C ATOM 2212 ND1 HIS A 146 4.304 27.850 -4.392 1.00 25.00 N ATOM 2213 CD2 HIS A 146 5.812 27.975 -5.977 1.00 25.00 C ATOM 2214 CE1 HIS A 146 4.244 29.055 -4.949 1.00 25.00 C ATOM 2215 NE2 HIS A 146 5.228 29.153 -5.840 1.00 25.00 N ATOM 0 H HIS A 146 8.230 25.163 -5.804 1.00 25.00 H new ATOM 0 HA HIS A 146 7.018 26.060 -3.257 1.00 25.00 H new ATOM 0 HB2 HIS A 146 5.492 25.111 -5.711 1.00 25.00 H new ATOM 0 HB3 HIS A 146 4.819 25.298 -4.104 1.00 25.00 H new ATOM 0 HD1 HIS A 146 3.741 27.513 -3.611 1.00 25.00 H new ATOM 0 HD2 HIS A 146 6.584 27.732 -6.692 1.00 25.00 H new ATOM 0 HE1 HIS A 146 3.521 29.823 -4.718 1.00 25.00 H new ATOM 2223 N VAL A 147 6.673 23.459 -2.948 1.00 25.00 N ATOM 2224 CA VAL A 147 6.488 21.984 -2.803 1.00 25.00 C ATOM 2225 C VAL A 147 4.993 21.773 -2.943 1.00 25.00 C ATOM 2226 O VAL A 147 4.206 22.551 -2.409 1.00 25.00 O ATOM 2227 CB VAL A 147 7.005 21.481 -1.404 1.00 25.00 C ATOM 2228 CG1 VAL A 147 7.052 19.900 -1.201 1.00 50.00 C ATOM 2229 CG2 VAL A 147 8.441 22.069 -1.132 1.00 50.00 C ATOM 0 H VAL A 147 6.373 23.999 -2.136 1.00 25.00 H new ATOM 0 HA VAL A 147 7.055 21.422 -3.546 1.00 25.00 H new ATOM 0 HB VAL A 147 6.264 21.842 -0.691 1.00 25.00 H new ATOM 0 HG11 VAL A 147 7.424 19.672 -0.202 1.00 50.00 H new ATOM 0 HG12 VAL A 147 6.050 19.488 -1.318 1.00 50.00 H new ATOM 0 HG13 VAL A 147 7.715 19.457 -1.944 1.00 50.00 H new ATOM 0 HG21 VAL A 147 8.799 21.721 -0.163 1.00 50.00 H new ATOM 0 HG22 VAL A 147 9.125 21.736 -1.913 1.00 50.00 H new ATOM 0 HG23 VAL A 147 8.394 23.158 -1.131 1.00 50.00 H new ATOM 2239 N ILE A 148 4.710 20.750 -3.718 1.00 25.00 N ATOM 2240 CA ILE A 148 3.298 20.290 -3.883 1.00 25.00 C ATOM 2241 C ILE A 148 3.434 19.221 -2.816 1.00 25.00 C ATOM 2242 O ILE A 148 4.305 18.332 -2.875 1.00 25.00 O ATOM 2243 CB ILE A 148 2.870 19.626 -5.271 1.00 25.00 C ATOM 2244 CG1 ILE A 148 2.838 20.709 -6.336 1.00 25.00 C ATOM 2245 CG2 ILE A 148 1.488 18.946 -5.169 1.00 25.00 C ATOM 2246 CD1 ILE A 148 2.715 20.236 -7.779 1.00 25.00 C ATOM 0 H ILE A 148 5.401 20.214 -4.244 1.00 25.00 H new ATOM 0 HA ILE A 148 2.551 21.082 -3.829 1.00 25.00 H new ATOM 0 HB ILE A 148 3.596 18.856 -5.533 1.00 25.00 H new ATOM 0 HG12 ILE A 148 2.001 21.374 -6.122 1.00 25.00 H new ATOM 0 HG13 ILE A 148 3.748 21.303 -6.247 1.00 25.00 H new ATOM 0 HG21 ILE A 148 1.228 18.505 -6.131 1.00 25.00 H new ATOM 0 HG22 ILE A 148 1.522 18.166 -4.409 1.00 25.00 H new ATOM 0 HG23 ILE A 148 0.737 19.687 -4.895 1.00 25.00 H new ATOM 0 HD11 ILE A 148 2.703 21.099 -8.445 1.00 25.00 H new ATOM 0 HD12 ILE A 148 3.564 19.599 -8.027 1.00 25.00 H new ATOM 0 HD13 ILE A 148 1.790 19.672 -7.899 1.00 25.00 H new ATOM 2258 N LEU A 149 2.586 19.283 -1.838 1.00 25.00 N ATOM 2259 CA LEU A 149 2.498 18.298 -0.776 1.00 25.00 C ATOM 2260 C LEU A 149 1.259 17.440 -0.976 1.00 25.00 C ATOM 2261 O LEU A 149 0.260 17.917 -1.400 1.00 25.00 O ATOM 2262 CB LEU A 149 2.455 18.951 0.596 1.00 25.00 C ATOM 2263 CG LEU A 149 3.704 19.750 1.074 1.00 25.00 C ATOM 2264 CD1 LEU A 149 3.321 21.261 1.199 1.00 50.00 C ATOM 2265 CD2 LEU A 149 4.271 19.190 2.397 1.00 50.00 C ATOM 0 H LEU A 149 1.909 20.040 -1.743 1.00 25.00 H new ATOM 0 HA LEU A 149 3.392 17.676 -0.821 1.00 25.00 H new ATOM 0 HB2 LEU A 149 1.600 19.627 0.615 1.00 25.00 H new ATOM 0 HB3 LEU A 149 2.260 18.169 1.330 1.00 25.00 H new ATOM 0 HG LEU A 149 4.500 19.644 0.337 1.00 25.00 H new ATOM 0 HD11 LEU A 149 4.189 21.830 1.533 1.00 50.00 H new ATOM 0 HD12 LEU A 149 2.994 21.635 0.229 1.00 50.00 H new ATOM 0 HD13 LEU A 149 2.513 21.373 1.922 1.00 50.00 H new ATOM 0 HD21 LEU A 149 5.141 19.775 2.696 1.00 50.00 H new ATOM 0 HD22 LEU A 149 3.509 19.250 3.174 1.00 50.00 H new ATOM 0 HD23 LEU A 149 4.564 18.150 2.256 1.00 50.00 H new ATOM 2277 N ALA A 150 1.328 16.177 -0.641 1.00 25.00 N ATOM 2278 CA ALA A 150 0.193 15.296 -0.670 1.00 25.00 C ATOM 2279 C ALA A 150 0.112 14.347 0.553 1.00 25.00 C ATOM 2280 O ALA A 150 1.214 13.977 1.038 1.00 25.00 O ATOM 2281 CB ALA A 150 0.258 14.457 -1.927 1.00 25.00 C ATOM 0 H ALA A 150 2.190 15.726 -0.335 1.00 25.00 H new ATOM 0 HA ALA A 150 -0.696 15.927 -0.645 1.00 25.00 H new ATOM 0 HB1 ALA A 150 -0.599 13.784 -1.960 1.00 25.00 H new ATOM 0 HB2 ALA A 150 0.241 15.109 -2.801 1.00 25.00 H new ATOM 0 HB3 ALA A 150 1.178 13.873 -1.927 1.00 25.00 H new ATOM 2287 N VAL A 151 -1.090 13.952 0.989 1.00 25.00 N ATOM 2288 CA VAL A 151 -1.307 13.084 2.180 1.00 25.00 C ATOM 2289 C VAL A 151 -2.441 12.118 1.947 1.00 25.00 C ATOM 2290 O VAL A 151 -3.483 12.553 1.376 1.00 25.00 O ATOM 2291 CB VAL A 151 -1.743 13.931 3.427 1.00 25.00 C ATOM 2292 CG1 VAL A 151 -1.901 12.984 4.646 1.00 50.00 C ATOM 2293 CG2 VAL A 151 -0.682 14.990 3.789 1.00 50.00 C ATOM 0 H VAL A 151 -1.958 14.223 0.527 1.00 25.00 H new ATOM 0 HA VAL A 151 -0.362 12.569 2.350 1.00 25.00 H new ATOM 0 HB VAL A 151 -2.679 14.433 3.182 1.00 25.00 H new ATOM 0 HG11 VAL A 151 -2.204 13.562 5.519 1.00 50.00 H new ATOM 0 HG12 VAL A 151 -2.660 12.233 4.427 1.00 50.00 H new ATOM 0 HG13 VAL A 151 -0.950 12.491 4.849 1.00 50.00 H new ATOM 0 HG21 VAL A 151 -1.016 15.558 4.657 1.00 50.00 H new ATOM 0 HG22 VAL A 151 0.261 14.496 4.021 1.00 50.00 H new ATOM 0 HG23 VAL A 151 -0.540 15.666 2.946 1.00 50.00 H new ATOM 2303 N TRP A 152 -2.222 10.840 2.174 1.00 25.00 N ATOM 2304 CA TRP A 152 -3.267 9.826 1.916 1.00 25.00 C ATOM 2305 C TRP A 152 -3.602 9.139 3.193 1.00 25.00 C ATOM 2306 O TRP A 152 -2.692 8.523 3.746 1.00 25.00 O ATOM 2307 CB TRP A 152 -2.799 8.876 0.768 1.00 25.00 C ATOM 2308 CG TRP A 152 -3.871 8.138 0.069 1.00 25.00 C ATOM 2309 CD1 TRP A 152 -4.696 7.219 0.594 1.00 25.00 C ATOM 2310 CD2 TRP A 152 -4.154 8.157 -1.343 1.00 25.00 C ATOM 2311 NE1 TRP A 152 -5.467 6.608 -0.347 1.00 25.00 N ATOM 2312 CE2 TRP A 152 -5.202 7.192 -1.530 1.00 25.00 C ATOM 2313 CE3 TRP A 152 -3.747 8.897 -2.502 1.00 25.00 C ATOM 2314 CZ2 TRP A 152 -5.846 6.995 -2.764 1.00 25.00 C ATOM 2315 CZ3 TRP A 152 -4.412 8.698 -3.767 1.00 25.00 C ATOM 2316 CH2 TRP A 152 -5.483 7.744 -3.826 1.00 25.00 C ATOM 0 H TRP A 152 -1.344 10.464 2.533 1.00 25.00 H new ATOM 0 HA TRP A 152 -4.193 10.281 1.564 1.00 25.00 H new ATOM 0 HB2 TRP A 152 -2.251 9.466 0.033 1.00 25.00 H new ATOM 0 HB3 TRP A 152 -2.097 8.153 1.183 1.00 25.00 H new ATOM 0 HD1 TRP A 152 -4.743 6.989 1.648 1.00 25.00 H new ATOM 0 HE1 TRP A 152 -6.126 5.846 -0.185 1.00 25.00 H new ATOM 0 HE3 TRP A 152 -2.937 9.608 -2.428 1.00 25.00 H new ATOM 0 HZ2 TRP A 152 -6.623 6.252 -2.861 1.00 25.00 H new ATOM 0 HZ3 TRP A 152 -4.112 9.251 -4.645 1.00 25.00 H new ATOM 0 HH2 TRP A 152 -6.019 7.621 -4.756 1.00 25.00 H new ATOM 2327 N ASP A 153 -4.824 9.210 3.640 1.00 25.00 N ATOM 2328 CA ASP A 153 -5.154 8.558 4.878 1.00 25.00 C ATOM 2329 C ASP A 153 -5.630 7.200 4.449 1.00 25.00 C ATOM 2330 O ASP A 153 -6.326 7.061 3.446 1.00 25.00 O ATOM 2331 CB ASP A 153 -6.222 9.313 5.684 1.00 25.00 C ATOM 2332 CG ASP A 153 -5.672 10.541 6.320 1.00 25.00 C ATOM 2333 OD1 ASP A 153 -4.665 10.450 7.054 1.00 25.00 O ATOM 2334 OD2 ASP A 153 -6.270 11.617 6.133 1.00 25.00 O1- ATOM 0 H ASP A 153 -5.592 9.699 3.180 1.00 25.00 H new ATOM 0 HA ASP A 153 -4.302 8.514 5.556 1.00 25.00 H new ATOM 0 HB2 ASP A 153 -7.049 9.583 5.027 1.00 25.00 H new ATOM 0 HB3 ASP A 153 -6.628 8.656 6.453 1.00 25.00 H new ATOM 2339 N VAL A 154 -5.205 6.150 5.111 1.00 25.00 N ATOM 2340 CA VAL A 154 -5.499 4.782 4.630 1.00 25.00 C ATOM 2341 C VAL A 154 -6.309 4.172 5.733 1.00 25.00 C ATOM 2342 O VAL A 154 -5.995 4.294 6.918 1.00 25.00 O ATOM 2343 CB VAL A 154 -4.158 4.082 4.421 1.00 25.00 C ATOM 2344 CG1 VAL A 154 -4.343 2.546 4.114 1.00 50.00 C ATOM 2345 CG2 VAL A 154 -3.247 4.796 3.460 1.00 50.00 C ATOM 0 H VAL A 154 -4.661 6.193 5.973 1.00 25.00 H new ATOM 0 HA VAL A 154 -6.045 4.722 3.689 1.00 25.00 H new ATOM 0 HB VAL A 154 -3.626 4.138 5.371 1.00 25.00 H new ATOM 0 HG11 VAL A 154 -3.366 2.083 3.971 1.00 50.00 H new ATOM 0 HG12 VAL A 154 -4.853 2.067 4.950 1.00 50.00 H new ATOM 0 HG13 VAL A 154 -4.937 2.425 3.208 1.00 50.00 H new ATOM 0 HG21 VAL A 154 -2.314 4.241 3.362 1.00 50.00 H new ATOM 0 HG22 VAL A 154 -3.730 4.868 2.486 1.00 50.00 H new ATOM 0 HG23 VAL A 154 -3.035 5.797 3.835 1.00 50.00 H new ATOM 2355 N ALA A 155 -7.492 3.613 5.497 1.00 25.00 N ATOM 2356 CA ALA A 155 -8.485 3.250 6.548 1.00 25.00 C ATOM 2357 C ALA A 155 -8.122 2.111 7.413 1.00 25.00 C ATOM 2358 O ALA A 155 -8.613 1.976 8.542 1.00 25.00 O ATOM 2359 CB ALA A 155 -9.822 2.916 5.770 1.00 25.00 C ATOM 0 H ALA A 155 -7.811 3.388 4.555 1.00 25.00 H new ATOM 0 HA ALA A 155 -8.561 4.089 7.240 1.00 25.00 H new ATOM 0 HB1 ALA A 155 -10.599 2.640 6.483 1.00 25.00 H new ATOM 0 HB2 ALA A 155 -10.143 3.791 5.205 1.00 25.00 H new ATOM 0 HB3 ALA A 155 -9.647 2.086 5.085 1.00 25.00 H new ATOM 2365 N ASP A 156 -7.165 1.315 6.992 1.00 25.00 N ATOM 2366 CA ASP A 156 -6.680 0.072 7.609 1.00 25.00 C ATOM 2367 C ASP A 156 -5.766 0.327 8.827 1.00 25.00 C ATOM 2368 O ASP A 156 -5.629 -0.495 9.718 1.00 25.00 O ATOM 2369 CB ASP A 156 -5.851 -0.723 6.546 1.00 25.00 C ATOM 2370 CG ASP A 156 -6.674 -1.212 5.422 1.00 25.00 C ATOM 2371 OD1 ASP A 156 -7.858 -1.576 5.649 1.00 25.00 O ATOM 2372 OD2 ASP A 156 -6.161 -1.260 4.285 1.00 25.00 O1- ATOM 0 H ASP A 156 -6.653 1.527 6.136 1.00 25.00 H new ATOM 0 HA ASP A 156 -7.554 -0.483 7.951 1.00 25.00 H new ATOM 0 HB2 ASP A 156 -5.059 -0.083 6.158 1.00 25.00 H new ATOM 0 HB3 ASP A 156 -5.367 -1.571 7.031 1.00 25.00 H new ATOM 2377 N THR A 157 -5.104 1.458 8.800 1.00 25.00 N ATOM 2378 CA THR A 157 -3.890 1.660 9.586 1.00 25.00 C ATOM 2379 C THR A 157 -3.777 2.969 10.345 1.00 25.00 C ATOM 2380 O THR A 157 -4.407 3.923 9.949 1.00 25.00 O ATOM 2381 CB THR A 157 -2.620 1.464 8.700 1.00 25.00 C ATOM 2382 OG1 THR A 157 -2.611 2.307 7.568 1.00 25.00 O ATOM 2383 CG2 THR A 157 -2.383 0.034 8.309 1.00 25.00 C ATOM 0 H THR A 157 -5.381 2.265 8.240 1.00 25.00 H new ATOM 0 HA THR A 157 -3.962 0.895 10.359 1.00 25.00 H new ATOM 0 HB THR A 157 -1.785 1.759 9.336 1.00 25.00 H new ATOM 0 HG1 THR A 157 -2.325 3.206 7.832 1.00 25.00 H new ATOM 0 HG21 THR A 157 -1.485 -0.031 7.694 1.00 25.00 H new ATOM 0 HG22 THR A 157 -2.254 -0.572 9.206 1.00 25.00 H new ATOM 0 HG23 THR A 157 -3.238 -0.335 7.742 1.00 25.00 H new ATOM 2391 N GLU A 158 -2.878 3.079 11.284 1.00 25.00 N ATOM 2392 CA GLU A 158 -2.576 4.333 11.967 1.00 25.00 C ATOM 2393 C GLU A 158 -1.392 5.082 11.351 1.00 25.00 C ATOM 2394 O GLU A 158 -1.230 6.253 11.421 1.00 25.00 O ATOM 2395 CB GLU A 158 -2.271 3.994 13.427 1.00 25.00 C ATOM 2396 CG GLU A 158 -2.021 5.243 14.405 1.00 25.00 C ATOM 2397 CD GLU A 158 -1.851 4.779 15.846 1.00 25.00 C ATOM 2398 OE1 GLU A 158 -2.226 5.597 16.774 1.00 25.00 O ATOM 2399 OE2 GLU A 158 -1.535 3.589 16.130 1.00 25.00 O1- ATOM 0 H GLU A 158 -2.317 2.292 11.611 1.00 25.00 H new ATOM 0 HA GLU A 158 -3.436 4.997 11.873 1.00 25.00 H new ATOM 0 HB2 GLU A 158 -3.100 3.408 13.824 1.00 25.00 H new ATOM 0 HB3 GLU A 158 -1.388 3.355 13.454 1.00 25.00 H new ATOM 0 HG2 GLU A 158 -1.132 5.787 14.087 1.00 25.00 H new ATOM 0 HG3 GLU A 158 -2.860 5.936 14.338 1.00 25.00 H new ATOM 2406 N ASN A 159 -0.624 4.382 10.545 1.00 25.00 N ATOM 2407 CA ASN A 159 0.185 5.027 9.501 1.00 25.00 C ATOM 2408 C ASN A 159 -0.703 5.651 8.424 1.00 25.00 C ATOM 2409 O ASN A 159 -1.820 5.097 8.106 1.00 25.00 O ATOM 2410 CB ASN A 159 1.159 4.056 8.863 1.00 25.00 C ATOM 2411 CG ASN A 159 2.367 3.769 9.641 1.00 25.00 C ATOM 2412 OD1 ASN A 159 3.266 4.600 9.760 1.00 25.00 O ATOM 2413 ND2 ASN A 159 2.353 2.618 10.268 1.00 25.00 N ATOM 0 H ASN A 159 -0.534 3.367 10.582 1.00 25.00 H new ATOM 0 HA ASN A 159 0.759 5.815 9.988 1.00 25.00 H new ATOM 0 HB2 ASN A 159 0.638 3.117 8.675 1.00 25.00 H new ATOM 0 HB3 ASN A 159 1.459 4.454 7.894 1.00 25.00 H new ATOM 0 HD21 ASN A 159 3.117 2.370 10.896 1.00 25.00 H new ATOM 0 HD22 ASN A 159 1.578 1.970 10.127 1.00 25.00 H new ATOM 2420 N ALA A 160 -0.166 6.643 7.761 1.00 25.00 N ATOM 2421 CA ALA A 160 -0.816 7.352 6.647 1.00 25.00 C ATOM 2422 C ALA A 160 0.331 7.783 5.797 1.00 25.00 C ATOM 2423 O ALA A 160 1.379 8.204 6.324 1.00 25.00 O ATOM 2424 CB ALA A 160 -1.511 8.571 7.226 1.00 25.00 C ATOM 0 H ALA A 160 0.764 7.004 7.975 1.00 25.00 H new ATOM 0 HA ALA A 160 -1.546 6.760 6.096 1.00 25.00 H new ATOM 0 HB1 ALA A 160 -2.005 9.122 6.426 1.00 25.00 H new ATOM 0 HB2 ALA A 160 -2.252 8.253 7.959 1.00 25.00 H new ATOM 0 HB3 ALA A 160 -0.775 9.214 7.709 1.00 25.00 H new ATOM 2430 N PHE A 161 0.189 7.714 4.468 1.00 25.00 N ATOM 2431 CA PHE A 161 1.298 7.982 3.568 1.00 25.00 C ATOM 2432 C PHE A 161 1.327 9.516 3.411 1.00 25.00 C ATOM 2433 O PHE A 161 0.386 10.233 3.796 1.00 25.00 O ATOM 2434 CB PHE A 161 1.054 7.401 2.167 1.00 25.00 C ATOM 2435 CG PHE A 161 1.442 5.964 2.023 1.00 25.00 C ATOM 2436 CD1 PHE A 161 0.394 5.011 1.985 1.00 50.00 C ATOM 2437 CD2 PHE A 161 2.801 5.457 1.837 1.00 50.00 C ATOM 2438 CE1 PHE A 161 0.703 3.595 1.888 1.00 25.00 C ATOM 2439 CE2 PHE A 161 3.094 4.065 1.837 1.00 25.00 C ATOM 2440 CZ PHE A 161 2.001 3.095 1.856 1.00 25.00 C ATOM 0 H PHE A 161 -0.685 7.474 4.000 1.00 25.00 H new ATOM 0 HA PHE A 161 2.213 7.544 3.968 1.00 25.00 H new ATOM 0 HB2 PHE A 161 -0.003 7.507 1.921 1.00 25.00 H new ATOM 0 HB3 PHE A 161 1.611 7.991 1.439 1.00 25.00 H new ATOM 0 HD1 PHE A 161 -0.635 5.337 2.028 1.00 50.00 H new ATOM 0 HD2 PHE A 161 3.607 6.161 1.695 1.00 50.00 H new ATOM 0 HE1 PHE A 161 -0.117 2.894 1.838 1.00 25.00 H new ATOM 0 HE2 PHE A 161 4.119 3.727 1.823 1.00 25.00 H new ATOM 0 HZ PHE A 161 2.193 2.032 1.846 1.00 25.00 H new ATOM 2450 N TYR A 162 2.437 9.975 2.874 1.00 25.00 N ATOM 2451 CA TYR A 162 2.570 11.314 2.324 1.00 25.00 C ATOM 2452 C TYR A 162 3.636 11.304 1.222 1.00 25.00 C ATOM 2453 O TYR A 162 4.412 10.347 1.120 1.00 25.00 O ATOM 2454 CB TYR A 162 2.968 12.338 3.354 1.00 25.00 C ATOM 2455 CG TYR A 162 4.379 12.225 3.880 1.00 25.00 C ATOM 2456 CD1 TYR A 162 4.672 11.340 4.905 1.00 50.00 C ATOM 2457 CD2 TYR A 162 5.393 12.995 3.358 1.00 50.00 C ATOM 2458 CE1 TYR A 162 5.959 11.316 5.541 1.00 25.00 C ATOM 2459 CE2 TYR A 162 6.716 12.917 3.914 1.00 25.00 C ATOM 2460 CZ TYR A 162 6.980 12.123 5.015 1.00 25.00 C ATOM 2461 OH TYR A 162 8.253 12.115 5.494 1.00 25.00 O ATOM 0 H TYR A 162 3.290 9.420 2.804 1.00 25.00 H new ATOM 0 HA TYR A 162 1.590 11.594 1.936 1.00 25.00 H new ATOM 0 HB2 TYR A 162 2.840 13.330 2.921 1.00 25.00 H new ATOM 0 HB3 TYR A 162 2.279 12.266 4.196 1.00 25.00 H new ATOM 0 HD1 TYR A 162 3.911 10.649 5.235 1.00 50.00 H new ATOM 0 HD2 TYR A 162 5.194 13.659 2.530 1.00 50.00 H new ATOM 0 HE1 TYR A 162 6.137 10.692 6.404 1.00 25.00 H new ATOM 0 HE2 TYR A 162 7.516 13.487 3.465 1.00 25.00 H new ATOM 0 HH TYR A 162 8.799 12.749 4.984 1.00 25.00 H new ATOM 2471 N GLN A 163 3.622 12.321 0.337 1.00 25.00 N ATOM 2472 CA GLN A 163 4.671 12.461 -0.644 1.00 25.00 C ATOM 2473 C GLN A 163 4.920 13.934 -0.950 1.00 25.00 C ATOM 2474 O GLN A 163 4.017 14.720 -0.665 1.00 25.00 O ATOM 2475 CB GLN A 163 4.389 11.642 -1.944 1.00 25.00 C ATOM 2476 CG GLN A 163 3.347 12.133 -2.795 1.00 25.00 C ATOM 2477 CD GLN A 163 3.244 11.291 -4.045 1.00 25.00 C ATOM 2478 OE1 GLN A 163 4.158 11.085 -4.823 1.00 25.00 O ATOM 2479 NE2 GLN A 163 2.047 10.848 -4.304 1.00 25.00 N ATOM 0 H GLN A 163 2.899 13.039 0.296 1.00 25.00 H new ATOM 0 HA GLN A 163 5.579 12.040 -0.213 1.00 25.00 H new ATOM 0 HB2 GLN A 163 5.310 11.596 -2.525 1.00 25.00 H new ATOM 0 HB3 GLN A 163 4.142 10.620 -1.657 1.00 25.00 H new ATOM 0 HG2 GLN A 163 2.397 12.120 -2.261 1.00 25.00 H new ATOM 0 HG3 GLN A 163 3.547 13.170 -3.064 1.00 25.00 H new ATOM 0 HE21 GLN A 163 1.285 11.024 -3.649 1.00 25.00 H new ATOM 0 HE22 GLN A 163 1.871 10.325 -5.162 1.00 25.00 H new ATOM 2488 N VAL A 164 6.114 14.342 -1.394 1.00 25.00 N ATOM 2489 CA VAL A 164 6.490 15.760 -1.481 1.00 25.00 C ATOM 2490 C VAL A 164 7.228 15.902 -2.781 1.00 25.00 C ATOM 2491 O VAL A 164 8.150 15.154 -3.012 1.00 25.00 O ATOM 2492 CB VAL A 164 7.298 16.195 -0.231 1.00 25.00 C ATOM 2493 CG1 VAL A 164 6.358 16.321 1.069 1.00 75.00 C ATOM 2494 CG2 VAL A 164 8.398 15.256 0.198 1.00 75.00 C ATOM 0 H VAL A 164 6.846 13.702 -1.703 1.00 25.00 H new ATOM 0 HA VAL A 164 5.630 16.430 -1.480 1.00 25.00 H new ATOM 0 HB VAL A 164 7.729 17.141 -0.559 1.00 25.00 H new ATOM 0 HG11 VAL A 164 6.960 16.628 1.925 1.00 75.00 H new ATOM 0 HG12 VAL A 164 5.582 17.064 0.886 1.00 75.00 H new ATOM 0 HG13 VAL A 164 5.895 15.357 1.278 1.00 75.00 H new ATOM 0 HG21 VAL A 164 8.896 15.658 1.080 1.00 75.00 H new ATOM 0 HG22 VAL A 164 7.972 14.281 0.435 1.00 75.00 H new ATOM 0 HG23 VAL A 164 9.121 15.150 -0.610 1.00 75.00 H new ATOM 2504 N ILE A 165 6.854 16.849 -3.642 1.00 25.00 N ATOM 2505 CA ILE A 165 7.414 17.045 -4.969 1.00 25.00 C ATOM 2506 C ILE A 165 7.705 18.507 -5.089 1.00 25.00 C ATOM 2507 O ILE A 165 6.851 19.383 -4.836 1.00 25.00 O ATOM 2508 CB ILE A 165 6.371 16.586 -6.069 1.00 25.00 C ATOM 2509 CG1 ILE A 165 6.113 15.076 -5.833 1.00 25.00 C ATOM 2510 CG2 ILE A 165 6.893 16.843 -7.521 1.00 25.00 C ATOM 2511 CD1 ILE A 165 5.058 14.530 -6.698 1.00 25.00 C ATOM 0 H ILE A 165 6.123 17.525 -3.420 1.00 25.00 H new ATOM 0 HA ILE A 165 8.319 16.456 -5.116 1.00 25.00 H new ATOM 0 HB ILE A 165 5.452 17.165 -5.978 1.00 25.00 H new ATOM 0 HG12 ILE A 165 7.037 14.524 -6.005 1.00 25.00 H new ATOM 0 HG13 ILE A 165 5.837 14.919 -4.790 1.00 25.00 H new ATOM 0 HG21 ILE A 165 6.144 16.512 -8.241 1.00 25.00 H new ATOM 0 HG22 ILE A 165 7.082 17.908 -7.657 1.00 25.00 H new ATOM 0 HG23 ILE A 165 7.818 16.288 -7.679 1.00 25.00 H new ATOM 0 HD11 ILE A 165 4.925 13.469 -6.485 1.00 25.00 H new ATOM 0 HD12 ILE A 165 4.123 15.058 -6.509 1.00 25.00 H new ATOM 0 HD13 ILE A 165 5.342 14.657 -7.743 1.00 25.00 H new ATOM 2523 N ASP A 166 8.888 18.949 -5.441 1.00 25.00 N ATOM 2524 CA ASP A 166 9.275 20.349 -5.628 1.00 25.00 C ATOM 2525 C ASP A 166 8.924 20.774 -7.069 1.00 25.00 C ATOM 2526 O ASP A 166 9.218 20.064 -8.025 1.00 25.00 O ATOM 2527 CB ASP A 166 10.738 20.403 -5.318 1.00 25.00 C ATOM 2528 CG ASP A 166 11.271 21.795 -5.328 1.00 25.00 C ATOM 2529 OD1 ASP A 166 11.348 22.363 -6.410 1.00 25.00 O ATOM 2530 OD2 ASP A 166 11.790 22.287 -4.322 1.00 25.00 O1- ATOM 0 H ASP A 166 9.663 18.310 -5.618 1.00 25.00 H new ATOM 0 HA ASP A 166 8.748 21.048 -4.978 1.00 25.00 H new ATOM 0 HB2 ASP A 166 10.916 19.956 -4.340 1.00 25.00 H new ATOM 0 HB3 ASP A 166 11.283 19.803 -6.047 1.00 25.00 H new ATOM 2535 N VAL A 167 8.327 21.942 -7.334 1.00 25.00 N ATOM 2536 CA VAL A 167 8.093 22.388 -8.656 1.00 25.00 C ATOM 2537 C VAL A 167 8.594 23.797 -8.624 1.00 25.00 C ATOM 2538 O VAL A 167 8.205 24.597 -7.770 1.00 25.00 O ATOM 2539 CB VAL A 167 6.632 22.236 -9.211 1.00 25.00 C ATOM 2540 CG1 VAL A 167 6.246 20.692 -9.316 1.00 50.00 C ATOM 2541 CG2 VAL A 167 5.612 22.995 -8.324 1.00 50.00 C ATOM 0 H VAL A 167 8.002 22.586 -6.613 1.00 25.00 H new ATOM 0 HA VAL A 167 8.608 21.753 -9.377 1.00 25.00 H new ATOM 0 HB VAL A 167 6.597 22.678 -10.207 1.00 25.00 H new ATOM 0 HG11 VAL A 167 5.231 20.596 -9.702 1.00 50.00 H new ATOM 0 HG12 VAL A 167 6.939 20.189 -9.990 1.00 50.00 H new ATOM 0 HG13 VAL A 167 6.303 20.235 -8.328 1.00 50.00 H new ATOM 0 HG21 VAL A 167 4.610 22.871 -8.734 1.00 50.00 H new ATOM 0 HG22 VAL A 167 5.642 22.594 -7.311 1.00 50.00 H new ATOM 0 HG23 VAL A 167 5.866 24.055 -8.302 1.00 50.00 H new ATOM 2551 N ASP A 168 9.355 24.221 -9.627 1.00 25.00 N ATOM 2552 CA ASP A 168 9.760 25.617 -9.814 1.00 25.00 C ATOM 2553 C ASP A 168 8.639 26.284 -10.658 1.00 25.00 C ATOM 2554 O ASP A 168 8.648 26.045 -11.874 1.00 25.00 O ATOM 2555 CB ASP A 168 11.128 25.670 -10.433 1.00 25.00 C ATOM 2556 CG ASP A 168 11.523 27.118 -10.716 1.00 25.00 C ATOM 2557 OD1 ASP A 168 12.531 27.332 -11.489 1.00 25.00 O ATOM 2558 OD2 ASP A 168 10.953 28.072 -10.145 1.00 25.00 O1- ATOM 0 H ASP A 168 9.716 23.596 -10.348 1.00 25.00 H new ATOM 0 HA ASP A 168 9.859 26.168 -8.879 1.00 25.00 H new ATOM 0 HB2 ASP A 168 11.856 25.211 -9.764 1.00 25.00 H new ATOM 0 HB3 ASP A 168 11.139 25.095 -11.359 1.00 25.00 H new ATOM 2563 N LEU A 169 7.695 27.014 -10.101 1.00 25.00 N ATOM 2564 CA LEU A 169 6.584 27.573 -10.826 1.00 25.00 C ATOM 2565 C LEU A 169 6.940 28.915 -11.375 1.00 25.00 C ATOM 2566 O LEU A 169 7.403 29.789 -10.634 1.00 25.00 O ATOM 2567 CB LEU A 169 5.357 27.585 -9.875 1.00 25.00 C ATOM 2568 CG LEU A 169 4.487 26.337 -9.891 1.00 25.00 C ATOM 2569 CD1 LEU A 169 3.710 26.249 -8.590 1.00 50.00 C ATOM 2570 CD2 LEU A 169 3.508 26.356 -11.018 1.00 50.00 C ATOM 0 H LEU A 169 7.683 27.238 -9.106 1.00 25.00 H new ATOM 0 HA LEU A 169 6.328 26.970 -11.697 1.00 25.00 H new ATOM 0 HB2 LEU A 169 5.713 27.742 -8.857 1.00 25.00 H new ATOM 0 HB3 LEU A 169 4.733 28.442 -10.130 1.00 25.00 H new ATOM 0 HG LEU A 169 5.147 25.479 -10.016 1.00 25.00 H new ATOM 0 HD11 LEU A 169 3.086 25.356 -8.599 1.00 50.00 H new ATOM 0 HD12 LEU A 169 4.406 26.197 -7.753 1.00 50.00 H new ATOM 0 HD13 LEU A 169 3.079 27.131 -8.483 1.00 50.00 H new ATOM 0 HD21 LEU A 169 2.907 25.447 -10.993 1.00 50.00 H new ATOM 0 HD22 LEU A 169 2.857 27.225 -10.920 1.00 50.00 H new ATOM 0 HD23 LEU A 169 4.045 26.410 -11.965 1.00 50.00 H new ATOM 2582 N VAL A 170 6.719 29.121 -12.678 1.00 25.00 N ATOM 2583 CA VAL A 170 7.187 30.373 -13.301 1.00 25.00 C ATOM 2584 C VAL A 170 5.994 30.949 -14.140 1.00 25.00 C ATOM 2585 O VAL A 170 4.985 30.255 -14.385 1.00 25.00 O ATOM 2586 CB VAL A 170 8.432 30.094 -14.162 1.00 25.00 C ATOM 2587 CG1 VAL A 170 9.599 29.612 -13.247 1.00 50.00 C ATOM 2588 CG2 VAL A 170 8.030 29.106 -15.338 1.00 50.00 C ATOM 0 H VAL A 170 6.241 28.471 -13.302 1.00 25.00 H new ATOM 0 HA VAL A 170 7.486 31.109 -12.555 1.00 25.00 H new ATOM 0 HB VAL A 170 8.808 30.994 -14.648 1.00 25.00 H new ATOM 0 HG11 VAL A 170 10.481 29.414 -13.856 1.00 50.00 H new ATOM 0 HG12 VAL A 170 9.830 30.385 -12.514 1.00 50.00 H new ATOM 0 HG13 VAL A 170 9.303 28.699 -12.730 1.00 50.00 H new ATOM 0 HG21 VAL A 170 8.904 28.901 -15.956 1.00 50.00 H new ATOM 0 HG22 VAL A 170 7.656 28.173 -14.917 1.00 50.00 H new ATOM 0 HG23 VAL A 170 7.254 29.565 -15.950 1.00 50.00 H new ATOM 2598 N ASN A 171 6.154 32.201 -14.576 1.00 25.00 N ATOM 2599 CA ASN A 171 5.211 32.853 -15.353 1.00 25.00 C ATOM 2600 C ASN A 171 5.446 32.427 -16.763 1.00 25.00 C ATOM 2601 O ASN A 171 6.602 32.261 -17.129 1.00 25.00 O ATOM 2602 CB ASN A 171 5.620 34.337 -15.248 1.00 25.00 C ATOM 2603 CG ASN A 171 4.835 35.183 -16.146 1.00 25.00 C ATOM 2604 OD1 ASN A 171 3.646 35.378 -16.040 1.00 25.00 O ATOM 2605 ND2 ASN A 171 5.557 35.829 -17.044 1.00 25.00 N ATOM 0 H ASN A 171 6.978 32.765 -14.369 1.00 25.00 H new ATOM 0 HA ASN A 171 4.180 32.661 -15.057 1.00 25.00 H new ATOM 0 HB2 ASN A 171 5.489 34.678 -14.221 1.00 25.00 H new ATOM 0 HB3 ASN A 171 6.679 34.440 -15.486 1.00 25.00 H new ATOM 0 HD21 ASN A 171 5.113 36.507 -17.664 1.00 25.00 H new ATOM 0 HD22 ASN A 171 6.559 35.650 -17.118 1.00 25.00 H new ATOM 2612 N LYS A 172 4.455 32.302 -17.624 1.00 25.00 N ATOM 2613 CA LYS A 172 4.769 32.078 -19.057 1.00 25.00 C ATOM 2614 C LYS A 172 5.228 33.342 -19.680 1.00 25.00 C ATOM 2615 O LYS A 172 6.006 33.239 -20.631 1.00 25.00 O ATOM 2616 CB LYS A 172 3.488 31.625 -19.793 1.00 25.00 C ATOM 2617 CG LYS A 172 3.072 30.221 -19.269 1.00 25.00 C ATOM 2618 CD LYS A 172 1.885 29.721 -20.103 1.00 25.00 C ATOM 2619 CE LYS A 172 1.459 28.353 -19.635 1.00 25.00 C ATOM 2620 NZ LYS A 172 0.361 27.694 -20.357 1.00 25.00 N1+ ATOM 2621 OXT LYS A 172 4.629 34.433 -19.384 1.00 25.00 O1- ATOM 0 H LYS A 172 3.463 32.346 -17.391 1.00 25.00 H new ATOM 0 HA LYS A 172 5.549 31.320 -19.131 1.00 25.00 H new ATOM 0 HB2 LYS A 172 2.684 32.342 -19.626 1.00 25.00 H new ATOM 0 HB3 LYS A 172 3.665 31.588 -20.868 1.00 25.00 H new ATOM 0 HG2 LYS A 172 3.908 29.526 -19.345 1.00 25.00 H new ATOM 0 HG3 LYS A 172 2.798 30.276 -18.215 1.00 25.00 H new ATOM 0 HD2 LYS A 172 1.052 30.418 -20.017 1.00 25.00 H new ATOM 0 HD3 LYS A 172 2.162 29.683 -21.157 1.00 25.00 H new ATOM 0 HE2 LYS A 172 2.329 27.698 -19.678 1.00 25.00 H new ATOM 0 HE3 LYS A 172 1.171 28.432 -18.587 1.00 25.00 H new ATOM 0 HZ1 LYS A 172 0.174 26.764 -19.930 1.00 25.00 H new ATOM 0 HZ2 LYS A 172 -0.495 28.281 -20.297 1.00 25.00 H new ATOM 0 HZ3 LYS A 172 0.627 27.570 -21.355 1.00 25.00 H new TER 2635 LYS A 172 HETATM 2636 CU CU1 A 173 1.096 1.776 -0.755 1.00 0.00 CU