USER MOD reduce.3.24.130724 H: found=0, std=0, add=778, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 775 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 69 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 71 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 44 TYR OH : rot 4:sc= 0.161 USER MOD Set 2.2: A 46 ASN : amide:sc= -0.261 K(o=-0.099,f=-1.2) USER MOD Single : A 1 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 1 GLN N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0419 USER MOD Single : A 7 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.0761) USER MOD Single : A 10 HIS : no HD1:sc= -0.551 K(o=-0.55,f=0.12) USER MOD Single : A 11 ASN : amide:sc=-0.00769 X(o=-0.0077,f=-0.15) USER MOD Single : A 20 SER OG : rot 180:sc= 0.068 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 TYR OH : rot -148:sc= 0.53 USER MOD Single : A 30 HIS : no HD1:sc= -1.97 K(o=-2,f=-2.8!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 80:sc= 1.19 USER MOD Single : A 34 THR OG1 : rot 83:sc= 1.18 USER MOD Single : A 38 GLN : amide:sc= -0.0113 X(o=-0.011,f=0) USER MOD Single : A 43 HIS : no HE2:sc= -2.24 K(o=-2.2,f=-3.4!) USER MOD Single : A 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 47 ASN : amide:sc= 0.356 X(o=0.36,f=0) USER MOD Single : A 50 SER OG : rot 43:sc= 0.00269 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= 0 X(o=0,f=-0.05) USER MOD Single : A 56 GLN : amide:sc= -1.02 K(o=-1,f=-0.2) USER MOD Single : A 61 LYS NZ :NH3+ -167:sc= -0.112 (180deg=-0.487) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 169:sc= -0.0273 (180deg=-0.259) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0.0324 USER MOD Single : A 82 GLN : amide:sc= -0.293 X(o=-0.29,f=-0.063) USER MOD Single : A 85 ASN : amide:sc= -0.538 K(o=-0.54,f=-4!) USER MOD Single : A 88 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 90 HIS : no HE2:sc= 0.384 K(o=0.38,f=-2.6!) USER MOD Single : A 91 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 92 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 93 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 1 136.883 -10.466 8.624 1.00 0.00 N ATOM 2 CA GLN A 1 138.003 -9.527 8.915 1.00 0.00 C ATOM 3 C GLN A 1 139.211 -9.805 8.015 1.00 0.00 C ATOM 4 O GLN A 1 140.091 -10.595 8.364 1.00 0.00 O ATOM 5 CB GLN A 1 138.390 -9.668 10.393 1.00 0.00 C ATOM 6 CG GLN A 1 137.616 -8.736 11.316 1.00 0.00 C ATOM 7 CD GLN A 1 137.126 -9.421 12.579 1.00 0.00 C ATOM 8 OE1 GLN A 1 135.922 -9.506 12.823 1.00 0.00 O ATOM 9 NE2 GLN A 1 138.055 -9.911 13.394 1.00 0.00 N ATOM 0 H1 GLN A 1 136.080 -10.253 9.249 1.00 0.00 H new ATOM 0 H2 GLN A 1 136.588 -10.358 7.633 1.00 0.00 H new ATOM 0 H3 GLN A 1 137.198 -11.444 8.787 1.00 0.00 H new ATOM 0 HA GLN A 1 137.676 -8.507 8.711 1.00 0.00 H new ATOM 0 HB2 GLN A 1 138.223 -10.698 10.707 1.00 0.00 H new ATOM 0 HB3 GLN A 1 139.456 -9.470 10.501 1.00 0.00 H new ATOM 0 HG2 GLN A 1 138.252 -7.894 11.590 1.00 0.00 H new ATOM 0 HG3 GLN A 1 136.762 -8.327 10.777 1.00 0.00 H new ATOM 0 HE21 GLN A 1 139.042 -9.820 13.155 1.00 0.00 H new ATOM 0 HE22 GLN A 1 137.780 -10.378 14.258 1.00 0.00 H new ATOM 17 N SER A 2 139.241 -9.150 6.852 1.00 0.00 N ATOM 18 CA SER A 2 140.332 -9.323 5.894 1.00 0.00 C ATOM 19 C SER A 2 140.486 -8.087 5.005 1.00 0.00 C ATOM 20 O SER A 2 139.664 -7.171 5.059 1.00 0.00 O ATOM 21 CB SER A 2 140.075 -10.556 5.025 1.00 0.00 C ATOM 22 OG SER A 2 140.022 -11.735 5.811 1.00 0.00 O ATOM 0 H SER A 2 138.520 -8.494 6.552 1.00 0.00 H new ATOM 0 HA SER A 2 141.256 -9.460 6.455 1.00 0.00 H new ATOM 0 HB2 SER A 2 139.137 -10.434 4.484 1.00 0.00 H new ATOM 0 HB3 SER A 2 140.864 -10.649 4.278 1.00 0.00 H new ATOM 0 HG SER A 2 139.855 -12.507 5.231 1.00 0.00 H new ATOM 28 N ASP A 3 141.547 -8.077 4.185 1.00 0.00 N ATOM 29 CA ASP A 3 141.830 -6.966 3.268 1.00 0.00 C ATOM 30 C ASP A 3 142.194 -5.691 4.028 1.00 0.00 C ATOM 31 O ASP A 3 141.342 -5.076 4.672 1.00 0.00 O ATOM 32 CB ASP A 3 140.636 -6.704 2.342 1.00 0.00 C ATOM 33 CG ASP A 3 140.517 -7.739 1.239 1.00 0.00 C ATOM 34 OD1 ASP A 3 141.342 -7.707 0.302 1.00 0.00 O ATOM 35 OD2 ASP A 3 139.599 -8.583 1.315 1.00 0.00 O ATOM 0 H ASP A 3 142.229 -8.834 4.139 1.00 0.00 H new ATOM 0 HA ASP A 3 142.688 -7.257 2.662 1.00 0.00 H new ATOM 0 HB2 ASP A 3 139.719 -6.698 2.931 1.00 0.00 H new ATOM 0 HB3 ASP A 3 140.736 -5.714 1.897 1.00 0.00 H new ATOM 40 N VAL A 4 143.467 -5.298 3.942 1.00 0.00 N ATOM 41 CA VAL A 4 143.952 -4.093 4.616 1.00 0.00 C ATOM 42 C VAL A 4 143.886 -2.883 3.686 1.00 0.00 C ATOM 43 O VAL A 4 144.350 -2.942 2.546 1.00 0.00 O ATOM 44 CB VAL A 4 145.407 -4.259 5.114 1.00 0.00 C ATOM 45 CG1 VAL A 4 145.808 -3.088 6.001 1.00 0.00 C ATOM 46 CG2 VAL A 4 145.583 -5.576 5.857 1.00 0.00 C ATOM 0 H VAL A 4 144.181 -5.798 3.412 1.00 0.00 H new ATOM 0 HA VAL A 4 143.301 -3.934 5.476 1.00 0.00 H new ATOM 0 HB VAL A 4 146.061 -4.272 4.242 1.00 0.00 H new ATOM 0 HG11 VAL A 4 146.835 -3.224 6.341 1.00 0.00 H new ATOM 0 HG12 VAL A 4 145.733 -2.160 5.434 1.00 0.00 H new ATOM 0 HG13 VAL A 4 145.143 -3.041 6.864 1.00 0.00 H new ATOM 0 HG21 VAL A 4 146.615 -5.667 6.196 1.00 0.00 H new ATOM 0 HG22 VAL A 4 144.915 -5.600 6.718 1.00 0.00 H new ATOM 0 HG23 VAL A 4 145.346 -6.405 5.190 1.00 0.00 H new ATOM 56 N ARG A 5 143.311 -1.785 4.179 1.00 0.00 N ATOM 57 CA ARG A 5 143.193 -0.561 3.388 1.00 0.00 C ATOM 58 C ARG A 5 144.446 0.302 3.535 1.00 0.00 C ATOM 59 O ARG A 5 144.733 0.813 4.619 1.00 0.00 O ATOM 60 CB ARG A 5 141.957 0.239 3.813 1.00 0.00 C ATOM 61 CG ARG A 5 140.685 -0.155 3.079 1.00 0.00 C ATOM 62 CD ARG A 5 139.472 0.559 3.656 1.00 0.00 C ATOM 63 NE ARG A 5 138.898 1.518 2.713 1.00 0.00 N ATOM 64 CZ ARG A 5 138.112 1.179 1.687 1.00 0.00 C ATOM 65 NH1 ARG A 5 137.814 -0.099 1.456 1.00 0.00 N ATOM 66 NH2 ARG A 5 137.625 2.121 0.887 1.00 0.00 N ATOM 0 H ARG A 5 142.921 -1.719 5.119 1.00 0.00 H new ATOM 0 HA ARG A 5 143.086 -0.846 2.342 1.00 0.00 H new ATOM 0 HB2 ARG A 5 141.802 0.108 4.884 1.00 0.00 H new ATOM 0 HB3 ARG A 5 142.148 1.299 3.646 1.00 0.00 H new ATOM 0 HG2 ARG A 5 140.783 0.087 2.021 1.00 0.00 H new ATOM 0 HG3 ARG A 5 140.542 -1.233 3.147 1.00 0.00 H new ATOM 0 HD2 ARG A 5 138.716 -0.176 3.930 1.00 0.00 H new ATOM 0 HD3 ARG A 5 139.758 1.078 4.571 1.00 0.00 H new ATOM 0 HE ARG A 5 139.111 2.507 2.847 1.00 0.00 H new ATOM 0 HH11 ARG A 5 138.187 -0.828 2.065 1.00 0.00 H new ATOM 0 HH12 ARG A 5 137.213 -0.349 0.670 1.00 0.00 H new ATOM 0 HH21 ARG A 5 137.851 3.101 1.056 1.00 0.00 H new ATOM 0 HH22 ARG A 5 137.025 1.864 0.103 1.00 0.00 H new ATOM 80 N ILE A 6 145.191 0.459 2.440 1.00 0.00 N ATOM 81 CA ILE A 6 146.416 1.259 2.451 1.00 0.00 C ATOM 82 C ILE A 6 146.214 2.590 1.726 1.00 0.00 C ATOM 83 O ILE A 6 145.822 2.616 0.557 1.00 0.00 O ATOM 84 CB ILE A 6 147.594 0.497 1.797 1.00 0.00 C ATOM 85 CG1 ILE A 6 147.670 -0.939 2.329 1.00 0.00 C ATOM 86 CG2 ILE A 6 148.912 1.227 2.038 1.00 0.00 C ATOM 87 CD1 ILE A 6 147.928 -1.028 3.821 1.00 0.00 C ATOM 0 H ILE A 6 144.968 0.043 1.536 1.00 0.00 H new ATOM 0 HA ILE A 6 146.657 1.454 3.496 1.00 0.00 H new ATOM 0 HB ILE A 6 147.417 0.457 0.722 1.00 0.00 H new ATOM 0 HG12 ILE A 6 146.735 -1.451 2.101 1.00 0.00 H new ATOM 0 HG13 ILE A 6 148.462 -1.470 1.801 1.00 0.00 H new ATOM 0 HG21 ILE A 6 149.726 0.673 1.569 1.00 0.00 H new ATOM 0 HG22 ILE A 6 148.858 2.227 1.607 1.00 0.00 H new ATOM 0 HG23 ILE A 6 149.095 1.303 3.110 1.00 0.00 H new ATOM 0 HD11 ILE A 6 147.968 -2.075 4.121 1.00 0.00 H new ATOM 0 HD12 ILE A 6 148.877 -0.546 4.055 1.00 0.00 H new ATOM 0 HD13 ILE A 6 147.124 -0.527 4.360 1.00 0.00 H new ATOM 99 N LYS A 7 146.488 3.693 2.427 1.00 0.00 N ATOM 100 CA LYS A 7 146.343 5.030 1.852 1.00 0.00 C ATOM 101 C LYS A 7 147.711 5.664 1.604 1.00 0.00 C ATOM 102 O LYS A 7 148.434 5.992 2.547 1.00 0.00 O ATOM 103 CB LYS A 7 145.508 5.924 2.777 1.00 0.00 C ATOM 104 CG LYS A 7 145.269 7.322 2.223 1.00 0.00 C ATOM 105 CD LYS A 7 143.889 7.448 1.595 1.00 0.00 C ATOM 106 CE LYS A 7 143.062 8.533 2.270 1.00 0.00 C ATOM 107 NZ LYS A 7 141.626 8.151 2.383 1.00 0.00 N ATOM 0 H LYS A 7 146.812 3.685 3.394 1.00 0.00 H new ATOM 0 HA LYS A 7 145.827 4.934 0.896 1.00 0.00 H new ATOM 0 HB2 LYS A 7 144.546 5.445 2.959 1.00 0.00 H new ATOM 0 HB3 LYS A 7 146.011 6.005 3.741 1.00 0.00 H new ATOM 0 HG2 LYS A 7 145.373 8.054 3.024 1.00 0.00 H new ATOM 0 HG3 LYS A 7 146.031 7.554 1.478 1.00 0.00 H new ATOM 0 HD2 LYS A 7 143.991 7.675 0.534 1.00 0.00 H new ATOM 0 HD3 LYS A 7 143.367 6.494 1.668 1.00 0.00 H new ATOM 0 HE2 LYS A 7 143.464 8.730 3.264 1.00 0.00 H new ATOM 0 HE3 LYS A 7 143.147 9.460 1.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 141.151 8.782 3.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 141.170 8.235 1.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 141.553 7.169 2.717 1.00 0.00 H new ATOM 121 N PHE A 8 148.061 5.837 0.330 1.00 0.00 N ATOM 122 CA PHE A 8 149.344 6.432 -0.037 1.00 0.00 C ATOM 123 C PHE A 8 149.151 7.754 -0.779 1.00 0.00 C ATOM 124 O PHE A 8 148.157 7.944 -1.484 1.00 0.00 O ATOM 125 CB PHE A 8 150.172 5.461 -0.892 1.00 0.00 C ATOM 126 CG PHE A 8 149.405 4.814 -2.016 1.00 0.00 C ATOM 127 CD1 PHE A 8 148.600 3.710 -1.781 1.00 0.00 C ATOM 128 CD2 PHE A 8 149.496 5.308 -3.307 1.00 0.00 C ATOM 129 CE1 PHE A 8 147.899 3.116 -2.812 1.00 0.00 C ATOM 130 CE2 PHE A 8 148.799 4.716 -4.341 1.00 0.00 C ATOM 131 CZ PHE A 8 147.999 3.619 -4.094 1.00 0.00 C ATOM 0 H PHE A 8 147.475 5.574 -0.463 1.00 0.00 H new ATOM 0 HA PHE A 8 149.887 6.635 0.886 1.00 0.00 H new ATOM 0 HB2 PHE A 8 151.022 5.999 -1.311 1.00 0.00 H new ATOM 0 HB3 PHE A 8 150.575 4.681 -0.247 1.00 0.00 H new ATOM 0 HD1 PHE A 8 148.520 3.310 -0.781 1.00 0.00 H new ATOM 0 HD2 PHE A 8 150.120 6.167 -3.507 1.00 0.00 H new ATOM 0 HE1 PHE A 8 147.273 2.258 -2.616 1.00 0.00 H new ATOM 0 HE2 PHE A 8 148.880 5.111 -5.343 1.00 0.00 H new ATOM 0 HZ PHE A 8 147.452 3.155 -4.902 1.00 0.00 H new ATOM 141 N GLU A 9 150.111 8.665 -0.610 1.00 0.00 N ATOM 142 CA GLU A 9 150.055 9.972 -1.258 1.00 0.00 C ATOM 143 C GLU A 9 151.233 10.164 -2.210 1.00 0.00 C ATOM 144 O GLU A 9 152.364 9.775 -1.906 1.00 0.00 O ATOM 145 CB GLU A 9 150.044 11.093 -0.212 1.00 0.00 C ATOM 146 CG GLU A 9 149.738 12.467 -0.796 1.00 0.00 C ATOM 147 CD GLU A 9 149.213 13.447 0.237 1.00 0.00 C ATOM 148 OE1 GLU A 9 148.148 13.176 0.830 1.00 0.00 O ATOM 149 OE2 GLU A 9 149.866 14.490 0.451 1.00 0.00 O ATOM 0 H GLU A 9 150.936 8.519 -0.029 1.00 0.00 H new ATOM 0 HA GLU A 9 149.132 10.016 -1.836 1.00 0.00 H new ATOM 0 HB2 GLU A 9 149.303 10.859 0.552 1.00 0.00 H new ATOM 0 HB3 GLU A 9 151.014 11.126 0.284 1.00 0.00 H new ATOM 0 HG2 GLU A 9 150.643 12.874 -1.247 1.00 0.00 H new ATOM 0 HG3 GLU A 9 149.004 12.361 -1.594 1.00 0.00 H new ATOM 156 N HIS A 10 150.956 10.767 -3.362 1.00 0.00 N ATOM 157 CA HIS A 10 151.978 11.019 -4.368 1.00 0.00 C ATOM 158 C HIS A 10 151.693 12.326 -5.101 1.00 0.00 C ATOM 159 O HIS A 10 150.690 12.442 -5.806 1.00 0.00 O ATOM 160 CB HIS A 10 152.037 9.860 -5.365 1.00 0.00 C ATOM 161 CG HIS A 10 153.097 10.018 -6.410 1.00 0.00 C ATOM 162 ND1 HIS A 10 152.819 10.328 -7.724 1.00 0.00 N ATOM 163 CD2 HIS A 10 154.442 9.901 -6.328 1.00 0.00 C ATOM 164 CE1 HIS A 10 153.949 10.390 -8.407 1.00 0.00 C ATOM 165 NE2 HIS A 10 154.947 10.137 -7.582 1.00 0.00 N ATOM 0 H HIS A 10 150.025 11.092 -3.622 1.00 0.00 H new ATOM 0 HA HIS A 10 152.943 11.103 -3.867 1.00 0.00 H new ATOM 0 HB2 HIS A 10 152.212 8.932 -4.820 1.00 0.00 H new ATOM 0 HB3 HIS A 10 151.068 9.764 -5.855 1.00 0.00 H new ATOM 0 HD2 HIS A 10 155.012 9.666 -5.441 1.00 0.00 H new ATOM 0 HE1 HIS A 10 154.040 10.610 -9.460 1.00 0.00 H new ATOM 0 HE2 HIS A 10 155.935 10.120 -7.835 1.00 0.00 H new ATOM 174 N ASN A 11 152.580 13.306 -4.926 1.00 0.00 N ATOM 175 CA ASN A 11 152.428 14.612 -5.568 1.00 0.00 C ATOM 176 C ASN A 11 151.106 15.277 -5.163 1.00 0.00 C ATOM 177 O ASN A 11 150.477 15.973 -5.965 1.00 0.00 O ATOM 178 CB ASN A 11 152.503 14.466 -7.093 1.00 0.00 C ATOM 179 CG ASN A 11 153.277 15.596 -7.744 1.00 0.00 C ATOM 180 OD1 ASN A 11 154.402 15.901 -7.348 1.00 0.00 O ATOM 181 ND2 ASN A 11 152.680 16.225 -8.751 1.00 0.00 N ATOM 0 H ASN A 11 153.413 13.220 -4.344 1.00 0.00 H new ATOM 0 HA ASN A 11 153.245 15.251 -5.232 1.00 0.00 H new ATOM 0 HB2 ASN A 11 152.975 13.515 -7.342 1.00 0.00 H new ATOM 0 HB3 ASN A 11 151.493 14.437 -7.503 1.00 0.00 H new ATOM 0 HD21 ASN A 11 153.155 16.992 -9.227 1.00 0.00 H new ATOM 0 HD22 ASN A 11 151.747 15.941 -9.048 1.00 0.00 H new ATOM 188 N GLY A 12 150.692 15.058 -3.912 1.00 0.00 N ATOM 189 CA GLY A 12 149.452 15.638 -3.419 1.00 0.00 C ATOM 190 C GLY A 12 148.214 14.841 -3.822 1.00 0.00 C ATOM 191 O GLY A 12 147.091 15.325 -3.673 1.00 0.00 O ATOM 0 H GLY A 12 151.196 14.488 -3.232 1.00 0.00 H new ATOM 0 HA2 GLY A 12 149.496 15.704 -2.332 1.00 0.00 H new ATOM 0 HA3 GLY A 12 149.359 16.656 -3.796 1.00 0.00 H new ATOM 195 N GLU A 13 148.415 13.619 -4.328 1.00 0.00 N ATOM 196 CA GLU A 13 147.305 12.762 -4.745 1.00 0.00 C ATOM 197 C GLU A 13 147.171 11.560 -3.814 1.00 0.00 C ATOM 198 O GLU A 13 148.114 10.784 -3.652 1.00 0.00 O ATOM 199 CB GLU A 13 147.511 12.286 -6.187 1.00 0.00 C ATOM 200 CG GLU A 13 147.386 13.395 -7.222 1.00 0.00 C ATOM 201 CD GLU A 13 145.956 13.609 -7.680 1.00 0.00 C ATOM 202 OE1 GLU A 13 145.436 12.752 -8.427 1.00 0.00 O ATOM 203 OE2 GLU A 13 145.356 14.633 -7.291 1.00 0.00 O ATOM 0 H GLU A 13 149.337 13.203 -4.458 1.00 0.00 H new ATOM 0 HA GLU A 13 146.386 13.346 -4.693 1.00 0.00 H new ATOM 0 HB2 GLU A 13 148.498 11.831 -6.272 1.00 0.00 H new ATOM 0 HB3 GLU A 13 146.781 11.508 -6.411 1.00 0.00 H new ATOM 0 HG2 GLU A 13 147.772 14.324 -6.802 1.00 0.00 H new ATOM 0 HG3 GLU A 13 148.007 13.153 -8.084 1.00 0.00 H new ATOM 210 N ARG A 14 145.994 11.414 -3.201 1.00 0.00 N ATOM 211 CA ARG A 14 145.735 10.306 -2.280 1.00 0.00 C ATOM 212 C ARG A 14 145.094 9.124 -3.006 1.00 0.00 C ATOM 213 O ARG A 14 144.230 9.307 -3.865 1.00 0.00 O ATOM 214 CB ARG A 14 144.828 10.758 -1.129 1.00 0.00 C ATOM 215 CG ARG A 14 145.452 11.820 -0.237 1.00 0.00 C ATOM 216 CD ARG A 14 145.196 13.222 -0.771 1.00 0.00 C ATOM 217 NE ARG A 14 145.376 14.243 0.260 1.00 0.00 N ATOM 218 CZ ARG A 14 144.464 14.534 1.193 1.00 0.00 C ATOM 219 NH1 ARG A 14 143.308 13.874 1.238 1.00 0.00 N ATOM 220 NH2 ARG A 14 144.712 15.486 2.087 1.00 0.00 N ATOM 0 H ARG A 14 145.206 12.049 -3.326 1.00 0.00 H new ATOM 0 HA ARG A 14 146.694 9.986 -1.873 1.00 0.00 H new ATOM 0 HB2 ARG A 14 143.897 11.146 -1.543 1.00 0.00 H new ATOM 0 HB3 ARG A 14 144.570 9.891 -0.520 1.00 0.00 H new ATOM 0 HG2 ARG A 14 145.046 11.734 0.771 1.00 0.00 H new ATOM 0 HG3 ARG A 14 146.526 11.649 -0.163 1.00 0.00 H new ATOM 0 HD2 ARG A 14 145.873 13.423 -1.602 1.00 0.00 H new ATOM 0 HD3 ARG A 14 144.181 13.280 -1.165 1.00 0.00 H new ATOM 0 HE ARG A 14 146.252 14.766 0.268 1.00 0.00 H new ATOM 0 HH11 ARG A 14 143.113 13.140 0.557 1.00 0.00 H new ATOM 0 HH12 ARG A 14 142.618 14.103 1.953 1.00 0.00 H new ATOM 0 HH21 ARG A 14 145.597 15.993 2.060 1.00 0.00 H new ATOM 0 HH22 ARG A 14 144.018 15.710 2.800 1.00 0.00 H new ATOM 234 N ARG A 15 145.523 7.911 -2.653 1.00 0.00 N ATOM 235 CA ARG A 15 144.990 6.697 -3.268 1.00 0.00 C ATOM 236 C ARG A 15 144.777 5.598 -2.226 1.00 0.00 C ATOM 237 O ARG A 15 145.626 5.380 -1.359 1.00 0.00 O ATOM 238 CB ARG A 15 145.934 6.200 -4.367 1.00 0.00 C ATOM 239 CG ARG A 15 145.724 6.878 -5.711 1.00 0.00 C ATOM 240 CD ARG A 15 144.470 6.366 -6.403 1.00 0.00 C ATOM 241 NE ARG A 15 144.022 7.264 -7.468 1.00 0.00 N ATOM 242 CZ ARG A 15 142.796 7.243 -7.999 1.00 0.00 C ATOM 243 NH1 ARG A 15 141.888 6.368 -7.572 1.00 0.00 N ATOM 244 NH2 ARG A 15 142.478 8.101 -8.962 1.00 0.00 N ATOM 0 H ARG A 15 146.238 7.745 -1.945 1.00 0.00 H new ATOM 0 HA ARG A 15 144.024 6.941 -3.709 1.00 0.00 H new ATOM 0 HB2 ARG A 15 146.964 6.359 -4.047 1.00 0.00 H new ATOM 0 HB3 ARG A 15 145.801 5.125 -4.488 1.00 0.00 H new ATOM 0 HG2 ARG A 15 145.648 7.956 -5.568 1.00 0.00 H new ATOM 0 HG3 ARG A 15 146.591 6.701 -6.348 1.00 0.00 H new ATOM 0 HD2 ARG A 15 144.665 5.378 -6.821 1.00 0.00 H new ATOM 0 HD3 ARG A 15 143.673 6.250 -5.668 1.00 0.00 H new ATOM 0 HE ARG A 15 144.687 7.949 -7.827 1.00 0.00 H new ATOM 0 HH11 ARG A 15 142.126 5.706 -6.833 1.00 0.00 H new ATOM 0 HH12 ARG A 15 140.955 6.360 -7.984 1.00 0.00 H new ATOM 0 HH21 ARG A 15 143.169 8.774 -9.294 1.00 0.00 H new ATOM 0 HH22 ARG A 15 141.543 8.087 -9.369 1.00 0.00 H new ATOM 258 N ILE A 16 143.636 4.911 -2.319 1.00 0.00 N ATOM 259 CA ILE A 16 143.302 3.833 -1.388 1.00 0.00 C ATOM 260 C ILE A 16 143.183 2.493 -2.113 1.00 0.00 C ATOM 261 O ILE A 16 142.479 2.385 -3.119 1.00 0.00 O ATOM 262 CB ILE A 16 141.974 4.110 -0.647 1.00 0.00 C ATOM 263 CG1 ILE A 16 141.926 5.556 -0.144 1.00 0.00 C ATOM 264 CG2 ILE A 16 141.796 3.135 0.511 1.00 0.00 C ATOM 265 CD1 ILE A 16 141.040 6.457 -0.977 1.00 0.00 C ATOM 0 H ILE A 16 142.927 5.083 -3.032 1.00 0.00 H new ATOM 0 HA ILE A 16 144.115 3.788 -0.664 1.00 0.00 H new ATOM 0 HB ILE A 16 141.153 3.966 -1.350 1.00 0.00 H new ATOM 0 HG12 ILE A 16 141.570 5.562 0.886 1.00 0.00 H new ATOM 0 HG13 ILE A 16 142.937 5.963 -0.134 1.00 0.00 H new ATOM 0 HG21 ILE A 16 140.856 3.344 1.022 1.00 0.00 H new ATOM 0 HG22 ILE A 16 141.782 2.114 0.128 1.00 0.00 H new ATOM 0 HG23 ILE A 16 142.623 3.248 1.212 1.00 0.00 H new ATOM 0 HD11 ILE A 16 141.054 7.465 -0.563 1.00 0.00 H new ATOM 0 HD12 ILE A 16 141.408 6.481 -2.003 1.00 0.00 H new ATOM 0 HD13 ILE A 16 140.019 6.075 -0.966 1.00 0.00 H new ATOM 277 N ILE A 17 143.869 1.474 -1.593 1.00 0.00 N ATOM 278 CA ILE A 17 143.832 0.139 -2.188 1.00 0.00 C ATOM 279 C ILE A 17 143.800 -0.944 -1.110 1.00 0.00 C ATOM 280 O ILE A 17 144.617 -0.940 -0.187 1.00 0.00 O ATOM 281 CB ILE A 17 145.041 -0.111 -3.117 1.00 0.00 C ATOM 282 CG1 ILE A 17 145.205 1.046 -4.109 1.00 0.00 C ATOM 283 CG2 ILE A 17 144.877 -1.431 -3.862 1.00 0.00 C ATOM 284 CD1 ILE A 17 146.386 0.882 -5.042 1.00 0.00 C ATOM 0 H ILE A 17 144.456 1.548 -0.762 1.00 0.00 H new ATOM 0 HA ILE A 17 142.919 0.089 -2.781 1.00 0.00 H new ATOM 0 HB ILE A 17 145.940 -0.169 -2.503 1.00 0.00 H new ATOM 0 HG12 ILE A 17 144.295 1.137 -4.701 1.00 0.00 H new ATOM 0 HG13 ILE A 17 145.318 1.977 -3.553 1.00 0.00 H new ATOM 0 HG21 ILE A 17 145.737 -1.591 -4.512 1.00 0.00 H new ATOM 0 HG22 ILE A 17 144.807 -2.248 -3.144 1.00 0.00 H new ATOM 0 HG23 ILE A 17 143.969 -1.399 -4.464 1.00 0.00 H new ATOM 0 HD11 ILE A 17 146.439 1.738 -5.715 1.00 0.00 H new ATOM 0 HD12 ILE A 17 147.305 0.821 -4.459 1.00 0.00 H new ATOM 0 HD13 ILE A 17 146.265 -0.031 -5.625 1.00 0.00 H new ATOM 296 N ALA A 18 142.851 -1.872 -1.239 1.00 0.00 N ATOM 297 CA ALA A 18 142.710 -2.966 -0.282 1.00 0.00 C ATOM 298 C ALA A 18 143.532 -4.180 -0.712 1.00 0.00 C ATOM 299 O ALA A 18 143.511 -4.572 -1.880 1.00 0.00 O ATOM 300 CB ALA A 18 141.245 -3.349 -0.122 1.00 0.00 C ATOM 0 H ALA A 18 142.169 -1.886 -1.998 1.00 0.00 H new ATOM 0 HA ALA A 18 143.089 -2.622 0.680 1.00 0.00 H new ATOM 0 HB1 ALA A 18 141.159 -4.166 0.595 1.00 0.00 H new ATOM 0 HB2 ALA A 18 140.681 -2.489 0.239 1.00 0.00 H new ATOM 0 HB3 ALA A 18 140.845 -3.667 -1.085 1.00 0.00 H new ATOM 306 N PHE A 19 144.255 -4.768 0.240 1.00 0.00 N ATOM 307 CA PHE A 19 145.088 -5.936 -0.036 1.00 0.00 C ATOM 308 C PHE A 19 144.806 -7.059 0.961 1.00 0.00 C ATOM 309 O PHE A 19 144.955 -6.879 2.172 1.00 0.00 O ATOM 310 CB PHE A 19 146.570 -5.553 0.015 1.00 0.00 C ATOM 311 CG PHE A 19 147.099 -5.014 -1.286 1.00 0.00 C ATOM 312 CD1 PHE A 19 147.283 -5.852 -2.374 1.00 0.00 C ATOM 313 CD2 PHE A 19 147.410 -3.670 -1.420 1.00 0.00 C ATOM 314 CE1 PHE A 19 147.768 -5.360 -3.571 1.00 0.00 C ATOM 315 CE2 PHE A 19 147.896 -3.173 -2.615 1.00 0.00 C ATOM 316 CZ PHE A 19 148.074 -4.019 -3.692 1.00 0.00 C ATOM 0 H PHE A 19 144.280 -4.454 1.210 1.00 0.00 H new ATOM 0 HA PHE A 19 144.845 -6.296 -1.036 1.00 0.00 H new ATOM 0 HB2 PHE A 19 146.717 -4.805 0.795 1.00 0.00 H new ATOM 0 HB3 PHE A 19 147.153 -6.429 0.300 1.00 0.00 H new ATOM 0 HD1 PHE A 19 147.045 -6.902 -2.286 1.00 0.00 H new ATOM 0 HD2 PHE A 19 147.271 -3.004 -0.582 1.00 0.00 H new ATOM 0 HE1 PHE A 19 147.908 -6.024 -4.411 1.00 0.00 H new ATOM 0 HE2 PHE A 19 148.136 -2.124 -2.706 1.00 0.00 H new ATOM 0 HZ PHE A 19 148.452 -3.632 -4.627 1.00 0.00 H new ATOM 326 N SER A 20 144.401 -8.220 0.443 1.00 0.00 N ATOM 327 CA SER A 20 144.101 -9.379 1.283 1.00 0.00 C ATOM 328 C SER A 20 145.366 -9.899 1.967 1.00 0.00 C ATOM 329 O SER A 20 146.424 -10.002 1.342 1.00 0.00 O ATOM 330 CB SER A 20 143.458 -10.492 0.448 1.00 0.00 C ATOM 331 OG SER A 20 143.936 -10.474 -0.888 1.00 0.00 O ATOM 0 H SER A 20 144.273 -8.382 -0.556 1.00 0.00 H new ATOM 0 HA SER A 20 143.398 -9.065 2.054 1.00 0.00 H new ATOM 0 HB2 SER A 20 143.673 -11.460 0.901 1.00 0.00 H new ATOM 0 HB3 SER A 20 142.375 -10.372 0.451 1.00 0.00 H new ATOM 0 HG SER A 20 143.511 -11.195 -1.397 1.00 0.00 H new ATOM 337 N ARG A 21 145.249 -10.223 3.255 1.00 0.00 N ATOM 338 CA ARG A 21 146.383 -10.730 4.028 1.00 0.00 C ATOM 339 C ARG A 21 146.651 -12.201 3.707 1.00 0.00 C ATOM 340 O ARG A 21 145.721 -12.958 3.420 1.00 0.00 O ATOM 341 CB ARG A 21 146.125 -10.567 5.530 1.00 0.00 C ATOM 342 CG ARG A 21 145.633 -9.183 5.922 1.00 0.00 C ATOM 343 CD ARG A 21 145.281 -9.117 7.400 1.00 0.00 C ATOM 344 NE ARG A 21 144.509 -7.918 7.722 1.00 0.00 N ATOM 345 CZ ARG A 21 144.420 -7.391 8.945 1.00 0.00 C ATOM 346 NH1 ARG A 21 145.030 -7.968 9.978 1.00 0.00 N ATOM 347 NH2 ARG A 21 143.713 -6.283 9.136 1.00 0.00 N ATOM 0 H ARG A 21 144.381 -10.143 3.785 1.00 0.00 H new ATOM 0 HA ARG A 21 147.262 -10.148 3.751 1.00 0.00 H new ATOM 0 HB2 ARG A 21 145.389 -11.307 5.845 1.00 0.00 H new ATOM 0 HB3 ARG A 21 147.045 -10.782 6.073 1.00 0.00 H new ATOM 0 HG2 ARG A 21 146.402 -8.444 5.696 1.00 0.00 H new ATOM 0 HG3 ARG A 21 144.758 -8.924 5.326 1.00 0.00 H new ATOM 0 HD2 ARG A 21 144.709 -10.003 7.677 1.00 0.00 H new ATOM 0 HD3 ARG A 21 146.196 -9.130 7.992 1.00 0.00 H new ATOM 0 HE ARG A 21 144.007 -7.455 6.964 1.00 0.00 H new ATOM 0 HH11 ARG A 21 145.572 -8.821 9.839 1.00 0.00 H new ATOM 0 HH12 ARG A 21 144.956 -7.557 10.909 1.00 0.00 H new ATOM 0 HH21 ARG A 21 143.240 -5.838 8.349 1.00 0.00 H new ATOM 0 HH22 ARG A 21 143.643 -5.877 10.069 1.00 0.00 H new ATOM 361 N PRO A 22 147.930 -12.631 3.750 1.00 0.00 N ATOM 362 CA PRO A 22 149.064 -11.760 4.088 1.00 0.00 C ATOM 363 C PRO A 22 149.484 -10.862 2.923 1.00 0.00 C ATOM 364 O PRO A 22 149.617 -11.325 1.789 1.00 0.00 O ATOM 365 CB PRO A 22 150.174 -12.756 4.420 1.00 0.00 C ATOM 366 CG PRO A 22 149.864 -13.955 3.590 1.00 0.00 C ATOM 367 CD PRO A 22 148.363 -14.014 3.472 1.00 0.00 C ATOM 0 HA PRO A 22 148.824 -11.072 4.898 1.00 0.00 H new ATOM 0 HB2 PRO A 22 151.156 -12.350 4.178 1.00 0.00 H new ATOM 0 HB3 PRO A 22 150.183 -13.001 5.482 1.00 0.00 H new ATOM 0 HG2 PRO A 22 150.328 -13.877 2.607 1.00 0.00 H new ATOM 0 HG3 PRO A 22 150.253 -14.861 4.055 1.00 0.00 H new ATOM 0 HD2 PRO A 22 148.053 -14.338 2.478 1.00 0.00 H new ATOM 0 HD3 PRO A 22 147.934 -14.718 4.185 1.00 0.00 H new ATOM 375 N VAL A 23 149.696 -9.578 3.213 1.00 0.00 N ATOM 376 CA VAL A 23 150.106 -8.618 2.191 1.00 0.00 C ATOM 377 C VAL A 23 151.613 -8.696 1.935 1.00 0.00 C ATOM 378 O VAL A 23 152.419 -8.546 2.855 1.00 0.00 O ATOM 379 CB VAL A 23 149.715 -7.170 2.578 1.00 0.00 C ATOM 380 CG1 VAL A 23 150.430 -6.729 3.849 1.00 0.00 C ATOM 381 CG2 VAL A 23 150.009 -6.210 1.433 1.00 0.00 C ATOM 0 H VAL A 23 149.590 -9.180 4.146 1.00 0.00 H new ATOM 0 HA VAL A 23 149.577 -8.883 1.275 1.00 0.00 H new ATOM 0 HB VAL A 23 148.643 -7.152 2.774 1.00 0.00 H new ATOM 0 HG11 VAL A 23 150.136 -5.709 4.096 1.00 0.00 H new ATOM 0 HG12 VAL A 23 150.158 -7.394 4.669 1.00 0.00 H new ATOM 0 HG13 VAL A 23 151.508 -6.768 3.692 1.00 0.00 H new ATOM 0 HG21 VAL A 23 149.727 -5.198 1.725 1.00 0.00 H new ATOM 0 HG22 VAL A 23 151.073 -6.237 1.200 1.00 0.00 H new ATOM 0 HG23 VAL A 23 149.437 -6.506 0.554 1.00 0.00 H new ATOM 391 N LYS A 24 151.985 -8.935 0.679 1.00 0.00 N ATOM 392 CA LYS A 24 153.393 -9.036 0.301 1.00 0.00 C ATOM 393 C LYS A 24 153.867 -7.761 -0.387 1.00 0.00 C ATOM 394 O LYS A 24 153.120 -7.139 -1.146 1.00 0.00 O ATOM 395 CB LYS A 24 153.614 -10.231 -0.632 1.00 0.00 C ATOM 396 CG LYS A 24 153.249 -11.570 -0.015 1.00 0.00 C ATOM 397 CD LYS A 24 154.165 -11.917 1.147 1.00 0.00 C ATOM 398 CE LYS A 24 154.240 -13.419 1.365 1.00 0.00 C ATOM 399 NZ LYS A 24 155.461 -14.015 0.750 1.00 0.00 N ATOM 0 H LYS A 24 151.331 -9.062 -0.094 1.00 0.00 H new ATOM 0 HA LYS A 24 153.972 -9.179 1.214 1.00 0.00 H new ATOM 0 HB2 LYS A 24 153.024 -10.086 -1.537 1.00 0.00 H new ATOM 0 HB3 LYS A 24 154.661 -10.255 -0.934 1.00 0.00 H new ATOM 0 HG2 LYS A 24 152.216 -11.543 0.331 1.00 0.00 H new ATOM 0 HG3 LYS A 24 153.311 -12.350 -0.774 1.00 0.00 H new ATOM 0 HD2 LYS A 24 155.164 -11.526 0.954 1.00 0.00 H new ATOM 0 HD3 LYS A 24 153.803 -11.434 2.054 1.00 0.00 H new ATOM 0 HE2 LYS A 24 154.233 -13.630 2.434 1.00 0.00 H new ATOM 0 HE3 LYS A 24 153.354 -13.891 0.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 155.472 -15.040 0.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 155.456 -13.837 -0.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 156.308 -13.584 1.172 1.00 0.00 H new ATOM 413 N TYR A 25 155.118 -7.383 -0.125 1.00 0.00 N ATOM 414 CA TYR A 25 155.703 -6.187 -0.729 1.00 0.00 C ATOM 415 C TYR A 25 155.717 -6.306 -2.253 1.00 0.00 C ATOM 416 O TYR A 25 155.412 -5.345 -2.959 1.00 0.00 O ATOM 417 CB TYR A 25 157.129 -5.967 -0.212 1.00 0.00 C ATOM 418 CG TYR A 25 157.809 -4.742 -0.790 1.00 0.00 C ATOM 419 CD1 TYR A 25 158.544 -4.821 -1.967 1.00 0.00 C ATOM 420 CD2 TYR A 25 157.718 -3.510 -0.156 1.00 0.00 C ATOM 421 CE1 TYR A 25 159.167 -3.706 -2.494 1.00 0.00 C ATOM 422 CE2 TYR A 25 158.338 -2.392 -0.678 1.00 0.00 C ATOM 423 CZ TYR A 25 159.062 -2.495 -1.847 1.00 0.00 C ATOM 424 OH TYR A 25 159.678 -1.382 -2.371 1.00 0.00 O ATOM 0 H TYR A 25 155.745 -7.888 0.501 1.00 0.00 H new ATOM 0 HA TYR A 25 155.089 -5.331 -0.449 1.00 0.00 H new ATOM 0 HB2 TYR A 25 157.102 -5.877 0.874 1.00 0.00 H new ATOM 0 HB3 TYR A 25 157.729 -6.847 -0.444 1.00 0.00 H new ATOM 0 HD1 TYR A 25 158.629 -5.769 -2.478 1.00 0.00 H new ATOM 0 HD2 TYR A 25 157.153 -3.425 0.760 1.00 0.00 H new ATOM 0 HE1 TYR A 25 159.734 -3.784 -3.410 1.00 0.00 H new ATOM 0 HE2 TYR A 25 158.256 -1.441 -0.173 1.00 0.00 H new ATOM 0 HH TYR A 25 159.952 -0.787 -1.643 1.00 0.00 H new ATOM 434 N GLU A 26 156.073 -7.494 -2.748 1.00 0.00 N ATOM 435 CA GLU A 26 156.131 -7.748 -4.187 1.00 0.00 C ATOM 436 C GLU A 26 154.777 -7.483 -4.848 1.00 0.00 C ATOM 437 O GLU A 26 154.714 -6.900 -5.931 1.00 0.00 O ATOM 438 CB GLU A 26 156.561 -9.194 -4.454 1.00 0.00 C ATOM 439 CG GLU A 26 157.281 -9.380 -5.781 1.00 0.00 C ATOM 440 CD GLU A 26 157.889 -10.762 -5.940 1.00 0.00 C ATOM 441 OE1 GLU A 26 157.256 -11.750 -5.509 1.00 0.00 O ATOM 442 OE2 GLU A 26 159.000 -10.856 -6.502 1.00 0.00 O ATOM 0 H GLU A 26 156.326 -8.296 -2.171 1.00 0.00 H new ATOM 0 HA GLU A 26 156.865 -7.067 -4.618 1.00 0.00 H new ATOM 0 HB2 GLU A 26 157.214 -9.525 -3.646 1.00 0.00 H new ATOM 0 HB3 GLU A 26 155.680 -9.836 -4.435 1.00 0.00 H new ATOM 0 HG2 GLU A 26 156.580 -9.202 -6.596 1.00 0.00 H new ATOM 0 HG3 GLU A 26 158.068 -8.631 -5.869 1.00 0.00 H new ATOM 449 N ASP A 27 153.696 -7.908 -4.189 1.00 0.00 N ATOM 450 CA ASP A 27 152.345 -7.712 -4.719 1.00 0.00 C ATOM 451 C ASP A 27 152.016 -6.225 -4.850 1.00 0.00 C ATOM 452 O ASP A 27 151.470 -5.791 -5.865 1.00 0.00 O ATOM 453 CB ASP A 27 151.303 -8.389 -3.819 1.00 0.00 C ATOM 454 CG ASP A 27 151.409 -9.905 -3.814 1.00 0.00 C ATOM 455 OD1 ASP A 27 151.757 -10.487 -4.863 1.00 0.00 O ATOM 456 OD2 ASP A 27 151.137 -10.511 -2.756 1.00 0.00 O ATOM 0 H ASP A 27 153.730 -8.389 -3.290 1.00 0.00 H new ATOM 0 HA ASP A 27 152.313 -8.168 -5.708 1.00 0.00 H new ATOM 0 HB2 ASP A 27 151.418 -8.020 -2.800 1.00 0.00 H new ATOM 0 HB3 ASP A 27 150.305 -8.102 -4.151 1.00 0.00 H new ATOM 461 N VAL A 28 152.354 -5.448 -3.822 1.00 0.00 N ATOM 462 CA VAL A 28 152.090 -4.014 -3.839 1.00 0.00 C ATOM 463 C VAL A 28 153.011 -3.302 -4.829 1.00 0.00 C ATOM 464 O VAL A 28 152.552 -2.503 -5.646 1.00 0.00 O ATOM 465 CB VAL A 28 152.251 -3.377 -2.440 1.00 0.00 C ATOM 466 CG1 VAL A 28 151.835 -1.911 -2.470 1.00 0.00 C ATOM 467 CG2 VAL A 28 151.444 -4.142 -1.398 1.00 0.00 C ATOM 0 H VAL A 28 152.808 -5.786 -2.973 1.00 0.00 H new ATOM 0 HA VAL A 28 151.053 -3.891 -4.153 1.00 0.00 H new ATOM 0 HB VAL A 28 153.303 -3.432 -2.160 1.00 0.00 H new ATOM 0 HG11 VAL A 28 151.955 -1.478 -1.477 1.00 0.00 H new ATOM 0 HG12 VAL A 28 152.461 -1.370 -3.179 1.00 0.00 H new ATOM 0 HG13 VAL A 28 150.791 -1.835 -2.775 1.00 0.00 H new ATOM 0 HG21 VAL A 28 151.574 -3.674 -0.422 1.00 0.00 H new ATOM 0 HG22 VAL A 28 150.389 -4.125 -1.671 1.00 0.00 H new ATOM 0 HG23 VAL A 28 151.791 -5.174 -1.355 1.00 0.00 H new ATOM 477 N GLU A 29 154.310 -3.599 -4.753 1.00 0.00 N ATOM 478 CA GLU A 29 155.295 -2.986 -5.644 1.00 0.00 C ATOM 479 C GLU A 29 154.976 -3.275 -7.111 1.00 0.00 C ATOM 480 O GLU A 29 155.113 -2.397 -7.963 1.00 0.00 O ATOM 481 CB GLU A 29 156.704 -3.483 -5.312 1.00 0.00 C ATOM 482 CG GLU A 29 157.757 -2.390 -5.370 1.00 0.00 C ATOM 483 CD GLU A 29 158.951 -2.778 -6.219 1.00 0.00 C ATOM 484 OE1 GLU A 29 159.879 -3.415 -5.681 1.00 0.00 O ATOM 485 OE2 GLU A 29 158.956 -2.448 -7.422 1.00 0.00 O ATOM 0 H GLU A 29 154.703 -4.260 -4.083 1.00 0.00 H new ATOM 0 HA GLU A 29 155.250 -1.908 -5.490 1.00 0.00 H new ATOM 0 HB2 GLU A 29 156.701 -3.922 -4.314 1.00 0.00 H new ATOM 0 HB3 GLU A 29 156.975 -4.276 -6.009 1.00 0.00 H new ATOM 0 HG2 GLU A 29 157.310 -1.481 -5.772 1.00 0.00 H new ATOM 0 HG3 GLU A 29 158.094 -2.160 -4.359 1.00 0.00 H new ATOM 492 N HIS A 30 154.553 -4.505 -7.399 1.00 0.00 N ATOM 493 CA HIS A 30 154.216 -4.900 -8.766 1.00 0.00 C ATOM 494 C HIS A 30 153.121 -4.001 -9.344 1.00 0.00 C ATOM 495 O HIS A 30 153.230 -3.525 -10.475 1.00 0.00 O ATOM 496 CB HIS A 30 153.763 -6.364 -8.804 1.00 0.00 C ATOM 497 CG HIS A 30 154.880 -7.350 -8.978 1.00 0.00 C ATOM 498 ND1 HIS A 30 155.994 -7.112 -9.758 1.00 0.00 N ATOM 499 CD2 HIS A 30 155.040 -8.596 -8.471 1.00 0.00 C ATOM 500 CE1 HIS A 30 156.787 -8.170 -9.723 1.00 0.00 C ATOM 501 NE2 HIS A 30 156.232 -9.083 -8.947 1.00 0.00 N ATOM 0 H HIS A 30 154.436 -5.244 -6.706 1.00 0.00 H new ATOM 0 HA HIS A 30 155.112 -4.788 -9.377 1.00 0.00 H new ATOM 0 HB2 HIS A 30 153.233 -6.592 -7.879 1.00 0.00 H new ATOM 0 HB3 HIS A 30 153.051 -6.491 -9.620 1.00 0.00 H new ATOM 0 HD2 HIS A 30 154.356 -9.111 -7.813 1.00 0.00 H new ATOM 0 HE1 HIS A 30 157.729 -8.270 -10.241 1.00 0.00 H new ATOM 0 HE2 HIS A 30 156.625 -10.000 -8.736 1.00 0.00 H new ATOM 510 N LYS A 31 152.067 -3.772 -8.560 1.00 0.00 N ATOM 511 CA LYS A 31 150.957 -2.931 -8.997 1.00 0.00 C ATOM 512 C LYS A 31 151.367 -1.460 -9.044 1.00 0.00 C ATOM 513 O LYS A 31 151.116 -0.775 -10.034 1.00 0.00 O ATOM 514 CB LYS A 31 149.748 -3.109 -8.069 1.00 0.00 C ATOM 515 CG LYS A 31 148.623 -3.930 -8.688 1.00 0.00 C ATOM 516 CD LYS A 31 148.013 -4.902 -7.686 1.00 0.00 C ATOM 517 CE LYS A 31 146.610 -4.477 -7.273 1.00 0.00 C ATOM 518 NZ LYS A 31 145.552 -5.190 -8.048 1.00 0.00 N ATOM 0 H LYS A 31 151.960 -4.157 -7.621 1.00 0.00 H new ATOM 0 HA LYS A 31 150.679 -3.243 -10.004 1.00 0.00 H new ATOM 0 HB2 LYS A 31 150.075 -3.591 -7.148 1.00 0.00 H new ATOM 0 HB3 LYS A 31 149.362 -2.127 -7.795 1.00 0.00 H new ATOM 0 HG2 LYS A 31 147.848 -3.261 -9.062 1.00 0.00 H new ATOM 0 HG3 LYS A 31 149.007 -4.484 -9.544 1.00 0.00 H new ATOM 0 HD2 LYS A 31 147.977 -5.900 -8.122 1.00 0.00 H new ATOM 0 HD3 LYS A 31 148.650 -4.962 -6.803 1.00 0.00 H new ATOM 0 HE2 LYS A 31 146.472 -4.672 -6.209 1.00 0.00 H new ATOM 0 HE3 LYS A 31 146.501 -3.402 -7.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 144.615 -4.869 -7.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 145.666 -4.984 -9.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 145.638 -6.215 -7.891 1.00 0.00 H new ATOM 532 N VAL A 32 151.999 -0.980 -7.971 1.00 0.00 N ATOM 533 CA VAL A 32 152.438 0.415 -7.900 1.00 0.00 C ATOM 534 C VAL A 32 153.366 0.767 -9.063 1.00 0.00 C ATOM 535 O VAL A 32 153.199 1.805 -9.705 1.00 0.00 O ATOM 536 CB VAL A 32 153.155 0.724 -6.568 1.00 0.00 C ATOM 537 CG1 VAL A 32 153.539 2.194 -6.494 1.00 0.00 C ATOM 538 CG2 VAL A 32 152.281 0.338 -5.382 1.00 0.00 C ATOM 0 H VAL A 32 152.217 -1.534 -7.143 1.00 0.00 H new ATOM 0 HA VAL A 32 151.537 1.025 -7.963 1.00 0.00 H new ATOM 0 HB VAL A 32 154.067 0.129 -6.527 1.00 0.00 H new ATOM 0 HG11 VAL A 32 154.043 2.391 -5.548 1.00 0.00 H new ATOM 0 HG12 VAL A 32 154.208 2.437 -7.319 1.00 0.00 H new ATOM 0 HG13 VAL A 32 152.641 2.808 -6.562 1.00 0.00 H new ATOM 0 HG21 VAL A 32 152.806 0.564 -4.454 1.00 0.00 H new ATOM 0 HG22 VAL A 32 151.349 0.902 -5.418 1.00 0.00 H new ATOM 0 HG23 VAL A 32 152.062 -0.729 -5.424 1.00 0.00 H new ATOM 548 N THR A 33 154.339 -0.104 -9.332 1.00 0.00 N ATOM 549 CA THR A 33 155.284 0.119 -10.422 1.00 0.00 C ATOM 550 C THR A 33 154.560 0.186 -11.769 1.00 0.00 C ATOM 551 O THR A 33 154.916 0.992 -12.626 1.00 0.00 O ATOM 552 CB THR A 33 156.353 -0.981 -10.447 1.00 0.00 C ATOM 553 OG1 THR A 33 157.073 -1.015 -9.225 1.00 0.00 O ATOM 554 CG2 THR A 33 157.363 -0.816 -11.564 1.00 0.00 C ATOM 0 H THR A 33 154.492 -0.967 -8.811 1.00 0.00 H new ATOM 0 HA THR A 33 155.775 1.077 -10.249 1.00 0.00 H new ATOM 0 HB THR A 33 155.802 -1.907 -10.609 1.00 0.00 H new ATOM 0 HG1 THR A 33 156.548 -1.492 -8.549 1.00 0.00 H new ATOM 0 HG21 THR A 33 158.089 -1.628 -11.521 1.00 0.00 H new ATOM 0 HG22 THR A 33 156.849 -0.838 -12.525 1.00 0.00 H new ATOM 0 HG23 THR A 33 157.879 0.138 -11.450 1.00 0.00 H new ATOM 562 N THR A 34 153.546 -0.662 -11.950 1.00 0.00 N ATOM 563 CA THR A 34 152.780 -0.687 -13.197 1.00 0.00 C ATOM 564 C THR A 34 151.892 0.554 -13.335 1.00 0.00 C ATOM 565 O THR A 34 151.797 1.134 -14.418 1.00 0.00 O ATOM 566 CB THR A 34 151.927 -1.957 -13.278 1.00 0.00 C ATOM 567 OG1 THR A 34 152.740 -3.114 -13.174 1.00 0.00 O ATOM 568 CG2 THR A 34 151.134 -2.068 -14.565 1.00 0.00 C ATOM 0 H THR A 34 153.237 -1.338 -11.252 1.00 0.00 H new ATOM 0 HA THR A 34 153.493 -0.685 -14.022 1.00 0.00 H new ATOM 0 HB THR A 34 151.227 -1.888 -12.445 1.00 0.00 H new ATOM 0 HG1 THR A 34 152.924 -3.301 -12.230 1.00 0.00 H new ATOM 0 HG21 THR A 34 150.553 -2.990 -14.556 1.00 0.00 H new ATOM 0 HG22 THR A 34 150.460 -1.215 -14.652 1.00 0.00 H new ATOM 0 HG23 THR A 34 151.818 -2.078 -15.414 1.00 0.00 H new ATOM 576 N VAL A 35 151.241 0.956 -12.240 1.00 0.00 N ATOM 577 CA VAL A 35 150.360 2.127 -12.259 1.00 0.00 C ATOM 578 C VAL A 35 151.131 3.389 -12.651 1.00 0.00 C ATOM 579 O VAL A 35 150.707 4.133 -13.534 1.00 0.00 O ATOM 580 CB VAL A 35 149.674 2.359 -10.892 1.00 0.00 C ATOM 581 CG1 VAL A 35 148.683 3.513 -10.973 1.00 0.00 C ATOM 582 CG2 VAL A 35 148.978 1.093 -10.411 1.00 0.00 C ATOM 0 H VAL A 35 151.306 0.491 -11.334 1.00 0.00 H new ATOM 0 HA VAL A 35 149.591 1.923 -13.004 1.00 0.00 H new ATOM 0 HB VAL A 35 150.447 2.620 -10.169 1.00 0.00 H new ATOM 0 HG11 VAL A 35 148.213 3.658 -10.000 1.00 0.00 H new ATOM 0 HG12 VAL A 35 149.208 4.424 -11.261 1.00 0.00 H new ATOM 0 HG13 VAL A 35 147.918 3.284 -11.715 1.00 0.00 H new ATOM 0 HG21 VAL A 35 148.503 1.282 -9.448 1.00 0.00 H new ATOM 0 HG22 VAL A 35 148.221 0.796 -11.137 1.00 0.00 H new ATOM 0 HG23 VAL A 35 149.711 0.293 -10.303 1.00 0.00 H new ATOM 592 N PHE A 36 152.265 3.622 -11.987 1.00 0.00 N ATOM 593 CA PHE A 36 153.094 4.796 -12.266 1.00 0.00 C ATOM 594 C PHE A 36 154.032 4.563 -13.453 1.00 0.00 C ATOM 595 O PHE A 36 154.448 5.515 -14.115 1.00 0.00 O ATOM 596 CB PHE A 36 153.913 5.176 -11.030 1.00 0.00 C ATOM 597 CG PHE A 36 153.072 5.603 -9.860 1.00 0.00 C ATOM 598 CD1 PHE A 36 152.338 6.778 -9.909 1.00 0.00 C ATOM 599 CD2 PHE A 36 153.016 4.830 -8.713 1.00 0.00 C ATOM 600 CE1 PHE A 36 151.563 7.172 -8.835 1.00 0.00 C ATOM 601 CE2 PHE A 36 152.243 5.219 -7.636 1.00 0.00 C ATOM 602 CZ PHE A 36 151.516 6.391 -7.697 1.00 0.00 C ATOM 0 H PHE A 36 152.630 3.014 -11.254 1.00 0.00 H new ATOM 0 HA PHE A 36 152.421 5.613 -12.524 1.00 0.00 H new ATOM 0 HB2 PHE A 36 154.526 4.325 -10.735 1.00 0.00 H new ATOM 0 HB3 PHE A 36 154.595 5.985 -11.291 1.00 0.00 H new ATOM 0 HD1 PHE A 36 152.372 7.392 -10.797 1.00 0.00 H new ATOM 0 HD2 PHE A 36 153.583 3.912 -8.659 1.00 0.00 H new ATOM 0 HE1 PHE A 36 150.995 8.089 -8.885 1.00 0.00 H new ATOM 0 HE2 PHE A 36 152.208 4.607 -6.747 1.00 0.00 H new ATOM 0 HZ PHE A 36 150.911 6.697 -6.856 1.00 0.00 H new ATOM 612 N GLY A 37 154.373 3.299 -13.710 1.00 0.00 N ATOM 613 CA GLY A 37 155.270 2.973 -14.808 1.00 0.00 C ATOM 614 C GLY A 37 156.741 3.000 -14.405 1.00 0.00 C ATOM 615 O GLY A 37 157.620 3.001 -15.269 1.00 0.00 O ATOM 0 H GLY A 37 154.043 2.495 -13.176 1.00 0.00 H new ATOM 0 HA2 GLY A 37 155.022 1.983 -15.191 1.00 0.00 H new ATOM 0 HA3 GLY A 37 155.109 3.679 -15.623 1.00 0.00 H new ATOM 619 N GLN A 38 157.011 3.022 -13.095 1.00 0.00 N ATOM 620 CA GLN A 38 158.384 3.052 -12.588 1.00 0.00 C ATOM 621 C GLN A 38 158.459 2.454 -11.182 1.00 0.00 C ATOM 622 O GLN A 38 157.485 2.502 -10.429 1.00 0.00 O ATOM 623 CB GLN A 38 158.905 4.492 -12.552 1.00 0.00 C ATOM 624 CG GLN A 38 159.558 4.949 -13.847 1.00 0.00 C ATOM 625 CD GLN A 38 159.915 6.423 -13.823 1.00 0.00 C ATOM 626 OE1 GLN A 38 159.501 7.187 -14.695 1.00 0.00 O ATOM 627 NE2 GLN A 38 160.684 6.833 -12.819 1.00 0.00 N ATOM 0 H GLN A 38 156.296 3.020 -12.368 1.00 0.00 H new ATOM 0 HA GLN A 38 159.002 2.456 -13.260 1.00 0.00 H new ATOM 0 HB2 GLN A 38 158.076 5.161 -12.320 1.00 0.00 H new ATOM 0 HB3 GLN A 38 159.627 4.585 -11.741 1.00 0.00 H new ATOM 0 HG2 GLN A 38 160.459 4.362 -14.024 1.00 0.00 H new ATOM 0 HG3 GLN A 38 158.883 4.755 -14.680 1.00 0.00 H new ATOM 0 HE21 GLN A 38 161.005 6.166 -12.117 1.00 0.00 H new ATOM 0 HE22 GLN A 38 160.953 7.815 -12.750 1.00 0.00 H new ATOM 636 N PRO A 39 159.622 1.886 -10.806 1.00 0.00 N ATOM 637 CA PRO A 39 159.818 1.286 -9.481 1.00 0.00 C ATOM 638 C PRO A 39 159.922 2.341 -8.375 1.00 0.00 C ATOM 639 O PRO A 39 161.018 2.685 -7.925 1.00 0.00 O ATOM 640 CB PRO A 39 161.133 0.517 -9.634 1.00 0.00 C ATOM 641 CG PRO A 39 161.875 1.248 -10.699 1.00 0.00 C ATOM 642 CD PRO A 39 160.835 1.788 -11.643 1.00 0.00 C ATOM 0 HA PRO A 39 158.979 0.657 -9.184 1.00 0.00 H new ATOM 0 HB2 PRO A 39 161.694 0.501 -8.700 1.00 0.00 H new ATOM 0 HB3 PRO A 39 160.955 -0.521 -9.916 1.00 0.00 H new ATOM 0 HG2 PRO A 39 162.471 2.056 -10.274 1.00 0.00 H new ATOM 0 HG3 PRO A 39 162.564 0.583 -11.219 1.00 0.00 H new ATOM 0 HD2 PRO A 39 161.124 2.759 -12.045 1.00 0.00 H new ATOM 0 HD3 PRO A 39 160.682 1.124 -12.494 1.00 0.00 H new ATOM 650 N LEU A 40 158.768 2.854 -7.945 1.00 0.00 N ATOM 651 CA LEU A 40 158.717 3.870 -6.895 1.00 0.00 C ATOM 652 C LEU A 40 158.974 3.249 -5.524 1.00 0.00 C ATOM 653 O LEU A 40 158.491 2.154 -5.230 1.00 0.00 O ATOM 654 CB LEU A 40 157.357 4.575 -6.898 1.00 0.00 C ATOM 655 CG LEU A 40 157.214 5.719 -7.906 1.00 0.00 C ATOM 656 CD1 LEU A 40 156.935 5.177 -9.302 1.00 0.00 C ATOM 657 CD2 LEU A 40 156.110 6.671 -7.469 1.00 0.00 C ATOM 0 H LEU A 40 157.855 2.581 -8.309 1.00 0.00 H new ATOM 0 HA LEU A 40 159.499 4.602 -7.098 1.00 0.00 H new ATOM 0 HB2 LEU A 40 156.583 3.835 -7.102 1.00 0.00 H new ATOM 0 HB3 LEU A 40 157.168 4.968 -5.899 1.00 0.00 H new ATOM 0 HG LEU A 40 158.154 6.269 -7.939 1.00 0.00 H new ATOM 0 HD11 LEU A 40 156.837 6.007 -10.002 1.00 0.00 H new ATOM 0 HD12 LEU A 40 157.758 4.534 -9.614 1.00 0.00 H new ATOM 0 HD13 LEU A 40 156.010 4.601 -9.290 1.00 0.00 H new ATOM 0 HD21 LEU A 40 156.019 7.480 -8.194 1.00 0.00 H new ATOM 0 HD22 LEU A 40 155.166 6.130 -7.408 1.00 0.00 H new ATOM 0 HD23 LEU A 40 156.354 7.086 -6.491 1.00 0.00 H new ATOM 669 N ASP A 41 159.733 3.958 -4.689 1.00 0.00 N ATOM 670 CA ASP A 41 160.054 3.481 -3.347 1.00 0.00 C ATOM 671 C ASP A 41 158.971 3.887 -2.347 1.00 0.00 C ATOM 672 O ASP A 41 158.487 5.021 -2.367 1.00 0.00 O ATOM 673 CB ASP A 41 161.413 4.033 -2.899 1.00 0.00 C ATOM 674 CG ASP A 41 162.475 2.953 -2.765 1.00 0.00 C ATOM 675 OD1 ASP A 41 162.150 1.850 -2.273 1.00 0.00 O ATOM 676 OD2 ASP A 41 163.635 3.215 -3.146 1.00 0.00 O ATOM 0 H ASP A 41 160.137 4.866 -4.920 1.00 0.00 H new ATOM 0 HA ASP A 41 160.102 2.392 -3.378 1.00 0.00 H new ATOM 0 HB2 ASP A 41 161.751 4.780 -3.617 1.00 0.00 H new ATOM 0 HB3 ASP A 41 161.296 4.541 -1.942 1.00 0.00 H new ATOM 681 N LEU A 42 158.597 2.950 -1.475 1.00 0.00 N ATOM 682 CA LEU A 42 157.572 3.199 -0.462 1.00 0.00 C ATOM 683 C LEU A 42 158.184 3.824 0.791 1.00 0.00 C ATOM 684 O LEU A 42 159.040 3.222 1.440 1.00 0.00 O ATOM 685 CB LEU A 42 156.856 1.892 -0.100 1.00 0.00 C ATOM 686 CG LEU A 42 155.900 1.357 -1.169 1.00 0.00 C ATOM 687 CD1 LEU A 42 155.817 -0.161 -1.102 1.00 0.00 C ATOM 688 CD2 LEU A 42 154.519 1.976 -1.008 1.00 0.00 C ATOM 0 H LEU A 42 158.990 2.009 -1.450 1.00 0.00 H new ATOM 0 HA LEU A 42 156.847 3.900 -0.877 1.00 0.00 H new ATOM 0 HB2 LEU A 42 157.607 1.130 0.107 1.00 0.00 H new ATOM 0 HB3 LEU A 42 156.295 2.046 0.822 1.00 0.00 H new ATOM 0 HG LEU A 42 156.289 1.636 -2.148 1.00 0.00 H new ATOM 0 HD11 LEU A 42 155.133 -0.522 -1.870 1.00 0.00 H new ATOM 0 HD12 LEU A 42 156.806 -0.587 -1.268 1.00 0.00 H new ATOM 0 HD13 LEU A 42 155.452 -0.462 -0.120 1.00 0.00 H new ATOM 0 HD21 LEU A 42 153.853 1.584 -1.776 1.00 0.00 H new ATOM 0 HD22 LEU A 42 154.122 1.729 -0.023 1.00 0.00 H new ATOM 0 HD23 LEU A 42 154.592 3.059 -1.109 1.00 0.00 H new ATOM 700 N HIS A 43 157.742 5.037 1.124 1.00 0.00 N ATOM 701 CA HIS A 43 158.248 5.748 2.297 1.00 0.00 C ATOM 702 C HIS A 43 157.190 5.814 3.398 1.00 0.00 C ATOM 703 O HIS A 43 156.112 6.375 3.199 1.00 0.00 O ATOM 704 CB HIS A 43 158.682 7.167 1.910 1.00 0.00 C ATOM 705 CG HIS A 43 159.969 7.224 1.144 1.00 0.00 C ATOM 706 ND1 HIS A 43 160.771 8.345 1.106 1.00 0.00 N ATOM 707 CD2 HIS A 43 160.590 6.295 0.378 1.00 0.00 C ATOM 708 CE1 HIS A 43 161.827 8.104 0.350 1.00 0.00 C ATOM 709 NE2 HIS A 43 161.742 6.867 -0.103 1.00 0.00 N ATOM 0 H HIS A 43 157.034 5.548 0.597 1.00 0.00 H new ATOM 0 HA HIS A 43 159.109 5.198 2.678 1.00 0.00 H new ATOM 0 HB2 HIS A 43 157.895 7.626 1.312 1.00 0.00 H new ATOM 0 HB3 HIS A 43 158.784 7.764 2.816 1.00 0.00 H new ATOM 0 HD1 HIS A 43 160.579 9.224 1.587 1.00 0.00 H new ATOM 0 HD2 HIS A 43 160.243 5.291 0.182 1.00 0.00 H new ATOM 0 HE1 HIS A 43 162.625 8.801 0.138 1.00 0.00 H new ATOM 718 N TYR A 44 157.505 5.242 4.560 1.00 0.00 N ATOM 719 CA TYR A 44 156.581 5.242 5.689 1.00 0.00 C ATOM 720 C TYR A 44 157.203 5.947 6.896 1.00 0.00 C ATOM 721 O TYR A 44 158.319 5.625 7.309 1.00 0.00 O ATOM 722 CB TYR A 44 156.190 3.804 6.051 1.00 0.00 C ATOM 723 CG TYR A 44 155.469 3.675 7.376 1.00 0.00 C ATOM 724 CD1 TYR A 44 156.179 3.632 8.569 1.00 0.00 C ATOM 725 CD2 TYR A 44 154.083 3.595 7.433 1.00 0.00 C ATOM 726 CE1 TYR A 44 155.529 3.513 9.782 1.00 0.00 C ATOM 727 CE2 TYR A 44 153.426 3.476 8.642 1.00 0.00 C ATOM 728 CZ TYR A 44 154.152 3.436 9.814 1.00 0.00 C ATOM 729 OH TYR A 44 153.498 3.316 11.021 1.00 0.00 O ATOM 0 H TYR A 44 158.393 4.774 4.742 1.00 0.00 H new ATOM 0 HA TYR A 44 155.682 5.788 5.402 1.00 0.00 H new ATOM 0 HB2 TYR A 44 155.554 3.402 5.263 1.00 0.00 H new ATOM 0 HB3 TYR A 44 157.090 3.190 6.078 1.00 0.00 H new ATOM 0 HD1 TYR A 44 157.257 3.693 8.548 1.00 0.00 H new ATOM 0 HD2 TYR A 44 153.511 3.626 6.518 1.00 0.00 H new ATOM 0 HE1 TYR A 44 156.096 3.480 10.701 1.00 0.00 H new ATOM 0 HE2 TYR A 44 152.348 3.415 8.670 1.00 0.00 H new ATOM 0 HH TYR A 44 154.149 3.367 11.752 1.00 0.00 H new ATOM 739 N MET A 45 156.467 6.905 7.459 1.00 0.00 N ATOM 740 CA MET A 45 156.935 7.655 8.623 1.00 0.00 C ATOM 741 C MET A 45 156.118 7.284 9.858 1.00 0.00 C ATOM 742 O MET A 45 154.904 7.487 9.890 1.00 0.00 O ATOM 743 CB MET A 45 156.838 9.163 8.364 1.00 0.00 C ATOM 744 CG MET A 45 157.387 9.591 7.011 1.00 0.00 C ATOM 745 SD MET A 45 158.218 11.190 7.073 1.00 0.00 S ATOM 746 CE MET A 45 156.825 12.306 6.914 1.00 0.00 C ATOM 0 H MET A 45 155.543 7.180 7.127 1.00 0.00 H new ATOM 0 HA MET A 45 157.979 7.397 8.801 1.00 0.00 H new ATOM 0 HB2 MET A 45 155.794 9.468 8.435 1.00 0.00 H new ATOM 0 HB3 MET A 45 157.378 9.692 9.149 1.00 0.00 H new ATOM 0 HG2 MET A 45 158.086 8.836 6.652 1.00 0.00 H new ATOM 0 HG3 MET A 45 156.571 9.638 6.290 1.00 0.00 H new ATOM 0 HE1 MET A 45 157.180 13.336 6.935 1.00 0.00 H new ATOM 0 HE2 MET A 45 156.314 12.118 5.970 1.00 0.00 H new ATOM 0 HE3 MET A 45 156.133 12.144 7.740 1.00 0.00 H new ATOM 756 N ASN A 46 156.790 6.736 10.872 1.00 0.00 N ATOM 757 CA ASN A 46 156.122 6.333 12.111 1.00 0.00 C ATOM 758 C ASN A 46 155.467 7.534 12.792 1.00 0.00 C ATOM 759 O ASN A 46 154.241 7.624 12.865 1.00 0.00 O ATOM 760 CB ASN A 46 157.117 5.668 13.070 1.00 0.00 C ATOM 761 CG ASN A 46 157.018 4.154 13.053 1.00 0.00 C ATOM 762 OD1 ASN A 46 155.924 3.592 12.999 1.00 0.00 O ATOM 763 ND2 ASN A 46 158.164 3.482 13.101 1.00 0.00 N ATOM 0 H ASN A 46 157.795 6.561 10.860 1.00 0.00 H new ATOM 0 HA ASN A 46 155.346 5.613 11.853 1.00 0.00 H new ATOM 0 HB2 ASN A 46 158.130 5.966 12.801 1.00 0.00 H new ATOM 0 HB3 ASN A 46 156.937 6.029 14.083 1.00 0.00 H new ATOM 0 HD21 ASN A 46 158.158 2.462 13.094 1.00 0.00 H new ATOM 0 HD22 ASN A 46 159.049 3.986 13.145 1.00 0.00 H new ATOM 770 N ASN A 47 156.296 8.455 13.280 1.00 0.00 N ATOM 771 CA ASN A 47 155.811 9.660 13.948 1.00 0.00 C ATOM 772 C ASN A 47 156.803 10.807 13.762 1.00 0.00 C ATOM 773 O ASN A 47 156.464 11.845 13.193 1.00 0.00 O ATOM 774 CB ASN A 47 155.580 9.392 15.441 1.00 0.00 C ATOM 775 CG ASN A 47 154.110 9.436 15.817 1.00 0.00 C ATOM 776 OD1 ASN A 47 153.656 10.367 16.482 1.00 0.00 O ATOM 777 ND2 ASN A 47 153.356 8.427 15.394 1.00 0.00 N ATOM 0 H ASN A 47 157.312 8.388 13.224 1.00 0.00 H new ATOM 0 HA ASN A 47 154.860 9.945 13.497 1.00 0.00 H new ATOM 0 HB2 ASN A 47 155.989 8.415 15.699 1.00 0.00 H new ATOM 0 HB3 ASN A 47 156.125 10.131 16.028 1.00 0.00 H new ATOM 0 HD21 ASN A 47 152.361 8.405 15.618 1.00 0.00 H new ATOM 0 HD22 ASN A 47 153.772 7.675 14.845 1.00 0.00 H new ATOM 784 N GLU A 48 158.034 10.603 14.236 1.00 0.00 N ATOM 785 CA GLU A 48 159.087 11.609 14.116 1.00 0.00 C ATOM 786 C GLU A 48 160.299 11.070 13.338 1.00 0.00 C ATOM 787 O GLU A 48 161.358 11.702 13.320 1.00 0.00 O ATOM 788 CB GLU A 48 159.525 12.074 15.508 1.00 0.00 C ATOM 789 CG GLU A 48 158.821 13.337 15.980 1.00 0.00 C ATOM 790 CD GLU A 48 159.050 13.621 17.452 1.00 0.00 C ATOM 791 OE1 GLU A 48 158.690 12.764 18.288 1.00 0.00 O ATOM 792 OE2 GLU A 48 159.588 14.702 17.772 1.00 0.00 O ATOM 0 H GLU A 48 158.325 9.747 14.708 1.00 0.00 H new ATOM 0 HA GLU A 48 158.681 12.453 13.559 1.00 0.00 H new ATOM 0 HB2 GLU A 48 159.337 11.274 16.224 1.00 0.00 H new ATOM 0 HB3 GLU A 48 160.601 12.249 15.501 1.00 0.00 H new ATOM 0 HG2 GLU A 48 159.172 14.185 15.392 1.00 0.00 H new ATOM 0 HG3 GLU A 48 157.751 13.242 15.795 1.00 0.00 H new ATOM 799 N LEU A 49 160.142 9.906 12.693 1.00 0.00 N ATOM 800 CA LEU A 49 161.228 9.299 11.920 1.00 0.00 C ATOM 801 C LEU A 49 160.745 8.881 10.530 1.00 0.00 C ATOM 802 O LEU A 49 159.545 8.702 10.308 1.00 0.00 O ATOM 803 CB LEU A 49 161.791 8.076 12.659 1.00 0.00 C ATOM 804 CG LEU A 49 163.164 8.271 13.317 1.00 0.00 C ATOM 805 CD1 LEU A 49 164.218 8.627 12.278 1.00 0.00 C ATOM 806 CD2 LEU A 49 163.095 9.339 14.400 1.00 0.00 C ATOM 0 H LEU A 49 159.275 9.369 12.693 1.00 0.00 H new ATOM 0 HA LEU A 49 162.014 10.045 11.806 1.00 0.00 H new ATOM 0 HB2 LEU A 49 161.078 7.780 13.429 1.00 0.00 H new ATOM 0 HB3 LEU A 49 161.861 7.248 11.953 1.00 0.00 H new ATOM 0 HG LEU A 49 163.452 7.329 13.783 1.00 0.00 H new ATOM 0 HD11 LEU A 49 165.182 8.760 12.769 1.00 0.00 H new ATOM 0 HD12 LEU A 49 164.292 7.824 11.545 1.00 0.00 H new ATOM 0 HD13 LEU A 49 163.936 9.552 11.776 1.00 0.00 H new ATOM 0 HD21 LEU A 49 164.079 9.461 14.854 1.00 0.00 H new ATOM 0 HD22 LEU A 49 162.778 10.284 13.959 1.00 0.00 H new ATOM 0 HD23 LEU A 49 162.378 9.037 15.164 1.00 0.00 H new ATOM 818 N SER A 50 161.690 8.723 9.599 1.00 0.00 N ATOM 819 CA SER A 50 161.369 8.321 8.229 1.00 0.00 C ATOM 820 C SER A 50 162.020 6.984 7.883 1.00 0.00 C ATOM 821 O SER A 50 163.246 6.861 7.891 1.00 0.00 O ATOM 822 CB SER A 50 161.826 9.392 7.232 1.00 0.00 C ATOM 823 OG SER A 50 163.092 9.924 7.590 1.00 0.00 O ATOM 0 H SER A 50 162.685 8.868 9.771 1.00 0.00 H new ATOM 0 HA SER A 50 160.287 8.209 8.161 1.00 0.00 H new ATOM 0 HB2 SER A 50 161.880 8.962 6.232 1.00 0.00 H new ATOM 0 HB3 SER A 50 161.089 10.195 7.194 1.00 0.00 H new ATOM 0 HG SER A 50 163.684 9.196 7.874 1.00 0.00 H new ATOM 829 N ILE A 51 161.191 5.985 7.574 1.00 0.00 N ATOM 830 CA ILE A 51 161.685 4.657 7.218 1.00 0.00 C ATOM 831 C ILE A 51 161.373 4.334 5.758 1.00 0.00 C ATOM 832 O ILE A 51 160.254 4.552 5.287 1.00 0.00 O ATOM 833 CB ILE A 51 161.079 3.560 8.121 1.00 0.00 C ATOM 834 CG1 ILE A 51 161.234 3.929 9.602 1.00 0.00 C ATOM 835 CG2 ILE A 51 161.734 2.214 7.838 1.00 0.00 C ATOM 836 CD1 ILE A 51 160.078 3.469 10.464 1.00 0.00 C ATOM 0 H ILE A 51 160.175 6.072 7.564 1.00 0.00 H new ATOM 0 HA ILE A 51 162.765 4.672 7.365 1.00 0.00 H new ATOM 0 HB ILE A 51 160.015 3.483 7.896 1.00 0.00 H new ATOM 0 HG12 ILE A 51 162.157 3.491 9.982 1.00 0.00 H new ATOM 0 HG13 ILE A 51 161.334 5.011 9.690 1.00 0.00 H new ATOM 0 HG21 ILE A 51 161.295 1.453 8.483 1.00 0.00 H new ATOM 0 HG22 ILE A 51 161.572 1.943 6.795 1.00 0.00 H new ATOM 0 HG23 ILE A 51 162.804 2.282 8.033 1.00 0.00 H new ATOM 0 HD11 ILE A 51 160.255 3.764 11.498 1.00 0.00 H new ATOM 0 HD12 ILE A 51 159.155 3.927 10.109 1.00 0.00 H new ATOM 0 HD13 ILE A 51 159.990 2.384 10.406 1.00 0.00 H new ATOM 848 N LEU A 52 162.372 3.814 5.046 1.00 0.00 N ATOM 849 CA LEU A 52 162.214 3.460 3.638 1.00 0.00 C ATOM 850 C LEU A 52 161.895 1.975 3.481 1.00 0.00 C ATOM 851 O LEU A 52 162.652 1.117 3.940 1.00 0.00 O ATOM 852 CB LEU A 52 163.485 3.806 2.858 1.00 0.00 C ATOM 853 CG LEU A 52 163.271 4.116 1.374 1.00 0.00 C ATOM 854 CD1 LEU A 52 164.244 5.188 0.904 1.00 0.00 C ATOM 855 CD2 LEU A 52 163.419 2.854 0.536 1.00 0.00 C ATOM 0 H LEU A 52 163.301 3.629 5.423 1.00 0.00 H new ATOM 0 HA LEU A 52 161.380 4.036 3.236 1.00 0.00 H new ATOM 0 HB2 LEU A 52 163.959 4.668 3.329 1.00 0.00 H new ATOM 0 HB3 LEU A 52 164.183 2.973 2.942 1.00 0.00 H new ATOM 0 HG LEU A 52 162.257 4.495 1.247 1.00 0.00 H new ATOM 0 HD11 LEU A 52 164.076 5.394 -0.153 1.00 0.00 H new ATOM 0 HD12 LEU A 52 164.087 6.100 1.481 1.00 0.00 H new ATOM 0 HD13 LEU A 52 165.267 4.839 1.047 1.00 0.00 H new ATOM 0 HD21 LEU A 52 163.263 3.095 -0.516 1.00 0.00 H new ATOM 0 HD22 LEU A 52 164.420 2.444 0.670 1.00 0.00 H new ATOM 0 HD23 LEU A 52 162.680 2.118 0.853 1.00 0.00 H new ATOM 867 N LEU A 53 160.773 1.680 2.828 1.00 0.00 N ATOM 868 CA LEU A 53 160.354 0.300 2.605 1.00 0.00 C ATOM 869 C LEU A 53 160.872 -0.216 1.263 1.00 0.00 C ATOM 870 O LEU A 53 160.142 -0.235 0.270 1.00 0.00 O ATOM 871 CB LEU A 53 158.824 0.191 2.658 1.00 0.00 C ATOM 872 CG LEU A 53 158.182 0.639 3.975 1.00 0.00 C ATOM 873 CD1 LEU A 53 156.791 1.207 3.727 1.00 0.00 C ATOM 874 CD2 LEU A 53 158.119 -0.520 4.959 1.00 0.00 C ATOM 0 H LEU A 53 160.138 2.380 2.444 1.00 0.00 H new ATOM 0 HA LEU A 53 160.779 -0.316 3.397 1.00 0.00 H new ATOM 0 HB2 LEU A 53 158.405 0.787 1.847 1.00 0.00 H new ATOM 0 HB3 LEU A 53 158.543 -0.845 2.470 1.00 0.00 H new ATOM 0 HG LEU A 53 158.800 1.425 4.409 1.00 0.00 H new ATOM 0 HD11 LEU A 53 156.351 1.520 4.674 1.00 0.00 H new ATOM 0 HD12 LEU A 53 156.862 2.065 3.059 1.00 0.00 H new ATOM 0 HD13 LEU A 53 156.162 0.443 3.270 1.00 0.00 H new ATOM 0 HD21 LEU A 53 157.660 -0.183 5.889 1.00 0.00 H new ATOM 0 HD22 LEU A 53 157.524 -1.328 4.532 1.00 0.00 H new ATOM 0 HD23 LEU A 53 159.128 -0.880 5.162 1.00 0.00 H new ATOM 886 N LYS A 54 162.136 -0.633 1.242 1.00 0.00 N ATOM 887 CA LYS A 54 162.755 -1.154 0.026 1.00 0.00 C ATOM 888 C LYS A 54 162.855 -2.681 0.073 1.00 0.00 C ATOM 889 O LYS A 54 162.762 -3.345 -0.961 1.00 0.00 O ATOM 890 CB LYS A 54 164.144 -0.542 -0.171 1.00 0.00 C ATOM 891 CG LYS A 54 164.827 -0.969 -1.462 1.00 0.00 C ATOM 892 CD LYS A 54 165.557 0.193 -2.121 1.00 0.00 C ATOM 893 CE LYS A 54 166.489 -0.280 -3.229 1.00 0.00 C ATOM 894 NZ LYS A 54 165.884 -0.116 -4.584 1.00 0.00 N ATOM 0 H LYS A 54 162.752 -0.620 2.055 1.00 0.00 H new ATOM 0 HA LYS A 54 162.124 -0.877 -0.818 1.00 0.00 H new ATOM 0 HB2 LYS A 54 164.057 0.544 -0.159 1.00 0.00 H new ATOM 0 HB3 LYS A 54 164.776 -0.820 0.672 1.00 0.00 H new ATOM 0 HG2 LYS A 54 165.534 -1.771 -1.252 1.00 0.00 H new ATOM 0 HG3 LYS A 54 164.084 -1.371 -2.151 1.00 0.00 H new ATOM 0 HD2 LYS A 54 164.830 0.893 -2.532 1.00 0.00 H new ATOM 0 HD3 LYS A 54 166.131 0.735 -1.369 1.00 0.00 H new ATOM 0 HE2 LYS A 54 167.423 0.280 -3.180 1.00 0.00 H new ATOM 0 HE3 LYS A 54 166.738 -1.329 -3.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 166.554 -0.451 -5.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 165.006 -0.671 -4.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 165.670 0.888 -4.749 1.00 0.00 H new ATOM 908 N ASN A 55 163.047 -3.231 1.276 1.00 0.00 N ATOM 909 CA ASN A 55 163.163 -4.678 1.453 1.00 0.00 C ATOM 910 C ASN A 55 161.918 -5.251 2.125 1.00 0.00 C ATOM 911 O ASN A 55 161.108 -4.512 2.688 1.00 0.00 O ATOM 912 CB ASN A 55 164.401 -5.015 2.290 1.00 0.00 C ATOM 913 CG ASN A 55 165.686 -4.497 1.669 1.00 0.00 C ATOM 914 OD1 ASN A 55 165.930 -4.681 0.476 1.00 0.00 O ATOM 915 ND2 ASN A 55 166.515 -3.841 2.475 1.00 0.00 N ATOM 0 H ASN A 55 163.125 -2.695 2.140 1.00 0.00 H new ATOM 0 HA ASN A 55 163.262 -5.128 0.465 1.00 0.00 H new ATOM 0 HB2 ASN A 55 164.287 -4.590 3.287 1.00 0.00 H new ATOM 0 HB3 ASN A 55 164.470 -6.096 2.410 1.00 0.00 H new ATOM 0 HD21 ASN A 55 167.392 -3.468 2.111 1.00 0.00 H new ATOM 0 HD22 ASN A 55 166.274 -3.711 3.458 1.00 0.00 H new ATOM 922 N GLN A 56 161.778 -6.578 2.069 1.00 0.00 N ATOM 923 CA GLN A 56 160.637 -7.258 2.681 1.00 0.00 C ATOM 924 C GLN A 56 160.622 -7.046 4.195 1.00 0.00 C ATOM 925 O GLN A 56 159.555 -6.924 4.799 1.00 0.00 O ATOM 926 CB GLN A 56 160.671 -8.757 2.369 1.00 0.00 C ATOM 927 CG GLN A 56 159.631 -9.194 1.349 1.00 0.00 C ATOM 928 CD GLN A 56 158.341 -9.663 1.995 1.00 0.00 C ATOM 929 OE1 GLN A 56 158.220 -10.822 2.394 1.00 0.00 O ATOM 930 NE2 GLN A 56 157.367 -8.765 2.102 1.00 0.00 N ATOM 0 H GLN A 56 162.440 -7.201 1.607 1.00 0.00 H new ATOM 0 HA GLN A 56 159.729 -6.828 2.259 1.00 0.00 H new ATOM 0 HB2 GLN A 56 161.662 -9.020 1.999 1.00 0.00 H new ATOM 0 HB3 GLN A 56 160.517 -9.315 3.293 1.00 0.00 H new ATOM 0 HG2 GLN A 56 159.415 -8.363 0.677 1.00 0.00 H new ATOM 0 HG3 GLN A 56 160.041 -9.999 0.739 1.00 0.00 H new ATOM 0 HE21 GLN A 56 157.509 -7.815 1.758 1.00 0.00 H new ATOM 0 HE22 GLN A 56 156.478 -9.026 2.528 1.00 0.00 H new ATOM 939 N ASP A 57 161.813 -7.006 4.801 1.00 0.00 N ATOM 940 CA ASP A 57 161.940 -6.808 6.246 1.00 0.00 C ATOM 941 C ASP A 57 161.227 -5.532 6.689 1.00 0.00 C ATOM 942 O ASP A 57 160.538 -5.521 7.709 1.00 0.00 O ATOM 943 CB ASP A 57 163.419 -6.750 6.652 1.00 0.00 C ATOM 944 CG ASP A 57 163.932 -8.072 7.198 1.00 0.00 C ATOM 945 OD1 ASP A 57 163.545 -9.131 6.660 1.00 0.00 O ATOM 946 OD2 ASP A 57 164.724 -8.046 8.164 1.00 0.00 O ATOM 0 H ASP A 57 162.702 -7.108 4.312 1.00 0.00 H new ATOM 0 HA ASP A 57 161.469 -7.656 6.743 1.00 0.00 H new ATOM 0 HB2 ASP A 57 164.017 -6.462 5.787 1.00 0.00 H new ATOM 0 HB3 ASP A 57 163.554 -5.974 7.405 1.00 0.00 H new ATOM 951 N ASP A 58 161.393 -4.461 5.911 1.00 0.00 N ATOM 952 CA ASP A 58 160.758 -3.180 6.217 1.00 0.00 C ATOM 953 C ASP A 58 159.237 -3.325 6.244 1.00 0.00 C ATOM 954 O ASP A 58 158.572 -2.812 7.146 1.00 0.00 O ATOM 955 CB ASP A 58 161.164 -2.118 5.190 1.00 0.00 C ATOM 956 CG ASP A 58 162.665 -1.904 5.132 1.00 0.00 C ATOM 957 OD1 ASP A 58 163.254 -1.533 6.172 1.00 0.00 O ATOM 958 OD2 ASP A 58 163.251 -2.108 4.047 1.00 0.00 O ATOM 0 H ASP A 58 161.962 -4.456 5.064 1.00 0.00 H new ATOM 0 HA ASP A 58 161.097 -2.862 7.203 1.00 0.00 H new ATOM 0 HB2 ASP A 58 160.805 -2.415 4.205 1.00 0.00 H new ATOM 0 HB3 ASP A 58 160.676 -1.175 5.436 1.00 0.00 H new ATOM 963 N LEU A 59 158.694 -4.031 5.251 1.00 0.00 N ATOM 964 CA LEU A 59 157.252 -4.250 5.161 1.00 0.00 C ATOM 965 C LEU A 59 156.755 -5.118 6.316 1.00 0.00 C ATOM 966 O LEU A 59 155.691 -4.859 6.879 1.00 0.00 O ATOM 967 CB LEU A 59 156.891 -4.904 3.825 1.00 0.00 C ATOM 968 CG LEU A 59 155.412 -5.274 3.666 1.00 0.00 C ATOM 969 CD1 LEU A 59 154.918 -4.927 2.269 1.00 0.00 C ATOM 970 CD2 LEU A 59 155.194 -6.752 3.967 1.00 0.00 C ATOM 0 H LEU A 59 159.232 -4.460 4.498 1.00 0.00 H new ATOM 0 HA LEU A 59 156.763 -3.278 5.225 1.00 0.00 H new ATOM 0 HB2 LEU A 59 157.170 -4.226 3.018 1.00 0.00 H new ATOM 0 HB3 LEU A 59 157.491 -5.806 3.705 1.00 0.00 H new ATOM 0 HG LEU A 59 154.834 -4.692 4.383 1.00 0.00 H new ATOM 0 HD11 LEU A 59 153.866 -5.198 2.177 1.00 0.00 H new ATOM 0 HD12 LEU A 59 155.034 -3.857 2.098 1.00 0.00 H new ATOM 0 HD13 LEU A 59 155.500 -5.478 1.530 1.00 0.00 H new ATOM 0 HD21 LEU A 59 154.138 -6.996 3.849 1.00 0.00 H new ATOM 0 HD22 LEU A 59 155.785 -7.355 3.277 1.00 0.00 H new ATOM 0 HD23 LEU A 59 155.503 -6.964 4.991 1.00 0.00 H new ATOM 982 N ASP A 60 157.527 -6.147 6.663 1.00 0.00 N ATOM 983 CA ASP A 60 157.155 -7.049 7.751 1.00 0.00 C ATOM 984 C ASP A 60 157.047 -6.292 9.074 1.00 0.00 C ATOM 985 O ASP A 60 156.126 -6.525 9.857 1.00 0.00 O ATOM 986 CB ASP A 60 158.175 -8.184 7.878 1.00 0.00 C ATOM 987 CG ASP A 60 157.532 -9.496 8.286 1.00 0.00 C ATOM 988 OD1 ASP A 60 156.944 -10.166 7.410 1.00 0.00 O ATOM 989 OD2 ASP A 60 157.617 -9.852 9.479 1.00 0.00 O ATOM 0 H ASP A 60 158.411 -6.376 6.208 1.00 0.00 H new ATOM 0 HA ASP A 60 156.180 -7.475 7.517 1.00 0.00 H new ATOM 0 HB2 ASP A 60 158.689 -8.315 6.926 1.00 0.00 H new ATOM 0 HB3 ASP A 60 158.931 -7.909 8.613 1.00 0.00 H new ATOM 994 N LYS A 61 157.989 -5.380 9.313 1.00 0.00 N ATOM 995 CA LYS A 61 157.995 -4.581 10.537 1.00 0.00 C ATOM 996 C LYS A 61 156.792 -3.639 10.584 1.00 0.00 C ATOM 997 O LYS A 61 156.217 -3.412 11.649 1.00 0.00 O ATOM 998 CB LYS A 61 159.289 -3.768 10.635 1.00 0.00 C ATOM 999 CG LYS A 61 160.526 -4.616 10.871 1.00 0.00 C ATOM 1000 CD LYS A 61 161.676 -3.783 11.417 1.00 0.00 C ATOM 1001 CE LYS A 61 162.684 -3.442 10.328 1.00 0.00 C ATOM 1002 NZ LYS A 61 162.264 -2.260 9.520 1.00 0.00 N ATOM 0 H LYS A 61 158.758 -5.176 8.675 1.00 0.00 H new ATOM 0 HA LYS A 61 157.934 -5.265 11.383 1.00 0.00 H new ATOM 0 HB2 LYS A 61 159.420 -3.198 9.715 1.00 0.00 H new ATOM 0 HB3 LYS A 61 159.194 -3.046 11.446 1.00 0.00 H new ATOM 0 HG2 LYS A 61 160.291 -5.417 11.571 1.00 0.00 H new ATOM 0 HG3 LYS A 61 160.829 -5.088 9.936 1.00 0.00 H new ATOM 0 HD2 LYS A 61 161.286 -2.864 11.854 1.00 0.00 H new ATOM 0 HD3 LYS A 61 162.175 -4.330 12.218 1.00 0.00 H new ATOM 0 HE2 LYS A 61 163.654 -3.242 10.783 1.00 0.00 H new ATOM 0 HE3 LYS A 61 162.811 -4.302 9.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 162.853 -2.197 8.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 161.266 -2.364 9.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 162.379 -1.395 10.085 1.00 0.00 H new ATOM 1016 N ALA A 62 156.419 -3.093 9.425 1.00 0.00 N ATOM 1017 CA ALA A 62 155.287 -2.173 9.337 1.00 0.00 C ATOM 1018 C ALA A 62 153.980 -2.861 9.725 1.00 0.00 C ATOM 1019 O ALA A 62 153.183 -2.308 10.486 1.00 0.00 O ATOM 1020 CB ALA A 62 155.184 -1.586 7.936 1.00 0.00 C ATOM 0 H ALA A 62 156.885 -3.273 8.536 1.00 0.00 H new ATOM 0 HA ALA A 62 155.461 -1.362 10.044 1.00 0.00 H new ATOM 0 HB1 ALA A 62 154.336 -0.903 7.889 1.00 0.00 H new ATOM 0 HB2 ALA A 62 156.100 -1.044 7.701 1.00 0.00 H new ATOM 0 HB3 ALA A 62 155.043 -2.390 7.214 1.00 0.00 H new ATOM 1026 N ILE A 63 153.765 -4.069 9.204 1.00 0.00 N ATOM 1027 CA ILE A 63 152.553 -4.826 9.508 1.00 0.00 C ATOM 1028 C ILE A 63 152.518 -5.223 10.981 1.00 0.00 C ATOM 1029 O ILE A 63 151.468 -5.153 11.623 1.00 0.00 O ATOM 1030 CB ILE A 63 152.425 -6.096 8.636 1.00 0.00 C ATOM 1031 CG1 ILE A 63 152.532 -5.743 7.149 1.00 0.00 C ATOM 1032 CG2 ILE A 63 151.104 -6.801 8.923 1.00 0.00 C ATOM 1033 CD1 ILE A 63 151.442 -4.810 6.664 1.00 0.00 C ATOM 0 H ILE A 63 154.412 -4.542 8.572 1.00 0.00 H new ATOM 0 HA ILE A 63 151.711 -4.171 9.283 1.00 0.00 H new ATOM 0 HB ILE A 63 153.243 -6.772 8.886 1.00 0.00 H new ATOM 0 HG12 ILE A 63 153.502 -5.282 6.963 1.00 0.00 H new ATOM 0 HG13 ILE A 63 152.499 -6.662 6.563 1.00 0.00 H new ATOM 0 HG21 ILE A 63 151.026 -7.694 8.303 1.00 0.00 H new ATOM 0 HG22 ILE A 63 151.064 -7.085 9.975 1.00 0.00 H new ATOM 0 HG23 ILE A 63 150.276 -6.129 8.697 1.00 0.00 H new ATOM 0 HD11 ILE A 63 151.584 -4.606 5.603 1.00 0.00 H new ATOM 0 HD12 ILE A 63 150.469 -5.277 6.817 1.00 0.00 H new ATOM 0 HD13 ILE A 63 151.488 -3.875 7.223 1.00 0.00 H new ATOM 1045 N ASP A 64 153.671 -5.635 11.512 1.00 0.00 N ATOM 1046 CA ASP A 64 153.772 -6.038 12.913 1.00 0.00 C ATOM 1047 C ASP A 64 153.277 -4.928 13.842 1.00 0.00 C ATOM 1048 O ASP A 64 152.582 -5.197 14.822 1.00 0.00 O ATOM 1049 CB ASP A 64 155.218 -6.404 13.262 1.00 0.00 C ATOM 1050 CG ASP A 64 155.307 -7.307 14.476 1.00 0.00 C ATOM 1051 OD1 ASP A 64 155.109 -8.531 14.322 1.00 0.00 O ATOM 1052 OD2 ASP A 64 155.573 -6.790 15.582 1.00 0.00 O ATOM 0 H ASP A 64 154.546 -5.698 10.992 1.00 0.00 H new ATOM 0 HA ASP A 64 153.139 -6.914 13.055 1.00 0.00 H new ATOM 0 HB2 ASP A 64 155.681 -6.900 12.409 1.00 0.00 H new ATOM 0 HB3 ASP A 64 155.786 -5.493 13.448 1.00 0.00 H new ATOM 1057 N ILE A 65 153.633 -3.682 13.523 1.00 0.00 N ATOM 1058 CA ILE A 65 153.217 -2.535 14.331 1.00 0.00 C ATOM 1059 C ILE A 65 151.703 -2.330 14.250 1.00 0.00 C ATOM 1060 O ILE A 65 151.054 -2.044 15.258 1.00 0.00 O ATOM 1061 CB ILE A 65 153.929 -1.232 13.895 1.00 0.00 C ATOM 1062 CG1 ILE A 65 155.449 -1.431 13.852 1.00 0.00 C ATOM 1063 CG2 ILE A 65 153.569 -0.088 14.836 1.00 0.00 C ATOM 1064 CD1 ILE A 65 156.135 -0.637 12.758 1.00 0.00 C ATOM 0 H ILE A 65 154.206 -3.442 12.714 1.00 0.00 H new ATOM 0 HA ILE A 65 153.501 -2.758 15.359 1.00 0.00 H new ATOM 0 HB ILE A 65 153.589 -0.977 12.891 1.00 0.00 H new ATOM 0 HG12 ILE A 65 155.872 -1.146 14.815 1.00 0.00 H new ATOM 0 HG13 ILE A 65 155.664 -2.490 13.710 1.00 0.00 H new ATOM 0 HG21 ILE A 65 154.078 0.821 14.515 1.00 0.00 H new ATOM 0 HG22 ILE A 65 152.491 0.074 14.817 1.00 0.00 H new ATOM 0 HG23 ILE A 65 153.880 -0.339 15.850 1.00 0.00 H new ATOM 0 HD11 ILE A 65 157.208 -0.827 12.788 1.00 0.00 H new ATOM 0 HD12 ILE A 65 155.740 -0.938 11.788 1.00 0.00 H new ATOM 0 HD13 ILE A 65 155.951 0.426 12.910 1.00 0.00 H new ATOM 1076 N LEU A 66 151.147 -2.481 13.047 1.00 0.00 N ATOM 1077 CA LEU A 66 149.709 -2.316 12.838 1.00 0.00 C ATOM 1078 C LEU A 66 148.917 -3.356 13.631 1.00 0.00 C ATOM 1079 O LEU A 66 147.891 -3.035 14.229 1.00 0.00 O ATOM 1080 CB LEU A 66 149.364 -2.418 11.348 1.00 0.00 C ATOM 1081 CG LEU A 66 147.906 -2.101 10.993 1.00 0.00 C ATOM 1082 CD1 LEU A 66 147.580 -0.646 11.306 1.00 0.00 C ATOM 1083 CD2 LEU A 66 147.634 -2.411 9.525 1.00 0.00 C ATOM 0 H LEU A 66 151.670 -2.717 12.204 1.00 0.00 H new ATOM 0 HA LEU A 66 149.432 -1.325 13.196 1.00 0.00 H new ATOM 0 HB2 LEU A 66 150.012 -1.739 10.794 1.00 0.00 H new ATOM 0 HB3 LEU A 66 149.593 -3.427 11.006 1.00 0.00 H new ATOM 0 HG LEU A 66 147.259 -2.732 11.602 1.00 0.00 H new ATOM 0 HD11 LEU A 66 146.541 -0.442 11.047 1.00 0.00 H new ATOM 0 HD12 LEU A 66 147.732 -0.460 12.369 1.00 0.00 H new ATOM 0 HD13 LEU A 66 148.233 0.006 10.726 1.00 0.00 H new ATOM 0 HD21 LEU A 66 146.595 -2.180 9.291 1.00 0.00 H new ATOM 0 HD22 LEU A 66 148.290 -1.807 8.898 1.00 0.00 H new ATOM 0 HD23 LEU A 66 147.822 -3.468 9.335 1.00 0.00 H new ATOM 1095 N ASP A 67 149.400 -4.602 13.631 1.00 0.00 N ATOM 1096 CA ASP A 67 148.731 -5.686 14.356 1.00 0.00 C ATOM 1097 C ASP A 67 148.614 -5.365 15.846 1.00 0.00 C ATOM 1098 O ASP A 67 147.604 -5.676 16.477 1.00 0.00 O ATOM 1099 CB ASP A 67 149.484 -7.007 14.166 1.00 0.00 C ATOM 1100 CG ASP A 67 148.741 -8.189 14.761 1.00 0.00 C ATOM 1101 OD1 ASP A 67 147.796 -8.686 14.111 1.00 0.00 O ATOM 1102 OD2 ASP A 67 149.102 -8.617 15.878 1.00 0.00 O ATOM 0 H ASP A 67 150.248 -4.884 13.139 1.00 0.00 H new ATOM 0 HA ASP A 67 147.726 -5.787 13.945 1.00 0.00 H new ATOM 0 HB2 ASP A 67 149.644 -7.181 13.102 1.00 0.00 H new ATOM 0 HB3 ASP A 67 150.468 -6.930 14.628 1.00 0.00 H new ATOM 1107 N ARG A 68 149.653 -4.738 16.401 1.00 0.00 N ATOM 1108 CA ARG A 68 149.667 -4.371 17.817 1.00 0.00 C ATOM 1109 C ARG A 68 148.727 -3.196 18.096 1.00 0.00 C ATOM 1110 O ARG A 68 148.155 -3.096 19.183 1.00 0.00 O ATOM 1111 CB ARG A 68 151.089 -4.010 18.258 1.00 0.00 C ATOM 1112 CG ARG A 68 151.446 -4.519 19.645 1.00 0.00 C ATOM 1113 CD ARG A 68 152.712 -3.861 20.176 1.00 0.00 C ATOM 1114 NE ARG A 68 153.685 -4.843 20.654 1.00 0.00 N ATOM 1115 CZ ARG A 68 153.511 -5.604 21.739 1.00 0.00 C ATOM 1116 NH1 ARG A 68 152.399 -5.505 22.466 1.00 0.00 N ATOM 1117 NH2 ARG A 68 154.454 -6.468 22.098 1.00 0.00 N ATOM 0 H ARG A 68 150.496 -4.474 15.891 1.00 0.00 H new ATOM 0 HA ARG A 68 149.319 -5.232 18.387 1.00 0.00 H new ATOM 0 HB2 ARG A 68 151.798 -4.418 17.537 1.00 0.00 H new ATOM 0 HB3 ARG A 68 151.202 -2.926 18.238 1.00 0.00 H new ATOM 0 HG2 ARG A 68 150.620 -4.323 20.329 1.00 0.00 H new ATOM 0 HG3 ARG A 68 151.584 -5.600 19.612 1.00 0.00 H new ATOM 0 HD2 ARG A 68 153.164 -3.258 19.389 1.00 0.00 H new ATOM 0 HD3 ARG A 68 152.454 -3.182 20.989 1.00 0.00 H new ATOM 0 HE ARG A 68 154.551 -4.954 20.126 1.00 0.00 H new ATOM 0 HH11 ARG A 68 151.671 -4.844 22.196 1.00 0.00 H new ATOM 0 HH12 ARG A 68 152.276 -6.090 23.292 1.00 0.00 H new ATOM 0 HH21 ARG A 68 155.308 -6.549 21.546 1.00 0.00 H new ATOM 0 HH22 ARG A 68 154.324 -7.050 22.925 1.00 0.00 H new ATOM 1131 N SER A 69 148.578 -2.306 17.113 1.00 0.00 N ATOM 1132 CA SER A 69 147.715 -1.137 17.255 1.00 0.00 C ATOM 1133 C SER A 69 146.353 -1.371 16.598 1.00 0.00 C ATOM 1134 O SER A 69 146.180 -1.123 15.402 1.00 0.00 O ATOM 1135 CB SER A 69 148.390 0.095 16.642 1.00 0.00 C ATOM 1136 OG SER A 69 147.759 1.294 17.067 1.00 0.00 O ATOM 0 H SER A 69 149.046 -2.375 16.209 1.00 0.00 H new ATOM 0 HA SER A 69 147.553 -0.965 18.319 1.00 0.00 H new ATOM 0 HB2 SER A 69 149.442 0.115 16.926 1.00 0.00 H new ATOM 0 HB3 SER A 69 148.354 0.029 15.555 1.00 0.00 H new ATOM 0 HG SER A 69 148.211 2.063 16.662 1.00 0.00 H new ATOM 1142 N SER A 70 145.385 -1.839 17.391 1.00 0.00 N ATOM 1143 CA SER A 70 144.032 -2.098 16.891 1.00 0.00 C ATOM 1144 C SER A 70 143.317 -0.797 16.515 1.00 0.00 C ATOM 1145 O SER A 70 142.485 -0.782 15.606 1.00 0.00 O ATOM 1146 CB SER A 70 143.209 -2.852 17.940 1.00 0.00 C ATOM 1147 OG SER A 70 143.058 -2.082 19.121 1.00 0.00 O ATOM 0 H SER A 70 145.513 -2.046 18.381 1.00 0.00 H new ATOM 0 HA SER A 70 144.125 -2.711 15.995 1.00 0.00 H new ATOM 0 HB2 SER A 70 142.228 -3.094 17.532 1.00 0.00 H new ATOM 0 HB3 SER A 70 143.697 -3.797 18.178 1.00 0.00 H new ATOM 0 HG SER A 70 142.528 -2.585 19.774 1.00 0.00 H new ATOM 1153 N SER A 71 143.643 0.289 17.224 1.00 0.00 N ATOM 1154 CA SER A 71 143.030 1.596 16.968 1.00 0.00 C ATOM 1155 C SER A 71 143.227 2.023 15.514 1.00 0.00 C ATOM 1156 O SER A 71 142.301 2.522 14.874 1.00 0.00 O ATOM 1157 CB SER A 71 143.618 2.658 17.904 1.00 0.00 C ATOM 1158 OG SER A 71 145.036 2.663 17.851 1.00 0.00 O ATOM 0 H SER A 71 144.328 0.288 17.980 1.00 0.00 H new ATOM 0 HA SER A 71 141.961 1.503 17.159 1.00 0.00 H new ATOM 0 HB2 SER A 71 143.238 3.641 17.626 1.00 0.00 H new ATOM 0 HB3 SER A 71 143.291 2.467 18.926 1.00 0.00 H new ATOM 0 HG SER A 71 145.384 3.351 18.456 1.00 0.00 H new ATOM 1164 N MET A 72 144.442 1.826 15.003 1.00 0.00 N ATOM 1165 CA MET A 72 144.769 2.190 13.628 1.00 0.00 C ATOM 1166 C MET A 72 144.350 1.093 12.651 1.00 0.00 C ATOM 1167 O MET A 72 144.207 -0.071 13.032 1.00 0.00 O ATOM 1168 CB MET A 72 146.269 2.456 13.495 1.00 0.00 C ATOM 1169 CG MET A 72 146.603 3.572 12.520 1.00 0.00 C ATOM 1170 SD MET A 72 148.311 4.132 12.665 1.00 0.00 S ATOM 1171 CE MET A 72 149.196 2.612 12.327 1.00 0.00 C ATOM 0 H MET A 72 145.217 1.415 15.524 1.00 0.00 H new ATOM 0 HA MET A 72 144.217 3.097 13.382 1.00 0.00 H new ATOM 0 HB2 MET A 72 146.673 2.708 14.475 1.00 0.00 H new ATOM 0 HB3 MET A 72 146.765 1.541 13.171 1.00 0.00 H new ATOM 0 HG2 MET A 72 146.423 3.226 11.502 1.00 0.00 H new ATOM 0 HG3 MET A 72 145.933 4.414 12.694 1.00 0.00 H new ATOM 0 HE1 MET A 72 150.255 2.831 12.186 1.00 0.00 H new ATOM 0 HE2 MET A 72 149.075 1.927 13.166 1.00 0.00 H new ATOM 0 HE3 MET A 72 148.797 2.152 11.423 1.00 0.00 H new ATOM 1181 N LYS A 73 144.160 1.477 11.387 1.00 0.00 N ATOM 1182 CA LYS A 73 143.762 0.533 10.343 1.00 0.00 C ATOM 1183 C LYS A 73 144.429 0.879 9.010 1.00 0.00 C ATOM 1184 O LYS A 73 145.043 0.019 8.375 1.00 0.00 O ATOM 1185 CB LYS A 73 142.237 0.522 10.187 1.00 0.00 C ATOM 1186 CG LYS A 73 141.507 0.007 11.419 1.00 0.00 C ATOM 1187 CD LYS A 73 140.052 -0.323 11.117 1.00 0.00 C ATOM 1188 CE LYS A 73 139.206 -0.335 12.383 1.00 0.00 C ATOM 1189 NZ LYS A 73 139.617 -1.415 13.327 1.00 0.00 N ATOM 0 H LYS A 73 144.276 2.437 11.062 1.00 0.00 H new ATOM 0 HA LYS A 73 144.092 -0.462 10.641 1.00 0.00 H new ATOM 0 HB2 LYS A 73 141.894 1.533 9.967 1.00 0.00 H new ATOM 0 HB3 LYS A 73 141.971 -0.098 9.331 1.00 0.00 H new ATOM 0 HG2 LYS A 73 142.011 -0.883 11.795 1.00 0.00 H new ATOM 0 HG3 LYS A 73 141.553 0.757 12.209 1.00 0.00 H new ATOM 0 HD2 LYS A 73 139.650 0.409 10.417 1.00 0.00 H new ATOM 0 HD3 LYS A 73 139.993 -1.296 10.630 1.00 0.00 H new ATOM 0 HE2 LYS A 73 139.288 0.631 12.881 1.00 0.00 H new ATOM 0 HE3 LYS A 73 138.158 -0.468 12.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 139.014 -1.384 14.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 139.515 -2.340 12.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 140.610 -1.275 13.604 1.00 0.00 H new ATOM 1203 N SER A 74 144.310 2.141 8.592 1.00 0.00 N ATOM 1204 CA SER A 74 144.907 2.595 7.335 1.00 0.00 C ATOM 1205 C SER A 74 146.405 2.866 7.503 1.00 0.00 C ATOM 1206 O SER A 74 146.858 3.242 8.586 1.00 0.00 O ATOM 1207 CB SER A 74 144.204 3.860 6.831 1.00 0.00 C ATOM 1208 OG SER A 74 142.799 3.766 6.992 1.00 0.00 O ATOM 0 H SER A 74 143.807 2.865 9.105 1.00 0.00 H new ATOM 0 HA SER A 74 144.779 1.800 6.600 1.00 0.00 H new ATOM 0 HB2 SER A 74 144.577 4.728 7.375 1.00 0.00 H new ATOM 0 HB3 SER A 74 144.442 4.017 5.779 1.00 0.00 H new ATOM 0 HG SER A 74 142.376 4.587 6.664 1.00 0.00 H new ATOM 1214 N LEU A 75 147.167 2.672 6.423 1.00 0.00 N ATOM 1215 CA LEU A 75 148.613 2.896 6.447 1.00 0.00 C ATOM 1216 C LEU A 75 148.998 4.067 5.545 1.00 0.00 C ATOM 1217 O LEU A 75 148.645 4.089 4.365 1.00 0.00 O ATOM 1218 CB LEU A 75 149.357 1.631 5.999 1.00 0.00 C ATOM 1219 CG LEU A 75 149.811 0.701 7.129 1.00 0.00 C ATOM 1220 CD1 LEU A 75 150.817 1.400 8.031 1.00 0.00 C ATOM 1221 CD2 LEU A 75 148.617 0.213 7.936 1.00 0.00 C ATOM 0 H LEU A 75 146.805 2.360 5.522 1.00 0.00 H new ATOM 0 HA LEU A 75 148.899 3.136 7.471 1.00 0.00 H new ATOM 0 HB2 LEU A 75 148.710 1.068 5.326 1.00 0.00 H new ATOM 0 HB3 LEU A 75 150.233 1.930 5.423 1.00 0.00 H new ATOM 0 HG LEU A 75 150.298 -0.165 6.681 1.00 0.00 H new ATOM 0 HD11 LEU A 75 151.126 0.721 8.826 1.00 0.00 H new ATOM 0 HD12 LEU A 75 151.688 1.693 7.446 1.00 0.00 H new ATOM 0 HD13 LEU A 75 150.359 2.287 8.468 1.00 0.00 H new ATOM 0 HD21 LEU A 75 148.961 -0.446 8.733 1.00 0.00 H new ATOM 0 HD22 LEU A 75 148.098 1.067 8.370 1.00 0.00 H new ATOM 0 HD23 LEU A 75 147.935 -0.333 7.283 1.00 0.00 H new ATOM 1233 N ARG A 76 149.725 5.036 6.105 1.00 0.00 N ATOM 1234 CA ARG A 76 150.158 6.209 5.345 1.00 0.00 C ATOM 1235 C ARG A 76 151.549 5.992 4.751 1.00 0.00 C ATOM 1236 O ARG A 76 152.544 5.953 5.478 1.00 0.00 O ATOM 1237 CB ARG A 76 150.163 7.456 6.236 1.00 0.00 C ATOM 1238 CG ARG A 76 148.794 7.826 6.785 1.00 0.00 C ATOM 1239 CD ARG A 76 148.514 9.313 6.631 1.00 0.00 C ATOM 1240 NE ARG A 76 147.205 9.682 7.169 1.00 0.00 N ATOM 1241 CZ ARG A 76 146.047 9.446 6.546 1.00 0.00 C ATOM 1242 NH1 ARG A 76 146.029 8.846 5.358 1.00 0.00 N ATOM 1243 NH2 ARG A 76 144.902 9.814 7.114 1.00 0.00 N ATOM 0 H ARG A 76 150.025 5.031 7.080 1.00 0.00 H new ATOM 0 HA ARG A 76 149.450 6.358 4.529 1.00 0.00 H new ATOM 0 HB2 ARG A 76 150.846 7.292 7.070 1.00 0.00 H new ATOM 0 HB3 ARG A 76 150.554 8.298 5.664 1.00 0.00 H new ATOM 0 HG2 ARG A 76 148.026 7.254 6.264 1.00 0.00 H new ATOM 0 HG3 ARG A 76 148.737 7.551 7.838 1.00 0.00 H new ATOM 0 HD2 ARG A 76 149.290 9.883 7.142 1.00 0.00 H new ATOM 0 HD3 ARG A 76 148.562 9.584 5.576 1.00 0.00 H new ATOM 0 HE ARG A 76 147.174 10.148 8.076 1.00 0.00 H new ATOM 0 HH11 ARG A 76 146.904 8.563 4.916 1.00 0.00 H new ATOM 0 HH12 ARG A 76 145.140 8.670 4.889 1.00 0.00 H new ATOM 0 HH21 ARG A 76 144.909 10.276 8.024 1.00 0.00 H new ATOM 0 HH22 ARG A 76 144.017 9.635 6.640 1.00 0.00 H new ATOM 1257 N ILE A 77 151.611 5.849 3.427 1.00 0.00 N ATOM 1258 CA ILE A 77 152.880 5.635 2.733 1.00 0.00 C ATOM 1259 C ILE A 77 153.047 6.620 1.575 1.00 0.00 C ATOM 1260 O ILE A 77 152.135 6.803 0.768 1.00 0.00 O ATOM 1261 CB ILE A 77 152.991 4.192 2.191 1.00 0.00 C ATOM 1262 CG1 ILE A 77 152.656 3.175 3.289 1.00 0.00 C ATOM 1263 CG2 ILE A 77 154.387 3.937 1.635 1.00 0.00 C ATOM 1264 CD1 ILE A 77 152.589 1.746 2.793 1.00 0.00 C ATOM 0 H ILE A 77 150.796 5.878 2.814 1.00 0.00 H new ATOM 0 HA ILE A 77 153.672 5.800 3.463 1.00 0.00 H new ATOM 0 HB ILE A 77 152.270 4.073 1.382 1.00 0.00 H new ATOM 0 HG12 ILE A 77 153.407 3.242 4.076 1.00 0.00 H new ATOM 0 HG13 ILE A 77 151.699 3.440 3.738 1.00 0.00 H new ATOM 0 HG21 ILE A 77 154.447 2.916 1.258 1.00 0.00 H new ATOM 0 HG22 ILE A 77 154.589 4.636 0.824 1.00 0.00 H new ATOM 0 HG23 ILE A 77 155.124 4.076 2.426 1.00 0.00 H new ATOM 0 HD11 ILE A 77 152.348 1.083 3.624 1.00 0.00 H new ATOM 0 HD12 ILE A 77 151.818 1.663 2.027 1.00 0.00 H new ATOM 0 HD13 ILE A 77 153.553 1.462 2.370 1.00 0.00 H new ATOM 1276 N LEU A 78 154.218 7.249 1.499 1.00 0.00 N ATOM 1277 CA LEU A 78 154.508 8.215 0.440 1.00 0.00 C ATOM 1278 C LEU A 78 155.392 7.586 -0.637 1.00 0.00 C ATOM 1279 O LEU A 78 156.399 6.949 -0.330 1.00 0.00 O ATOM 1280 CB LEU A 78 155.194 9.457 1.021 1.00 0.00 C ATOM 1281 CG LEU A 78 154.574 10.001 2.315 1.00 0.00 C ATOM 1282 CD1 LEU A 78 155.337 9.499 3.533 1.00 0.00 C ATOM 1283 CD2 LEU A 78 154.544 11.523 2.293 1.00 0.00 C ATOM 0 H LEU A 78 154.983 7.107 2.159 1.00 0.00 H new ATOM 0 HA LEU A 78 153.564 8.514 -0.015 1.00 0.00 H new ATOM 0 HB2 LEU A 78 156.241 9.219 1.211 1.00 0.00 H new ATOM 0 HB3 LEU A 78 155.178 10.246 0.269 1.00 0.00 H new ATOM 0 HG LEU A 78 153.549 9.636 2.382 1.00 0.00 H new ATOM 0 HD11 LEU A 78 154.880 9.897 4.439 1.00 0.00 H new ATOM 0 HD12 LEU A 78 155.305 8.410 3.559 1.00 0.00 H new ATOM 0 HD13 LEU A 78 156.374 9.830 3.475 1.00 0.00 H new ATOM 0 HD21 LEU A 78 154.101 11.892 3.218 1.00 0.00 H new ATOM 0 HD22 LEU A 78 155.560 11.906 2.199 1.00 0.00 H new ATOM 0 HD23 LEU A 78 153.949 11.863 1.445 1.00 0.00 H new ATOM 1295 N LEU A 79 155.005 7.767 -1.899 1.00 0.00 N ATOM 1296 CA LEU A 79 155.763 7.212 -3.022 1.00 0.00 C ATOM 1297 C LEU A 79 156.753 8.235 -3.576 1.00 0.00 C ATOM 1298 O LEU A 79 156.397 9.389 -3.817 1.00 0.00 O ATOM 1299 CB LEU A 79 154.817 6.754 -4.138 1.00 0.00 C ATOM 1300 CG LEU A 79 153.602 5.942 -3.677 1.00 0.00 C ATOM 1301 CD1 LEU A 79 152.392 6.256 -4.543 1.00 0.00 C ATOM 1302 CD2 LEU A 79 153.912 4.452 -3.707 1.00 0.00 C ATOM 0 H LEU A 79 154.174 8.292 -2.170 1.00 0.00 H new ATOM 0 HA LEU A 79 156.321 6.352 -2.651 1.00 0.00 H new ATOM 0 HB2 LEU A 79 154.462 7.634 -4.675 1.00 0.00 H new ATOM 0 HB3 LEU A 79 155.385 6.154 -4.849 1.00 0.00 H new ATOM 0 HG LEU A 79 153.370 6.222 -2.649 1.00 0.00 H new ATOM 0 HD11 LEU A 79 151.538 5.671 -4.201 1.00 0.00 H new ATOM 0 HD12 LEU A 79 152.157 7.318 -4.469 1.00 0.00 H new ATOM 0 HD13 LEU A 79 152.612 6.005 -5.581 1.00 0.00 H new ATOM 0 HD21 LEU A 79 153.037 3.892 -3.376 1.00 0.00 H new ATOM 0 HD22 LEU A 79 154.171 4.155 -4.723 1.00 0.00 H new ATOM 0 HD23 LEU A 79 154.750 4.241 -3.043 1.00 0.00 H new ATOM 1314 N LEU A 80 157.997 7.802 -3.778 1.00 0.00 N ATOM 1315 CA LEU A 80 159.041 8.677 -4.309 1.00 0.00 C ATOM 1316 C LEU A 80 159.976 7.907 -5.241 1.00 0.00 C ATOM 1317 O LEU A 80 160.367 6.775 -4.948 1.00 0.00 O ATOM 1318 CB LEU A 80 159.839 9.311 -3.165 1.00 0.00 C ATOM 1319 CG LEU A 80 159.069 10.341 -2.332 1.00 0.00 C ATOM 1320 CD1 LEU A 80 159.900 10.801 -1.143 1.00 0.00 C ATOM 1321 CD2 LEU A 80 158.664 11.528 -3.195 1.00 0.00 C ATOM 0 H LEU A 80 158.306 6.850 -3.582 1.00 0.00 H new ATOM 0 HA LEU A 80 158.560 9.468 -4.884 1.00 0.00 H new ATOM 0 HB2 LEU A 80 160.189 8.519 -2.503 1.00 0.00 H new ATOM 0 HB3 LEU A 80 160.724 9.792 -3.582 1.00 0.00 H new ATOM 0 HG LEU A 80 158.164 9.867 -1.951 1.00 0.00 H new ATOM 0 HD11 LEU A 80 159.335 11.532 -0.565 1.00 0.00 H new ATOM 0 HD12 LEU A 80 160.137 9.945 -0.512 1.00 0.00 H new ATOM 0 HD13 LEU A 80 160.824 11.256 -1.499 1.00 0.00 H new ATOM 0 HD21 LEU A 80 158.118 12.250 -2.588 1.00 0.00 H new ATOM 0 HD22 LEU A 80 159.556 12.000 -3.606 1.00 0.00 H new ATOM 0 HD23 LEU A 80 158.027 11.185 -4.010 1.00 0.00 H new ATOM 1333 N SER A 81 160.327 8.529 -6.368 1.00 0.00 N ATOM 1334 CA SER A 81 161.213 7.905 -7.350 1.00 0.00 C ATOM 1335 C SER A 81 162.644 7.813 -6.821 1.00 0.00 C ATOM 1336 O SER A 81 163.280 8.832 -6.544 1.00 0.00 O ATOM 1337 CB SER A 81 161.190 8.691 -8.666 1.00 0.00 C ATOM 1338 OG SER A 81 161.072 10.086 -8.431 1.00 0.00 O ATOM 0 H SER A 81 160.011 9.465 -6.623 1.00 0.00 H new ATOM 0 HA SER A 81 160.850 6.894 -7.533 1.00 0.00 H new ATOM 0 HB2 SER A 81 162.102 8.490 -9.228 1.00 0.00 H new ATOM 0 HB3 SER A 81 160.356 8.352 -9.280 1.00 0.00 H new ATOM 0 HG SER A 81 161.062 10.562 -9.287 1.00 0.00 H new ATOM 1344 N GLN A 82 163.143 6.584 -6.679 1.00 0.00 N ATOM 1345 CA GLN A 82 164.498 6.356 -6.180 1.00 0.00 C ATOM 1346 C GLN A 82 165.199 5.243 -6.961 1.00 0.00 C ATOM 1347 O GLN A 82 165.943 4.443 -6.388 1.00 0.00 O ATOM 1348 CB GLN A 82 164.452 5.998 -4.693 1.00 0.00 C ATOM 1349 CG GLN A 82 164.329 7.205 -3.777 1.00 0.00 C ATOM 1350 CD GLN A 82 165.659 7.615 -3.173 1.00 0.00 C ATOM 1351 OE1 GLN A 82 166.074 8.768 -3.286 1.00 0.00 O ATOM 1352 NE2 GLN A 82 166.338 6.670 -2.530 1.00 0.00 N ATOM 0 H GLN A 82 162.628 5.732 -6.903 1.00 0.00 H new ATOM 0 HA GLN A 82 165.067 7.275 -6.317 1.00 0.00 H new ATOM 0 HB2 GLN A 82 163.609 5.331 -4.515 1.00 0.00 H new ATOM 0 HB3 GLN A 82 165.355 5.446 -4.433 1.00 0.00 H new ATOM 0 HG2 GLN A 82 163.915 8.043 -4.339 1.00 0.00 H new ATOM 0 HG3 GLN A 82 163.625 6.979 -2.977 1.00 0.00 H new ATOM 0 HE21 GLN A 82 165.957 5.726 -2.460 1.00 0.00 H new ATOM 0 HE22 GLN A 82 167.240 6.889 -2.107 1.00 0.00 H new ATOM 1361 N ASP A 83 164.963 5.194 -8.272 1.00 0.00 N ATOM 1362 CA ASP A 83 165.576 4.177 -9.120 1.00 0.00 C ATOM 1363 C ASP A 83 166.449 4.813 -10.198 1.00 0.00 C ATOM 1364 O ASP A 83 165.946 5.282 -11.221 1.00 0.00 O ATOM 1365 CB ASP A 83 164.496 3.301 -9.763 1.00 0.00 C ATOM 1366 CG ASP A 83 165.071 2.096 -10.485 1.00 0.00 C ATOM 1367 OD1 ASP A 83 165.686 1.238 -9.817 1.00 0.00 O ATOM 1368 OD2 ASP A 83 164.904 2.011 -11.720 1.00 0.00 O ATOM 0 H ASP A 83 164.353 5.845 -8.767 1.00 0.00 H new ATOM 0 HA ASP A 83 166.213 3.553 -8.493 1.00 0.00 H new ATOM 0 HB2 ASP A 83 163.804 2.961 -8.993 1.00 0.00 H new ATOM 0 HB3 ASP A 83 163.920 3.901 -10.468 1.00 0.00 H new ATOM 1373 N ARG A 84 167.760 4.823 -9.959 1.00 0.00 N ATOM 1374 CA ARG A 84 168.713 5.398 -10.908 1.00 0.00 C ATOM 1375 C ARG A 84 169.607 4.315 -11.516 1.00 0.00 C ATOM 1376 O ARG A 84 169.882 4.330 -12.718 1.00 0.00 O ATOM 1377 CB ARG A 84 169.575 6.461 -10.221 1.00 0.00 C ATOM 1378 CG ARG A 84 169.108 7.886 -10.480 1.00 0.00 C ATOM 1379 CD ARG A 84 170.275 8.861 -10.528 1.00 0.00 C ATOM 1380 NE ARG A 84 169.890 10.153 -11.100 1.00 0.00 N ATOM 1381 CZ ARG A 84 169.184 11.085 -10.447 1.00 0.00 C ATOM 1382 NH1 ARG A 84 168.786 10.877 -9.193 1.00 0.00 N ATOM 1383 NH2 ARG A 84 168.880 12.231 -11.050 1.00 0.00 N ATOM 0 H ARG A 84 168.187 4.439 -9.116 1.00 0.00 H new ATOM 0 HA ARG A 84 168.144 5.865 -11.712 1.00 0.00 H new ATOM 0 HB2 ARG A 84 169.575 6.277 -9.147 1.00 0.00 H new ATOM 0 HB3 ARG A 84 170.605 6.358 -10.562 1.00 0.00 H new ATOM 0 HG2 ARG A 84 168.563 7.924 -11.423 1.00 0.00 H new ATOM 0 HG3 ARG A 84 168.413 8.189 -9.697 1.00 0.00 H new ATOM 0 HD2 ARG A 84 170.662 9.012 -9.520 1.00 0.00 H new ATOM 0 HD3 ARG A 84 171.083 8.430 -11.119 1.00 0.00 H new ATOM 0 HE ARG A 84 170.178 10.356 -12.057 1.00 0.00 H new ATOM 0 HH11 ARG A 84 169.019 10.002 -8.723 1.00 0.00 H new ATOM 0 HH12 ARG A 84 168.249 11.592 -8.703 1.00 0.00 H new ATOM 0 HH21 ARG A 84 169.185 12.399 -12.009 1.00 0.00 H new ATOM 0 HH22 ARG A 84 168.342 12.942 -10.554 1.00 0.00 H new ATOM 1397 N ASN A 85 170.058 3.386 -10.674 1.00 0.00 N ATOM 1398 CA ASN A 85 170.927 2.290 -11.106 1.00 0.00 C ATOM 1399 C ASN A 85 171.157 1.301 -9.960 1.00 0.00 C ATOM 1400 O ASN A 85 170.708 1.530 -8.836 1.00 0.00 O ATOM 1401 CB ASN A 85 172.274 2.830 -11.613 1.00 0.00 C ATOM 1402 CG ASN A 85 173.005 3.678 -10.583 1.00 0.00 C ATOM 1403 OD1 ASN A 85 172.384 4.360 -9.767 1.00 0.00 O ATOM 1404 ND2 ASN A 85 174.334 3.646 -10.618 1.00 0.00 N ATOM 0 H ASN A 85 169.834 3.371 -9.679 1.00 0.00 H new ATOM 0 HA ASN A 85 170.430 1.769 -11.925 1.00 0.00 H new ATOM 0 HB2 ASN A 85 172.909 1.992 -11.901 1.00 0.00 H new ATOM 0 HB3 ASN A 85 172.105 3.425 -12.510 1.00 0.00 H new ATOM 0 HD21 ASN A 85 174.875 4.199 -9.953 1.00 0.00 H new ATOM 0 HD22 ASN A 85 174.812 3.068 -11.309 1.00 0.00 H new ATOM 1411 N LEU A 86 171.861 0.204 -10.252 1.00 0.00 N ATOM 1412 CA LEU A 86 172.154 -0.816 -9.242 1.00 0.00 C ATOM 1413 C LEU A 86 173.462 -0.490 -8.508 1.00 0.00 C ATOM 1414 O LEU A 86 174.387 -1.306 -8.472 1.00 0.00 O ATOM 1415 CB LEU A 86 172.236 -2.207 -9.896 1.00 0.00 C ATOM 1416 CG LEU A 86 171.059 -3.148 -9.608 1.00 0.00 C ATOM 1417 CD1 LEU A 86 170.973 -3.463 -8.121 1.00 0.00 C ATOM 1418 CD2 LEU A 86 169.752 -2.550 -10.109 1.00 0.00 C ATOM 0 H LEU A 86 172.238 -0.000 -11.178 1.00 0.00 H new ATOM 0 HA LEU A 86 171.344 -0.822 -8.512 1.00 0.00 H new ATOM 0 HB2 LEU A 86 172.317 -2.077 -10.975 1.00 0.00 H new ATOM 0 HB3 LEU A 86 173.154 -2.691 -9.563 1.00 0.00 H new ATOM 0 HG LEU A 86 171.232 -4.081 -10.145 1.00 0.00 H new ATOM 0 HD11 LEU A 86 170.132 -4.132 -7.939 1.00 0.00 H new ATOM 0 HD12 LEU A 86 171.896 -3.944 -7.797 1.00 0.00 H new ATOM 0 HD13 LEU A 86 170.830 -2.539 -7.561 1.00 0.00 H new ATOM 0 HD21 LEU A 86 168.932 -3.235 -9.894 1.00 0.00 H new ATOM 0 HD22 LEU A 86 169.571 -1.599 -9.608 1.00 0.00 H new ATOM 0 HD23 LEU A 86 169.815 -2.387 -11.185 1.00 0.00 H new ATOM 1430 N GLU A 87 173.530 0.713 -7.925 1.00 0.00 N ATOM 1431 CA GLU A 87 174.717 1.163 -7.191 1.00 0.00 C ATOM 1432 C GLU A 87 175.955 1.191 -8.096 1.00 0.00 C ATOM 1433 O GLU A 87 175.850 1.016 -9.312 1.00 0.00 O ATOM 1434 CB GLU A 87 174.960 0.263 -5.973 1.00 0.00 C ATOM 1435 CG GLU A 87 174.627 0.931 -4.645 1.00 0.00 C ATOM 1436 CD GLU A 87 173.152 0.846 -4.294 1.00 0.00 C ATOM 1437 OE1 GLU A 87 172.605 -0.277 -4.288 1.00 0.00 O ATOM 1438 OE2 GLU A 87 172.546 1.904 -4.023 1.00 0.00 O ATOM 0 H GLU A 87 172.772 1.395 -7.948 1.00 0.00 H new ATOM 0 HA GLU A 87 174.535 2.181 -6.846 1.00 0.00 H new ATOM 0 HB2 GLU A 87 174.361 -0.642 -6.075 1.00 0.00 H new ATOM 0 HB3 GLU A 87 176.005 -0.046 -5.963 1.00 0.00 H new ATOM 0 HG2 GLU A 87 175.211 0.464 -3.852 1.00 0.00 H new ATOM 0 HG3 GLU A 87 174.926 1.978 -4.686 1.00 0.00 H new ATOM 1445 N HIS A 88 177.128 1.417 -7.497 1.00 0.00 N ATOM 1446 CA HIS A 88 178.376 1.468 -8.254 1.00 0.00 C ATOM 1447 C HIS A 88 179.057 0.101 -8.275 1.00 0.00 C ATOM 1448 O HIS A 88 179.266 -0.514 -7.228 1.00 0.00 O ATOM 1449 CB HIS A 88 179.324 2.515 -7.665 1.00 0.00 C ATOM 1450 CG HIS A 88 180.511 2.791 -8.534 1.00 0.00 C ATOM 1451 ND1 HIS A 88 180.467 3.638 -9.622 1.00 0.00 N ATOM 1452 CD2 HIS A 88 181.780 2.322 -8.476 1.00 0.00 C ATOM 1453 CE1 HIS A 88 181.657 3.676 -10.196 1.00 0.00 C ATOM 1454 NE2 HIS A 88 182.471 2.888 -9.519 1.00 0.00 N ATOM 0 H HIS A 88 177.236 1.567 -6.494 1.00 0.00 H new ATOM 0 HA HIS A 88 178.133 1.751 -9.278 1.00 0.00 H new ATOM 0 HB2 HIS A 88 178.775 3.443 -7.505 1.00 0.00 H new ATOM 0 HB3 HIS A 88 179.668 2.175 -6.688 1.00 0.00 H new ATOM 0 HD2 HIS A 88 182.175 1.631 -7.746 1.00 0.00 H new ATOM 0 HE1 HIS A 88 181.919 4.254 -11.070 1.00 0.00 H new ATOM 0 HE2 HIS A 88 183.454 2.726 -9.736 1.00 0.00 H new ATOM 1463 N HIS A 89 179.400 -0.367 -9.475 1.00 0.00 N ATOM 1464 CA HIS A 89 180.055 -1.663 -9.636 1.00 0.00 C ATOM 1465 C HIS A 89 180.688 -1.795 -11.022 1.00 0.00 C ATOM 1466 O HIS A 89 180.595 -0.885 -11.848 1.00 0.00 O ATOM 1467 CB HIS A 89 179.046 -2.793 -9.413 1.00 0.00 C ATOM 1468 CG HIS A 89 179.477 -3.789 -8.381 1.00 0.00 C ATOM 1469 ND1 HIS A 89 180.072 -4.994 -8.698 1.00 0.00 N ATOM 1470 CD2 HIS A 89 179.394 -3.757 -7.030 1.00 0.00 C ATOM 1471 CE1 HIS A 89 180.334 -5.658 -7.586 1.00 0.00 C ATOM 1472 NE2 HIS A 89 179.933 -4.929 -6.561 1.00 0.00 N ATOM 0 H HIS A 89 179.235 0.132 -10.349 1.00 0.00 H new ATOM 0 HA HIS A 89 180.848 -1.735 -8.892 1.00 0.00 H new ATOM 0 HB2 HIS A 89 178.091 -2.362 -9.113 1.00 0.00 H new ATOM 0 HB3 HIS A 89 178.879 -3.311 -10.358 1.00 0.00 H new ATOM 0 HD2 HIS A 89 178.981 -2.958 -6.432 1.00 0.00 H new ATOM 0 HE1 HIS A 89 180.797 -6.632 -7.526 1.00 0.00 H new ATOM 0 HE2 HIS A 89 180.011 -5.194 -5.579 1.00 0.00 H new ATOM 1481 N HIS A 90 181.332 -2.935 -11.268 1.00 0.00 N ATOM 1482 CA HIS A 90 181.982 -3.193 -12.551 1.00 0.00 C ATOM 1483 C HIS A 90 182.112 -4.694 -12.809 1.00 0.00 C ATOM 1484 O HIS A 90 181.805 -5.510 -11.937 1.00 0.00 O ATOM 1485 CB HIS A 90 183.368 -2.536 -12.588 1.00 0.00 C ATOM 1486 CG HIS A 90 184.266 -2.948 -11.457 1.00 0.00 C ATOM 1487 ND1 HIS A 90 184.816 -4.210 -11.348 1.00 0.00 N ATOM 1488 CD2 HIS A 90 184.705 -2.255 -10.378 1.00 0.00 C ATOM 1489 CE1 HIS A 90 185.550 -4.275 -10.251 1.00 0.00 C ATOM 1490 NE2 HIS A 90 185.500 -3.102 -9.647 1.00 0.00 N ATOM 0 H HIS A 90 181.417 -3.696 -10.594 1.00 0.00 H new ATOM 0 HA HIS A 90 181.360 -2.761 -13.335 1.00 0.00 H new ATOM 0 HB2 HIS A 90 183.852 -2.784 -13.533 1.00 0.00 H new ATOM 0 HB3 HIS A 90 183.247 -1.453 -12.567 1.00 0.00 H new ATOM 0 HD1 HIS A 90 184.677 -4.973 -12.011 1.00 0.00 H new ATOM 0 HD2 HIS A 90 184.473 -1.228 -10.138 1.00 0.00 H new ATOM 0 HE1 HIS A 90 186.097 -5.140 -9.907 1.00 0.00 H new ATOM 1499 N HIS A 91 182.578 -5.053 -14.007 1.00 0.00 N ATOM 1500 CA HIS A 91 182.759 -6.458 -14.369 1.00 0.00 C ATOM 1501 C HIS A 91 183.887 -7.085 -13.552 1.00 0.00 C ATOM 1502 O HIS A 91 184.915 -6.449 -13.311 1.00 0.00 O ATOM 1503 CB HIS A 91 183.061 -6.596 -15.865 1.00 0.00 C ATOM 1504 CG HIS A 91 181.878 -7.013 -16.686 1.00 0.00 C ATOM 1505 ND1 HIS A 91 180.986 -6.114 -17.233 1.00 0.00 N ATOM 1506 CD2 HIS A 91 181.447 -8.242 -17.060 1.00 0.00 C ATOM 1507 CE1 HIS A 91 180.059 -6.771 -17.907 1.00 0.00 C ATOM 1508 NE2 HIS A 91 180.316 -8.063 -17.818 1.00 0.00 N ATOM 0 H HIS A 91 182.836 -4.392 -14.740 1.00 0.00 H new ATOM 0 HA HIS A 91 181.831 -6.984 -14.147 1.00 0.00 H new ATOM 0 HB2 HIS A 91 183.434 -5.643 -16.240 1.00 0.00 H new ATOM 0 HB3 HIS A 91 183.860 -7.326 -15.999 1.00 0.00 H new ATOM 0 HD2 HIS A 91 181.907 -9.186 -16.809 1.00 0.00 H new ATOM 0 HE1 HIS A 91 179.232 -6.327 -18.440 1.00 0.00 H new ATOM 0 HE2 HIS A 91 179.764 -8.808 -18.243 1.00 0.00 H new ATOM 1517 N HIS A 92 183.689 -8.333 -13.129 1.00 0.00 N ATOM 1518 CA HIS A 92 184.692 -9.044 -12.342 1.00 0.00 C ATOM 1519 C HIS A 92 185.701 -9.742 -13.251 1.00 0.00 C ATOM 1520 O HIS A 92 185.327 -10.366 -14.244 1.00 0.00 O ATOM 1521 CB HIS A 92 184.021 -10.067 -11.419 1.00 0.00 C ATOM 1522 CG HIS A 92 184.946 -10.670 -10.408 1.00 0.00 C ATOM 1523 ND1 HIS A 92 185.008 -12.025 -10.163 1.00 0.00 N ATOM 1524 CD2 HIS A 92 185.847 -10.096 -9.576 1.00 0.00 C ATOM 1525 CE1 HIS A 92 185.905 -12.260 -9.222 1.00 0.00 C ATOM 1526 NE2 HIS A 92 186.429 -11.106 -8.850 1.00 0.00 N ATOM 0 H HIS A 92 182.843 -8.871 -13.319 1.00 0.00 H new ATOM 0 HA HIS A 92 185.224 -8.314 -11.732 1.00 0.00 H new ATOM 0 HB2 HIS A 92 183.194 -9.584 -10.898 1.00 0.00 H new ATOM 0 HB3 HIS A 92 183.593 -10.864 -12.027 1.00 0.00 H new ATOM 0 HD2 HIS A 92 186.067 -9.041 -9.498 1.00 0.00 H new ATOM 0 HE1 HIS A 92 186.165 -13.230 -8.825 1.00 0.00 H new ATOM 0 HE2 HIS A 92 187.150 -10.985 -8.138 1.00 0.00 H new ATOM 1535 N HIS A 93 186.981 -9.630 -12.901 1.00 0.00 N ATOM 1536 CA HIS A 93 188.051 -10.248 -13.682 1.00 0.00 C ATOM 1537 C HIS A 93 188.046 -11.770 -13.530 1.00 0.00 C ATOM 1538 O HIS A 93 187.459 -12.271 -12.546 1.00 0.00 O ATOM 1539 CB HIS A 93 189.412 -9.687 -13.258 1.00 0.00 C ATOM 1540 CG HIS A 93 189.888 -8.553 -14.113 1.00 0.00 C ATOM 1541 ND1 HIS A 93 189.875 -7.236 -13.699 1.00 0.00 N ATOM 1542 CD2 HIS A 93 190.398 -8.545 -15.368 1.00 0.00 C ATOM 1543 CE1 HIS A 93 190.354 -6.469 -14.663 1.00 0.00 C ATOM 1544 NE2 HIS A 93 190.679 -7.239 -15.684 1.00 0.00 N ATOM 1545 OXT HIS A 93 188.629 -12.449 -14.402 1.00 0.00 O ATOM 0 H HIS A 93 187.303 -9.116 -12.081 1.00 0.00 H new ATOM 0 HA HIS A 93 187.875 -10.011 -14.731 1.00 0.00 H new ATOM 0 HB2 HIS A 93 189.350 -9.349 -12.224 1.00 0.00 H new ATOM 0 HB3 HIS A 93 190.151 -10.488 -13.288 1.00 0.00 H new ATOM 0 HD2 HIS A 93 190.554 -9.405 -16.002 1.00 0.00 H new ATOM 0 HE1 HIS A 93 190.461 -5.395 -14.622 1.00 0.00 H new ATOM 0 HE2 HIS A 93 191.075 -6.916 -16.566 1.00 0.00 H new TER 1554 HIS A 93