USER MOD reduce.3.24.130724 H: found=0, std=0, add=770, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 770 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 75 SER OG : rot 171:sc= 0.978 USER MOD Set 1.2: A 77 LYS NZ :NH3+ -151:sc= 1.15 (180deg=0) USER MOD Set 2.1: A 50 ASN : amide:sc= -0.759 K(o=-1.3,f=-0.41) USER MOD Set 2.2: A 52 ASN : amide:sc= -0.571 K(o=-1.3,f=-0.7) USER MOD Set 3.1: A 34 LYS NZ :NH3+ -119:sc= 0.466 (180deg=0.554) USER MOD Set 3.2: A 89 SER OG : rot 180:sc= 0.511 USER MOD Set 4.1: A 16 TYR OH : rot 180:sc= 0.496 USER MOD Set 4.2: A 19 SER OG : rot 65:sc=-0.00309 USER MOD Set 5.1: A 5 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 1 ALA N :NH3+ -126:sc= 0.103 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0.00615 USER MOD Single : A 8 SER OG : rot 128:sc= 1.53 USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 SER OG : rot -5:sc= 1 USER MOD Single : A 14 TYR OH : rot 30:sc= -0.0538 USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 THR OG1 : rot 85:sc= 1.2 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -145:sc= 1.27 (180deg=-0.217) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.088) USER MOD Single : A 29 ASN : amide:sc= -3.16! K(o=-3.2!,f=-0.41) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -155:sc= 1.23 (180deg=1.16) USER MOD Single : A 37 THR OG1 : rot -150:sc= -1.8! USER MOD Single : A 40 TYR OH : rot 180:sc= 0.0424 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.108 K(o=-0.11,f=-1.9!) USER MOD Single : A 48 ASN : amide:sc= -2.45! K(o=-2.4!,f=-1.3) USER MOD Single : A 49 ASN : amide:sc= -0.116 K(o=-0.12,f=-1.4!) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 38:sc= 0.151 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 TYR OH : rot -117:sc= -0.19 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot -160:sc= -0.732 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot -97:sc= 0.0829 USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 109:sc= -0.826! USER MOD Single : A 91 LYS NZ :NH3+ 144:sc= 0.673 (180deg=0.181) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.103 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= -0.0625 K(o=-0.063,f=-4.1!) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 98 ASN : amide:sc= -0.871 K(o=-0.87,f=-0.0072) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= 0.618 K(o=0.62,f=-2.6) USER MOD Single : A 102 TYR OH : rot -125:sc= 1.22 USER MOD Single : A 103 GLN : amide:sc= -0.541 X(o=-0.54,f=-0.2) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0.0596 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -11.330 15.459 12.471 1.00 0.00 N ATOM 2 CA ALA A 1 -10.096 14.937 13.093 1.00 0.00 C ATOM 3 C ALA A 1 -8.957 14.929 12.081 1.00 0.00 C ATOM 4 O ALA A 1 -9.175 15.166 10.892 1.00 0.00 O ATOM 5 CB ALA A 1 -10.329 13.538 13.640 1.00 0.00 C ATOM 0 H1 ALA A 1 -11.701 16.245 13.042 1.00 0.00 H new ATOM 0 H2 ALA A 1 -11.118 15.798 11.511 1.00 0.00 H new ATOM 0 H3 ALA A 1 -12.041 14.702 12.421 1.00 0.00 H new ATOM 0 HA ALA A 1 -9.821 15.590 13.921 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -9.410 13.168 14.095 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -11.119 13.568 14.390 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -10.625 12.874 12.828 1.00 0.00 H new ATOM 13 N SER A 2 -7.749 14.656 12.555 1.00 0.00 N ATOM 14 CA SER A 2 -6.573 14.651 11.697 1.00 0.00 C ATOM 15 C SER A 2 -6.600 13.469 10.731 1.00 0.00 C ATOM 16 O SER A 2 -6.905 12.335 11.118 1.00 0.00 O ATOM 17 CB SER A 2 -5.304 14.612 12.555 1.00 0.00 C ATOM 18 OG SER A 2 -5.384 13.603 13.550 1.00 0.00 O ATOM 0 H SER A 2 -7.558 14.435 13.532 1.00 0.00 H new ATOM 0 HA SER A 2 -6.576 15.565 11.104 1.00 0.00 H new ATOM 0 HB2 SER A 2 -4.438 14.430 11.919 1.00 0.00 H new ATOM 0 HB3 SER A 2 -5.153 15.582 13.029 1.00 0.00 H new ATOM 0 HG SER A 2 -4.560 13.601 14.081 1.00 0.00 H new ATOM 24 N ILE A 3 -6.298 13.757 9.466 1.00 0.00 N ATOM 25 CA ILE A 3 -6.224 12.731 8.432 1.00 0.00 C ATOM 26 C ILE A 3 -4.997 11.834 8.638 1.00 0.00 C ATOM 27 O ILE A 3 -5.134 10.612 8.728 1.00 0.00 O ATOM 28 CB ILE A 3 -6.183 13.344 7.009 1.00 0.00 C ATOM 29 CG1 ILE A 3 -7.449 14.155 6.722 1.00 0.00 C ATOM 30 CG2 ILE A 3 -6.003 12.261 5.954 1.00 0.00 C ATOM 31 CD1 ILE A 3 -8.729 13.352 6.832 1.00 0.00 C ATOM 0 H ILE A 3 -6.100 14.700 9.133 1.00 0.00 H new ATOM 0 HA ILE A 3 -7.130 12.131 8.519 1.00 0.00 H new ATOM 0 HB ILE A 3 -5.326 14.016 6.965 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -7.497 14.994 7.416 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -7.380 14.575 5.719 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -5.977 12.718 4.965 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -5.068 11.730 6.133 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -6.835 11.559 6.008 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -9.582 13.995 6.615 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -8.704 12.529 6.118 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -8.823 12.954 7.842 1.00 0.00 H new ATOM 43 N PRO A 4 -3.777 12.411 8.710 1.00 0.00 N ATOM 44 CA PRO A 4 -2.572 11.626 8.956 1.00 0.00 C ATOM 45 C PRO A 4 -2.483 11.159 10.403 1.00 0.00 C ATOM 46 O PRO A 4 -2.723 11.926 11.336 1.00 0.00 O ATOM 47 CB PRO A 4 -1.427 12.582 8.627 1.00 0.00 C ATOM 48 CG PRO A 4 -1.991 13.953 8.773 1.00 0.00 C ATOM 49 CD PRO A 4 -3.475 13.848 8.542 1.00 0.00 C ATOM 0 HA PRO A 4 -2.553 10.717 8.355 1.00 0.00 H new ATOM 0 HB2 PRO A 4 -0.585 12.431 9.302 1.00 0.00 H new ATOM 0 HB3 PRO A 4 -1.057 12.417 7.615 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -1.783 14.351 9.766 1.00 0.00 H new ATOM 0 HG3 PRO A 4 -1.537 14.635 8.054 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -4.031 14.456 9.255 1.00 0.00 H new ATOM 0 HD3 PRO A 4 -3.747 14.197 7.546 1.00 0.00 H new ATOM 57 N SER A 5 -2.133 9.898 10.584 1.00 0.00 N ATOM 58 CA SER A 5 -2.060 9.319 11.912 1.00 0.00 C ATOM 59 C SER A 5 -0.608 9.038 12.299 1.00 0.00 C ATOM 60 O SER A 5 0.042 9.874 12.931 1.00 0.00 O ATOM 61 CB SER A 5 -2.923 8.050 11.989 1.00 0.00 C ATOM 62 OG SER A 5 -2.847 7.448 13.268 1.00 0.00 O ATOM 0 H SER A 5 -1.895 9.256 9.828 1.00 0.00 H new ATOM 0 HA SER A 5 -2.457 10.036 12.631 1.00 0.00 H new ATOM 0 HB2 SER A 5 -3.960 8.300 11.764 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.595 7.339 11.231 1.00 0.00 H new ATOM 0 HG SER A 5 -3.408 6.645 13.285 1.00 0.00 H new ATOM 68 N SER A 6 -0.091 7.878 11.913 1.00 0.00 N ATOM 69 CA SER A 6 1.283 7.522 12.226 1.00 0.00 C ATOM 70 C SER A 6 2.203 7.843 11.051 1.00 0.00 C ATOM 71 O SER A 6 3.077 8.704 11.155 1.00 0.00 O ATOM 72 CB SER A 6 1.365 6.038 12.586 1.00 0.00 C ATOM 73 OG SER A 6 0.462 5.720 13.633 1.00 0.00 O ATOM 0 H SER A 6 -0.602 7.171 11.384 1.00 0.00 H new ATOM 0 HA SER A 6 1.613 8.110 13.082 1.00 0.00 H new ATOM 0 HB2 SER A 6 1.137 5.434 11.708 1.00 0.00 H new ATOM 0 HB3 SER A 6 2.382 5.789 12.889 1.00 0.00 H new ATOM 0 HG SER A 6 0.530 4.766 13.845 1.00 0.00 H new ATOM 79 N ALA A 7 1.993 7.164 9.931 1.00 0.00 N ATOM 80 CA ALA A 7 2.810 7.382 8.748 1.00 0.00 C ATOM 81 C ALA A 7 2.132 8.352 7.788 1.00 0.00 C ATOM 82 O ALA A 7 1.092 8.931 8.109 1.00 0.00 O ATOM 83 CB ALA A 7 3.103 6.062 8.049 1.00 0.00 C ATOM 0 H ALA A 7 1.265 6.459 9.818 1.00 0.00 H new ATOM 0 HA ALA A 7 3.754 7.823 9.068 1.00 0.00 H new ATOM 0 HB1 ALA A 7 3.715 6.246 7.166 1.00 0.00 H new ATOM 0 HB2 ALA A 7 3.638 5.400 8.730 1.00 0.00 H new ATOM 0 HB3 ALA A 7 2.166 5.593 7.749 1.00 0.00 H new ATOM 89 N SER A 8 2.725 8.536 6.619 1.00 0.00 N ATOM 90 CA SER A 8 2.142 9.387 5.596 1.00 0.00 C ATOM 91 C SER A 8 0.990 8.672 4.906 1.00 0.00 C ATOM 92 O SER A 8 0.012 9.295 4.491 1.00 0.00 O ATOM 93 CB SER A 8 3.208 9.766 4.568 1.00 0.00 C ATOM 94 OG SER A 8 4.318 10.373 5.200 1.00 0.00 O ATOM 0 H SER A 8 3.612 8.106 6.355 1.00 0.00 H new ATOM 0 HA SER A 8 1.760 10.292 6.069 1.00 0.00 H new ATOM 0 HB2 SER A 8 3.532 8.876 4.028 1.00 0.00 H new ATOM 0 HB3 SER A 8 2.784 10.449 3.832 1.00 0.00 H new ATOM 0 HG SER A 8 5.141 9.919 4.922 1.00 0.00 H new ATOM 100 N VAL A 9 1.099 7.357 4.806 1.00 0.00 N ATOM 101 CA VAL A 9 0.143 6.574 4.063 1.00 0.00 C ATOM 102 C VAL A 9 -0.642 5.639 4.964 1.00 0.00 C ATOM 103 O VAL A 9 -0.164 5.210 6.013 1.00 0.00 O ATOM 104 CB VAL A 9 0.843 5.793 2.927 1.00 0.00 C ATOM 105 CG1 VAL A 9 2.161 5.231 3.392 1.00 0.00 C ATOM 106 CG2 VAL A 9 -0.028 4.674 2.387 1.00 0.00 C ATOM 0 H VAL A 9 1.847 6.813 5.235 1.00 0.00 H new ATOM 0 HA VAL A 9 -0.572 7.265 3.616 1.00 0.00 H new ATOM 0 HB VAL A 9 1.021 6.504 2.120 1.00 0.00 H new ATOM 0 HG11 VAL A 9 2.633 4.686 2.574 1.00 0.00 H new ATOM 0 HG12 VAL A 9 2.812 6.045 3.709 1.00 0.00 H new ATOM 0 HG13 VAL A 9 1.993 4.554 4.229 1.00 0.00 H new ATOM 0 HG21 VAL A 9 0.503 4.152 1.591 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -0.259 3.973 3.189 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -0.954 5.092 1.992 1.00 0.00 H new ATOM 116 N GLN A 10 -1.861 5.368 4.538 1.00 0.00 N ATOM 117 CA GLN A 10 -2.771 4.482 5.236 1.00 0.00 C ATOM 118 C GLN A 10 -3.569 3.691 4.205 1.00 0.00 C ATOM 119 O GLN A 10 -3.930 4.224 3.156 1.00 0.00 O ATOM 120 CB GLN A 10 -3.717 5.306 6.112 1.00 0.00 C ATOM 121 CG GLN A 10 -4.668 4.478 6.962 1.00 0.00 C ATOM 122 CD GLN A 10 -5.723 5.335 7.635 1.00 0.00 C ATOM 123 OE1 GLN A 10 -5.523 5.840 8.739 1.00 0.00 O ATOM 124 NE2 GLN A 10 -6.861 5.499 6.976 1.00 0.00 N ATOM 0 H GLN A 10 -2.252 5.764 3.683 1.00 0.00 H new ATOM 0 HA GLN A 10 -2.212 3.796 5.872 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -3.123 5.942 6.768 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -4.302 5.966 5.472 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -5.154 3.729 6.337 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -4.100 3.940 7.721 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -6.989 5.064 6.062 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -7.609 6.060 7.382 1.00 0.00 H new ATOM 133 N LEU A 11 -3.817 2.423 4.473 1.00 0.00 N ATOM 134 CA LEU A 11 -4.653 1.627 3.590 1.00 0.00 C ATOM 135 C LEU A 11 -6.092 2.096 3.672 1.00 0.00 C ATOM 136 O LEU A 11 -6.591 2.433 4.750 1.00 0.00 O ATOM 137 CB LEU A 11 -4.605 0.145 3.958 1.00 0.00 C ATOM 138 CG LEU A 11 -5.517 -0.748 3.110 1.00 0.00 C ATOM 139 CD1 LEU A 11 -4.740 -1.368 1.957 1.00 0.00 C ATOM 140 CD2 LEU A 11 -6.155 -1.816 3.982 1.00 0.00 C ATOM 0 H LEU A 11 -3.456 1.924 5.286 1.00 0.00 H new ATOM 0 HA LEU A 11 -4.269 1.754 2.578 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -3.578 -0.208 3.860 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -4.882 0.034 5.007 1.00 0.00 H new ATOM 0 HG LEU A 11 -6.311 -0.137 2.681 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -5.405 -1.998 1.367 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -4.334 -0.578 1.325 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -3.923 -1.972 2.352 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -6.802 -2.446 3.371 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -5.376 -2.428 4.436 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -6.746 -1.341 4.765 1.00 0.00 H new ATOM 152 N ASP A 12 -6.753 2.127 2.530 1.00 0.00 N ATOM 153 CA ASP A 12 -8.174 2.400 2.497 1.00 0.00 C ATOM 154 C ASP A 12 -8.943 1.098 2.581 1.00 0.00 C ATOM 155 O ASP A 12 -9.598 0.812 3.581 1.00 0.00 O ATOM 156 CB ASP A 12 -8.568 3.138 1.219 1.00 0.00 C ATOM 157 CG ASP A 12 -10.061 3.394 1.157 1.00 0.00 C ATOM 158 OD1 ASP A 12 -10.538 4.329 1.829 1.00 0.00 O ATOM 159 OD2 ASP A 12 -10.769 2.639 0.461 1.00 0.00 O ATOM 0 H ASP A 12 -6.329 1.967 1.616 1.00 0.00 H new ATOM 0 HA ASP A 12 -8.417 3.035 3.349 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -8.034 4.087 1.167 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -8.263 2.552 0.352 1.00 0.00 H new ATOM 164 N SER A 13 -8.829 0.308 1.525 1.00 0.00 N ATOM 165 CA SER A 13 -9.539 -0.968 1.410 1.00 0.00 C ATOM 166 C SER A 13 -8.988 -1.790 0.266 1.00 0.00 C ATOM 167 O SER A 13 -8.366 -1.264 -0.659 1.00 0.00 O ATOM 168 CB SER A 13 -11.045 -0.747 1.193 1.00 0.00 C ATOM 169 OG SER A 13 -11.652 -0.108 2.306 1.00 0.00 O ATOM 0 H SER A 13 -8.243 0.528 0.720 1.00 0.00 H new ATOM 0 HA SER A 13 -9.390 -1.507 2.346 1.00 0.00 H new ATOM 0 HB2 SER A 13 -11.198 -0.142 0.299 1.00 0.00 H new ATOM 0 HB3 SER A 13 -11.531 -1.706 1.016 1.00 0.00 H new ATOM 0 HG SER A 13 -10.995 -0.013 3.027 1.00 0.00 H new ATOM 175 N TYR A 14 -9.217 -3.087 0.354 1.00 0.00 N ATOM 176 CA TYR A 14 -8.808 -4.023 -0.667 1.00 0.00 C ATOM 177 C TYR A 14 -9.679 -5.263 -0.568 1.00 0.00 C ATOM 178 O TYR A 14 -10.239 -5.546 0.494 1.00 0.00 O ATOM 179 CB TYR A 14 -7.327 -4.373 -0.509 1.00 0.00 C ATOM 180 CG TYR A 14 -6.996 -5.099 0.776 1.00 0.00 C ATOM 181 CD1 TYR A 14 -7.209 -6.455 0.885 1.00 0.00 C ATOM 182 CD2 TYR A 14 -6.454 -4.435 1.861 1.00 0.00 C ATOM 183 CE1 TYR A 14 -6.898 -7.145 2.036 1.00 0.00 C ATOM 184 CE2 TYR A 14 -6.140 -5.107 3.026 1.00 0.00 C ATOM 185 CZ TYR A 14 -6.364 -6.466 3.110 1.00 0.00 C ATOM 186 OH TYR A 14 -6.049 -7.146 4.265 1.00 0.00 O ATOM 0 H TYR A 14 -9.696 -3.520 1.144 1.00 0.00 H new ATOM 0 HA TYR A 14 -8.933 -3.576 -1.653 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -7.019 -4.991 -1.352 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -6.741 -3.455 -0.556 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -7.630 -6.991 0.047 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -6.273 -3.372 1.796 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -7.071 -8.209 2.096 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -5.722 -4.572 3.866 1.00 0.00 H new ATOM 0 HH TYR A 14 -5.802 -8.068 4.045 1.00 0.00 H new ATOM 196 N ASN A 15 -9.808 -5.991 -1.658 1.00 0.00 N ATOM 197 CA ASN A 15 -10.665 -7.159 -1.688 1.00 0.00 C ATOM 198 C ASN A 15 -9.934 -8.357 -2.260 1.00 0.00 C ATOM 199 O ASN A 15 -8.894 -8.213 -2.908 1.00 0.00 O ATOM 200 CB ASN A 15 -11.922 -6.884 -2.516 1.00 0.00 C ATOM 201 CG ASN A 15 -12.786 -5.792 -1.917 1.00 0.00 C ATOM 202 OD1 ASN A 15 -13.647 -6.059 -1.080 1.00 0.00 O ATOM 203 ND2 ASN A 15 -12.563 -4.558 -2.342 1.00 0.00 N ATOM 0 H ASN A 15 -9.329 -5.794 -2.537 1.00 0.00 H new ATOM 0 HA ASN A 15 -10.954 -7.382 -0.661 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -11.632 -6.599 -3.527 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -12.506 -7.801 -2.598 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -13.116 -3.784 -1.974 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -11.838 -4.381 -3.038 1.00 0.00 H new ATOM 210 N TYR A 16 -10.494 -9.529 -2.014 1.00 0.00 N ATOM 211 CA TYR A 16 -9.931 -10.779 -2.494 1.00 0.00 C ATOM 212 C TYR A 16 -11.028 -11.558 -3.210 1.00 0.00 C ATOM 213 O TYR A 16 -12.199 -11.463 -2.841 1.00 0.00 O ATOM 214 CB TYR A 16 -9.373 -11.585 -1.312 1.00 0.00 C ATOM 215 CG TYR A 16 -8.294 -12.597 -1.664 1.00 0.00 C ATOM 216 CD1 TYR A 16 -7.357 -12.339 -2.654 1.00 0.00 C ATOM 217 CD2 TYR A 16 -8.206 -13.806 -0.985 1.00 0.00 C ATOM 218 CE1 TYR A 16 -6.369 -13.255 -2.963 1.00 0.00 C ATOM 219 CE2 TYR A 16 -7.220 -14.726 -1.288 1.00 0.00 C ATOM 220 CZ TYR A 16 -6.306 -14.449 -2.278 1.00 0.00 C ATOM 221 OH TYR A 16 -5.322 -15.367 -2.584 1.00 0.00 O ATOM 0 H TYR A 16 -11.353 -9.641 -1.475 1.00 0.00 H new ATOM 0 HA TYR A 16 -9.113 -10.586 -3.188 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -8.968 -10.888 -0.578 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -10.198 -12.111 -0.831 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -7.400 -11.404 -3.194 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -8.920 -14.031 -0.207 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -5.649 -13.036 -3.738 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -7.167 -15.660 -0.749 1.00 0.00 H new ATOM 0 HH TYR A 16 -5.418 -16.154 -2.008 1.00 0.00 H new ATOM 231 N ASP A 17 -10.651 -12.305 -4.230 1.00 0.00 N ATOM 232 CA ASP A 17 -11.609 -13.037 -5.060 1.00 0.00 C ATOM 233 C ASP A 17 -10.911 -14.228 -5.696 1.00 0.00 C ATOM 234 O ASP A 17 -10.178 -14.064 -6.674 1.00 0.00 O ATOM 235 CB ASP A 17 -12.175 -12.117 -6.149 1.00 0.00 C ATOM 236 CG ASP A 17 -13.327 -12.744 -6.911 1.00 0.00 C ATOM 237 OD1 ASP A 17 -13.090 -13.649 -7.737 1.00 0.00 O ATOM 238 OD2 ASP A 17 -14.482 -12.324 -6.690 1.00 0.00 O ATOM 0 H ASP A 17 -9.678 -12.426 -4.512 1.00 0.00 H new ATOM 0 HA ASP A 17 -12.433 -13.387 -4.439 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -12.512 -11.186 -5.692 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -11.380 -11.859 -6.849 1.00 0.00 H new ATOM 243 N GLY A 18 -11.126 -15.417 -5.143 1.00 0.00 N ATOM 244 CA GLY A 18 -10.308 -16.556 -5.519 1.00 0.00 C ATOM 245 C GLY A 18 -8.870 -16.280 -5.146 1.00 0.00 C ATOM 246 O GLY A 18 -8.468 -16.482 -4.000 1.00 0.00 O ATOM 0 H GLY A 18 -11.846 -15.612 -4.447 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -10.661 -17.455 -5.014 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -10.389 -16.740 -6.590 1.00 0.00 H new ATOM 250 N SER A 19 -8.089 -15.817 -6.102 1.00 0.00 N ATOM 251 CA SER A 19 -6.879 -15.112 -5.792 1.00 0.00 C ATOM 252 C SER A 19 -6.787 -13.893 -6.701 1.00 0.00 C ATOM 253 O SER A 19 -6.252 -13.955 -7.808 1.00 0.00 O ATOM 254 CB SER A 19 -5.678 -16.029 -5.974 1.00 0.00 C ATOM 255 OG SER A 19 -4.506 -15.456 -5.419 1.00 0.00 O ATOM 0 H SER A 19 -8.278 -15.921 -7.099 1.00 0.00 H new ATOM 0 HA SER A 19 -6.886 -14.784 -4.752 1.00 0.00 H new ATOM 0 HB2 SER A 19 -5.876 -16.990 -5.499 1.00 0.00 H new ATOM 0 HB3 SER A 19 -5.523 -16.224 -7.035 1.00 0.00 H new ATOM 0 HG SER A 19 -4.612 -15.369 -4.449 1.00 0.00 H new ATOM 261 N THR A 20 -7.349 -12.791 -6.231 1.00 0.00 N ATOM 262 CA THR A 20 -7.348 -11.536 -6.961 1.00 0.00 C ATOM 263 C THR A 20 -7.216 -10.378 -5.981 1.00 0.00 C ATOM 264 O THR A 20 -7.813 -10.412 -4.908 1.00 0.00 O ATOM 265 CB THR A 20 -8.646 -11.363 -7.786 1.00 0.00 C ATOM 266 OG1 THR A 20 -8.915 -12.555 -8.535 1.00 0.00 O ATOM 267 CG2 THR A 20 -8.536 -10.182 -8.739 1.00 0.00 C ATOM 0 H THR A 20 -7.821 -12.743 -5.328 1.00 0.00 H new ATOM 0 HA THR A 20 -6.503 -11.545 -7.650 1.00 0.00 H new ATOM 0 HB THR A 20 -9.463 -11.174 -7.090 1.00 0.00 H new ATOM 0 HG1 THR A 20 -9.394 -13.196 -7.969 1.00 0.00 H new ATOM 0 HG21 THR A 20 -9.462 -10.084 -9.306 1.00 0.00 H new ATOM 0 HG22 THR A 20 -8.361 -9.270 -8.169 1.00 0.00 H new ATOM 0 HG23 THR A 20 -7.706 -10.345 -9.426 1.00 0.00 H new ATOM 275 N PHE A 21 -6.433 -9.373 -6.332 1.00 0.00 N ATOM 276 CA PHE A 21 -6.320 -8.184 -5.507 1.00 0.00 C ATOM 277 C PHE A 21 -7.016 -7.029 -6.195 1.00 0.00 C ATOM 278 O PHE A 21 -6.785 -6.764 -7.372 1.00 0.00 O ATOM 279 CB PHE A 21 -4.853 -7.821 -5.255 1.00 0.00 C ATOM 280 CG PHE A 21 -4.654 -6.789 -4.177 1.00 0.00 C ATOM 281 CD1 PHE A 21 -4.936 -5.450 -4.401 1.00 0.00 C ATOM 282 CD2 PHE A 21 -4.196 -7.171 -2.933 1.00 0.00 C ATOM 283 CE1 PHE A 21 -4.761 -4.515 -3.400 1.00 0.00 C ATOM 284 CE2 PHE A 21 -4.020 -6.241 -1.925 1.00 0.00 C ATOM 285 CZ PHE A 21 -4.301 -4.910 -2.160 1.00 0.00 C ATOM 0 H PHE A 21 -5.867 -9.357 -7.181 1.00 0.00 H new ATOM 0 HA PHE A 21 -6.791 -8.387 -4.545 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -4.307 -8.725 -4.984 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -4.416 -7.451 -6.183 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -5.296 -5.135 -5.369 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -3.972 -8.210 -2.744 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -4.984 -3.475 -3.587 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -3.663 -6.555 -0.955 1.00 0.00 H new ATOM 0 HZ PHE A 21 -4.161 -4.180 -1.376 1.00 0.00 H new ATOM 295 N SER A 22 -7.877 -6.358 -5.474 1.00 0.00 N ATOM 296 CA SER A 22 -8.509 -5.163 -5.988 1.00 0.00 C ATOM 297 C SER A 22 -8.860 -4.229 -4.844 1.00 0.00 C ATOM 298 O SER A 22 -9.548 -4.612 -3.901 1.00 0.00 O ATOM 299 CB SER A 22 -9.745 -5.522 -6.813 1.00 0.00 C ATOM 300 OG SER A 22 -10.664 -6.296 -6.058 1.00 0.00 O ATOM 0 H SER A 22 -8.159 -6.616 -4.528 1.00 0.00 H new ATOM 0 HA SER A 22 -7.811 -4.647 -6.647 1.00 0.00 H new ATOM 0 HB2 SER A 22 -10.232 -4.610 -7.157 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.443 -6.077 -7.701 1.00 0.00 H new ATOM 0 HG SER A 22 -11.444 -6.509 -6.611 1.00 0.00 H new ATOM 306 N GLY A 23 -8.364 -3.011 -4.915 1.00 0.00 N ATOM 307 CA GLY A 23 -8.574 -2.077 -3.837 1.00 0.00 C ATOM 308 C GLY A 23 -7.975 -0.731 -4.129 1.00 0.00 C ATOM 309 O GLY A 23 -7.741 -0.382 -5.290 1.00 0.00 O ATOM 0 H GLY A 23 -7.820 -2.651 -5.699 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -9.643 -1.966 -3.658 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -8.137 -2.477 -2.922 1.00 0.00 H new ATOM 313 N LYS A 24 -7.713 0.024 -3.081 1.00 0.00 N ATOM 314 CA LYS A 24 -7.180 1.356 -3.232 1.00 0.00 C ATOM 315 C LYS A 24 -6.509 1.831 -1.947 1.00 0.00 C ATOM 316 O LYS A 24 -6.737 1.282 -0.866 1.00 0.00 O ATOM 317 CB LYS A 24 -8.287 2.308 -3.674 1.00 0.00 C ATOM 318 CG LYS A 24 -9.486 2.360 -2.743 1.00 0.00 C ATOM 319 CD LYS A 24 -10.590 3.219 -3.339 1.00 0.00 C ATOM 320 CE LYS A 24 -11.728 3.466 -2.359 1.00 0.00 C ATOM 321 NZ LYS A 24 -12.195 2.217 -1.701 1.00 0.00 N ATOM 0 H LYS A 24 -7.862 -0.266 -2.115 1.00 0.00 H new ATOM 0 HA LYS A 24 -6.410 1.342 -4.004 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -7.871 3.311 -3.765 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -8.627 2.013 -4.667 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -9.859 1.351 -2.565 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -9.185 2.764 -1.776 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -10.172 4.175 -3.654 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -10.983 2.733 -4.232 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -11.400 4.173 -1.597 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -12.562 3.929 -2.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.222 2.268 -1.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -11.975 1.402 -2.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -11.714 2.106 -0.785 1.00 0.00 H new ATOM 335 N ILE A 25 -5.688 2.857 -2.083 1.00 0.00 N ATOM 336 CA ILE A 25 -4.819 3.308 -1.009 1.00 0.00 C ATOM 337 C ILE A 25 -5.053 4.790 -0.715 1.00 0.00 C ATOM 338 O ILE A 25 -5.569 5.529 -1.555 1.00 0.00 O ATOM 339 CB ILE A 25 -3.332 3.083 -1.375 1.00 0.00 C ATOM 340 CG1 ILE A 25 -3.148 1.703 -2.021 1.00 0.00 C ATOM 341 CG2 ILE A 25 -2.449 3.199 -0.138 1.00 0.00 C ATOM 342 CD1 ILE A 25 -1.727 1.408 -2.443 1.00 0.00 C ATOM 0 H ILE A 25 -5.604 3.402 -2.941 1.00 0.00 H new ATOM 0 HA ILE A 25 -5.057 2.725 -0.120 1.00 0.00 H new ATOM 0 HB ILE A 25 -3.035 3.853 -2.087 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -3.474 0.937 -1.317 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -3.798 1.632 -2.893 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -1.408 3.037 -0.418 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -2.558 4.193 0.295 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -2.748 2.449 0.594 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -1.679 0.415 -2.890 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -1.402 2.151 -3.172 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -1.073 1.445 -1.571 1.00 0.00 H new ATOM 354 N TYR A 26 -4.657 5.211 0.476 1.00 0.00 N ATOM 355 CA TYR A 26 -4.908 6.558 0.959 1.00 0.00 C ATOM 356 C TYR A 26 -3.605 7.146 1.519 1.00 0.00 C ATOM 357 O TYR A 26 -3.224 6.840 2.646 1.00 0.00 O ATOM 358 CB TYR A 26 -5.963 6.446 2.060 1.00 0.00 C ATOM 359 CG TYR A 26 -6.678 7.723 2.416 1.00 0.00 C ATOM 360 CD1 TYR A 26 -6.023 8.748 3.072 1.00 0.00 C ATOM 361 CD2 TYR A 26 -8.027 7.885 2.121 1.00 0.00 C ATOM 362 CE1 TYR A 26 -6.690 9.906 3.425 1.00 0.00 C ATOM 363 CE2 TYR A 26 -8.700 9.039 2.464 1.00 0.00 C ATOM 364 CZ TYR A 26 -8.026 10.048 3.117 1.00 0.00 C ATOM 365 OH TYR A 26 -8.693 11.199 3.469 1.00 0.00 O ATOM 0 H TYR A 26 -4.150 4.624 1.138 1.00 0.00 H new ATOM 0 HA TYR A 26 -5.259 7.213 0.161 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -6.706 5.710 1.752 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -5.483 6.058 2.959 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -4.975 8.643 3.312 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -8.558 7.093 1.614 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -6.166 10.697 3.941 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -9.747 9.151 2.223 1.00 0.00 H new ATOM 0 HH TYR A 26 -9.627 11.138 3.178 1.00 0.00 H new ATOM 375 N VAL A 27 -2.909 7.986 0.755 1.00 0.00 N ATOM 376 CA VAL A 27 -1.563 8.390 1.163 1.00 0.00 C ATOM 377 C VAL A 27 -1.321 9.885 0.994 1.00 0.00 C ATOM 378 O VAL A 27 -1.878 10.533 0.111 1.00 0.00 O ATOM 379 CB VAL A 27 -0.437 7.583 0.439 1.00 0.00 C ATOM 380 CG1 VAL A 27 -0.996 6.395 -0.323 1.00 0.00 C ATOM 381 CG2 VAL A 27 0.407 8.455 -0.482 1.00 0.00 C ATOM 0 H VAL A 27 -3.239 8.389 -0.122 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.512 8.155 2.226 1.00 0.00 H new ATOM 0 HB VAL A 27 0.217 7.208 1.226 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -0.182 5.860 -0.812 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -1.505 5.725 0.370 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -1.703 6.745 -1.075 1.00 0.00 H new ATOM 0 HG21 VAL A 27 1.174 7.845 -0.959 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -0.230 8.900 -1.246 1.00 0.00 H new ATOM 0 HG23 VAL A 27 0.882 9.245 0.100 1.00 0.00 H new ATOM 391 N LYS A 28 -0.494 10.412 1.885 1.00 0.00 N ATOM 392 CA LYS A 28 -0.098 11.808 1.872 1.00 0.00 C ATOM 393 C LYS A 28 0.987 12.031 0.834 1.00 0.00 C ATOM 394 O LYS A 28 1.960 11.284 0.782 1.00 0.00 O ATOM 395 CB LYS A 28 0.410 12.191 3.262 1.00 0.00 C ATOM 396 CG LYS A 28 0.666 13.669 3.463 1.00 0.00 C ATOM 397 CD LYS A 28 0.814 13.982 4.940 1.00 0.00 C ATOM 398 CE LYS A 28 0.995 15.466 5.181 1.00 0.00 C ATOM 399 NZ LYS A 28 0.935 15.794 6.625 1.00 0.00 N ATOM 0 H LYS A 28 -0.076 9.875 2.644 1.00 0.00 H new ATOM 0 HA LYS A 28 -0.953 12.432 1.613 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -0.318 11.859 4.003 1.00 0.00 H new ATOM 0 HB3 LYS A 28 1.334 11.647 3.457 1.00 0.00 H new ATOM 0 HG2 LYS A 28 1.569 13.964 2.929 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -0.156 14.248 3.042 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -0.067 13.631 5.477 1.00 0.00 H new ATOM 0 HD3 LYS A 28 1.670 13.440 5.343 1.00 0.00 H new ATOM 0 HE2 LYS A 28 1.954 15.787 4.774 1.00 0.00 H new ATOM 0 HE3 LYS A 28 0.221 16.019 4.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 1.309 16.752 6.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -0.052 15.751 6.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 1.506 15.109 7.161 1.00 0.00 H new ATOM 413 N ASN A 29 0.817 13.044 0.003 1.00 0.00 N ATOM 414 CA ASN A 29 1.806 13.356 -1.016 1.00 0.00 C ATOM 415 C ASN A 29 2.821 14.356 -0.480 1.00 0.00 C ATOM 416 O ASN A 29 2.466 15.436 -0.005 1.00 0.00 O ATOM 417 CB ASN A 29 1.145 13.883 -2.301 1.00 0.00 C ATOM 418 CG ASN A 29 0.165 15.014 -2.070 1.00 0.00 C ATOM 419 OD1 ASN A 29 0.538 16.171 -1.881 1.00 0.00 O ATOM 420 ND2 ASN A 29 -1.102 14.683 -2.154 1.00 0.00 N ATOM 0 H ASN A 29 0.007 13.663 0.013 1.00 0.00 H new ATOM 0 HA ASN A 29 2.327 12.433 -1.272 1.00 0.00 H new ATOM 0 HB2 ASN A 29 1.923 14.224 -2.984 1.00 0.00 H new ATOM 0 HB3 ASN A 29 0.626 13.061 -2.794 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -1.823 15.398 -2.062 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -1.366 13.710 -2.312 1.00 0.00 H new ATOM 427 N ILE A 30 4.088 13.963 -0.518 1.00 0.00 N ATOM 428 CA ILE A 30 5.174 14.821 -0.062 1.00 0.00 C ATOM 429 C ILE A 30 5.470 15.886 -1.107 1.00 0.00 C ATOM 430 O ILE A 30 5.441 17.081 -0.825 1.00 0.00 O ATOM 431 CB ILE A 30 6.457 14.011 0.207 1.00 0.00 C ATOM 432 CG1 ILE A 30 6.151 12.774 1.057 1.00 0.00 C ATOM 433 CG2 ILE A 30 7.501 14.879 0.886 1.00 0.00 C ATOM 434 CD1 ILE A 30 5.440 13.070 2.363 1.00 0.00 C ATOM 0 H ILE A 30 4.390 13.051 -0.862 1.00 0.00 H new ATOM 0 HA ILE A 30 4.856 15.289 0.870 1.00 0.00 H new ATOM 0 HB ILE A 30 6.856 13.676 -0.750 1.00 0.00 H new ATOM 0 HG12 ILE A 30 5.538 12.089 0.471 1.00 0.00 H new ATOM 0 HG13 ILE A 30 7.086 12.258 1.276 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.400 14.291 1.068 1.00 0.00 H new ATOM 0 HG22 ILE A 30 7.745 15.725 0.243 1.00 0.00 H new ATOM 0 HG23 ILE A 30 7.108 15.245 1.835 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.263 12.138 2.900 1.00 0.00 H new ATOM 0 HD12 ILE A 30 6.058 13.729 2.973 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.487 13.556 2.156 1.00 0.00 H new ATOM 446 N ALA A 31 5.772 15.435 -2.312 1.00 0.00 N ATOM 447 CA ALA A 31 5.938 16.333 -3.440 1.00 0.00 C ATOM 448 C ALA A 31 4.749 16.202 -4.386 1.00 0.00 C ATOM 449 O ALA A 31 3.816 17.001 -4.333 1.00 0.00 O ATOM 450 CB ALA A 31 7.244 16.049 -4.167 1.00 0.00 C ATOM 0 H ALA A 31 5.908 14.449 -2.534 1.00 0.00 H new ATOM 0 HA ALA A 31 5.979 17.358 -3.071 1.00 0.00 H new ATOM 0 HB1 ALA A 31 7.348 16.733 -5.009 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.080 16.188 -3.481 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.241 15.022 -4.533 1.00 0.00 H new ATOM 456 N TYR A 32 4.784 15.174 -5.227 1.00 0.00 N ATOM 457 CA TYR A 32 3.688 14.870 -6.136 1.00 0.00 C ATOM 458 C TYR A 32 3.874 13.474 -6.714 1.00 0.00 C ATOM 459 O TYR A 32 3.204 12.528 -6.312 1.00 0.00 O ATOM 460 CB TYR A 32 3.614 15.904 -7.267 1.00 0.00 C ATOM 461 CG TYR A 32 2.445 15.704 -8.207 1.00 0.00 C ATOM 462 CD1 TYR A 32 1.169 15.482 -7.711 1.00 0.00 C ATOM 463 CD2 TYR A 32 2.616 15.749 -9.585 1.00 0.00 C ATOM 464 CE1 TYR A 32 0.092 15.307 -8.559 1.00 0.00 C ATOM 465 CE2 TYR A 32 1.545 15.574 -10.442 1.00 0.00 C ATOM 466 CZ TYR A 32 0.285 15.354 -9.924 1.00 0.00 C ATOM 467 OH TYR A 32 -0.788 15.189 -10.774 1.00 0.00 O ATOM 0 H TYR A 32 5.572 14.530 -5.297 1.00 0.00 H new ATOM 0 HA TYR A 32 2.752 14.909 -5.578 1.00 0.00 H new ATOM 0 HB2 TYR A 32 3.550 16.901 -6.831 1.00 0.00 H new ATOM 0 HB3 TYR A 32 4.540 15.866 -7.841 1.00 0.00 H new ATOM 0 HD1 TYR A 32 1.014 15.445 -6.643 1.00 0.00 H new ATOM 0 HD2 TYR A 32 3.601 15.923 -9.993 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -0.895 15.134 -8.155 1.00 0.00 H new ATOM 0 HE2 TYR A 32 1.694 15.609 -11.511 1.00 0.00 H new ATOM 0 HH TYR A 32 -0.482 15.251 -11.703 1.00 0.00 H new ATOM 477 N SER A 33 4.830 13.341 -7.620 1.00 0.00 N ATOM 478 CA SER A 33 5.083 12.071 -8.279 1.00 0.00 C ATOM 479 C SER A 33 5.981 11.184 -7.416 1.00 0.00 C ATOM 480 O SER A 33 7.148 10.953 -7.734 1.00 0.00 O ATOM 481 CB SER A 33 5.719 12.318 -9.647 1.00 0.00 C ATOM 482 OG SER A 33 4.919 13.202 -10.417 1.00 0.00 O ATOM 0 H SER A 33 5.444 14.100 -7.916 1.00 0.00 H new ATOM 0 HA SER A 33 4.136 11.551 -8.420 1.00 0.00 H new ATOM 0 HB2 SER A 33 6.716 12.739 -9.520 1.00 0.00 H new ATOM 0 HB3 SER A 33 5.837 11.372 -10.175 1.00 0.00 H new ATOM 0 HG SER A 33 5.342 13.350 -11.289 1.00 0.00 H new ATOM 488 N LYS A 34 5.437 10.725 -6.298 1.00 0.00 N ATOM 489 CA LYS A 34 6.156 9.834 -5.402 1.00 0.00 C ATOM 490 C LYS A 34 5.793 8.396 -5.731 1.00 0.00 C ATOM 491 O LYS A 34 4.906 8.148 -6.550 1.00 0.00 O ATOM 492 CB LYS A 34 5.828 10.183 -3.955 1.00 0.00 C ATOM 493 CG LYS A 34 6.015 11.670 -3.632 1.00 0.00 C ATOM 494 CD LYS A 34 7.083 12.347 -4.505 1.00 0.00 C ATOM 495 CE LYS A 34 8.431 11.630 -4.477 1.00 0.00 C ATOM 496 NZ LYS A 34 9.197 11.841 -5.736 1.00 0.00 N ATOM 0 H LYS A 34 4.493 10.958 -5.989 1.00 0.00 H new ATOM 0 HA LYS A 34 7.231 9.953 -5.534 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.797 9.900 -3.745 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.462 9.592 -3.294 1.00 0.00 H new ATOM 0 HG2 LYS A 34 5.065 12.187 -3.765 1.00 0.00 H new ATOM 0 HG3 LYS A 34 6.291 11.776 -2.583 1.00 0.00 H new ATOM 0 HD2 LYS A 34 6.725 12.393 -5.534 1.00 0.00 H new ATOM 0 HD3 LYS A 34 7.219 13.375 -4.168 1.00 0.00 H new ATOM 0 HE2 LYS A 34 9.016 11.990 -3.631 1.00 0.00 H new ATOM 0 HE3 LYS A 34 8.272 10.563 -4.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 9.365 10.924 -6.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 8.653 12.456 -6.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 10.109 12.290 -5.516 1.00 0.00 H new ATOM 510 N LYS A 35 6.471 7.450 -5.114 1.00 0.00 N ATOM 511 CA LYS A 35 6.281 6.054 -5.462 1.00 0.00 C ATOM 512 C LYS A 35 5.393 5.367 -4.453 1.00 0.00 C ATOM 513 O LYS A 35 5.626 5.452 -3.245 1.00 0.00 O ATOM 514 CB LYS A 35 7.608 5.304 -5.512 1.00 0.00 C ATOM 515 CG LYS A 35 8.622 5.862 -6.490 1.00 0.00 C ATOM 516 CD LYS A 35 9.859 4.983 -6.510 1.00 0.00 C ATOM 517 CE LYS A 35 11.020 5.630 -7.240 1.00 0.00 C ATOM 518 NZ LYS A 35 12.238 4.787 -7.153 1.00 0.00 N ATOM 0 H LYS A 35 7.153 7.618 -4.375 1.00 0.00 H new ATOM 0 HA LYS A 35 5.816 6.037 -6.448 1.00 0.00 H new ATOM 0 HB2 LYS A 35 8.048 5.307 -4.515 1.00 0.00 H new ATOM 0 HB3 LYS A 35 7.411 4.264 -5.770 1.00 0.00 H new ATOM 0 HG2 LYS A 35 8.187 5.915 -7.488 1.00 0.00 H new ATOM 0 HG3 LYS A 35 8.893 6.879 -6.206 1.00 0.00 H new ATOM 0 HD2 LYS A 35 10.158 4.759 -5.486 1.00 0.00 H new ATOM 0 HD3 LYS A 35 9.618 4.033 -6.987 1.00 0.00 H new ATOM 0 HE2 LYS A 35 10.755 5.786 -8.286 1.00 0.00 H new ATOM 0 HE3 LYS A 35 11.222 6.612 -6.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 13.082 5.384 -7.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 12.267 4.313 -6.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 12.220 4.072 -7.908 1.00 0.00 H new ATOM 532 N VAL A 36 4.378 4.684 -4.944 1.00 0.00 N ATOM 533 CA VAL A 36 3.571 3.844 -4.096 1.00 0.00 C ATOM 534 C VAL A 36 3.614 2.427 -4.612 1.00 0.00 C ATOM 535 O VAL A 36 3.047 2.097 -5.654 1.00 0.00 O ATOM 536 CB VAL A 36 2.120 4.337 -3.969 1.00 0.00 C ATOM 537 CG1 VAL A 36 1.281 3.309 -3.247 1.00 0.00 C ATOM 538 CG2 VAL A 36 2.096 5.642 -3.206 1.00 0.00 C ATOM 0 H VAL A 36 4.097 4.697 -5.924 1.00 0.00 H new ATOM 0 HA VAL A 36 3.992 3.886 -3.091 1.00 0.00 H new ATOM 0 HB VAL A 36 1.707 4.490 -4.966 1.00 0.00 H new ATOM 0 HG11 VAL A 36 0.256 3.670 -3.163 1.00 0.00 H new ATOM 0 HG12 VAL A 36 1.292 2.373 -3.806 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.689 3.141 -2.250 1.00 0.00 H new ATOM 0 HG21 VAL A 36 1.068 5.992 -3.116 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.516 5.490 -2.212 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.687 6.386 -3.740 1.00 0.00 H new ATOM 548 N THR A 37 4.312 1.604 -3.872 1.00 0.00 N ATOM 549 CA THR A 37 4.582 0.251 -4.291 1.00 0.00 C ATOM 550 C THR A 37 4.023 -0.733 -3.295 1.00 0.00 C ATOM 551 O THR A 37 4.425 -0.756 -2.130 1.00 0.00 O ATOM 552 CB THR A 37 6.092 0.035 -4.466 1.00 0.00 C ATOM 553 OG1 THR A 37 6.816 0.698 -3.420 1.00 0.00 O ATOM 554 CG2 THR A 37 6.536 0.567 -5.813 1.00 0.00 C ATOM 0 H THR A 37 4.708 1.851 -2.965 1.00 0.00 H new ATOM 0 HA THR A 37 4.094 0.085 -5.251 1.00 0.00 H new ATOM 0 HB THR A 37 6.300 -1.034 -4.414 1.00 0.00 H new ATOM 0 HG1 THR A 37 7.696 0.972 -3.754 1.00 0.00 H new ATOM 0 HG21 THR A 37 7.608 0.411 -5.931 1.00 0.00 H new ATOM 0 HG22 THR A 37 6.004 0.041 -6.605 1.00 0.00 H new ATOM 0 HG23 THR A 37 6.316 1.633 -5.874 1.00 0.00 H new ATOM 562 N VAL A 38 3.067 -1.517 -3.744 1.00 0.00 N ATOM 563 CA VAL A 38 2.510 -2.557 -2.909 1.00 0.00 C ATOM 564 C VAL A 38 3.464 -3.712 -2.860 1.00 0.00 C ATOM 565 O VAL A 38 4.028 -4.113 -3.872 1.00 0.00 O ATOM 566 CB VAL A 38 1.153 -3.078 -3.405 1.00 0.00 C ATOM 567 CG1 VAL A 38 0.678 -4.277 -2.580 1.00 0.00 C ATOM 568 CG2 VAL A 38 0.115 -1.991 -3.364 1.00 0.00 C ATOM 0 H VAL A 38 2.661 -1.454 -4.678 1.00 0.00 H new ATOM 0 HA VAL A 38 2.353 -2.115 -1.925 1.00 0.00 H new ATOM 0 HB VAL A 38 1.289 -3.402 -4.437 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -0.285 -4.620 -2.958 1.00 0.00 H new ATOM 0 HG12 VAL A 38 1.407 -5.084 -2.658 1.00 0.00 H new ATOM 0 HG13 VAL A 38 0.574 -3.982 -1.536 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -0.837 -2.384 -3.720 1.00 0.00 H new ATOM 0 HG22 VAL A 38 0.001 -1.635 -2.340 1.00 0.00 H new ATOM 0 HG23 VAL A 38 0.428 -1.165 -4.002 1.00 0.00 H new ATOM 578 N VAL A 39 3.636 -4.232 -1.685 1.00 0.00 N ATOM 579 CA VAL A 39 4.472 -5.391 -1.499 1.00 0.00 C ATOM 580 C VAL A 39 3.660 -6.463 -0.822 1.00 0.00 C ATOM 581 O VAL A 39 3.316 -6.334 0.352 1.00 0.00 O ATOM 582 CB VAL A 39 5.740 -5.097 -0.657 1.00 0.00 C ATOM 583 CG1 VAL A 39 6.987 -5.528 -1.411 1.00 0.00 C ATOM 584 CG2 VAL A 39 5.827 -3.625 -0.272 1.00 0.00 C ATOM 0 H VAL A 39 3.208 -3.874 -0.831 1.00 0.00 H new ATOM 0 HA VAL A 39 4.815 -5.712 -2.482 1.00 0.00 H new ATOM 0 HB VAL A 39 5.670 -5.674 0.265 1.00 0.00 H new ATOM 0 HG11 VAL A 39 7.869 -5.315 -0.807 1.00 0.00 H new ATOM 0 HG12 VAL A 39 6.937 -6.597 -1.616 1.00 0.00 H new ATOM 0 HG13 VAL A 39 7.051 -4.981 -2.352 1.00 0.00 H new ATOM 0 HG21 VAL A 39 6.728 -3.456 0.317 1.00 0.00 H new ATOM 0 HG22 VAL A 39 5.864 -3.014 -1.174 1.00 0.00 H new ATOM 0 HG23 VAL A 39 4.952 -3.350 0.317 1.00 0.00 H new ATOM 594 N TYR A 40 3.300 -7.503 -1.555 1.00 0.00 N ATOM 595 CA TYR A 40 2.622 -8.606 -0.925 1.00 0.00 C ATOM 596 C TYR A 40 3.494 -9.811 -0.912 1.00 0.00 C ATOM 597 O TYR A 40 4.200 -10.128 -1.868 1.00 0.00 O ATOM 598 CB TYR A 40 1.250 -8.937 -1.529 1.00 0.00 C ATOM 599 CG TYR A 40 1.226 -9.838 -2.761 1.00 0.00 C ATOM 600 CD1 TYR A 40 1.541 -11.192 -2.715 1.00 0.00 C ATOM 601 CD2 TYR A 40 0.848 -9.316 -3.964 1.00 0.00 C ATOM 602 CE1 TYR A 40 1.481 -11.980 -3.850 1.00 0.00 C ATOM 603 CE2 TYR A 40 0.777 -10.086 -5.107 1.00 0.00 C ATOM 604 CZ TYR A 40 1.096 -11.421 -5.045 1.00 0.00 C ATOM 605 OH TYR A 40 1.020 -12.199 -6.180 1.00 0.00 O ATOM 0 H TYR A 40 3.463 -7.601 -2.557 1.00 0.00 H new ATOM 0 HA TYR A 40 2.419 -8.283 0.096 1.00 0.00 H new ATOM 0 HB2 TYR A 40 0.645 -9.409 -0.754 1.00 0.00 H new ATOM 0 HB3 TYR A 40 0.760 -7.998 -1.788 1.00 0.00 H new ATOM 0 HD1 TYR A 40 1.838 -11.636 -1.776 1.00 0.00 H new ATOM 0 HD2 TYR A 40 0.597 -8.267 -4.023 1.00 0.00 H new ATOM 0 HE1 TYR A 40 1.735 -13.028 -3.798 1.00 0.00 H new ATOM 0 HE2 TYR A 40 0.473 -9.642 -6.044 1.00 0.00 H new ATOM 0 HH TYR A 40 0.731 -11.647 -6.936 1.00 0.00 H new ATOM 615 N ALA A 41 3.463 -10.447 0.213 1.00 0.00 N ATOM 616 CA ALA A 41 4.195 -11.635 0.426 1.00 0.00 C ATOM 617 C ALA A 41 3.312 -12.775 0.021 1.00 0.00 C ATOM 618 O ALA A 41 2.416 -13.151 0.757 1.00 0.00 O ATOM 619 CB ALA A 41 4.594 -11.698 1.876 1.00 0.00 C ATOM 0 H ALA A 41 2.916 -10.144 1.019 1.00 0.00 H new ATOM 0 HA ALA A 41 5.111 -11.677 -0.163 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.161 -12.611 2.058 1.00 0.00 H new ATOM 0 HB2 ALA A 41 5.210 -10.833 2.122 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.700 -11.696 2.500 1.00 0.00 H new ATOM 625 N ASP A 42 3.520 -13.225 -1.202 1.00 0.00 N ATOM 626 CA ASP A 42 2.706 -14.287 -1.828 1.00 0.00 C ATOM 627 C ASP A 42 2.435 -15.455 -0.878 1.00 0.00 C ATOM 628 O ASP A 42 3.092 -15.607 0.143 1.00 0.00 O ATOM 629 CB ASP A 42 3.353 -14.797 -3.130 1.00 0.00 C ATOM 630 CG ASP A 42 4.525 -15.742 -2.922 1.00 0.00 C ATOM 631 OD1 ASP A 42 4.301 -16.892 -2.488 1.00 0.00 O ATOM 632 OD2 ASP A 42 5.675 -15.345 -3.218 1.00 0.00 O ATOM 0 H ASP A 42 4.261 -12.870 -1.806 1.00 0.00 H new ATOM 0 HA ASP A 42 1.745 -13.832 -2.070 1.00 0.00 H new ATOM 0 HB2 ASP A 42 2.593 -15.305 -3.724 1.00 0.00 H new ATOM 0 HB3 ASP A 42 3.692 -13.940 -3.712 1.00 0.00 H new ATOM 637 N GLY A 43 1.442 -16.271 -1.238 1.00 0.00 N ATOM 638 CA GLY A 43 0.865 -17.264 -0.330 1.00 0.00 C ATOM 639 C GLY A 43 1.860 -18.270 0.209 1.00 0.00 C ATOM 640 O GLY A 43 1.577 -18.982 1.173 1.00 0.00 O ATOM 0 H GLY A 43 1.016 -16.262 -2.165 1.00 0.00 H new ATOM 0 HA2 GLY A 43 0.400 -16.745 0.509 1.00 0.00 H new ATOM 0 HA3 GLY A 43 0.072 -17.799 -0.853 1.00 0.00 H new ATOM 644 N SER A 44 3.026 -18.301 -0.391 1.00 0.00 N ATOM 645 CA SER A 44 4.067 -19.225 -0.009 1.00 0.00 C ATOM 646 C SER A 44 5.180 -18.435 0.638 1.00 0.00 C ATOM 647 O SER A 44 6.006 -18.964 1.383 1.00 0.00 O ATOM 648 CB SER A 44 4.587 -19.949 -1.249 1.00 0.00 C ATOM 649 OG SER A 44 5.500 -20.978 -0.914 1.00 0.00 O ATOM 0 H SER A 44 3.281 -17.683 -1.162 1.00 0.00 H new ATOM 0 HA SER A 44 3.683 -19.968 0.690 1.00 0.00 H new ATOM 0 HB2 SER A 44 3.748 -20.373 -1.801 1.00 0.00 H new ATOM 0 HB3 SER A 44 5.074 -19.233 -1.911 1.00 0.00 H new ATOM 0 HG SER A 44 5.810 -21.420 -1.732 1.00 0.00 H new ATOM 655 N ASP A 45 5.155 -17.142 0.362 1.00 0.00 N ATOM 656 CA ASP A 45 6.196 -16.245 0.758 1.00 0.00 C ATOM 657 C ASP A 45 6.160 -15.945 2.229 1.00 0.00 C ATOM 658 O ASP A 45 6.685 -16.715 3.033 1.00 0.00 O ATOM 659 CB ASP A 45 6.147 -14.948 -0.057 1.00 0.00 C ATOM 660 CG ASP A 45 7.396 -14.094 0.084 1.00 0.00 C ATOM 661 OD1 ASP A 45 8.294 -14.447 0.879 1.00 0.00 O ATOM 662 OD2 ASP A 45 7.487 -13.070 -0.626 1.00 0.00 O ATOM 0 H ASP A 45 4.396 -16.693 -0.150 1.00 0.00 H new ATOM 0 HA ASP A 45 7.140 -16.749 0.552 1.00 0.00 H new ATOM 0 HB2 ASP A 45 6.002 -15.195 -1.109 1.00 0.00 H new ATOM 0 HB3 ASP A 45 5.281 -14.365 0.256 1.00 0.00 H new ATOM 667 N ASN A 46 5.469 -14.876 2.577 1.00 0.00 N ATOM 668 CA ASN A 46 5.710 -14.214 3.864 1.00 0.00 C ATOM 669 C ASN A 46 7.217 -13.939 3.969 1.00 0.00 C ATOM 670 O ASN A 46 7.988 -14.816 4.363 1.00 0.00 O ATOM 671 CB ASN A 46 5.230 -15.095 5.006 1.00 0.00 C ATOM 672 CG ASN A 46 5.130 -14.360 6.331 1.00 0.00 C ATOM 673 OD1 ASN A 46 5.809 -13.359 6.561 1.00 0.00 O ATOM 674 ND2 ASN A 46 4.291 -14.867 7.220 1.00 0.00 N ATOM 0 H ASN A 46 4.744 -14.445 2.002 1.00 0.00 H new ATOM 0 HA ASN A 46 5.158 -13.276 3.927 1.00 0.00 H new ATOM 0 HB2 ASN A 46 4.253 -15.507 4.752 1.00 0.00 H new ATOM 0 HB3 ASN A 46 5.912 -15.938 5.117 1.00 0.00 H new ATOM 0 HD21 ASN A 46 4.189 -14.427 8.134 1.00 0.00 H new ATOM 0 HD22 ASN A 46 3.746 -15.698 6.991 1.00 0.00 H new ATOM 681 N TRP A 47 7.618 -12.708 3.658 1.00 0.00 N ATOM 682 CA TRP A 47 8.941 -12.429 3.154 1.00 0.00 C ATOM 683 C TRP A 47 10.100 -13.141 3.822 1.00 0.00 C ATOM 684 O TRP A 47 10.442 -12.902 4.978 1.00 0.00 O ATOM 685 CB TRP A 47 9.219 -10.953 3.150 1.00 0.00 C ATOM 686 CG TRP A 47 8.467 -10.350 2.062 1.00 0.00 C ATOM 687 CD1 TRP A 47 8.739 -10.463 0.751 1.00 0.00 C ATOM 688 CD2 TRP A 47 7.274 -9.642 2.175 1.00 0.00 C ATOM 689 NE1 TRP A 47 7.785 -9.823 0.017 1.00 0.00 N ATOM 690 CE2 TRP A 47 6.865 -9.314 0.885 1.00 0.00 C ATOM 691 CE3 TRP A 47 6.513 -9.244 3.251 1.00 0.00 C ATOM 692 CZ2 TRP A 47 5.715 -8.612 0.656 1.00 0.00 C ATOM 693 CZ3 TRP A 47 5.378 -8.563 3.022 1.00 0.00 C ATOM 694 CH2 TRP A 47 4.979 -8.252 1.734 1.00 0.00 C ATOM 0 H TRP A 47 7.027 -11.882 3.752 1.00 0.00 H new ATOM 0 HA TRP A 47 8.899 -12.839 2.145 1.00 0.00 H new ATOM 0 HB2 TRP A 47 8.930 -10.510 4.103 1.00 0.00 H new ATOM 0 HB3 TRP A 47 10.286 -10.768 3.023 1.00 0.00 H new ATOM 0 HD1 TRP A 47 9.590 -10.985 0.339 1.00 0.00 H new ATOM 0 HE1 TRP A 47 7.763 -9.740 -0.999 1.00 0.00 H new ATOM 0 HE3 TRP A 47 6.823 -9.475 4.260 1.00 0.00 H new ATOM 0 HZ2 TRP A 47 5.405 -8.354 -0.346 1.00 0.00 H new ATOM 0 HZ3 TRP A 47 4.767 -8.253 3.857 1.00 0.00 H new ATOM 0 HH2 TRP A 47 4.058 -7.709 1.585 1.00 0.00 H new ATOM 705 N ASN A 48 10.705 -14.009 3.034 1.00 0.00 N ATOM 706 CA ASN A 48 12.049 -14.511 3.296 1.00 0.00 C ATOM 707 C ASN A 48 13.059 -13.507 2.738 1.00 0.00 C ATOM 708 O ASN A 48 14.158 -13.873 2.316 1.00 0.00 O ATOM 709 CB ASN A 48 12.236 -15.876 2.622 1.00 0.00 C ATOM 710 CG ASN A 48 12.059 -15.827 1.113 1.00 0.00 C ATOM 711 OD1 ASN A 48 12.998 -15.567 0.360 1.00 0.00 O ATOM 712 ND2 ASN A 48 10.846 -16.098 0.658 1.00 0.00 N ATOM 0 H ASN A 48 10.280 -14.390 2.189 1.00 0.00 H new ATOM 0 HA ASN A 48 12.201 -14.632 4.369 1.00 0.00 H new ATOM 0 HB2 ASN A 48 13.232 -16.255 2.853 1.00 0.00 H new ATOM 0 HB3 ASN A 48 11.521 -16.583 3.043 1.00 0.00 H new ATOM 0 HD21 ASN A 48 10.666 -16.096 -0.346 1.00 0.00 H new ATOM 0 HD22 ASN A 48 10.092 -16.309 1.311 1.00 0.00 H new ATOM 719 N ASN A 49 12.670 -12.230 2.773 1.00 0.00 N ATOM 720 CA ASN A 49 13.327 -11.176 2.003 1.00 0.00 C ATOM 721 C ASN A 49 13.240 -11.533 0.526 1.00 0.00 C ATOM 722 O ASN A 49 14.213 -11.462 -0.224 1.00 0.00 O ATOM 723 CB ASN A 49 14.784 -10.959 2.431 1.00 0.00 C ATOM 724 CG ASN A 49 15.352 -9.669 1.862 1.00 0.00 C ATOM 725 OD1 ASN A 49 14.622 -8.696 1.655 1.00 0.00 O ATOM 726 ND2 ASN A 49 16.651 -9.648 1.602 1.00 0.00 N ATOM 0 H ASN A 49 11.888 -11.899 3.338 1.00 0.00 H new ATOM 0 HA ASN A 49 12.814 -10.233 2.193 1.00 0.00 H new ATOM 0 HB2 ASN A 49 14.844 -10.934 3.519 1.00 0.00 H new ATOM 0 HB3 ASN A 49 15.390 -11.801 2.098 1.00 0.00 H new ATOM 0 HD21 ASN A 49 17.080 -8.807 1.217 1.00 0.00 H new ATOM 0 HD22 ASN A 49 17.222 -10.473 1.787 1.00 0.00 H new ATOM 733 N ASN A 50 12.037 -11.930 0.128 1.00 0.00 N ATOM 734 CA ASN A 50 11.785 -12.428 -1.215 1.00 0.00 C ATOM 735 C ASN A 50 11.558 -11.269 -2.186 1.00 0.00 C ATOM 736 O ASN A 50 12.269 -11.137 -3.180 1.00 0.00 O ATOM 737 CB ASN A 50 10.573 -13.358 -1.183 1.00 0.00 C ATOM 738 CG ASN A 50 10.263 -13.974 -2.535 1.00 0.00 C ATOM 739 OD1 ASN A 50 11.153 -14.198 -3.353 1.00 0.00 O ATOM 740 ND2 ASN A 50 8.990 -14.239 -2.776 1.00 0.00 N ATOM 0 H ASN A 50 11.212 -11.915 0.727 1.00 0.00 H new ATOM 0 HA ASN A 50 12.654 -12.985 -1.565 1.00 0.00 H new ATOM 0 HB2 ASN A 50 10.751 -14.154 -0.460 1.00 0.00 H new ATOM 0 HB3 ASN A 50 9.703 -12.801 -0.836 1.00 0.00 H new ATOM 0 HD21 ASN A 50 8.714 -14.646 -3.670 1.00 0.00 H new ATOM 0 HD22 ASN A 50 8.284 -14.037 -2.068 1.00 0.00 H new ATOM 747 N GLY A 51 10.573 -10.431 -1.899 1.00 0.00 N ATOM 748 CA GLY A 51 10.369 -9.238 -2.701 1.00 0.00 C ATOM 749 C GLY A 51 9.361 -9.434 -3.820 1.00 0.00 C ATOM 750 O GLY A 51 9.703 -9.922 -4.898 1.00 0.00 O ATOM 0 H GLY A 51 9.914 -10.553 -1.130 1.00 0.00 H new ATOM 0 HA2 GLY A 51 10.032 -8.427 -2.055 1.00 0.00 H new ATOM 0 HA3 GLY A 51 11.322 -8.929 -3.130 1.00 0.00 H new ATOM 754 N ASN A 52 8.123 -9.038 -3.560 1.00 0.00 N ATOM 755 CA ASN A 52 7.043 -9.151 -4.535 1.00 0.00 C ATOM 756 C ASN A 52 6.246 -7.852 -4.555 1.00 0.00 C ATOM 757 O ASN A 52 5.497 -7.571 -3.622 1.00 0.00 O ATOM 758 CB ASN A 52 6.120 -10.320 -4.173 1.00 0.00 C ATOM 759 CG ASN A 52 6.760 -11.679 -4.386 1.00 0.00 C ATOM 760 OD1 ASN A 52 7.484 -11.897 -5.357 1.00 0.00 O ATOM 761 ND2 ASN A 52 6.523 -12.590 -3.456 1.00 0.00 N ATOM 0 H ASN A 52 7.837 -8.630 -2.670 1.00 0.00 H new ATOM 0 HA ASN A 52 7.469 -9.336 -5.521 1.00 0.00 H new ATOM 0 HB2 ASN A 52 5.820 -10.227 -3.129 1.00 0.00 H new ATOM 0 HB3 ASN A 52 5.212 -10.256 -4.773 1.00 0.00 H new ATOM 0 HD21 ASN A 52 6.947 -13.515 -3.528 1.00 0.00 H new ATOM 0 HD22 ASN A 52 5.916 -12.367 -2.667 1.00 0.00 H new ATOM 768 N ILE A 53 6.410 -7.060 -5.605 1.00 0.00 N ATOM 769 CA ILE A 53 5.827 -5.728 -5.632 1.00 0.00 C ATOM 770 C ILE A 53 4.813 -5.573 -6.759 1.00 0.00 C ATOM 771 O ILE A 53 4.962 -6.145 -7.838 1.00 0.00 O ATOM 772 CB ILE A 53 6.932 -4.638 -5.738 1.00 0.00 C ATOM 773 CG1 ILE A 53 6.353 -3.213 -5.735 1.00 0.00 C ATOM 774 CG2 ILE A 53 7.787 -4.850 -6.976 1.00 0.00 C ATOM 775 CD1 ILE A 53 6.065 -2.646 -7.115 1.00 0.00 C ATOM 0 H ILE A 53 6.936 -7.314 -6.441 1.00 0.00 H new ATOM 0 HA ILE A 53 5.295 -5.592 -4.690 1.00 0.00 H new ATOM 0 HB ILE A 53 7.556 -4.741 -4.851 1.00 0.00 H new ATOM 0 HG12 ILE A 53 5.430 -3.211 -5.156 1.00 0.00 H new ATOM 0 HG13 ILE A 53 7.052 -2.552 -5.223 1.00 0.00 H new ATOM 0 HG21 ILE A 53 8.552 -4.075 -7.027 1.00 0.00 H new ATOM 0 HG22 ILE A 53 8.265 -5.828 -6.925 1.00 0.00 H new ATOM 0 HG23 ILE A 53 7.159 -4.799 -7.865 1.00 0.00 H new ATOM 0 HD11 ILE A 53 5.660 -1.639 -7.017 1.00 0.00 H new ATOM 0 HD12 ILE A 53 6.988 -2.611 -7.694 1.00 0.00 H new ATOM 0 HD13 ILE A 53 5.340 -3.281 -7.625 1.00 0.00 H new ATOM 787 N ILE A 54 3.774 -4.806 -6.472 1.00 0.00 N ATOM 788 CA ILE A 54 2.802 -4.391 -7.466 1.00 0.00 C ATOM 789 C ILE A 54 2.569 -2.882 -7.315 1.00 0.00 C ATOM 790 O ILE A 54 2.142 -2.406 -6.262 1.00 0.00 O ATOM 791 CB ILE A 54 1.468 -5.187 -7.345 1.00 0.00 C ATOM 792 CG1 ILE A 54 0.523 -4.840 -8.496 1.00 0.00 C ATOM 793 CG2 ILE A 54 0.785 -4.961 -6.010 1.00 0.00 C ATOM 794 CD1 ILE A 54 0.965 -5.413 -9.823 1.00 0.00 C ATOM 0 H ILE A 54 3.581 -4.452 -5.535 1.00 0.00 H new ATOM 0 HA ILE A 54 3.192 -4.607 -8.461 1.00 0.00 H new ATOM 0 HB ILE A 54 1.721 -6.245 -7.405 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -0.475 -5.210 -8.262 1.00 0.00 H new ATOM 0 HG13 ILE A 54 0.449 -3.756 -8.582 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -0.140 -5.536 -5.973 1.00 0.00 H new ATOM 0 HG22 ILE A 54 1.445 -5.283 -5.204 1.00 0.00 H new ATOM 0 HG23 ILE A 54 0.558 -3.901 -5.892 1.00 0.00 H new ATOM 0 HD11 ILE A 54 0.252 -5.130 -10.597 1.00 0.00 H new ATOM 0 HD12 ILE A 54 1.950 -5.023 -10.078 1.00 0.00 H new ATOM 0 HD13 ILE A 54 1.012 -6.500 -9.753 1.00 0.00 H new ATOM 806 N ALA A 55 2.919 -2.122 -8.340 1.00 0.00 N ATOM 807 CA ALA A 55 2.859 -0.669 -8.252 1.00 0.00 C ATOM 808 C ALA A 55 1.420 -0.168 -8.288 1.00 0.00 C ATOM 809 O ALA A 55 0.598 -0.659 -9.065 1.00 0.00 O ATOM 810 CB ALA A 55 3.672 -0.026 -9.365 1.00 0.00 C ATOM 0 H ALA A 55 3.245 -2.482 -9.237 1.00 0.00 H new ATOM 0 HA ALA A 55 3.292 -0.380 -7.294 1.00 0.00 H new ATOM 0 HB1 ALA A 55 3.612 1.059 -9.279 1.00 0.00 H new ATOM 0 HB2 ALA A 55 4.713 -0.340 -9.283 1.00 0.00 H new ATOM 0 HB3 ALA A 55 3.274 -0.336 -10.332 1.00 0.00 H new ATOM 816 N ALA A 56 1.131 0.807 -7.438 1.00 0.00 N ATOM 817 CA ALA A 56 -0.194 1.407 -7.371 1.00 0.00 C ATOM 818 C ALA A 56 -0.373 2.431 -8.481 1.00 0.00 C ATOM 819 O ALA A 56 0.601 2.891 -9.079 1.00 0.00 O ATOM 820 CB ALA A 56 -0.401 2.064 -6.016 1.00 0.00 C ATOM 0 H ALA A 56 1.803 1.202 -6.780 1.00 0.00 H new ATOM 0 HA ALA A 56 -0.938 0.621 -7.502 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -1.395 2.510 -5.976 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -0.307 1.314 -5.230 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.351 2.839 -5.869 1.00 0.00 H new ATOM 826 N SER A 57 -1.617 2.794 -8.744 1.00 0.00 N ATOM 827 CA SER A 57 -1.929 3.743 -9.788 1.00 0.00 C ATOM 828 C SER A 57 -2.663 4.928 -9.182 1.00 0.00 C ATOM 829 O SER A 57 -3.473 4.770 -8.264 1.00 0.00 O ATOM 830 CB SER A 57 -2.781 3.064 -10.861 1.00 0.00 C ATOM 831 OG SER A 57 -2.197 1.829 -11.253 1.00 0.00 O ATOM 0 H SER A 57 -2.431 2.440 -8.241 1.00 0.00 H new ATOM 0 HA SER A 57 -1.011 4.101 -10.255 1.00 0.00 H new ATOM 0 HB2 SER A 57 -3.788 2.892 -10.480 1.00 0.00 H new ATOM 0 HB3 SER A 57 -2.876 3.719 -11.727 1.00 0.00 H new ATOM 0 HG SER A 57 -2.755 1.406 -11.939 1.00 0.00 H new ATOM 837 N PHE A 58 -2.358 6.111 -9.671 1.00 0.00 N ATOM 838 CA PHE A 58 -2.960 7.319 -9.155 1.00 0.00 C ATOM 839 C PHE A 58 -4.424 7.393 -9.555 1.00 0.00 C ATOM 840 O PHE A 58 -4.795 7.041 -10.676 1.00 0.00 O ATOM 841 CB PHE A 58 -2.254 8.573 -9.668 1.00 0.00 C ATOM 842 CG PHE A 58 -0.763 8.607 -9.455 1.00 0.00 C ATOM 843 CD1 PHE A 58 0.086 7.850 -10.248 1.00 0.00 C ATOM 844 CD2 PHE A 58 -0.215 9.412 -8.472 1.00 0.00 C ATOM 845 CE1 PHE A 58 1.454 7.893 -10.058 1.00 0.00 C ATOM 846 CE2 PHE A 58 1.153 9.460 -8.281 1.00 0.00 C ATOM 847 CZ PHE A 58 1.989 8.700 -9.073 1.00 0.00 C ATOM 0 H PHE A 58 -1.693 6.261 -10.430 1.00 0.00 H new ATOM 0 HA PHE A 58 -2.864 7.281 -8.070 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.454 8.671 -10.735 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -2.694 9.443 -9.180 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -0.326 7.220 -11.022 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -0.863 10.009 -7.847 1.00 0.00 H new ATOM 0 HE1 PHE A 58 2.105 7.296 -10.680 1.00 0.00 H new ATOM 0 HE2 PHE A 58 1.568 10.093 -7.511 1.00 0.00 H new ATOM 0 HZ PHE A 58 3.058 8.736 -8.923 1.00 0.00 H new ATOM 857 N SER A 59 -5.244 7.843 -8.631 1.00 0.00 N ATOM 858 CA SER A 59 -6.658 8.050 -8.891 1.00 0.00 C ATOM 859 C SER A 59 -6.932 9.547 -8.935 1.00 0.00 C ATOM 860 O SER A 59 -7.709 10.030 -9.759 1.00 0.00 O ATOM 861 CB SER A 59 -7.513 7.369 -7.815 1.00 0.00 C ATOM 862 OG SER A 59 -8.897 7.497 -8.098 1.00 0.00 O ATOM 0 H SER A 59 -4.955 8.076 -7.681 1.00 0.00 H new ATOM 0 HA SER A 59 -6.924 7.604 -9.849 1.00 0.00 H new ATOM 0 HB2 SER A 59 -7.249 6.313 -7.752 1.00 0.00 H new ATOM 0 HB3 SER A 59 -7.296 7.810 -6.842 1.00 0.00 H new ATOM 0 HG SER A 59 -9.417 7.052 -7.396 1.00 0.00 H new ATOM 868 N GLY A 60 -6.276 10.277 -8.044 1.00 0.00 N ATOM 869 CA GLY A 60 -6.342 11.722 -8.069 1.00 0.00 C ATOM 870 C GLY A 60 -6.034 12.315 -6.714 1.00 0.00 C ATOM 871 O GLY A 60 -6.208 11.649 -5.698 1.00 0.00 O ATOM 0 H GLY A 60 -5.696 9.890 -7.300 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -5.635 12.107 -8.805 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -7.336 12.036 -8.387 1.00 0.00 H new ATOM 875 N PRO A 61 -5.556 13.562 -6.661 1.00 0.00 N ATOM 876 CA PRO A 61 -5.295 14.243 -5.394 1.00 0.00 C ATOM 877 C PRO A 61 -6.583 14.464 -4.603 1.00 0.00 C ATOM 878 O PRO A 61 -7.608 14.853 -5.169 1.00 0.00 O ATOM 879 CB PRO A 61 -4.688 15.589 -5.813 1.00 0.00 C ATOM 880 CG PRO A 61 -4.271 15.408 -7.234 1.00 0.00 C ATOM 881 CD PRO A 61 -5.220 14.403 -7.817 1.00 0.00 C ATOM 0 HA PRO A 61 -4.641 13.662 -4.744 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -5.415 16.395 -5.716 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -3.837 15.850 -5.184 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -4.319 16.351 -7.778 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -3.242 15.055 -7.297 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -6.104 14.880 -8.240 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -4.756 13.825 -8.616 1.00 0.00 H new ATOM 889 N ILE A 62 -6.535 14.203 -3.306 1.00 0.00 N ATOM 890 CA ILE A 62 -7.690 14.400 -2.445 1.00 0.00 C ATOM 891 C ILE A 62 -7.797 15.878 -2.080 1.00 0.00 C ATOM 892 O ILE A 62 -7.188 16.340 -1.112 1.00 0.00 O ATOM 893 CB ILE A 62 -7.595 13.529 -1.168 1.00 0.00 C ATOM 894 CG1 ILE A 62 -7.414 12.057 -1.556 1.00 0.00 C ATOM 895 CG2 ILE A 62 -8.844 13.691 -0.313 1.00 0.00 C ATOM 896 CD1 ILE A 62 -7.131 11.141 -0.386 1.00 0.00 C ATOM 0 H ILE A 62 -5.706 13.853 -2.826 1.00 0.00 H new ATOM 0 HA ILE A 62 -8.586 14.091 -2.983 1.00 0.00 H new ATOM 0 HB ILE A 62 -6.734 13.858 -0.586 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -8.315 11.713 -2.064 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -6.595 11.979 -2.271 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -8.757 13.071 0.579 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -8.951 14.735 -0.020 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -9.719 13.383 -0.885 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -7.016 10.118 -0.744 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -6.213 11.457 0.110 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -7.960 11.187 0.321 1.00 0.00 H new ATOM 908 N SER A 63 -8.557 16.610 -2.887 1.00 0.00 N ATOM 909 CA SER A 63 -8.640 18.057 -2.775 1.00 0.00 C ATOM 910 C SER A 63 -9.173 18.486 -1.412 1.00 0.00 C ATOM 911 O SER A 63 -10.279 18.116 -1.010 1.00 0.00 O ATOM 912 CB SER A 63 -9.507 18.616 -3.902 1.00 0.00 C ATOM 913 OG SER A 63 -10.788 17.998 -3.935 1.00 0.00 O ATOM 0 H SER A 63 -9.130 16.217 -3.634 1.00 0.00 H new ATOM 0 HA SER A 63 -7.633 18.465 -2.868 1.00 0.00 H new ATOM 0 HB2 SER A 63 -9.625 19.692 -3.771 1.00 0.00 H new ATOM 0 HB3 SER A 63 -9.005 18.464 -4.857 1.00 0.00 H new ATOM 0 HG SER A 63 -11.099 17.841 -3.019 1.00 0.00 H new ATOM 919 N GLY A 64 -8.367 19.261 -0.706 1.00 0.00 N ATOM 920 CA GLY A 64 -8.738 19.715 0.614 1.00 0.00 C ATOM 921 C GLY A 64 -7.613 19.523 1.602 1.00 0.00 C ATOM 922 O GLY A 64 -7.422 20.332 2.508 1.00 0.00 O ATOM 0 H GLY A 64 -7.455 19.586 -1.028 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -9.012 20.769 0.574 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -9.619 19.170 0.953 1.00 0.00 H new ATOM 926 N SER A 65 -6.859 18.454 1.415 1.00 0.00 N ATOM 927 CA SER A 65 -5.729 18.147 2.275 1.00 0.00 C ATOM 928 C SER A 65 -4.531 17.743 1.428 1.00 0.00 C ATOM 929 O SER A 65 -4.650 17.579 0.213 1.00 0.00 O ATOM 930 CB SER A 65 -6.101 17.015 3.235 1.00 0.00 C ATOM 931 OG SER A 65 -7.245 17.354 4.002 1.00 0.00 O ATOM 0 H SER A 65 -7.011 17.777 0.667 1.00 0.00 H new ATOM 0 HA SER A 65 -5.469 19.032 2.856 1.00 0.00 H new ATOM 0 HB2 SER A 65 -6.295 16.103 2.670 1.00 0.00 H new ATOM 0 HB3 SER A 65 -5.262 16.806 3.899 1.00 0.00 H new ATOM 0 HG SER A 65 -7.464 16.615 4.607 1.00 0.00 H new ATOM 937 N ASN A 66 -3.381 17.581 2.065 1.00 0.00 N ATOM 938 CA ASN A 66 -2.166 17.179 1.358 1.00 0.00 C ATOM 939 C ASN A 66 -2.145 15.676 1.121 1.00 0.00 C ATOM 940 O ASN A 66 -1.100 15.034 1.221 1.00 0.00 O ATOM 941 CB ASN A 66 -0.920 17.596 2.139 1.00 0.00 C ATOM 942 CG ASN A 66 -0.228 18.794 1.526 1.00 0.00 C ATOM 943 OD1 ASN A 66 -0.521 19.940 1.872 1.00 0.00 O ATOM 944 ND2 ASN A 66 0.691 18.542 0.607 1.00 0.00 N ATOM 0 H ASN A 66 -3.260 17.720 3.068 1.00 0.00 H new ATOM 0 HA ASN A 66 -2.164 17.685 0.393 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -1.200 17.828 3.167 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -0.223 16.759 2.180 1.00 0.00 H new ATOM 0 HD21 ASN A 66 1.186 19.312 0.157 1.00 0.00 H new ATOM 0 HD22 ASN A 66 0.904 17.578 0.349 1.00 0.00 H new ATOM 951 N TYR A 67 -3.299 15.118 0.796 1.00 0.00 N ATOM 952 CA TYR A 67 -3.404 13.694 0.561 1.00 0.00 C ATOM 953 C TYR A 67 -3.772 13.399 -0.872 1.00 0.00 C ATOM 954 O TYR A 67 -4.294 14.247 -1.593 1.00 0.00 O ATOM 955 CB TYR A 67 -4.406 13.040 1.512 1.00 0.00 C ATOM 956 CG TYR A 67 -3.750 12.441 2.731 1.00 0.00 C ATOM 957 CD1 TYR A 67 -3.129 13.249 3.657 1.00 0.00 C ATOM 958 CD2 TYR A 67 -3.749 11.074 2.947 1.00 0.00 C ATOM 959 CE1 TYR A 67 -2.515 12.722 4.777 1.00 0.00 C ATOM 960 CE2 TYR A 67 -3.140 10.527 4.062 1.00 0.00 C ATOM 961 CZ TYR A 67 -2.525 11.355 4.976 1.00 0.00 C ATOM 962 OH TYR A 67 -1.910 10.815 6.080 1.00 0.00 O ATOM 0 H TYR A 67 -4.174 15.632 0.690 1.00 0.00 H new ATOM 0 HA TYR A 67 -2.421 13.265 0.757 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -5.139 13.783 1.827 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -4.951 12.261 0.979 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -3.122 14.318 3.505 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -4.232 10.423 2.233 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -2.032 13.373 5.490 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -3.146 9.458 4.215 1.00 0.00 H new ATOM 0 HH TYR A 67 -1.171 10.239 5.794 1.00 0.00 H new ATOM 972 N GLU A 68 -3.476 12.188 -1.271 1.00 0.00 N ATOM 973 CA GLU A 68 -3.732 11.737 -2.625 1.00 0.00 C ATOM 974 C GLU A 68 -4.449 10.390 -2.576 1.00 0.00 C ATOM 975 O GLU A 68 -4.528 9.767 -1.514 1.00 0.00 O ATOM 976 CB GLU A 68 -2.413 11.667 -3.402 1.00 0.00 C ATOM 977 CG GLU A 68 -2.581 11.566 -4.908 1.00 0.00 C ATOM 978 CD GLU A 68 -1.409 12.165 -5.656 1.00 0.00 C ATOM 979 OE1 GLU A 68 -0.429 11.442 -5.902 1.00 0.00 O ATOM 980 OE2 GLU A 68 -1.474 13.369 -5.986 1.00 0.00 O ATOM 0 H GLU A 68 -3.050 11.483 -0.670 1.00 0.00 H new ATOM 0 HA GLU A 68 -4.379 12.441 -3.148 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -1.822 12.554 -3.172 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -1.844 10.805 -3.053 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -2.693 10.519 -5.190 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -3.498 12.076 -5.205 1.00 0.00 H new ATOM 987 N TYR A 69 -4.931 9.929 -3.716 1.00 0.00 N ATOM 988 CA TYR A 69 -5.883 8.835 -3.762 1.00 0.00 C ATOM 989 C TYR A 69 -5.396 7.837 -4.776 1.00 0.00 C ATOM 990 O TYR A 69 -5.156 8.178 -5.935 1.00 0.00 O ATOM 991 CB TYR A 69 -7.275 9.351 -4.142 1.00 0.00 C ATOM 992 CG TYR A 69 -8.418 8.627 -3.464 1.00 0.00 C ATOM 993 CD1 TYR A 69 -8.267 8.084 -2.195 1.00 0.00 C ATOM 994 CD2 TYR A 69 -9.662 8.525 -4.076 1.00 0.00 C ATOM 995 CE1 TYR A 69 -9.318 7.457 -1.557 1.00 0.00 C ATOM 996 CE2 TYR A 69 -10.718 7.892 -3.446 1.00 0.00 C ATOM 997 CZ TYR A 69 -10.540 7.360 -2.186 1.00 0.00 C ATOM 998 OH TYR A 69 -11.593 6.741 -1.546 1.00 0.00 O ATOM 0 H TYR A 69 -4.675 10.300 -4.631 1.00 0.00 H new ATOM 0 HA TYR A 69 -5.962 8.365 -2.782 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -7.336 10.411 -3.896 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -7.398 9.267 -5.222 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -7.310 8.154 -1.699 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -9.806 8.947 -5.060 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -9.183 7.044 -0.568 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -11.676 7.815 -3.938 1.00 0.00 H new ATOM 0 HH TYR A 69 -12.383 6.758 -2.125 1.00 0.00 H new ATOM 1008 N TRP A 70 -5.210 6.620 -4.332 1.00 0.00 N ATOM 1009 CA TRP A 70 -4.535 5.631 -5.124 1.00 0.00 C ATOM 1010 C TRP A 70 -5.439 4.440 -5.335 1.00 0.00 C ATOM 1011 O TRP A 70 -6.078 3.992 -4.402 1.00 0.00 O ATOM 1012 CB TRP A 70 -3.269 5.231 -4.383 1.00 0.00 C ATOM 1013 CG TRP A 70 -2.454 6.420 -3.954 1.00 0.00 C ATOM 1014 CD1 TRP A 70 -2.718 7.292 -2.958 1.00 0.00 C ATOM 1015 CD2 TRP A 70 -1.241 6.854 -4.520 1.00 0.00 C ATOM 1016 NE1 TRP A 70 -1.731 8.240 -2.903 1.00 0.00 N ATOM 1017 CE2 TRP A 70 -0.811 7.983 -3.842 1.00 0.00 C ATOM 1018 CE3 TRP A 70 -0.500 6.378 -5.527 1.00 0.00 C ATOM 1019 CZ2 TRP A 70 0.362 8.650 -4.161 1.00 0.00 C ATOM 1020 CZ3 TRP A 70 0.674 7.001 -5.871 1.00 0.00 C ATOM 1021 CH2 TRP A 70 1.103 8.140 -5.178 1.00 0.00 C ATOM 0 H TRP A 70 -5.521 6.291 -3.418 1.00 0.00 H new ATOM 0 HA TRP A 70 -4.277 6.027 -6.106 1.00 0.00 H new ATOM 0 HB2 TRP A 70 -3.536 4.642 -3.506 1.00 0.00 H new ATOM 0 HB3 TRP A 70 -2.663 4.591 -5.024 1.00 0.00 H new ATOM 0 HD1 TRP A 70 -3.577 7.249 -2.304 1.00 0.00 H new ATOM 0 HE1 TRP A 70 -1.701 9.021 -2.248 1.00 0.00 H new ATOM 0 HE3 TRP A 70 -0.826 5.503 -6.070 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 0.672 9.535 -3.625 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 1.271 6.610 -6.682 1.00 0.00 H new ATOM 0 HH2 TRP A 70 2.032 8.617 -5.455 1.00 0.00 H new ATOM 1032 N THR A 71 -5.508 3.945 -6.553 1.00 0.00 N ATOM 1033 CA THR A 71 -6.366 2.814 -6.868 1.00 0.00 C ATOM 1034 C THR A 71 -5.647 1.852 -7.789 1.00 0.00 C ATOM 1035 O THR A 71 -4.780 2.274 -8.558 1.00 0.00 O ATOM 1036 CB THR A 71 -7.671 3.273 -7.554 1.00 0.00 C ATOM 1037 OG1 THR A 71 -7.380 4.203 -8.609 1.00 0.00 O ATOM 1038 CG2 THR A 71 -8.620 3.918 -6.560 1.00 0.00 C ATOM 0 H THR A 71 -4.979 4.307 -7.346 1.00 0.00 H new ATOM 0 HA THR A 71 -6.613 2.320 -5.928 1.00 0.00 H new ATOM 0 HB THR A 71 -8.153 2.388 -7.970 1.00 0.00 H new ATOM 0 HG1 THR A 71 -8.185 4.720 -8.821 1.00 0.00 H new ATOM 0 HG21 THR A 71 -9.529 4.230 -7.075 1.00 0.00 H new ATOM 0 HG22 THR A 71 -8.873 3.200 -5.780 1.00 0.00 H new ATOM 0 HG23 THR A 71 -8.141 4.788 -6.111 1.00 0.00 H new ATOM 1046 N PHE A 72 -5.976 0.566 -7.709 1.00 0.00 N ATOM 1047 CA PHE A 72 -5.448 -0.386 -8.667 1.00 0.00 C ATOM 1048 C PHE A 72 -6.071 -1.764 -8.501 1.00 0.00 C ATOM 1049 O PHE A 72 -6.696 -2.069 -7.483 1.00 0.00 O ATOM 1050 CB PHE A 72 -3.916 -0.494 -8.563 1.00 0.00 C ATOM 1051 CG PHE A 72 -3.432 -1.349 -7.422 1.00 0.00 C ATOM 1052 CD1 PHE A 72 -3.587 -0.944 -6.106 1.00 0.00 C ATOM 1053 CD2 PHE A 72 -2.816 -2.564 -7.677 1.00 0.00 C ATOM 1054 CE1 PHE A 72 -3.140 -1.736 -5.068 1.00 0.00 C ATOM 1055 CE2 PHE A 72 -2.367 -3.358 -6.642 1.00 0.00 C ATOM 1056 CZ PHE A 72 -2.529 -2.944 -5.338 1.00 0.00 C ATOM 0 H PHE A 72 -6.595 0.169 -7.002 1.00 0.00 H new ATOM 0 HA PHE A 72 -5.710 -0.009 -9.656 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -3.528 -0.901 -9.497 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -3.499 0.507 -8.454 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -4.063 0.001 -5.890 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -2.686 -2.893 -8.697 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -3.268 -1.411 -4.046 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -1.889 -4.303 -6.854 1.00 0.00 H new ATOM 0 HZ PHE A 72 -2.178 -3.565 -4.527 1.00 0.00 H new ATOM 1066 N SER A 73 -5.894 -2.581 -9.522 1.00 0.00 N ATOM 1067 CA SER A 73 -6.296 -3.971 -9.483 1.00 0.00 C ATOM 1068 C SER A 73 -5.097 -4.850 -9.809 1.00 0.00 C ATOM 1069 O SER A 73 -4.254 -4.481 -10.628 1.00 0.00 O ATOM 1070 CB SER A 73 -7.442 -4.220 -10.463 1.00 0.00 C ATOM 1071 OG SER A 73 -7.195 -3.600 -11.717 1.00 0.00 O ATOM 0 H SER A 73 -5.466 -2.297 -10.403 1.00 0.00 H new ATOM 0 HA SER A 73 -6.653 -4.220 -8.484 1.00 0.00 H new ATOM 0 HB2 SER A 73 -7.575 -5.293 -10.605 1.00 0.00 H new ATOM 0 HB3 SER A 73 -8.372 -3.837 -10.043 1.00 0.00 H new ATOM 0 HG SER A 73 -7.944 -3.778 -12.323 1.00 0.00 H new ATOM 1077 N ALA A 74 -5.017 -6.001 -9.165 1.00 0.00 N ATOM 1078 CA ALA A 74 -3.862 -6.872 -9.305 1.00 0.00 C ATOM 1079 C ALA A 74 -4.274 -8.331 -9.435 1.00 0.00 C ATOM 1080 O ALA A 74 -5.011 -8.851 -8.597 1.00 0.00 O ATOM 1081 CB ALA A 74 -2.935 -6.710 -8.108 1.00 0.00 C ATOM 0 H ALA A 74 -5.740 -6.355 -8.538 1.00 0.00 H new ATOM 0 HA ALA A 74 -3.340 -6.582 -10.217 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -2.073 -7.367 -8.224 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -2.597 -5.676 -8.047 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -3.470 -6.971 -7.195 1.00 0.00 H new ATOM 1087 N SER A 75 -3.806 -8.998 -10.475 1.00 0.00 N ATOM 1088 CA SER A 75 -3.989 -10.430 -10.566 1.00 0.00 C ATOM 1089 C SER A 75 -2.910 -11.103 -9.734 1.00 0.00 C ATOM 1090 O SER A 75 -1.763 -11.238 -10.165 1.00 0.00 O ATOM 1091 CB SER A 75 -3.927 -10.908 -12.020 1.00 0.00 C ATOM 1092 OG SER A 75 -4.178 -12.305 -12.111 1.00 0.00 O ATOM 0 H SER A 75 -3.304 -8.576 -11.256 1.00 0.00 H new ATOM 0 HA SER A 75 -4.975 -10.694 -10.185 1.00 0.00 H new ATOM 0 HB2 SER A 75 -4.660 -10.364 -12.616 1.00 0.00 H new ATOM 0 HB3 SER A 75 -2.946 -10.684 -12.438 1.00 0.00 H new ATOM 0 HG SER A 75 -4.277 -12.559 -13.052 1.00 0.00 H new ATOM 1098 N VAL A 76 -3.275 -11.502 -8.530 1.00 0.00 N ATOM 1099 CA VAL A 76 -2.321 -12.095 -7.613 1.00 0.00 C ATOM 1100 C VAL A 76 -2.327 -13.606 -7.767 1.00 0.00 C ATOM 1101 O VAL A 76 -3.318 -14.188 -8.206 1.00 0.00 O ATOM 1102 CB VAL A 76 -2.610 -11.696 -6.146 1.00 0.00 C ATOM 1103 CG1 VAL A 76 -2.613 -10.188 -6.009 1.00 0.00 C ATOM 1104 CG2 VAL A 76 -3.932 -12.257 -5.669 1.00 0.00 C ATOM 0 H VAL A 76 -4.224 -11.426 -8.165 1.00 0.00 H new ATOM 0 HA VAL A 76 -1.331 -11.712 -7.863 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.820 -12.117 -5.524 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -2.817 -9.917 -4.973 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.640 -9.794 -6.302 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -3.384 -9.766 -6.653 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -4.103 -11.957 -4.635 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -4.737 -11.874 -6.296 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -3.910 -13.345 -5.732 1.00 0.00 H new ATOM 1114 N LYS A 77 -1.219 -14.236 -7.430 1.00 0.00 N ATOM 1115 CA LYS A 77 -1.075 -15.666 -7.629 1.00 0.00 C ATOM 1116 C LYS A 77 -0.900 -16.337 -6.280 1.00 0.00 C ATOM 1117 O LYS A 77 0.005 -17.146 -6.079 1.00 0.00 O ATOM 1118 CB LYS A 77 0.123 -15.967 -8.539 1.00 0.00 C ATOM 1119 CG LYS A 77 0.148 -15.150 -9.827 1.00 0.00 C ATOM 1120 CD LYS A 77 -1.158 -15.267 -10.602 1.00 0.00 C ATOM 1121 CE LYS A 77 -1.093 -14.500 -11.914 1.00 0.00 C ATOM 1122 NZ LYS A 77 -2.414 -14.447 -12.598 1.00 0.00 N ATOM 0 H LYS A 77 -0.405 -13.781 -7.017 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.969 -16.055 -8.115 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.043 -15.780 -7.985 1.00 0.00 H new ATOM 0 HB3 LYS A 77 0.115 -17.027 -8.794 1.00 0.00 H new ATOM 0 HG2 LYS A 77 0.336 -14.103 -9.589 1.00 0.00 H new ATOM 0 HG3 LYS A 77 0.973 -15.487 -10.454 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -1.372 -16.317 -10.802 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -1.979 -14.885 -9.995 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -0.743 -13.485 -11.723 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -0.363 -14.970 -12.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -2.270 -14.383 -13.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -2.954 -15.308 -12.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -2.942 -13.613 -12.270 1.00 0.00 H new ATOM 1136 N GLY A 78 -1.772 -15.973 -5.357 1.00 0.00 N ATOM 1137 CA GLY A 78 -1.662 -16.445 -3.995 1.00 0.00 C ATOM 1138 C GLY A 78 -0.900 -15.458 -3.144 1.00 0.00 C ATOM 1139 O GLY A 78 0.212 -15.071 -3.491 1.00 0.00 O ATOM 0 H GLY A 78 -2.563 -15.352 -5.529 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -2.657 -16.599 -3.578 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.157 -17.411 -3.980 1.00 0.00 H new ATOM 1143 N ILE A 79 -1.486 -15.040 -2.035 1.00 0.00 N ATOM 1144 CA ILE A 79 -0.868 -14.031 -1.184 1.00 0.00 C ATOM 1145 C ILE A 79 -0.980 -14.413 0.287 1.00 0.00 C ATOM 1146 O ILE A 79 -2.053 -14.753 0.785 1.00 0.00 O ATOM 1147 CB ILE A 79 -1.480 -12.639 -1.463 1.00 0.00 C ATOM 1148 CG1 ILE A 79 -1.070 -11.587 -0.424 1.00 0.00 C ATOM 1149 CG2 ILE A 79 -2.993 -12.725 -1.577 1.00 0.00 C ATOM 1150 CD1 ILE A 79 -1.598 -10.198 -0.740 1.00 0.00 C ATOM 0 H ILE A 79 -2.387 -15.381 -1.701 1.00 0.00 H new ATOM 0 HA ILE A 79 0.194 -13.980 -1.423 1.00 0.00 H new ATOM 0 HB ILE A 79 -1.074 -12.308 -2.419 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -1.434 -11.893 0.557 1.00 0.00 H new ATOM 0 HG13 ILE A 79 0.018 -11.550 -0.363 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.400 -11.733 -1.773 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -3.259 -13.395 -2.395 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -3.407 -13.109 -0.645 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -1.273 -9.501 0.032 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -1.213 -9.874 -1.707 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -2.687 -10.222 -0.773 1.00 0.00 H new ATOM 1162 N LYS A 80 0.165 -14.383 0.954 1.00 0.00 N ATOM 1163 CA LYS A 80 0.278 -14.800 2.347 1.00 0.00 C ATOM 1164 C LYS A 80 -0.117 -13.636 3.245 1.00 0.00 C ATOM 1165 O LYS A 80 -1.072 -13.708 4.020 1.00 0.00 O ATOM 1166 CB LYS A 80 1.731 -15.228 2.702 1.00 0.00 C ATOM 1167 CG LYS A 80 1.834 -16.476 3.570 1.00 0.00 C ATOM 1168 CD LYS A 80 1.097 -16.332 4.898 1.00 0.00 C ATOM 1169 CE LYS A 80 -0.351 -16.794 4.803 1.00 0.00 C ATOM 1170 NZ LYS A 80 -1.120 -16.460 6.032 1.00 0.00 N ATOM 0 H LYS A 80 1.045 -14.068 0.545 1.00 0.00 H new ATOM 0 HA LYS A 80 -0.380 -15.655 2.498 1.00 0.00 H new ATOM 0 HB2 LYS A 80 2.281 -15.399 1.777 1.00 0.00 H new ATOM 0 HB3 LYS A 80 2.223 -14.403 3.217 1.00 0.00 H new ATOM 0 HG2 LYS A 80 1.428 -17.328 3.024 1.00 0.00 H new ATOM 0 HG3 LYS A 80 2.884 -16.693 3.764 1.00 0.00 H new ATOM 0 HD2 LYS A 80 1.613 -16.912 5.663 1.00 0.00 H new ATOM 0 HD3 LYS A 80 1.124 -15.290 5.216 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -0.825 -16.327 3.940 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -0.379 -17.871 4.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -2.101 -16.791 5.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -0.682 -16.926 6.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -1.115 -15.430 6.175 1.00 0.00 H new ATOM 1184 N GLU A 81 0.654 -12.571 3.119 1.00 0.00 N ATOM 1185 CA GLU A 81 0.493 -11.355 3.920 1.00 0.00 C ATOM 1186 C GLU A 81 0.976 -10.183 3.093 1.00 0.00 C ATOM 1187 O GLU A 81 1.478 -10.397 1.991 1.00 0.00 O ATOM 1188 CB GLU A 81 1.323 -11.421 5.206 1.00 0.00 C ATOM 1189 CG GLU A 81 1.334 -12.784 5.861 1.00 0.00 C ATOM 1190 CD GLU A 81 1.899 -12.763 7.265 1.00 0.00 C ATOM 1191 OE1 GLU A 81 2.820 -11.965 7.533 1.00 0.00 O ATOM 1192 OE2 GLU A 81 1.414 -13.543 8.113 1.00 0.00 O ATOM 0 H GLU A 81 1.422 -12.518 2.450 1.00 0.00 H new ATOM 0 HA GLU A 81 -0.556 -11.248 4.194 1.00 0.00 H new ATOM 0 HB2 GLU A 81 2.349 -11.130 4.980 1.00 0.00 H new ATOM 0 HB3 GLU A 81 0.933 -10.691 5.916 1.00 0.00 H new ATOM 0 HG2 GLU A 81 0.317 -13.174 5.891 1.00 0.00 H new ATOM 0 HG3 GLU A 81 1.921 -13.470 5.250 1.00 0.00 H new ATOM 1199 N PHE A 82 0.852 -8.954 3.593 1.00 0.00 N ATOM 1200 CA PHE A 82 1.425 -7.829 2.862 1.00 0.00 C ATOM 1201 C PHE A 82 1.437 -6.536 3.655 1.00 0.00 C ATOM 1202 O PHE A 82 0.897 -6.453 4.762 1.00 0.00 O ATOM 1203 CB PHE A 82 0.704 -7.606 1.524 1.00 0.00 C ATOM 1204 CG PHE A 82 -0.665 -6.997 1.625 1.00 0.00 C ATOM 1205 CD1 PHE A 82 -1.775 -7.784 1.873 1.00 0.00 C ATOM 1206 CD2 PHE A 82 -0.841 -5.633 1.448 1.00 0.00 C ATOM 1207 CE1 PHE A 82 -3.033 -7.223 1.948 1.00 0.00 C ATOM 1208 CE2 PHE A 82 -2.096 -5.068 1.519 1.00 0.00 C ATOM 1209 CZ PHE A 82 -3.193 -5.863 1.771 1.00 0.00 C ATOM 0 H PHE A 82 0.380 -8.718 4.466 1.00 0.00 H new ATOM 0 HA PHE A 82 2.463 -8.104 2.676 1.00 0.00 H new ATOM 0 HB2 PHE A 82 1.324 -6.963 0.899 1.00 0.00 H new ATOM 0 HB3 PHE A 82 0.620 -8.564 1.011 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -1.656 -8.849 2.009 1.00 0.00 H new ATOM 0 HD2 PHE A 82 0.016 -5.006 1.252 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -3.892 -7.847 2.145 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -2.219 -4.004 1.377 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.177 -5.423 1.830 1.00 0.00 H new ATOM 1219 N TYR A 83 2.079 -5.540 3.053 1.00 0.00 N ATOM 1220 CA TYR A 83 2.102 -4.178 3.551 1.00 0.00 C ATOM 1221 C TYR A 83 2.465 -3.236 2.409 1.00 0.00 C ATOM 1222 O TYR A 83 3.098 -3.646 1.437 1.00 0.00 O ATOM 1223 CB TYR A 83 3.073 -4.012 4.736 1.00 0.00 C ATOM 1224 CG TYR A 83 4.444 -4.664 4.586 1.00 0.00 C ATOM 1225 CD1 TYR A 83 5.233 -4.478 3.456 1.00 0.00 C ATOM 1226 CD2 TYR A 83 4.957 -5.449 5.612 1.00 0.00 C ATOM 1227 CE1 TYR A 83 6.488 -5.060 3.356 1.00 0.00 C ATOM 1228 CE2 TYR A 83 6.206 -6.033 5.515 1.00 0.00 C ATOM 1229 CZ TYR A 83 6.967 -5.835 4.387 1.00 0.00 C ATOM 1230 OH TYR A 83 8.217 -6.410 4.290 1.00 0.00 O ATOM 0 H TYR A 83 2.607 -5.664 2.189 1.00 0.00 H new ATOM 0 HA TYR A 83 1.110 -3.930 3.928 1.00 0.00 H new ATOM 0 HB2 TYR A 83 3.219 -2.946 4.911 1.00 0.00 H new ATOM 0 HB3 TYR A 83 2.597 -4.419 5.628 1.00 0.00 H new ATOM 0 HD1 TYR A 83 4.863 -3.871 2.643 1.00 0.00 H new ATOM 0 HD2 TYR A 83 4.368 -5.606 6.503 1.00 0.00 H new ATOM 0 HE1 TYR A 83 7.088 -4.905 2.471 1.00 0.00 H new ATOM 0 HE2 TYR A 83 6.583 -6.643 6.323 1.00 0.00 H new ATOM 0 HH TYR A 83 8.128 -7.337 3.985 1.00 0.00 H new ATOM 1240 N ILE A 84 2.043 -1.990 2.501 1.00 0.00 N ATOM 1241 CA ILE A 84 2.347 -1.021 1.461 1.00 0.00 C ATOM 1242 C ILE A 84 3.530 -0.173 1.899 1.00 0.00 C ATOM 1243 O ILE A 84 3.748 0.007 3.095 1.00 0.00 O ATOM 1244 CB ILE A 84 1.143 -0.097 1.161 1.00 0.00 C ATOM 1245 CG1 ILE A 84 -0.162 -0.898 1.079 1.00 0.00 C ATOM 1246 CG2 ILE A 84 1.369 0.658 -0.139 1.00 0.00 C ATOM 1247 CD1 ILE A 84 -0.139 -2.002 0.047 1.00 0.00 C ATOM 0 H ILE A 84 1.493 -1.625 3.278 1.00 0.00 H new ATOM 0 HA ILE A 84 2.582 -1.571 0.550 1.00 0.00 H new ATOM 0 HB ILE A 84 1.056 0.617 1.980 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -0.372 -1.332 2.056 1.00 0.00 H new ATOM 0 HG13 ILE A 84 -0.981 -0.217 0.850 1.00 0.00 H new ATOM 0 HG21 ILE A 84 0.514 1.304 -0.338 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.271 1.265 -0.055 1.00 0.00 H new ATOM 0 HG23 ILE A 84 1.484 -0.053 -0.957 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -1.097 -2.522 0.049 1.00 0.00 H new ATOM 0 HD12 ILE A 84 0.039 -1.574 -0.940 1.00 0.00 H new ATOM 0 HD13 ILE A 84 0.657 -2.707 0.286 1.00 0.00 H new ATOM 1259 N LYS A 85 4.304 0.337 0.957 1.00 0.00 N ATOM 1260 CA LYS A 85 5.402 1.197 1.303 1.00 0.00 C ATOM 1261 C LYS A 85 5.379 2.446 0.457 1.00 0.00 C ATOM 1262 O LYS A 85 4.939 2.444 -0.699 1.00 0.00 O ATOM 1263 CB LYS A 85 6.741 0.486 1.167 1.00 0.00 C ATOM 1264 CG LYS A 85 6.965 -0.137 -0.187 1.00 0.00 C ATOM 1265 CD LYS A 85 8.416 -0.526 -0.359 1.00 0.00 C ATOM 1266 CE LYS A 85 8.687 -1.158 -1.713 1.00 0.00 C ATOM 1267 NZ LYS A 85 10.136 -1.407 -1.931 1.00 0.00 N ATOM 0 H LYS A 85 4.188 0.168 -0.042 1.00 0.00 H new ATOM 0 HA LYS A 85 5.284 1.476 2.350 1.00 0.00 H new ATOM 0 HB2 LYS A 85 7.542 1.198 1.366 1.00 0.00 H new ATOM 0 HB3 LYS A 85 6.809 -0.290 1.929 1.00 0.00 H new ATOM 0 HG2 LYS A 85 6.331 -1.017 -0.298 1.00 0.00 H new ATOM 0 HG3 LYS A 85 6.676 0.565 -0.969 1.00 0.00 H new ATOM 0 HD2 LYS A 85 9.043 0.358 -0.241 1.00 0.00 H new ATOM 0 HD3 LYS A 85 8.698 -1.225 0.429 1.00 0.00 H new ATOM 0 HE2 LYS A 85 8.142 -2.099 -1.790 1.00 0.00 H new ATOM 0 HE3 LYS A 85 8.309 -0.505 -2.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 10.277 -1.839 -2.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 10.654 -0.506 -1.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 10.492 -2.050 -1.196 1.00 0.00 H new ATOM 1281 N TYR A 86 5.870 3.495 1.055 1.00 0.00 N ATOM 1282 CA TYR A 86 5.833 4.821 0.473 1.00 0.00 C ATOM 1283 C TYR A 86 7.249 5.292 0.182 1.00 0.00 C ATOM 1284 O TYR A 86 8.009 5.589 1.103 1.00 0.00 O ATOM 1285 CB TYR A 86 5.127 5.781 1.436 1.00 0.00 C ATOM 1286 CG TYR A 86 4.880 7.156 0.867 1.00 0.00 C ATOM 1287 CD1 TYR A 86 4.280 7.310 -0.368 1.00 0.00 C ATOM 1288 CD2 TYR A 86 5.242 8.297 1.565 1.00 0.00 C ATOM 1289 CE1 TYR A 86 4.050 8.556 -0.896 1.00 0.00 C ATOM 1290 CE2 TYR A 86 5.011 9.555 1.041 1.00 0.00 C ATOM 1291 CZ TYR A 86 4.415 9.678 -0.193 1.00 0.00 C ATOM 1292 OH TYR A 86 4.187 10.924 -0.732 1.00 0.00 O ATOM 0 H TYR A 86 6.314 3.460 1.972 1.00 0.00 H new ATOM 0 HA TYR A 86 5.278 4.798 -0.465 1.00 0.00 H new ATOM 0 HB2 TYR A 86 4.172 5.345 1.731 1.00 0.00 H new ATOM 0 HB3 TYR A 86 5.727 5.877 2.341 1.00 0.00 H new ATOM 0 HD1 TYR A 86 3.987 6.434 -0.928 1.00 0.00 H new ATOM 0 HD2 TYR A 86 5.712 8.202 2.533 1.00 0.00 H new ATOM 0 HE1 TYR A 86 3.582 8.654 -1.864 1.00 0.00 H new ATOM 0 HE2 TYR A 86 5.297 10.436 1.597 1.00 0.00 H new ATOM 0 HH TYR A 86 3.470 11.369 -0.234 1.00 0.00 H new ATOM 1302 N GLU A 87 7.599 5.342 -1.093 1.00 0.00 N ATOM 1303 CA GLU A 87 8.946 5.688 -1.495 1.00 0.00 C ATOM 1304 C GLU A 87 8.973 7.100 -2.058 1.00 0.00 C ATOM 1305 O GLU A 87 8.336 7.395 -3.068 1.00 0.00 O ATOM 1306 CB GLU A 87 9.472 4.689 -2.524 1.00 0.00 C ATOM 1307 CG GLU A 87 10.975 4.767 -2.717 1.00 0.00 C ATOM 1308 CD GLU A 87 11.511 3.677 -3.622 1.00 0.00 C ATOM 1309 OE1 GLU A 87 11.258 2.491 -3.337 1.00 0.00 O ATOM 1310 OE2 GLU A 87 12.204 4.004 -4.611 1.00 0.00 O ATOM 0 H GLU A 87 6.964 5.146 -1.867 1.00 0.00 H new ATOM 0 HA GLU A 87 9.595 5.647 -0.620 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.204 3.680 -2.211 1.00 0.00 H new ATOM 0 HB3 GLU A 87 8.979 4.868 -3.480 1.00 0.00 H new ATOM 0 HG2 GLU A 87 11.232 5.740 -3.137 1.00 0.00 H new ATOM 0 HG3 GLU A 87 11.465 4.699 -1.746 1.00 0.00 H new ATOM 1317 N VAL A 88 9.699 7.972 -1.389 1.00 0.00 N ATOM 1318 CA VAL A 88 9.737 9.376 -1.753 1.00 0.00 C ATOM 1319 C VAL A 88 11.172 9.806 -2.018 1.00 0.00 C ATOM 1320 O VAL A 88 12.101 9.071 -1.683 1.00 0.00 O ATOM 1321 CB VAL A 88 9.152 10.266 -0.647 1.00 0.00 C ATOM 1322 CG1 VAL A 88 8.529 11.523 -1.217 1.00 0.00 C ATOM 1323 CG2 VAL A 88 8.158 9.495 0.202 1.00 0.00 C ATOM 0 H VAL A 88 10.276 7.731 -0.583 1.00 0.00 H new ATOM 0 HA VAL A 88 9.132 9.495 -2.652 1.00 0.00 H new ATOM 0 HB VAL A 88 9.975 10.575 -0.002 1.00 0.00 H new ATOM 0 HG11 VAL A 88 8.125 12.129 -0.406 1.00 0.00 H new ATOM 0 HG12 VAL A 88 9.287 12.094 -1.754 1.00 0.00 H new ATOM 0 HG13 VAL A 88 7.726 11.252 -1.902 1.00 0.00 H new ATOM 0 HG21 VAL A 88 7.758 10.148 0.978 1.00 0.00 H new ATOM 0 HG22 VAL A 88 7.343 9.138 -0.427 1.00 0.00 H new ATOM 0 HG23 VAL A 88 8.658 8.645 0.666 1.00 0.00 H new ATOM 1333 N SER A 89 11.344 10.972 -2.627 1.00 0.00 N ATOM 1334 CA SER A 89 12.661 11.482 -2.988 1.00 0.00 C ATOM 1335 C SER A 89 13.642 11.382 -1.819 1.00 0.00 C ATOM 1336 O SER A 89 14.775 10.925 -1.982 1.00 0.00 O ATOM 1337 CB SER A 89 12.537 12.938 -3.427 1.00 0.00 C ATOM 1338 OG SER A 89 11.350 13.141 -4.175 1.00 0.00 O ATOM 0 H SER A 89 10.575 11.591 -2.885 1.00 0.00 H new ATOM 0 HA SER A 89 13.048 10.874 -3.805 1.00 0.00 H new ATOM 0 HB2 SER A 89 12.535 13.587 -2.551 1.00 0.00 H new ATOM 0 HB3 SER A 89 13.403 13.216 -4.028 1.00 0.00 H new ATOM 0 HG SER A 89 11.290 14.081 -4.445 1.00 0.00 H new ATOM 1344 N GLY A 90 13.197 11.802 -0.640 1.00 0.00 N ATOM 1345 CA GLY A 90 14.074 11.808 0.512 1.00 0.00 C ATOM 1346 C GLY A 90 13.574 10.958 1.665 1.00 0.00 C ATOM 1347 O GLY A 90 14.302 10.740 2.636 1.00 0.00 O ATOM 0 H GLY A 90 12.250 12.136 -0.463 1.00 0.00 H new ATOM 0 HA2 GLY A 90 15.059 11.451 0.210 1.00 0.00 H new ATOM 0 HA3 GLY A 90 14.199 12.834 0.857 1.00 0.00 H new ATOM 1351 N LYS A 91 12.342 10.469 1.584 1.00 0.00 N ATOM 1352 CA LYS A 91 11.785 9.691 2.677 1.00 0.00 C ATOM 1353 C LYS A 91 11.217 8.362 2.254 1.00 0.00 C ATOM 1354 O LYS A 91 11.148 8.021 1.074 1.00 0.00 O ATOM 1355 CB LYS A 91 10.699 10.460 3.391 1.00 0.00 C ATOM 1356 CG LYS A 91 11.236 11.370 4.459 1.00 0.00 C ATOM 1357 CD LYS A 91 11.771 10.577 5.637 1.00 0.00 C ATOM 1358 CE LYS A 91 12.923 11.291 6.317 1.00 0.00 C ATOM 1359 NZ LYS A 91 14.183 11.181 5.534 1.00 0.00 N ATOM 0 H LYS A 91 11.720 10.596 0.785 1.00 0.00 H new ATOM 0 HA LYS A 91 12.628 9.499 3.340 1.00 0.00 H new ATOM 0 HB2 LYS A 91 10.140 11.050 2.665 1.00 0.00 H new ATOM 0 HB3 LYS A 91 9.996 9.757 3.839 1.00 0.00 H new ATOM 0 HG2 LYS A 91 12.030 11.992 4.045 1.00 0.00 H new ATOM 0 HG3 LYS A 91 10.448 12.042 4.798 1.00 0.00 H new ATOM 0 HD2 LYS A 91 10.970 10.410 6.357 1.00 0.00 H new ATOM 0 HD3 LYS A 91 12.102 9.596 5.295 1.00 0.00 H new ATOM 0 HE2 LYS A 91 12.670 12.343 6.452 1.00 0.00 H new ATOM 0 HE3 LYS A 91 13.075 10.870 7.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 14.723 12.066 5.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 14.752 10.391 5.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 13.956 11.009 4.534 1.00 0.00 H new ATOM 1373 N THR A 92 10.835 7.616 3.266 1.00 0.00 N ATOM 1374 CA THR A 92 10.186 6.324 3.103 1.00 0.00 C ATOM 1375 C THR A 92 9.306 6.044 4.311 1.00 0.00 C ATOM 1376 O THR A 92 9.655 6.406 5.435 1.00 0.00 O ATOM 1377 CB THR A 92 11.195 5.171 2.934 1.00 0.00 C ATOM 1378 OG1 THR A 92 12.209 5.545 1.991 1.00 0.00 O ATOM 1379 CG2 THR A 92 10.509 3.895 2.449 1.00 0.00 C ATOM 0 H THR A 92 10.966 7.888 4.240 1.00 0.00 H new ATOM 0 HA THR A 92 9.589 6.374 2.192 1.00 0.00 H new ATOM 0 HB THR A 92 11.642 4.976 3.909 1.00 0.00 H new ATOM 0 HG1 THR A 92 12.848 4.809 1.889 1.00 0.00 H new ATOM 0 HG21 THR A 92 11.249 3.103 2.341 1.00 0.00 H new ATOM 0 HG22 THR A 92 9.754 3.590 3.174 1.00 0.00 H new ATOM 0 HG23 THR A 92 10.033 4.081 1.486 1.00 0.00 H new ATOM 1387 N TYR A 93 8.177 5.413 4.078 1.00 0.00 N ATOM 1388 CA TYR A 93 7.286 4.997 5.154 1.00 0.00 C ATOM 1389 C TYR A 93 6.660 3.671 4.782 1.00 0.00 C ATOM 1390 O TYR A 93 6.992 3.084 3.750 1.00 0.00 O ATOM 1391 CB TYR A 93 6.176 6.024 5.427 1.00 0.00 C ATOM 1392 CG TYR A 93 6.663 7.437 5.566 1.00 0.00 C ATOM 1393 CD1 TYR A 93 6.763 8.225 4.450 1.00 0.00 C ATOM 1394 CD2 TYR A 93 7.018 7.975 6.795 1.00 0.00 C ATOM 1395 CE1 TYR A 93 7.208 9.529 4.529 1.00 0.00 C ATOM 1396 CE2 TYR A 93 7.463 9.279 6.894 1.00 0.00 C ATOM 1397 CZ TYR A 93 7.556 10.053 5.757 1.00 0.00 C ATOM 1398 OH TYR A 93 7.997 11.354 5.845 1.00 0.00 O ATOM 0 H TYR A 93 7.846 5.172 3.144 1.00 0.00 H new ATOM 0 HA TYR A 93 7.879 4.910 6.065 1.00 0.00 H new ATOM 0 HB2 TYR A 93 5.449 5.981 4.616 1.00 0.00 H new ATOM 0 HB3 TYR A 93 5.652 5.741 6.340 1.00 0.00 H new ATOM 0 HD1 TYR A 93 6.488 7.817 3.488 1.00 0.00 H new ATOM 0 HD2 TYR A 93 6.945 7.367 7.685 1.00 0.00 H new ATOM 0 HE1 TYR A 93 7.283 10.134 3.637 1.00 0.00 H new ATOM 0 HE2 TYR A 93 7.736 9.689 7.855 1.00 0.00 H new ATOM 0 HH TYR A 93 8.200 11.568 6.780 1.00 0.00 H new ATOM 1408 N TYR A 94 5.729 3.232 5.599 1.00 0.00 N ATOM 1409 CA TYR A 94 5.121 1.918 5.451 1.00 0.00 C ATOM 1410 C TYR A 94 3.689 1.934 5.966 1.00 0.00 C ATOM 1411 O TYR A 94 3.366 2.679 6.890 1.00 0.00 O ATOM 1412 CB TYR A 94 5.901 0.853 6.235 1.00 0.00 C ATOM 1413 CG TYR A 94 7.337 0.639 5.797 1.00 0.00 C ATOM 1414 CD1 TYR A 94 7.637 0.062 4.569 1.00 0.00 C ATOM 1415 CD2 TYR A 94 8.392 0.986 6.632 1.00 0.00 C ATOM 1416 CE1 TYR A 94 8.945 -0.162 4.185 1.00 0.00 C ATOM 1417 CE2 TYR A 94 9.703 0.773 6.253 1.00 0.00 C ATOM 1418 CZ TYR A 94 9.975 0.197 5.030 1.00 0.00 C ATOM 1419 OH TYR A 94 11.281 -0.026 4.656 1.00 0.00 O ATOM 0 H TYR A 94 5.368 3.771 6.386 1.00 0.00 H new ATOM 0 HA TYR A 94 5.138 1.673 4.389 1.00 0.00 H new ATOM 0 HB2 TYR A 94 5.899 1.129 7.289 1.00 0.00 H new ATOM 0 HB3 TYR A 94 5.370 -0.095 6.153 1.00 0.00 H new ATOM 0 HD1 TYR A 94 6.834 -0.216 3.903 1.00 0.00 H new ATOM 0 HD2 TYR A 94 8.183 1.430 7.594 1.00 0.00 H new ATOM 0 HE1 TYR A 94 9.160 -0.616 3.229 1.00 0.00 H new ATOM 0 HE2 TYR A 94 10.511 1.056 6.911 1.00 0.00 H new ATOM 0 HH TYR A 94 11.882 0.286 5.365 1.00 0.00 H new ATOM 1429 N ASP A 95 2.846 1.124 5.353 1.00 0.00 N ATOM 1430 CA ASP A 95 1.514 0.853 5.870 1.00 0.00 C ATOM 1431 C ASP A 95 1.417 -0.632 6.178 1.00 0.00 C ATOM 1432 O ASP A 95 1.087 -1.444 5.310 1.00 0.00 O ATOM 1433 CB ASP A 95 0.430 1.266 4.869 1.00 0.00 C ATOM 1434 CG ASP A 95 -0.969 0.989 5.389 1.00 0.00 C ATOM 1435 OD1 ASP A 95 -1.464 1.771 6.229 1.00 0.00 O ATOM 1436 OD2 ASP A 95 -1.581 -0.008 4.959 1.00 0.00 O ATOM 0 H ASP A 95 3.063 0.635 4.484 1.00 0.00 H new ATOM 0 HA ASP A 95 1.352 1.438 6.775 1.00 0.00 H new ATOM 0 HB2 ASP A 95 0.529 2.329 4.647 1.00 0.00 H new ATOM 0 HB3 ASP A 95 0.580 0.729 3.932 1.00 0.00 H new ATOM 1441 N ASN A 96 1.764 -0.987 7.403 1.00 0.00 N ATOM 1442 CA ASN A 96 1.873 -2.384 7.800 1.00 0.00 C ATOM 1443 C ASN A 96 1.130 -2.639 9.103 1.00 0.00 C ATOM 1444 O ASN A 96 1.507 -3.530 9.876 1.00 0.00 O ATOM 1445 CB ASN A 96 3.353 -2.764 7.963 1.00 0.00 C ATOM 1446 CG ASN A 96 4.034 -2.037 9.117 1.00 0.00 C ATOM 1447 OD1 ASN A 96 3.646 -0.929 9.491 1.00 0.00 O ATOM 1448 ND2 ASN A 96 5.064 -2.648 9.678 1.00 0.00 N ATOM 0 H ASN A 96 1.977 -0.322 8.147 1.00 0.00 H new ATOM 0 HA ASN A 96 1.421 -2.999 7.021 1.00 0.00 H new ATOM 0 HB2 ASN A 96 3.430 -3.839 8.123 1.00 0.00 H new ATOM 0 HB3 ASN A 96 3.883 -2.541 7.037 1.00 0.00 H new ATOM 0 HD21 ASN A 96 5.565 -2.202 10.446 1.00 0.00 H new ATOM 0 HD22 ASN A 96 5.357 -3.565 9.342 1.00 0.00 H new ATOM 1455 N ASN A 97 0.055 -1.875 9.319 1.00 0.00 N ATOM 1456 CA ASN A 97 -0.683 -1.866 10.582 1.00 0.00 C ATOM 1457 C ASN A 97 0.166 -1.246 11.696 1.00 0.00 C ATOM 1458 O ASN A 97 -0.204 -0.230 12.284 1.00 0.00 O ATOM 1459 CB ASN A 97 -1.117 -3.283 10.956 1.00 0.00 C ATOM 1460 CG ASN A 97 -2.455 -3.310 11.650 1.00 0.00 C ATOM 1461 OD1 ASN A 97 -2.814 -2.395 12.389 1.00 0.00 O ATOM 1462 ND2 ASN A 97 -3.211 -4.356 11.399 1.00 0.00 N ATOM 0 H ASN A 97 -0.329 -1.242 8.617 1.00 0.00 H new ATOM 0 HA ASN A 97 -1.578 -1.256 10.457 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -1.166 -3.895 10.055 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -0.365 -3.731 11.605 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -4.135 -4.431 11.824 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -2.873 -5.092 10.779 1.00 0.00 H new ATOM 1469 N ASN A 98 1.314 -1.862 11.951 1.00 0.00 N ATOM 1470 CA ASN A 98 2.274 -1.405 12.954 1.00 0.00 C ATOM 1471 C ASN A 98 3.453 -2.363 12.940 1.00 0.00 C ATOM 1472 O ASN A 98 4.608 -1.962 12.795 1.00 0.00 O ATOM 1473 CB ASN A 98 1.645 -1.375 14.354 1.00 0.00 C ATOM 1474 CG ASN A 98 2.592 -0.848 15.422 1.00 0.00 C ATOM 1475 OD1 ASN A 98 2.556 -1.291 16.568 1.00 0.00 O ATOM 1476 ND2 ASN A 98 3.433 0.112 15.061 1.00 0.00 N ATOM 0 H ASN A 98 1.611 -2.706 11.461 1.00 0.00 H new ATOM 0 HA ASN A 98 2.593 -0.390 12.716 1.00 0.00 H new ATOM 0 HB2 ASN A 98 0.750 -0.753 14.331 1.00 0.00 H new ATOM 0 HB3 ASN A 98 1.326 -2.382 14.624 1.00 0.00 H new ATOM 0 HD21 ASN A 98 4.079 0.508 15.744 1.00 0.00 H new ATOM 0 HD22 ASN A 98 3.434 0.454 14.100 1.00 0.00 H new ATOM 1483 N SER A 99 3.119 -3.636 13.078 1.00 0.00 N ATOM 1484 CA SER A 99 4.072 -4.728 13.005 1.00 0.00 C ATOM 1485 C SER A 99 3.281 -6.029 13.028 1.00 0.00 C ATOM 1486 O SER A 99 3.299 -6.772 14.011 1.00 0.00 O ATOM 1487 CB SER A 99 5.061 -4.669 14.178 1.00 0.00 C ATOM 1488 OG SER A 99 6.126 -5.589 14.007 1.00 0.00 O ATOM 0 H SER A 99 2.161 -3.943 13.247 1.00 0.00 H new ATOM 0 HA SER A 99 4.659 -4.658 12.089 1.00 0.00 H new ATOM 0 HB2 SER A 99 5.462 -3.659 14.267 1.00 0.00 H new ATOM 0 HB3 SER A 99 4.537 -4.887 15.109 1.00 0.00 H new ATOM 0 HG SER A 99 6.739 -5.526 14.769 1.00 0.00 H new ATOM 1494 N ALA A 100 2.558 -6.280 11.945 1.00 0.00 N ATOM 1495 CA ALA A 100 1.594 -7.368 11.910 1.00 0.00 C ATOM 1496 C ALA A 100 1.476 -7.981 10.519 1.00 0.00 C ATOM 1497 O ALA A 100 1.336 -9.199 10.391 1.00 0.00 O ATOM 1498 CB ALA A 100 0.236 -6.850 12.364 1.00 0.00 C ATOM 0 H ALA A 100 2.622 -5.744 11.080 1.00 0.00 H new ATOM 0 HA ALA A 100 1.943 -8.151 12.583 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -0.490 -7.663 12.339 1.00 0.00 H new ATOM 0 HB2 ALA A 100 0.315 -6.465 13.381 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -0.090 -6.052 11.698 1.00 0.00 H new ATOM 1504 N ASN A 101 1.543 -7.131 9.485 1.00 0.00 N ATOM 1505 CA ASN A 101 1.257 -7.541 8.101 1.00 0.00 C ATOM 1506 C ASN A 101 -0.227 -7.823 7.950 1.00 0.00 C ATOM 1507 O ASN A 101 -0.895 -8.219 8.904 1.00 0.00 O ATOM 1508 CB ASN A 101 2.063 -8.776 7.674 1.00 0.00 C ATOM 1509 CG ASN A 101 3.557 -8.544 7.705 1.00 0.00 C ATOM 1510 OD1 ASN A 101 4.023 -7.409 7.666 1.00 0.00 O ATOM 1511 ND2 ASN A 101 4.320 -9.617 7.735 1.00 0.00 N ATOM 0 H ASN A 101 1.795 -6.147 9.582 1.00 0.00 H new ATOM 0 HA ASN A 101 1.555 -6.719 7.451 1.00 0.00 H new ATOM 0 HB2 ASN A 101 1.816 -9.610 8.331 1.00 0.00 H new ATOM 0 HB3 ASN A 101 1.766 -9.066 6.666 1.00 0.00 H new ATOM 0 HD21 ASN A 101 5.335 -9.521 7.726 1.00 0.00 H new ATOM 0 HD22 ASN A 101 3.895 -10.544 7.767 1.00 0.00 H new ATOM 1518 N TYR A 102 -0.758 -7.588 6.770 1.00 0.00 N ATOM 1519 CA TYR A 102 -2.144 -7.916 6.508 1.00 0.00 C ATOM 1520 C TYR A 102 -2.247 -9.384 6.131 1.00 0.00 C ATOM 1521 O TYR A 102 -1.819 -9.780 5.047 1.00 0.00 O ATOM 1522 CB TYR A 102 -2.710 -7.021 5.404 1.00 0.00 C ATOM 1523 CG TYR A 102 -2.696 -5.550 5.760 1.00 0.00 C ATOM 1524 CD1 TYR A 102 -3.751 -4.976 6.458 1.00 0.00 C ATOM 1525 CD2 TYR A 102 -1.623 -4.741 5.410 1.00 0.00 C ATOM 1526 CE1 TYR A 102 -3.736 -3.635 6.794 1.00 0.00 C ATOM 1527 CE2 TYR A 102 -1.601 -3.403 5.745 1.00 0.00 C ATOM 1528 CZ TYR A 102 -2.658 -2.855 6.437 1.00 0.00 C ATOM 1529 OH TYR A 102 -2.636 -1.523 6.776 1.00 0.00 O ATOM 0 H TYR A 102 -0.258 -7.175 5.983 1.00 0.00 H new ATOM 0 HA TYR A 102 -2.735 -7.740 7.406 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -2.133 -7.172 4.492 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -3.734 -7.326 5.188 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -4.595 -5.586 6.742 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -0.792 -5.166 4.867 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -4.565 -3.201 7.333 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -0.758 -2.788 5.466 1.00 0.00 H new ATOM 0 HH TYR A 102 -2.502 -0.982 5.970 1.00 0.00 H new ATOM 1539 N GLN A 103 -2.764 -10.191 7.057 1.00 0.00 N ATOM 1540 CA GLN A 103 -2.921 -11.622 6.834 1.00 0.00 C ATOM 1541 C GLN A 103 -3.989 -11.871 5.783 1.00 0.00 C ATOM 1542 O GLN A 103 -5.159 -11.541 5.991 1.00 0.00 O ATOM 1543 CB GLN A 103 -3.312 -12.350 8.128 1.00 0.00 C ATOM 1544 CG GLN A 103 -2.170 -12.650 9.088 1.00 0.00 C ATOM 1545 CD GLN A 103 -1.450 -11.417 9.569 1.00 0.00 C ATOM 1546 OE1 GLN A 103 -1.827 -10.806 10.569 1.00 0.00 O ATOM 1547 NE2 GLN A 103 -0.405 -11.054 8.862 1.00 0.00 N ATOM 0 H GLN A 103 -3.082 -9.873 7.972 1.00 0.00 H new ATOM 0 HA GLN A 103 -1.962 -12.010 6.491 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -4.054 -11.747 8.652 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -3.795 -13.290 7.862 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -2.562 -13.191 9.949 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -1.455 -13.310 8.595 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -0.132 -11.594 8.041 1.00 0.00 H new ATOM 0 HE22 GLN A 103 0.134 -10.232 9.134 1.00 0.00 H new ATOM 1556 N VAL A 104 -3.595 -12.442 4.659 1.00 0.00 N ATOM 1557 CA VAL A 104 -4.541 -12.744 3.603 1.00 0.00 C ATOM 1558 C VAL A 104 -4.917 -14.218 3.651 1.00 0.00 C ATOM 1559 O VAL A 104 -4.052 -15.084 3.796 1.00 0.00 O ATOM 1560 CB VAL A 104 -3.971 -12.416 2.210 1.00 0.00 C ATOM 1561 CG1 VAL A 104 -5.096 -12.291 1.195 1.00 0.00 C ATOM 1562 CG2 VAL A 104 -3.128 -11.153 2.250 1.00 0.00 C ATOM 0 H VAL A 104 -2.631 -12.705 4.455 1.00 0.00 H new ATOM 0 HA VAL A 104 -5.422 -12.123 3.767 1.00 0.00 H new ATOM 0 HB VAL A 104 -3.322 -13.236 1.902 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -4.678 -12.059 0.215 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -5.644 -13.231 1.142 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -5.773 -11.493 1.499 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -2.738 -10.944 1.254 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -3.742 -10.316 2.582 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -2.298 -11.291 2.943 1.00 0.00 H new ATOM 1572 N SER A 105 -6.205 -14.497 3.556 1.00 0.00 N ATOM 1573 CA SER A 105 -6.692 -15.861 3.574 1.00 0.00 C ATOM 1574 C SER A 105 -7.988 -15.947 2.783 1.00 0.00 C ATOM 1575 O SER A 105 -8.746 -14.977 2.721 1.00 0.00 O ATOM 1576 CB SER A 105 -6.916 -16.323 5.020 1.00 0.00 C ATOM 1577 OG SER A 105 -7.218 -17.707 5.083 1.00 0.00 O ATOM 0 H SER A 105 -6.935 -13.791 3.465 1.00 0.00 H new ATOM 0 HA SER A 105 -5.951 -16.515 3.115 1.00 0.00 H new ATOM 0 HB2 SER A 105 -6.024 -16.117 5.611 1.00 0.00 H new ATOM 0 HB3 SER A 105 -7.731 -15.751 5.464 1.00 0.00 H new ATOM 0 HG SER A 105 -7.353 -17.970 6.017 1.00 0.00 H new ATOM 1583 N THR A 106 -8.228 -17.090 2.163 1.00 0.00 N ATOM 1584 CA THR A 106 -9.458 -17.311 1.431 1.00 0.00 C ATOM 1585 C THR A 106 -10.541 -17.838 2.363 1.00 0.00 C ATOM 1586 O THR A 106 -11.324 -17.021 2.891 1.00 0.00 O ATOM 1587 CB THR A 106 -9.238 -18.290 0.263 1.00 0.00 C ATOM 1588 OG1 THR A 106 -8.242 -19.265 0.623 1.00 0.00 O ATOM 1589 CG2 THR A 106 -8.799 -17.552 -0.990 1.00 0.00 C ATOM 1590 OXT THR A 106 -10.590 -19.064 2.591 1.00 0.00 O ATOM 0 H THR A 106 -7.583 -17.880 2.154 1.00 0.00 H new ATOM 0 HA THR A 106 -9.782 -16.356 1.018 1.00 0.00 H new ATOM 0 HB THR A 106 -10.183 -18.791 0.056 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.107 -19.886 -0.123 1.00 0.00 H new ATOM 0 HG21 THR A 106 -8.650 -18.266 -1.800 1.00 0.00 H new ATOM 0 HG22 THR A 106 -9.567 -16.833 -1.277 1.00 0.00 H new ATOM 0 HG23 THR A 106 -7.864 -17.026 -0.794 1.00 0.00 H new TER 1598 THR A 106