USER MOD reduce.3.24.130724 H: found=0, std=0, add=1806, rem=0, adj=60 USER MOD reduce.3.24.130724 removed 1802 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: B 35 THR OG1 : rot 93:sc= 1.2 USER MOD Set 1.2: B 53 HIS : no HE2:sc= 0.314 K(o=1.5,f=-2.4) USER MOD Set 2.1: B 19 GLN : amide:sc= -0.072 K(o=0.62,f=-6!) USER MOD Set 2.2: B 22 LYS NZ :NH3+ 169:sc= 0.689 (180deg=0) USER MOD Set 3.1: B 21 TYR OH : rot -6:sc= 0.644 USER MOD Set 3.2: B 113 HIS : no HD1:sc= -1.45! C(o=-0.8!,f=-11!) USER MOD Set 4.1: B 18 THR OG1 : rot 98:sc= 1.22 USER MOD Set 4.2: B 37 SER OG : rot 144:sc= 0.469 USER MOD Set 5.1: A 43 ASN : amide:sc= -0.774 X(o=-1.1,f=-0.61) USER MOD Set 5.2: B 3 HIS : no HD1:sc= -0.316 K(o=-1.1,f=-3) USER MOD Set 6.1: A 81 THR OG1 : rot 75:sc= 1.28 USER MOD Set 6.2: B 1 MET CE :methyl -176:sc= -0.456 (180deg=-0.556) USER MOD Set 6.3: B 2 THR OG1 : rot -135:sc= 0.00567 USER MOD Set 7.1: A 35 THR OG1 : rot 91:sc= 0.883 USER MOD Set 7.2: A 53 HIS : no HE2:sc= 0.299 K(o=1.2,f=-2.6) USER MOD Set 8.1: A 18 THR OG1 : rot 97:sc= 1.38 USER MOD Set 8.2: A 37 SER OG : rot 143:sc= 0.301 USER MOD Set 9.1: A 21 TYR OH : rot -8:sc= 0.693 USER MOD Set 9.2: A 113 HIS : no HD1:sc= -0.963! C(o=-0.27!,f=-11!) USER MOD Set10.1: A 19 GLN : amide:sc= 0.435 K(o=1.2,f=-4.4) USER MOD Set10.2: A 22 LYS NZ :NH3+ 142:sc= 0.774 (180deg=0) USER MOD Set11.1: A 7 THR OG1 : rot 156:sc= 0.29 USER MOD Set11.2: B 7 THR OG1 : rot 31:sc= 0.318 USER MOD Set12.1: A 1 MET CE :methyl 142:sc= -0.163 (180deg=-0.0993) USER MOD Set12.2: A 2 THR OG1 : rot -160:sc= -0.411 USER MOD Set12.3: B 81 THR OG1 : rot 78:sc= 1.28 USER MOD Single : A 1 MET N :NH3+ -166:sc= 0.892 (180deg=0.591) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 10 TYR OH : rot -152:sc= -4! USER MOD Single : A 13 ASN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : A 17 SER OG : rot -74:sc= 1.29 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 130:sc= 0 USER MOD Single : A 45 MET CE :methyl 153:sc= -0.233 (180deg=-1.25) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 101:sc= -0.418 USER MOD Single : A 54 THR OG1 : rot -38:sc= 0.377 USER MOD Single : A 58 LYS NZ :NH3+ -169:sc= -0.0125 (180deg=-0.127) USER MOD Single : A 60 SER OG : rot 47:sc= 0.197 USER MOD Single : A 62 THR OG1 : rot 40:sc= -0.0213 USER MOD Single : A 74 ASN : amide:sc= -1.67! C(o=-1.7!,f=-2.8!) USER MOD Single : A 77 GLN : amide:sc= -0.037 K(o=-0.037,f=-0.77) USER MOD Single : A 86 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0163) USER MOD Single : A 88 SER OG : rot -23:sc= 0.409 USER MOD Single : A 92 MET CE :methyl -136:sc= -2.18 (180deg=-4.59!) USER MOD Single : A 94 GLN : amide:sc= 0.233 K(o=0.23,f=-0.28) USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0519) USER MOD Single : A 99 MET CE :methyl -117:sc= -1.75 (180deg=-3.54) USER MOD Single : A 103 TYR OH : rot -59:sc= 0.415 USER MOD Single : A 104 THR OG1 : rot -160:sc= 0 USER MOD Single : A 106 THR OG1 : rot 153:sc= 0.362 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 118 TYR OH : rot -32:sc= 1.09 USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 TYR OH : rot -140:sc= 0.224 USER MOD Single : B 13 ASN : amide:sc= -0.117 K(o=-0.12,f=-2.4!) USER MOD Single : B 17 SER OG : rot 92:sc= 0.608 USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 33 SER OG : rot 140:sc= 0 USER MOD Single : B 43 ASN : amide:sc= -2.71! C(o=-2.7!,f=-4.7!) USER MOD Single : B 45 MET CE :methyl -155:sc= -0.388 (180deg=-1.2) USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 SER OG : rot 101:sc= -0.532 USER MOD Single : B 54 THR OG1 : rot -46:sc= 0.333 USER MOD Single : B 58 LYS NZ :NH3+ -142:sc= -0.561 (180deg=-3.12!) USER MOD Single : B 60 SER OG : rot 46:sc= 0.261 USER MOD Single : B 62 THR OG1 : rot 180:sc= 0 USER MOD Single : B 74 ASN : amide:sc= -1.39 K(o=-1.4,f=-2.8!) USER MOD Single : B 77 GLN : amide:sc= -1.54! C(o=-1.5!,f=-4.9!) USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 88 SER OG : rot 85:sc= 0.706 USER MOD Single : B 92 MET CE :methyl -138:sc= -1.95 (180deg=-4.5!) USER MOD Single : B 94 GLN : amide:sc= 0.0768 X(o=0.077,f=-0.26) USER MOD Single : B 95 GLN : amide:sc= -0.662 K(o=-0.66,f=0) USER MOD Single : B 98 LYS NZ :NH3+ -116:sc= -0.341 (180deg=-1.81!) USER MOD Single : B 99 MET CE :methyl 136:sc= -1.82 (180deg=-3.09) USER MOD Single : B 103 TYR OH : rot -68:sc= 0.247 USER MOD Single : B 104 THR OG1 : rot 180:sc= 0 USER MOD Single : B 106 THR OG1 : rot 155:sc= 1.01 USER MOD Single : B 112 SER OG : rot 180:sc= 0 USER MOD Single : B 118 TYR OH : rot -32:sc= 0.821 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.382 18.039 -7.505 1.00 0.00 N ATOM 2 CA MET A 1 6.423 17.349 -8.321 1.00 0.00 C ATOM 3 C MET A 1 6.214 15.819 -8.327 1.00 0.00 C ATOM 4 O MET A 1 6.948 15.092 -9.005 1.00 0.00 O ATOM 5 CB MET A 1 7.844 17.692 -7.778 1.00 0.00 C ATOM 6 CG MET A 1 8.178 17.094 -6.398 1.00 0.00 C ATOM 7 SD MET A 1 7.044 17.657 -5.102 1.00 0.00 S ATOM 8 CE MET A 1 7.559 16.662 -3.700 1.00 0.00 C ATOM 0 H1 MET A 1 5.401 19.059 -7.708 1.00 0.00 H new ATOM 0 H2 MET A 1 4.445 17.656 -7.743 1.00 0.00 H new ATOM 0 H3 MET A 1 5.573 17.883 -6.495 1.00 0.00 H new ATOM 0 HA MET A 1 6.333 17.704 -9.348 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.585 17.343 -8.497 1.00 0.00 H new ATOM 0 HB3 MET A 1 7.942 18.776 -7.720 1.00 0.00 H new ATOM 0 HG2 MET A 1 8.143 16.006 -6.459 1.00 0.00 H new ATOM 0 HG3 MET A 1 9.198 17.365 -6.126 1.00 0.00 H new ATOM 0 HE1 MET A 1 7.510 17.261 -2.791 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.898 15.800 -3.603 1.00 0.00 H new ATOM 0 HE3 MET A 1 8.582 16.319 -3.853 1.00 0.00 H new ATOM 18 N THR A 2 5.191 15.346 -7.592 1.00 0.00 N ATOM 19 CA THR A 2 5.028 13.928 -7.233 1.00 0.00 C ATOM 20 C THR A 2 3.542 13.498 -7.291 1.00 0.00 C ATOM 21 O THR A 2 2.645 14.300 -7.013 1.00 0.00 O ATOM 22 CB THR A 2 5.600 13.701 -5.793 1.00 0.00 C ATOM 23 OG1 THR A 2 6.983 14.085 -5.759 1.00 0.00 O ATOM 24 CG2 THR A 2 5.480 12.247 -5.338 1.00 0.00 C ATOM 0 H THR A 2 4.449 15.944 -7.228 1.00 0.00 H new ATOM 0 HA THR A 2 5.574 13.318 -7.953 1.00 0.00 H new ATOM 0 HB THR A 2 5.009 14.314 -5.113 1.00 0.00 H new ATOM 0 HG1 THR A 2 7.419 13.670 -4.986 1.00 0.00 H new ATOM 0 HG21 THR A 2 5.891 12.145 -4.334 1.00 0.00 H new ATOM 0 HG22 THR A 2 4.430 11.953 -5.332 1.00 0.00 H new ATOM 0 HG23 THR A 2 6.033 11.604 -6.023 1.00 0.00 H new ATOM 32 N HIS A 3 3.302 12.217 -7.668 1.00 0.00 N ATOM 33 CA HIS A 3 1.958 11.596 -7.712 1.00 0.00 C ATOM 34 C HIS A 3 2.055 10.173 -7.112 1.00 0.00 C ATOM 35 O HIS A 3 2.562 9.267 -7.771 1.00 0.00 O ATOM 36 CB HIS A 3 1.414 11.508 -9.174 1.00 0.00 C ATOM 37 CG HIS A 3 1.665 12.729 -10.024 1.00 0.00 C ATOM 38 ND1 HIS A 3 0.779 13.778 -10.127 1.00 0.00 N ATOM 39 CD2 HIS A 3 2.730 13.066 -10.796 1.00 0.00 C ATOM 40 CE1 HIS A 3 1.285 14.701 -10.921 1.00 0.00 C ATOM 41 NE2 HIS A 3 2.467 14.296 -11.339 1.00 0.00 N ATOM 0 H HIS A 3 4.046 11.581 -7.953 1.00 0.00 H new ATOM 0 HA HIS A 3 1.268 12.214 -7.137 1.00 0.00 H new ATOM 0 HB2 HIS A 3 1.867 10.645 -9.662 1.00 0.00 H new ATOM 0 HB3 HIS A 3 0.340 11.326 -9.135 1.00 0.00 H new ATOM 0 HD2 HIS A 3 3.620 12.474 -10.953 1.00 0.00 H new ATOM 0 HE1 HIS A 3 0.810 15.634 -11.185 1.00 0.00 H new ATOM 0 HE2 HIS A 3 3.085 14.813 -11.964 1.00 0.00 H new ATOM 50 N PRO A 4 1.600 9.954 -5.841 1.00 0.00 N ATOM 51 CA PRO A 4 1.689 8.643 -5.159 1.00 0.00 C ATOM 52 C PRO A 4 0.443 7.771 -5.386 1.00 0.00 C ATOM 53 O PRO A 4 -0.062 7.138 -4.455 1.00 0.00 O ATOM 54 CB PRO A 4 1.841 9.071 -3.691 1.00 0.00 C ATOM 55 CG PRO A 4 0.995 10.308 -3.580 1.00 0.00 C ATOM 56 CD PRO A 4 0.965 10.963 -4.956 1.00 0.00 C ATOM 0 HA PRO A 4 2.501 8.015 -5.524 1.00 0.00 H new ATOM 0 HB2 PRO A 4 1.498 8.291 -3.011 1.00 0.00 H new ATOM 0 HB3 PRO A 4 2.882 9.276 -3.441 1.00 0.00 H new ATOM 0 HG2 PRO A 4 -0.014 10.055 -3.253 1.00 0.00 H new ATOM 0 HG3 PRO A 4 1.409 10.991 -2.838 1.00 0.00 H new ATOM 0 HD2 PRO A 4 -0.054 11.187 -5.271 1.00 0.00 H new ATOM 0 HD3 PRO A 4 1.515 11.904 -4.963 1.00 0.00 H new ATOM 64 N ASP A 5 0.036 7.661 -6.660 1.00 0.00 N ATOM 65 CA ASP A 5 -1.140 6.862 -7.095 1.00 0.00 C ATOM 66 C ASP A 5 -0.858 5.335 -7.093 1.00 0.00 C ATOM 67 O ASP A 5 -1.646 4.539 -7.631 1.00 0.00 O ATOM 68 CB ASP A 5 -1.566 7.330 -8.508 1.00 0.00 C ATOM 69 CG ASP A 5 -0.481 7.109 -9.574 1.00 0.00 C ATOM 70 OD1 ASP A 5 0.421 7.963 -9.712 1.00 0.00 O ATOM 71 OD2 ASP A 5 -0.519 6.074 -10.278 1.00 0.00 O ATOM 0 H ASP A 5 0.514 8.126 -7.432 1.00 0.00 H new ATOM 0 HA ASP A 5 -1.946 7.028 -6.380 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -2.469 6.796 -8.803 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -1.819 8.390 -8.471 1.00 0.00 H new ATOM 76 N PHE A 6 0.237 4.944 -6.431 1.00 0.00 N ATOM 77 CA PHE A 6 0.808 3.606 -6.473 1.00 0.00 C ATOM 78 C PHE A 6 1.123 3.171 -5.022 1.00 0.00 C ATOM 79 O PHE A 6 1.723 3.918 -4.250 1.00 0.00 O ATOM 80 CB PHE A 6 2.083 3.663 -7.380 1.00 0.00 C ATOM 81 CG PHE A 6 2.820 2.353 -7.694 1.00 0.00 C ATOM 82 CD1 PHE A 6 2.314 1.110 -7.354 1.00 0.00 C ATOM 83 CD2 PHE A 6 4.052 2.389 -8.352 1.00 0.00 C ATOM 84 CE1 PHE A 6 3.005 -0.034 -7.653 1.00 0.00 C ATOM 85 CE2 PHE A 6 4.741 1.235 -8.649 1.00 0.00 C ATOM 86 CZ PHE A 6 4.218 0.024 -8.298 1.00 0.00 C ATOM 0 H PHE A 6 0.764 5.579 -5.831 1.00 0.00 H new ATOM 0 HA PHE A 6 0.125 2.869 -6.896 1.00 0.00 H new ATOM 0 HB2 PHE A 6 1.795 4.116 -8.328 1.00 0.00 H new ATOM 0 HB3 PHE A 6 2.796 4.339 -6.907 1.00 0.00 H new ATOM 0 HD1 PHE A 6 1.363 1.042 -6.847 1.00 0.00 H new ATOM 0 HD2 PHE A 6 4.473 3.343 -8.634 1.00 0.00 H new ATOM 0 HE1 PHE A 6 2.592 -0.994 -7.379 1.00 0.00 H new ATOM 0 HE2 PHE A 6 5.692 1.288 -9.158 1.00 0.00 H new ATOM 0 HZ PHE A 6 4.755 -0.885 -8.526 1.00 0.00 H new ATOM 96 N THR A 7 0.663 1.970 -4.667 1.00 0.00 N ATOM 97 CA THR A 7 0.968 1.311 -3.384 1.00 0.00 C ATOM 98 C THR A 7 1.508 -0.100 -3.674 1.00 0.00 C ATOM 99 O THR A 7 1.048 -0.764 -4.597 1.00 0.00 O ATOM 100 CB THR A 7 -0.294 1.241 -2.450 1.00 0.00 C ATOM 101 OG1 THR A 7 0.035 0.584 -1.214 1.00 0.00 O ATOM 102 CG2 THR A 7 -1.485 0.517 -3.111 1.00 0.00 C ATOM 0 H THR A 7 0.057 1.414 -5.270 1.00 0.00 H new ATOM 0 HA THR A 7 1.719 1.898 -2.855 1.00 0.00 H new ATOM 0 HB THR A 7 -0.597 2.270 -2.259 1.00 0.00 H new ATOM 0 HG1 THR A 7 -0.590 0.870 -0.515 1.00 0.00 H new ATOM 0 HG21 THR A 7 -2.328 0.499 -2.421 1.00 0.00 H new ATOM 0 HG22 THR A 7 -1.772 1.045 -4.021 1.00 0.00 H new ATOM 0 HG23 THR A 7 -1.197 -0.505 -3.360 1.00 0.00 H new ATOM 110 N ILE A 8 2.518 -0.532 -2.902 1.00 0.00 N ATOM 111 CA ILE A 8 3.156 -1.856 -3.063 1.00 0.00 C ATOM 112 C ILE A 8 2.967 -2.666 -1.773 1.00 0.00 C ATOM 113 O ILE A 8 3.104 -2.123 -0.672 1.00 0.00 O ATOM 114 CB ILE A 8 4.700 -1.717 -3.380 1.00 0.00 C ATOM 115 CG1 ILE A 8 4.948 -0.830 -4.639 1.00 0.00 C ATOM 116 CG2 ILE A 8 5.380 -3.104 -3.544 1.00 0.00 C ATOM 117 CD1 ILE A 8 6.417 -0.596 -4.978 1.00 0.00 C ATOM 0 H ILE A 8 2.918 0.025 -2.147 1.00 0.00 H new ATOM 0 HA ILE A 8 2.684 -2.367 -3.902 1.00 0.00 H new ATOM 0 HB ILE A 8 5.156 -1.221 -2.523 1.00 0.00 H new ATOM 0 HG12 ILE A 8 4.462 -1.296 -5.496 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.467 0.136 -4.486 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.439 -2.967 -3.761 1.00 0.00 H new ATOM 0 HG22 ILE A 8 5.269 -3.675 -2.622 1.00 0.00 H new ATOM 0 HG23 ILE A 8 4.909 -3.645 -4.364 1.00 0.00 H new ATOM 0 HD11 ILE A 8 6.490 0.031 -5.867 1.00 0.00 H new ATOM 0 HD12 ILE A 8 6.909 -0.098 -4.142 1.00 0.00 H new ATOM 0 HD13 ILE A 8 6.904 -1.553 -5.168 1.00 0.00 H new ATOM 129 N LEU A 9 2.635 -3.957 -1.907 1.00 0.00 N ATOM 130 CA LEU A 9 2.614 -4.894 -0.767 1.00 0.00 C ATOM 131 C LEU A 9 3.949 -5.651 -0.755 1.00 0.00 C ATOM 132 O LEU A 9 4.531 -5.984 -1.795 1.00 0.00 O ATOM 133 CB LEU A 9 1.376 -5.842 -0.814 1.00 0.00 C ATOM 134 CG LEU A 9 0.087 -5.328 -0.078 1.00 0.00 C ATOM 135 CD1 LEU A 9 0.310 -5.240 1.448 1.00 0.00 C ATOM 136 CD2 LEU A 9 -0.404 -3.981 -0.648 1.00 0.00 C ATOM 0 H LEU A 9 2.375 -4.382 -2.797 1.00 0.00 H new ATOM 0 HA LEU A 9 2.507 -4.345 0.169 1.00 0.00 H new ATOM 0 HB2 LEU A 9 1.125 -6.027 -1.858 1.00 0.00 H new ATOM 0 HB3 LEU A 9 1.660 -6.800 -0.380 1.00 0.00 H new ATOM 0 HG LEU A 9 -0.699 -6.061 -0.260 1.00 0.00 H new ATOM 0 HD11 LEU A 9 -0.600 -4.881 1.929 1.00 0.00 H new ATOM 0 HD12 LEU A 9 0.561 -6.227 1.837 1.00 0.00 H new ATOM 0 HD13 LEU A 9 1.127 -4.550 1.657 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -1.297 -3.662 -0.110 1.00 0.00 H new ATOM 0 HD22 LEU A 9 0.377 -3.230 -0.531 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -0.640 -4.098 -1.706 1.00 0.00 H new ATOM 148 N TYR A 10 4.371 -5.946 0.473 1.00 0.00 N ATOM 149 CA TYR A 10 5.706 -6.424 0.819 1.00 0.00 C ATOM 150 C TYR A 10 5.634 -7.951 1.037 1.00 0.00 C ATOM 151 O TYR A 10 5.304 -8.413 2.129 1.00 0.00 O ATOM 152 CB TYR A 10 6.116 -5.638 2.099 1.00 0.00 C ATOM 153 CG TYR A 10 7.589 -5.583 2.454 1.00 0.00 C ATOM 154 CD1 TYR A 10 8.459 -4.770 1.731 1.00 0.00 C ATOM 155 CD2 TYR A 10 8.094 -6.278 3.550 1.00 0.00 C ATOM 156 CE1 TYR A 10 9.777 -4.664 2.084 1.00 0.00 C ATOM 157 CE2 TYR A 10 9.408 -6.163 3.908 1.00 0.00 C ATOM 158 CZ TYR A 10 10.245 -5.359 3.174 1.00 0.00 C ATOM 159 OH TYR A 10 11.551 -5.252 3.534 1.00 0.00 O ATOM 0 H TYR A 10 3.765 -5.854 1.288 1.00 0.00 H new ATOM 0 HA TYR A 10 6.452 -6.257 0.042 1.00 0.00 H new ATOM 0 HB2 TYR A 10 5.759 -4.614 1.992 1.00 0.00 H new ATOM 0 HB3 TYR A 10 5.584 -6.074 2.944 1.00 0.00 H new ATOM 0 HD1 TYR A 10 8.089 -4.216 0.881 1.00 0.00 H new ATOM 0 HD2 TYR A 10 7.439 -6.916 4.125 1.00 0.00 H new ATOM 0 HE1 TYR A 10 10.445 -4.039 1.510 1.00 0.00 H new ATOM 0 HE2 TYR A 10 9.786 -6.702 4.764 1.00 0.00 H new ATOM 0 HH TYR A 10 11.834 -6.074 3.987 1.00 0.00 H new ATOM 169 N VAL A 11 5.959 -8.723 -0.008 1.00 0.00 N ATOM 170 CA VAL A 11 5.825 -10.203 -0.011 1.00 0.00 C ATOM 171 C VAL A 11 7.226 -10.811 0.033 1.00 0.00 C ATOM 172 O VAL A 11 8.201 -10.081 0.110 1.00 0.00 O ATOM 173 CB VAL A 11 5.039 -10.723 -1.271 1.00 0.00 C ATOM 174 CG1 VAL A 11 3.584 -10.202 -1.258 1.00 0.00 C ATOM 175 CG2 VAL A 11 5.765 -10.366 -2.597 1.00 0.00 C ATOM 0 H VAL A 11 6.324 -8.347 -0.883 1.00 0.00 H new ATOM 0 HA VAL A 11 5.249 -10.507 0.863 1.00 0.00 H new ATOM 0 HB VAL A 11 5.008 -11.811 -1.217 1.00 0.00 H new ATOM 0 HG11 VAL A 11 3.057 -10.572 -2.137 1.00 0.00 H new ATOM 0 HG12 VAL A 11 3.080 -10.553 -0.358 1.00 0.00 H new ATOM 0 HG13 VAL A 11 3.588 -9.112 -1.270 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.188 -10.744 -3.441 1.00 0.00 H new ATOM 0 HG22 VAL A 11 5.861 -9.283 -2.679 1.00 0.00 H new ATOM 0 HG23 VAL A 11 6.756 -10.820 -2.603 1.00 0.00 H new ATOM 185 N ASP A 12 7.323 -12.144 0.034 1.00 0.00 N ATOM 186 CA ASP A 12 8.612 -12.852 0.123 1.00 0.00 C ATOM 187 C ASP A 12 8.773 -13.816 -1.064 1.00 0.00 C ATOM 188 O ASP A 12 9.777 -13.744 -1.784 1.00 0.00 O ATOM 189 CB ASP A 12 8.703 -13.591 1.485 1.00 0.00 C ATOM 190 CG ASP A 12 10.074 -14.225 1.764 1.00 0.00 C ATOM 191 OD1 ASP A 12 11.082 -13.484 1.802 1.00 0.00 O ATOM 192 OD2 ASP A 12 10.152 -15.457 1.960 1.00 0.00 O ATOM 0 H ASP A 12 6.516 -12.764 -0.026 1.00 0.00 H new ATOM 0 HA ASP A 12 9.431 -12.135 0.071 1.00 0.00 H new ATOM 0 HB2 ASP A 12 8.471 -12.887 2.284 1.00 0.00 H new ATOM 0 HB3 ASP A 12 7.941 -14.370 1.515 1.00 0.00 H new ATOM 197 N ASN A 13 7.776 -14.709 -1.268 1.00 0.00 N ATOM 198 CA ASN A 13 7.778 -15.707 -2.373 1.00 0.00 C ATOM 199 C ASN A 13 7.159 -15.110 -3.648 1.00 0.00 C ATOM 200 O ASN A 13 5.937 -14.983 -3.704 1.00 0.00 O ATOM 201 CB ASN A 13 6.981 -16.983 -1.958 1.00 0.00 C ATOM 202 CG ASN A 13 7.716 -17.882 -0.968 1.00 0.00 C ATOM 203 OD1 ASN A 13 8.508 -17.421 -0.145 1.00 0.00 O ATOM 204 ND2 ASN A 13 7.462 -19.180 -1.052 1.00 0.00 N ATOM 0 H ASN A 13 6.948 -14.761 -0.675 1.00 0.00 H new ATOM 0 HA ASN A 13 8.814 -15.980 -2.576 1.00 0.00 H new ATOM 0 HB2 ASN A 13 6.031 -16.678 -1.519 1.00 0.00 H new ATOM 0 HB3 ASN A 13 6.748 -17.560 -2.853 1.00 0.00 H new ATOM 0 HD21 ASN A 13 7.929 -19.833 -0.422 1.00 0.00 H new ATOM 0 HD22 ASN A 13 6.800 -19.526 -1.746 1.00 0.00 H new ATOM 211 N PRO A 14 7.981 -14.753 -4.700 1.00 0.00 N ATOM 212 CA PRO A 14 7.467 -14.113 -5.942 1.00 0.00 C ATOM 213 C PRO A 14 6.302 -14.907 -6.638 1.00 0.00 C ATOM 214 O PRO A 14 5.236 -14.321 -6.813 1.00 0.00 O ATOM 215 CB PRO A 14 8.725 -13.942 -6.844 1.00 0.00 C ATOM 216 CG PRO A 14 9.888 -14.000 -5.893 1.00 0.00 C ATOM 217 CD PRO A 14 9.465 -14.917 -4.758 1.00 0.00 C ATOM 0 HA PRO A 14 6.990 -13.157 -5.725 1.00 0.00 H new ATOM 0 HB2 PRO A 14 8.786 -14.732 -7.592 1.00 0.00 H new ATOM 0 HB3 PRO A 14 8.700 -12.994 -7.382 1.00 0.00 H new ATOM 0 HG2 PRO A 14 10.779 -14.383 -6.391 1.00 0.00 H new ATOM 0 HG3 PRO A 14 10.134 -13.006 -5.519 1.00 0.00 H new ATOM 0 HD2 PRO A 14 9.746 -15.952 -4.954 1.00 0.00 H new ATOM 0 HD3 PRO A 14 9.936 -14.632 -3.817 1.00 0.00 H new ATOM 225 N PRO A 15 6.433 -16.248 -7.015 1.00 0.00 N ATOM 226 CA PRO A 15 5.329 -16.983 -7.693 1.00 0.00 C ATOM 227 C PRO A 15 4.043 -17.026 -6.840 1.00 0.00 C ATOM 228 O PRO A 15 3.003 -16.499 -7.240 1.00 0.00 O ATOM 229 CB PRO A 15 5.906 -18.411 -7.934 1.00 0.00 C ATOM 230 CG PRO A 15 7.389 -18.229 -7.873 1.00 0.00 C ATOM 231 CD PRO A 15 7.609 -17.146 -6.840 1.00 0.00 C ATOM 0 HA PRO A 15 5.027 -16.494 -8.619 1.00 0.00 H new ATOM 0 HB2 PRO A 15 5.560 -19.112 -7.175 1.00 0.00 H new ATOM 0 HB3 PRO A 15 5.594 -18.808 -8.900 1.00 0.00 H new ATOM 0 HG2 PRO A 15 7.889 -19.155 -7.587 1.00 0.00 H new ATOM 0 HG3 PRO A 15 7.791 -17.937 -8.843 1.00 0.00 H new ATOM 0 HD2 PRO A 15 7.652 -17.557 -5.831 1.00 0.00 H new ATOM 0 HD3 PRO A 15 8.546 -16.616 -7.009 1.00 0.00 H new ATOM 239 N ALA A 16 4.173 -17.601 -5.633 1.00 0.00 N ATOM 240 CA ALA A 16 3.028 -17.996 -4.784 1.00 0.00 C ATOM 241 C ALA A 16 2.175 -16.796 -4.362 1.00 0.00 C ATOM 242 O ALA A 16 0.936 -16.840 -4.454 1.00 0.00 O ATOM 243 CB ALA A 16 3.520 -18.752 -3.541 1.00 0.00 C ATOM 0 H ALA A 16 5.079 -17.808 -5.213 1.00 0.00 H new ATOM 0 HA ALA A 16 2.397 -18.652 -5.384 1.00 0.00 H new ATOM 0 HB1 ALA A 16 2.666 -19.036 -2.926 1.00 0.00 H new ATOM 0 HB2 ALA A 16 4.059 -19.648 -3.850 1.00 0.00 H new ATOM 0 HB3 ALA A 16 4.185 -18.109 -2.964 1.00 0.00 H new ATOM 249 N SER A 17 2.847 -15.717 -3.943 1.00 0.00 N ATOM 250 CA SER A 17 2.177 -14.539 -3.381 1.00 0.00 C ATOM 251 C SER A 17 1.546 -13.704 -4.498 1.00 0.00 C ATOM 252 O SER A 17 0.470 -13.136 -4.310 1.00 0.00 O ATOM 253 CB SER A 17 3.178 -13.682 -2.589 1.00 0.00 C ATOM 254 OG SER A 17 4.130 -13.078 -3.447 1.00 0.00 O ATOM 0 H SER A 17 3.863 -15.636 -3.983 1.00 0.00 H new ATOM 0 HA SER A 17 1.391 -14.878 -2.706 1.00 0.00 H new ATOM 0 HB2 SER A 17 2.642 -12.910 -2.036 1.00 0.00 H new ATOM 0 HB3 SER A 17 3.690 -14.303 -1.854 1.00 0.00 H new ATOM 0 HG SER A 17 4.768 -13.755 -3.756 1.00 0.00 H new ATOM 260 N THR A 18 2.202 -13.654 -5.674 1.00 0.00 N ATOM 261 CA THR A 18 1.690 -12.904 -6.825 1.00 0.00 C ATOM 262 C THR A 18 0.427 -13.504 -7.458 1.00 0.00 C ATOM 263 O THR A 18 -0.521 -12.788 -7.791 1.00 0.00 O ATOM 264 CB THR A 18 2.800 -12.726 -7.904 1.00 0.00 C ATOM 265 OG1 THR A 18 3.891 -11.979 -7.334 1.00 0.00 O ATOM 266 CG2 THR A 18 2.292 -12.004 -9.161 1.00 0.00 C ATOM 0 H THR A 18 3.089 -14.127 -5.846 1.00 0.00 H new ATOM 0 HA THR A 18 1.395 -11.932 -6.430 1.00 0.00 H new ATOM 0 HB THR A 18 3.124 -13.720 -8.211 1.00 0.00 H new ATOM 0 HG1 THR A 18 4.587 -12.598 -7.029 1.00 0.00 H new ATOM 0 HG21 THR A 18 3.106 -11.907 -9.879 1.00 0.00 H new ATOM 0 HG22 THR A 18 1.481 -12.579 -9.608 1.00 0.00 H new ATOM 0 HG23 THR A 18 1.928 -11.013 -8.889 1.00 0.00 H new ATOM 274 N GLN A 19 0.417 -14.855 -7.520 1.00 0.00 N ATOM 275 CA GLN A 19 -0.756 -15.650 -7.939 1.00 0.00 C ATOM 276 C GLN A 19 -1.899 -15.449 -6.926 1.00 0.00 C ATOM 277 O GLN A 19 -3.078 -15.411 -7.303 1.00 0.00 O ATOM 278 CB GLN A 19 -0.381 -17.151 -8.033 1.00 0.00 C ATOM 279 CG GLN A 19 0.724 -17.492 -9.061 1.00 0.00 C ATOM 280 CD GLN A 19 0.258 -17.532 -10.513 1.00 0.00 C ATOM 281 OE1 GLN A 19 0.306 -16.537 -11.227 1.00 0.00 O ATOM 282 NE2 GLN A 19 -0.190 -18.692 -10.963 1.00 0.00 N ATOM 0 H GLN A 19 1.227 -15.426 -7.279 1.00 0.00 H new ATOM 0 HA GLN A 19 -1.084 -15.315 -8.923 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -0.056 -17.490 -7.049 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -1.277 -17.718 -8.286 1.00 0.00 H new ATOM 0 HG2 GLN A 19 1.523 -16.757 -8.971 1.00 0.00 H new ATOM 0 HG3 GLN A 19 1.152 -18.461 -8.805 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -0.218 -19.503 -10.344 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -0.508 -18.776 -11.929 1.00 0.00 H new ATOM 291 N PHE A 20 -1.524 -15.310 -5.638 1.00 0.00 N ATOM 292 CA PHE A 20 -2.495 -15.121 -4.558 1.00 0.00 C ATOM 293 C PHE A 20 -3.173 -13.744 -4.685 1.00 0.00 C ATOM 294 O PHE A 20 -4.383 -13.659 -4.500 1.00 0.00 O ATOM 295 CB PHE A 20 -1.838 -15.280 -3.158 1.00 0.00 C ATOM 296 CG PHE A 20 -2.850 -15.193 -2.008 1.00 0.00 C ATOM 297 CD1 PHE A 20 -3.733 -16.246 -1.757 1.00 0.00 C ATOM 298 CD2 PHE A 20 -2.943 -14.055 -1.202 1.00 0.00 C ATOM 299 CE1 PHE A 20 -4.672 -16.156 -0.751 1.00 0.00 C ATOM 300 CE2 PHE A 20 -3.883 -13.976 -0.192 1.00 0.00 C ATOM 301 CZ PHE A 20 -4.744 -15.025 0.031 1.00 0.00 C ATOM 0 H PHE A 20 -0.553 -15.326 -5.327 1.00 0.00 H new ATOM 0 HA PHE A 20 -3.253 -15.899 -4.653 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -1.324 -16.240 -3.111 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -1.081 -14.507 -3.028 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -3.680 -17.142 -2.358 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -2.271 -13.226 -1.371 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -5.353 -16.976 -0.576 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -3.941 -13.090 0.423 1.00 0.00 H new ATOM 0 HZ PHE A 20 -5.478 -14.962 0.821 1.00 0.00 H new ATOM 311 N TYR A 21 -2.407 -12.687 -5.058 1.00 0.00 N ATOM 312 CA TYR A 21 -2.982 -11.342 -5.320 1.00 0.00 C ATOM 313 C TYR A 21 -3.808 -11.361 -6.616 1.00 0.00 C ATOM 314 O TYR A 21 -4.765 -10.584 -6.731 1.00 0.00 O ATOM 315 CB TYR A 21 -1.882 -10.241 -5.322 1.00 0.00 C ATOM 316 CG TYR A 21 -1.541 -9.741 -3.906 1.00 0.00 C ATOM 317 CD1 TYR A 21 -0.717 -10.479 -3.058 1.00 0.00 C ATOM 318 CD2 TYR A 21 -2.088 -8.554 -3.405 1.00 0.00 C ATOM 319 CE1 TYR A 21 -0.443 -10.056 -1.777 1.00 0.00 C ATOM 320 CE2 TYR A 21 -1.827 -8.134 -2.115 1.00 0.00 C ATOM 321 CZ TYR A 21 -1.006 -8.888 -1.309 1.00 0.00 C ATOM 322 OH TYR A 21 -0.766 -8.483 -0.020 1.00 0.00 O ATOM 0 H TYR A 21 -1.396 -12.739 -5.184 1.00 0.00 H new ATOM 0 HA TYR A 21 -3.660 -11.086 -4.506 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -0.980 -10.635 -5.791 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -2.216 -9.400 -5.929 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -0.284 -11.402 -3.414 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -2.726 -7.955 -4.039 1.00 0.00 H new ATOM 0 HE1 TYR A 21 0.210 -10.636 -1.142 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -2.265 -7.220 -1.742 1.00 0.00 H new ATOM 0 HH TYR A 21 -0.285 -9.189 0.461 1.00 0.00 H new ATOM 332 N LYS A 22 -3.434 -12.214 -7.593 1.00 0.00 N ATOM 333 CA LYS A 22 -4.170 -12.327 -8.872 1.00 0.00 C ATOM 334 C LYS A 22 -5.649 -12.679 -8.654 1.00 0.00 C ATOM 335 O LYS A 22 -6.539 -12.062 -9.233 1.00 0.00 O ATOM 336 CB LYS A 22 -3.498 -13.351 -9.817 1.00 0.00 C ATOM 337 CG LYS A 22 -2.191 -12.860 -10.465 1.00 0.00 C ATOM 338 CD LYS A 22 -1.491 -13.961 -11.285 1.00 0.00 C ATOM 339 CE LYS A 22 -2.368 -14.523 -12.422 1.00 0.00 C ATOM 340 NZ LYS A 22 -1.697 -15.617 -13.166 1.00 0.00 N ATOM 0 H LYS A 22 -2.628 -12.834 -7.521 1.00 0.00 H new ATOM 0 HA LYS A 22 -4.132 -11.347 -9.347 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -3.291 -14.262 -9.256 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -4.203 -13.615 -10.605 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -2.407 -12.010 -11.113 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -1.515 -12.504 -9.688 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -0.571 -13.559 -11.709 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -1.206 -14.775 -10.619 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -3.305 -14.892 -12.006 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -2.621 -13.719 -13.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -2.395 -16.347 -13.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -1.270 -15.235 -14.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -0.955 -16.037 -12.571 1.00 0.00 H new ATOM 354 N ALA A 23 -5.876 -13.693 -7.805 1.00 0.00 N ATOM 355 CA ALA A 23 -7.232 -14.151 -7.424 1.00 0.00 C ATOM 356 C ALA A 23 -7.876 -13.196 -6.386 1.00 0.00 C ATOM 357 O ALA A 23 -9.095 -12.983 -6.390 1.00 0.00 O ATOM 358 CB ALA A 23 -7.154 -15.586 -6.867 1.00 0.00 C ATOM 0 H ALA A 23 -5.127 -14.223 -7.360 1.00 0.00 H new ATOM 0 HA ALA A 23 -7.864 -14.144 -8.312 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -8.152 -15.922 -6.587 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -6.748 -16.251 -7.629 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -6.507 -15.601 -5.990 1.00 0.00 H new ATOM 364 N LEU A 24 -7.027 -12.639 -5.500 1.00 0.00 N ATOM 365 CA LEU A 24 -7.431 -11.736 -4.384 1.00 0.00 C ATOM 366 C LEU A 24 -8.115 -10.445 -4.882 1.00 0.00 C ATOM 367 O LEU A 24 -8.995 -9.884 -4.213 1.00 0.00 O ATOM 368 CB LEU A 24 -6.160 -11.327 -3.582 1.00 0.00 C ATOM 369 CG LEU A 24 -6.363 -10.640 -2.192 1.00 0.00 C ATOM 370 CD1 LEU A 24 -6.778 -11.668 -1.131 1.00 0.00 C ATOM 371 CD2 LEU A 24 -5.100 -9.865 -1.744 1.00 0.00 C ATOM 0 H LEU A 24 -6.021 -12.802 -5.533 1.00 0.00 H new ATOM 0 HA LEU A 24 -8.145 -12.283 -3.768 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.559 -12.223 -3.428 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -5.573 -10.653 -4.206 1.00 0.00 H new ATOM 0 HG LEU A 24 -7.169 -9.914 -2.302 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -6.913 -11.167 -0.172 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -7.714 -12.141 -1.429 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.002 -12.427 -1.037 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -5.282 -9.402 -0.774 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -4.259 -10.554 -1.665 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -4.868 -9.092 -2.477 1.00 0.00 H new ATOM 383 N LEU A 25 -7.688 -10.001 -6.076 1.00 0.00 N ATOM 384 CA LEU A 25 -8.230 -8.811 -6.758 1.00 0.00 C ATOM 385 C LEU A 25 -9.129 -9.230 -7.930 1.00 0.00 C ATOM 386 O LEU A 25 -10.172 -8.619 -8.162 1.00 0.00 O ATOM 387 CB LEU A 25 -7.054 -7.933 -7.253 1.00 0.00 C ATOM 388 CG LEU A 25 -6.074 -7.448 -6.137 1.00 0.00 C ATOM 389 CD1 LEU A 25 -4.902 -6.646 -6.725 1.00 0.00 C ATOM 390 CD2 LEU A 25 -6.827 -6.637 -5.070 1.00 0.00 C ATOM 0 H LEU A 25 -6.947 -10.464 -6.603 1.00 0.00 H new ATOM 0 HA LEU A 25 -8.838 -8.235 -6.061 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -6.487 -8.497 -7.993 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -7.462 -7.059 -7.762 1.00 0.00 H new ATOM 0 HG LEU A 25 -5.651 -8.330 -5.656 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.241 -6.325 -5.920 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -4.346 -7.272 -7.423 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -5.287 -5.771 -7.250 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -6.127 -6.308 -4.302 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -7.291 -5.767 -5.535 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -7.598 -7.260 -4.616 1.00 0.00 H new ATOM 402 N GLY A 26 -8.702 -10.269 -8.662 1.00 0.00 N ATOM 403 CA GLY A 26 -9.328 -10.654 -9.934 1.00 0.00 C ATOM 404 C GLY A 26 -8.626 -10.008 -11.130 1.00 0.00 C ATOM 405 O GLY A 26 -9.252 -9.747 -12.160 1.00 0.00 O ATOM 0 H GLY A 26 -7.918 -10.862 -8.391 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -9.301 -11.739 -10.039 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -10.378 -10.360 -9.926 1.00 0.00 H new ATOM 409 N VAL A 27 -7.307 -9.753 -10.981 1.00 0.00 N ATOM 410 CA VAL A 27 -6.457 -9.106 -12.018 1.00 0.00 C ATOM 411 C VAL A 27 -5.218 -9.992 -12.302 1.00 0.00 C ATOM 412 O VAL A 27 -5.082 -11.068 -11.718 1.00 0.00 O ATOM 413 CB VAL A 27 -6.005 -7.653 -11.576 1.00 0.00 C ATOM 414 CG1 VAL A 27 -7.227 -6.770 -11.212 1.00 0.00 C ATOM 415 CG2 VAL A 27 -4.978 -7.699 -10.411 1.00 0.00 C ATOM 0 H VAL A 27 -6.794 -9.991 -10.132 1.00 0.00 H new ATOM 0 HA VAL A 27 -7.048 -9.003 -12.928 1.00 0.00 H new ATOM 0 HB VAL A 27 -5.506 -7.196 -12.431 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -6.884 -5.780 -10.913 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.882 -6.681 -12.078 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -7.775 -7.228 -10.388 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -4.693 -6.683 -10.137 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -5.426 -8.195 -9.550 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -4.093 -8.251 -10.728 1.00 0.00 H new ATOM 425 N ASP A 28 -4.333 -9.541 -13.208 1.00 0.00 N ATOM 426 CA ASP A 28 -3.052 -10.222 -13.511 1.00 0.00 C ATOM 427 C ASP A 28 -1.934 -9.160 -13.646 1.00 0.00 C ATOM 428 O ASP A 28 -2.232 -8.015 -14.019 1.00 0.00 O ATOM 429 CB ASP A 28 -3.165 -11.093 -14.804 1.00 0.00 C ATOM 430 CG ASP A 28 -3.320 -10.272 -16.101 1.00 0.00 C ATOM 431 OD1 ASP A 28 -4.463 -9.928 -16.468 1.00 0.00 O ATOM 432 OD2 ASP A 28 -2.299 -9.965 -16.760 1.00 0.00 O ATOM 0 H ASP A 28 -4.482 -8.693 -13.754 1.00 0.00 H new ATOM 0 HA ASP A 28 -2.805 -10.899 -12.694 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -2.277 -11.720 -14.887 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -4.019 -11.762 -14.705 1.00 0.00 H new ATOM 437 N PRO A 29 -0.640 -9.497 -13.328 1.00 0.00 N ATOM 438 CA PRO A 29 0.483 -8.533 -13.405 1.00 0.00 C ATOM 439 C PRO A 29 0.818 -8.146 -14.863 1.00 0.00 C ATOM 440 O PRO A 29 1.283 -8.987 -15.641 1.00 0.00 O ATOM 441 CB PRO A 29 1.674 -9.273 -12.713 1.00 0.00 C ATOM 442 CG PRO A 29 1.043 -10.450 -12.031 1.00 0.00 C ATOM 443 CD PRO A 29 -0.157 -10.815 -12.869 1.00 0.00 C ATOM 0 HA PRO A 29 0.244 -7.587 -12.919 1.00 0.00 H new ATOM 0 HB2 PRO A 29 2.421 -9.590 -13.441 1.00 0.00 H new ATOM 0 HB3 PRO A 29 2.181 -8.625 -11.998 1.00 0.00 H new ATOM 0 HG2 PRO A 29 1.742 -11.284 -11.964 1.00 0.00 H new ATOM 0 HG3 PRO A 29 0.747 -10.199 -11.012 1.00 0.00 H new ATOM 0 HD2 PRO A 29 0.113 -11.461 -13.704 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -0.912 -11.344 -12.288 1.00 0.00 H new ATOM 451 N VAL A 30 0.547 -6.873 -15.213 1.00 0.00 N ATOM 452 CA VAL A 30 0.867 -6.299 -16.538 1.00 0.00 C ATOM 453 C VAL A 30 2.396 -6.274 -16.765 1.00 0.00 C ATOM 454 O VAL A 30 2.882 -6.622 -17.847 1.00 0.00 O ATOM 455 CB VAL A 30 0.233 -4.860 -16.709 1.00 0.00 C ATOM 456 CG1 VAL A 30 0.584 -3.920 -15.525 1.00 0.00 C ATOM 457 CG2 VAL A 30 0.621 -4.221 -18.073 1.00 0.00 C ATOM 0 H VAL A 30 0.098 -6.209 -14.582 1.00 0.00 H new ATOM 0 HA VAL A 30 0.424 -6.939 -17.301 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.849 -4.992 -16.702 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.127 -2.944 -15.687 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.206 -4.348 -14.596 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.666 -3.807 -15.459 1.00 0.00 H new ATOM 0 HG21 VAL A 30 0.167 -3.233 -18.154 1.00 0.00 H new ATOM 0 HG22 VAL A 30 1.705 -4.128 -18.136 1.00 0.00 H new ATOM 0 HG23 VAL A 30 0.263 -4.853 -18.886 1.00 0.00 H new ATOM 467 N GLU A 31 3.139 -5.888 -15.715 1.00 0.00 N ATOM 468 CA GLU A 31 4.607 -5.994 -15.655 1.00 0.00 C ATOM 469 C GLU A 31 4.969 -7.056 -14.612 1.00 0.00 C ATOM 470 O GLU A 31 4.274 -7.202 -13.603 1.00 0.00 O ATOM 471 CB GLU A 31 5.259 -4.627 -15.291 1.00 0.00 C ATOM 472 CG GLU A 31 5.105 -3.533 -16.367 1.00 0.00 C ATOM 473 CD GLU A 31 5.726 -3.944 -17.719 1.00 0.00 C ATOM 474 OE1 GLU A 31 6.965 -3.828 -17.873 1.00 0.00 O ATOM 475 OE2 GLU A 31 4.991 -4.404 -18.619 1.00 0.00 O ATOM 0 H GLU A 31 2.731 -5.487 -14.871 1.00 0.00 H new ATOM 0 HA GLU A 31 4.990 -6.281 -16.634 1.00 0.00 H new ATOM 0 HB2 GLU A 31 4.820 -4.267 -14.361 1.00 0.00 H new ATOM 0 HB3 GLU A 31 6.321 -4.785 -15.102 1.00 0.00 H new ATOM 0 HG2 GLU A 31 4.047 -3.313 -16.508 1.00 0.00 H new ATOM 0 HG3 GLU A 31 5.577 -2.615 -16.018 1.00 0.00 H new ATOM 482 N SER A 32 6.051 -7.796 -14.864 1.00 0.00 N ATOM 483 CA SER A 32 6.524 -8.850 -13.964 1.00 0.00 C ATOM 484 C SER A 32 8.030 -9.066 -14.156 1.00 0.00 C ATOM 485 O SER A 32 8.579 -8.838 -15.240 1.00 0.00 O ATOM 486 CB SER A 32 5.740 -10.162 -14.207 1.00 0.00 C ATOM 487 OG SER A 32 5.884 -10.608 -15.544 1.00 0.00 O ATOM 0 H SER A 32 6.625 -7.681 -15.699 1.00 0.00 H new ATOM 0 HA SER A 32 6.349 -8.541 -12.934 1.00 0.00 H new ATOM 0 HB2 SER A 32 6.097 -10.933 -13.524 1.00 0.00 H new ATOM 0 HB3 SER A 32 4.684 -10.004 -13.986 1.00 0.00 H new ATOM 0 HG SER A 32 5.380 -11.439 -15.668 1.00 0.00 H new ATOM 493 N SER A 33 8.668 -9.521 -13.087 1.00 0.00 N ATOM 494 CA SER A 33 10.110 -9.768 -12.999 1.00 0.00 C ATOM 495 C SER A 33 10.314 -11.080 -12.202 1.00 0.00 C ATOM 496 O SER A 33 9.368 -11.530 -11.539 1.00 0.00 O ATOM 497 CB SER A 33 10.774 -8.562 -12.285 1.00 0.00 C ATOM 498 OG SER A 33 10.393 -7.334 -12.886 1.00 0.00 O ATOM 0 H SER A 33 8.179 -9.739 -12.218 1.00 0.00 H new ATOM 0 HA SER A 33 10.566 -9.874 -13.983 1.00 0.00 H new ATOM 0 HB2 SER A 33 10.490 -8.558 -11.233 1.00 0.00 H new ATOM 0 HB3 SER A 33 11.858 -8.667 -12.322 1.00 0.00 H new ATOM 0 HG SER A 33 10.086 -6.712 -12.193 1.00 0.00 H new ATOM 504 N PRO A 34 11.526 -11.733 -12.241 1.00 0.00 N ATOM 505 CA PRO A 34 11.783 -12.987 -11.471 1.00 0.00 C ATOM 506 C PRO A 34 11.523 -12.830 -9.948 1.00 0.00 C ATOM 507 O PRO A 34 11.146 -13.794 -9.279 1.00 0.00 O ATOM 508 CB PRO A 34 13.279 -13.308 -11.776 1.00 0.00 C ATOM 509 CG PRO A 34 13.852 -12.018 -12.284 1.00 0.00 C ATOM 510 CD PRO A 34 12.724 -11.346 -13.036 1.00 0.00 C ATOM 0 HA PRO A 34 11.107 -13.789 -11.766 1.00 0.00 H new ATOM 0 HB2 PRO A 34 13.801 -13.648 -10.881 1.00 0.00 H new ATOM 0 HB3 PRO A 34 13.370 -14.101 -12.518 1.00 0.00 H new ATOM 0 HG2 PRO A 34 14.203 -11.394 -11.463 1.00 0.00 H new ATOM 0 HG3 PRO A 34 14.707 -12.198 -12.936 1.00 0.00 H new ATOM 0 HD2 PRO A 34 12.852 -10.264 -13.076 1.00 0.00 H new ATOM 0 HD3 PRO A 34 12.658 -11.697 -14.066 1.00 0.00 H new ATOM 518 N THR A 35 11.734 -11.608 -9.413 1.00 0.00 N ATOM 519 CA THR A 35 11.557 -11.323 -7.974 1.00 0.00 C ATOM 520 C THR A 35 10.674 -10.064 -7.705 1.00 0.00 C ATOM 521 O THR A 35 10.727 -9.465 -6.616 1.00 0.00 O ATOM 522 CB THR A 35 12.964 -11.224 -7.292 1.00 0.00 C ATOM 523 OG1 THR A 35 12.826 -11.070 -5.872 1.00 0.00 O ATOM 524 CG2 THR A 35 13.823 -10.086 -7.882 1.00 0.00 C ATOM 0 H THR A 35 12.029 -10.799 -9.961 1.00 0.00 H new ATOM 0 HA THR A 35 11.005 -12.149 -7.527 1.00 0.00 H new ATOM 0 HB THR A 35 13.487 -12.158 -7.497 1.00 0.00 H new ATOM 0 HG1 THR A 35 12.821 -11.953 -5.446 1.00 0.00 H new ATOM 0 HG21 THR A 35 14.788 -10.059 -7.376 1.00 0.00 H new ATOM 0 HG22 THR A 35 13.976 -10.261 -8.947 1.00 0.00 H new ATOM 0 HG23 THR A 35 13.312 -9.134 -7.740 1.00 0.00 H new ATOM 532 N PHE A 36 9.822 -9.697 -8.682 1.00 0.00 N ATOM 533 CA PHE A 36 8.931 -8.511 -8.579 1.00 0.00 C ATOM 534 C PHE A 36 7.687 -8.717 -9.464 1.00 0.00 C ATOM 535 O PHE A 36 7.703 -9.538 -10.380 1.00 0.00 O ATOM 536 CB PHE A 36 9.714 -7.223 -8.989 1.00 0.00 C ATOM 537 CG PHE A 36 8.928 -5.903 -8.908 1.00 0.00 C ATOM 538 CD1 PHE A 36 8.722 -5.272 -7.683 1.00 0.00 C ATOM 539 CD2 PHE A 36 8.395 -5.295 -10.057 1.00 0.00 C ATOM 540 CE1 PHE A 36 8.003 -4.093 -7.600 1.00 0.00 C ATOM 541 CE2 PHE A 36 7.683 -4.113 -9.968 1.00 0.00 C ATOM 542 CZ PHE A 36 7.488 -3.512 -8.741 1.00 0.00 C ATOM 0 H PHE A 36 9.728 -10.206 -9.561 1.00 0.00 H new ATOM 0 HA PHE A 36 8.598 -8.390 -7.548 1.00 0.00 H new ATOM 0 HB2 PHE A 36 10.594 -7.139 -8.352 1.00 0.00 H new ATOM 0 HB3 PHE A 36 10.071 -7.348 -10.011 1.00 0.00 H new ATOM 0 HD1 PHE A 36 9.130 -5.710 -6.784 1.00 0.00 H new ATOM 0 HD2 PHE A 36 8.543 -5.757 -11.022 1.00 0.00 H new ATOM 0 HE1 PHE A 36 7.844 -3.626 -6.639 1.00 0.00 H new ATOM 0 HE2 PHE A 36 7.279 -3.659 -10.861 1.00 0.00 H new ATOM 0 HZ PHE A 36 6.933 -2.588 -8.674 1.00 0.00 H new ATOM 552 N SER A 37 6.608 -7.974 -9.171 1.00 0.00 N ATOM 553 CA SER A 37 5.371 -7.968 -9.974 1.00 0.00 C ATOM 554 C SER A 37 4.693 -6.590 -9.889 1.00 0.00 C ATOM 555 O SER A 37 4.886 -5.857 -8.915 1.00 0.00 O ATOM 556 CB SER A 37 4.411 -9.079 -9.495 1.00 0.00 C ATOM 557 OG SER A 37 5.005 -10.366 -9.622 1.00 0.00 O ATOM 0 H SER A 37 6.568 -7.354 -8.362 1.00 0.00 H new ATOM 0 HA SER A 37 5.627 -8.165 -11.015 1.00 0.00 H new ATOM 0 HB2 SER A 37 4.138 -8.903 -8.454 1.00 0.00 H new ATOM 0 HB3 SER A 37 3.490 -9.042 -10.077 1.00 0.00 H new ATOM 0 HG SER A 37 4.734 -10.927 -8.866 1.00 0.00 H new ATOM 563 N LEU A 38 3.907 -6.252 -10.917 1.00 0.00 N ATOM 564 CA LEU A 38 3.179 -4.983 -11.011 1.00 0.00 C ATOM 565 C LEU A 38 1.876 -5.238 -11.788 1.00 0.00 C ATOM 566 O LEU A 38 1.911 -5.688 -12.930 1.00 0.00 O ATOM 567 CB LEU A 38 4.101 -3.913 -11.674 1.00 0.00 C ATOM 568 CG LEU A 38 3.537 -2.464 -11.901 1.00 0.00 C ATOM 569 CD1 LEU A 38 2.818 -2.319 -13.251 1.00 0.00 C ATOM 570 CD2 LEU A 38 2.624 -2.008 -10.748 1.00 0.00 C ATOM 0 H LEU A 38 3.757 -6.863 -11.720 1.00 0.00 H new ATOM 0 HA LEU A 38 2.907 -4.592 -10.031 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.998 -3.826 -11.062 1.00 0.00 H new ATOM 0 HB3 LEU A 38 4.413 -4.301 -12.643 1.00 0.00 H new ATOM 0 HG LEU A 38 4.406 -1.806 -11.919 1.00 0.00 H new ATOM 0 HD11 LEU A 38 2.447 -1.300 -13.358 1.00 0.00 H new ATOM 0 HD12 LEU A 38 3.515 -2.539 -14.060 1.00 0.00 H new ATOM 0 HD13 LEU A 38 1.981 -3.016 -13.294 1.00 0.00 H new ATOM 0 HD21 LEU A 38 2.259 -1.001 -10.950 1.00 0.00 H new ATOM 0 HD22 LEU A 38 1.778 -2.690 -10.662 1.00 0.00 H new ATOM 0 HD23 LEU A 38 3.188 -2.009 -9.815 1.00 0.00 H new ATOM 582 N PHE A 39 0.744 -4.909 -11.156 1.00 0.00 N ATOM 583 CA PHE A 39 -0.605 -4.954 -11.757 1.00 0.00 C ATOM 584 C PHE A 39 -1.295 -3.596 -11.511 1.00 0.00 C ATOM 585 O PHE A 39 -1.289 -3.076 -10.393 1.00 0.00 O ATOM 586 CB PHE A 39 -1.431 -6.160 -11.182 1.00 0.00 C ATOM 587 CG PHE A 39 -1.063 -6.573 -9.741 1.00 0.00 C ATOM 588 CD1 PHE A 39 -0.019 -7.482 -9.499 1.00 0.00 C ATOM 589 CD2 PHE A 39 -1.733 -6.049 -8.636 1.00 0.00 C ATOM 590 CE1 PHE A 39 0.329 -7.844 -8.210 1.00 0.00 C ATOM 591 CE2 PHE A 39 -1.378 -6.414 -7.347 1.00 0.00 C ATOM 592 CZ PHE A 39 -0.351 -7.309 -7.136 1.00 0.00 C ATOM 0 H PHE A 39 0.734 -4.595 -10.186 1.00 0.00 H new ATOM 0 HA PHE A 39 -0.536 -5.119 -12.832 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -2.490 -5.903 -11.211 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -1.294 -7.020 -11.837 1.00 0.00 H new ATOM 0 HD1 PHE A 39 0.521 -7.905 -10.333 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -2.541 -5.348 -8.787 1.00 0.00 H new ATOM 0 HE1 PHE A 39 1.133 -8.546 -8.045 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -1.908 -5.995 -6.504 1.00 0.00 H new ATOM 0 HZ PHE A 39 -0.079 -7.591 -6.130 1.00 0.00 H new ATOM 602 N VAL A 40 -1.874 -3.025 -12.582 1.00 0.00 N ATOM 603 CA VAL A 40 -2.529 -1.705 -12.552 1.00 0.00 C ATOM 604 C VAL A 40 -4.048 -1.892 -12.691 1.00 0.00 C ATOM 605 O VAL A 40 -4.508 -2.538 -13.639 1.00 0.00 O ATOM 606 CB VAL A 40 -2.014 -0.766 -13.713 1.00 0.00 C ATOM 607 CG1 VAL A 40 -2.601 0.667 -13.583 1.00 0.00 C ATOM 608 CG2 VAL A 40 -0.468 -0.738 -13.769 1.00 0.00 C ATOM 0 H VAL A 40 -1.901 -3.470 -13.500 1.00 0.00 H new ATOM 0 HA VAL A 40 -2.284 -1.230 -11.602 1.00 0.00 H new ATOM 0 HB VAL A 40 -2.370 -1.182 -14.655 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -2.227 1.288 -14.397 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -3.689 0.620 -13.632 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -2.299 1.099 -12.629 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -0.145 -0.083 -14.578 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -0.076 -0.365 -12.822 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -0.092 -1.746 -13.946 1.00 0.00 H new ATOM 618 N LEU A 41 -4.811 -1.324 -11.747 1.00 0.00 N ATOM 619 CA LEU A 41 -6.259 -1.570 -11.623 1.00 0.00 C ATOM 620 C LEU A 41 -7.034 -0.429 -12.288 1.00 0.00 C ATOM 621 O LEU A 41 -6.623 0.738 -12.207 1.00 0.00 O ATOM 622 CB LEU A 41 -6.681 -1.719 -10.124 1.00 0.00 C ATOM 623 CG LEU A 41 -6.250 -3.046 -9.394 1.00 0.00 C ATOM 624 CD1 LEU A 41 -4.718 -3.155 -9.201 1.00 0.00 C ATOM 625 CD2 LEU A 41 -6.992 -3.197 -8.044 1.00 0.00 C ATOM 0 H LEU A 41 -4.444 -0.680 -11.046 1.00 0.00 H new ATOM 0 HA LEU A 41 -6.496 -2.507 -12.127 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.268 -0.877 -9.569 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -7.766 -1.637 -10.067 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.539 -3.871 -10.046 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -4.481 -4.090 -8.693 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -4.226 -3.136 -10.174 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -4.366 -2.316 -8.600 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -6.678 -4.121 -7.558 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -6.754 -2.350 -7.401 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -8.067 -3.227 -8.221 1.00 0.00 H new ATOM 637 N ALA A 42 -8.186 -0.774 -12.903 1.00 0.00 N ATOM 638 CA ALA A 42 -9.064 0.186 -13.620 1.00 0.00 C ATOM 639 C ALA A 42 -9.720 1.218 -12.668 1.00 0.00 C ATOM 640 O ALA A 42 -10.400 2.147 -13.116 1.00 0.00 O ATOM 641 CB ALA A 42 -10.137 -0.585 -14.414 1.00 0.00 C ATOM 0 H ALA A 42 -8.538 -1.731 -12.918 1.00 0.00 H new ATOM 0 HA ALA A 42 -8.439 0.755 -14.309 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -10.779 0.122 -14.939 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -9.653 -1.241 -15.137 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -10.738 -1.182 -13.728 1.00 0.00 H new ATOM 647 N ASN A 43 -9.503 1.031 -11.350 1.00 0.00 N ATOM 648 CA ASN A 43 -9.960 1.953 -10.288 1.00 0.00 C ATOM 649 C ASN A 43 -9.242 3.322 -10.335 1.00 0.00 C ATOM 650 O ASN A 43 -9.632 4.249 -9.617 1.00 0.00 O ATOM 651 CB ASN A 43 -9.739 1.297 -8.893 1.00 0.00 C ATOM 652 CG ASN A 43 -10.405 -0.082 -8.718 1.00 0.00 C ATOM 653 OD1 ASN A 43 -9.917 -0.924 -7.960 1.00 0.00 O ATOM 654 ND2 ASN A 43 -11.521 -0.329 -9.404 1.00 0.00 N ATOM 0 H ASN A 43 -8.998 0.223 -10.987 1.00 0.00 H new ATOM 0 HA ASN A 43 -11.021 2.138 -10.459 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -8.668 1.193 -8.721 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -10.121 1.970 -8.125 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -11.990 -1.230 -9.308 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -11.906 0.383 -10.025 1.00 0.00 H new ATOM 661 N GLY A 44 -8.193 3.441 -11.175 1.00 0.00 N ATOM 662 CA GLY A 44 -7.356 4.644 -11.219 1.00 0.00 C ATOM 663 C GLY A 44 -6.218 4.572 -10.210 1.00 0.00 C ATOM 664 O GLY A 44 -5.607 5.592 -9.876 1.00 0.00 O ATOM 0 H GLY A 44 -7.910 2.713 -11.831 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -6.947 4.767 -12.222 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -7.969 5.522 -11.015 1.00 0.00 H new ATOM 668 N MET A 45 -5.949 3.345 -9.721 1.00 0.00 N ATOM 669 CA MET A 45 -4.876 3.058 -8.756 1.00 0.00 C ATOM 670 C MET A 45 -3.892 2.056 -9.376 1.00 0.00 C ATOM 671 O MET A 45 -4.198 1.402 -10.386 1.00 0.00 O ATOM 672 CB MET A 45 -5.492 2.519 -7.425 1.00 0.00 C ATOM 673 CG MET A 45 -6.112 1.103 -7.482 1.00 0.00 C ATOM 674 SD MET A 45 -4.901 -0.200 -7.167 1.00 0.00 S ATOM 675 CE MET A 45 -4.455 0.119 -5.457 1.00 0.00 C ATOM 0 H MET A 45 -6.480 2.517 -9.991 1.00 0.00 H new ATOM 0 HA MET A 45 -4.328 3.970 -8.520 1.00 0.00 H new ATOM 0 HB2 MET A 45 -4.714 2.521 -6.662 1.00 0.00 H new ATOM 0 HB3 MET A 45 -6.262 3.217 -7.097 1.00 0.00 H new ATOM 0 HG2 MET A 45 -6.915 1.032 -6.748 1.00 0.00 H new ATOM 0 HG3 MET A 45 -6.561 0.947 -8.463 1.00 0.00 H new ATOM 0 HE1 MET A 45 -4.127 -0.808 -4.987 1.00 0.00 H new ATOM 0 HE2 MET A 45 -3.646 0.849 -5.422 1.00 0.00 H new ATOM 0 HE3 MET A 45 -5.320 0.510 -4.922 1.00 0.00 H new ATOM 685 N LYS A 46 -2.714 1.950 -8.767 1.00 0.00 N ATOM 686 CA LYS A 46 -1.626 1.085 -9.237 1.00 0.00 C ATOM 687 C LYS A 46 -1.107 0.285 -8.029 1.00 0.00 C ATOM 688 O LYS A 46 -1.000 0.840 -6.930 1.00 0.00 O ATOM 689 CB LYS A 46 -0.542 1.988 -9.888 1.00 0.00 C ATOM 690 CG LYS A 46 0.573 1.259 -10.666 1.00 0.00 C ATOM 691 CD LYS A 46 1.346 2.216 -11.609 1.00 0.00 C ATOM 692 CE LYS A 46 2.360 1.495 -12.509 1.00 0.00 C ATOM 693 NZ LYS A 46 2.872 2.379 -13.585 1.00 0.00 N ATOM 0 H LYS A 46 -2.481 2.469 -7.920 1.00 0.00 H new ATOM 0 HA LYS A 46 -1.949 0.369 -9.992 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -1.037 2.682 -10.568 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -0.078 2.586 -9.104 1.00 0.00 H new ATOM 0 HG2 LYS A 46 1.269 0.805 -9.961 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.137 0.449 -11.250 1.00 0.00 H new ATOM 0 HD2 LYS A 46 0.633 2.753 -12.235 1.00 0.00 H new ATOM 0 HD3 LYS A 46 1.869 2.962 -11.010 1.00 0.00 H new ATOM 0 HE2 LYS A 46 3.194 1.139 -11.904 1.00 0.00 H new ATOM 0 HE3 LYS A 46 1.891 0.617 -12.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 3.553 1.855 -14.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 2.080 2.698 -14.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 3.342 3.205 -13.162 1.00 0.00 H new ATOM 707 N LEU A 47 -0.813 -1.016 -8.221 1.00 0.00 N ATOM 708 CA LEU A 47 -0.481 -1.927 -7.100 1.00 0.00 C ATOM 709 C LEU A 47 0.719 -2.835 -7.474 1.00 0.00 C ATOM 710 O LEU A 47 0.681 -3.560 -8.466 1.00 0.00 O ATOM 711 CB LEU A 47 -1.749 -2.752 -6.689 1.00 0.00 C ATOM 712 CG LEU A 47 -1.943 -3.062 -5.158 1.00 0.00 C ATOM 713 CD1 LEU A 47 -3.312 -3.726 -4.908 1.00 0.00 C ATOM 714 CD2 LEU A 47 -0.793 -3.919 -4.569 1.00 0.00 C ATOM 0 H LEU A 47 -0.798 -1.462 -9.138 1.00 0.00 H new ATOM 0 HA LEU A 47 -0.176 -1.341 -6.233 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -2.630 -2.213 -7.038 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -1.722 -3.701 -7.225 1.00 0.00 H new ATOM 0 HG LEU A 47 -1.915 -2.106 -4.635 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.427 -3.933 -3.844 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -4.107 -3.056 -5.236 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -3.371 -4.660 -5.467 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -0.980 -4.101 -3.511 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -0.741 -4.871 -5.098 1.00 0.00 H new ATOM 0 HD23 LEU A 47 0.152 -3.388 -4.684 1.00 0.00 H new ATOM 726 N GLY A 48 1.779 -2.762 -6.651 1.00 0.00 N ATOM 727 CA GLY A 48 3.012 -3.533 -6.834 1.00 0.00 C ATOM 728 C GLY A 48 3.082 -4.710 -5.882 1.00 0.00 C ATOM 729 O GLY A 48 2.311 -4.798 -4.921 1.00 0.00 O ATOM 0 H GLY A 48 1.800 -2.157 -5.830 1.00 0.00 H new ATOM 0 HA2 GLY A 48 3.068 -3.892 -7.862 1.00 0.00 H new ATOM 0 HA3 GLY A 48 3.874 -2.885 -6.676 1.00 0.00 H new ATOM 733 N LEU A 49 4.071 -5.575 -6.127 1.00 0.00 N ATOM 734 CA LEU A 49 4.471 -6.654 -5.218 1.00 0.00 C ATOM 735 C LEU A 49 5.997 -6.747 -5.279 1.00 0.00 C ATOM 736 O LEU A 49 6.550 -7.156 -6.304 1.00 0.00 O ATOM 737 CB LEU A 49 3.788 -8.007 -5.610 1.00 0.00 C ATOM 738 CG LEU A 49 2.958 -8.687 -4.481 1.00 0.00 C ATOM 739 CD1 LEU A 49 1.799 -7.795 -3.991 1.00 0.00 C ATOM 740 CD2 LEU A 49 2.451 -10.065 -4.921 1.00 0.00 C ATOM 0 H LEU A 49 4.628 -5.544 -6.981 1.00 0.00 H new ATOM 0 HA LEU A 49 4.148 -6.442 -4.199 1.00 0.00 H new ATOM 0 HB2 LEU A 49 3.133 -7.830 -6.463 1.00 0.00 H new ATOM 0 HB3 LEU A 49 4.560 -8.702 -5.939 1.00 0.00 H new ATOM 0 HG LEU A 49 3.629 -8.828 -3.633 1.00 0.00 H new ATOM 0 HD11 LEU A 49 1.250 -8.312 -3.204 1.00 0.00 H new ATOM 0 HD12 LEU A 49 2.200 -6.860 -3.599 1.00 0.00 H new ATOM 0 HD13 LEU A 49 1.127 -7.582 -4.823 1.00 0.00 H new ATOM 0 HD21 LEU A 49 1.875 -10.516 -4.113 1.00 0.00 H new ATOM 0 HD22 LEU A 49 1.817 -9.956 -5.801 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.300 -10.705 -5.162 1.00 0.00 H new ATOM 752 N TRP A 50 6.671 -6.344 -4.194 1.00 0.00 N ATOM 753 CA TRP A 50 8.135 -6.416 -4.089 1.00 0.00 C ATOM 754 C TRP A 50 8.496 -7.516 -3.081 1.00 0.00 C ATOM 755 O TRP A 50 7.976 -7.532 -1.957 1.00 0.00 O ATOM 756 CB TRP A 50 8.703 -5.042 -3.644 1.00 0.00 C ATOM 757 CG TRP A 50 10.169 -4.812 -3.919 1.00 0.00 C ATOM 758 CD1 TRP A 50 11.230 -5.577 -3.522 1.00 0.00 C ATOM 759 CD2 TRP A 50 10.730 -3.702 -4.623 1.00 0.00 C ATOM 760 NE1 TRP A 50 12.398 -5.012 -3.939 1.00 0.00 N ATOM 761 CE2 TRP A 50 12.120 -3.855 -4.601 1.00 0.00 C ATOM 762 CE3 TRP A 50 10.175 -2.593 -5.271 1.00 0.00 C ATOM 763 CZ2 TRP A 50 12.973 -2.934 -5.177 1.00 0.00 C ATOM 764 CZ3 TRP A 50 11.022 -1.674 -5.854 1.00 0.00 C ATOM 765 CH2 TRP A 50 12.409 -1.851 -5.798 1.00 0.00 C ATOM 0 H TRP A 50 6.218 -5.959 -3.365 1.00 0.00 H new ATOM 0 HA TRP A 50 8.574 -6.658 -5.057 1.00 0.00 H new ATOM 0 HB2 TRP A 50 8.133 -4.257 -4.141 1.00 0.00 H new ATOM 0 HB3 TRP A 50 8.533 -4.930 -2.573 1.00 0.00 H new ATOM 0 HD1 TRP A 50 11.154 -6.496 -2.960 1.00 0.00 H new ATOM 0 HE1 TRP A 50 13.330 -5.394 -3.781 1.00 0.00 H new ATOM 0 HE3 TRP A 50 9.104 -2.459 -5.314 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 14.045 -3.063 -5.139 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 10.612 -0.811 -6.358 1.00 0.00 H new ATOM 0 HH2 TRP A 50 13.052 -1.114 -6.257 1.00 0.00 H new ATOM 776 N SER A 51 9.369 -8.439 -3.504 1.00 0.00 N ATOM 777 CA SER A 51 9.865 -9.516 -2.650 1.00 0.00 C ATOM 778 C SER A 51 10.983 -8.986 -1.720 1.00 0.00 C ATOM 779 O SER A 51 11.997 -8.463 -2.192 1.00 0.00 O ATOM 780 CB SER A 51 10.349 -10.685 -3.526 1.00 0.00 C ATOM 781 OG SER A 51 9.307 -11.140 -4.377 1.00 0.00 O ATOM 0 H SER A 51 9.749 -8.457 -4.450 1.00 0.00 H new ATOM 0 HA SER A 51 9.061 -9.885 -2.013 1.00 0.00 H new ATOM 0 HB2 SER A 51 11.202 -10.368 -4.125 1.00 0.00 H new ATOM 0 HB3 SER A 51 10.691 -11.503 -2.892 1.00 0.00 H new ATOM 0 HG SER A 51 9.443 -10.784 -5.280 1.00 0.00 H new ATOM 787 N ARG A 52 10.785 -9.141 -0.404 1.00 0.00 N ATOM 788 CA ARG A 52 11.618 -8.518 0.644 1.00 0.00 C ATOM 789 C ARG A 52 13.038 -9.115 0.708 1.00 0.00 C ATOM 790 O ARG A 52 13.933 -8.523 1.317 1.00 0.00 O ATOM 791 CB ARG A 52 10.931 -8.683 2.016 1.00 0.00 C ATOM 792 CG ARG A 52 10.826 -10.149 2.493 1.00 0.00 C ATOM 793 CD ARG A 52 10.303 -10.293 3.926 1.00 0.00 C ATOM 794 NE ARG A 52 10.478 -11.679 4.403 1.00 0.00 N ATOM 795 CZ ARG A 52 10.424 -12.076 5.679 1.00 0.00 C ATOM 796 NH1 ARG A 52 10.105 -11.225 6.648 1.00 0.00 N ATOM 797 NH2 ARG A 52 10.695 -13.330 5.980 1.00 0.00 N ATOM 0 H ARG A 52 10.029 -9.712 -0.027 1.00 0.00 H new ATOM 0 HA ARG A 52 11.720 -7.463 0.390 1.00 0.00 H new ATOM 0 HB2 ARG A 52 11.484 -8.108 2.759 1.00 0.00 H new ATOM 0 HB3 ARG A 52 9.929 -8.256 1.963 1.00 0.00 H new ATOM 0 HG2 ARG A 52 10.167 -10.695 1.818 1.00 0.00 H new ATOM 0 HG3 ARG A 52 11.809 -10.615 2.425 1.00 0.00 H new ATOM 0 HD2 ARG A 52 10.834 -9.606 4.584 1.00 0.00 H new ATOM 0 HD3 ARG A 52 9.249 -10.019 3.964 1.00 0.00 H new ATOM 0 HE ARG A 52 10.655 -12.395 3.699 1.00 0.00 H new ATOM 0 HH11 ARG A 52 9.897 -10.252 6.424 1.00 0.00 H new ATOM 0 HH12 ARG A 52 10.068 -11.545 7.616 1.00 0.00 H new ATOM 0 HH21 ARG A 52 10.944 -13.989 5.242 1.00 0.00 H new ATOM 0 HH22 ARG A 52 10.656 -13.641 6.951 1.00 0.00 H new ATOM 811 N HIS A 53 13.232 -10.291 0.080 1.00 0.00 N ATOM 812 CA HIS A 53 14.540 -10.969 0.039 1.00 0.00 C ATOM 813 C HIS A 53 15.530 -10.225 -0.898 1.00 0.00 C ATOM 814 O HIS A 53 16.713 -10.568 -0.943 1.00 0.00 O ATOM 815 CB HIS A 53 14.376 -12.456 -0.389 1.00 0.00 C ATOM 816 CG HIS A 53 14.094 -12.675 -1.851 1.00 0.00 C ATOM 817 ND1 HIS A 53 15.092 -12.688 -2.806 1.00 0.00 N ATOM 818 CD2 HIS A 53 12.937 -12.879 -2.522 1.00 0.00 C ATOM 819 CE1 HIS A 53 14.563 -12.881 -3.991 1.00 0.00 C ATOM 820 NE2 HIS A 53 13.258 -13.002 -3.851 1.00 0.00 N ATOM 0 H HIS A 53 12.492 -10.794 -0.409 1.00 0.00 H new ATOM 0 HA HIS A 53 14.960 -10.949 1.045 1.00 0.00 H new ATOM 0 HB2 HIS A 53 15.286 -12.995 -0.126 1.00 0.00 H new ATOM 0 HB3 HIS A 53 13.565 -12.897 0.191 1.00 0.00 H new ATOM 0 HD1 HIS A 53 16.087 -12.566 -2.619 1.00 0.00 H new ATOM 0 HD2 HIS A 53 11.947 -12.935 -2.093 1.00 0.00 H new ATOM 0 HE1 HIS A 53 15.105 -12.932 -4.924 1.00 0.00 H new ATOM 829 N THR A 54 15.027 -9.224 -1.657 1.00 0.00 N ATOM 830 CA THR A 54 15.847 -8.417 -2.583 1.00 0.00 C ATOM 831 C THR A 54 15.522 -6.908 -2.451 1.00 0.00 C ATOM 832 O THR A 54 16.036 -6.090 -3.225 1.00 0.00 O ATOM 833 CB THR A 54 15.621 -8.897 -4.060 1.00 0.00 C ATOM 834 OG1 THR A 54 16.588 -8.302 -4.941 1.00 0.00 O ATOM 835 CG2 THR A 54 14.196 -8.571 -4.551 1.00 0.00 C ATOM 0 H THR A 54 14.043 -8.955 -1.643 1.00 0.00 H new ATOM 0 HA THR A 54 16.895 -8.557 -2.319 1.00 0.00 H new ATOM 0 HB THR A 54 15.746 -9.980 -4.071 1.00 0.00 H new ATOM 0 HG1 THR A 54 16.750 -7.374 -4.670 1.00 0.00 H new ATOM 0 HG21 THR A 54 14.077 -8.918 -5.577 1.00 0.00 H new ATOM 0 HG22 THR A 54 13.468 -9.070 -3.912 1.00 0.00 H new ATOM 0 HG23 THR A 54 14.035 -7.494 -4.511 1.00 0.00 H new ATOM 843 N VAL A 55 14.678 -6.539 -1.463 1.00 0.00 N ATOM 844 CA VAL A 55 14.251 -5.135 -1.263 1.00 0.00 C ATOM 845 C VAL A 55 15.455 -4.223 -0.922 1.00 0.00 C ATOM 846 O VAL A 55 16.442 -4.682 -0.346 1.00 0.00 O ATOM 847 CB VAL A 55 13.143 -5.018 -0.152 1.00 0.00 C ATOM 848 CG1 VAL A 55 13.724 -5.299 1.255 1.00 0.00 C ATOM 849 CG2 VAL A 55 12.409 -3.652 -0.229 1.00 0.00 C ATOM 0 H VAL A 55 14.278 -7.194 -0.791 1.00 0.00 H new ATOM 0 HA VAL A 55 13.820 -4.796 -2.205 1.00 0.00 H new ATOM 0 HB VAL A 55 12.395 -5.788 -0.341 1.00 0.00 H new ATOM 0 HG11 VAL A 55 12.933 -5.210 2.000 1.00 0.00 H new ATOM 0 HG12 VAL A 55 14.137 -6.307 1.283 1.00 0.00 H new ATOM 0 HG13 VAL A 55 14.511 -4.578 1.474 1.00 0.00 H new ATOM 0 HG21 VAL A 55 11.650 -3.602 0.552 1.00 0.00 H new ATOM 0 HG22 VAL A 55 13.127 -2.844 -0.088 1.00 0.00 H new ATOM 0 HG23 VAL A 55 11.934 -3.549 -1.204 1.00 0.00 H new ATOM 859 N GLU A 56 15.384 -2.948 -1.336 1.00 0.00 N ATOM 860 CA GLU A 56 16.405 -1.933 -1.015 1.00 0.00 C ATOM 861 C GLU A 56 15.743 -0.734 -0.292 1.00 0.00 C ATOM 862 O GLU A 56 14.932 -0.035 -0.900 1.00 0.00 O ATOM 863 CB GLU A 56 17.158 -1.492 -2.296 1.00 0.00 C ATOM 864 CG GLU A 56 18.238 -2.494 -2.765 1.00 0.00 C ATOM 865 CD GLU A 56 19.114 -1.964 -3.916 1.00 0.00 C ATOM 866 OE1 GLU A 56 19.767 -0.909 -3.732 1.00 0.00 O ATOM 867 OE2 GLU A 56 19.176 -2.599 -4.991 1.00 0.00 O ATOM 0 H GLU A 56 14.616 -2.589 -1.904 1.00 0.00 H new ATOM 0 HA GLU A 56 17.145 -2.365 -0.341 1.00 0.00 H new ATOM 0 HB2 GLU A 56 16.435 -1.350 -3.099 1.00 0.00 H new ATOM 0 HB3 GLU A 56 17.628 -0.525 -2.115 1.00 0.00 H new ATOM 0 HG2 GLU A 56 18.878 -2.747 -1.920 1.00 0.00 H new ATOM 0 HG3 GLU A 56 17.752 -3.416 -3.084 1.00 0.00 H new ATOM 874 N PRO A 57 16.064 -0.474 1.024 1.00 0.00 N ATOM 875 CA PRO A 57 17.057 -1.248 1.826 1.00 0.00 C ATOM 876 C PRO A 57 16.515 -2.622 2.304 1.00 0.00 C ATOM 877 O PRO A 57 15.314 -2.772 2.555 1.00 0.00 O ATOM 878 CB PRO A 57 17.347 -0.299 3.014 1.00 0.00 C ATOM 879 CG PRO A 57 16.055 0.433 3.220 1.00 0.00 C ATOM 880 CD PRO A 57 15.473 0.631 1.830 1.00 0.00 C ATOM 0 HA PRO A 57 17.943 -1.512 1.249 1.00 0.00 H new ATOM 0 HB2 PRO A 57 17.637 -0.854 3.906 1.00 0.00 H new ATOM 0 HB3 PRO A 57 18.162 0.388 2.786 1.00 0.00 H new ATOM 0 HG2 PRO A 57 15.376 -0.140 3.852 1.00 0.00 H new ATOM 0 HG3 PRO A 57 16.221 1.389 3.716 1.00 0.00 H new ATOM 0 HD2 PRO A 57 14.384 0.576 1.843 1.00 0.00 H new ATOM 0 HD3 PRO A 57 15.738 1.607 1.423 1.00 0.00 H new ATOM 888 N LYS A 58 17.419 -3.620 2.349 1.00 0.00 N ATOM 889 CA LYS A 58 17.137 -4.992 2.836 1.00 0.00 C ATOM 890 C LYS A 58 16.503 -4.993 4.243 1.00 0.00 C ATOM 891 O LYS A 58 17.034 -4.372 5.170 1.00 0.00 O ATOM 892 CB LYS A 58 18.449 -5.829 2.835 1.00 0.00 C ATOM 893 CG LYS A 58 18.981 -6.187 1.429 1.00 0.00 C ATOM 894 CD LYS A 58 18.103 -7.231 0.700 1.00 0.00 C ATOM 895 CE LYS A 58 18.149 -8.620 1.360 1.00 0.00 C ATOM 896 NZ LYS A 58 19.512 -9.207 1.333 1.00 0.00 N ATOM 0 H LYS A 58 18.384 -3.497 2.043 1.00 0.00 H new ATOM 0 HA LYS A 58 16.412 -5.442 2.158 1.00 0.00 H new ATOM 0 HB2 LYS A 58 19.219 -5.274 3.370 1.00 0.00 H new ATOM 0 HB3 LYS A 58 18.277 -6.751 3.390 1.00 0.00 H new ATOM 0 HG2 LYS A 58 19.036 -5.281 0.825 1.00 0.00 H new ATOM 0 HG3 LYS A 58 19.997 -6.573 1.518 1.00 0.00 H new ATOM 0 HD2 LYS A 58 17.072 -6.879 0.678 1.00 0.00 H new ATOM 0 HD3 LYS A 58 18.433 -7.316 -0.335 1.00 0.00 H new ATOM 0 HE2 LYS A 58 17.809 -8.541 2.393 1.00 0.00 H new ATOM 0 HE3 LYS A 58 17.457 -9.288 0.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 19.465 -10.207 1.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 19.902 -9.136 0.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 20.126 -8.690 1.994 1.00 0.00 H new ATOM 910 N ALA A 59 15.368 -5.702 4.380 1.00 0.00 N ATOM 911 CA ALA A 59 14.608 -5.771 5.636 1.00 0.00 C ATOM 912 C ALA A 59 13.859 -7.101 5.751 1.00 0.00 C ATOM 913 O ALA A 59 13.040 -7.453 4.885 1.00 0.00 O ATOM 914 CB ALA A 59 13.626 -4.598 5.739 1.00 0.00 C ATOM 0 H ALA A 59 14.954 -6.243 3.621 1.00 0.00 H new ATOM 0 HA ALA A 59 15.317 -5.705 6.461 1.00 0.00 H new ATOM 0 HB1 ALA A 59 13.073 -4.667 6.676 1.00 0.00 H new ATOM 0 HB2 ALA A 59 14.178 -3.658 5.712 1.00 0.00 H new ATOM 0 HB3 ALA A 59 12.928 -4.633 4.902 1.00 0.00 H new ATOM 920 N SER A 60 14.165 -7.845 6.818 1.00 0.00 N ATOM 921 CA SER A 60 13.437 -9.059 7.182 1.00 0.00 C ATOM 922 C SER A 60 12.297 -8.683 8.145 1.00 0.00 C ATOM 923 O SER A 60 12.469 -8.688 9.372 1.00 0.00 O ATOM 924 CB SER A 60 14.422 -10.074 7.810 1.00 0.00 C ATOM 925 OG SER A 60 15.198 -9.485 8.850 1.00 0.00 O ATOM 0 H SER A 60 14.929 -7.619 7.455 1.00 0.00 H new ATOM 0 HA SER A 60 12.995 -9.529 6.304 1.00 0.00 H new ATOM 0 HB2 SER A 60 13.865 -10.922 8.208 1.00 0.00 H new ATOM 0 HB3 SER A 60 15.085 -10.463 7.037 1.00 0.00 H new ATOM 0 HG SER A 60 14.611 -8.978 9.449 1.00 0.00 H new ATOM 931 N VAL A 61 11.138 -8.315 7.567 1.00 0.00 N ATOM 932 CA VAL A 61 9.956 -7.878 8.332 1.00 0.00 C ATOM 933 C VAL A 61 8.671 -8.299 7.599 1.00 0.00 C ATOM 934 O VAL A 61 8.507 -8.022 6.411 1.00 0.00 O ATOM 935 CB VAL A 61 9.976 -6.314 8.607 1.00 0.00 C ATOM 936 CG1 VAL A 61 10.160 -5.487 7.308 1.00 0.00 C ATOM 937 CG2 VAL A 61 8.717 -5.851 9.405 1.00 0.00 C ATOM 0 H VAL A 61 10.995 -8.312 6.557 1.00 0.00 H new ATOM 0 HA VAL A 61 9.981 -8.369 9.305 1.00 0.00 H new ATOM 0 HB VAL A 61 10.849 -6.121 9.230 1.00 0.00 H new ATOM 0 HG11 VAL A 61 10.167 -4.424 7.551 1.00 0.00 H new ATOM 0 HG12 VAL A 61 11.104 -5.757 6.835 1.00 0.00 H new ATOM 0 HG13 VAL A 61 9.338 -5.697 6.623 1.00 0.00 H new ATOM 0 HG21 VAL A 61 8.768 -4.775 9.573 1.00 0.00 H new ATOM 0 HG22 VAL A 61 7.818 -6.087 8.835 1.00 0.00 H new ATOM 0 HG23 VAL A 61 8.684 -6.367 10.365 1.00 0.00 H new ATOM 947 N THR A 62 7.810 -9.037 8.319 1.00 0.00 N ATOM 948 CA THR A 62 6.462 -9.443 7.875 1.00 0.00 C ATOM 949 C THR A 62 5.583 -9.627 9.129 1.00 0.00 C ATOM 950 O THR A 62 5.945 -10.400 10.027 1.00 0.00 O ATOM 951 CB THR A 62 6.482 -10.781 7.035 1.00 0.00 C ATOM 952 OG1 THR A 62 7.411 -11.711 7.616 1.00 0.00 O ATOM 953 CG2 THR A 62 6.830 -10.560 5.545 1.00 0.00 C ATOM 0 H THR A 62 8.037 -9.378 9.253 1.00 0.00 H new ATOM 0 HA THR A 62 6.063 -8.667 7.222 1.00 0.00 H new ATOM 0 HB THR A 62 5.470 -11.185 7.068 1.00 0.00 H new ATOM 0 HG1 THR A 62 7.347 -11.670 8.593 1.00 0.00 H new ATOM 0 HG21 THR A 62 6.827 -11.518 5.025 1.00 0.00 H new ATOM 0 HG22 THR A 62 6.091 -9.899 5.093 1.00 0.00 H new ATOM 0 HG23 THR A 62 7.818 -10.107 5.465 1.00 0.00 H new ATOM 961 N GLY A 63 4.448 -8.911 9.194 1.00 0.00 N ATOM 962 CA GLY A 63 3.568 -8.954 10.365 1.00 0.00 C ATOM 963 C GLY A 63 2.576 -7.803 10.359 1.00 0.00 C ATOM 964 O GLY A 63 2.648 -6.897 11.195 1.00 0.00 O ATOM 0 H GLY A 63 4.122 -8.297 8.448 1.00 0.00 H new ATOM 0 HA2 GLY A 63 3.028 -9.901 10.381 1.00 0.00 H new ATOM 0 HA3 GLY A 63 4.168 -8.914 11.274 1.00 0.00 H new ATOM 968 N GLY A 64 1.654 -7.841 9.390 1.00 0.00 N ATOM 969 CA GLY A 64 0.650 -6.796 9.214 1.00 0.00 C ATOM 970 C GLY A 64 1.191 -5.644 8.367 1.00 0.00 C ATOM 971 O GLY A 64 0.964 -5.606 7.149 1.00 0.00 O ATOM 0 H GLY A 64 1.586 -8.597 8.709 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -0.236 -7.216 8.737 1.00 0.00 H new ATOM 0 HA3 GLY A 64 0.339 -6.419 10.188 1.00 0.00 H new ATOM 975 N GLY A 65 1.942 -4.729 9.019 1.00 0.00 N ATOM 976 CA GLY A 65 2.524 -3.560 8.354 1.00 0.00 C ATOM 977 C GLY A 65 1.460 -2.595 7.839 1.00 0.00 C ATOM 978 O GLY A 65 0.444 -2.383 8.513 1.00 0.00 O ATOM 0 H GLY A 65 2.156 -4.786 10.015 1.00 0.00 H new ATOM 0 HA2 GLY A 65 3.178 -3.037 9.051 1.00 0.00 H new ATOM 0 HA3 GLY A 65 3.145 -3.891 7.521 1.00 0.00 H new ATOM 982 N GLY A 66 1.718 -1.990 6.662 1.00 0.00 N ATOM 983 CA GLY A 66 0.747 -1.125 5.985 1.00 0.00 C ATOM 984 C GLY A 66 -0.477 -1.900 5.520 1.00 0.00 C ATOM 985 O GLY A 66 -0.373 -3.098 5.213 1.00 0.00 O ATOM 0 H GLY A 66 2.601 -2.090 6.162 1.00 0.00 H new ATOM 0 HA2 GLY A 66 0.437 -0.329 6.662 1.00 0.00 H new ATOM 0 HA3 GLY A 66 1.222 -0.648 5.128 1.00 0.00 H new ATOM 989 N GLU A 67 -1.635 -1.223 5.433 1.00 0.00 N ATOM 990 CA GLU A 67 -2.915 -1.873 5.129 1.00 0.00 C ATOM 991 C GLU A 67 -3.303 -1.641 3.663 1.00 0.00 C ATOM 992 O GLU A 67 -2.942 -0.620 3.057 1.00 0.00 O ATOM 993 CB GLU A 67 -4.059 -1.324 6.030 1.00 0.00 C ATOM 994 CG GLU A 67 -3.776 -1.256 7.543 1.00 0.00 C ATOM 995 CD GLU A 67 -5.069 -1.070 8.359 1.00 0.00 C ATOM 996 OE1 GLU A 67 -5.750 -0.031 8.169 1.00 0.00 O ATOM 997 OE2 GLU A 67 -5.430 -1.982 9.146 1.00 0.00 O ATOM 0 H GLU A 67 -1.707 -0.215 5.571 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.785 -2.938 5.320 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -4.312 -0.321 5.686 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -4.941 -1.946 5.876 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -3.274 -2.170 7.860 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -3.095 -0.431 7.749 1.00 0.00 H new ATOM 1004 N LEU A 68 -4.080 -2.583 3.120 1.00 0.00 N ATOM 1005 CA LEU A 68 -4.633 -2.509 1.771 1.00 0.00 C ATOM 1006 C LEU A 68 -6.155 -2.518 1.911 1.00 0.00 C ATOM 1007 O LEU A 68 -6.727 -3.567 2.213 1.00 0.00 O ATOM 1008 CB LEU A 68 -4.128 -3.686 0.892 1.00 0.00 C ATOM 1009 CG LEU A 68 -4.560 -3.655 -0.613 1.00 0.00 C ATOM 1010 CD1 LEU A 68 -4.075 -2.362 -1.317 1.00 0.00 C ATOM 1011 CD2 LEU A 68 -4.078 -4.927 -1.355 1.00 0.00 C ATOM 0 H LEU A 68 -4.345 -3.433 3.618 1.00 0.00 H new ATOM 0 HA LEU A 68 -4.307 -1.599 1.268 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -3.039 -3.705 0.936 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -4.481 -4.619 1.331 1.00 0.00 H new ATOM 0 HG LEU A 68 -5.649 -3.647 -0.647 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -4.392 -2.374 -2.360 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -4.504 -1.493 -0.818 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -2.987 -2.308 -1.270 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -4.391 -4.880 -2.398 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -2.991 -4.988 -1.305 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -4.513 -5.809 -0.885 1.00 0.00 H new ATOM 1023 N ALA A 69 -6.803 -1.360 1.784 1.00 0.00 N ATOM 1024 CA ALA A 69 -8.233 -1.228 2.100 1.00 0.00 C ATOM 1025 C ALA A 69 -9.113 -1.535 0.865 1.00 0.00 C ATOM 1026 O ALA A 69 -9.069 -0.827 -0.141 1.00 0.00 O ATOM 1027 CB ALA A 69 -8.524 0.157 2.687 1.00 0.00 C ATOM 0 H ALA A 69 -6.364 -0.497 1.465 1.00 0.00 H new ATOM 0 HA ALA A 69 -8.490 -1.968 2.858 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -9.587 0.239 2.916 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -7.945 0.294 3.600 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -8.248 0.924 1.963 1.00 0.00 H new ATOM 1033 N PHE A 70 -9.904 -2.609 0.974 1.00 0.00 N ATOM 1034 CA PHE A 70 -10.818 -3.094 -0.061 1.00 0.00 C ATOM 1035 C PHE A 70 -12.218 -2.520 0.225 1.00 0.00 C ATOM 1036 O PHE A 70 -12.867 -2.902 1.203 1.00 0.00 O ATOM 1037 CB PHE A 70 -10.877 -4.650 -0.016 1.00 0.00 C ATOM 1038 CG PHE A 70 -9.599 -5.398 -0.383 1.00 0.00 C ATOM 1039 CD1 PHE A 70 -8.507 -5.406 0.473 1.00 0.00 C ATOM 1040 CD2 PHE A 70 -9.507 -6.121 -1.573 1.00 0.00 C ATOM 1041 CE1 PHE A 70 -7.359 -6.098 0.151 1.00 0.00 C ATOM 1042 CE2 PHE A 70 -8.360 -6.812 -1.896 1.00 0.00 C ATOM 1043 CZ PHE A 70 -7.285 -6.803 -1.033 1.00 0.00 C ATOM 0 H PHE A 70 -9.924 -3.183 1.817 1.00 0.00 H new ATOM 0 HA PHE A 70 -10.473 -2.779 -1.046 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -11.169 -4.950 0.990 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -11.669 -4.980 -0.689 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -8.557 -4.862 1.405 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -10.348 -6.139 -2.251 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -6.516 -6.088 0.826 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -8.303 -7.360 -2.825 1.00 0.00 H new ATOM 0 HZ PHE A 70 -6.386 -7.347 -1.283 1.00 0.00 H new ATOM 1053 N ARG A 71 -12.657 -1.569 -0.599 1.00 0.00 N ATOM 1054 CA ARG A 71 -13.952 -0.897 -0.412 1.00 0.00 C ATOM 1055 C ARG A 71 -15.073 -1.588 -1.190 1.00 0.00 C ATOM 1056 O ARG A 71 -14.965 -1.839 -2.397 1.00 0.00 O ATOM 1057 CB ARG A 71 -13.866 0.572 -0.862 1.00 0.00 C ATOM 1058 CG ARG A 71 -12.717 1.362 -0.212 1.00 0.00 C ATOM 1059 CD ARG A 71 -13.003 2.852 -0.199 1.00 0.00 C ATOM 1060 NE ARG A 71 -13.076 3.435 -1.547 1.00 0.00 N ATOM 1061 CZ ARG A 71 -14.001 4.312 -1.948 1.00 0.00 C ATOM 1062 NH1 ARG A 71 -15.010 4.658 -1.155 1.00 0.00 N ATOM 1063 NH2 ARG A 71 -13.935 4.818 -3.156 1.00 0.00 N ATOM 0 H ARG A 71 -12.133 -1.241 -1.410 1.00 0.00 H new ATOM 0 HA ARG A 71 -14.185 -0.950 0.651 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -13.746 0.603 -1.945 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -14.809 1.067 -0.631 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -12.565 1.011 0.809 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -11.791 1.173 -0.756 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -13.945 3.031 0.320 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -12.224 3.361 0.369 1.00 0.00 H new ATOM 0 HE ARG A 71 -12.369 3.149 -2.225 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -15.088 4.252 -0.222 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -15.706 5.329 -1.479 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -13.180 4.542 -3.784 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -14.638 5.488 -3.467 1.00 0.00 H new ATOM 1077 N VAL A 72 -16.147 -1.888 -0.454 1.00 0.00 N ATOM 1078 CA VAL A 72 -17.360 -2.553 -0.979 1.00 0.00 C ATOM 1079 C VAL A 72 -18.611 -1.746 -0.591 1.00 0.00 C ATOM 1080 O VAL A 72 -18.562 -0.915 0.328 1.00 0.00 O ATOM 1081 CB VAL A 72 -17.529 -4.025 -0.437 1.00 0.00 C ATOM 1082 CG1 VAL A 72 -16.322 -4.924 -0.767 1.00 0.00 C ATOM 1083 CG2 VAL A 72 -17.839 -4.052 1.078 1.00 0.00 C ATOM 0 H VAL A 72 -16.207 -1.675 0.542 1.00 0.00 H new ATOM 0 HA VAL A 72 -17.246 -2.600 -2.062 1.00 0.00 H new ATOM 0 HB VAL A 72 -18.389 -4.439 -0.963 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -16.494 -5.924 -0.370 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -16.195 -4.980 -1.848 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -15.422 -4.505 -0.317 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -17.948 -5.085 1.409 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -17.023 -3.580 1.625 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -18.765 -3.510 1.270 1.00 0.00 H new ATOM 1093 N GLU A 73 -19.715 -1.995 -1.313 1.00 0.00 N ATOM 1094 CA GLU A 73 -20.971 -1.236 -1.170 1.00 0.00 C ATOM 1095 C GLU A 73 -21.665 -1.448 0.202 1.00 0.00 C ATOM 1096 O GLU A 73 -22.260 -0.495 0.726 1.00 0.00 O ATOM 1097 CB GLU A 73 -21.932 -1.582 -2.342 1.00 0.00 C ATOM 1098 CG GLU A 73 -22.381 -3.057 -2.394 1.00 0.00 C ATOM 1099 CD GLU A 73 -23.181 -3.421 -3.654 1.00 0.00 C ATOM 1100 OE1 GLU A 73 -24.401 -3.166 -3.690 1.00 0.00 O ATOM 1101 OE2 GLU A 73 -22.584 -3.965 -4.614 1.00 0.00 O ATOM 0 H GLU A 73 -19.763 -2.732 -2.016 1.00 0.00 H new ATOM 0 HA GLU A 73 -20.713 -0.178 -1.210 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -22.817 -0.950 -2.267 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -21.441 -1.333 -3.282 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -21.500 -3.697 -2.338 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -22.989 -3.273 -1.515 1.00 0.00 H new ATOM 1108 N ASN A 74 -21.591 -2.677 0.791 1.00 0.00 N ATOM 1109 CA ASN A 74 -22.209 -2.949 2.115 1.00 0.00 C ATOM 1110 C ASN A 74 -21.696 -4.261 2.741 1.00 0.00 C ATOM 1111 O ASN A 74 -20.885 -4.982 2.148 1.00 0.00 O ATOM 1112 CB ASN A 74 -23.771 -2.987 2.024 1.00 0.00 C ATOM 1113 CG ASN A 74 -24.331 -4.272 1.397 1.00 0.00 C ATOM 1114 OD1 ASN A 74 -24.633 -5.238 2.098 1.00 0.00 O ATOM 1115 ND2 ASN A 74 -24.493 -4.290 0.090 1.00 0.00 N ATOM 0 H ASN A 74 -21.117 -3.479 0.375 1.00 0.00 H new ATOM 0 HA ASN A 74 -21.912 -2.124 2.762 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -24.186 -2.874 3.026 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -24.111 -2.132 1.440 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -24.877 -5.118 -0.365 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -24.234 -3.476 -0.467 1.00 0.00 H new ATOM 1122 N ASP A 75 -22.211 -4.530 3.961 1.00 0.00 N ATOM 1123 CA ASP A 75 -21.742 -5.591 4.886 1.00 0.00 C ATOM 1124 C ASP A 75 -21.757 -6.983 4.258 1.00 0.00 C ATOM 1125 O ASP A 75 -20.930 -7.837 4.607 1.00 0.00 O ATOM 1126 CB ASP A 75 -22.585 -5.570 6.191 1.00 0.00 C ATOM 1127 CG ASP A 75 -24.096 -5.700 5.938 1.00 0.00 C ATOM 1128 OD1 ASP A 75 -24.726 -4.690 5.547 1.00 0.00 O ATOM 1129 OD2 ASP A 75 -24.661 -6.798 6.114 1.00 0.00 O ATOM 0 H ASP A 75 -22.992 -3.997 4.344 1.00 0.00 H new ATOM 0 HA ASP A 75 -20.700 -5.372 5.120 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -22.260 -6.384 6.839 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -22.391 -4.640 6.726 1.00 0.00 H new ATOM 1134 N ALA A 76 -22.720 -7.201 3.349 1.00 0.00 N ATOM 1135 CA ALA A 76 -22.897 -8.483 2.668 1.00 0.00 C ATOM 1136 C ALA A 76 -21.666 -8.801 1.818 1.00 0.00 C ATOM 1137 O ALA A 76 -21.107 -9.887 1.901 1.00 0.00 O ATOM 1138 CB ALA A 76 -24.168 -8.472 1.803 1.00 0.00 C ATOM 0 H ALA A 76 -23.396 -6.490 3.069 1.00 0.00 H new ATOM 0 HA ALA A 76 -23.012 -9.263 3.421 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -24.278 -9.436 1.306 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -25.037 -8.288 2.435 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -24.091 -7.684 1.053 1.00 0.00 H new ATOM 1144 N GLN A 77 -21.227 -7.784 1.054 1.00 0.00 N ATOM 1145 CA GLN A 77 -20.083 -7.884 0.136 1.00 0.00 C ATOM 1146 C GLN A 77 -18.741 -8.058 0.876 1.00 0.00 C ATOM 1147 O GLN A 77 -17.790 -8.583 0.307 1.00 0.00 O ATOM 1148 CB GLN A 77 -20.030 -6.630 -0.771 1.00 0.00 C ATOM 1149 CG GLN A 77 -21.292 -6.386 -1.615 1.00 0.00 C ATOM 1150 CD GLN A 77 -21.533 -7.424 -2.716 1.00 0.00 C ATOM 1151 OE1 GLN A 77 -20.598 -7.990 -3.285 1.00 0.00 O ATOM 1152 NE2 GLN A 77 -22.796 -7.668 -3.035 1.00 0.00 N ATOM 0 H GLN A 77 -21.662 -6.862 1.058 1.00 0.00 H new ATOM 0 HA GLN A 77 -20.230 -8.778 -0.470 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -19.854 -5.755 -0.146 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -19.175 -6.720 -1.441 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -22.158 -6.370 -0.953 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -21.222 -5.399 -2.073 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -23.548 -7.183 -2.546 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -23.016 -8.340 -3.770 1.00 0.00 H new ATOM 1161 N VAL A 78 -18.692 -7.628 2.157 1.00 0.00 N ATOM 1162 CA VAL A 78 -17.534 -7.873 3.058 1.00 0.00 C ATOM 1163 C VAL A 78 -17.411 -9.382 3.357 1.00 0.00 C ATOM 1164 O VAL A 78 -16.317 -9.956 3.356 1.00 0.00 O ATOM 1165 CB VAL A 78 -17.683 -7.099 4.429 1.00 0.00 C ATOM 1166 CG1 VAL A 78 -16.493 -7.368 5.388 1.00 0.00 C ATOM 1167 CG2 VAL A 78 -17.863 -5.586 4.209 1.00 0.00 C ATOM 0 H VAL A 78 -19.448 -7.104 2.597 1.00 0.00 H new ATOM 0 HA VAL A 78 -16.643 -7.509 2.547 1.00 0.00 H new ATOM 0 HB VAL A 78 -18.584 -7.487 4.904 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -16.641 -6.815 6.315 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -16.436 -8.434 5.607 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -15.565 -7.044 4.916 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -17.962 -5.087 5.173 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -16.995 -5.189 3.683 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -18.760 -5.409 3.615 1.00 0.00 H new ATOM 1177 N ASP A 79 -18.586 -10.001 3.588 1.00 0.00 N ATOM 1178 CA ASP A 79 -18.737 -11.417 3.956 1.00 0.00 C ATOM 1179 C ASP A 79 -18.466 -12.335 2.744 1.00 0.00 C ATOM 1180 O ASP A 79 -17.937 -13.446 2.892 1.00 0.00 O ATOM 1181 CB ASP A 79 -20.176 -11.609 4.533 1.00 0.00 C ATOM 1182 CG ASP A 79 -20.646 -13.069 4.619 1.00 0.00 C ATOM 1183 OD1 ASP A 79 -20.381 -13.744 5.632 1.00 0.00 O ATOM 1184 OD2 ASP A 79 -21.308 -13.545 3.669 1.00 0.00 O ATOM 0 H ASP A 79 -19.479 -9.513 3.521 1.00 0.00 H new ATOM 0 HA ASP A 79 -18.005 -11.696 4.714 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -20.214 -11.170 5.530 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -20.878 -11.052 3.913 1.00 0.00 H new ATOM 1189 N GLU A 80 -18.837 -11.850 1.546 1.00 0.00 N ATOM 1190 CA GLU A 80 -18.594 -12.562 0.274 1.00 0.00 C ATOM 1191 C GLU A 80 -17.082 -12.641 0.017 1.00 0.00 C ATOM 1192 O GLU A 80 -16.538 -13.695 -0.338 1.00 0.00 O ATOM 1193 CB GLU A 80 -19.335 -11.845 -0.884 1.00 0.00 C ATOM 1194 CG GLU A 80 -20.840 -11.663 -0.618 1.00 0.00 C ATOM 1195 CD GLU A 80 -21.649 -11.100 -1.798 1.00 0.00 C ATOM 1196 OE1 GLU A 80 -21.304 -11.372 -2.967 1.00 0.00 O ATOM 1197 OE2 GLU A 80 -22.672 -10.426 -1.555 1.00 0.00 O ATOM 0 H GLU A 80 -19.313 -10.955 1.430 1.00 0.00 H new ATOM 0 HA GLU A 80 -18.984 -13.578 0.335 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -18.881 -10.868 -1.048 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -19.201 -12.417 -1.802 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -21.262 -12.627 -0.336 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -20.964 -10.998 0.237 1.00 0.00 H new ATOM 1204 N THR A 81 -16.433 -11.489 0.245 1.00 0.00 N ATOM 1205 CA THR A 81 -14.983 -11.317 0.144 1.00 0.00 C ATOM 1206 C THR A 81 -14.247 -12.191 1.191 1.00 0.00 C ATOM 1207 O THR A 81 -13.200 -12.772 0.893 1.00 0.00 O ATOM 1208 CB THR A 81 -14.633 -9.802 0.333 1.00 0.00 C ATOM 1209 OG1 THR A 81 -15.286 -9.013 -0.671 1.00 0.00 O ATOM 1210 CG2 THR A 81 -13.145 -9.525 0.268 1.00 0.00 C ATOM 0 H THR A 81 -16.918 -10.632 0.511 1.00 0.00 H new ATOM 0 HA THR A 81 -14.650 -11.642 -0.842 1.00 0.00 H new ATOM 0 HB THR A 81 -14.983 -9.532 1.329 1.00 0.00 H new ATOM 0 HG1 THR A 81 -16.240 -8.938 -0.459 1.00 0.00 H new ATOM 0 HG21 THR A 81 -12.967 -8.458 0.406 1.00 0.00 H new ATOM 0 HG22 THR A 81 -12.636 -10.082 1.055 1.00 0.00 H new ATOM 0 HG23 THR A 81 -12.759 -9.835 -0.703 1.00 0.00 H new ATOM 1218 N PHE A 82 -14.847 -12.295 2.400 1.00 0.00 N ATOM 1219 CA PHE A 82 -14.334 -13.118 3.516 1.00 0.00 C ATOM 1220 C PHE A 82 -14.139 -14.576 3.064 1.00 0.00 C ATOM 1221 O PHE A 82 -13.021 -15.092 3.022 1.00 0.00 O ATOM 1222 CB PHE A 82 -15.332 -13.022 4.721 1.00 0.00 C ATOM 1223 CG PHE A 82 -15.044 -13.906 5.957 1.00 0.00 C ATOM 1224 CD1 PHE A 82 -15.408 -15.259 5.986 1.00 0.00 C ATOM 1225 CD2 PHE A 82 -14.456 -13.375 7.103 1.00 0.00 C ATOM 1226 CE1 PHE A 82 -15.184 -16.037 7.103 1.00 0.00 C ATOM 1227 CE2 PHE A 82 -14.229 -14.157 8.221 1.00 0.00 C ATOM 1228 CZ PHE A 82 -14.593 -15.486 8.220 1.00 0.00 C ATOM 0 H PHE A 82 -15.711 -11.803 2.629 1.00 0.00 H new ATOM 0 HA PHE A 82 -13.361 -12.744 3.834 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -15.364 -11.983 5.050 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -16.328 -13.271 4.354 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -15.873 -15.701 5.117 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -14.172 -12.333 7.119 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -15.472 -17.078 7.102 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -13.766 -13.725 9.096 1.00 0.00 H new ATOM 0 HZ PHE A 82 -14.415 -16.096 9.094 1.00 0.00 H new ATOM 1238 N ALA A 83 -15.259 -15.194 2.663 1.00 0.00 N ATOM 1239 CA ALA A 83 -15.326 -16.629 2.341 1.00 0.00 C ATOM 1240 C ALA A 83 -14.550 -16.976 1.063 1.00 0.00 C ATOM 1241 O ALA A 83 -14.005 -18.076 0.949 1.00 0.00 O ATOM 1242 CB ALA A 83 -16.790 -17.066 2.224 1.00 0.00 C ATOM 0 H ALA A 83 -16.150 -14.710 2.552 1.00 0.00 H new ATOM 0 HA ALA A 83 -14.849 -17.175 3.155 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -16.835 -18.129 1.986 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -17.301 -16.885 3.170 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -17.278 -16.496 1.433 1.00 0.00 H new ATOM 1248 N GLY A 84 -14.524 -16.034 0.107 1.00 0.00 N ATOM 1249 CA GLY A 84 -13.762 -16.201 -1.134 1.00 0.00 C ATOM 1250 C GLY A 84 -12.255 -16.290 -0.900 1.00 0.00 C ATOM 1251 O GLY A 84 -11.590 -17.196 -1.427 1.00 0.00 O ATOM 0 H GLY A 84 -15.024 -15.148 0.173 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -14.099 -17.104 -1.643 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -13.972 -15.363 -1.799 1.00 0.00 H new ATOM 1255 N TRP A 85 -11.737 -15.371 -0.067 1.00 0.00 N ATOM 1256 CA TRP A 85 -10.325 -15.370 0.359 1.00 0.00 C ATOM 1257 C TRP A 85 -10.024 -16.658 1.145 1.00 0.00 C ATOM 1258 O TRP A 85 -8.963 -17.268 0.954 1.00 0.00 O ATOM 1259 CB TRP A 85 -10.029 -14.120 1.220 1.00 0.00 C ATOM 1260 CG TRP A 85 -10.049 -12.793 0.496 1.00 0.00 C ATOM 1261 CD1 TRP A 85 -10.233 -12.558 -0.842 1.00 0.00 C ATOM 1262 CD2 TRP A 85 -9.877 -11.505 1.103 1.00 0.00 C ATOM 1263 NE1 TRP A 85 -10.152 -11.211 -1.096 1.00 0.00 N ATOM 1264 CE2 TRP A 85 -9.937 -10.549 0.082 1.00 0.00 C ATOM 1265 CE3 TRP A 85 -9.671 -11.071 2.408 1.00 0.00 C ATOM 1266 CZ2 TRP A 85 -9.791 -9.192 0.326 1.00 0.00 C ATOM 1267 CZ3 TRP A 85 -9.533 -9.716 2.651 1.00 0.00 C ATOM 1268 CH2 TRP A 85 -9.594 -8.793 1.615 1.00 0.00 C ATOM 0 H TRP A 85 -12.285 -14.608 0.330 1.00 0.00 H new ATOM 0 HA TRP A 85 -9.681 -15.337 -0.520 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -10.758 -14.080 2.029 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -9.049 -14.245 1.680 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -10.415 -13.319 -1.586 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -10.238 -10.775 -2.014 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -9.619 -11.781 3.220 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -9.832 -8.474 -0.479 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -9.375 -9.371 3.662 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -9.484 -7.741 1.834 1.00 0.00 H new ATOM 1279 N LYS A 86 -10.950 -17.031 2.050 1.00 0.00 N ATOM 1280 CA LYS A 86 -10.826 -18.242 2.893 1.00 0.00 C ATOM 1281 C LYS A 86 -10.630 -19.485 2.014 1.00 0.00 C ATOM 1282 O LYS A 86 -9.734 -20.300 2.252 1.00 0.00 O ATOM 1283 CB LYS A 86 -12.078 -18.389 3.798 1.00 0.00 C ATOM 1284 CG LYS A 86 -12.177 -19.725 4.573 1.00 0.00 C ATOM 1285 CD LYS A 86 -13.354 -19.768 5.571 1.00 0.00 C ATOM 1286 CE LYS A 86 -14.700 -19.356 4.947 1.00 0.00 C ATOM 1287 NZ LYS A 86 -15.826 -19.560 5.885 1.00 0.00 N ATOM 0 H LYS A 86 -11.806 -16.503 2.219 1.00 0.00 H new ATOM 0 HA LYS A 86 -9.950 -18.143 3.534 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -12.086 -17.569 4.516 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -12.969 -18.279 3.179 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -12.284 -20.543 3.861 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -11.245 -19.893 5.113 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -13.442 -20.777 5.974 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -13.134 -19.108 6.410 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -14.658 -18.308 4.652 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -14.873 -19.936 4.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -16.708 -19.224 5.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -15.914 -20.572 6.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -15.649 -19.027 6.761 1.00 0.00 H new ATOM 1301 N ALA A 87 -11.456 -19.564 0.967 1.00 0.00 N ATOM 1302 CA ALA A 87 -11.467 -20.678 0.010 1.00 0.00 C ATOM 1303 C ALA A 87 -10.237 -20.662 -0.921 1.00 0.00 C ATOM 1304 O ALA A 87 -9.882 -21.682 -1.514 1.00 0.00 O ATOM 1305 CB ALA A 87 -12.763 -20.622 -0.809 1.00 0.00 C ATOM 0 H ALA A 87 -12.148 -18.845 0.756 1.00 0.00 H new ATOM 0 HA ALA A 87 -11.421 -21.611 0.572 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -12.779 -21.446 -1.522 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -13.620 -20.704 -0.140 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -12.813 -19.676 -1.347 1.00 0.00 H new ATOM 1311 N SER A 88 -9.602 -19.479 -1.040 1.00 0.00 N ATOM 1312 CA SER A 88 -8.402 -19.263 -1.876 1.00 0.00 C ATOM 1313 C SER A 88 -7.099 -19.258 -1.027 1.00 0.00 C ATOM 1314 O SER A 88 -6.001 -19.033 -1.549 1.00 0.00 O ATOM 1315 CB SER A 88 -8.556 -17.914 -2.635 1.00 0.00 C ATOM 1316 OG SER A 88 -7.456 -17.640 -3.499 1.00 0.00 O ATOM 0 H SER A 88 -9.910 -18.637 -0.554 1.00 0.00 H new ATOM 0 HA SER A 88 -8.319 -20.087 -2.585 1.00 0.00 H new ATOM 0 HB2 SER A 88 -9.476 -17.934 -3.220 1.00 0.00 H new ATOM 0 HB3 SER A 88 -8.655 -17.104 -1.912 1.00 0.00 H new ATOM 0 HG SER A 88 -6.668 -18.136 -3.193 1.00 0.00 H new ATOM 1322 N GLY A 89 -7.251 -19.532 0.291 1.00 0.00 N ATOM 1323 CA GLY A 89 -6.120 -19.825 1.179 1.00 0.00 C ATOM 1324 C GLY A 89 -5.492 -18.592 1.830 1.00 0.00 C ATOM 1325 O GLY A 89 -4.273 -18.391 1.744 1.00 0.00 O ATOM 0 H GLY A 89 -8.158 -19.554 0.758 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -6.456 -20.504 1.963 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -5.353 -20.350 0.610 1.00 0.00 H new ATOM 1329 N VAL A 90 -6.324 -17.766 2.485 1.00 0.00 N ATOM 1330 CA VAL A 90 -5.848 -16.616 3.286 1.00 0.00 C ATOM 1331 C VAL A 90 -5.719 -17.050 4.774 1.00 0.00 C ATOM 1332 O VAL A 90 -6.412 -17.986 5.203 1.00 0.00 O ATOM 1333 CB VAL A 90 -6.832 -15.383 3.122 1.00 0.00 C ATOM 1334 CG1 VAL A 90 -8.127 -15.557 3.943 1.00 0.00 C ATOM 1335 CG2 VAL A 90 -6.149 -14.032 3.440 1.00 0.00 C ATOM 0 H VAL A 90 -7.339 -17.871 2.478 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.868 -16.298 2.930 1.00 0.00 H new ATOM 0 HB VAL A 90 -7.111 -15.362 2.069 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -8.769 -14.688 3.799 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -8.650 -16.454 3.611 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -7.878 -15.652 5.000 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -6.867 -13.222 3.312 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -5.790 -14.039 4.469 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -5.308 -13.881 2.763 1.00 0.00 H new ATOM 1345 N ALA A 91 -4.825 -16.396 5.543 1.00 0.00 N ATOM 1346 CA ALA A 91 -4.640 -16.692 6.986 1.00 0.00 C ATOM 1347 C ALA A 91 -5.859 -16.223 7.800 1.00 0.00 C ATOM 1348 O ALA A 91 -6.434 -17.013 8.555 1.00 0.00 O ATOM 1349 CB ALA A 91 -3.350 -16.056 7.513 1.00 0.00 C ATOM 0 H ALA A 91 -4.216 -15.657 5.191 1.00 0.00 H new ATOM 0 HA ALA A 91 -4.552 -17.772 7.102 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -3.237 -16.287 8.572 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -2.497 -16.453 6.962 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -3.397 -14.975 7.380 1.00 0.00 H new ATOM 1355 N MET A 92 -6.227 -14.925 7.646 1.00 0.00 N ATOM 1356 CA MET A 92 -7.503 -14.373 8.177 1.00 0.00 C ATOM 1357 C MET A 92 -7.573 -14.404 9.725 1.00 0.00 C ATOM 1358 O MET A 92 -8.069 -15.378 10.312 1.00 0.00 O ATOM 1359 CB MET A 92 -8.733 -15.100 7.546 1.00 0.00 C ATOM 1360 CG MET A 92 -10.099 -14.634 8.051 1.00 0.00 C ATOM 1361 SD MET A 92 -11.462 -15.575 7.346 1.00 0.00 S ATOM 1362 CE MET A 92 -11.296 -15.241 5.598 1.00 0.00 C ATOM 0 H MET A 92 -5.655 -14.237 7.156 1.00 0.00 H new ATOM 0 HA MET A 92 -7.533 -13.323 7.885 1.00 0.00 H new ATOM 0 HB2 MET A 92 -8.699 -14.965 6.465 1.00 0.00 H new ATOM 0 HB3 MET A 92 -8.639 -16.169 7.737 1.00 0.00 H new ATOM 0 HG2 MET A 92 -10.128 -14.720 9.137 1.00 0.00 H new ATOM 0 HG3 MET A 92 -10.229 -13.579 7.811 1.00 0.00 H new ATOM 0 HE1 MET A 92 -12.277 -15.031 5.173 1.00 0.00 H new ATOM 0 HE2 MET A 92 -10.646 -14.378 5.453 1.00 0.00 H new ATOM 0 HE3 MET A 92 -10.864 -16.109 5.101 1.00 0.00 H new ATOM 1372 N LEU A 93 -6.997 -13.387 10.392 1.00 0.00 N ATOM 1373 CA LEU A 93 -7.134 -13.238 11.858 1.00 0.00 C ATOM 1374 C LEU A 93 -7.838 -11.897 12.208 1.00 0.00 C ATOM 1375 O LEU A 93 -7.191 -10.898 12.523 1.00 0.00 O ATOM 1376 CB LEU A 93 -5.753 -13.446 12.617 1.00 0.00 C ATOM 1377 CG LEU A 93 -4.392 -13.058 11.915 1.00 0.00 C ATOM 1378 CD1 LEU A 93 -3.996 -14.047 10.798 1.00 0.00 C ATOM 1379 CD2 LEU A 93 -4.389 -11.605 11.405 1.00 0.00 C ATOM 0 H LEU A 93 -6.436 -12.661 9.947 1.00 0.00 H new ATOM 0 HA LEU A 93 -7.778 -14.038 12.223 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -5.808 -12.882 13.548 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -5.688 -14.500 12.886 1.00 0.00 H new ATOM 0 HG LEU A 93 -3.628 -13.131 12.689 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -3.053 -13.732 10.350 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -3.881 -15.045 11.220 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -4.773 -14.063 10.034 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -3.432 -11.388 10.931 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -5.192 -11.472 10.680 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -4.541 -10.925 12.243 1.00 0.00 H new ATOM 1391 N GLN A 94 -9.189 -11.930 12.136 1.00 0.00 N ATOM 1392 CA GLN A 94 -10.108 -10.852 12.570 1.00 0.00 C ATOM 1393 C GLN A 94 -11.544 -11.277 12.231 1.00 0.00 C ATOM 1394 O GLN A 94 -11.811 -11.707 11.099 1.00 0.00 O ATOM 1395 CB GLN A 94 -9.805 -9.470 11.900 1.00 0.00 C ATOM 1396 CG GLN A 94 -10.794 -8.323 12.249 1.00 0.00 C ATOM 1397 CD GLN A 94 -10.828 -7.935 13.736 1.00 0.00 C ATOM 1398 OE1 GLN A 94 -9.823 -8.022 14.440 1.00 0.00 O ATOM 1399 NE2 GLN A 94 -11.992 -7.519 14.223 1.00 0.00 N ATOM 0 H GLN A 94 -9.687 -12.737 11.761 1.00 0.00 H new ATOM 0 HA GLN A 94 -9.970 -10.714 13.642 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -8.801 -9.159 12.188 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -9.800 -9.604 10.818 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -10.529 -7.442 11.664 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -11.797 -8.620 11.942 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -12.807 -7.458 13.613 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -12.070 -7.261 15.207 1.00 0.00 H new ATOM 1408 N GLN A 95 -12.452 -11.174 13.205 1.00 0.00 N ATOM 1409 CA GLN A 95 -13.889 -11.332 12.966 1.00 0.00 C ATOM 1410 C GLN A 95 -14.439 -9.990 12.436 1.00 0.00 C ATOM 1411 O GLN A 95 -14.224 -8.958 13.087 1.00 0.00 O ATOM 1412 CB GLN A 95 -14.604 -11.735 14.278 1.00 0.00 C ATOM 1413 CG GLN A 95 -14.086 -13.039 14.909 1.00 0.00 C ATOM 1414 CD GLN A 95 -14.705 -13.311 16.275 1.00 0.00 C ATOM 1415 OE1 GLN A 95 -14.170 -12.892 17.303 1.00 0.00 O ATOM 1416 NE2 GLN A 95 -15.845 -13.982 16.296 1.00 0.00 N ATOM 0 H GLN A 95 -12.213 -10.980 14.177 1.00 0.00 H new ATOM 0 HA GLN A 95 -14.067 -12.119 12.233 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -14.493 -10.927 15.001 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -15.670 -11.841 14.079 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -14.304 -13.873 14.242 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -13.002 -12.985 15.009 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -16.258 -14.313 15.424 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -16.311 -14.168 17.184 1.00 0.00 H new ATOM 1425 N PRO A 96 -15.100 -9.975 11.225 1.00 0.00 N ATOM 1426 CA PRO A 96 -15.767 -8.768 10.670 1.00 0.00 C ATOM 1427 C PRO A 96 -16.669 -8.073 11.716 1.00 0.00 C ATOM 1428 O PRO A 96 -17.716 -8.608 12.084 1.00 0.00 O ATOM 1429 CB PRO A 96 -16.597 -9.324 9.482 1.00 0.00 C ATOM 1430 CG PRO A 96 -15.877 -10.565 9.049 1.00 0.00 C ATOM 1431 CD PRO A 96 -15.213 -11.132 10.294 1.00 0.00 C ATOM 0 HA PRO A 96 -15.054 -8.001 10.367 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -17.620 -9.547 9.786 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -16.657 -8.599 8.670 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -16.571 -11.286 8.616 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -15.136 -10.337 8.283 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -15.809 -11.934 10.730 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -14.234 -11.552 10.064 1.00 0.00 H new ATOM 1439 N ALA A 97 -16.220 -6.913 12.222 1.00 0.00 N ATOM 1440 CA ALA A 97 -16.859 -6.208 13.349 1.00 0.00 C ATOM 1441 C ALA A 97 -17.356 -4.817 12.926 1.00 0.00 C ATOM 1442 O ALA A 97 -16.691 -4.119 12.153 1.00 0.00 O ATOM 1443 CB ALA A 97 -15.846 -6.096 14.502 1.00 0.00 C ATOM 0 H ALA A 97 -15.397 -6.433 11.859 1.00 0.00 H new ATOM 0 HA ALA A 97 -17.730 -6.775 13.678 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -16.307 -5.576 15.342 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -15.541 -7.094 14.816 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -14.972 -5.538 14.166 1.00 0.00 H new ATOM 1449 N LYS A 98 -18.547 -4.439 13.425 1.00 0.00 N ATOM 1450 CA LYS A 98 -19.109 -3.094 13.252 1.00 0.00 C ATOM 1451 C LYS A 98 -18.320 -2.074 14.090 1.00 0.00 C ATOM 1452 O LYS A 98 -18.494 -1.983 15.305 1.00 0.00 O ATOM 1453 CB LYS A 98 -20.635 -3.071 13.615 1.00 0.00 C ATOM 1454 CG LYS A 98 -21.585 -3.264 12.420 1.00 0.00 C ATOM 1455 CD LYS A 98 -21.383 -2.197 11.316 1.00 0.00 C ATOM 1456 CE LYS A 98 -21.974 -0.822 11.665 1.00 0.00 C ATOM 1457 NZ LYS A 98 -23.461 -0.849 11.696 1.00 0.00 N ATOM 0 H LYS A 98 -19.147 -5.065 13.962 1.00 0.00 H new ATOM 0 HA LYS A 98 -19.019 -2.814 12.202 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -20.832 -3.854 14.348 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -20.866 -2.120 14.095 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -21.429 -4.255 11.994 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -22.616 -3.226 12.771 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -20.316 -2.085 11.123 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -21.838 -2.553 10.392 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -21.596 -0.500 12.636 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -21.639 -0.087 10.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -23.824 0.120 11.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -23.819 -1.260 10.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -23.781 -1.427 12.500 1.00 0.00 H new ATOM 1471 N MET A 99 -17.430 -1.345 13.413 1.00 0.00 N ATOM 1472 CA MET A 99 -16.628 -0.253 14.003 1.00 0.00 C ATOM 1473 C MET A 99 -17.260 1.099 13.607 1.00 0.00 C ATOM 1474 O MET A 99 -18.162 1.131 12.755 1.00 0.00 O ATOM 1475 CB MET A 99 -15.164 -0.376 13.485 1.00 0.00 C ATOM 1476 CG MET A 99 -14.132 0.572 14.111 1.00 0.00 C ATOM 1477 SD MET A 99 -12.467 0.266 13.488 1.00 0.00 S ATOM 1478 CE MET A 99 -12.193 -1.419 14.032 1.00 0.00 C ATOM 0 H MET A 99 -17.238 -1.494 12.422 1.00 0.00 H new ATOM 0 HA MET A 99 -16.615 -0.317 15.091 1.00 0.00 H new ATOM 0 HB2 MET A 99 -14.829 -1.400 13.649 1.00 0.00 H new ATOM 0 HB3 MET A 99 -15.169 -0.211 12.408 1.00 0.00 H new ATOM 0 HG2 MET A 99 -14.414 1.604 13.901 1.00 0.00 H new ATOM 0 HG3 MET A 99 -14.141 0.453 15.194 1.00 0.00 H new ATOM 0 HE1 MET A 99 -11.361 -1.443 14.736 1.00 0.00 H new ATOM 0 HE2 MET A 99 -13.092 -1.795 14.520 1.00 0.00 H new ATOM 0 HE3 MET A 99 -11.958 -2.046 13.171 1.00 0.00 H new ATOM 1488 N GLU A 100 -16.794 2.202 14.234 1.00 0.00 N ATOM 1489 CA GLU A 100 -17.210 3.590 13.908 1.00 0.00 C ATOM 1490 C GLU A 100 -17.117 3.885 12.396 1.00 0.00 C ATOM 1491 O GLU A 100 -18.017 4.487 11.818 1.00 0.00 O ATOM 1492 CB GLU A 100 -16.311 4.602 14.670 1.00 0.00 C ATOM 1493 CG GLU A 100 -16.405 4.512 16.200 1.00 0.00 C ATOM 1494 CD GLU A 100 -15.449 5.478 16.917 1.00 0.00 C ATOM 1495 OE1 GLU A 100 -15.704 6.698 16.901 1.00 0.00 O ATOM 1496 OE2 GLU A 100 -14.424 5.026 17.474 1.00 0.00 O ATOM 0 H GLU A 100 -16.111 2.156 14.990 1.00 0.00 H new ATOM 0 HA GLU A 100 -18.251 3.694 14.213 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -15.274 4.443 14.373 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -16.580 5.612 14.361 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -17.428 4.726 16.509 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -16.184 3.492 16.513 1.00 0.00 H new ATOM 1503 N PHE A 101 -16.026 3.402 11.774 1.00 0.00 N ATOM 1504 CA PHE A 101 -15.699 3.683 10.356 1.00 0.00 C ATOM 1505 C PHE A 101 -16.537 2.793 9.401 1.00 0.00 C ATOM 1506 O PHE A 101 -16.554 3.022 8.184 1.00 0.00 O ATOM 1507 CB PHE A 101 -14.172 3.474 10.108 1.00 0.00 C ATOM 1508 CG PHE A 101 -13.266 3.998 11.237 1.00 0.00 C ATOM 1509 CD1 PHE A 101 -13.329 5.327 11.653 1.00 0.00 C ATOM 1510 CD2 PHE A 101 -12.378 3.148 11.902 1.00 0.00 C ATOM 1511 CE1 PHE A 101 -12.539 5.785 12.690 1.00 0.00 C ATOM 1512 CE2 PHE A 101 -11.590 3.604 12.940 1.00 0.00 C ATOM 1513 CZ PHE A 101 -11.670 4.922 13.334 1.00 0.00 C ATOM 0 H PHE A 101 -15.342 2.804 12.238 1.00 0.00 H new ATOM 0 HA PHE A 101 -15.951 4.722 10.145 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -13.981 2.410 9.970 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -13.896 3.970 9.178 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -14.005 6.008 11.158 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -12.307 2.114 11.598 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -12.600 6.818 12.998 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -10.912 2.929 13.442 1.00 0.00 H new ATOM 0 HZ PHE A 101 -11.054 5.281 14.145 1.00 0.00 H new ATOM 1523 N GLY A 102 -17.203 1.772 9.974 1.00 0.00 N ATOM 1524 CA GLY A 102 -18.098 0.878 9.238 1.00 0.00 C ATOM 1525 C GLY A 102 -17.866 -0.582 9.599 1.00 0.00 C ATOM 1526 O GLY A 102 -17.081 -0.881 10.508 1.00 0.00 O ATOM 0 H GLY A 102 -17.130 1.549 10.967 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -19.133 1.144 9.452 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -17.948 1.015 8.167 1.00 0.00 H new ATOM 1530 N TYR A 103 -18.542 -1.500 8.882 1.00 0.00 N ATOM 1531 CA TYR A 103 -18.395 -2.948 9.107 1.00 0.00 C ATOM 1532 C TYR A 103 -17.079 -3.414 8.475 1.00 0.00 C ATOM 1533 O TYR A 103 -17.020 -3.632 7.266 1.00 0.00 O ATOM 1534 CB TYR A 103 -19.595 -3.717 8.491 1.00 0.00 C ATOM 1535 CG TYR A 103 -19.688 -5.172 8.959 1.00 0.00 C ATOM 1536 CD1 TYR A 103 -19.891 -5.442 10.304 1.00 0.00 C ATOM 1537 CD2 TYR A 103 -19.606 -6.259 8.084 1.00 0.00 C ATOM 1538 CE1 TYR A 103 -20.014 -6.712 10.775 1.00 0.00 C ATOM 1539 CE2 TYR A 103 -19.724 -7.552 8.551 1.00 0.00 C ATOM 1540 CZ TYR A 103 -19.933 -7.773 9.899 1.00 0.00 C ATOM 1541 OH TYR A 103 -20.058 -9.060 10.375 1.00 0.00 O ATOM 0 H TYR A 103 -19.198 -1.261 8.139 1.00 0.00 H new ATOM 0 HA TYR A 103 -18.380 -3.153 10.178 1.00 0.00 H new ATOM 0 HB2 TYR A 103 -20.519 -3.200 8.749 1.00 0.00 H new ATOM 0 HB3 TYR A 103 -19.511 -3.697 7.404 1.00 0.00 H new ATOM 0 HD1 TYR A 103 -19.953 -4.618 10.999 1.00 0.00 H new ATOM 0 HD2 TYR A 103 -19.448 -6.085 7.030 1.00 0.00 H new ATOM 0 HE1 TYR A 103 -20.174 -6.888 11.828 1.00 0.00 H new ATOM 0 HE2 TYR A 103 -19.654 -8.385 7.868 1.00 0.00 H new ATOM 0 HH TYR A 103 -19.361 -9.231 11.042 1.00 0.00 H new ATOM 1551 N THR A 104 -16.037 -3.596 9.295 1.00 0.00 N ATOM 1552 CA THR A 104 -14.661 -3.781 8.807 1.00 0.00 C ATOM 1553 C THR A 104 -14.163 -5.196 9.120 1.00 0.00 C ATOM 1554 O THR A 104 -14.530 -5.790 10.136 1.00 0.00 O ATOM 1555 CB THR A 104 -13.701 -2.697 9.422 1.00 0.00 C ATOM 1556 OG1 THR A 104 -12.387 -2.784 8.838 1.00 0.00 O ATOM 1557 CG2 THR A 104 -13.591 -2.807 10.957 1.00 0.00 C ATOM 0 H THR A 104 -16.121 -3.619 10.311 1.00 0.00 H new ATOM 0 HA THR A 104 -14.661 -3.654 7.724 1.00 0.00 H new ATOM 0 HB THR A 104 -14.142 -1.728 9.188 1.00 0.00 H new ATOM 0 HG1 THR A 104 -11.738 -2.346 9.427 1.00 0.00 H new ATOM 0 HG21 THR A 104 -12.917 -2.036 11.330 1.00 0.00 H new ATOM 0 HG22 THR A 104 -14.577 -2.673 11.403 1.00 0.00 H new ATOM 0 HG23 THR A 104 -13.202 -3.789 11.224 1.00 0.00 H new ATOM 1565 N PHE A 105 -13.317 -5.712 8.230 1.00 0.00 N ATOM 1566 CA PHE A 105 -12.733 -7.050 8.333 1.00 0.00 C ATOM 1567 C PHE A 105 -11.274 -7.000 7.883 1.00 0.00 C ATOM 1568 O PHE A 105 -10.969 -6.386 6.862 1.00 0.00 O ATOM 1569 CB PHE A 105 -13.551 -8.076 7.481 1.00 0.00 C ATOM 1570 CG PHE A 105 -12.840 -9.412 7.177 1.00 0.00 C ATOM 1571 CD1 PHE A 105 -12.182 -10.146 8.166 1.00 0.00 C ATOM 1572 CD2 PHE A 105 -12.776 -9.887 5.874 1.00 0.00 C ATOM 1573 CE1 PHE A 105 -11.500 -11.298 7.843 1.00 0.00 C ATOM 1574 CE2 PHE A 105 -12.089 -11.018 5.548 1.00 0.00 C ATOM 1575 CZ PHE A 105 -11.449 -11.728 6.531 1.00 0.00 C ATOM 0 H PHE A 105 -13.012 -5.203 7.401 1.00 0.00 H new ATOM 0 HA PHE A 105 -12.771 -7.382 9.370 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -14.483 -8.292 8.003 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -13.817 -7.604 6.535 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -12.208 -9.808 9.191 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -13.287 -9.343 5.094 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -11.004 -11.866 8.616 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -12.049 -11.353 4.522 1.00 0.00 H new ATOM 0 HZ PHE A 105 -10.904 -12.626 6.279 1.00 0.00 H new ATOM 1585 N THR A 106 -10.383 -7.625 8.651 1.00 0.00 N ATOM 1586 CA THR A 106 -8.952 -7.621 8.365 1.00 0.00 C ATOM 1587 C THR A 106 -8.444 -9.060 8.166 1.00 0.00 C ATOM 1588 O THR A 106 -8.537 -9.896 9.066 1.00 0.00 O ATOM 1589 CB THR A 106 -8.169 -6.922 9.522 1.00 0.00 C ATOM 1590 OG1 THR A 106 -8.783 -5.653 9.837 1.00 0.00 O ATOM 1591 CG2 THR A 106 -6.700 -6.690 9.149 1.00 0.00 C ATOM 0 H THR A 106 -10.635 -8.148 9.489 1.00 0.00 H new ATOM 0 HA THR A 106 -8.782 -7.062 7.445 1.00 0.00 H new ATOM 0 HB THR A 106 -8.205 -7.581 10.389 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.600 -5.424 10.772 1.00 0.00 H new ATOM 0 HG21 THR A 106 -6.187 -6.202 9.978 1.00 0.00 H new ATOM 0 HG22 THR A 106 -6.222 -7.647 8.939 1.00 0.00 H new ATOM 0 HG23 THR A 106 -6.645 -6.056 8.264 1.00 0.00 H new ATOM 1599 N ALA A 107 -7.932 -9.347 6.968 1.00 0.00 N ATOM 1600 CA ALA A 107 -7.330 -10.639 6.645 1.00 0.00 C ATOM 1601 C ALA A 107 -5.815 -10.502 6.576 1.00 0.00 C ATOM 1602 O ALA A 107 -5.290 -9.380 6.568 1.00 0.00 O ATOM 1603 CB ALA A 107 -7.883 -11.172 5.326 1.00 0.00 C ATOM 0 H ALA A 107 -7.924 -8.686 6.192 1.00 0.00 H new ATOM 0 HA ALA A 107 -7.582 -11.352 7.430 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -7.424 -12.135 5.101 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -8.963 -11.295 5.408 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -7.658 -10.467 4.526 1.00 0.00 H new ATOM 1609 N ALA A 108 -5.122 -11.630 6.501 1.00 0.00 N ATOM 1610 CA ALA A 108 -3.662 -11.662 6.401 1.00 0.00 C ATOM 1611 C ALA A 108 -3.265 -12.675 5.349 1.00 0.00 C ATOM 1612 O ALA A 108 -3.738 -13.802 5.387 1.00 0.00 O ATOM 1613 CB ALA A 108 -3.042 -12.016 7.757 1.00 0.00 C ATOM 0 H ALA A 108 -5.554 -12.554 6.508 1.00 0.00 H new ATOM 0 HA ALA A 108 -3.292 -10.678 6.112 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -1.956 -12.036 7.666 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -3.331 -11.268 8.496 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -3.398 -12.996 8.075 1.00 0.00 H new ATOM 1619 N ASP A 109 -2.436 -12.254 4.395 1.00 0.00 N ATOM 1620 CA ASP A 109 -1.827 -13.149 3.389 1.00 0.00 C ATOM 1621 C ASP A 109 -0.929 -14.218 4.073 1.00 0.00 C ATOM 1622 O ASP A 109 -0.682 -14.133 5.287 1.00 0.00 O ATOM 1623 CB ASP A 109 -0.994 -12.292 2.391 1.00 0.00 C ATOM 1624 CG ASP A 109 -1.819 -11.171 1.735 1.00 0.00 C ATOM 1625 OD1 ASP A 109 -1.999 -10.124 2.382 1.00 0.00 O ATOM 1626 OD2 ASP A 109 -2.280 -11.320 0.594 1.00 0.00 O ATOM 0 H ASP A 109 -2.161 -11.277 4.290 1.00 0.00 H new ATOM 0 HA ASP A 109 -2.614 -13.676 2.850 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -0.146 -11.853 2.916 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -0.587 -12.940 1.614 1.00 0.00 H new ATOM 1631 N PRO A 110 -0.452 -15.269 3.327 1.00 0.00 N ATOM 1632 CA PRO A 110 0.651 -16.157 3.802 1.00 0.00 C ATOM 1633 C PRO A 110 1.880 -15.354 4.317 1.00 0.00 C ATOM 1634 O PRO A 110 2.564 -15.774 5.253 1.00 0.00 O ATOM 1635 CB PRO A 110 1.002 -16.985 2.534 1.00 0.00 C ATOM 1636 CG PRO A 110 -0.292 -17.063 1.772 1.00 0.00 C ATOM 1637 CD PRO A 110 -0.990 -15.733 2.010 1.00 0.00 C ATOM 0 HA PRO A 110 0.357 -16.770 4.654 1.00 0.00 H new ATOM 0 HB2 PRO A 110 1.782 -16.501 1.946 1.00 0.00 H new ATOM 0 HB3 PRO A 110 1.370 -17.977 2.796 1.00 0.00 H new ATOM 0 HG2 PRO A 110 -0.112 -17.226 0.709 1.00 0.00 H new ATOM 0 HG3 PRO A 110 -0.903 -17.894 2.123 1.00 0.00 H new ATOM 0 HD2 PRO A 110 -0.770 -15.020 1.216 1.00 0.00 H new ATOM 0 HD3 PRO A 110 -2.073 -15.851 2.041 1.00 0.00 H new ATOM 1645 N ASP A 111 2.102 -14.175 3.707 1.00 0.00 N ATOM 1646 CA ASP A 111 3.228 -13.265 4.022 1.00 0.00 C ATOM 1647 C ASP A 111 2.895 -12.301 5.188 1.00 0.00 C ATOM 1648 O ASP A 111 3.695 -11.414 5.492 1.00 0.00 O ATOM 1649 CB ASP A 111 3.586 -12.435 2.757 1.00 0.00 C ATOM 1650 CG ASP A 111 3.803 -13.288 1.491 1.00 0.00 C ATOM 1651 OD1 ASP A 111 2.800 -13.723 0.881 1.00 0.00 O ATOM 1652 OD2 ASP A 111 4.969 -13.543 1.112 1.00 0.00 O ATOM 0 H ASP A 111 1.496 -13.818 2.968 1.00 0.00 H new ATOM 0 HA ASP A 111 4.073 -13.880 4.332 1.00 0.00 H new ATOM 0 HB2 ASP A 111 2.788 -11.717 2.567 1.00 0.00 H new ATOM 0 HB3 ASP A 111 4.491 -11.860 2.956 1.00 0.00 H new ATOM 1657 N SER A 112 1.700 -12.467 5.799 1.00 0.00 N ATOM 1658 CA SER A 112 1.221 -11.663 6.946 1.00 0.00 C ATOM 1659 C SER A 112 1.143 -10.153 6.612 1.00 0.00 C ATOM 1660 O SER A 112 2.093 -9.391 6.863 1.00 0.00 O ATOM 1661 CB SER A 112 2.096 -11.912 8.206 1.00 0.00 C ATOM 1662 OG SER A 112 2.135 -13.285 8.543 1.00 0.00 O ATOM 0 H SER A 112 1.030 -13.176 5.503 1.00 0.00 H new ATOM 0 HA SER A 112 0.205 -11.993 7.164 1.00 0.00 H new ATOM 0 HB2 SER A 112 3.108 -11.551 8.025 1.00 0.00 H new ATOM 0 HB3 SER A 112 1.699 -11.341 9.045 1.00 0.00 H new ATOM 0 HG SER A 112 2.694 -13.411 9.338 1.00 0.00 H new ATOM 1668 N HIS A 113 0.021 -9.732 5.996 1.00 0.00 N ATOM 1669 CA HIS A 113 -0.265 -8.300 5.722 1.00 0.00 C ATOM 1670 C HIS A 113 -1.595 -7.905 6.369 1.00 0.00 C ATOM 1671 O HIS A 113 -2.276 -8.736 6.968 1.00 0.00 O ATOM 1672 CB HIS A 113 -0.341 -7.991 4.204 1.00 0.00 C ATOM 1673 CG HIS A 113 0.826 -8.464 3.399 1.00 0.00 C ATOM 1674 ND1 HIS A 113 0.679 -9.142 2.222 1.00 0.00 N ATOM 1675 CD2 HIS A 113 2.153 -8.377 3.607 1.00 0.00 C ATOM 1676 CE1 HIS A 113 1.841 -9.468 1.752 1.00 0.00 C ATOM 1677 NE2 HIS A 113 2.763 -9.026 2.567 1.00 0.00 N ATOM 0 H HIS A 113 -0.711 -10.365 5.674 1.00 0.00 H new ATOM 0 HA HIS A 113 0.559 -7.725 6.144 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -1.247 -8.445 3.802 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -0.439 -6.913 4.073 1.00 0.00 H new ATOM 0 HD2 HIS A 113 2.643 -7.888 4.436 1.00 0.00 H new ATOM 0 HE1 HIS A 113 2.019 -10.015 0.838 1.00 0.00 H new ATOM 0 HE2 HIS A 113 3.769 -9.145 2.448 1.00 0.00 H new ATOM 1686 N ARG A 114 -1.936 -6.621 6.258 1.00 0.00 N ATOM 1687 CA ARG A 114 -3.258 -6.103 6.621 1.00 0.00 C ATOM 1688 C ARG A 114 -4.087 -5.927 5.337 1.00 0.00 C ATOM 1689 O ARG A 114 -3.737 -5.110 4.486 1.00 0.00 O ATOM 1690 CB ARG A 114 -3.109 -4.753 7.369 1.00 0.00 C ATOM 1691 CG ARG A 114 -2.531 -4.828 8.801 1.00 0.00 C ATOM 1692 CD ARG A 114 -3.412 -5.665 9.735 1.00 0.00 C ATOM 1693 NE ARG A 114 -2.986 -5.622 11.146 1.00 0.00 N ATOM 1694 CZ ARG A 114 -3.061 -6.656 12.001 1.00 0.00 C ATOM 1695 NH1 ARG A 114 -3.383 -7.870 11.582 1.00 0.00 N ATOM 1696 NH2 ARG A 114 -2.813 -6.473 13.275 1.00 0.00 N ATOM 0 H ARG A 114 -1.298 -5.904 5.911 1.00 0.00 H new ATOM 0 HA ARG A 114 -3.766 -6.802 7.285 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -2.469 -4.101 6.775 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -4.089 -4.279 7.419 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -1.530 -5.258 8.765 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -2.431 -3.820 9.204 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -4.441 -5.311 9.664 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -3.407 -6.700 9.394 1.00 0.00 H new ATOM 0 HE ARG A 114 -2.607 -4.743 11.499 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -3.579 -8.033 10.594 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -3.435 -8.642 12.247 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -2.563 -5.545 13.618 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -2.870 -7.258 13.924 1.00 0.00 H new ATOM 1710 N LEU A 115 -5.146 -6.738 5.176 1.00 0.00 N ATOM 1711 CA LEU A 115 -6.120 -6.587 4.080 1.00 0.00 C ATOM 1712 C LEU A 115 -7.450 -6.145 4.701 1.00 0.00 C ATOM 1713 O LEU A 115 -8.188 -6.975 5.235 1.00 0.00 O ATOM 1714 CB LEU A 115 -6.305 -7.936 3.327 1.00 0.00 C ATOM 1715 CG LEU A 115 -5.027 -8.600 2.729 1.00 0.00 C ATOM 1716 CD1 LEU A 115 -5.368 -9.977 2.109 1.00 0.00 C ATOM 1717 CD2 LEU A 115 -4.317 -7.668 1.709 1.00 0.00 C ATOM 0 H LEU A 115 -5.352 -7.517 5.802 1.00 0.00 H new ATOM 0 HA LEU A 115 -5.767 -5.849 3.360 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -6.764 -8.646 4.014 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -7.014 -7.775 2.515 1.00 0.00 H new ATOM 0 HG LEU A 115 -4.322 -8.765 3.544 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -4.464 -10.425 1.697 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -5.778 -10.631 2.878 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -6.103 -9.846 1.314 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -3.432 -8.167 1.315 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -4.999 -7.439 0.890 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -4.022 -6.743 2.205 1.00 0.00 H new ATOM 1729 N ARG A 116 -7.759 -4.844 4.632 1.00 0.00 N ATOM 1730 CA ARG A 116 -8.918 -4.275 5.334 1.00 0.00 C ATOM 1731 C ARG A 116 -10.110 -4.100 4.377 1.00 0.00 C ATOM 1732 O ARG A 116 -10.243 -3.067 3.731 1.00 0.00 O ATOM 1733 CB ARG A 116 -8.501 -2.921 5.981 1.00 0.00 C ATOM 1734 CG ARG A 116 -9.602 -2.257 6.839 1.00 0.00 C ATOM 1735 CD ARG A 116 -9.138 -0.945 7.479 1.00 0.00 C ATOM 1736 NE ARG A 116 -10.237 -0.252 8.177 1.00 0.00 N ATOM 1737 CZ ARG A 116 -10.142 0.959 8.755 1.00 0.00 C ATOM 1738 NH1 ARG A 116 -8.972 1.593 8.816 1.00 0.00 N ATOM 1739 NH2 ARG A 116 -11.211 1.511 9.314 1.00 0.00 N ATOM 0 H ARG A 116 -7.221 -4.163 4.096 1.00 0.00 H new ATOM 0 HA ARG A 116 -9.241 -4.959 6.119 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -7.622 -3.086 6.604 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -8.207 -2.230 5.191 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -10.476 -2.064 6.217 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -9.914 -2.948 7.622 1.00 0.00 H new ATOM 0 HD2 ARG A 116 -8.333 -1.151 8.185 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -8.728 -0.291 6.709 1.00 0.00 H new ATOM 0 HE ARG A 116 -11.138 -0.727 8.225 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -8.136 1.161 8.422 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -8.912 2.511 9.257 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -12.103 1.017 9.305 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -11.140 2.429 9.753 1.00 0.00 H new ATOM 1753 N VAL A 117 -11.006 -5.102 4.311 1.00 0.00 N ATOM 1754 CA VAL A 117 -12.259 -4.980 3.544 1.00 0.00 C ATOM 1755 C VAL A 117 -13.349 -4.480 4.481 1.00 0.00 C ATOM 1756 O VAL A 117 -13.691 -5.143 5.463 1.00 0.00 O ATOM 1757 CB VAL A 117 -12.671 -6.292 2.761 1.00 0.00 C ATOM 1758 CG1 VAL A 117 -12.786 -7.525 3.631 1.00 0.00 C ATOM 1759 CG2 VAL A 117 -13.947 -6.071 1.902 1.00 0.00 C ATOM 0 H VAL A 117 -10.886 -6.001 4.777 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.101 -4.254 2.746 1.00 0.00 H new ATOM 0 HB VAL A 117 -11.840 -6.496 2.086 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -13.072 -8.379 3.016 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -11.826 -7.726 4.107 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.543 -7.360 4.398 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -14.198 -6.994 1.380 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -14.776 -5.783 2.549 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -13.763 -5.281 1.174 1.00 0.00 H new ATOM 1769 N TYR A 118 -13.876 -3.275 4.200 1.00 0.00 N ATOM 1770 CA TYR A 118 -14.846 -2.626 5.088 1.00 0.00 C ATOM 1771 C TYR A 118 -16.122 -2.258 4.331 1.00 0.00 C ATOM 1772 O TYR A 118 -16.141 -2.270 3.093 1.00 0.00 O ATOM 1773 CB TYR A 118 -14.233 -1.416 5.846 1.00 0.00 C ATOM 1774 CG TYR A 118 -14.011 -0.145 5.025 1.00 0.00 C ATOM 1775 CD1 TYR A 118 -12.910 -0.015 4.178 1.00 0.00 C ATOM 1776 CD2 TYR A 118 -14.897 0.939 5.120 1.00 0.00 C ATOM 1777 CE1 TYR A 118 -12.701 1.142 3.464 1.00 0.00 C ATOM 1778 CE2 TYR A 118 -14.692 2.094 4.400 1.00 0.00 C ATOM 1779 CZ TYR A 118 -13.594 2.195 3.576 1.00 0.00 C ATOM 1780 OH TYR A 118 -13.378 3.363 2.872 1.00 0.00 O ATOM 0 H TYR A 118 -13.645 -2.735 3.366 1.00 0.00 H new ATOM 0 HA TYR A 118 -15.123 -3.349 5.856 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -14.885 -1.172 6.685 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -13.275 -1.724 6.265 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -12.212 -0.834 4.082 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -15.756 0.866 5.770 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -11.841 1.229 2.816 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -15.388 2.916 4.481 1.00 0.00 H new ATOM 0 HH TYR A 118 -12.414 3.514 2.777 1.00 0.00 H new ATOM 1790 N ALA A 119 -17.159 -1.883 5.072 1.00 0.00 N ATOM 1791 CA ALA A 119 -18.407 -1.359 4.516 1.00 0.00 C ATOM 1792 C ALA A 119 -18.724 -0.055 5.230 1.00 0.00 C ATOM 1793 O ALA A 119 -19.028 -0.075 6.422 1.00 0.00 O ATOM 1794 CB ALA A 119 -19.538 -2.372 4.720 1.00 0.00 C ATOM 0 H ALA A 119 -17.159 -1.934 6.091 1.00 0.00 H new ATOM 0 HA ALA A 119 -18.305 -1.183 3.445 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -20.463 -1.974 4.303 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -19.286 -3.305 4.217 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -19.671 -2.559 5.786 1.00 0.00 H new ATOM 1800 N PHE A 120 -18.651 1.074 4.516 1.00 0.00 N ATOM 1801 CA PHE A 120 -18.862 2.399 5.118 1.00 0.00 C ATOM 1802 C PHE A 120 -20.375 2.627 5.256 1.00 0.00 C ATOM 1803 O PHE A 120 -21.097 2.675 4.247 1.00 0.00 O ATOM 1804 CB PHE A 120 -18.205 3.511 4.247 1.00 0.00 C ATOM 1805 CG PHE A 120 -18.215 4.912 4.872 1.00 0.00 C ATOM 1806 CD1 PHE A 120 -17.173 5.330 5.703 1.00 0.00 C ATOM 1807 CD2 PHE A 120 -19.249 5.818 4.612 1.00 0.00 C ATOM 1808 CE1 PHE A 120 -17.174 6.591 6.264 1.00 0.00 C ATOM 1809 CE2 PHE A 120 -19.250 7.077 5.178 1.00 0.00 C ATOM 1810 CZ PHE A 120 -18.207 7.468 5.994 1.00 0.00 C ATOM 0 H PHE A 120 -18.447 1.098 3.517 1.00 0.00 H new ATOM 0 HA PHE A 120 -18.393 2.442 6.101 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -17.173 3.228 4.041 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -18.721 3.553 3.288 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -16.354 4.656 5.910 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -20.059 5.528 3.959 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -16.367 6.893 6.915 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -20.067 7.756 4.983 1.00 0.00 H new ATOM 0 HZ PHE A 120 -18.199 8.460 6.421 1.00 0.00 H new ATOM 1820 N ALA A 121 -20.840 2.711 6.511 1.00 0.00 N ATOM 1821 CA ALA A 121 -22.251 2.912 6.839 1.00 0.00 C ATOM 1822 C ALA A 121 -22.602 4.405 6.709 1.00 0.00 C ATOM 1823 O ALA A 121 -22.343 5.204 7.623 1.00 0.00 O ATOM 1824 CB ALA A 121 -22.543 2.375 8.254 1.00 0.00 C ATOM 0 H ALA A 121 -20.238 2.640 7.331 1.00 0.00 H new ATOM 0 HA ALA A 121 -22.878 2.357 6.141 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -23.596 2.528 8.491 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -22.313 1.310 8.294 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -21.927 2.906 8.979 1.00 0.00 H new ATOM 1830 N GLY A 122 -23.133 4.776 5.533 1.00 0.00 N ATOM 1831 CA GLY A 122 -23.560 6.151 5.238 1.00 0.00 C ATOM 1832 C GLY A 122 -24.971 6.209 4.645 1.00 0.00 C ATOM 1833 O GLY A 122 -25.665 7.227 4.828 1.00 0.00 O ATOM 1834 OXT GLY A 122 -25.393 5.232 3.982 1.00 0.00 O ATOM 0 H GLY A 122 -23.278 4.128 4.759 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -23.529 6.743 6.153 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -22.857 6.605 4.540 1.00 0.00 H new TER 1838 GLY A 122 ATOM 1839 N MET B 1 -17.917 -7.152 -6.843 1.00 0.00 N ATOM 1840 CA MET B 1 -17.938 -7.430 -5.388 1.00 0.00 C ATOM 1841 C MET B 1 -17.043 -6.453 -4.610 1.00 0.00 C ATOM 1842 O MET B 1 -17.447 -5.979 -3.547 1.00 0.00 O ATOM 1843 CB MET B 1 -17.539 -8.909 -5.081 1.00 0.00 C ATOM 1844 CG MET B 1 -16.195 -9.365 -5.682 1.00 0.00 C ATOM 1845 SD MET B 1 -15.646 -10.983 -5.083 1.00 0.00 S ATOM 1846 CE MET B 1 -15.097 -10.584 -3.420 1.00 0.00 C ATOM 0 H1 MET B 1 -18.532 -7.831 -7.335 1.00 0.00 H new ATOM 0 H2 MET B 1 -18.259 -6.185 -7.017 1.00 0.00 H new ATOM 0 H3 MET B 1 -16.945 -7.244 -7.200 1.00 0.00 H new ATOM 0 HA MET B 1 -18.964 -7.282 -5.052 1.00 0.00 H new ATOM 0 HB2 MET B 1 -17.498 -9.040 -4.000 1.00 0.00 H new ATOM 0 HB3 MET B 1 -18.326 -9.565 -5.452 1.00 0.00 H new ATOM 0 HG2 MET B 1 -16.285 -9.400 -6.768 1.00 0.00 H new ATOM 0 HG3 MET B 1 -15.432 -8.622 -5.449 1.00 0.00 H new ATOM 0 HE1 MET B 1 -14.667 -11.472 -2.956 1.00 0.00 H new ATOM 0 HE2 MET B 1 -14.345 -9.797 -3.464 1.00 0.00 H new ATOM 0 HE3 MET B 1 -15.946 -10.241 -2.829 1.00 0.00 H new ATOM 1856 N THR B 2 -15.826 -6.152 -5.123 1.00 0.00 N ATOM 1857 CA THR B 2 -14.808 -5.407 -4.347 1.00 0.00 C ATOM 1858 C THR B 2 -13.993 -4.429 -5.232 1.00 0.00 C ATOM 1859 O THR B 2 -13.713 -4.726 -6.399 1.00 0.00 O ATOM 1860 CB THR B 2 -13.854 -6.421 -3.632 1.00 0.00 C ATOM 1861 OG1 THR B 2 -14.627 -7.379 -2.885 1.00 0.00 O ATOM 1862 CG2 THR B 2 -12.876 -5.723 -2.690 1.00 0.00 C ATOM 0 H THR B 2 -15.528 -6.412 -6.063 1.00 0.00 H new ATOM 0 HA THR B 2 -15.329 -4.802 -3.605 1.00 0.00 H new ATOM 0 HB THR B 2 -13.276 -6.923 -4.408 1.00 0.00 H new ATOM 0 HG1 THR B 2 -14.228 -7.502 -1.999 1.00 0.00 H new ATOM 0 HG21 THR B 2 -12.234 -6.466 -2.216 1.00 0.00 H new ATOM 0 HG22 THR B 2 -12.263 -5.022 -3.256 1.00 0.00 H new ATOM 0 HG23 THR B 2 -13.432 -5.182 -1.924 1.00 0.00 H new ATOM 1870 N HIS B 3 -13.626 -3.259 -4.654 1.00 0.00 N ATOM 1871 CA HIS B 3 -12.744 -2.245 -5.288 1.00 0.00 C ATOM 1872 C HIS B 3 -11.709 -1.760 -4.246 1.00 0.00 C ATOM 1873 O HIS B 3 -12.061 -0.984 -3.359 1.00 0.00 O ATOM 1874 CB HIS B 3 -13.553 -1.018 -5.815 1.00 0.00 C ATOM 1875 CG HIS B 3 -14.423 -1.263 -7.018 1.00 0.00 C ATOM 1876 ND1 HIS B 3 -14.186 -0.669 -8.238 1.00 0.00 N ATOM 1877 CD2 HIS B 3 -15.556 -1.986 -7.176 1.00 0.00 C ATOM 1878 CE1 HIS B 3 -15.129 -1.013 -9.087 1.00 0.00 C ATOM 1879 NE2 HIS B 3 -15.973 -1.813 -8.472 1.00 0.00 N ATOM 0 H HIS B 3 -13.938 -2.988 -3.721 1.00 0.00 H new ATOM 0 HA HIS B 3 -12.250 -2.711 -6.140 1.00 0.00 H new ATOM 0 HB2 HIS B 3 -14.183 -0.650 -5.006 1.00 0.00 H new ATOM 0 HB3 HIS B 3 -12.849 -0.222 -6.058 1.00 0.00 H new ATOM 0 HD2 HIS B 3 -16.042 -2.588 -6.422 1.00 0.00 H new ATOM 0 HE1 HIS B 3 -15.199 -0.693 -10.116 1.00 0.00 H new ATOM 0 HE2 HIS B 3 -16.802 -2.236 -8.890 1.00 0.00 H new ATOM 1888 N PRO B 4 -10.423 -2.218 -4.323 1.00 0.00 N ATOM 1889 CA PRO B 4 -9.360 -1.830 -3.368 1.00 0.00 C ATOM 1890 C PRO B 4 -8.578 -0.579 -3.818 1.00 0.00 C ATOM 1891 O PRO B 4 -7.343 -0.530 -3.738 1.00 0.00 O ATOM 1892 CB PRO B 4 -8.484 -3.094 -3.355 1.00 0.00 C ATOM 1893 CG PRO B 4 -8.557 -3.609 -4.761 1.00 0.00 C ATOM 1894 CD PRO B 4 -9.900 -3.177 -5.328 1.00 0.00 C ATOM 0 HA PRO B 4 -9.739 -1.542 -2.387 1.00 0.00 H new ATOM 0 HB2 PRO B 4 -7.458 -2.864 -3.068 1.00 0.00 H new ATOM 0 HB3 PRO B 4 -8.857 -3.829 -2.642 1.00 0.00 H new ATOM 0 HG2 PRO B 4 -7.739 -3.209 -5.360 1.00 0.00 H new ATOM 0 HG3 PRO B 4 -8.463 -4.695 -4.779 1.00 0.00 H new ATOM 0 HD2 PRO B 4 -9.788 -2.709 -6.306 1.00 0.00 H new ATOM 0 HD3 PRO B 4 -10.571 -4.026 -5.456 1.00 0.00 H new ATOM 1902 N ASP B 5 -9.329 0.470 -4.180 1.00 0.00 N ATOM 1903 CA ASP B 5 -8.781 1.779 -4.628 1.00 0.00 C ATOM 1904 C ASP B 5 -8.235 2.631 -3.448 1.00 0.00 C ATOM 1905 O ASP B 5 -7.941 3.825 -3.608 1.00 0.00 O ATOM 1906 CB ASP B 5 -9.899 2.558 -5.367 1.00 0.00 C ATOM 1907 CG ASP B 5 -11.092 2.905 -4.448 1.00 0.00 C ATOM 1908 OD1 ASP B 5 -11.869 1.991 -4.090 1.00 0.00 O ATOM 1909 OD2 ASP B 5 -11.256 4.083 -4.067 1.00 0.00 O ATOM 0 H ASP B 5 -10.349 0.444 -4.173 1.00 0.00 H new ATOM 0 HA ASP B 5 -7.940 1.584 -5.293 1.00 0.00 H new ATOM 0 HB2 ASP B 5 -9.484 3.478 -5.779 1.00 0.00 H new ATOM 0 HB3 ASP B 5 -10.255 1.964 -6.209 1.00 0.00 H new ATOM 1914 N PHE B 6 -8.058 1.984 -2.293 1.00 0.00 N ATOM 1915 CA PHE B 6 -7.775 2.614 -1.014 1.00 0.00 C ATOM 1916 C PHE B 6 -6.609 1.846 -0.344 1.00 0.00 C ATOM 1917 O PHE B 6 -6.614 0.617 -0.276 1.00 0.00 O ATOM 1918 CB PHE B 6 -9.085 2.584 -0.160 1.00 0.00 C ATOM 1919 CG PHE B 6 -9.094 3.316 1.189 1.00 0.00 C ATOM 1920 CD1 PHE B 6 -8.065 4.144 1.597 1.00 0.00 C ATOM 1921 CD2 PHE B 6 -10.178 3.164 2.052 1.00 0.00 C ATOM 1922 CE1 PHE B 6 -8.119 4.782 2.807 1.00 0.00 C ATOM 1923 CE2 PHE B 6 -10.225 3.808 3.265 1.00 0.00 C ATOM 1924 CZ PHE B 6 -9.195 4.616 3.643 1.00 0.00 C ATOM 0 H PHE B 6 -8.111 0.967 -2.228 1.00 0.00 H new ATOM 0 HA PHE B 6 -7.469 3.654 -1.122 1.00 0.00 H new ATOM 0 HB2 PHE B 6 -9.888 3.000 -0.769 1.00 0.00 H new ATOM 0 HB3 PHE B 6 -9.335 1.540 0.027 1.00 0.00 H new ATOM 0 HD1 PHE B 6 -7.209 4.289 0.954 1.00 0.00 H new ATOM 0 HD2 PHE B 6 -10.999 2.526 1.761 1.00 0.00 H new ATOM 0 HE1 PHE B 6 -7.304 5.424 3.108 1.00 0.00 H new ATOM 0 HE2 PHE B 6 -11.076 3.674 3.917 1.00 0.00 H new ATOM 0 HZ PHE B 6 -9.225 5.123 4.596 1.00 0.00 H new ATOM 1934 N THR B 7 -5.593 2.596 0.089 1.00 0.00 N ATOM 1935 CA THR B 7 -4.456 2.083 0.876 1.00 0.00 C ATOM 1936 C THR B 7 -4.311 2.931 2.148 1.00 0.00 C ATOM 1937 O THR B 7 -4.525 4.140 2.118 1.00 0.00 O ATOM 1938 CB THR B 7 -3.119 2.091 0.047 1.00 0.00 C ATOM 1939 OG1 THR B 7 -2.025 1.595 0.844 1.00 0.00 O ATOM 1940 CG2 THR B 7 -2.761 3.496 -0.486 1.00 0.00 C ATOM 0 H THR B 7 -5.531 3.597 -0.098 1.00 0.00 H new ATOM 0 HA THR B 7 -4.655 1.045 1.142 1.00 0.00 H new ATOM 0 HB THR B 7 -3.283 1.438 -0.810 1.00 0.00 H new ATOM 0 HG1 THR B 7 -2.361 0.938 1.488 1.00 0.00 H new ATOM 0 HG21 THR B 7 -1.830 3.445 -1.051 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.560 3.853 -1.136 1.00 0.00 H new ATOM 0 HG23 THR B 7 -2.640 4.183 0.352 1.00 0.00 H new ATOM 1948 N ILE B 8 -3.984 2.281 3.274 1.00 0.00 N ATOM 1949 CA ILE B 8 -3.823 2.952 4.580 1.00 0.00 C ATOM 1950 C ILE B 8 -2.393 2.737 5.086 1.00 0.00 C ATOM 1951 O ILE B 8 -1.847 1.637 4.964 1.00 0.00 O ATOM 1952 CB ILE B 8 -4.867 2.401 5.632 1.00 0.00 C ATOM 1953 CG1 ILE B 8 -6.321 2.571 5.084 1.00 0.00 C ATOM 1954 CG2 ILE B 8 -4.709 3.072 7.021 1.00 0.00 C ATOM 1955 CD1 ILE B 8 -7.425 2.076 5.999 1.00 0.00 C ATOM 0 H ILE B 8 -3.823 1.274 3.309 1.00 0.00 H new ATOM 0 HA ILE B 8 -4.009 4.019 4.454 1.00 0.00 H new ATOM 0 HB ILE B 8 -4.667 1.339 5.775 1.00 0.00 H new ATOM 0 HG12 ILE B 8 -6.491 3.627 4.876 1.00 0.00 H new ATOM 0 HG13 ILE B 8 -6.397 2.043 4.133 1.00 0.00 H new ATOM 0 HG21 ILE B 8 -5.447 2.661 7.710 1.00 0.00 H new ATOM 0 HG22 ILE B 8 -3.707 2.880 7.406 1.00 0.00 H new ATOM 0 HG23 ILE B 8 -4.861 4.147 6.925 1.00 0.00 H new ATOM 0 HD11 ILE B 8 -8.392 2.241 5.524 1.00 0.00 H new ATOM 0 HD12 ILE B 8 -7.290 1.011 6.188 1.00 0.00 H new ATOM 0 HD13 ILE B 8 -7.387 2.620 6.943 1.00 0.00 H new ATOM 1967 N LEU B 9 -1.776 3.795 5.628 1.00 0.00 N ATOM 1968 CA LEU B 9 -0.479 3.691 6.317 1.00 0.00 C ATOM 1969 C LEU B 9 -0.747 3.579 7.818 1.00 0.00 C ATOM 1970 O LEU B 9 -1.671 4.191 8.374 1.00 0.00 O ATOM 1971 CB LEU B 9 0.474 4.871 5.953 1.00 0.00 C ATOM 1972 CG LEU B 9 1.455 4.602 4.763 1.00 0.00 C ATOM 1973 CD1 LEU B 9 2.480 3.502 5.120 1.00 0.00 C ATOM 1974 CD2 LEU B 9 0.699 4.258 3.466 1.00 0.00 C ATOM 0 H LEU B 9 -2.157 4.741 5.603 1.00 0.00 H new ATOM 0 HA LEU B 9 0.049 2.797 5.984 1.00 0.00 H new ATOM 0 HB2 LEU B 9 -0.133 5.744 5.711 1.00 0.00 H new ATOM 0 HB3 LEU B 9 1.062 5.126 6.835 1.00 0.00 H new ATOM 0 HG LEU B 9 2.005 5.526 4.583 1.00 0.00 H new ATOM 0 HD11 LEU B 9 3.147 3.338 4.274 1.00 0.00 H new ATOM 0 HD12 LEU B 9 3.063 3.815 5.986 1.00 0.00 H new ATOM 0 HD13 LEU B 9 1.954 2.576 5.352 1.00 0.00 H new ATOM 0 HD21 LEU B 9 1.415 4.078 2.664 1.00 0.00 H new ATOM 0 HD22 LEU B 9 0.097 3.363 3.622 1.00 0.00 H new ATOM 0 HD23 LEU B 9 0.049 5.089 3.192 1.00 0.00 H new ATOM 1986 N TYR B 10 0.132 2.794 8.451 1.00 0.00 N ATOM 1987 CA TYR B 10 -0.002 2.335 9.828 1.00 0.00 C ATOM 1988 C TYR B 10 0.870 3.221 10.747 1.00 0.00 C ATOM 1989 O TYR B 10 2.074 3.012 10.893 1.00 0.00 O ATOM 1990 CB TYR B 10 0.359 0.813 9.891 1.00 0.00 C ATOM 1991 CG TYR B 10 1.841 0.416 9.673 1.00 0.00 C ATOM 1992 CD1 TYR B 10 2.522 0.695 8.481 1.00 0.00 C ATOM 1993 CD2 TYR B 10 2.555 -0.253 10.676 1.00 0.00 C ATOM 1994 CE1 TYR B 10 3.842 0.323 8.302 1.00 0.00 C ATOM 1995 CE2 TYR B 10 3.870 -0.621 10.496 1.00 0.00 C ATOM 1996 CZ TYR B 10 4.511 -0.331 9.317 1.00 0.00 C ATOM 1997 OH TYR B 10 5.832 -0.688 9.157 1.00 0.00 O ATOM 0 H TYR B 10 0.981 2.453 8.000 1.00 0.00 H new ATOM 0 HA TYR B 10 -1.027 2.432 10.186 1.00 0.00 H new ATOM 0 HB2 TYR B 10 0.050 0.435 10.866 1.00 0.00 H new ATOM 0 HB3 TYR B 10 -0.241 0.294 9.143 1.00 0.00 H new ATOM 0 HD1 TYR B 10 2.006 1.211 7.685 1.00 0.00 H new ATOM 0 HD2 TYR B 10 2.064 -0.485 11.610 1.00 0.00 H new ATOM 0 HE1 TYR B 10 4.347 0.543 7.373 1.00 0.00 H new ATOM 0 HE2 TYR B 10 4.398 -1.138 11.283 1.00 0.00 H new ATOM 0 HH TYR B 10 5.980 -1.576 9.544 1.00 0.00 H new ATOM 2007 N VAL B 11 0.239 4.212 11.383 1.00 0.00 N ATOM 2008 CA VAL B 11 0.941 5.227 12.207 1.00 0.00 C ATOM 2009 C VAL B 11 0.606 4.959 13.676 1.00 0.00 C ATOM 2010 O VAL B 11 -0.105 4.011 13.975 1.00 0.00 O ATOM 2011 CB VAL B 11 0.539 6.702 11.804 1.00 0.00 C ATOM 2012 CG1 VAL B 11 0.866 6.984 10.319 1.00 0.00 C ATOM 2013 CG2 VAL B 11 -0.949 7.022 12.117 1.00 0.00 C ATOM 0 H VAL B 11 -0.772 4.342 11.348 1.00 0.00 H new ATOM 0 HA VAL B 11 2.014 5.143 12.037 1.00 0.00 H new ATOM 0 HB VAL B 11 1.141 7.369 12.421 1.00 0.00 H new ATOM 0 HG11 VAL B 11 0.579 8.006 10.071 1.00 0.00 H new ATOM 0 HG12 VAL B 11 1.936 6.857 10.151 1.00 0.00 H new ATOM 0 HG13 VAL B 11 0.315 6.288 9.687 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -1.171 8.047 11.820 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -1.592 6.337 11.565 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -1.129 6.906 13.186 1.00 0.00 H new ATOM 2023 N ASP B 12 1.147 5.767 14.591 1.00 0.00 N ATOM 2024 CA ASP B 12 0.915 5.602 16.035 1.00 0.00 C ATOM 2025 C ASP B 12 0.344 6.893 16.636 1.00 0.00 C ATOM 2026 O ASP B 12 -0.706 6.854 17.287 1.00 0.00 O ATOM 2027 CB ASP B 12 2.224 5.176 16.748 1.00 0.00 C ATOM 2028 CG ASP B 12 2.029 4.891 18.251 1.00 0.00 C ATOM 2029 OD1 ASP B 12 1.116 4.101 18.599 1.00 0.00 O ATOM 2030 OD2 ASP B 12 2.775 5.445 19.092 1.00 0.00 O ATOM 0 H ASP B 12 1.756 6.551 14.357 1.00 0.00 H new ATOM 0 HA ASP B 12 0.181 4.811 16.186 1.00 0.00 H new ATOM 0 HB2 ASP B 12 2.621 4.284 16.264 1.00 0.00 H new ATOM 0 HB3 ASP B 12 2.969 5.962 16.627 1.00 0.00 H new ATOM 2035 N ASN B 13 1.036 8.032 16.409 1.00 0.00 N ATOM 2036 CA ASN B 13 0.632 9.363 16.942 1.00 0.00 C ATOM 2037 C ASN B 13 -0.337 10.052 15.953 1.00 0.00 C ATOM 2038 O ASN B 13 0.118 10.528 14.912 1.00 0.00 O ATOM 2039 CB ASN B 13 1.883 10.268 17.160 1.00 0.00 C ATOM 2040 CG ASN B 13 2.906 9.722 18.157 1.00 0.00 C ATOM 2041 OD1 ASN B 13 3.032 8.513 18.354 1.00 0.00 O ATOM 2042 ND2 ASN B 13 3.663 10.617 18.776 1.00 0.00 N ATOM 0 H ASN B 13 1.890 8.060 15.852 1.00 0.00 H new ATOM 0 HA ASN B 13 0.133 9.215 17.900 1.00 0.00 H new ATOM 0 HB2 ASN B 13 2.377 10.418 16.200 1.00 0.00 H new ATOM 0 HB3 ASN B 13 1.550 11.247 17.503 1.00 0.00 H new ATOM 0 HD21 ASN B 13 4.376 10.311 19.438 1.00 0.00 H new ATOM 0 HD22 ASN B 13 3.533 11.611 18.590 1.00 0.00 H new ATOM 2049 N PRO B 14 -1.687 10.112 16.252 1.00 0.00 N ATOM 2050 CA PRO B 14 -2.687 10.713 15.327 1.00 0.00 C ATOM 2051 C PRO B 14 -2.343 12.173 14.861 1.00 0.00 C ATOM 2052 O PRO B 14 -2.251 12.382 13.651 1.00 0.00 O ATOM 2053 CB PRO B 14 -4.038 10.611 16.095 1.00 0.00 C ATOM 2054 CG PRO B 14 -3.817 9.522 17.104 1.00 0.00 C ATOM 2055 CD PRO B 14 -2.348 9.574 17.477 1.00 0.00 C ATOM 0 HA PRO B 14 -2.714 10.178 14.377 1.00 0.00 H new ATOM 0 HB2 PRO B 14 -4.292 11.554 16.579 1.00 0.00 H new ATOM 0 HB3 PRO B 14 -4.860 10.367 15.422 1.00 0.00 H new ATOM 0 HG2 PRO B 14 -4.446 9.672 17.982 1.00 0.00 H new ATOM 0 HG3 PRO B 14 -4.078 8.549 16.688 1.00 0.00 H new ATOM 0 HD2 PRO B 14 -2.177 10.218 18.339 1.00 0.00 H new ATOM 0 HD3 PRO B 14 -1.966 8.587 17.736 1.00 0.00 H new ATOM 2063 N PRO B 15 -2.104 13.209 15.769 1.00 0.00 N ATOM 2064 CA PRO B 15 -1.805 14.597 15.313 1.00 0.00 C ATOM 2065 C PRO B 15 -0.535 14.664 14.439 1.00 0.00 C ATOM 2066 O PRO B 15 -0.594 15.042 13.267 1.00 0.00 O ATOM 2067 CB PRO B 15 -1.637 15.407 16.634 1.00 0.00 C ATOM 2068 CG PRO B 15 -2.351 14.587 17.663 1.00 0.00 C ATOM 2069 CD PRO B 15 -2.111 13.149 17.259 1.00 0.00 C ATOM 0 HA PRO B 15 -2.596 14.995 14.677 1.00 0.00 H new ATOM 0 HB2 PRO B 15 -0.585 15.538 16.889 1.00 0.00 H new ATOM 0 HB3 PRO B 15 -2.071 16.403 16.548 1.00 0.00 H new ATOM 0 HG2 PRO B 15 -1.964 14.785 18.663 1.00 0.00 H new ATOM 0 HG3 PRO B 15 -3.416 14.818 17.682 1.00 0.00 H new ATOM 0 HD2 PRO B 15 -1.166 12.773 17.651 1.00 0.00 H new ATOM 0 HD3 PRO B 15 -2.895 12.490 17.632 1.00 0.00 H new ATOM 2077 N ALA B 16 0.589 14.219 15.025 1.00 0.00 N ATOM 2078 CA ALA B 16 1.941 14.455 14.485 1.00 0.00 C ATOM 2079 C ALA B 16 2.145 13.791 13.113 1.00 0.00 C ATOM 2080 O ALA B 16 2.660 14.419 12.176 1.00 0.00 O ATOM 2081 CB ALA B 16 2.992 13.953 15.479 1.00 0.00 C ATOM 0 H ALA B 16 0.586 13.682 15.892 1.00 0.00 H new ATOM 0 HA ALA B 16 2.055 15.529 14.341 1.00 0.00 H new ATOM 0 HB1 ALA B 16 3.989 14.130 15.075 1.00 0.00 H new ATOM 0 HB2 ALA B 16 2.883 14.486 16.423 1.00 0.00 H new ATOM 0 HB3 ALA B 16 2.853 12.885 15.647 1.00 0.00 H new ATOM 2087 N SER B 17 1.691 12.538 12.996 1.00 0.00 N ATOM 2088 CA SER B 17 1.911 11.721 11.798 1.00 0.00 C ATOM 2089 C SER B 17 0.973 12.157 10.666 1.00 0.00 C ATOM 2090 O SER B 17 1.364 12.142 9.496 1.00 0.00 O ATOM 2091 CB SER B 17 1.685 10.237 12.134 1.00 0.00 C ATOM 2092 OG SER B 17 2.401 9.869 13.304 1.00 0.00 O ATOM 0 H SER B 17 1.162 12.063 13.727 1.00 0.00 H new ATOM 0 HA SER B 17 2.939 11.860 11.462 1.00 0.00 H new ATOM 0 HB2 SER B 17 0.621 10.051 12.280 1.00 0.00 H new ATOM 0 HB3 SER B 17 2.005 9.617 11.296 1.00 0.00 H new ATOM 0 HG SER B 17 1.826 9.983 14.089 1.00 0.00 H new ATOM 2098 N THR B 18 -0.256 12.581 11.020 1.00 0.00 N ATOM 2099 CA THR B 18 -1.240 13.048 10.039 1.00 0.00 C ATOM 2100 C THR B 18 -0.882 14.385 9.378 1.00 0.00 C ATOM 2101 O THR B 18 -1.009 14.547 8.163 1.00 0.00 O ATOM 2102 CB THR B 18 -2.670 13.125 10.666 1.00 0.00 C ATOM 2103 OG1 THR B 18 -3.087 11.800 11.041 1.00 0.00 O ATOM 2104 CG2 THR B 18 -3.724 13.745 9.717 1.00 0.00 C ATOM 0 H THR B 18 -0.587 12.607 11.985 1.00 0.00 H new ATOM 0 HA THR B 18 -1.228 12.301 9.246 1.00 0.00 H new ATOM 0 HB THR B 18 -2.605 13.781 11.534 1.00 0.00 H new ATOM 0 HG1 THR B 18 -2.929 11.666 11.999 1.00 0.00 H new ATOM 0 HG21 THR B 18 -4.693 13.768 10.215 1.00 0.00 H new ATOM 0 HG22 THR B 18 -3.426 14.760 9.456 1.00 0.00 H new ATOM 0 HG23 THR B 18 -3.796 13.144 8.811 1.00 0.00 H new ATOM 2112 N GLN B 19 -0.335 15.295 10.212 1.00 0.00 N ATOM 2113 CA GLN B 19 0.237 16.581 9.767 1.00 0.00 C ATOM 2114 C GLN B 19 1.451 16.318 8.866 1.00 0.00 C ATOM 2115 O GLN B 19 1.678 17.040 7.887 1.00 0.00 O ATOM 2116 CB GLN B 19 0.649 17.440 10.994 1.00 0.00 C ATOM 2117 CG GLN B 19 -0.522 17.907 11.892 1.00 0.00 C ATOM 2118 CD GLN B 19 -1.275 19.143 11.385 1.00 0.00 C ATOM 2119 OE1 GLN B 19 -1.329 19.420 10.189 1.00 0.00 O ATOM 2120 NE2 GLN B 19 -1.875 19.886 12.301 1.00 0.00 N ATOM 0 H GLN B 19 -0.278 15.155 11.221 1.00 0.00 H new ATOM 0 HA GLN B 19 -0.514 17.131 9.201 1.00 0.00 H new ATOM 0 HB2 GLN B 19 1.346 16.865 11.603 1.00 0.00 H new ATOM 0 HB3 GLN B 19 1.187 18.319 10.638 1.00 0.00 H new ATOM 0 HG2 GLN B 19 -1.231 17.085 11.995 1.00 0.00 H new ATOM 0 HG3 GLN B 19 -0.134 18.120 12.888 1.00 0.00 H new ATOM 0 HE21 GLN B 19 -1.812 19.630 13.286 1.00 0.00 H new ATOM 0 HE22 GLN B 19 -2.400 20.714 12.022 1.00 0.00 H new ATOM 2129 N PHE B 20 2.216 15.259 9.196 1.00 0.00 N ATOM 2130 CA PHE B 20 3.413 14.892 8.439 1.00 0.00 C ATOM 2131 C PHE B 20 3.026 14.391 7.038 1.00 0.00 C ATOM 2132 O PHE B 20 3.689 14.759 6.070 1.00 0.00 O ATOM 2133 CB PHE B 20 4.262 13.830 9.188 1.00 0.00 C ATOM 2134 CG PHE B 20 5.576 13.492 8.471 1.00 0.00 C ATOM 2135 CD1 PHE B 20 6.566 14.464 8.313 1.00 0.00 C ATOM 2136 CD2 PHE B 20 5.810 12.229 7.925 1.00 0.00 C ATOM 2137 CE1 PHE B 20 7.737 14.182 7.645 1.00 0.00 C ATOM 2138 CE2 PHE B 20 6.985 11.956 7.251 1.00 0.00 C ATOM 2139 CZ PHE B 20 7.944 12.930 7.113 1.00 0.00 C ATOM 0 H PHE B 20 2.019 14.645 9.986 1.00 0.00 H new ATOM 0 HA PHE B 20 4.028 15.786 8.335 1.00 0.00 H new ATOM 0 HB2 PHE B 20 4.486 14.194 10.191 1.00 0.00 H new ATOM 0 HB3 PHE B 20 3.674 12.920 9.304 1.00 0.00 H new ATOM 0 HD1 PHE B 20 6.411 15.452 8.721 1.00 0.00 H new ATOM 0 HD2 PHE B 20 5.064 11.456 8.031 1.00 0.00 H new ATOM 0 HE1 PHE B 20 8.494 14.945 7.539 1.00 0.00 H new ATOM 0 HE2 PHE B 20 7.150 10.974 6.832 1.00 0.00 H new ATOM 0 HZ PHE B 20 8.861 12.713 6.586 1.00 0.00 H new ATOM 2149 N TYR B 21 1.923 13.606 6.922 1.00 0.00 N ATOM 2150 CA TYR B 21 1.394 13.165 5.605 1.00 0.00 C ATOM 2151 C TYR B 21 0.782 14.355 4.850 1.00 0.00 C ATOM 2152 O TYR B 21 0.794 14.351 3.612 1.00 0.00 O ATOM 2153 CB TYR B 21 0.406 11.974 5.754 1.00 0.00 C ATOM 2154 CG TYR B 21 1.122 10.616 5.813 1.00 0.00 C ATOM 2155 CD1 TYR B 21 1.689 10.144 6.998 1.00 0.00 C ATOM 2156 CD2 TYR B 21 1.277 9.833 4.663 1.00 0.00 C ATOM 2157 CE1 TYR B 21 2.377 8.952 7.035 1.00 0.00 C ATOM 2158 CE2 TYR B 21 1.957 8.634 4.701 1.00 0.00 C ATOM 2159 CZ TYR B 21 2.510 8.202 5.886 1.00 0.00 C ATOM 2160 OH TYR B 21 3.226 7.035 5.908 1.00 0.00 O ATOM 0 H TYR B 21 1.386 13.267 7.720 1.00 0.00 H new ATOM 0 HA TYR B 21 2.224 12.792 5.005 1.00 0.00 H new ATOM 0 HB2 TYR B 21 -0.185 12.108 6.660 1.00 0.00 H new ATOM 0 HB3 TYR B 21 -0.290 11.977 4.915 1.00 0.00 H new ATOM 0 HD1 TYR B 21 1.586 10.725 7.903 1.00 0.00 H new ATOM 0 HD2 TYR B 21 0.856 10.174 3.729 1.00 0.00 H new ATOM 0 HE1 TYR B 21 2.811 8.606 7.961 1.00 0.00 H new ATOM 0 HE2 TYR B 21 2.055 8.037 3.806 1.00 0.00 H new ATOM 0 HH TYR B 21 3.652 6.929 6.784 1.00 0.00 H new ATOM 2170 N LYS B 22 0.229 15.348 5.579 1.00 0.00 N ATOM 2171 CA LYS B 22 -0.371 16.548 4.952 1.00 0.00 C ATOM 2172 C LYS B 22 0.631 17.290 4.056 1.00 0.00 C ATOM 2173 O LYS B 22 0.325 17.643 2.920 1.00 0.00 O ATOM 2174 CB LYS B 22 -0.972 17.499 6.018 1.00 0.00 C ATOM 2175 CG LYS B 22 -2.269 16.970 6.664 1.00 0.00 C ATOM 2176 CD LYS B 22 -2.766 17.855 7.825 1.00 0.00 C ATOM 2177 CE LYS B 22 -3.171 19.270 7.381 1.00 0.00 C ATOM 2178 NZ LYS B 22 -3.624 20.112 8.518 1.00 0.00 N ATOM 0 H LYS B 22 0.185 15.344 6.598 1.00 0.00 H new ATOM 0 HA LYS B 22 -1.183 16.201 4.313 1.00 0.00 H new ATOM 0 HB2 LYS B 22 -0.231 17.668 6.799 1.00 0.00 H new ATOM 0 HB3 LYS B 22 -1.175 18.465 5.556 1.00 0.00 H new ATOM 0 HG2 LYS B 22 -3.048 16.906 5.904 1.00 0.00 H new ATOM 0 HG3 LYS B 22 -2.099 15.958 7.032 1.00 0.00 H new ATOM 0 HD2 LYS B 22 -3.620 17.373 8.300 1.00 0.00 H new ATOM 0 HD3 LYS B 22 -1.981 17.929 8.578 1.00 0.00 H new ATOM 0 HE2 LYS B 22 -2.324 19.751 6.891 1.00 0.00 H new ATOM 0 HE3 LYS B 22 -3.970 19.202 6.642 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 -3.708 21.101 8.206 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 -4.549 19.775 8.852 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 -2.933 20.051 9.293 1.00 0.00 H new ATOM 2192 N ALA B 23 1.838 17.507 4.605 1.00 0.00 N ATOM 2193 CA ALA B 23 2.954 18.161 3.888 1.00 0.00 C ATOM 2194 C ALA B 23 3.637 17.182 2.898 1.00 0.00 C ATOM 2195 O ALA B 23 4.108 17.589 1.829 1.00 0.00 O ATOM 2196 CB ALA B 23 3.973 18.700 4.905 1.00 0.00 C ATOM 0 H ALA B 23 2.071 17.235 5.560 1.00 0.00 H new ATOM 0 HA ALA B 23 2.554 18.991 3.305 1.00 0.00 H new ATOM 0 HB1 ALA B 23 4.795 19.182 4.376 1.00 0.00 H new ATOM 0 HB2 ALA B 23 3.487 19.425 5.558 1.00 0.00 H new ATOM 0 HB3 ALA B 23 4.360 17.876 5.504 1.00 0.00 H new ATOM 2202 N LEU B 24 3.689 15.896 3.294 1.00 0.00 N ATOM 2203 CA LEU B 24 4.342 14.798 2.527 1.00 0.00 C ATOM 2204 C LEU B 24 3.711 14.590 1.132 1.00 0.00 C ATOM 2205 O LEU B 24 4.390 14.204 0.169 1.00 0.00 O ATOM 2206 CB LEU B 24 4.189 13.468 3.327 1.00 0.00 C ATOM 2207 CG LEU B 24 5.135 12.285 2.959 1.00 0.00 C ATOM 2208 CD1 LEU B 24 6.538 12.520 3.536 1.00 0.00 C ATOM 2209 CD2 LEU B 24 4.565 10.925 3.421 1.00 0.00 C ATOM 0 H LEU B 24 3.274 15.577 4.169 1.00 0.00 H new ATOM 0 HA LEU B 24 5.387 15.075 2.389 1.00 0.00 H new ATOM 0 HB2 LEU B 24 4.332 13.695 4.384 1.00 0.00 H new ATOM 0 HB3 LEU B 24 3.161 13.124 3.211 1.00 0.00 H new ATOM 0 HG LEU B 24 5.209 12.247 1.872 1.00 0.00 H new ATOM 0 HD11 LEU B 24 7.186 11.685 3.270 1.00 0.00 H new ATOM 0 HD12 LEU B 24 6.950 13.443 3.127 1.00 0.00 H new ATOM 0 HD13 LEU B 24 6.476 12.600 4.621 1.00 0.00 H new ATOM 0 HD21 LEU B 24 5.256 10.128 3.145 1.00 0.00 H new ATOM 0 HD22 LEU B 24 4.435 10.934 4.503 1.00 0.00 H new ATOM 0 HD23 LEU B 24 3.601 10.753 2.941 1.00 0.00 H new ATOM 2221 N LEU B 25 2.396 14.858 1.058 1.00 0.00 N ATOM 2222 CA LEU B 25 1.600 14.763 -0.177 1.00 0.00 C ATOM 2223 C LEU B 25 1.291 16.163 -0.727 1.00 0.00 C ATOM 2224 O LEU B 25 1.335 16.377 -1.943 1.00 0.00 O ATOM 2225 CB LEU B 25 0.297 13.992 0.125 1.00 0.00 C ATOM 2226 CG LEU B 25 0.502 12.535 0.636 1.00 0.00 C ATOM 2227 CD1 LEU B 25 -0.833 11.877 1.003 1.00 0.00 C ATOM 2228 CD2 LEU B 25 1.261 11.698 -0.401 1.00 0.00 C ATOM 0 H LEU B 25 1.848 15.151 1.867 1.00 0.00 H new ATOM 0 HA LEU B 25 2.168 14.227 -0.938 1.00 0.00 H new ATOM 0 HB2 LEU B 25 -0.272 14.547 0.871 1.00 0.00 H new ATOM 0 HB3 LEU B 25 -0.309 13.962 -0.781 1.00 0.00 H new ATOM 0 HG LEU B 25 1.104 12.582 1.543 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.653 10.861 1.356 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -1.319 12.454 1.790 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -1.478 11.847 0.125 1.00 0.00 H new ATOM 0 HD21 LEU B 25 1.393 10.684 -0.024 1.00 0.00 H new ATOM 0 HD22 LEU B 25 0.693 11.668 -1.331 1.00 0.00 H new ATOM 0 HD23 LEU B 25 2.237 12.146 -0.587 1.00 0.00 H new ATOM 2240 N GLY B 26 0.979 17.098 0.183 1.00 0.00 N ATOM 2241 CA GLY B 26 0.452 18.418 -0.189 1.00 0.00 C ATOM 2242 C GLY B 26 -1.079 18.442 -0.183 1.00 0.00 C ATOM 2243 O GLY B 26 -1.703 19.198 -0.937 1.00 0.00 O ATOM 0 H GLY B 26 1.084 16.962 1.188 1.00 0.00 H new ATOM 0 HA2 GLY B 26 0.830 19.169 0.505 1.00 0.00 H new ATOM 0 HA3 GLY B 26 0.816 18.688 -1.180 1.00 0.00 H new ATOM 2247 N VAL B 27 -1.685 17.599 0.688 1.00 0.00 N ATOM 2248 CA VAL B 27 -3.160 17.461 0.834 1.00 0.00 C ATOM 2249 C VAL B 27 -3.560 17.652 2.315 1.00 0.00 C ATOM 2250 O VAL B 27 -2.703 17.904 3.159 1.00 0.00 O ATOM 2251 CB VAL B 27 -3.677 16.058 0.308 1.00 0.00 C ATOM 2252 CG1 VAL B 27 -3.318 15.845 -1.187 1.00 0.00 C ATOM 2253 CG2 VAL B 27 -3.158 14.891 1.191 1.00 0.00 C ATOM 0 H VAL B 27 -1.161 16.989 1.316 1.00 0.00 H new ATOM 0 HA VAL B 27 -3.629 18.233 0.224 1.00 0.00 H new ATOM 0 HB VAL B 27 -4.764 16.062 0.384 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -3.687 14.873 -1.515 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -3.779 16.630 -1.787 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -2.236 15.882 -1.310 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -3.532 13.945 0.800 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -2.068 14.883 1.179 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -3.509 15.025 2.214 1.00 0.00 H new ATOM 2263 N ASP B 28 -4.866 17.549 2.621 1.00 0.00 N ATOM 2264 CA ASP B 28 -5.388 17.602 4.012 1.00 0.00 C ATOM 2265 C ASP B 28 -6.476 16.510 4.191 1.00 0.00 C ATOM 2266 O ASP B 28 -7.130 16.137 3.203 1.00 0.00 O ATOM 2267 CB ASP B 28 -5.947 19.023 4.346 1.00 0.00 C ATOM 2268 CG ASP B 28 -7.215 19.397 3.557 1.00 0.00 C ATOM 2269 OD1 ASP B 28 -7.094 19.885 2.413 1.00 0.00 O ATOM 2270 OD2 ASP B 28 -8.341 19.206 4.073 1.00 0.00 O ATOM 0 H ASP B 28 -5.594 17.427 1.917 1.00 0.00 H new ATOM 0 HA ASP B 28 -4.574 17.407 4.710 1.00 0.00 H new ATOM 0 HB2 ASP B 28 -6.166 19.075 5.412 1.00 0.00 H new ATOM 0 HB3 ASP B 28 -5.173 19.764 4.143 1.00 0.00 H new ATOM 2275 N PRO B 29 -6.671 15.950 5.437 1.00 0.00 N ATOM 2276 CA PRO B 29 -7.672 14.890 5.683 1.00 0.00 C ATOM 2277 C PRO B 29 -9.122 15.411 5.549 1.00 0.00 C ATOM 2278 O PRO B 29 -9.576 16.222 6.361 1.00 0.00 O ATOM 2279 CB PRO B 29 -7.349 14.399 7.123 1.00 0.00 C ATOM 2280 CG PRO B 29 -6.682 15.569 7.782 1.00 0.00 C ATOM 2281 CD PRO B 29 -5.927 16.289 6.681 1.00 0.00 C ATOM 0 HA PRO B 29 -7.614 14.086 4.950 1.00 0.00 H new ATOM 0 HB2 PRO B 29 -8.255 14.108 7.655 1.00 0.00 H new ATOM 0 HB3 PRO B 29 -6.695 13.527 7.107 1.00 0.00 H new ATOM 0 HG2 PRO B 29 -7.416 16.227 8.247 1.00 0.00 H new ATOM 0 HG3 PRO B 29 -6.005 15.240 8.570 1.00 0.00 H new ATOM 0 HD2 PRO B 29 -5.908 17.365 6.851 1.00 0.00 H new ATOM 0 HD3 PRO B 29 -4.890 15.956 6.627 1.00 0.00 H new ATOM 2289 N VAL B 30 -9.822 14.932 4.498 1.00 0.00 N ATOM 2290 CA VAL B 30 -11.241 15.258 4.238 1.00 0.00 C ATOM 2291 C VAL B 30 -12.135 14.709 5.376 1.00 0.00 C ATOM 2292 O VAL B 30 -13.039 15.399 5.856 1.00 0.00 O ATOM 2293 CB VAL B 30 -11.705 14.716 2.824 1.00 0.00 C ATOM 2294 CG1 VAL B 30 -11.396 13.209 2.642 1.00 0.00 C ATOM 2295 CG2 VAL B 30 -13.204 15.016 2.553 1.00 0.00 C ATOM 0 H VAL B 30 -9.417 14.305 3.803 1.00 0.00 H new ATOM 0 HA VAL B 30 -11.346 16.343 4.216 1.00 0.00 H new ATOM 0 HB VAL B 30 -11.120 15.257 2.081 1.00 0.00 H new ATOM 0 HG11 VAL B 30 -11.733 12.885 1.657 1.00 0.00 H new ATOM 0 HG12 VAL B 30 -10.322 13.044 2.731 1.00 0.00 H new ATOM 0 HG13 VAL B 30 -11.915 12.636 3.410 1.00 0.00 H new ATOM 0 HG21 VAL B 30 -13.481 14.628 1.573 1.00 0.00 H new ATOM 0 HG22 VAL B 30 -13.815 14.538 3.319 1.00 0.00 H new ATOM 0 HG23 VAL B 30 -13.370 16.093 2.577 1.00 0.00 H new ATOM 2305 N GLU B 31 -11.839 13.473 5.814 1.00 0.00 N ATOM 2306 CA GLU B 31 -12.423 12.860 7.018 1.00 0.00 C ATOM 2307 C GLU B 31 -11.319 12.726 8.074 1.00 0.00 C ATOM 2308 O GLU B 31 -10.155 12.497 7.736 1.00 0.00 O ATOM 2309 CB GLU B 31 -13.033 11.465 6.698 1.00 0.00 C ATOM 2310 CG GLU B 31 -14.280 11.485 5.792 1.00 0.00 C ATOM 2311 CD GLU B 31 -15.488 12.188 6.446 1.00 0.00 C ATOM 2312 OE1 GLU B 31 -16.258 11.521 7.175 1.00 0.00 O ATOM 2313 OE2 GLU B 31 -15.666 13.411 6.262 1.00 0.00 O ATOM 0 H GLU B 31 -11.177 12.863 5.334 1.00 0.00 H new ATOM 0 HA GLU B 31 -13.229 13.492 7.391 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -12.268 10.852 6.222 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -13.294 10.976 7.637 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -14.035 11.989 4.857 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -14.555 10.461 5.539 1.00 0.00 H new ATOM 2320 N SER B 32 -11.690 12.876 9.349 1.00 0.00 N ATOM 2321 CA SER B 32 -10.752 12.775 10.470 1.00 0.00 C ATOM 2322 C SER B 32 -11.500 12.371 11.745 1.00 0.00 C ATOM 2323 O SER B 32 -12.688 12.665 11.912 1.00 0.00 O ATOM 2324 CB SER B 32 -9.998 14.115 10.665 1.00 0.00 C ATOM 2325 OG SER B 32 -10.897 15.194 10.847 1.00 0.00 O ATOM 0 H SER B 32 -12.650 13.071 9.633 1.00 0.00 H new ATOM 0 HA SER B 32 -10.014 12.004 10.248 1.00 0.00 H new ATOM 0 HB2 SER B 32 -9.338 14.040 11.529 1.00 0.00 H new ATOM 0 HB3 SER B 32 -9.367 14.308 9.798 1.00 0.00 H new ATOM 0 HG SER B 32 -10.391 16.024 10.969 1.00 0.00 H new ATOM 2331 N SER B 33 -10.770 11.705 12.628 1.00 0.00 N ATOM 2332 CA SER B 33 -11.258 11.174 13.909 1.00 0.00 C ATOM 2333 C SER B 33 -10.159 11.428 14.971 1.00 0.00 C ATOM 2334 O SER B 33 -9.017 11.723 14.590 1.00 0.00 O ATOM 2335 CB SER B 33 -11.544 9.656 13.747 1.00 0.00 C ATOM 2336 OG SER B 33 -12.444 9.408 12.680 1.00 0.00 O ATOM 0 H SER B 33 -9.781 11.508 12.473 1.00 0.00 H new ATOM 0 HA SER B 33 -12.182 11.661 14.222 1.00 0.00 H new ATOM 0 HB2 SER B 33 -10.609 9.126 13.566 1.00 0.00 H new ATOM 0 HB3 SER B 33 -11.960 9.262 14.674 1.00 0.00 H new ATOM 0 HG SER B 33 -12.156 8.611 12.188 1.00 0.00 H new ATOM 2342 N PRO B 34 -10.464 11.351 16.313 1.00 0.00 N ATOM 2343 CA PRO B 34 -9.440 11.548 17.380 1.00 0.00 C ATOM 2344 C PRO B 34 -8.208 10.610 17.232 1.00 0.00 C ATOM 2345 O PRO B 34 -7.095 10.978 17.625 1.00 0.00 O ATOM 2346 CB PRO B 34 -10.222 11.279 18.704 1.00 0.00 C ATOM 2347 CG PRO B 34 -11.487 10.587 18.278 1.00 0.00 C ATOM 2348 CD PRO B 34 -11.810 11.132 16.906 1.00 0.00 C ATOM 0 HA PRO B 34 -9.005 12.547 17.338 1.00 0.00 H new ATOM 0 HB2 PRO B 34 -9.642 10.656 19.385 1.00 0.00 H new ATOM 0 HB3 PRO B 34 -10.439 12.209 19.230 1.00 0.00 H new ATOM 0 HG2 PRO B 34 -11.351 9.506 18.248 1.00 0.00 H new ATOM 0 HG3 PRO B 34 -12.297 10.786 18.979 1.00 0.00 H new ATOM 0 HD2 PRO B 34 -12.400 10.428 16.320 1.00 0.00 H new ATOM 0 HD3 PRO B 34 -12.382 12.058 16.963 1.00 0.00 H new ATOM 2356 N THR B 35 -8.423 9.398 16.678 1.00 0.00 N ATOM 2357 CA THR B 35 -7.353 8.390 16.516 1.00 0.00 C ATOM 2358 C THR B 35 -7.292 7.805 15.069 1.00 0.00 C ATOM 2359 O THR B 35 -6.742 6.711 14.844 1.00 0.00 O ATOM 2360 CB THR B 35 -7.535 7.274 17.596 1.00 0.00 C ATOM 2361 OG1 THR B 35 -6.428 6.360 17.577 1.00 0.00 O ATOM 2362 CG2 THR B 35 -8.864 6.516 17.419 1.00 0.00 C ATOM 0 H THR B 35 -9.333 9.092 16.334 1.00 0.00 H new ATOM 0 HA THR B 35 -6.391 8.879 16.668 1.00 0.00 H new ATOM 0 HB THR B 35 -7.564 7.767 18.568 1.00 0.00 H new ATOM 0 HG1 THR B 35 -5.755 6.648 18.228 1.00 0.00 H new ATOM 0 HG21 THR B 35 -8.951 5.750 18.189 1.00 0.00 H new ATOM 0 HG22 THR B 35 -9.696 7.215 17.507 1.00 0.00 H new ATOM 0 HG23 THR B 35 -8.887 6.046 16.436 1.00 0.00 H new ATOM 2370 N PHE B 36 -7.816 8.557 14.082 1.00 0.00 N ATOM 2371 CA PHE B 36 -7.843 8.121 12.659 1.00 0.00 C ATOM 2372 C PHE B 36 -7.868 9.357 11.739 1.00 0.00 C ATOM 2373 O PHE B 36 -8.225 10.450 12.172 1.00 0.00 O ATOM 2374 CB PHE B 36 -9.085 7.209 12.402 1.00 0.00 C ATOM 2375 CG PHE B 36 -9.173 6.559 11.008 1.00 0.00 C ATOM 2376 CD1 PHE B 36 -8.454 5.401 10.721 1.00 0.00 C ATOM 2377 CD2 PHE B 36 -9.976 7.097 9.990 1.00 0.00 C ATOM 2378 CE1 PHE B 36 -8.523 4.806 9.476 1.00 0.00 C ATOM 2379 CE2 PHE B 36 -10.044 6.497 8.744 1.00 0.00 C ATOM 2380 CZ PHE B 36 -9.318 5.353 8.489 1.00 0.00 C ATOM 0 H PHE B 36 -8.230 9.476 14.239 1.00 0.00 H new ATOM 0 HA PHE B 36 -6.946 7.543 12.439 1.00 0.00 H new ATOM 0 HB2 PHE B 36 -9.089 6.417 13.151 1.00 0.00 H new ATOM 0 HB3 PHE B 36 -9.985 7.803 12.561 1.00 0.00 H new ATOM 0 HD1 PHE B 36 -7.831 4.960 11.486 1.00 0.00 H new ATOM 0 HD2 PHE B 36 -10.549 7.992 10.181 1.00 0.00 H new ATOM 0 HE1 PHE B 36 -7.954 3.911 9.275 1.00 0.00 H new ATOM 0 HE2 PHE B 36 -10.666 6.925 7.972 1.00 0.00 H new ATOM 0 HZ PHE B 36 -9.371 4.885 7.517 1.00 0.00 H new ATOM 2390 N SER B 37 -7.467 9.174 10.470 1.00 0.00 N ATOM 2391 CA SER B 37 -7.521 10.223 9.431 1.00 0.00 C ATOM 2392 C SER B 37 -7.742 9.584 8.052 1.00 0.00 C ATOM 2393 O SER B 37 -7.404 8.417 7.840 1.00 0.00 O ATOM 2394 CB SER B 37 -6.221 11.061 9.435 1.00 0.00 C ATOM 2395 OG SER B 37 -6.039 11.725 10.682 1.00 0.00 O ATOM 0 H SER B 37 -7.093 8.288 10.131 1.00 0.00 H new ATOM 0 HA SER B 37 -8.356 10.888 9.650 1.00 0.00 H new ATOM 0 HB2 SER B 37 -5.367 10.413 9.237 1.00 0.00 H new ATOM 0 HB3 SER B 37 -6.257 11.796 8.631 1.00 0.00 H new ATOM 0 HG SER B 37 -5.085 11.749 10.904 1.00 0.00 H new ATOM 2401 N LEU B 38 -8.325 10.357 7.130 1.00 0.00 N ATOM 2402 CA LEU B 38 -8.614 9.924 5.762 1.00 0.00 C ATOM 2403 C LEU B 38 -8.505 11.150 4.837 1.00 0.00 C ATOM 2404 O LEU B 38 -9.208 12.138 5.031 1.00 0.00 O ATOM 2405 CB LEU B 38 -10.020 9.246 5.720 1.00 0.00 C ATOM 2406 CG LEU B 38 -10.564 8.706 4.346 1.00 0.00 C ATOM 2407 CD1 LEU B 38 -11.374 9.763 3.572 1.00 0.00 C ATOM 2408 CD2 LEU B 38 -9.438 8.131 3.466 1.00 0.00 C ATOM 0 H LEU B 38 -8.614 11.317 7.318 1.00 0.00 H new ATOM 0 HA LEU B 38 -7.898 9.179 5.414 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -10.003 8.410 6.419 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -10.744 9.966 6.101 1.00 0.00 H new ATOM 0 HG LEU B 38 -11.246 7.893 4.594 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -11.725 9.336 2.632 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -12.230 10.076 4.170 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -10.741 10.626 3.365 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -9.858 7.770 2.527 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -8.704 8.910 3.259 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -8.954 7.306 3.988 1.00 0.00 H new ATOM 2420 N PHE B 39 -7.635 11.050 3.824 1.00 0.00 N ATOM 2421 CA PHE B 39 -7.475 12.049 2.746 1.00 0.00 C ATOM 2422 C PHE B 39 -7.556 11.323 1.389 1.00 0.00 C ATOM 2423 O PHE B 39 -6.920 10.288 1.180 1.00 0.00 O ATOM 2424 CB PHE B 39 -6.139 12.852 2.913 1.00 0.00 C ATOM 2425 CG PHE B 39 -4.979 12.061 3.516 1.00 0.00 C ATOM 2426 CD1 PHE B 39 -4.100 11.336 2.716 1.00 0.00 C ATOM 2427 CD2 PHE B 39 -4.776 12.040 4.898 1.00 0.00 C ATOM 2428 CE1 PHE B 39 -3.063 10.623 3.280 1.00 0.00 C ATOM 2429 CE2 PHE B 39 -3.742 11.326 5.445 1.00 0.00 C ATOM 2430 CZ PHE B 39 -2.884 10.616 4.636 1.00 0.00 C ATOM 0 H PHE B 39 -7.005 10.254 3.724 1.00 0.00 H new ATOM 0 HA PHE B 39 -8.277 12.785 2.798 1.00 0.00 H new ATOM 0 HB2 PHE B 39 -5.834 13.227 1.936 1.00 0.00 H new ATOM 0 HB3 PHE B 39 -6.332 13.721 3.542 1.00 0.00 H new ATOM 0 HD1 PHE B 39 -4.231 11.332 1.644 1.00 0.00 H new ATOM 0 HD2 PHE B 39 -5.442 12.593 5.543 1.00 0.00 H new ATOM 0 HE1 PHE B 39 -2.388 10.067 2.647 1.00 0.00 H new ATOM 0 HE2 PHE B 39 -3.600 11.320 6.516 1.00 0.00 H new ATOM 0 HZ PHE B 39 -2.071 10.054 5.071 1.00 0.00 H new ATOM 2440 N VAL B 40 -8.361 11.886 0.471 1.00 0.00 N ATOM 2441 CA VAL B 40 -8.612 11.307 -0.860 1.00 0.00 C ATOM 2442 C VAL B 40 -7.938 12.185 -1.927 1.00 0.00 C ATOM 2443 O VAL B 40 -8.167 13.399 -1.969 1.00 0.00 O ATOM 2444 CB VAL B 40 -10.161 11.200 -1.168 1.00 0.00 C ATOM 2445 CG1 VAL B 40 -10.421 10.422 -2.488 1.00 0.00 C ATOM 2446 CG2 VAL B 40 -10.929 10.567 0.016 1.00 0.00 C ATOM 0 H VAL B 40 -8.859 12.761 0.633 1.00 0.00 H new ATOM 0 HA VAL B 40 -8.196 10.299 -0.877 1.00 0.00 H new ATOM 0 HB VAL B 40 -10.540 12.213 -1.301 1.00 0.00 H new ATOM 0 HG11 VAL B 40 -11.494 10.366 -2.672 1.00 0.00 H new ATOM 0 HG12 VAL B 40 -9.938 10.940 -3.317 1.00 0.00 H new ATOM 0 HG13 VAL B 40 -10.014 9.414 -2.403 1.00 0.00 H new ATOM 0 HG21 VAL B 40 -11.990 10.508 -0.228 1.00 0.00 H new ATOM 0 HG22 VAL B 40 -10.544 9.565 0.205 1.00 0.00 H new ATOM 0 HG23 VAL B 40 -10.795 11.181 0.906 1.00 0.00 H new ATOM 2456 N LEU B 41 -7.109 11.564 -2.774 1.00 0.00 N ATOM 2457 CA LEU B 41 -6.234 12.282 -3.718 1.00 0.00 C ATOM 2458 C LEU B 41 -6.890 12.312 -5.104 1.00 0.00 C ATOM 2459 O LEU B 41 -7.525 11.330 -5.514 1.00 0.00 O ATOM 2460 CB LEU B 41 -4.820 11.623 -3.800 1.00 0.00 C ATOM 2461 CG LEU B 41 -3.927 11.665 -2.506 1.00 0.00 C ATOM 2462 CD1 LEU B 41 -4.457 10.735 -1.389 1.00 0.00 C ATOM 2463 CD2 LEU B 41 -2.452 11.346 -2.839 1.00 0.00 C ATOM 0 H LEU B 41 -7.023 10.549 -2.827 1.00 0.00 H new ATOM 0 HA LEU B 41 -6.101 13.302 -3.356 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -4.951 10.579 -4.086 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -4.269 12.107 -4.606 1.00 0.00 H new ATOM 0 HG LEU B 41 -3.981 12.683 -2.120 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -3.804 10.802 -0.519 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -5.466 11.040 -1.110 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -4.475 9.707 -1.750 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -1.857 11.382 -1.926 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -2.385 10.350 -3.277 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -2.072 12.081 -3.549 1.00 0.00 H new ATOM 2475 N ALA B 42 -6.681 13.425 -5.835 1.00 0.00 N ATOM 2476 CA ALA B 42 -7.248 13.644 -7.190 1.00 0.00 C ATOM 2477 C ALA B 42 -6.655 12.685 -8.245 1.00 0.00 C ATOM 2478 O ALA B 42 -7.105 12.663 -9.391 1.00 0.00 O ATOM 2479 CB ALA B 42 -7.046 15.107 -7.612 1.00 0.00 C ATOM 0 H ALA B 42 -6.112 14.204 -5.504 1.00 0.00 H new ATOM 0 HA ALA B 42 -8.314 13.425 -7.136 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -7.464 15.260 -8.607 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -7.549 15.763 -6.902 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -5.981 15.338 -7.627 1.00 0.00 H new ATOM 2485 N ASN B 43 -5.649 11.888 -7.833 1.00 0.00 N ATOM 2486 CA ASN B 43 -5.023 10.828 -8.657 1.00 0.00 C ATOM 2487 C ASN B 43 -6.001 9.668 -8.982 1.00 0.00 C ATOM 2488 O ASN B 43 -5.681 8.801 -9.802 1.00 0.00 O ATOM 2489 CB ASN B 43 -3.800 10.242 -7.903 1.00 0.00 C ATOM 2490 CG ASN B 43 -2.743 11.273 -7.521 1.00 0.00 C ATOM 2491 OD1 ASN B 43 -2.815 11.897 -6.464 1.00 0.00 O ATOM 2492 ND2 ASN B 43 -1.746 11.441 -8.363 1.00 0.00 N ATOM 0 H ASN B 43 -5.240 11.962 -6.902 1.00 0.00 H new ATOM 0 HA ASN B 43 -4.724 11.291 -9.598 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -4.150 9.746 -6.998 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -3.336 9.478 -8.526 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -1.003 12.105 -8.147 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -1.717 10.907 -9.232 1.00 0.00 H new ATOM 2499 N GLY B 44 -7.178 9.650 -8.323 1.00 0.00 N ATOM 2500 CA GLY B 44 -8.130 8.538 -8.442 1.00 0.00 C ATOM 2501 C GLY B 44 -7.850 7.444 -7.418 1.00 0.00 C ATOM 2502 O GLY B 44 -8.320 6.308 -7.556 1.00 0.00 O ATOM 0 H GLY B 44 -7.488 10.398 -7.702 1.00 0.00 H new ATOM 0 HA2 GLY B 44 -9.145 8.912 -8.307 1.00 0.00 H new ATOM 0 HA3 GLY B 44 -8.076 8.119 -9.447 1.00 0.00 H new ATOM 2506 N MET B 45 -7.056 7.801 -6.390 1.00 0.00 N ATOM 2507 CA MET B 45 -6.683 6.908 -5.285 1.00 0.00 C ATOM 2508 C MET B 45 -7.199 7.498 -3.959 1.00 0.00 C ATOM 2509 O MET B 45 -7.540 8.690 -3.882 1.00 0.00 O ATOM 2510 CB MET B 45 -5.140 6.736 -5.216 1.00 0.00 C ATOM 2511 CG MET B 45 -4.389 8.005 -4.762 1.00 0.00 C ATOM 2512 SD MET B 45 -2.707 7.687 -4.216 1.00 0.00 S ATOM 2513 CE MET B 45 -2.939 6.482 -2.897 1.00 0.00 C ATOM 0 H MET B 45 -6.651 8.734 -6.306 1.00 0.00 H new ATOM 0 HA MET B 45 -7.132 5.929 -5.455 1.00 0.00 H new ATOM 0 HB2 MET B 45 -4.905 5.922 -4.530 1.00 0.00 H new ATOM 0 HB3 MET B 45 -4.773 6.441 -6.199 1.00 0.00 H new ATOM 0 HG2 MET B 45 -4.366 8.718 -5.586 1.00 0.00 H new ATOM 0 HG3 MET B 45 -4.944 8.474 -3.949 1.00 0.00 H new ATOM 0 HE1 MET B 45 -2.098 6.533 -2.206 1.00 0.00 H new ATOM 0 HE2 MET B 45 -3.863 6.702 -2.362 1.00 0.00 H new ATOM 0 HE3 MET B 45 -2.997 5.481 -3.325 1.00 0.00 H new ATOM 2523 N LYS B 46 -7.210 6.669 -2.919 1.00 0.00 N ATOM 2524 CA LYS B 46 -7.688 7.044 -1.585 1.00 0.00 C ATOM 2525 C LYS B 46 -6.644 6.570 -0.557 1.00 0.00 C ATOM 2526 O LYS B 46 -6.083 5.479 -0.713 1.00 0.00 O ATOM 2527 CB LYS B 46 -9.087 6.398 -1.375 1.00 0.00 C ATOM 2528 CG LYS B 46 -9.867 6.877 -0.134 1.00 0.00 C ATOM 2529 CD LYS B 46 -11.340 6.397 -0.142 1.00 0.00 C ATOM 2530 CE LYS B 46 -12.150 6.919 1.061 1.00 0.00 C ATOM 2531 NZ LYS B 46 -13.579 6.530 0.984 1.00 0.00 N ATOM 0 H LYS B 46 -6.884 5.704 -2.976 1.00 0.00 H new ATOM 0 HA LYS B 46 -7.803 8.121 -1.467 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -9.693 6.593 -2.260 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -8.961 5.317 -1.307 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -9.373 6.511 0.766 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -9.843 7.966 -0.091 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -11.818 6.725 -1.065 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -11.361 5.307 -0.142 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -11.719 6.531 1.984 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -12.073 8.005 1.105 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -14.085 6.902 1.813 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -13.999 6.922 0.117 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -13.656 5.493 0.968 1.00 0.00 H new ATOM 2545 N LEU B 47 -6.361 7.391 0.473 1.00 0.00 N ATOM 2546 CA LEU B 47 -5.247 7.122 1.417 1.00 0.00 C ATOM 2547 C LEU B 47 -5.688 7.414 2.875 1.00 0.00 C ATOM 2548 O LEU B 47 -6.115 8.522 3.199 1.00 0.00 O ATOM 2549 CB LEU B 47 -3.983 7.947 1.000 1.00 0.00 C ATOM 2550 CG LEU B 47 -2.583 7.258 1.183 1.00 0.00 C ATOM 2551 CD1 LEU B 47 -1.471 8.127 0.564 1.00 0.00 C ATOM 2552 CD2 LEU B 47 -2.270 6.923 2.664 1.00 0.00 C ATOM 0 H LEU B 47 -6.883 8.243 0.676 1.00 0.00 H new ATOM 0 HA LEU B 47 -4.979 6.066 1.372 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -4.090 8.221 -0.050 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -3.981 8.874 1.573 1.00 0.00 H new ATOM 0 HG LEU B 47 -2.622 6.306 0.654 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -0.507 7.636 0.699 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -1.664 8.261 -0.500 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -1.454 9.100 1.055 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -1.291 6.449 2.731 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -2.270 7.841 3.252 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -3.029 6.244 3.052 1.00 0.00 H new ATOM 2564 N GLY B 48 -5.574 6.385 3.733 1.00 0.00 N ATOM 2565 CA GLY B 48 -5.945 6.454 5.150 1.00 0.00 C ATOM 2566 C GLY B 48 -4.724 6.582 6.036 1.00 0.00 C ATOM 2567 O GLY B 48 -3.594 6.365 5.589 1.00 0.00 O ATOM 0 H GLY B 48 -5.216 5.471 3.454 1.00 0.00 H new ATOM 0 HA2 GLY B 48 -6.606 7.305 5.313 1.00 0.00 H new ATOM 0 HA3 GLY B 48 -6.504 5.559 5.425 1.00 0.00 H new ATOM 2571 N LEU B 49 -4.979 6.872 7.318 1.00 0.00 N ATOM 2572 CA LEU B 49 -3.996 6.783 8.407 1.00 0.00 C ATOM 2573 C LEU B 49 -4.714 6.204 9.626 1.00 0.00 C ATOM 2574 O LEU B 49 -5.581 6.869 10.205 1.00 0.00 O ATOM 2575 CB LEU B 49 -3.386 8.167 8.759 1.00 0.00 C ATOM 2576 CG LEU B 49 -2.438 8.809 7.711 1.00 0.00 C ATOM 2577 CD1 LEU B 49 -1.838 10.109 8.252 1.00 0.00 C ATOM 2578 CD2 LEU B 49 -1.330 7.844 7.249 1.00 0.00 C ATOM 0 H LEU B 49 -5.897 7.183 7.635 1.00 0.00 H new ATOM 0 HA LEU B 49 -3.168 6.147 8.093 1.00 0.00 H new ATOM 0 HB2 LEU B 49 -4.206 8.861 8.943 1.00 0.00 H new ATOM 0 HB3 LEU B 49 -2.837 8.066 9.695 1.00 0.00 H new ATOM 0 HG LEU B 49 -3.041 9.039 6.833 1.00 0.00 H new ATOM 0 HD11 LEU B 49 -1.176 10.544 7.503 1.00 0.00 H new ATOM 0 HD12 LEU B 49 -2.639 10.812 8.481 1.00 0.00 H new ATOM 0 HD13 LEU B 49 -1.271 9.898 9.159 1.00 0.00 H new ATOM 0 HD21 LEU B 49 -0.695 8.343 6.517 1.00 0.00 H new ATOM 0 HD22 LEU B 49 -0.728 7.544 8.107 1.00 0.00 H new ATOM 0 HD23 LEU B 49 -1.782 6.961 6.796 1.00 0.00 H new ATOM 2590 N TRP B 50 -4.377 4.958 9.994 1.00 0.00 N ATOM 2591 CA TRP B 50 -4.929 4.306 11.194 1.00 0.00 C ATOM 2592 C TRP B 50 -3.831 4.230 12.263 1.00 0.00 C ATOM 2593 O TRP B 50 -2.716 3.772 11.984 1.00 0.00 O ATOM 2594 CB TRP B 50 -5.497 2.879 10.883 1.00 0.00 C ATOM 2595 CG TRP B 50 -6.487 2.344 11.941 1.00 0.00 C ATOM 2596 CD1 TRP B 50 -6.844 2.925 13.141 1.00 0.00 C ATOM 2597 CD2 TRP B 50 -7.263 1.131 11.873 1.00 0.00 C ATOM 2598 NE1 TRP B 50 -7.778 2.161 13.789 1.00 0.00 N ATOM 2599 CE2 TRP B 50 -8.048 1.057 13.036 1.00 0.00 C ATOM 2600 CE3 TRP B 50 -7.361 0.101 10.949 1.00 0.00 C ATOM 2601 CZ2 TRP B 50 -8.924 0.003 13.277 1.00 0.00 C ATOM 2602 CZ3 TRP B 50 -8.231 -0.946 11.185 1.00 0.00 C ATOM 2603 CH2 TRP B 50 -8.995 -0.992 12.343 1.00 0.00 C ATOM 0 H TRP B 50 -3.720 4.377 9.473 1.00 0.00 H new ATOM 0 HA TRP B 50 -5.766 4.901 11.558 1.00 0.00 H new ATOM 0 HB2 TRP B 50 -5.996 2.903 9.914 1.00 0.00 H new ATOM 0 HB3 TRP B 50 -4.665 2.181 10.795 1.00 0.00 H new ATOM 0 HD1 TRP B 50 -6.442 3.854 13.517 1.00 0.00 H new ATOM 0 HE1 TRP B 50 -8.203 2.382 14.689 1.00 0.00 H new ATOM 0 HE3 TRP B 50 -6.761 0.117 10.051 1.00 0.00 H new ATOM 0 HZ2 TRP B 50 -9.527 -0.028 14.172 1.00 0.00 H new ATOM 0 HZ3 TRP B 50 -8.318 -1.740 10.458 1.00 0.00 H new ATOM 0 HH2 TRP B 50 -9.657 -1.829 12.509 1.00 0.00 H new ATOM 2614 N SER B 51 -4.156 4.701 13.474 1.00 0.00 N ATOM 2615 CA SER B 51 -3.256 4.640 14.619 1.00 0.00 C ATOM 2616 C SER B 51 -3.282 3.224 15.244 1.00 0.00 C ATOM 2617 O SER B 51 -4.344 2.733 15.640 1.00 0.00 O ATOM 2618 CB SER B 51 -3.651 5.723 15.637 1.00 0.00 C ATOM 2619 OG SER B 51 -3.665 7.007 15.029 1.00 0.00 O ATOM 0 H SER B 51 -5.055 5.135 13.682 1.00 0.00 H new ATOM 0 HA SER B 51 -2.233 4.834 14.297 1.00 0.00 H new ATOM 0 HB2 SER B 51 -4.635 5.500 16.048 1.00 0.00 H new ATOM 0 HB3 SER B 51 -2.949 5.718 16.471 1.00 0.00 H new ATOM 0 HG SER B 51 -4.589 7.263 14.826 1.00 0.00 H new ATOM 2625 N ARG B 52 -2.106 2.584 15.326 1.00 0.00 N ATOM 2626 CA ARG B 52 -1.957 1.159 15.680 1.00 0.00 C ATOM 2627 C ARG B 52 -2.293 0.877 17.157 1.00 0.00 C ATOM 2628 O ARG B 52 -2.492 -0.280 17.541 1.00 0.00 O ATOM 2629 CB ARG B 52 -0.516 0.685 15.365 1.00 0.00 C ATOM 2630 CG ARG B 52 0.584 1.416 16.163 1.00 0.00 C ATOM 2631 CD ARG B 52 1.986 0.824 15.941 1.00 0.00 C ATOM 2632 NE ARG B 52 2.986 1.512 16.768 1.00 0.00 N ATOM 2633 CZ ARG B 52 3.157 1.323 18.085 1.00 0.00 C ATOM 2634 NH1 ARG B 52 2.459 0.403 18.744 1.00 0.00 N ATOM 2635 NH2 ARG B 52 4.028 2.067 18.742 1.00 0.00 N ATOM 0 H ARG B 52 -1.215 3.047 15.146 1.00 0.00 H new ATOM 0 HA ARG B 52 -2.673 0.601 15.076 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -0.446 -0.384 15.568 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -0.326 0.821 14.300 1.00 0.00 H new ATOM 0 HG2 ARG B 52 0.592 2.468 15.879 1.00 0.00 H new ATOM 0 HG3 ARG B 52 0.343 1.374 17.225 1.00 0.00 H new ATOM 0 HD2 ARG B 52 1.978 -0.239 16.183 1.00 0.00 H new ATOM 0 HD3 ARG B 52 2.258 0.909 14.889 1.00 0.00 H new ATOM 0 HE ARG B 52 3.597 2.185 16.306 1.00 0.00 H new ATOM 0 HH11 ARG B 52 1.780 -0.174 18.248 1.00 0.00 H new ATOM 0 HH12 ARG B 52 2.603 0.274 19.746 1.00 0.00 H new ATOM 0 HH21 ARG B 52 4.565 2.780 18.248 1.00 0.00 H new ATOM 0 HH22 ARG B 52 4.164 1.929 19.744 1.00 0.00 H new ATOM 2649 N HIS B 53 -2.359 1.941 17.978 1.00 0.00 N ATOM 2650 CA HIS B 53 -2.696 1.823 19.410 1.00 0.00 C ATOM 2651 C HIS B 53 -4.203 1.500 19.606 1.00 0.00 C ATOM 2652 O HIS B 53 -4.636 1.227 20.728 1.00 0.00 O ATOM 2653 CB HIS B 53 -2.302 3.114 20.183 1.00 0.00 C ATOM 2654 CG HIS B 53 -3.225 4.288 19.984 1.00 0.00 C ATOM 2655 ND1 HIS B 53 -4.335 4.504 20.778 1.00 0.00 N ATOM 2656 CD2 HIS B 53 -3.205 5.305 19.095 1.00 0.00 C ATOM 2657 CE1 HIS B 53 -4.950 5.596 20.384 1.00 0.00 C ATOM 2658 NE2 HIS B 53 -4.286 6.102 19.367 1.00 0.00 N ATOM 0 H HIS B 53 -2.182 2.898 17.672 1.00 0.00 H new ATOM 0 HA HIS B 53 -2.119 0.994 19.820 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -2.259 2.882 21.247 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -1.297 3.407 19.880 1.00 0.00 H new ATOM 0 HD1 HIS B 53 -4.631 3.908 21.551 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -2.474 5.461 18.316 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -5.848 6.008 20.821 1.00 0.00 H new ATOM 2667 N THR B 54 -4.993 1.552 18.507 1.00 0.00 N ATOM 2668 CA THR B 54 -6.442 1.258 18.527 1.00 0.00 C ATOM 2669 C THR B 54 -6.849 0.341 17.348 1.00 0.00 C ATOM 2670 O THR B 54 -8.042 0.060 17.164 1.00 0.00 O ATOM 2671 CB THR B 54 -7.273 2.593 18.491 1.00 0.00 C ATOM 2672 OG1 THR B 54 -8.669 2.353 18.757 1.00 0.00 O ATOM 2673 CG2 THR B 54 -7.137 3.306 17.132 1.00 0.00 C ATOM 0 H THR B 54 -4.641 1.799 17.582 1.00 0.00 H new ATOM 0 HA THR B 54 -6.661 0.729 19.454 1.00 0.00 H new ATOM 0 HB THR B 54 -6.865 3.233 19.273 1.00 0.00 H new ATOM 0 HG1 THR B 54 -8.977 1.591 18.223 1.00 0.00 H new ATOM 0 HG21 THR B 54 -7.724 4.224 17.143 1.00 0.00 H new ATOM 0 HG22 THR B 54 -6.090 3.547 16.951 1.00 0.00 H new ATOM 0 HG23 THR B 54 -7.501 2.652 16.340 1.00 0.00 H new ATOM 2681 N VAL B 55 -5.856 -0.120 16.548 1.00 0.00 N ATOM 2682 CA VAL B 55 -6.108 -0.983 15.368 1.00 0.00 C ATOM 2683 C VAL B 55 -6.804 -2.309 15.770 1.00 0.00 C ATOM 2684 O VAL B 55 -6.609 -2.804 16.887 1.00 0.00 O ATOM 2685 CB VAL B 55 -4.781 -1.279 14.555 1.00 0.00 C ATOM 2686 CG1 VAL B 55 -3.792 -2.161 15.359 1.00 0.00 C ATOM 2687 CG2 VAL B 55 -5.077 -1.902 13.159 1.00 0.00 C ATOM 0 H VAL B 55 -4.870 0.093 16.700 1.00 0.00 H new ATOM 0 HA VAL B 55 -6.782 -0.428 14.715 1.00 0.00 H new ATOM 0 HB VAL B 55 -4.301 -0.315 14.388 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -2.896 -2.339 14.764 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -3.518 -1.651 16.283 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -4.265 -3.114 15.597 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -4.138 -2.088 12.637 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -5.614 -2.842 13.287 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -5.686 -1.213 12.575 1.00 0.00 H new ATOM 2697 N GLU B 56 -7.645 -2.845 14.869 1.00 0.00 N ATOM 2698 CA GLU B 56 -8.318 -4.143 15.047 1.00 0.00 C ATOM 2699 C GLU B 56 -7.983 -5.067 13.853 1.00 0.00 C ATOM 2700 O GLU B 56 -8.373 -4.765 12.721 1.00 0.00 O ATOM 2701 CB GLU B 56 -9.850 -3.964 15.230 1.00 0.00 C ATOM 2702 CG GLU B 56 -10.226 -3.392 16.612 1.00 0.00 C ATOM 2703 CD GLU B 56 -11.735 -3.318 16.893 1.00 0.00 C ATOM 2704 OE1 GLU B 56 -12.433 -4.333 16.685 1.00 0.00 O ATOM 2705 OE2 GLU B 56 -12.224 -2.265 17.366 1.00 0.00 O ATOM 0 H GLU B 56 -7.879 -2.385 13.989 1.00 0.00 H new ATOM 0 HA GLU B 56 -7.950 -4.613 15.959 1.00 0.00 H new ATOM 0 HB2 GLU B 56 -10.229 -3.301 14.452 1.00 0.00 H new ATOM 0 HB3 GLU B 56 -10.342 -4.927 15.095 1.00 0.00 H new ATOM 0 HG2 GLU B 56 -9.757 -4.005 17.382 1.00 0.00 H new ATOM 0 HG3 GLU B 56 -9.805 -2.391 16.701 1.00 0.00 H new ATOM 2712 N PRO B 57 -7.229 -6.205 14.071 1.00 0.00 N ATOM 2713 CA PRO B 57 -6.731 -6.646 15.406 1.00 0.00 C ATOM 2714 C PRO B 57 -5.506 -5.833 15.899 1.00 0.00 C ATOM 2715 O PRO B 57 -4.687 -5.365 15.094 1.00 0.00 O ATOM 2716 CB PRO B 57 -6.370 -8.128 15.161 1.00 0.00 C ATOM 2717 CG PRO B 57 -5.941 -8.165 13.728 1.00 0.00 C ATOM 2718 CD PRO B 57 -6.811 -7.154 13.004 1.00 0.00 C ATOM 0 HA PRO B 57 -7.469 -6.497 16.194 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -5.572 -8.459 15.825 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -7.224 -8.781 15.339 1.00 0.00 H new ATOM 0 HG2 PRO B 57 -4.885 -7.912 13.630 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -6.070 -9.162 13.308 1.00 0.00 H new ATOM 0 HD2 PRO B 57 -6.259 -6.647 12.213 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -7.672 -7.632 12.536 1.00 0.00 H new ATOM 2726 N LYS B 58 -5.449 -5.630 17.229 1.00 0.00 N ATOM 2727 CA LYS B 58 -4.353 -4.919 17.923 1.00 0.00 C ATOM 2728 C LYS B 58 -2.969 -5.513 17.579 1.00 0.00 C ATOM 2729 O LYS B 58 -2.765 -6.725 17.692 1.00 0.00 O ATOM 2730 CB LYS B 58 -4.579 -4.959 19.461 1.00 0.00 C ATOM 2731 CG LYS B 58 -3.637 -4.041 20.274 1.00 0.00 C ATOM 2732 CD LYS B 58 -3.872 -2.524 20.019 1.00 0.00 C ATOM 2733 CE LYS B 58 -5.228 -2.004 20.549 1.00 0.00 C ATOM 2734 NZ LYS B 58 -6.401 -2.438 19.739 1.00 0.00 N ATOM 0 H LYS B 58 -6.175 -5.961 17.864 1.00 0.00 H new ATOM 0 HA LYS B 58 -4.364 -3.885 17.578 1.00 0.00 H new ATOM 0 HB2 LYS B 58 -5.611 -4.676 19.671 1.00 0.00 H new ATOM 0 HB3 LYS B 58 -4.453 -5.985 19.807 1.00 0.00 H new ATOM 0 HG2 LYS B 58 -3.770 -4.247 21.336 1.00 0.00 H new ATOM 0 HG3 LYS B 58 -2.604 -4.286 20.029 1.00 0.00 H new ATOM 0 HD2 LYS B 58 -3.068 -1.958 20.489 1.00 0.00 H new ATOM 0 HD3 LYS B 58 -3.814 -2.332 18.948 1.00 0.00 H new ATOM 0 HE2 LYS B 58 -5.361 -2.347 21.575 1.00 0.00 H new ATOM 0 HE3 LYS B 58 -5.202 -0.915 20.577 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 -7.091 -1.662 19.683 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 -6.086 -2.691 18.781 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 -6.846 -3.264 20.187 1.00 0.00 H new ATOM 2748 N ALA B 59 -2.032 -4.641 17.169 1.00 0.00 N ATOM 2749 CA ALA B 59 -0.679 -5.043 16.750 1.00 0.00 C ATOM 2750 C ALA B 59 0.335 -3.933 17.041 1.00 0.00 C ATOM 2751 O ALA B 59 0.192 -2.805 16.544 1.00 0.00 O ATOM 2752 CB ALA B 59 -0.660 -5.391 15.256 1.00 0.00 C ATOM 0 H ALA B 59 -2.192 -3.635 17.119 1.00 0.00 H new ATOM 0 HA ALA B 59 -0.399 -5.927 17.322 1.00 0.00 H new ATOM 0 HB1 ALA B 59 0.348 -5.686 14.964 1.00 0.00 H new ATOM 0 HB2 ALA B 59 -1.349 -6.214 15.065 1.00 0.00 H new ATOM 0 HB3 ALA B 59 -0.966 -4.520 14.676 1.00 0.00 H new ATOM 2758 N SER B 60 1.347 -4.261 17.857 1.00 0.00 N ATOM 2759 CA SER B 60 2.497 -3.389 18.094 1.00 0.00 C ATOM 2760 C SER B 60 3.598 -3.736 17.071 1.00 0.00 C ATOM 2761 O SER B 60 4.467 -4.580 17.330 1.00 0.00 O ATOM 2762 CB SER B 60 2.980 -3.551 19.560 1.00 0.00 C ATOM 2763 OG SER B 60 3.220 -4.912 19.886 1.00 0.00 O ATOM 0 H SER B 60 1.387 -5.141 18.370 1.00 0.00 H new ATOM 0 HA SER B 60 2.227 -2.342 17.959 1.00 0.00 H new ATOM 0 HB2 SER B 60 3.893 -2.975 19.708 1.00 0.00 H new ATOM 0 HB3 SER B 60 2.231 -3.141 20.237 1.00 0.00 H new ATOM 0 HG SER B 60 3.728 -5.337 19.163 1.00 0.00 H new ATOM 2769 N VAL B 61 3.528 -3.098 15.889 1.00 0.00 N ATOM 2770 CA VAL B 61 4.468 -3.339 14.782 1.00 0.00 C ATOM 2771 C VAL B 61 4.680 -2.036 13.986 1.00 0.00 C ATOM 2772 O VAL B 61 3.713 -1.391 13.571 1.00 0.00 O ATOM 2773 CB VAL B 61 3.976 -4.512 13.834 1.00 0.00 C ATOM 2774 CG1 VAL B 61 2.557 -4.250 13.258 1.00 0.00 C ATOM 2775 CG2 VAL B 61 5.007 -4.809 12.704 1.00 0.00 C ATOM 0 H VAL B 61 2.816 -2.400 15.675 1.00 0.00 H new ATOM 0 HA VAL B 61 5.420 -3.656 15.207 1.00 0.00 H new ATOM 0 HB VAL B 61 3.903 -5.405 14.454 1.00 0.00 H new ATOM 0 HG11 VAL B 61 2.266 -5.081 12.616 1.00 0.00 H new ATOM 0 HG12 VAL B 61 1.843 -4.157 14.077 1.00 0.00 H new ATOM 0 HG13 VAL B 61 2.565 -3.328 12.677 1.00 0.00 H new ATOM 0 HG21 VAL B 61 4.635 -5.618 12.075 1.00 0.00 H new ATOM 0 HG22 VAL B 61 5.150 -3.915 12.098 1.00 0.00 H new ATOM 0 HG23 VAL B 61 5.958 -5.102 13.148 1.00 0.00 H new ATOM 2785 N THR B 62 5.957 -1.638 13.858 1.00 0.00 N ATOM 2786 CA THR B 62 6.418 -0.500 13.038 1.00 0.00 C ATOM 2787 C THR B 62 7.869 -0.779 12.604 1.00 0.00 C ATOM 2788 O THR B 62 8.737 -1.000 13.460 1.00 0.00 O ATOM 2789 CB THR B 62 6.336 0.875 13.809 1.00 0.00 C ATOM 2790 OG1 THR B 62 6.735 0.695 15.180 1.00 0.00 O ATOM 2791 CG2 THR B 62 4.932 1.512 13.751 1.00 0.00 C ATOM 0 H THR B 62 6.722 -2.113 14.337 1.00 0.00 H new ATOM 0 HA THR B 62 5.762 -0.408 12.173 1.00 0.00 H new ATOM 0 HB THR B 62 7.019 1.561 13.307 1.00 0.00 H new ATOM 0 HG1 THR B 62 6.683 1.553 15.651 1.00 0.00 H new ATOM 0 HG21 THR B 62 4.937 2.455 14.298 1.00 0.00 H new ATOM 0 HG22 THR B 62 4.659 1.697 12.712 1.00 0.00 H new ATOM 0 HG23 THR B 62 4.206 0.835 14.202 1.00 0.00 H new ATOM 2799 N GLY B 63 8.124 -0.781 11.286 1.00 0.00 N ATOM 2800 CA GLY B 63 9.452 -1.091 10.750 1.00 0.00 C ATOM 2801 C GLY B 63 9.399 -1.388 9.262 1.00 0.00 C ATOM 2802 O GLY B 63 9.615 -2.528 8.831 1.00 0.00 O ATOM 0 H GLY B 63 7.425 -0.571 10.574 1.00 0.00 H new ATOM 0 HA2 GLY B 63 10.123 -0.251 10.930 1.00 0.00 H new ATOM 0 HA3 GLY B 63 9.867 -1.949 11.278 1.00 0.00 H new ATOM 2806 N GLY B 64 9.092 -0.350 8.476 1.00 0.00 N ATOM 2807 CA GLY B 64 8.962 -0.472 7.027 1.00 0.00 C ATOM 2808 C GLY B 64 7.559 -0.918 6.624 1.00 0.00 C ATOM 2809 O GLY B 64 6.704 -0.077 6.307 1.00 0.00 O ATOM 0 H GLY B 64 8.928 0.593 8.829 1.00 0.00 H new ATOM 0 HA2 GLY B 64 9.188 0.486 6.559 1.00 0.00 H new ATOM 0 HA3 GLY B 64 9.693 -1.189 6.655 1.00 0.00 H new ATOM 2813 N GLY B 65 7.319 -2.247 6.692 1.00 0.00 N ATOM 2814 CA GLY B 65 6.025 -2.843 6.341 1.00 0.00 C ATOM 2815 C GLY B 65 5.689 -2.677 4.862 1.00 0.00 C ATOM 2816 O GLY B 65 6.583 -2.775 4.014 1.00 0.00 O ATOM 0 H GLY B 65 8.018 -2.927 6.991 1.00 0.00 H new ATOM 0 HA2 GLY B 65 6.037 -3.904 6.591 1.00 0.00 H new ATOM 0 HA3 GLY B 65 5.241 -2.383 6.943 1.00 0.00 H new ATOM 2820 N GLY B 66 4.395 -2.434 4.564 1.00 0.00 N ATOM 2821 CA GLY B 66 3.941 -2.138 3.202 1.00 0.00 C ATOM 2822 C GLY B 66 4.477 -0.800 2.702 1.00 0.00 C ATOM 2823 O GLY B 66 4.728 0.111 3.510 1.00 0.00 O ATOM 0 H GLY B 66 3.648 -2.439 5.258 1.00 0.00 H new ATOM 0 HA2 GLY B 66 4.265 -2.933 2.530 1.00 0.00 H new ATOM 0 HA3 GLY B 66 2.851 -2.125 3.177 1.00 0.00 H new ATOM 2827 N GLU B 67 4.635 -0.660 1.375 1.00 0.00 N ATOM 2828 CA GLU B 67 5.296 0.502 0.765 1.00 0.00 C ATOM 2829 C GLU B 67 4.253 1.444 0.155 1.00 0.00 C ATOM 2830 O GLU B 67 3.170 1.012 -0.267 1.00 0.00 O ATOM 2831 CB GLU B 67 6.314 0.030 -0.322 1.00 0.00 C ATOM 2832 CG GLU B 67 7.124 -1.225 0.099 1.00 0.00 C ATOM 2833 CD GLU B 67 8.380 -1.483 -0.751 1.00 0.00 C ATOM 2834 OE1 GLU B 67 8.242 -1.895 -1.927 1.00 0.00 O ATOM 2835 OE2 GLU B 67 9.515 -1.253 -0.246 1.00 0.00 O ATOM 0 H GLU B 67 4.308 -1.349 0.698 1.00 0.00 H new ATOM 0 HA GLU B 67 5.841 1.046 1.537 1.00 0.00 H new ATOM 0 HB2 GLU B 67 5.775 -0.186 -1.245 1.00 0.00 H new ATOM 0 HB3 GLU B 67 7.006 0.844 -0.540 1.00 0.00 H new ATOM 0 HG2 GLU B 67 7.421 -1.118 1.142 1.00 0.00 H new ATOM 0 HG3 GLU B 67 6.475 -2.098 0.041 1.00 0.00 H new ATOM 2842 N LEU B 68 4.601 2.733 0.100 1.00 0.00 N ATOM 2843 CA LEU B 68 3.773 3.772 -0.505 1.00 0.00 C ATOM 2844 C LEU B 68 4.583 4.365 -1.656 1.00 0.00 C ATOM 2845 O LEU B 68 5.542 5.100 -1.399 1.00 0.00 O ATOM 2846 CB LEU B 68 3.374 4.851 0.540 1.00 0.00 C ATOM 2847 CG LEU B 68 2.353 5.931 0.050 1.00 0.00 C ATOM 2848 CD1 LEU B 68 1.037 5.284 -0.447 1.00 0.00 C ATOM 2849 CD2 LEU B 68 2.094 6.983 1.154 1.00 0.00 C ATOM 0 H LEU B 68 5.479 3.086 0.481 1.00 0.00 H new ATOM 0 HA LEU B 68 2.835 3.359 -0.877 1.00 0.00 H new ATOM 0 HB2 LEU B 68 2.952 4.348 1.410 1.00 0.00 H new ATOM 0 HB3 LEU B 68 4.279 5.359 0.873 1.00 0.00 H new ATOM 0 HG LEU B 68 2.794 6.448 -0.803 1.00 0.00 H new ATOM 0 HD11 LEU B 68 0.351 6.063 -0.780 1.00 0.00 H new ATOM 0 HD12 LEU B 68 1.253 4.612 -1.278 1.00 0.00 H new ATOM 0 HD13 LEU B 68 0.579 4.721 0.366 1.00 0.00 H new ATOM 0 HD21 LEU B 68 1.381 7.724 0.791 1.00 0.00 H new ATOM 0 HD22 LEU B 68 1.687 6.491 2.037 1.00 0.00 H new ATOM 0 HD23 LEU B 68 3.031 7.477 1.413 1.00 0.00 H new ATOM 2861 N ALA B 69 4.278 3.991 -2.897 1.00 0.00 N ATOM 2862 CA ALA B 69 5.126 4.339 -4.050 1.00 0.00 C ATOM 2863 C ALA B 69 4.712 5.698 -4.658 1.00 0.00 C ATOM 2864 O ALA B 69 3.603 5.857 -5.170 1.00 0.00 O ATOM 2865 CB ALA B 69 5.104 3.213 -5.088 1.00 0.00 C ATOM 0 H ALA B 69 3.450 3.446 -3.137 1.00 0.00 H new ATOM 0 HA ALA B 69 6.154 4.449 -3.704 1.00 0.00 H new ATOM 0 HB1 ALA B 69 5.735 3.485 -5.934 1.00 0.00 H new ATOM 0 HB2 ALA B 69 5.479 2.294 -4.636 1.00 0.00 H new ATOM 0 HB3 ALA B 69 4.082 3.057 -5.434 1.00 0.00 H new ATOM 2871 N PHE B 70 5.633 6.668 -4.588 1.00 0.00 N ATOM 2872 CA PHE B 70 5.461 8.028 -5.091 1.00 0.00 C ATOM 2873 C PHE B 70 6.081 8.105 -6.497 1.00 0.00 C ATOM 2874 O PHE B 70 7.306 8.027 -6.650 1.00 0.00 O ATOM 2875 CB PHE B 70 6.177 9.020 -4.136 1.00 0.00 C ATOM 2876 CG PHE B 70 5.584 9.141 -2.731 1.00 0.00 C ATOM 2877 CD1 PHE B 70 5.714 8.112 -1.806 1.00 0.00 C ATOM 2878 CD2 PHE B 70 4.909 10.293 -2.332 1.00 0.00 C ATOM 2879 CE1 PHE B 70 5.193 8.229 -0.536 1.00 0.00 C ATOM 2880 CE2 PHE B 70 4.389 10.406 -1.064 1.00 0.00 C ATOM 2881 CZ PHE B 70 4.527 9.375 -0.165 1.00 0.00 C ATOM 0 H PHE B 70 6.548 6.517 -4.164 1.00 0.00 H new ATOM 0 HA PHE B 70 4.404 8.289 -5.140 1.00 0.00 H new ATOM 0 HB2 PHE B 70 7.220 8.717 -4.044 1.00 0.00 H new ATOM 0 HB3 PHE B 70 6.171 10.007 -4.598 1.00 0.00 H new ATOM 0 HD1 PHE B 70 6.231 7.207 -2.087 1.00 0.00 H new ATOM 0 HD2 PHE B 70 4.792 11.109 -3.029 1.00 0.00 H new ATOM 0 HE1 PHE B 70 5.307 7.420 0.170 1.00 0.00 H new ATOM 0 HE2 PHE B 70 3.870 11.308 -0.773 1.00 0.00 H new ATOM 0 HZ PHE B 70 4.114 9.464 0.829 1.00 0.00 H new ATOM 2891 N ARG B 71 5.232 8.195 -7.521 1.00 0.00 N ATOM 2892 CA ARG B 71 5.675 8.217 -8.922 1.00 0.00 C ATOM 2893 C ARG B 71 5.893 9.649 -9.431 1.00 0.00 C ATOM 2894 O ARG B 71 5.017 10.515 -9.324 1.00 0.00 O ATOM 2895 CB ARG B 71 4.638 7.522 -9.836 1.00 0.00 C ATOM 2896 CG ARG B 71 4.229 6.102 -9.395 1.00 0.00 C ATOM 2897 CD ARG B 71 3.601 5.297 -10.540 1.00 0.00 C ATOM 2898 NE ARG B 71 2.368 5.912 -11.059 1.00 0.00 N ATOM 2899 CZ ARG B 71 2.115 6.183 -12.348 1.00 0.00 C ATOM 2900 NH1 ARG B 71 3.041 6.039 -13.280 1.00 0.00 N ATOM 2901 NH2 ARG B 71 0.937 6.653 -12.693 1.00 0.00 N ATOM 0 H ARG B 71 4.220 8.255 -7.407 1.00 0.00 H new ATOM 0 HA ARG B 71 6.624 7.681 -8.958 1.00 0.00 H new ATOM 0 HB2 ARG B 71 3.744 8.143 -9.883 1.00 0.00 H new ATOM 0 HB3 ARG B 71 5.044 7.470 -10.846 1.00 0.00 H new ATOM 0 HG2 ARG B 71 5.105 5.574 -9.020 1.00 0.00 H new ATOM 0 HG3 ARG B 71 3.520 6.170 -8.570 1.00 0.00 H new ATOM 0 HD2 ARG B 71 4.324 5.202 -11.351 1.00 0.00 H new ATOM 0 HD3 ARG B 71 3.380 4.289 -10.191 1.00 0.00 H new ATOM 0 HE ARG B 71 1.645 6.152 -10.381 1.00 0.00 H new ATOM 0 HH11 ARG B 71 3.974 5.715 -13.026 1.00 0.00 H new ATOM 0 HH12 ARG B 71 2.822 6.252 -14.253 1.00 0.00 H new ATOM 0 HH21 ARG B 71 0.222 6.809 -11.982 1.00 0.00 H new ATOM 0 HH22 ARG B 71 0.738 6.861 -13.671 1.00 0.00 H new ATOM 2915 N VAL B 72 7.102 9.872 -9.968 1.00 0.00 N ATOM 2916 CA VAL B 72 7.531 11.157 -10.548 1.00 0.00 C ATOM 2917 C VAL B 72 8.048 10.945 -11.983 1.00 0.00 C ATOM 2918 O VAL B 72 8.386 9.819 -12.372 1.00 0.00 O ATOM 2919 CB VAL B 72 8.669 11.843 -9.702 1.00 0.00 C ATOM 2920 CG1 VAL B 72 8.237 12.118 -8.245 1.00 0.00 C ATOM 2921 CG2 VAL B 72 9.986 11.036 -9.744 1.00 0.00 C ATOM 0 H VAL B 72 7.823 9.152 -10.013 1.00 0.00 H new ATOM 0 HA VAL B 72 6.658 11.810 -10.547 1.00 0.00 H new ATOM 0 HB VAL B 72 8.855 12.809 -10.172 1.00 0.00 H new ATOM 0 HG11 VAL B 72 9.057 12.591 -7.705 1.00 0.00 H new ATOM 0 HG12 VAL B 72 7.371 12.779 -8.241 1.00 0.00 H new ATOM 0 HG13 VAL B 72 7.978 11.178 -7.759 1.00 0.00 H new ATOM 0 HG21 VAL B 72 10.744 11.545 -9.148 1.00 0.00 H new ATOM 0 HG22 VAL B 72 9.815 10.039 -9.339 1.00 0.00 H new ATOM 0 HG23 VAL B 72 10.330 10.955 -10.775 1.00 0.00 H new ATOM 2931 N GLU B 73 8.110 12.044 -12.748 1.00 0.00 N ATOM 2932 CA GLU B 73 8.470 12.021 -14.179 1.00 0.00 C ATOM 2933 C GLU B 73 9.940 11.605 -14.443 1.00 0.00 C ATOM 2934 O GLU B 73 10.201 10.932 -15.449 1.00 0.00 O ATOM 2935 CB GLU B 73 8.153 13.399 -14.830 1.00 0.00 C ATOM 2936 CG GLU B 73 8.798 14.595 -14.124 1.00 0.00 C ATOM 2937 CD GLU B 73 8.476 15.944 -14.772 1.00 0.00 C ATOM 2938 OE1 GLU B 73 9.188 16.345 -15.714 1.00 0.00 O ATOM 2939 OE2 GLU B 73 7.503 16.605 -14.347 1.00 0.00 O ATOM 0 H GLU B 73 7.912 12.979 -12.393 1.00 0.00 H new ATOM 0 HA GLU B 73 7.858 11.248 -14.645 1.00 0.00 H new ATOM 0 HB2 GLU B 73 8.486 13.382 -15.868 1.00 0.00 H new ATOM 0 HB3 GLU B 73 7.072 13.540 -14.844 1.00 0.00 H new ATOM 0 HG2 GLU B 73 8.467 14.613 -13.086 1.00 0.00 H new ATOM 0 HG3 GLU B 73 9.879 14.458 -14.112 1.00 0.00 H new ATOM 2946 N ASN B 74 10.899 11.983 -13.546 1.00 0.00 N ATOM 2947 CA ASN B 74 12.328 11.605 -13.719 1.00 0.00 C ATOM 2948 C ASN B 74 13.151 11.832 -12.434 1.00 0.00 C ATOM 2949 O ASN B 74 12.631 12.303 -11.415 1.00 0.00 O ATOM 2950 CB ASN B 74 12.972 12.390 -14.901 1.00 0.00 C ATOM 2951 CG ASN B 74 13.154 13.877 -14.592 1.00 0.00 C ATOM 2952 OD1 ASN B 74 14.213 14.306 -14.138 1.00 0.00 O ATOM 2953 ND2 ASN B 74 12.118 14.664 -14.810 1.00 0.00 N ATOM 0 H ASN B 74 10.709 12.539 -12.712 1.00 0.00 H new ATOM 0 HA ASN B 74 12.344 10.539 -13.944 1.00 0.00 H new ATOM 0 HB2 ASN B 74 13.941 11.951 -15.138 1.00 0.00 H new ATOM 0 HB3 ASN B 74 12.347 12.281 -15.787 1.00 0.00 H new ATOM 0 HD21 ASN B 74 12.181 15.660 -14.601 1.00 0.00 H new ATOM 0 HD22 ASN B 74 11.253 14.276 -15.188 1.00 0.00 H new ATOM 2960 N ASP B 75 14.448 11.482 -12.541 1.00 0.00 N ATOM 2961 CA ASP B 75 15.404 11.366 -11.415 1.00 0.00 C ATOM 2962 C ASP B 75 15.539 12.659 -10.609 1.00 0.00 C ATOM 2963 O ASP B 75 15.801 12.622 -9.400 1.00 0.00 O ATOM 2964 CB ASP B 75 16.788 10.908 -11.943 1.00 0.00 C ATOM 2965 CG ASP B 75 17.367 11.848 -13.017 1.00 0.00 C ATOM 2966 OD1 ASP B 75 17.014 11.687 -14.206 1.00 0.00 O ATOM 2967 OD2 ASP B 75 18.158 12.756 -12.684 1.00 0.00 O ATOM 0 H ASP B 75 14.876 11.265 -13.441 1.00 0.00 H new ATOM 0 HA ASP B 75 15.004 10.617 -10.731 1.00 0.00 H new ATOM 0 HB2 ASP B 75 17.486 10.846 -11.108 1.00 0.00 H new ATOM 0 HB3 ASP B 75 16.698 9.904 -12.358 1.00 0.00 H new ATOM 2972 N ALA B 76 15.375 13.795 -11.304 1.00 0.00 N ATOM 2973 CA ALA B 76 15.491 15.121 -10.700 1.00 0.00 C ATOM 2974 C ALA B 76 14.406 15.315 -9.642 1.00 0.00 C ATOM 2975 O ALA B 76 14.688 15.720 -8.519 1.00 0.00 O ATOM 2976 CB ALA B 76 15.400 16.216 -11.775 1.00 0.00 C ATOM 0 H ALA B 76 15.158 13.815 -12.301 1.00 0.00 H new ATOM 0 HA ALA B 76 16.465 15.199 -10.218 1.00 0.00 H new ATOM 0 HB1 ALA B 76 15.488 17.195 -11.305 1.00 0.00 H new ATOM 0 HB2 ALA B 76 16.207 16.085 -12.496 1.00 0.00 H new ATOM 0 HB3 ALA B 76 14.440 16.145 -12.287 1.00 0.00 H new ATOM 2982 N GLN B 77 13.172 14.942 -10.021 1.00 0.00 N ATOM 2983 CA GLN B 77 11.976 15.080 -9.178 1.00 0.00 C ATOM 2984 C GLN B 77 12.008 14.138 -7.957 1.00 0.00 C ATOM 2985 O GLN B 77 11.362 14.412 -6.950 1.00 0.00 O ATOM 2986 CB GLN B 77 10.706 14.800 -10.019 1.00 0.00 C ATOM 2987 CG GLN B 77 10.598 15.594 -11.329 1.00 0.00 C ATOM 2988 CD GLN B 77 10.450 17.104 -11.156 1.00 0.00 C ATOM 2989 OE1 GLN B 77 9.894 17.580 -10.175 1.00 0.00 O ATOM 2990 NE2 GLN B 77 10.922 17.870 -12.128 1.00 0.00 N ATOM 0 H GLN B 77 12.976 14.531 -10.934 1.00 0.00 H new ATOM 0 HA GLN B 77 11.959 16.103 -8.802 1.00 0.00 H new ATOM 0 HB2 GLN B 77 10.673 13.736 -10.254 1.00 0.00 H new ATOM 0 HB3 GLN B 77 9.830 15.018 -9.408 1.00 0.00 H new ATOM 0 HG2 GLN B 77 11.486 15.397 -11.930 1.00 0.00 H new ATOM 0 HG3 GLN B 77 9.742 15.222 -11.893 1.00 0.00 H new ATOM 0 HE21 GLN B 77 11.381 17.446 -12.934 1.00 0.00 H new ATOM 0 HE22 GLN B 77 10.826 18.884 -12.070 1.00 0.00 H new ATOM 2999 N VAL B 78 12.788 13.035 -8.063 1.00 0.00 N ATOM 3000 CA VAL B 78 13.055 12.114 -6.930 1.00 0.00 C ATOM 3001 C VAL B 78 13.888 12.842 -5.853 1.00 0.00 C ATOM 3002 O VAL B 78 13.633 12.725 -4.648 1.00 0.00 O ATOM 3003 CB VAL B 78 13.847 10.824 -7.391 1.00 0.00 C ATOM 3004 CG1 VAL B 78 14.134 9.860 -6.212 1.00 0.00 C ATOM 3005 CG2 VAL B 78 13.117 10.085 -8.524 1.00 0.00 C ATOM 0 H VAL B 78 13.248 12.759 -8.931 1.00 0.00 H new ATOM 0 HA VAL B 78 12.090 11.804 -6.529 1.00 0.00 H new ATOM 0 HB VAL B 78 14.806 11.173 -7.773 1.00 0.00 H new ATOM 0 HG11 VAL B 78 14.679 8.990 -6.578 1.00 0.00 H new ATOM 0 HG12 VAL B 78 14.733 10.373 -5.460 1.00 0.00 H new ATOM 0 HG13 VAL B 78 13.192 9.538 -5.768 1.00 0.00 H new ATOM 0 HG21 VAL B 78 13.691 9.205 -8.814 1.00 0.00 H new ATOM 0 HG22 VAL B 78 12.129 9.777 -8.180 1.00 0.00 H new ATOM 0 HG23 VAL B 78 13.012 10.748 -9.383 1.00 0.00 H new ATOM 3015 N ASP B 79 14.876 13.623 -6.343 1.00 0.00 N ATOM 3016 CA ASP B 79 15.843 14.352 -5.516 1.00 0.00 C ATOM 3017 C ASP B 79 15.189 15.580 -4.859 1.00 0.00 C ATOM 3018 O ASP B 79 15.541 15.959 -3.736 1.00 0.00 O ATOM 3019 CB ASP B 79 17.056 14.770 -6.392 1.00 0.00 C ATOM 3020 CG ASP B 79 18.149 15.494 -5.590 1.00 0.00 C ATOM 3021 OD1 ASP B 79 18.854 14.826 -4.803 1.00 0.00 O ATOM 3022 OD2 ASP B 79 18.304 16.727 -5.731 1.00 0.00 O ATOM 0 H ASP B 79 15.020 13.762 -7.343 1.00 0.00 H new ATOM 0 HA ASP B 79 16.190 13.700 -4.714 1.00 0.00 H new ATOM 0 HB2 ASP B 79 17.483 13.883 -6.860 1.00 0.00 H new ATOM 0 HB3 ASP B 79 16.711 15.420 -7.196 1.00 0.00 H new ATOM 3027 N GLU B 80 14.227 16.185 -5.575 1.00 0.00 N ATOM 3028 CA GLU B 80 13.447 17.330 -5.070 1.00 0.00 C ATOM 3029 C GLU B 80 12.582 16.878 -3.886 1.00 0.00 C ATOM 3030 O GLU B 80 12.525 17.535 -2.837 1.00 0.00 O ATOM 3031 CB GLU B 80 12.602 17.947 -6.211 1.00 0.00 C ATOM 3032 CG GLU B 80 13.458 18.386 -7.417 1.00 0.00 C ATOM 3033 CD GLU B 80 12.719 19.262 -8.435 1.00 0.00 C ATOM 3034 OE1 GLU B 80 12.198 20.329 -8.042 1.00 0.00 O ATOM 3035 OE2 GLU B 80 12.697 18.922 -9.638 1.00 0.00 O ATOM 0 H GLU B 80 13.968 15.896 -6.518 1.00 0.00 H new ATOM 0 HA GLU B 80 14.120 18.110 -4.713 1.00 0.00 H new ATOM 0 HB2 GLU B 80 11.861 17.220 -6.543 1.00 0.00 H new ATOM 0 HB3 GLU B 80 12.054 18.808 -5.827 1.00 0.00 H new ATOM 0 HG2 GLU B 80 14.327 18.932 -7.050 1.00 0.00 H new ATOM 0 HG3 GLU B 80 13.831 17.497 -7.925 1.00 0.00 H new ATOM 3042 N THR B 81 11.955 15.707 -4.083 1.00 0.00 N ATOM 3043 CA THR B 81 11.130 15.038 -3.076 1.00 0.00 C ATOM 3044 C THR B 81 11.983 14.607 -1.857 1.00 0.00 C ATOM 3045 O THR B 81 11.527 14.700 -0.715 1.00 0.00 O ATOM 3046 CB THR B 81 10.402 13.808 -3.709 1.00 0.00 C ATOM 3047 OG1 THR B 81 9.660 14.241 -4.861 1.00 0.00 O ATOM 3048 CG2 THR B 81 9.427 13.144 -2.732 1.00 0.00 C ATOM 0 H THR B 81 12.011 15.194 -4.963 1.00 0.00 H new ATOM 0 HA THR B 81 10.378 15.743 -2.721 1.00 0.00 H new ATOM 0 HB THR B 81 11.167 13.079 -3.977 1.00 0.00 H new ATOM 0 HG1 THR B 81 10.271 14.357 -5.619 1.00 0.00 H new ATOM 0 HG21 THR B 81 8.946 12.295 -3.218 1.00 0.00 H new ATOM 0 HG22 THR B 81 9.971 12.798 -1.853 1.00 0.00 H new ATOM 0 HG23 THR B 81 8.668 13.865 -2.428 1.00 0.00 H new ATOM 3056 N PHE B 82 13.237 14.180 -2.132 1.00 0.00 N ATOM 3057 CA PHE B 82 14.227 13.778 -1.108 1.00 0.00 C ATOM 3058 C PHE B 82 14.426 14.912 -0.083 1.00 0.00 C ATOM 3059 O PHE B 82 14.100 14.777 1.096 1.00 0.00 O ATOM 3060 CB PHE B 82 15.572 13.403 -1.822 1.00 0.00 C ATOM 3061 CG PHE B 82 16.767 13.028 -0.930 1.00 0.00 C ATOM 3062 CD1 PHE B 82 17.562 14.009 -0.327 1.00 0.00 C ATOM 3063 CD2 PHE B 82 17.112 11.697 -0.712 1.00 0.00 C ATOM 3064 CE1 PHE B 82 18.645 13.666 0.457 1.00 0.00 C ATOM 3065 CE2 PHE B 82 18.202 11.359 0.066 1.00 0.00 C ATOM 3066 CZ PHE B 82 18.966 12.342 0.655 1.00 0.00 C ATOM 0 H PHE B 82 13.594 14.104 -3.085 1.00 0.00 H new ATOM 0 HA PHE B 82 13.867 12.907 -0.561 1.00 0.00 H new ATOM 0 HB2 PHE B 82 15.376 12.565 -2.491 1.00 0.00 H new ATOM 0 HB3 PHE B 82 15.869 14.246 -2.445 1.00 0.00 H new ATOM 0 HD1 PHE B 82 17.324 15.052 -0.478 1.00 0.00 H new ATOM 0 HD2 PHE B 82 16.517 10.915 -1.159 1.00 0.00 H new ATOM 0 HE1 PHE B 82 19.243 14.439 0.917 1.00 0.00 H new ATOM 0 HE2 PHE B 82 18.456 10.320 0.213 1.00 0.00 H new ATOM 0 HZ PHE B 82 19.813 12.075 1.269 1.00 0.00 H new ATOM 3076 N ALA B 83 14.903 16.058 -0.596 1.00 0.00 N ATOM 3077 CA ALA B 83 15.317 17.208 0.223 1.00 0.00 C ATOM 3078 C ALA B 83 14.125 17.897 0.910 1.00 0.00 C ATOM 3079 O ALA B 83 14.270 18.432 2.010 1.00 0.00 O ATOM 3080 CB ALA B 83 16.097 18.206 -0.640 1.00 0.00 C ATOM 0 H ALA B 83 15.013 16.213 -1.598 1.00 0.00 H new ATOM 0 HA ALA B 83 15.963 16.834 1.017 1.00 0.00 H new ATOM 0 HB1 ALA B 83 16.401 19.056 -0.029 1.00 0.00 H new ATOM 0 HB2 ALA B 83 16.982 17.719 -1.050 1.00 0.00 H new ATOM 0 HB3 ALA B 83 15.464 18.554 -1.456 1.00 0.00 H new ATOM 3086 N GLY B 84 12.961 17.879 0.242 1.00 0.00 N ATOM 3087 CA GLY B 84 11.725 18.431 0.805 1.00 0.00 C ATOM 3088 C GLY B 84 11.249 17.680 2.043 1.00 0.00 C ATOM 3089 O GLY B 84 10.923 18.294 3.067 1.00 0.00 O ATOM 0 H GLY B 84 12.853 17.486 -0.693 1.00 0.00 H new ATOM 0 HA2 GLY B 84 11.885 19.478 1.061 1.00 0.00 H new ATOM 0 HA3 GLY B 84 10.943 18.404 0.047 1.00 0.00 H new ATOM 3093 N TRP B 85 11.263 16.343 1.957 1.00 0.00 N ATOM 3094 CA TRP B 85 10.940 15.454 3.090 1.00 0.00 C ATOM 3095 C TRP B 85 11.971 15.636 4.206 1.00 0.00 C ATOM 3096 O TRP B 85 11.601 15.674 5.385 1.00 0.00 O ATOM 3097 CB TRP B 85 10.876 14.002 2.599 1.00 0.00 C ATOM 3098 CG TRP B 85 9.682 13.720 1.721 1.00 0.00 C ATOM 3099 CD1 TRP B 85 8.738 14.607 1.249 1.00 0.00 C ATOM 3100 CD2 TRP B 85 9.305 12.452 1.226 1.00 0.00 C ATOM 3101 NE1 TRP B 85 7.800 13.944 0.513 1.00 0.00 N ATOM 3102 CE2 TRP B 85 8.128 12.620 0.483 1.00 0.00 C ATOM 3103 CE3 TRP B 85 9.849 11.187 1.354 1.00 0.00 C ATOM 3104 CZ2 TRP B 85 7.492 11.566 -0.126 1.00 0.00 C ATOM 3105 CZ3 TRP B 85 9.217 10.141 0.744 1.00 0.00 C ATOM 3106 CH2 TRP B 85 8.048 10.336 0.014 1.00 0.00 C ATOM 0 H TRP B 85 11.499 15.843 1.100 1.00 0.00 H new ATOM 0 HA TRP B 85 9.964 15.712 3.501 1.00 0.00 H new ATOM 0 HB2 TRP B 85 11.787 13.772 2.046 1.00 0.00 H new ATOM 0 HB3 TRP B 85 10.850 13.335 3.461 1.00 0.00 H new ATOM 0 HD1 TRP B 85 8.741 15.671 1.435 1.00 0.00 H new ATOM 0 HE1 TRP B 85 6.989 14.367 0.061 1.00 0.00 H new ATOM 0 HE3 TRP B 85 10.753 11.030 1.923 1.00 0.00 H new ATOM 0 HZ2 TRP B 85 6.585 11.710 -0.694 1.00 0.00 H new ATOM 0 HZ3 TRP B 85 9.631 9.147 0.829 1.00 0.00 H new ATOM 0 HH2 TRP B 85 7.571 9.487 -0.453 1.00 0.00 H new ATOM 3117 N LYS B 86 13.257 15.714 3.823 1.00 0.00 N ATOM 3118 CA LYS B 86 14.379 15.907 4.763 1.00 0.00 C ATOM 3119 C LYS B 86 14.152 17.170 5.607 1.00 0.00 C ATOM 3120 O LYS B 86 14.262 17.146 6.837 1.00 0.00 O ATOM 3121 CB LYS B 86 15.710 15.985 3.967 1.00 0.00 C ATOM 3122 CG LYS B 86 16.971 16.245 4.811 1.00 0.00 C ATOM 3123 CD LYS B 86 18.283 16.157 3.992 1.00 0.00 C ATOM 3124 CE LYS B 86 18.279 17.020 2.708 1.00 0.00 C ATOM 3125 NZ LYS B 86 19.639 17.162 2.126 1.00 0.00 N ATOM 0 H LYS B 86 13.551 15.645 2.849 1.00 0.00 H new ATOM 0 HA LYS B 86 14.437 15.061 5.447 1.00 0.00 H new ATOM 0 HB2 LYS B 86 15.844 15.050 3.424 1.00 0.00 H new ATOM 0 HB3 LYS B 86 15.622 16.776 3.223 1.00 0.00 H new ATOM 0 HG2 LYS B 86 16.899 17.234 5.265 1.00 0.00 H new ATOM 0 HG3 LYS B 86 17.010 15.522 5.626 1.00 0.00 H new ATOM 0 HD2 LYS B 86 19.116 16.467 4.624 1.00 0.00 H new ATOM 0 HD3 LYS B 86 18.460 15.117 3.718 1.00 0.00 H new ATOM 0 HE2 LYS B 86 17.615 16.569 1.971 1.00 0.00 H new ATOM 0 HE3 LYS B 86 17.878 18.007 2.937 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 19.590 17.747 1.268 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 20.268 17.616 2.819 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 20.013 16.222 1.883 1.00 0.00 H new ATOM 3139 N ALA B 87 13.756 18.242 4.913 1.00 0.00 N ATOM 3140 CA ALA B 87 13.509 19.561 5.511 1.00 0.00 C ATOM 3141 C ALA B 87 12.216 19.592 6.347 1.00 0.00 C ATOM 3142 O ALA B 87 12.036 20.462 7.199 1.00 0.00 O ATOM 3143 CB ALA B 87 13.450 20.619 4.402 1.00 0.00 C ATOM 0 H ALA B 87 13.595 18.219 3.906 1.00 0.00 H new ATOM 0 HA ALA B 87 14.332 19.779 6.192 1.00 0.00 H new ATOM 0 HB1 ALA B 87 13.267 21.599 4.843 1.00 0.00 H new ATOM 0 HB2 ALA B 87 14.398 20.635 3.864 1.00 0.00 H new ATOM 0 HB3 ALA B 87 12.644 20.376 3.710 1.00 0.00 H new ATOM 3149 N SER B 88 11.314 18.627 6.071 1.00 0.00 N ATOM 3150 CA SER B 88 10.026 18.478 6.781 1.00 0.00 C ATOM 3151 C SER B 88 10.073 17.376 7.867 1.00 0.00 C ATOM 3152 O SER B 88 9.057 17.076 8.506 1.00 0.00 O ATOM 3153 CB SER B 88 8.914 18.168 5.752 1.00 0.00 C ATOM 3154 OG SER B 88 8.800 19.204 4.786 1.00 0.00 O ATOM 0 H SER B 88 11.460 17.925 5.345 1.00 0.00 H new ATOM 0 HA SER B 88 9.815 19.416 7.294 1.00 0.00 H new ATOM 0 HB2 SER B 88 9.131 17.224 5.252 1.00 0.00 H new ATOM 0 HB3 SER B 88 7.962 18.043 6.269 1.00 0.00 H new ATOM 0 HG SER B 88 9.448 19.053 4.066 1.00 0.00 H new ATOM 3160 N GLY B 89 11.280 16.790 8.061 1.00 0.00 N ATOM 3161 CA GLY B 89 11.570 15.916 9.206 1.00 0.00 C ATOM 3162 C GLY B 89 11.244 14.441 8.975 1.00 0.00 C ATOM 3163 O GLY B 89 10.528 13.825 9.774 1.00 0.00 O ATOM 0 H GLY B 89 12.070 16.914 7.428 1.00 0.00 H new ATOM 0 HA2 GLY B 89 12.627 16.007 9.458 1.00 0.00 H new ATOM 0 HA3 GLY B 89 11.005 16.269 10.069 1.00 0.00 H new ATOM 3167 N VAL B 90 11.772 13.870 7.881 1.00 0.00 N ATOM 3168 CA VAL B 90 11.671 12.418 7.602 1.00 0.00 C ATOM 3169 C VAL B 90 12.949 11.705 8.129 1.00 0.00 C ATOM 3170 O VAL B 90 14.003 12.342 8.236 1.00 0.00 O ATOM 3171 CB VAL B 90 11.461 12.168 6.052 1.00 0.00 C ATOM 3172 CG1 VAL B 90 12.768 12.345 5.252 1.00 0.00 C ATOM 3173 CG2 VAL B 90 10.808 10.798 5.756 1.00 0.00 C ATOM 0 H VAL B 90 12.279 14.392 7.166 1.00 0.00 H new ATOM 0 HA VAL B 90 10.805 12.002 8.118 1.00 0.00 H new ATOM 0 HB VAL B 90 10.764 12.935 5.716 1.00 0.00 H new ATOM 0 HG11 VAL B 90 12.575 12.164 4.195 1.00 0.00 H new ATOM 0 HG12 VAL B 90 13.141 13.361 5.384 1.00 0.00 H new ATOM 0 HG13 VAL B 90 13.514 11.636 5.611 1.00 0.00 H new ATOM 0 HG21 VAL B 90 10.687 10.678 4.679 1.00 0.00 H new ATOM 0 HG22 VAL B 90 11.444 10.001 6.141 1.00 0.00 H new ATOM 0 HG23 VAL B 90 9.832 10.748 6.239 1.00 0.00 H new ATOM 3183 N ALA B 91 12.843 10.409 8.482 1.00 0.00 N ATOM 3184 CA ALA B 91 14.000 9.609 8.958 1.00 0.00 C ATOM 3185 C ALA B 91 14.994 9.339 7.811 1.00 0.00 C ATOM 3186 O ALA B 91 16.187 9.626 7.949 1.00 0.00 O ATOM 3187 CB ALA B 91 13.533 8.293 9.600 1.00 0.00 C ATOM 0 H ALA B 91 11.967 9.888 8.448 1.00 0.00 H new ATOM 0 HA ALA B 91 14.517 10.190 9.721 1.00 0.00 H new ATOM 0 HB1 ALA B 91 14.400 7.726 9.940 1.00 0.00 H new ATOM 0 HB2 ALA B 91 12.887 8.512 10.450 1.00 0.00 H new ATOM 0 HB3 ALA B 91 12.981 7.706 8.866 1.00 0.00 H new ATOM 3193 N MET B 92 14.478 8.769 6.692 1.00 0.00 N ATOM 3194 CA MET B 92 15.230 8.650 5.417 1.00 0.00 C ATOM 3195 C MET B 92 16.474 7.731 5.540 1.00 0.00 C ATOM 3196 O MET B 92 17.585 8.206 5.823 1.00 0.00 O ATOM 3197 CB MET B 92 15.620 10.061 4.876 1.00 0.00 C ATOM 3198 CG MET B 92 16.451 10.082 3.591 1.00 0.00 C ATOM 3199 SD MET B 92 16.973 11.751 3.146 1.00 0.00 S ATOM 3200 CE MET B 92 15.412 12.518 2.744 1.00 0.00 C ATOM 0 H MET B 92 13.535 8.382 6.648 1.00 0.00 H new ATOM 0 HA MET B 92 14.566 8.173 4.697 1.00 0.00 H new ATOM 0 HB2 MET B 92 14.705 10.627 4.702 1.00 0.00 H new ATOM 0 HB3 MET B 92 16.176 10.585 5.653 1.00 0.00 H new ATOM 0 HG2 MET B 92 17.330 9.450 3.718 1.00 0.00 H new ATOM 0 HG3 MET B 92 15.867 9.656 2.775 1.00 0.00 H new ATOM 0 HE1 MET B 92 15.527 13.131 1.850 1.00 0.00 H new ATOM 0 HE2 MET B 92 14.664 11.747 2.561 1.00 0.00 H new ATOM 0 HE3 MET B 92 15.090 13.145 3.575 1.00 0.00 H new ATOM 3210 N LEU B 93 16.280 6.404 5.412 1.00 0.00 N ATOM 3211 CA LEU B 93 17.407 5.445 5.364 1.00 0.00 C ATOM 3212 C LEU B 93 17.418 4.676 4.014 1.00 0.00 C ATOM 3213 O LEU B 93 16.933 3.546 3.913 1.00 0.00 O ATOM 3214 CB LEU B 93 17.437 4.486 6.634 1.00 0.00 C ATOM 3215 CG LEU B 93 16.086 4.072 7.345 1.00 0.00 C ATOM 3216 CD1 LEU B 93 15.477 5.231 8.162 1.00 0.00 C ATOM 3217 CD2 LEU B 93 15.057 3.477 6.360 1.00 0.00 C ATOM 0 H LEU B 93 15.359 5.971 5.340 1.00 0.00 H new ATOM 0 HA LEU B 93 18.336 6.013 5.413 1.00 0.00 H new ATOM 0 HB2 LEU B 93 17.940 3.567 6.334 1.00 0.00 H new ATOM 0 HB3 LEU B 93 18.066 4.963 7.386 1.00 0.00 H new ATOM 0 HG LEU B 93 16.347 3.281 8.048 1.00 0.00 H new ATOM 0 HD11 LEU B 93 14.551 4.898 8.631 1.00 0.00 H new ATOM 0 HD12 LEU B 93 16.182 5.543 8.932 1.00 0.00 H new ATOM 0 HD13 LEU B 93 15.267 6.071 7.500 1.00 0.00 H new ATOM 0 HD21 LEU B 93 14.149 3.210 6.900 1.00 0.00 H new ATOM 0 HD22 LEU B 93 14.820 4.214 5.593 1.00 0.00 H new ATOM 0 HD23 LEU B 93 15.475 2.586 5.891 1.00 0.00 H new ATOM 3229 N GLN B 94 18.004 5.340 2.990 1.00 0.00 N ATOM 3230 CA GLN B 94 18.285 4.783 1.646 1.00 0.00 C ATOM 3231 C GLN B 94 18.866 5.903 0.774 1.00 0.00 C ATOM 3232 O GLN B 94 18.289 6.999 0.710 1.00 0.00 O ATOM 3233 CB GLN B 94 17.016 4.190 0.950 1.00 0.00 C ATOM 3234 CG GLN B 94 17.194 3.676 -0.503 1.00 0.00 C ATOM 3235 CD GLN B 94 18.170 2.504 -0.656 1.00 0.00 C ATOM 3236 OE1 GLN B 94 18.343 1.690 0.252 1.00 0.00 O ATOM 3237 NE2 GLN B 94 18.815 2.412 -1.811 1.00 0.00 N ATOM 0 H GLN B 94 18.304 6.311 3.080 1.00 0.00 H new ATOM 0 HA GLN B 94 18.989 3.960 1.767 1.00 0.00 H new ATOM 0 HB2 GLN B 94 16.648 3.365 1.560 1.00 0.00 H new ATOM 0 HB3 GLN B 94 16.240 4.956 0.947 1.00 0.00 H new ATOM 0 HG2 GLN B 94 16.220 3.372 -0.888 1.00 0.00 H new ATOM 0 HG3 GLN B 94 17.539 4.501 -1.126 1.00 0.00 H new ATOM 0 HE21 GLN B 94 18.650 3.102 -2.544 1.00 0.00 H new ATOM 0 HE22 GLN B 94 19.476 1.651 -1.967 1.00 0.00 H new ATOM 3246 N GLN B 95 20.002 5.638 0.123 1.00 0.00 N ATOM 3247 CA GLN B 95 20.541 6.514 -0.919 1.00 0.00 C ATOM 3248 C GLN B 95 19.803 6.225 -2.243 1.00 0.00 C ATOM 3249 O GLN B 95 19.750 5.059 -2.653 1.00 0.00 O ATOM 3250 CB GLN B 95 22.069 6.305 -1.080 1.00 0.00 C ATOM 3251 CG GLN B 95 22.895 6.753 0.147 1.00 0.00 C ATOM 3252 CD GLN B 95 24.418 6.697 -0.043 1.00 0.00 C ATOM 3253 OE1 GLN B 95 25.165 6.449 0.905 1.00 0.00 O ATOM 3254 NE2 GLN B 95 24.896 6.947 -1.257 1.00 0.00 N ATOM 0 H GLN B 95 20.572 4.812 0.303 1.00 0.00 H new ATOM 0 HA GLN B 95 20.384 7.555 -0.636 1.00 0.00 H new ATOM 0 HB2 GLN B 95 22.263 5.250 -1.271 1.00 0.00 H new ATOM 0 HB3 GLN B 95 22.411 6.856 -1.956 1.00 0.00 H new ATOM 0 HG2 GLN B 95 22.613 7.774 0.403 1.00 0.00 H new ATOM 0 HG3 GLN B 95 22.626 6.125 0.997 1.00 0.00 H new ATOM 0 HE21 GLN B 95 24.256 7.150 -2.025 1.00 0.00 H new ATOM 0 HE22 GLN B 95 25.903 6.936 -1.421 1.00 0.00 H new ATOM 3263 N PRO B 96 19.163 7.267 -2.888 1.00 0.00 N ATOM 3264 CA PRO B 96 18.513 7.133 -4.219 1.00 0.00 C ATOM 3265 C PRO B 96 19.435 6.433 -5.242 1.00 0.00 C ATOM 3266 O PRO B 96 20.437 7.007 -5.668 1.00 0.00 O ATOM 3267 CB PRO B 96 18.215 8.600 -4.632 1.00 0.00 C ATOM 3268 CG PRO B 96 18.083 9.340 -3.335 1.00 0.00 C ATOM 3269 CD PRO B 96 19.007 8.645 -2.348 1.00 0.00 C ATOM 0 HA PRO B 96 17.617 6.514 -4.184 1.00 0.00 H new ATOM 0 HB2 PRO B 96 19.019 9.011 -5.242 1.00 0.00 H new ATOM 0 HB3 PRO B 96 17.301 8.668 -5.222 1.00 0.00 H new ATOM 0 HG2 PRO B 96 18.360 10.387 -3.455 1.00 0.00 H new ATOM 0 HG3 PRO B 96 17.052 9.322 -2.981 1.00 0.00 H new ATOM 0 HD2 PRO B 96 19.968 9.155 -2.278 1.00 0.00 H new ATOM 0 HD3 PRO B 96 18.579 8.632 -1.346 1.00 0.00 H new ATOM 3277 N ALA B 97 19.113 5.172 -5.574 1.00 0.00 N ATOM 3278 CA ALA B 97 19.971 4.297 -6.390 1.00 0.00 C ATOM 3279 C ALA B 97 19.267 3.892 -7.692 1.00 0.00 C ATOM 3280 O ALA B 97 18.056 3.644 -7.705 1.00 0.00 O ATOM 3281 CB ALA B 97 20.350 3.056 -5.565 1.00 0.00 C ATOM 0 H ALA B 97 18.243 4.728 -5.281 1.00 0.00 H new ATOM 0 HA ALA B 97 20.875 4.839 -6.666 1.00 0.00 H new ATOM 0 HB1 ALA B 97 20.986 2.402 -6.162 1.00 0.00 H new ATOM 0 HB2 ALA B 97 20.888 3.365 -4.669 1.00 0.00 H new ATOM 0 HB3 ALA B 97 19.446 2.519 -5.278 1.00 0.00 H new ATOM 3287 N LYS B 98 20.045 3.837 -8.791 1.00 0.00 N ATOM 3288 CA LYS B 98 19.569 3.365 -10.093 1.00 0.00 C ATOM 3289 C LYS B 98 19.401 1.835 -10.051 1.00 0.00 C ATOM 3290 O LYS B 98 20.385 1.096 -10.125 1.00 0.00 O ATOM 3291 CB LYS B 98 20.544 3.800 -11.249 1.00 0.00 C ATOM 3292 CG LYS B 98 19.909 4.681 -12.354 1.00 0.00 C ATOM 3293 CD LYS B 98 18.551 4.132 -12.860 1.00 0.00 C ATOM 3294 CE LYS B 98 18.061 4.846 -14.126 1.00 0.00 C ATOM 3295 NZ LYS B 98 17.956 6.317 -13.943 1.00 0.00 N ATOM 0 H LYS B 98 21.025 4.121 -8.794 1.00 0.00 H new ATOM 0 HA LYS B 98 18.602 3.822 -10.303 1.00 0.00 H new ATOM 0 HB2 LYS B 98 21.381 4.343 -10.811 1.00 0.00 H new ATOM 0 HB3 LYS B 98 20.954 2.903 -11.713 1.00 0.00 H new ATOM 0 HG2 LYS B 98 19.766 5.690 -11.969 1.00 0.00 H new ATOM 0 HG3 LYS B 98 20.600 4.755 -13.194 1.00 0.00 H new ATOM 0 HD2 LYS B 98 18.647 3.065 -13.063 1.00 0.00 H new ATOM 0 HD3 LYS B 98 17.804 4.240 -12.074 1.00 0.00 H new ATOM 0 HE2 LYS B 98 18.745 4.633 -14.948 1.00 0.00 H new ATOM 0 HE3 LYS B 98 17.087 4.448 -14.410 1.00 0.00 H new ATOM 0 HZ1 LYS B 98 16.962 6.608 -14.036 1.00 0.00 H new ATOM 0 HZ2 LYS B 98 18.306 6.575 -12.998 1.00 0.00 H new ATOM 0 HZ3 LYS B 98 18.527 6.799 -14.667 1.00 0.00 H new ATOM 3309 N MET B 99 18.150 1.394 -9.881 1.00 0.00 N ATOM 3310 CA MET B 99 17.769 -0.030 -9.908 1.00 0.00 C ATOM 3311 C MET B 99 17.160 -0.366 -11.286 1.00 0.00 C ATOM 3312 O MET B 99 16.899 0.546 -12.085 1.00 0.00 O ATOM 3313 CB MET B 99 16.749 -0.318 -8.763 1.00 0.00 C ATOM 3314 CG MET B 99 16.527 -1.809 -8.457 1.00 0.00 C ATOM 3315 SD MET B 99 15.320 -2.086 -7.153 1.00 0.00 S ATOM 3316 CE MET B 99 16.130 -1.329 -5.747 1.00 0.00 C ATOM 0 H MET B 99 17.361 2.020 -9.719 1.00 0.00 H new ATOM 0 HA MET B 99 18.647 -0.657 -9.752 1.00 0.00 H new ATOM 0 HB2 MET B 99 17.094 0.177 -7.855 1.00 0.00 H new ATOM 0 HB3 MET B 99 15.791 0.131 -9.027 1.00 0.00 H new ATOM 0 HG2 MET B 99 16.197 -2.315 -9.364 1.00 0.00 H new ATOM 0 HG3 MET B 99 17.476 -2.260 -8.168 1.00 0.00 H new ATOM 0 HE1 MET B 99 15.408 -0.732 -5.189 1.00 0.00 H new ATOM 0 HE2 MET B 99 16.536 -2.106 -5.099 1.00 0.00 H new ATOM 0 HE3 MET B 99 16.939 -0.687 -6.095 1.00 0.00 H new ATOM 3326 N GLU B 100 16.943 -1.675 -11.547 1.00 0.00 N ATOM 3327 CA GLU B 100 16.285 -2.184 -12.778 1.00 0.00 C ATOM 3328 C GLU B 100 14.946 -1.462 -13.052 1.00 0.00 C ATOM 3329 O GLU B 100 14.642 -1.096 -14.185 1.00 0.00 O ATOM 3330 CB GLU B 100 15.995 -3.708 -12.641 1.00 0.00 C ATOM 3331 CG GLU B 100 17.188 -4.571 -12.191 1.00 0.00 C ATOM 3332 CD GLU B 100 16.832 -6.068 -12.073 1.00 0.00 C ATOM 3333 OE1 GLU B 100 15.864 -6.401 -11.348 1.00 0.00 O ATOM 3334 OE2 GLU B 100 17.503 -6.913 -12.709 1.00 0.00 O ATOM 0 H GLU B 100 17.221 -2.417 -10.905 1.00 0.00 H new ATOM 0 HA GLU B 100 16.968 -1.995 -13.606 1.00 0.00 H new ATOM 0 HB2 GLU B 100 15.182 -3.843 -11.928 1.00 0.00 H new ATOM 0 HB3 GLU B 100 15.641 -4.081 -13.602 1.00 0.00 H new ATOM 0 HG2 GLU B 100 18.006 -4.452 -12.902 1.00 0.00 H new ATOM 0 HG3 GLU B 100 17.548 -4.211 -11.227 1.00 0.00 H new ATOM 3341 N PHE B 101 14.175 -1.242 -11.977 1.00 0.00 N ATOM 3342 CA PHE B 101 12.803 -0.679 -12.050 1.00 0.00 C ATOM 3343 C PHE B 101 12.836 0.856 -12.215 1.00 0.00 C ATOM 3344 O PHE B 101 11.807 1.480 -12.498 1.00 0.00 O ATOM 3345 CB PHE B 101 12.000 -1.097 -10.784 1.00 0.00 C ATOM 3346 CG PHE B 101 12.171 -2.579 -10.441 1.00 0.00 C ATOM 3347 CD1 PHE B 101 11.837 -3.571 -11.365 1.00 0.00 C ATOM 3348 CD2 PHE B 101 12.712 -2.979 -9.221 1.00 0.00 C ATOM 3349 CE1 PHE B 101 12.041 -4.905 -11.076 1.00 0.00 C ATOM 3350 CE2 PHE B 101 12.905 -4.313 -8.932 1.00 0.00 C ATOM 3351 CZ PHE B 101 12.574 -5.275 -9.860 1.00 0.00 C ATOM 0 H PHE B 101 14.479 -1.448 -11.025 1.00 0.00 H new ATOM 0 HA PHE B 101 12.303 -1.082 -12.930 1.00 0.00 H new ATOM 0 HB2 PHE B 101 12.324 -0.492 -9.937 1.00 0.00 H new ATOM 0 HB3 PHE B 101 10.943 -0.884 -10.942 1.00 0.00 H new ATOM 0 HD1 PHE B 101 11.414 -3.291 -12.318 1.00 0.00 H new ATOM 0 HD2 PHE B 101 12.984 -2.232 -8.490 1.00 0.00 H new ATOM 0 HE1 PHE B 101 11.783 -5.660 -11.804 1.00 0.00 H new ATOM 0 HE2 PHE B 101 13.316 -4.604 -7.977 1.00 0.00 H new ATOM 0 HZ PHE B 101 12.732 -6.319 -9.635 1.00 0.00 H new ATOM 3361 N GLY B 102 14.033 1.445 -12.031 1.00 0.00 N ATOM 3362 CA GLY B 102 14.266 2.872 -12.235 1.00 0.00 C ATOM 3363 C GLY B 102 15.075 3.483 -11.100 1.00 0.00 C ATOM 3364 O GLY B 102 15.552 2.759 -10.217 1.00 0.00 O ATOM 0 H GLY B 102 14.865 0.934 -11.735 1.00 0.00 H new ATOM 0 HA2 GLY B 102 14.792 3.023 -13.178 1.00 0.00 H new ATOM 0 HA3 GLY B 102 13.309 3.388 -12.318 1.00 0.00 H new ATOM 3368 N TYR B 103 15.221 4.820 -11.109 1.00 0.00 N ATOM 3369 CA TYR B 103 15.974 5.537 -10.072 1.00 0.00 C ATOM 3370 C TYR B 103 15.087 5.659 -8.824 1.00 0.00 C ATOM 3371 O TYR B 103 14.219 6.529 -8.768 1.00 0.00 O ATOM 3372 CB TYR B 103 16.392 6.935 -10.594 1.00 0.00 C ATOM 3373 CG TYR B 103 17.473 7.605 -9.747 1.00 0.00 C ATOM 3374 CD1 TYR B 103 18.746 7.050 -9.687 1.00 0.00 C ATOM 3375 CD2 TYR B 103 17.241 8.779 -9.026 1.00 0.00 C ATOM 3376 CE1 TYR B 103 19.747 7.626 -8.950 1.00 0.00 C ATOM 3377 CE2 TYR B 103 18.248 9.370 -8.287 1.00 0.00 C ATOM 3378 CZ TYR B 103 19.500 8.789 -8.252 1.00 0.00 C ATOM 3379 OH TYR B 103 20.511 9.375 -7.530 1.00 0.00 O ATOM 0 H TYR B 103 14.824 5.425 -11.828 1.00 0.00 H new ATOM 0 HA TYR B 103 16.882 4.991 -9.817 1.00 0.00 H new ATOM 0 HB2 TYR B 103 16.752 6.839 -11.618 1.00 0.00 H new ATOM 0 HB3 TYR B 103 15.514 7.580 -10.624 1.00 0.00 H new ATOM 0 HD1 TYR B 103 18.951 6.142 -10.235 1.00 0.00 H new ATOM 0 HD2 TYR B 103 16.260 9.231 -9.047 1.00 0.00 H new ATOM 0 HE1 TYR B 103 20.726 7.171 -8.916 1.00 0.00 H new ATOM 0 HE2 TYR B 103 18.057 10.281 -7.740 1.00 0.00 H new ATOM 0 HH TYR B 103 20.748 8.800 -6.773 1.00 0.00 H new ATOM 3389 N THR B 104 15.321 4.804 -7.823 1.00 0.00 N ATOM 3390 CA THR B 104 14.388 4.614 -6.698 1.00 0.00 C ATOM 3391 C THR B 104 15.012 5.103 -5.385 1.00 0.00 C ATOM 3392 O THR B 104 16.230 5.016 -5.190 1.00 0.00 O ATOM 3393 CB THR B 104 13.948 3.112 -6.575 1.00 0.00 C ATOM 3394 OG1 THR B 104 12.934 2.975 -5.564 1.00 0.00 O ATOM 3395 CG2 THR B 104 15.130 2.167 -6.262 1.00 0.00 C ATOM 0 H THR B 104 16.158 4.224 -7.766 1.00 0.00 H new ATOM 0 HA THR B 104 13.498 5.210 -6.898 1.00 0.00 H new ATOM 0 HB THR B 104 13.549 2.819 -7.546 1.00 0.00 H new ATOM 0 HG1 THR B 104 12.665 2.035 -5.496 1.00 0.00 H new ATOM 0 HG21 THR B 104 14.767 1.142 -6.188 1.00 0.00 H new ATOM 0 HG22 THR B 104 15.870 2.233 -7.060 1.00 0.00 H new ATOM 0 HG23 THR B 104 15.588 2.458 -5.317 1.00 0.00 H new ATOM 3403 N PHE B 105 14.158 5.612 -4.499 1.00 0.00 N ATOM 3404 CA PHE B 105 14.551 6.167 -3.203 1.00 0.00 C ATOM 3405 C PHE B 105 13.521 5.762 -2.153 1.00 0.00 C ATOM 3406 O PHE B 105 12.320 5.859 -2.409 1.00 0.00 O ATOM 3407 CB PHE B 105 14.678 7.723 -3.297 1.00 0.00 C ATOM 3408 CG PHE B 105 14.511 8.498 -1.978 1.00 0.00 C ATOM 3409 CD1 PHE B 105 15.383 8.300 -0.904 1.00 0.00 C ATOM 3410 CD2 PHE B 105 13.453 9.404 -1.810 1.00 0.00 C ATOM 3411 CE1 PHE B 105 15.206 8.980 0.282 1.00 0.00 C ATOM 3412 CE2 PHE B 105 13.281 10.082 -0.622 1.00 0.00 C ATOM 3413 CZ PHE B 105 14.157 9.871 0.422 1.00 0.00 C ATOM 0 H PHE B 105 13.152 5.651 -4.664 1.00 0.00 H new ATOM 0 HA PHE B 105 15.524 5.772 -2.913 1.00 0.00 H new ATOM 0 HB2 PHE B 105 15.656 7.963 -3.714 1.00 0.00 H new ATOM 0 HB3 PHE B 105 13.932 8.086 -4.005 1.00 0.00 H new ATOM 0 HD1 PHE B 105 16.205 7.606 -1.004 1.00 0.00 H new ATOM 0 HD2 PHE B 105 12.763 9.573 -2.624 1.00 0.00 H new ATOM 0 HE1 PHE B 105 15.888 8.817 1.104 1.00 0.00 H new ATOM 0 HE2 PHE B 105 12.462 10.777 -0.509 1.00 0.00 H new ATOM 0 HZ PHE B 105 14.024 10.403 1.352 1.00 0.00 H new ATOM 3423 N THR B 106 13.981 5.307 -0.990 1.00 0.00 N ATOM 3424 CA THR B 106 13.098 4.839 0.076 1.00 0.00 C ATOM 3425 C THR B 106 13.329 5.671 1.347 1.00 0.00 C ATOM 3426 O THR B 106 14.433 5.688 1.897 1.00 0.00 O ATOM 3427 CB THR B 106 13.351 3.328 0.380 1.00 0.00 C ATOM 3428 OG1 THR B 106 13.632 2.622 -0.836 1.00 0.00 O ATOM 3429 CG2 THR B 106 12.147 2.677 1.080 1.00 0.00 C ATOM 0 H THR B 106 14.973 5.252 -0.760 1.00 0.00 H new ATOM 0 HA THR B 106 12.066 4.958 -0.253 1.00 0.00 H new ATOM 0 HB THR B 106 14.208 3.269 1.052 1.00 0.00 H new ATOM 0 HG1 THR B 106 14.162 1.823 -0.635 1.00 0.00 H new ATOM 0 HG21 THR B 106 12.363 1.626 1.274 1.00 0.00 H new ATOM 0 HG22 THR B 106 11.955 3.188 2.023 1.00 0.00 H new ATOM 0 HG23 THR B 106 11.268 2.754 0.440 1.00 0.00 H new ATOM 3437 N ALA B 107 12.290 6.367 1.798 1.00 0.00 N ATOM 3438 CA ALA B 107 12.325 7.138 3.040 1.00 0.00 C ATOM 3439 C ALA B 107 11.526 6.413 4.118 1.00 0.00 C ATOM 3440 O ALA B 107 10.806 5.447 3.823 1.00 0.00 O ATOM 3441 CB ALA B 107 11.778 8.548 2.810 1.00 0.00 C ATOM 0 H ALA B 107 11.395 6.413 1.311 1.00 0.00 H new ATOM 0 HA ALA B 107 13.358 7.230 3.374 1.00 0.00 H new ATOM 0 HB1 ALA B 107 11.811 9.108 3.744 1.00 0.00 H new ATOM 0 HB2 ALA B 107 12.385 9.056 2.061 1.00 0.00 H new ATOM 0 HB3 ALA B 107 10.747 8.486 2.461 1.00 0.00 H new ATOM 3447 N ALA B 108 11.636 6.883 5.351 1.00 0.00 N ATOM 3448 CA ALA B 108 10.905 6.320 6.485 1.00 0.00 C ATOM 3449 C ALA B 108 10.350 7.456 7.318 1.00 0.00 C ATOM 3450 O ALA B 108 11.085 8.370 7.665 1.00 0.00 O ATOM 3451 CB ALA B 108 11.823 5.423 7.321 1.00 0.00 C ATOM 0 H ALA B 108 12.237 7.669 5.598 1.00 0.00 H new ATOM 0 HA ALA B 108 10.082 5.702 6.125 1.00 0.00 H new ATOM 0 HB1 ALA B 108 11.263 5.012 8.161 1.00 0.00 H new ATOM 0 HB2 ALA B 108 12.198 4.608 6.702 1.00 0.00 H new ATOM 0 HB3 ALA B 108 12.662 6.010 7.696 1.00 0.00 H new ATOM 3457 N ASP B 109 9.052 7.406 7.608 1.00 0.00 N ATOM 3458 CA ASP B 109 8.383 8.349 8.527 1.00 0.00 C ATOM 3459 C ASP B 109 8.969 8.216 9.962 1.00 0.00 C ATOM 3460 O ASP B 109 9.757 7.292 10.224 1.00 0.00 O ATOM 3461 CB ASP B 109 6.853 8.055 8.528 1.00 0.00 C ATOM 3462 CG ASP B 109 6.234 8.109 7.122 1.00 0.00 C ATOM 3463 OD1 ASP B 109 6.381 7.122 6.380 1.00 0.00 O ATOM 3464 OD2 ASP B 109 5.599 9.112 6.756 1.00 0.00 O ATOM 0 H ASP B 109 8.422 6.708 7.213 1.00 0.00 H new ATOM 0 HA ASP B 109 8.554 9.371 8.190 1.00 0.00 H new ATOM 0 HB2 ASP B 109 6.678 7.070 8.959 1.00 0.00 H new ATOM 0 HB3 ASP B 109 6.349 8.778 9.170 1.00 0.00 H new ATOM 3469 N PRO B 110 8.626 9.140 10.914 1.00 0.00 N ATOM 3470 CA PRO B 110 8.876 8.930 12.373 1.00 0.00 C ATOM 3471 C PRO B 110 8.360 7.546 12.865 1.00 0.00 C ATOM 3472 O PRO B 110 8.952 6.927 13.750 1.00 0.00 O ATOM 3473 CB PRO B 110 8.096 10.107 13.043 1.00 0.00 C ATOM 3474 CG PRO B 110 7.249 10.699 11.944 1.00 0.00 C ATOM 3475 CD PRO B 110 8.029 10.481 10.674 1.00 0.00 C ATOM 0 HA PRO B 110 9.938 8.925 12.619 1.00 0.00 H new ATOM 0 HB2 PRO B 110 7.478 9.751 13.867 1.00 0.00 H new ATOM 0 HB3 PRO B 110 8.780 10.849 13.455 1.00 0.00 H new ATOM 0 HG2 PRO B 110 6.275 10.213 11.894 1.00 0.00 H new ATOM 0 HG3 PRO B 110 7.068 11.760 12.116 1.00 0.00 H new ATOM 0 HD2 PRO B 110 7.388 10.492 9.793 1.00 0.00 H new ATOM 0 HD3 PRO B 110 8.790 11.247 10.524 1.00 0.00 H new ATOM 3483 N ASP B 111 7.270 7.069 12.231 1.00 0.00 N ATOM 3484 CA ASP B 111 6.600 5.789 12.566 1.00 0.00 C ATOM 3485 C ASP B 111 7.227 4.589 11.811 1.00 0.00 C ATOM 3486 O ASP B 111 6.703 3.477 11.892 1.00 0.00 O ATOM 3487 CB ASP B 111 5.091 5.885 12.212 1.00 0.00 C ATOM 3488 CG ASP B 111 4.417 7.138 12.784 1.00 0.00 C ATOM 3489 OD1 ASP B 111 4.577 8.221 12.183 1.00 0.00 O ATOM 3490 OD2 ASP B 111 3.746 7.057 13.841 1.00 0.00 O ATOM 0 H ASP B 111 6.822 7.566 11.461 1.00 0.00 H new ATOM 0 HA ASP B 111 6.731 5.618 13.634 1.00 0.00 H new ATOM 0 HB2 ASP B 111 4.977 5.882 11.128 1.00 0.00 H new ATOM 0 HB3 ASP B 111 4.579 5.000 12.589 1.00 0.00 H new ATOM 3495 N SER B 112 8.321 4.843 11.063 1.00 0.00 N ATOM 3496 CA SER B 112 9.074 3.827 10.297 1.00 0.00 C ATOM 3497 C SER B 112 8.194 3.096 9.255 1.00 0.00 C ATOM 3498 O SER B 112 7.617 2.031 9.532 1.00 0.00 O ATOM 3499 CB SER B 112 9.779 2.822 11.245 1.00 0.00 C ATOM 3500 OG SER B 112 10.707 3.482 12.084 1.00 0.00 O ATOM 0 H SER B 112 8.714 5.780 10.973 1.00 0.00 H new ATOM 0 HA SER B 112 9.841 4.360 9.736 1.00 0.00 H new ATOM 0 HB2 SER B 112 9.035 2.307 11.853 1.00 0.00 H new ATOM 0 HB3 SER B 112 10.292 2.061 10.657 1.00 0.00 H new ATOM 0 HG SER B 112 11.137 2.828 12.674 1.00 0.00 H new ATOM 3506 N HIS B 113 8.052 3.707 8.065 1.00 0.00 N ATOM 3507 CA HIS B 113 7.339 3.092 6.918 1.00 0.00 C ATOM 3508 C HIS B 113 8.280 3.016 5.707 1.00 0.00 C ATOM 3509 O HIS B 113 9.422 3.479 5.764 1.00 0.00 O ATOM 3510 CB HIS B 113 6.067 3.890 6.517 1.00 0.00 C ATOM 3511 CG HIS B 113 5.142 4.250 7.647 1.00 0.00 C ATOM 3512 ND1 HIS B 113 4.537 5.472 7.747 1.00 0.00 N ATOM 3513 CD2 HIS B 113 4.722 3.555 8.716 1.00 0.00 C ATOM 3514 CE1 HIS B 113 3.799 5.523 8.815 1.00 0.00 C ATOM 3515 NE2 HIS B 113 3.891 4.374 9.432 1.00 0.00 N ATOM 0 H HIS B 113 8.424 4.636 7.866 1.00 0.00 H new ATOM 0 HA HIS B 113 7.027 2.095 7.229 1.00 0.00 H new ATOM 0 HB2 HIS B 113 6.378 4.809 6.019 1.00 0.00 H new ATOM 0 HB3 HIS B 113 5.508 3.305 5.786 1.00 0.00 H new ATOM 0 HD2 HIS B 113 4.990 2.539 8.965 1.00 0.00 H new ATOM 0 HE1 HIS B 113 3.211 6.369 9.138 1.00 0.00 H new ATOM 0 HE2 HIS B 113 3.421 4.128 10.303 1.00 0.00 H new ATOM 3524 N ARG B 114 7.787 2.417 4.624 1.00 0.00 N ATOM 3525 CA ARG B 114 8.451 2.441 3.317 1.00 0.00 C ATOM 3526 C ARG B 114 7.768 3.492 2.433 1.00 0.00 C ATOM 3527 O ARG B 114 6.592 3.347 2.100 1.00 0.00 O ATOM 3528 CB ARG B 114 8.380 1.031 2.671 1.00 0.00 C ATOM 3529 CG ARG B 114 9.258 -0.031 3.359 1.00 0.00 C ATOM 3530 CD ARG B 114 10.745 0.318 3.249 1.00 0.00 C ATOM 3531 NE ARG B 114 11.608 -0.552 4.052 1.00 0.00 N ATOM 3532 CZ ARG B 114 12.614 -1.280 3.570 1.00 0.00 C ATOM 3533 NH1 ARG B 114 12.762 -1.475 2.257 1.00 0.00 N ATOM 3534 NH2 ARG B 114 13.465 -1.823 4.407 1.00 0.00 N ATOM 0 H ARG B 114 6.909 1.897 4.627 1.00 0.00 H new ATOM 0 HA ARG B 114 9.502 2.707 3.429 1.00 0.00 H new ATOM 0 HB2 ARG B 114 7.344 0.691 2.683 1.00 0.00 H new ATOM 0 HB3 ARG B 114 8.678 1.109 1.625 1.00 0.00 H new ATOM 0 HG2 ARG B 114 8.978 -0.112 4.409 1.00 0.00 H new ATOM 0 HG3 ARG B 114 9.077 -1.005 2.905 1.00 0.00 H new ATOM 0 HD2 ARG B 114 11.049 0.255 2.204 1.00 0.00 H new ATOM 0 HD3 ARG B 114 10.892 1.352 3.562 1.00 0.00 H new ATOM 0 HE ARG B 114 11.425 -0.604 5.054 1.00 0.00 H new ATOM 0 HH11 ARG B 114 12.097 -1.063 1.602 1.00 0.00 H new ATOM 0 HH12 ARG B 114 13.540 -2.036 1.909 1.00 0.00 H new ATOM 0 HH21 ARG B 114 13.351 -1.685 5.411 1.00 0.00 H new ATOM 0 HH22 ARG B 114 14.241 -2.383 4.054 1.00 0.00 H new ATOM 3548 N LEU B 115 8.484 4.578 2.111 1.00 0.00 N ATOM 3549 CA LEU B 115 8.018 5.596 1.154 1.00 0.00 C ATOM 3550 C LEU B 115 8.922 5.520 -0.081 1.00 0.00 C ATOM 3551 O LEU B 115 10.037 6.039 -0.073 1.00 0.00 O ATOM 3552 CB LEU B 115 8.104 7.009 1.793 1.00 0.00 C ATOM 3553 CG LEU B 115 7.335 7.229 3.131 1.00 0.00 C ATOM 3554 CD1 LEU B 115 7.617 8.639 3.705 1.00 0.00 C ATOM 3555 CD2 LEU B 115 5.813 6.972 2.970 1.00 0.00 C ATOM 0 H LEU B 115 9.403 4.777 2.506 1.00 0.00 H new ATOM 0 HA LEU B 115 6.979 5.413 0.878 1.00 0.00 H new ATOM 0 HB2 LEU B 115 9.155 7.240 1.965 1.00 0.00 H new ATOM 0 HB3 LEU B 115 7.734 7.732 1.067 1.00 0.00 H new ATOM 0 HG LEU B 115 7.705 6.496 3.848 1.00 0.00 H new ATOM 0 HD11 LEU B 115 7.069 8.768 4.638 1.00 0.00 H new ATOM 0 HD12 LEU B 115 8.685 8.748 3.893 1.00 0.00 H new ATOM 0 HD13 LEU B 115 7.296 9.395 2.988 1.00 0.00 H new ATOM 0 HD21 LEU B 115 5.313 7.136 3.925 1.00 0.00 H new ATOM 0 HD22 LEU B 115 5.405 7.655 2.225 1.00 0.00 H new ATOM 0 HD23 LEU B 115 5.650 5.944 2.647 1.00 0.00 H new ATOM 3567 N ARG B 116 8.432 4.865 -1.141 1.00 0.00 N ATOM 3568 CA ARG B 116 9.237 4.566 -2.334 1.00 0.00 C ATOM 3569 C ARG B 116 9.020 5.604 -3.446 1.00 0.00 C ATOM 3570 O ARG B 116 8.135 5.414 -4.273 1.00 0.00 O ATOM 3571 CB ARG B 116 8.916 3.110 -2.810 1.00 0.00 C ATOM 3572 CG ARG B 116 9.833 2.021 -2.211 1.00 0.00 C ATOM 3573 CD ARG B 116 11.220 1.995 -2.897 1.00 0.00 C ATOM 3574 NE ARG B 116 12.115 0.916 -2.429 1.00 0.00 N ATOM 3575 CZ ARG B 116 11.873 -0.393 -2.514 1.00 0.00 C ATOM 3576 NH1 ARG B 116 10.693 -0.861 -2.850 1.00 0.00 N ATOM 3577 NH2 ARG B 116 12.829 -1.246 -2.234 1.00 0.00 N ATOM 0 H ARG B 116 7.471 4.528 -1.197 1.00 0.00 H new ATOM 0 HA ARG B 116 10.295 4.627 -2.078 1.00 0.00 H new ATOM 0 HB2 ARG B 116 7.882 2.878 -2.554 1.00 0.00 H new ATOM 0 HB3 ARG B 116 8.991 3.072 -3.897 1.00 0.00 H new ATOM 0 HG2 ARG B 116 9.959 2.199 -1.143 1.00 0.00 H new ATOM 0 HG3 ARG B 116 9.357 1.046 -2.317 1.00 0.00 H new ATOM 0 HD2 ARG B 116 11.077 1.891 -3.973 1.00 0.00 H new ATOM 0 HD3 ARG B 116 11.711 2.954 -2.732 1.00 0.00 H new ATOM 0 HE ARG B 116 12.998 1.198 -2.002 1.00 0.00 H new ATOM 0 HH11 ARG B 116 9.929 -0.217 -3.055 1.00 0.00 H new ATOM 0 HH12 ARG B 116 10.541 -1.868 -2.906 1.00 0.00 H new ATOM 0 HH21 ARG B 116 13.749 -0.907 -1.954 1.00 0.00 H new ATOM 0 HH22 ARG B 116 12.652 -2.249 -2.296 1.00 0.00 H new ATOM 3591 N VAL B 117 9.835 6.664 -3.510 1.00 0.00 N ATOM 3592 CA VAL B 117 9.768 7.641 -4.618 1.00 0.00 C ATOM 3593 C VAL B 117 10.741 7.182 -5.692 1.00 0.00 C ATOM 3594 O VAL B 117 11.951 7.154 -5.444 1.00 0.00 O ATOM 3595 CB VAL B 117 10.125 9.117 -4.191 1.00 0.00 C ATOM 3596 CG1 VAL B 117 9.710 10.153 -5.273 1.00 0.00 C ATOM 3597 CG2 VAL B 117 9.554 9.454 -2.812 1.00 0.00 C ATOM 0 H VAL B 117 10.549 6.872 -2.812 1.00 0.00 H new ATOM 0 HA VAL B 117 8.738 7.671 -4.972 1.00 0.00 H new ATOM 0 HB VAL B 117 11.210 9.178 -4.109 1.00 0.00 H new ATOM 0 HG11 VAL B 117 9.975 11.156 -4.937 1.00 0.00 H new ATOM 0 HG12 VAL B 117 10.230 9.934 -6.205 1.00 0.00 H new ATOM 0 HG13 VAL B 117 8.634 10.097 -5.436 1.00 0.00 H new ATOM 0 HG21 VAL B 117 9.819 10.478 -2.549 1.00 0.00 H new ATOM 0 HG22 VAL B 117 8.469 9.354 -2.833 1.00 0.00 H new ATOM 0 HG23 VAL B 117 9.967 8.771 -2.070 1.00 0.00 H new ATOM 3607 N TYR B 118 10.236 6.822 -6.880 1.00 0.00 N ATOM 3608 CA TYR B 118 11.090 6.281 -7.950 1.00 0.00 C ATOM 3609 C TYR B 118 10.940 7.091 -9.237 1.00 0.00 C ATOM 3610 O TYR B 118 10.005 7.888 -9.364 1.00 0.00 O ATOM 3611 CB TYR B 118 10.856 4.760 -8.170 1.00 0.00 C ATOM 3612 CG TYR B 118 9.565 4.374 -8.898 1.00 0.00 C ATOM 3613 CD1 TYR B 118 8.327 4.439 -8.257 1.00 0.00 C ATOM 3614 CD2 TYR B 118 9.589 3.921 -10.227 1.00 0.00 C ATOM 3615 CE1 TYR B 118 7.172 4.070 -8.910 1.00 0.00 C ATOM 3616 CE2 TYR B 118 8.432 3.559 -10.879 1.00 0.00 C ATOM 3617 CZ TYR B 118 7.229 3.630 -10.219 1.00 0.00 C ATOM 3618 OH TYR B 118 6.075 3.255 -10.870 1.00 0.00 O ATOM 0 H TYR B 118 9.248 6.894 -7.125 1.00 0.00 H new ATOM 0 HA TYR B 118 12.127 6.382 -7.629 1.00 0.00 H new ATOM 0 HB2 TYR B 118 11.700 4.361 -8.733 1.00 0.00 H new ATOM 0 HB3 TYR B 118 10.861 4.268 -7.197 1.00 0.00 H new ATOM 0 HD1 TYR B 118 8.274 4.783 -7.235 1.00 0.00 H new ATOM 0 HD2 TYR B 118 10.533 3.855 -10.747 1.00 0.00 H new ATOM 0 HE1 TYR B 118 6.222 4.124 -8.399 1.00 0.00 H new ATOM 0 HE2 TYR B 118 8.470 3.221 -11.904 1.00 0.00 H new ATOM 0 HH TYR B 118 5.446 2.870 -10.225 1.00 0.00 H new ATOM 3628 N ALA B 119 11.822 6.841 -10.200 1.00 0.00 N ATOM 3629 CA ALA B 119 11.741 7.409 -11.547 1.00 0.00 C ATOM 3630 C ALA B 119 11.861 6.262 -12.537 1.00 0.00 C ATOM 3631 O ALA B 119 12.926 5.657 -12.631 1.00 0.00 O ATOM 3632 CB ALA B 119 12.874 8.421 -11.760 1.00 0.00 C ATOM 0 H ALA B 119 12.627 6.229 -10.067 1.00 0.00 H new ATOM 0 HA ALA B 119 10.795 7.932 -11.688 1.00 0.00 H new ATOM 0 HB1 ALA B 119 12.805 8.838 -12.765 1.00 0.00 H new ATOM 0 HB2 ALA B 119 12.788 9.223 -11.027 1.00 0.00 H new ATOM 0 HB3 ALA B 119 13.835 7.922 -11.639 1.00 0.00 H new ATOM 3638 N PHE B 120 10.779 5.951 -13.263 1.00 0.00 N ATOM 3639 CA PHE B 120 10.775 4.821 -14.199 1.00 0.00 C ATOM 3640 C PHE B 120 11.478 5.268 -15.488 1.00 0.00 C ATOM 3641 O PHE B 120 11.001 6.194 -16.166 1.00 0.00 O ATOM 3642 CB PHE B 120 9.329 4.327 -14.502 1.00 0.00 C ATOM 3643 CG PHE B 120 9.294 2.962 -15.209 1.00 0.00 C ATOM 3644 CD1 PHE B 120 9.412 2.856 -16.601 1.00 0.00 C ATOM 3645 CD2 PHE B 120 9.179 1.780 -14.471 1.00 0.00 C ATOM 3646 CE1 PHE B 120 9.412 1.621 -17.223 1.00 0.00 C ATOM 3647 CE2 PHE B 120 9.184 0.548 -15.097 1.00 0.00 C ATOM 3648 CZ PHE B 120 9.301 0.469 -16.472 1.00 0.00 C ATOM 0 H PHE B 120 9.899 6.464 -13.220 1.00 0.00 H new ATOM 0 HA PHE B 120 11.303 3.980 -13.751 1.00 0.00 H new ATOM 0 HB2 PHE B 120 8.771 4.260 -13.568 1.00 0.00 H new ATOM 0 HB3 PHE B 120 8.822 5.065 -15.124 1.00 0.00 H new ATOM 0 HD1 PHE B 120 9.504 3.752 -17.197 1.00 0.00 H new ATOM 0 HD2 PHE B 120 9.085 1.831 -13.396 1.00 0.00 H new ATOM 0 HE1 PHE B 120 9.499 1.558 -18.298 1.00 0.00 H new ATOM 0 HE2 PHE B 120 9.096 -0.355 -14.511 1.00 0.00 H new ATOM 0 HZ PHE B 120 9.306 -0.495 -16.959 1.00 0.00 H new ATOM 3658 N ALA B 121 12.625 4.634 -15.789 1.00 0.00 N ATOM 3659 CA ALA B 121 13.380 4.882 -17.019 1.00 0.00 C ATOM 3660 C ALA B 121 12.538 4.405 -18.214 1.00 0.00 C ATOM 3661 O ALA B 121 12.512 3.209 -18.535 1.00 0.00 O ATOM 3662 CB ALA B 121 14.758 4.186 -16.962 1.00 0.00 C ATOM 0 H ALA B 121 13.051 3.934 -15.181 1.00 0.00 H new ATOM 0 HA ALA B 121 13.576 5.948 -17.133 1.00 0.00 H new ATOM 0 HB1 ALA B 121 15.303 4.382 -17.885 1.00 0.00 H new ATOM 0 HB2 ALA B 121 15.326 4.572 -16.116 1.00 0.00 H new ATOM 0 HB3 ALA B 121 14.618 3.111 -16.845 1.00 0.00 H new ATOM 3668 N GLY B 122 11.795 5.354 -18.809 1.00 0.00 N ATOM 3669 CA GLY B 122 10.841 5.079 -19.882 1.00 0.00 C ATOM 3670 C GLY B 122 11.268 5.675 -21.222 1.00 0.00 C ATOM 3671 O GLY B 122 11.960 6.716 -21.225 1.00 0.00 O ATOM 3672 OXT GLY B 122 10.905 5.119 -22.277 1.00 0.00 O ATOM 0 H GLY B 122 11.845 6.340 -18.552 1.00 0.00 H new ATOM 0 HA2 GLY B 122 10.724 4.001 -19.990 1.00 0.00 H new ATOM 0 HA3 GLY B 122 9.866 5.479 -19.606 1.00 0.00 H new TER 3676 GLY B 122