USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1080 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 111 LYS NZ :NH3+ -145:sc= 1.99 (180deg=0.244) USER MOD Set 1.2: A 112 GLN : amide:sc= 1.01 K(o=3,f=-6.6!) USER MOD Set 2.1: A 81 MET CE :methyl -166:sc= -1.95 (180deg=-2.34) USER MOD Set 2.2: A 96 GLN : amide:sc= 0 K(o=-2,f=-2.7) USER MOD Set 3.1: A 65 THR OG1 : rot -170:sc= 0.178 USER MOD Set 3.2: A 67 THR OG1 : rot 180:sc= 0.0051 USER MOD Set 4.1: A 11 TYR OH : rot 180:sc= 0.723 USER MOD Set 4.2: A 39 LYS NZ :NH3+ 147:sc= 0.824 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ -142:sc= 0.0864 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ -165:sc= 1.26 (180deg=1.07) USER MOD Single : A 12 SER OG : rot 38:sc= 0.00721 USER MOD Single : A 13 GLN : amide:sc= -0.0271 K(o=-0.027,f=-1.5) USER MOD Single : A 16 LYS NZ :NH3+ 154:sc= 1.22 (180deg=1.06) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 28 LYS NZ :NH3+ 149:sc= 1.28 (180deg=0.583) USER MOD Single : A 34 ASN : amide:sc= -5.36! C(o=-5.4!,f=-4.5!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 ASN : amide:sc= -2.58! C(o=-2.6!,f=-6.4!) USER MOD Single : A 43 ASN : amide:sc= -0.0972 K(o=-0.097,f=-7.7!) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl 170:sc= -0.335 (180deg=-0.563) USER MOD Single : A 50 MET CE :methyl -174:sc= -0.568 (180deg=-0.675) USER MOD Single : A 54 GLN : amide:sc= -1.89! K(o=-1.9!,f=-0.88) USER MOD Single : A 57 LYS NZ :NH3+ -158:sc= 1.63 (180deg=1.15) USER MOD Single : A 59 CYS SG : rot 170:sc= -0.0818 USER MOD Single : A 61 ASN : amide:sc= -0.473 K(o=-0.47,f=-10!) USER MOD Single : A 62 HIS : no HD1:sc= -11.2! C(o=-11!,f=-12!) USER MOD Single : A 66 THR OG1 : rot -102:sc= 0.723 USER MOD Single : A 68 MET CE :methyl 148:sc= -0.789 (180deg=-1.72) USER MOD Single : A 69 ASN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : A 71 LYS NZ :NH3+ 170:sc= -0.0191 (180deg=-0.134) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 138:sc= 2.27 USER MOD Single : A 85 SER OG : rot 180:sc= 0.124 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 177:sc= 1.03 (180deg=0.852) USER MOD Single : A 100 LYS NZ :NH3+ -123:sc= 0.757 (180deg=0.362) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 THR OG1 : rot -155:sc= -1.31 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 CYS SG : rot 82:sc= 0.417 USER MOD Single : A 118 GLN : amide:sc= -2.19! C(o=-2.2!,f=-8.8!) USER MOD Single : A 127 GLN : amide:sc= -0.826 K(o=-0.83,f=-1.8!) USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 150:sc= -0.368 (180deg=-2.92!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.130 -3.686 -13.766 1.00 0.00 N ATOM 2 CA GLY A 1 -14.851 -4.252 -14.153 1.00 0.00 C ATOM 3 C GLY A 1 -15.017 -5.704 -14.479 1.00 0.00 C ATOM 4 O GLY A 1 -16.074 -6.113 -14.963 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.211 -2.721 -14.145 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.899 -4.273 -14.147 1.00 0.00 H new ATOM 0 H3 GLY A 1 -16.197 -3.657 -12.729 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -14.453 -3.719 -15.017 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -14.130 -4.131 -13.344 1.00 0.00 H new ATOM 10 N SER A 2 -14.003 -6.482 -14.230 1.00 0.00 N ATOM 11 CA SER A 2 -14.040 -7.886 -14.497 1.00 0.00 C ATOM 12 C SER A 2 -13.554 -8.657 -13.260 1.00 0.00 C ATOM 13 O SER A 2 -14.149 -9.670 -12.874 1.00 0.00 O ATOM 14 CB SER A 2 -13.175 -8.187 -15.733 1.00 0.00 C ATOM 15 OG SER A 2 -13.222 -9.551 -16.107 1.00 0.00 O ATOM 0 H SER A 2 -13.122 -6.155 -13.833 1.00 0.00 H new ATOM 0 HA SER A 2 -15.060 -8.207 -14.709 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.513 -7.573 -16.568 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.142 -7.905 -15.527 1.00 0.00 H new ATOM 0 HG SER A 2 -12.659 -9.693 -16.897 1.00 0.00 H new ATOM 21 N GLY A 3 -12.509 -8.165 -12.629 1.00 0.00 N ATOM 22 CA GLY A 3 -11.985 -8.801 -11.461 1.00 0.00 C ATOM 23 C GLY A 3 -11.007 -7.926 -10.706 1.00 0.00 C ATOM 24 O GLY A 3 -11.319 -7.435 -9.619 1.00 0.00 O ATOM 0 H GLY A 3 -12.011 -7.322 -12.915 1.00 0.00 H new ATOM 0 HA2 GLY A 3 -12.808 -9.072 -10.800 1.00 0.00 H new ATOM 0 HA3 GLY A 3 -11.489 -9.728 -11.749 1.00 0.00 H new ATOM 28 N GLU A 4 -9.861 -7.679 -11.299 1.00 0.00 N ATOM 29 CA GLU A 4 -8.777 -6.977 -10.621 1.00 0.00 C ATOM 30 C GLU A 4 -8.586 -5.544 -11.119 1.00 0.00 C ATOM 31 O GLU A 4 -7.562 -4.912 -10.847 1.00 0.00 O ATOM 32 CB GLU A 4 -7.492 -7.777 -10.764 1.00 0.00 C ATOM 33 CG GLU A 4 -7.515 -9.119 -10.041 1.00 0.00 C ATOM 34 CD GLU A 4 -7.435 -8.988 -8.533 1.00 0.00 C ATOM 35 OE1 GLU A 4 -8.400 -8.524 -7.896 1.00 0.00 O ATOM 36 OE2 GLU A 4 -6.372 -9.328 -7.948 1.00 0.00 O ATOM 0 H GLU A 4 -9.648 -7.954 -12.258 1.00 0.00 H new ATOM 0 HA GLU A 4 -9.047 -6.893 -9.568 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.299 -7.949 -11.823 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -6.662 -7.184 -10.381 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -8.429 -9.651 -10.305 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -6.681 -9.727 -10.391 1.00 0.00 H new ATOM 43 N GLU A 5 -9.547 -5.023 -11.837 1.00 0.00 N ATOM 44 CA GLU A 5 -9.521 -3.708 -12.229 1.00 0.00 C ATOM 45 C GLU A 5 -10.652 -3.037 -11.558 1.00 0.00 C ATOM 46 O GLU A 5 -11.187 -3.580 -10.596 1.00 0.00 O ATOM 47 CB GLU A 5 -9.454 -3.516 -13.761 1.00 0.00 C ATOM 48 CG GLU A 5 -10.663 -3.975 -14.465 1.00 0.00 C ATOM 49 CD GLU A 5 -10.807 -5.462 -14.489 1.00 0.00 C ATOM 50 OE1 GLU A 5 -10.248 -6.127 -15.388 1.00 0.00 O ATOM 51 OE2 GLU A 5 -11.455 -5.994 -13.588 1.00 0.00 O ATOM 0 H GLU A 5 -10.367 -5.541 -12.152 1.00 0.00 H new ATOM 0 HA GLU A 5 -8.592 -3.233 -11.914 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -9.295 -2.460 -13.980 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -8.590 -4.056 -14.149 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -11.540 -3.540 -13.986 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -10.641 -3.603 -15.489 1.00 0.00 H new ATOM 58 N ASP A 6 -11.002 -1.902 -12.073 1.00 0.00 N ATOM 59 CA ASP A 6 -11.885 -0.884 -11.403 1.00 0.00 C ATOM 60 C ASP A 6 -11.013 -0.091 -10.423 1.00 0.00 C ATOM 61 O ASP A 6 -11.445 0.780 -9.650 1.00 0.00 O ATOM 62 CB ASP A 6 -13.108 -1.544 -10.741 1.00 0.00 C ATOM 63 CG ASP A 6 -13.995 -0.636 -9.893 1.00 0.00 C ATOM 64 OD1 ASP A 6 -14.787 0.167 -10.469 1.00 0.00 O ATOM 65 OD2 ASP A 6 -13.971 -0.755 -8.654 1.00 0.00 O ATOM 0 H ASP A 6 -10.694 -1.608 -13.000 1.00 0.00 H new ATOM 0 HA ASP A 6 -12.308 -0.195 -12.134 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -13.723 -1.987 -11.525 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.756 -2.362 -10.112 1.00 0.00 H new ATOM 70 N GLU A 7 -9.768 -0.403 -10.520 1.00 0.00 N ATOM 71 CA GLU A 7 -8.718 0.182 -9.848 1.00 0.00 C ATOM 72 C GLU A 7 -7.635 0.257 -10.824 1.00 0.00 C ATOM 73 O GLU A 7 -7.462 -0.653 -11.650 1.00 0.00 O ATOM 74 CB GLU A 7 -8.413 -0.605 -8.588 1.00 0.00 C ATOM 75 CG GLU A 7 -8.223 -2.087 -8.783 1.00 0.00 C ATOM 76 CD GLU A 7 -8.369 -2.819 -7.486 1.00 0.00 C ATOM 77 OE1 GLU A 7 -7.579 -2.589 -6.568 1.00 0.00 O ATOM 78 OE2 GLU A 7 -9.282 -3.667 -7.362 1.00 0.00 O ATOM 0 H GLU A 7 -9.456 -1.151 -11.139 1.00 0.00 H new ATOM 0 HA GLU A 7 -8.921 1.188 -9.481 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -7.510 -0.197 -8.134 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -9.225 -0.450 -7.877 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -8.954 -2.460 -9.500 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -7.236 -2.279 -9.205 1.00 0.00 H new ATOM 85 N LYS A 8 -6.942 1.320 -10.779 1.00 0.00 N ATOM 86 CA LYS A 8 -6.064 1.620 -11.835 1.00 0.00 C ATOM 87 C LYS A 8 -4.623 1.753 -11.382 1.00 0.00 C ATOM 88 O LYS A 8 -4.365 2.003 -10.199 1.00 0.00 O ATOM 89 CB LYS A 8 -6.546 2.879 -12.557 1.00 0.00 C ATOM 90 CG LYS A 8 -6.599 4.104 -11.659 1.00 0.00 C ATOM 91 CD LYS A 8 -7.335 5.263 -12.297 1.00 0.00 C ATOM 92 CE LYS A 8 -7.321 6.464 -11.371 1.00 0.00 C ATOM 93 NZ LYS A 8 -8.244 7.523 -11.808 1.00 0.00 N ATOM 0 H LYS A 8 -6.964 2.002 -10.020 1.00 0.00 H new ATOM 0 HA LYS A 8 -6.077 0.781 -12.530 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -5.884 3.083 -13.399 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -7.538 2.696 -12.969 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -7.087 3.841 -10.721 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -5.583 4.414 -11.414 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -6.868 5.521 -13.247 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -8.363 4.975 -12.515 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -7.590 6.145 -10.364 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -6.309 6.867 -11.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -8.021 8.407 -11.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -8.143 7.671 -12.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -9.222 7.241 -11.594 1.00 0.00 H new ATOM 107 N VAL A 9 -3.703 1.622 -12.327 1.00 0.00 N ATOM 108 CA VAL A 9 -2.303 1.746 -12.066 1.00 0.00 C ATOM 109 C VAL A 9 -1.943 3.194 -12.207 1.00 0.00 C ATOM 110 O VAL A 9 -2.174 3.806 -13.251 1.00 0.00 O ATOM 111 CB VAL A 9 -1.425 0.942 -13.074 1.00 0.00 C ATOM 112 CG1 VAL A 9 0.053 1.015 -12.694 1.00 0.00 C ATOM 113 CG2 VAL A 9 -1.868 -0.499 -13.187 1.00 0.00 C ATOM 0 H VAL A 9 -3.925 1.425 -13.303 1.00 0.00 H new ATOM 0 HA VAL A 9 -2.112 1.352 -11.068 1.00 0.00 H new ATOM 0 HB VAL A 9 -1.558 1.407 -14.051 1.00 0.00 H new ATOM 0 HG11 VAL A 9 0.642 0.446 -13.413 1.00 0.00 H new ATOM 0 HG12 VAL A 9 0.379 2.055 -12.700 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.194 0.596 -11.698 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -1.229 -1.021 -13.899 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -1.793 -0.980 -12.212 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -2.901 -0.536 -13.532 1.00 0.00 H new ATOM 123 N LEU A 10 -1.466 3.744 -11.161 1.00 0.00 N ATOM 124 CA LEU A 10 -0.974 5.115 -11.187 1.00 0.00 C ATOM 125 C LEU A 10 0.537 5.149 -11.303 1.00 0.00 C ATOM 126 O LEU A 10 1.090 5.806 -12.182 1.00 0.00 O ATOM 127 CB LEU A 10 -1.442 5.960 -9.975 1.00 0.00 C ATOM 128 CG LEU A 10 -2.925 6.372 -9.903 1.00 0.00 C ATOM 129 CD1 LEU A 10 -3.353 7.116 -11.156 1.00 0.00 C ATOM 130 CD2 LEU A 10 -3.830 5.190 -9.629 1.00 0.00 C ATOM 0 H LEU A 10 -1.393 3.284 -10.254 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.412 5.573 -12.074 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -1.208 5.401 -9.069 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -0.842 6.870 -9.952 1.00 0.00 H new ATOM 0 HG LEU A 10 -3.026 7.054 -9.059 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -4.404 7.393 -11.074 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -2.749 8.016 -11.269 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.214 6.474 -12.026 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -4.866 5.527 -9.587 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -3.720 4.455 -10.426 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -3.557 4.736 -8.677 1.00 0.00 H new ATOM 142 N TYR A 11 1.188 4.417 -10.451 1.00 0.00 N ATOM 143 CA TYR A 11 2.638 4.405 -10.390 1.00 0.00 C ATOM 144 C TYR A 11 3.180 3.011 -10.170 1.00 0.00 C ATOM 145 O TYR A 11 2.607 2.215 -9.408 1.00 0.00 O ATOM 146 CB TYR A 11 3.189 5.428 -9.348 1.00 0.00 C ATOM 147 CG TYR A 11 2.489 5.431 -7.990 1.00 0.00 C ATOM 148 CD1 TYR A 11 1.275 6.075 -7.842 1.00 0.00 C ATOM 149 CD2 TYR A 11 3.031 4.805 -6.871 1.00 0.00 C ATOM 150 CE1 TYR A 11 0.607 6.095 -6.650 1.00 0.00 C ATOM 151 CE2 TYR A 11 2.362 4.827 -5.650 1.00 0.00 C ATOM 152 CZ TYR A 11 1.140 5.477 -5.556 1.00 0.00 C ATOM 153 OH TYR A 11 0.428 5.485 -4.365 1.00 0.00 O ATOM 0 H TYR A 11 0.737 3.805 -9.771 1.00 0.00 H new ATOM 0 HA TYR A 11 3.001 4.731 -11.364 1.00 0.00 H new ATOM 0 HB2 TYR A 11 4.248 5.223 -9.190 1.00 0.00 H new ATOM 0 HB3 TYR A 11 3.118 6.428 -9.775 1.00 0.00 H new ATOM 0 HD1 TYR A 11 0.841 6.577 -8.694 1.00 0.00 H new ATOM 0 HD2 TYR A 11 3.981 4.297 -6.951 1.00 0.00 H new ATOM 0 HE1 TYR A 11 -0.344 6.601 -6.574 1.00 0.00 H new ATOM 0 HE2 TYR A 11 2.790 4.343 -4.785 1.00 0.00 H new ATOM 0 HH TYR A 11 0.935 5.005 -3.678 1.00 0.00 H new ATOM 163 N SER A 12 4.222 2.707 -10.905 1.00 0.00 N ATOM 164 CA SER A 12 4.904 1.474 -10.872 1.00 0.00 C ATOM 165 C SER A 12 6.421 1.713 -10.698 1.00 0.00 C ATOM 166 O SER A 12 7.008 2.549 -11.407 1.00 0.00 O ATOM 167 CB SER A 12 4.592 0.792 -12.177 1.00 0.00 C ATOM 168 OG SER A 12 4.677 1.699 -13.278 1.00 0.00 O ATOM 0 H SER A 12 4.625 3.363 -11.574 1.00 0.00 H new ATOM 0 HA SER A 12 4.591 0.852 -10.033 1.00 0.00 H new ATOM 0 HB2 SER A 12 5.286 -0.034 -12.331 1.00 0.00 H new ATOM 0 HB3 SER A 12 3.591 0.364 -12.134 1.00 0.00 H new ATOM 0 HG SER A 12 5.424 2.317 -13.136 1.00 0.00 H new ATOM 174 N GLN A 13 7.039 1.044 -9.720 1.00 0.00 N ATOM 175 CA GLN A 13 8.467 1.256 -9.444 1.00 0.00 C ATOM 176 C GLN A 13 9.201 0.034 -8.877 1.00 0.00 C ATOM 177 O GLN A 13 8.601 -0.823 -8.288 1.00 0.00 O ATOM 178 CB GLN A 13 8.679 2.593 -8.698 1.00 0.00 C ATOM 179 CG GLN A 13 10.077 2.910 -8.219 1.00 0.00 C ATOM 180 CD GLN A 13 10.213 4.355 -7.815 1.00 0.00 C ATOM 181 OE1 GLN A 13 9.253 4.995 -7.411 1.00 0.00 O ATOM 182 NE2 GLN A 13 11.392 4.876 -7.902 1.00 0.00 N ATOM 0 H GLN A 13 6.584 0.361 -9.114 1.00 0.00 H new ATOM 0 HA GLN A 13 8.979 1.365 -10.400 1.00 0.00 H new ATOM 0 HB2 GLN A 13 8.358 3.400 -9.356 1.00 0.00 H new ATOM 0 HB3 GLN A 13 8.016 2.604 -7.833 1.00 0.00 H new ATOM 0 HG2 GLN A 13 10.325 2.270 -7.372 1.00 0.00 H new ATOM 0 HG3 GLN A 13 10.793 2.684 -9.010 1.00 0.00 H new ATOM 0 HE21 GLN A 13 12.173 4.316 -8.243 1.00 0.00 H new ATOM 0 HE22 GLN A 13 11.542 5.847 -7.630 1.00 0.00 H new ATOM 191 N ARG A 14 10.517 -0.001 -9.051 1.00 0.00 N ATOM 192 CA ARG A 14 11.334 -1.131 -8.681 1.00 0.00 C ATOM 193 C ARG A 14 11.540 -1.125 -7.181 1.00 0.00 C ATOM 194 O ARG A 14 12.073 -0.161 -6.609 1.00 0.00 O ATOM 195 CB ARG A 14 12.689 -1.016 -9.387 1.00 0.00 C ATOM 196 CG ARG A 14 13.568 -2.266 -9.370 1.00 0.00 C ATOM 197 CD ARG A 14 12.909 -3.417 -10.121 1.00 0.00 C ATOM 198 NE ARG A 14 12.348 -2.968 -11.410 1.00 0.00 N ATOM 199 CZ ARG A 14 12.575 -3.506 -12.605 1.00 0.00 C ATOM 200 NH1 ARG A 14 13.467 -4.473 -12.761 1.00 0.00 N ATOM 201 NH2 ARG A 14 11.918 -3.038 -13.654 1.00 0.00 N ATOM 0 H ARG A 14 11.046 0.770 -9.459 1.00 0.00 H new ATOM 0 HA ARG A 14 10.845 -2.060 -8.975 1.00 0.00 H new ATOM 0 HB2 ARG A 14 12.511 -0.736 -10.425 1.00 0.00 H new ATOM 0 HB3 ARG A 14 13.246 -0.199 -8.928 1.00 0.00 H new ATOM 0 HG2 ARG A 14 14.534 -2.040 -9.822 1.00 0.00 H new ATOM 0 HG3 ARG A 14 13.760 -2.564 -8.339 1.00 0.00 H new ATOM 0 HD2 ARG A 14 13.641 -4.206 -10.296 1.00 0.00 H new ATOM 0 HD3 ARG A 14 12.117 -3.847 -9.508 1.00 0.00 H new ATOM 0 HE ARG A 14 11.722 -2.163 -11.382 1.00 0.00 H new ATOM 0 HH11 ARG A 14 13.993 -4.817 -11.957 1.00 0.00 H new ATOM 0 HH12 ARG A 14 13.628 -4.874 -13.685 1.00 0.00 H new ATOM 0 HH21 ARG A 14 11.250 -2.276 -13.539 1.00 0.00 H new ATOM 0 HH22 ARG A 14 12.080 -3.439 -14.578 1.00 0.00 H new ATOM 215 N VAL A 15 11.116 -2.187 -6.579 1.00 0.00 N ATOM 216 CA VAL A 15 11.141 -2.361 -5.157 1.00 0.00 C ATOM 217 C VAL A 15 11.598 -3.792 -4.855 1.00 0.00 C ATOM 218 O VAL A 15 11.674 -4.632 -5.769 1.00 0.00 O ATOM 219 CB VAL A 15 9.686 -2.182 -4.589 1.00 0.00 C ATOM 220 CG1 VAL A 15 8.805 -3.400 -4.895 1.00 0.00 C ATOM 221 CG2 VAL A 15 9.682 -1.852 -3.107 1.00 0.00 C ATOM 0 H VAL A 15 10.728 -2.988 -7.078 1.00 0.00 H new ATOM 0 HA VAL A 15 11.813 -1.632 -4.704 1.00 0.00 H new ATOM 0 HB VAL A 15 9.253 -1.325 -5.105 1.00 0.00 H new ATOM 0 HG11 VAL A 15 7.807 -3.239 -4.487 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.738 -3.538 -5.974 1.00 0.00 H new ATOM 0 HG13 VAL A 15 9.243 -4.289 -4.442 1.00 0.00 H new ATOM 0 HG21 VAL A 15 8.654 -1.738 -2.762 1.00 0.00 H new ATOM 0 HG22 VAL A 15 10.163 -2.658 -2.553 1.00 0.00 H new ATOM 0 HG23 VAL A 15 10.226 -0.922 -2.940 1.00 0.00 H new ATOM 231 N LYS A 16 11.887 -4.062 -3.611 1.00 0.00 N ATOM 232 CA LYS A 16 12.126 -5.399 -3.162 1.00 0.00 C ATOM 233 C LYS A 16 10.987 -5.798 -2.291 1.00 0.00 C ATOM 234 O LYS A 16 10.511 -4.982 -1.503 1.00 0.00 O ATOM 235 CB LYS A 16 13.411 -5.538 -2.351 1.00 0.00 C ATOM 236 CG LYS A 16 14.672 -5.601 -3.155 1.00 0.00 C ATOM 237 CD LYS A 16 15.839 -6.022 -2.290 1.00 0.00 C ATOM 238 CE LYS A 16 17.058 -6.308 -3.132 1.00 0.00 C ATOM 239 NZ LYS A 16 18.165 -6.857 -2.328 1.00 0.00 N ATOM 0 H LYS A 16 11.963 -3.355 -2.880 1.00 0.00 H new ATOM 0 HA LYS A 16 12.225 -6.031 -4.044 1.00 0.00 H new ATOM 0 HB2 LYS A 16 13.480 -4.695 -1.663 1.00 0.00 H new ATOM 0 HB3 LYS A 16 13.342 -6.440 -1.743 1.00 0.00 H new ATOM 0 HG2 LYS A 16 14.550 -6.306 -3.977 1.00 0.00 H new ATOM 0 HG3 LYS A 16 14.875 -4.626 -3.599 1.00 0.00 H new ATOM 0 HD2 LYS A 16 16.066 -5.235 -1.570 1.00 0.00 H new ATOM 0 HD3 LYS A 16 15.571 -6.910 -1.718 1.00 0.00 H new ATOM 0 HE2 LYS A 16 16.797 -7.014 -3.920 1.00 0.00 H new ATOM 0 HE3 LYS A 16 17.385 -5.390 -3.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 18.783 -7.433 -2.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 18.715 -6.077 -1.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 17.779 -7.450 -1.565 1.00 0.00 H new ATOM 253 N LEU A 17 10.544 -7.021 -2.403 1.00 0.00 N ATOM 254 CA LEU A 17 9.518 -7.479 -1.543 1.00 0.00 C ATOM 255 C LEU A 17 10.186 -8.355 -0.545 1.00 0.00 C ATOM 256 O LEU A 17 11.213 -8.930 -0.841 1.00 0.00 O ATOM 257 CB LEU A 17 8.441 -8.253 -2.305 1.00 0.00 C ATOM 258 CG LEU A 17 7.340 -8.868 -1.455 1.00 0.00 C ATOM 259 CD1 LEU A 17 6.485 -7.788 -0.798 1.00 0.00 C ATOM 260 CD2 LEU A 17 6.502 -9.804 -2.280 1.00 0.00 C ATOM 0 H LEU A 17 10.882 -7.705 -3.080 1.00 0.00 H new ATOM 0 HA LEU A 17 9.007 -6.640 -1.071 1.00 0.00 H new ATOM 0 HB2 LEU A 17 7.982 -7.581 -3.030 1.00 0.00 H new ATOM 0 HB3 LEU A 17 8.925 -9.049 -2.871 1.00 0.00 H new ATOM 0 HG LEU A 17 7.805 -9.445 -0.656 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.706 -8.256 -0.197 1.00 0.00 H new ATOM 0 HD12 LEU A 17 7.112 -7.166 -0.159 1.00 0.00 H new ATOM 0 HD13 LEU A 17 6.025 -7.169 -1.569 1.00 0.00 H new ATOM 0 HD21 LEU A 17 5.719 -10.236 -1.657 1.00 0.00 H new ATOM 0 HD22 LEU A 17 6.048 -9.255 -3.105 1.00 0.00 H new ATOM 0 HD23 LEU A 17 7.131 -10.601 -2.677 1.00 0.00 H new ATOM 272 N PHE A 18 9.665 -8.396 0.613 1.00 0.00 N ATOM 273 CA PHE A 18 10.192 -9.166 1.710 1.00 0.00 C ATOM 274 C PHE A 18 9.065 -9.864 2.422 1.00 0.00 C ATOM 275 O PHE A 18 8.041 -9.265 2.667 1.00 0.00 O ATOM 276 CB PHE A 18 10.877 -8.242 2.727 1.00 0.00 C ATOM 277 CG PHE A 18 12.219 -7.661 2.350 1.00 0.00 C ATOM 278 CD1 PHE A 18 12.336 -6.703 1.365 1.00 0.00 C ATOM 279 CD2 PHE A 18 13.362 -8.065 3.013 1.00 0.00 C ATOM 280 CE1 PHE A 18 13.562 -6.169 1.044 1.00 0.00 C ATOM 281 CE2 PHE A 18 14.593 -7.532 2.695 1.00 0.00 C ATOM 282 CZ PHE A 18 14.693 -6.583 1.708 1.00 0.00 C ATOM 0 H PHE A 18 8.821 -7.878 0.855 1.00 0.00 H new ATOM 0 HA PHE A 18 10.907 -9.885 1.310 1.00 0.00 H new ATOM 0 HB2 PHE A 18 10.200 -7.414 2.938 1.00 0.00 H new ATOM 0 HB3 PHE A 18 11.001 -8.798 3.656 1.00 0.00 H new ATOM 0 HD1 PHE A 18 11.454 -6.368 0.839 1.00 0.00 H new ATOM 0 HD2 PHE A 18 13.290 -8.810 3.792 1.00 0.00 H new ATOM 0 HE1 PHE A 18 13.637 -5.422 0.268 1.00 0.00 H new ATOM 0 HE2 PHE A 18 15.477 -7.860 3.221 1.00 0.00 H new ATOM 0 HZ PHE A 18 15.655 -6.164 1.454 1.00 0.00 H new ATOM 292 N ARG A 19 9.242 -11.112 2.746 1.00 0.00 N ATOM 293 CA ARG A 19 8.284 -11.808 3.541 1.00 0.00 C ATOM 294 C ARG A 19 8.902 -12.208 4.798 1.00 0.00 C ATOM 295 O ARG A 19 10.098 -12.470 4.896 1.00 0.00 O ATOM 296 CB ARG A 19 7.647 -13.015 2.884 1.00 0.00 C ATOM 297 CG ARG A 19 6.540 -13.720 3.688 1.00 0.00 C ATOM 298 CD ARG A 19 6.055 -15.001 3.028 1.00 0.00 C ATOM 299 NE ARG A 19 5.027 -15.663 3.851 1.00 0.00 N ATOM 300 CZ ARG A 19 4.366 -16.788 3.541 1.00 0.00 C ATOM 301 NH1 ARG A 19 4.654 -17.475 2.436 1.00 0.00 N ATOM 302 NH2 ARG A 19 3.432 -17.228 4.366 1.00 0.00 N ATOM 0 H ARG A 19 10.050 -11.669 2.467 1.00 0.00 H new ATOM 0 HA ARG A 19 7.468 -11.103 3.696 1.00 0.00 H new ATOM 0 HB2 ARG A 19 7.230 -12.704 1.926 1.00 0.00 H new ATOM 0 HB3 ARG A 19 8.430 -13.742 2.669 1.00 0.00 H new ATOM 0 HG2 ARG A 19 6.913 -13.950 4.686 1.00 0.00 H new ATOM 0 HG3 ARG A 19 5.698 -13.039 3.811 1.00 0.00 H new ATOM 0 HD2 ARG A 19 5.647 -14.775 2.043 1.00 0.00 H new ATOM 0 HD3 ARG A 19 6.896 -15.678 2.877 1.00 0.00 H new ATOM 0 HE ARG A 19 4.796 -15.223 4.742 1.00 0.00 H new ATOM 0 HH11 ARG A 19 5.389 -17.147 1.809 1.00 0.00 H new ATOM 0 HH12 ARG A 19 4.140 -18.328 2.218 1.00 0.00 H new ATOM 0 HH21 ARG A 19 3.224 -16.714 5.222 1.00 0.00 H new ATOM 0 HH22 ARG A 19 2.919 -18.082 4.147 1.00 0.00 H new ATOM 316 N PHE A 20 8.090 -12.215 5.709 1.00 0.00 N ATOM 317 CA PHE A 20 8.380 -12.560 7.039 1.00 0.00 C ATOM 318 C PHE A 20 8.496 -14.033 7.065 1.00 0.00 C ATOM 319 O PHE A 20 7.568 -14.757 6.701 1.00 0.00 O ATOM 320 CB PHE A 20 7.264 -12.179 7.993 1.00 0.00 C ATOM 321 CG PHE A 20 7.625 -12.350 9.450 1.00 0.00 C ATOM 322 CD1 PHE A 20 8.429 -11.427 10.086 1.00 0.00 C ATOM 323 CD2 PHE A 20 7.173 -13.447 10.171 1.00 0.00 C ATOM 324 CE1 PHE A 20 8.778 -11.582 11.411 1.00 0.00 C ATOM 325 CE2 PHE A 20 7.523 -13.611 11.496 1.00 0.00 C ATOM 326 CZ PHE A 20 8.326 -12.675 12.116 1.00 0.00 C ATOM 0 H PHE A 20 7.111 -11.964 5.569 1.00 0.00 H new ATOM 0 HA PHE A 20 9.283 -12.037 7.353 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.986 -11.140 7.816 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.386 -12.786 7.772 1.00 0.00 H new ATOM 0 HD1 PHE A 20 8.791 -10.570 9.538 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.541 -14.179 9.690 1.00 0.00 H new ATOM 0 HE1 PHE A 20 9.405 -10.847 11.895 1.00 0.00 H new ATOM 0 HE2 PHE A 20 7.169 -14.470 12.047 1.00 0.00 H new ATOM 0 HZ PHE A 20 8.600 -12.800 13.153 1.00 0.00 H new ATOM 336 N ASP A 21 9.597 -14.450 7.421 1.00 0.00 N ATOM 337 CA ASP A 21 9.850 -15.830 7.606 1.00 0.00 C ATOM 338 C ASP A 21 9.504 -16.115 8.967 1.00 0.00 C ATOM 339 O ASP A 21 9.984 -15.501 9.845 1.00 0.00 O ATOM 340 CB ASP A 21 11.287 -16.267 7.403 1.00 0.00 C ATOM 341 CG ASP A 21 11.288 -17.649 6.802 1.00 0.00 C ATOM 342 OD1 ASP A 21 11.140 -18.618 7.543 1.00 0.00 O ATOM 343 OD2 ASP A 21 11.438 -17.776 5.585 1.00 0.00 O ATOM 0 H ASP A 21 10.399 -13.848 7.607 1.00 0.00 H new ATOM 0 HA ASP A 21 9.271 -16.366 6.854 1.00 0.00 H new ATOM 0 HB2 ASP A 21 11.806 -15.568 6.747 1.00 0.00 H new ATOM 0 HB3 ASP A 21 11.820 -16.267 8.354 1.00 0.00 H new ATOM 348 N ALA A 22 8.626 -16.936 9.107 1.00 0.00 N ATOM 349 CA ALA A 22 8.147 -17.382 10.386 1.00 0.00 C ATOM 350 C ALA A 22 9.211 -18.202 11.056 1.00 0.00 C ATOM 351 O ALA A 22 9.437 -18.090 12.252 1.00 0.00 O ATOM 352 CB ALA A 22 6.877 -18.176 10.235 1.00 0.00 C ATOM 0 H ALA A 22 8.153 -17.380 8.320 1.00 0.00 H new ATOM 0 HA ALA A 22 7.921 -16.514 11.005 1.00 0.00 H new ATOM 0 HB1 ALA A 22 6.533 -18.503 11.216 1.00 0.00 H new ATOM 0 HB2 ALA A 22 6.112 -17.554 9.771 1.00 0.00 H new ATOM 0 HB3 ALA A 22 7.065 -19.047 9.608 1.00 0.00 H new ATOM 358 N GLU A 23 9.910 -18.970 10.249 1.00 0.00 N ATOM 359 CA GLU A 23 10.935 -19.831 10.727 1.00 0.00 C ATOM 360 C GLU A 23 12.205 -19.049 10.977 1.00 0.00 C ATOM 361 O GLU A 23 12.999 -19.398 11.847 1.00 0.00 O ATOM 362 CB GLU A 23 11.187 -20.960 9.747 1.00 0.00 C ATOM 363 CG GLU A 23 9.948 -21.782 9.442 1.00 0.00 C ATOM 364 CD GLU A 23 9.205 -22.230 10.676 1.00 0.00 C ATOM 365 OE1 GLU A 23 9.788 -22.970 11.503 1.00 0.00 O ATOM 366 OE2 GLU A 23 8.012 -21.865 10.836 1.00 0.00 O ATOM 0 H GLU A 23 9.772 -19.005 9.239 1.00 0.00 H new ATOM 0 HA GLU A 23 10.606 -20.267 11.670 1.00 0.00 H new ATOM 0 HB2 GLU A 23 11.576 -20.544 8.817 1.00 0.00 H new ATOM 0 HB3 GLU A 23 11.959 -21.616 10.150 1.00 0.00 H new ATOM 0 HG2 GLU A 23 9.276 -21.194 8.816 1.00 0.00 H new ATOM 0 HG3 GLU A 23 10.237 -22.659 8.863 1.00 0.00 H new ATOM 373 N VAL A 24 12.404 -17.958 10.227 1.00 0.00 N ATOM 374 CA VAL A 24 13.612 -17.163 10.467 1.00 0.00 C ATOM 375 C VAL A 24 13.291 -16.013 11.351 1.00 0.00 C ATOM 376 O VAL A 24 14.177 -15.355 11.929 1.00 0.00 O ATOM 377 CB VAL A 24 14.280 -16.596 9.185 1.00 0.00 C ATOM 378 CG1 VAL A 24 15.719 -16.142 9.433 1.00 0.00 C ATOM 379 CG2 VAL A 24 14.229 -17.586 8.113 1.00 0.00 C ATOM 0 H VAL A 24 11.784 -17.620 9.491 1.00 0.00 H new ATOM 0 HA VAL A 24 14.319 -17.855 10.924 1.00 0.00 H new ATOM 0 HB VAL A 24 13.717 -15.713 8.885 1.00 0.00 H new ATOM 0 HG11 VAL A 24 16.143 -15.754 8.507 1.00 0.00 H new ATOM 0 HG12 VAL A 24 15.728 -15.360 10.192 1.00 0.00 H new ATOM 0 HG13 VAL A 24 16.313 -16.988 9.777 1.00 0.00 H new ATOM 0 HG21 VAL A 24 14.700 -17.178 7.219 1.00 0.00 H new ATOM 0 HG22 VAL A 24 14.759 -18.486 8.424 1.00 0.00 H new ATOM 0 HG23 VAL A 24 13.190 -17.833 7.895 1.00 0.00 H new ATOM 389 N SER A 25 12.009 -15.845 11.541 1.00 0.00 N ATOM 390 CA SER A 25 11.443 -14.656 12.099 1.00 0.00 C ATOM 391 C SER A 25 11.962 -13.485 11.366 1.00 0.00 C ATOM 392 O SER A 25 12.145 -12.409 11.945 1.00 0.00 O ATOM 393 CB SER A 25 11.742 -14.581 13.530 1.00 0.00 C ATOM 394 OG SER A 25 10.878 -15.397 14.303 1.00 0.00 O ATOM 0 H SER A 25 11.315 -16.554 11.304 1.00 0.00 H new ATOM 0 HA SER A 25 10.358 -14.671 11.996 1.00 0.00 H new ATOM 0 HB2 SER A 25 12.775 -14.886 13.700 1.00 0.00 H new ATOM 0 HB3 SER A 25 11.656 -13.547 13.863 1.00 0.00 H new ATOM 0 HG SER A 25 11.114 -15.318 15.251 1.00 0.00 H new ATOM 400 N GLN A 26 12.158 -13.623 10.065 1.00 0.00 N ATOM 401 CA GLN A 26 12.803 -12.495 9.482 1.00 0.00 C ATOM 402 C GLN A 26 12.124 -12.011 8.227 1.00 0.00 C ATOM 403 O GLN A 26 11.615 -12.801 7.476 1.00 0.00 O ATOM 404 CB GLN A 26 14.299 -12.767 9.208 1.00 0.00 C ATOM 405 CG GLN A 26 15.054 -11.582 8.597 1.00 0.00 C ATOM 406 CD GLN A 26 16.420 -11.937 8.043 1.00 0.00 C ATOM 407 OE1 GLN A 26 17.099 -12.837 8.526 1.00 0.00 O ATOM 408 NE2 GLN A 26 16.820 -11.244 7.008 1.00 0.00 N ATOM 0 H GLN A 26 11.910 -14.409 9.465 1.00 0.00 H new ATOM 0 HA GLN A 26 12.723 -11.699 10.222 1.00 0.00 H new ATOM 0 HB2 GLN A 26 14.783 -13.047 10.144 1.00 0.00 H new ATOM 0 HB3 GLN A 26 14.384 -13.622 8.537 1.00 0.00 H new ATOM 0 HG2 GLN A 26 14.450 -11.153 7.797 1.00 0.00 H new ATOM 0 HG3 GLN A 26 15.172 -10.809 9.357 1.00 0.00 H new ATOM 0 HE21 GLN A 26 16.230 -10.502 6.632 1.00 0.00 H new ATOM 0 HE22 GLN A 26 17.722 -11.446 6.577 1.00 0.00 H new ATOM 417 N TRP A 27 12.151 -10.715 7.995 1.00 0.00 N ATOM 418 CA TRP A 27 11.720 -10.157 6.823 1.00 0.00 C ATOM 419 C TRP A 27 12.825 -10.374 5.788 1.00 0.00 C ATOM 420 O TRP A 27 13.843 -9.671 5.768 1.00 0.00 O ATOM 421 CB TRP A 27 11.470 -8.696 7.092 1.00 0.00 C ATOM 422 CG TRP A 27 10.374 -8.446 8.094 1.00 0.00 C ATOM 423 CD1 TRP A 27 9.034 -8.386 7.845 1.00 0.00 C ATOM 424 CD2 TRP A 27 10.528 -8.223 9.506 1.00 0.00 C ATOM 425 NE1 TRP A 27 8.349 -8.146 9.011 1.00 0.00 N ATOM 426 CE2 TRP A 27 9.242 -8.038 10.041 1.00 0.00 C ATOM 427 CE3 TRP A 27 11.632 -8.163 10.366 1.00 0.00 C ATOM 428 CZ2 TRP A 27 9.025 -7.798 11.396 1.00 0.00 C ATOM 429 CZ3 TRP A 27 11.415 -7.925 11.708 1.00 0.00 C ATOM 430 CH2 TRP A 27 10.120 -7.745 12.210 1.00 0.00 C ATOM 0 H TRP A 27 12.495 -10.034 8.672 1.00 0.00 H new ATOM 0 HA TRP A 27 10.799 -10.601 6.444 1.00 0.00 H new ATOM 0 HB2 TRP A 27 12.391 -8.239 7.452 1.00 0.00 H new ATOM 0 HB3 TRP A 27 11.214 -8.201 6.155 1.00 0.00 H new ATOM 0 HD1 TRP A 27 8.579 -8.509 6.873 1.00 0.00 H new ATOM 0 HE1 TRP A 27 7.336 -8.062 9.095 1.00 0.00 H new ATOM 0 HE3 TRP A 27 12.634 -8.300 9.986 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 8.028 -7.659 11.788 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 12.257 -7.877 12.382 1.00 0.00 H new ATOM 0 HH2 TRP A 27 9.984 -7.560 13.265 1.00 0.00 H new ATOM 441 N LYS A 28 12.653 -11.414 5.031 1.00 0.00 N ATOM 442 CA LYS A 28 13.597 -11.870 4.043 1.00 0.00 C ATOM 443 C LYS A 28 13.030 -11.628 2.699 1.00 0.00 C ATOM 444 O LYS A 28 11.835 -11.892 2.463 1.00 0.00 O ATOM 445 CB LYS A 28 13.889 -13.355 4.294 1.00 0.00 C ATOM 446 CG LYS A 28 14.736 -14.073 3.244 1.00 0.00 C ATOM 447 CD LYS A 28 14.926 -15.557 3.602 1.00 0.00 C ATOM 448 CE LYS A 28 13.582 -16.266 3.819 1.00 0.00 C ATOM 449 NZ LYS A 28 13.718 -17.710 4.109 1.00 0.00 N ATOM 0 H LYS A 28 11.817 -11.996 5.083 1.00 0.00 H new ATOM 0 HA LYS A 28 14.540 -11.328 4.109 1.00 0.00 H new ATOM 0 HB2 LYS A 28 14.392 -13.445 5.257 1.00 0.00 H new ATOM 0 HB3 LYS A 28 12.937 -13.879 4.381 1.00 0.00 H new ATOM 0 HG2 LYS A 28 14.257 -13.990 2.268 1.00 0.00 H new ATOM 0 HG3 LYS A 28 15.709 -13.588 3.164 1.00 0.00 H new ATOM 0 HD2 LYS A 28 15.476 -16.056 2.804 1.00 0.00 H new ATOM 0 HD3 LYS A 28 15.530 -15.639 4.505 1.00 0.00 H new ATOM 0 HE2 LYS A 28 13.056 -15.786 4.644 1.00 0.00 H new ATOM 0 HE3 LYS A 28 12.965 -16.138 2.930 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 12.940 -18.014 4.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 13.682 -18.248 3.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 14.627 -17.885 4.583 1.00 0.00 H new ATOM 463 N GLU A 29 13.862 -11.113 1.821 1.00 0.00 N ATOM 464 CA GLU A 29 13.463 -10.723 0.575 1.00 0.00 C ATOM 465 C GLU A 29 12.823 -11.820 -0.205 1.00 0.00 C ATOM 466 O GLU A 29 13.169 -13.010 -0.122 1.00 0.00 O ATOM 467 CB GLU A 29 14.535 -9.985 -0.238 1.00 0.00 C ATOM 468 CG GLU A 29 15.807 -10.761 -0.495 1.00 0.00 C ATOM 469 CD GLU A 29 16.719 -10.034 -1.451 1.00 0.00 C ATOM 470 OE1 GLU A 29 17.374 -9.049 -1.045 1.00 0.00 O ATOM 471 OE2 GLU A 29 16.814 -10.453 -2.628 1.00 0.00 O ATOM 0 H GLU A 29 14.855 -10.968 2.003 1.00 0.00 H new ATOM 0 HA GLU A 29 12.690 -9.979 0.768 1.00 0.00 H new ATOM 0 HB2 GLU A 29 14.105 -9.698 -1.198 1.00 0.00 H new ATOM 0 HB3 GLU A 29 14.792 -9.063 0.284 1.00 0.00 H new ATOM 0 HG2 GLU A 29 16.327 -10.930 0.448 1.00 0.00 H new ATOM 0 HG3 GLU A 29 15.560 -11.741 -0.902 1.00 0.00 H new ATOM 478 N ARG A 30 11.850 -11.420 -0.870 1.00 0.00 N ATOM 479 CA ARG A 30 11.123 -12.259 -1.743 1.00 0.00 C ATOM 480 C ARG A 30 11.659 -12.064 -3.113 1.00 0.00 C ATOM 481 O ARG A 30 11.606 -12.949 -3.939 1.00 0.00 O ATOM 482 CB ARG A 30 9.620 -11.982 -1.716 1.00 0.00 C ATOM 483 CG ARG A 30 8.900 -12.395 -0.431 1.00 0.00 C ATOM 484 CD ARG A 30 9.024 -13.902 -0.131 1.00 0.00 C ATOM 485 NE ARG A 30 10.393 -14.297 0.265 1.00 0.00 N ATOM 486 CZ ARG A 30 10.785 -15.533 0.578 1.00 0.00 C ATOM 487 NH1 ARG A 30 9.897 -16.504 0.729 1.00 0.00 N ATOM 488 NH2 ARG A 30 12.077 -15.783 0.753 1.00 0.00 N ATOM 0 H ARG A 30 11.504 -10.461 -0.836 1.00 0.00 H new ATOM 0 HA ARG A 30 11.245 -13.292 -1.416 1.00 0.00 H new ATOM 0 HB2 ARG A 30 9.461 -10.915 -1.875 1.00 0.00 H new ATOM 0 HB3 ARG A 30 9.157 -12.501 -2.555 1.00 0.00 H new ATOM 0 HG2 ARG A 30 9.308 -11.828 0.406 1.00 0.00 H new ATOM 0 HG3 ARG A 30 7.845 -12.131 -0.511 1.00 0.00 H new ATOM 0 HD2 ARG A 30 8.329 -14.167 0.666 1.00 0.00 H new ATOM 0 HD3 ARG A 30 8.728 -14.469 -1.014 1.00 0.00 H new ATOM 0 HE ARG A 30 11.098 -13.561 0.302 1.00 0.00 H new ATOM 0 HH11 ARG A 30 8.903 -16.310 0.606 1.00 0.00 H new ATOM 0 HH12 ARG A 30 10.207 -17.446 0.968 1.00 0.00 H new ATOM 0 HH21 ARG A 30 12.760 -15.033 0.648 1.00 0.00 H new ATOM 0 HH22 ARG A 30 12.386 -16.725 0.993 1.00 0.00 H new ATOM 502 N GLY A 31 12.190 -10.890 -3.338 1.00 0.00 N ATOM 503 CA GLY A 31 12.770 -10.575 -4.577 1.00 0.00 C ATOM 504 C GLY A 31 12.631 -9.171 -4.886 1.00 0.00 C ATOM 505 O GLY A 31 12.554 -8.331 -3.996 1.00 0.00 O ATOM 0 H GLY A 31 12.222 -10.136 -2.651 1.00 0.00 H new ATOM 0 HA2 GLY A 31 13.827 -10.843 -4.564 1.00 0.00 H new ATOM 0 HA3 GLY A 31 12.301 -11.169 -5.361 1.00 0.00 H new ATOM 509 N LEU A 32 12.486 -8.940 -6.106 1.00 0.00 N ATOM 510 CA LEU A 32 12.628 -7.678 -6.689 1.00 0.00 C ATOM 511 C LEU A 32 11.606 -7.567 -7.785 1.00 0.00 C ATOM 512 O LEU A 32 11.272 -8.582 -8.432 1.00 0.00 O ATOM 513 CB LEU A 32 14.019 -7.679 -7.293 1.00 0.00 C ATOM 514 CG LEU A 32 14.624 -6.380 -7.732 1.00 0.00 C ATOM 515 CD1 LEU A 32 14.795 -5.491 -6.538 1.00 0.00 C ATOM 516 CD2 LEU A 32 15.961 -6.668 -8.351 1.00 0.00 C ATOM 0 H LEU A 32 12.249 -9.669 -6.779 1.00 0.00 H new ATOM 0 HA LEU A 32 12.494 -6.856 -5.986 1.00 0.00 H new ATOM 0 HB2 LEU A 32 14.694 -8.126 -6.563 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.001 -8.342 -8.158 1.00 0.00 H new ATOM 0 HG LEU A 32 13.981 -5.882 -8.457 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.235 -4.544 -6.850 1.00 0.00 H new ATOM 0 HD12 LEU A 32 13.823 -5.307 -6.080 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.451 -5.975 -5.815 1.00 0.00 H new ATOM 0 HD21 LEU A 32 16.419 -5.735 -8.678 1.00 0.00 H new ATOM 0 HD22 LEU A 32 16.606 -7.151 -7.617 1.00 0.00 H new ATOM 0 HD23 LEU A 32 15.830 -7.328 -9.209 1.00 0.00 H new ATOM 528 N GLY A 33 11.092 -6.403 -7.989 1.00 0.00 N ATOM 529 CA GLY A 33 10.164 -6.225 -9.037 1.00 0.00 C ATOM 530 C GLY A 33 9.605 -4.850 -9.062 1.00 0.00 C ATOM 531 O GLY A 33 10.118 -3.952 -8.413 1.00 0.00 O ATOM 0 H GLY A 33 11.301 -5.567 -7.443 1.00 0.00 H new ATOM 0 HA2 GLY A 33 10.650 -6.436 -9.990 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.352 -6.944 -8.927 1.00 0.00 H new ATOM 535 N ASN A 34 8.568 -4.707 -9.787 1.00 0.00 N ATOM 536 CA ASN A 34 7.877 -3.482 -9.977 1.00 0.00 C ATOM 537 C ASN A 34 6.691 -3.487 -9.147 1.00 0.00 C ATOM 538 O ASN A 34 5.839 -4.372 -9.222 1.00 0.00 O ATOM 539 CB ASN A 34 7.499 -3.332 -11.409 1.00 0.00 C ATOM 540 CG ASN A 34 6.753 -2.065 -11.694 1.00 0.00 C ATOM 541 OD1 ASN A 34 7.357 -1.030 -11.962 1.00 0.00 O ATOM 542 ND2 ASN A 34 5.443 -2.149 -11.674 1.00 0.00 N ATOM 0 H ASN A 34 8.148 -5.484 -10.297 1.00 0.00 H new ATOM 0 HA ASN A 34 8.518 -2.645 -9.699 1.00 0.00 H new ATOM 0 HB2 ASN A 34 8.401 -3.360 -12.021 1.00 0.00 H new ATOM 0 HB3 ASN A 34 6.885 -4.182 -11.707 1.00 0.00 H new ATOM 0 HD21 ASN A 34 4.876 -1.329 -11.888 1.00 0.00 H new ATOM 0 HD22 ASN A 34 4.992 -3.035 -11.445 1.00 0.00 H new ATOM 549 N LEU A 35 6.665 -2.547 -8.337 1.00 0.00 N ATOM 550 CA LEU A 35 5.608 -2.319 -7.492 1.00 0.00 C ATOM 551 C LEU A 35 4.639 -1.464 -8.205 1.00 0.00 C ATOM 552 O LEU A 35 4.978 -0.372 -8.620 1.00 0.00 O ATOM 553 CB LEU A 35 6.100 -1.680 -6.165 1.00 0.00 C ATOM 554 CG LEU A 35 5.088 -1.282 -5.045 1.00 0.00 C ATOM 555 CD1 LEU A 35 5.859 -0.942 -3.781 1.00 0.00 C ATOM 556 CD2 LEU A 35 4.255 -0.056 -5.425 1.00 0.00 C ATOM 0 H LEU A 35 7.424 -1.873 -8.237 1.00 0.00 H new ATOM 0 HA LEU A 35 5.120 -3.254 -7.215 1.00 0.00 H new ATOM 0 HB2 LEU A 35 6.813 -2.375 -5.720 1.00 0.00 H new ATOM 0 HB3 LEU A 35 6.655 -0.780 -6.430 1.00 0.00 H new ATOM 0 HG LEU A 35 4.416 -2.128 -4.898 1.00 0.00 H new ATOM 0 HD11 LEU A 35 5.160 -0.663 -2.993 1.00 0.00 H new ATOM 0 HD12 LEU A 35 6.437 -1.810 -3.463 1.00 0.00 H new ATOM 0 HD13 LEU A 35 6.534 -0.109 -3.979 1.00 0.00 H new ATOM 0 HD21 LEU A 35 3.566 0.181 -4.614 1.00 0.00 H new ATOM 0 HD22 LEU A 35 4.916 0.793 -5.600 1.00 0.00 H new ATOM 0 HD23 LEU A 35 3.689 -0.268 -6.332 1.00 0.00 H new ATOM 568 N LYS A 36 3.468 -1.944 -8.376 1.00 0.00 N ATOM 569 CA LYS A 36 2.478 -1.161 -8.934 1.00 0.00 C ATOM 570 C LYS A 36 1.346 -0.994 -7.961 1.00 0.00 C ATOM 571 O LYS A 36 1.065 -1.875 -7.146 1.00 0.00 O ATOM 572 CB LYS A 36 2.036 -1.669 -10.304 1.00 0.00 C ATOM 573 CG LYS A 36 1.543 -3.098 -10.332 1.00 0.00 C ATOM 574 CD LYS A 36 1.179 -3.517 -11.747 1.00 0.00 C ATOM 575 CE LYS A 36 0.850 -4.996 -11.818 1.00 0.00 C ATOM 576 NZ LYS A 36 0.428 -5.409 -13.167 1.00 0.00 N ATOM 0 H LYS A 36 3.185 -2.892 -8.128 1.00 0.00 H new ATOM 0 HA LYS A 36 2.887 -0.170 -9.128 1.00 0.00 H new ATOM 0 HB2 LYS A 36 1.243 -1.020 -10.676 1.00 0.00 H new ATOM 0 HB3 LYS A 36 2.873 -1.577 -10.996 1.00 0.00 H new ATOM 0 HG2 LYS A 36 2.314 -3.761 -9.939 1.00 0.00 H new ATOM 0 HG3 LYS A 36 0.673 -3.200 -9.683 1.00 0.00 H new ATOM 0 HD2 LYS A 36 0.324 -2.935 -12.092 1.00 0.00 H new ATOM 0 HD3 LYS A 36 2.008 -3.294 -12.419 1.00 0.00 H new ATOM 0 HE2 LYS A 36 1.724 -5.575 -11.519 1.00 0.00 H new ATOM 0 HE3 LYS A 36 0.057 -5.225 -11.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 0.214 -6.427 -13.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -0.421 -4.876 -13.443 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 1.193 -5.216 -13.844 1.00 0.00 H new ATOM 590 N ILE A 37 0.720 0.108 -8.041 1.00 0.00 N ATOM 591 CA ILE A 37 -0.349 0.444 -7.178 1.00 0.00 C ATOM 592 C ILE A 37 -1.613 0.443 -7.942 1.00 0.00 C ATOM 593 O ILE A 37 -1.689 1.054 -9.025 1.00 0.00 O ATOM 594 CB ILE A 37 -0.110 1.884 -6.622 1.00 0.00 C ATOM 595 CG1 ILE A 37 0.830 1.867 -5.432 1.00 0.00 C ATOM 596 CG2 ILE A 37 -1.409 2.645 -6.294 1.00 0.00 C ATOM 597 CD1 ILE A 37 0.143 1.618 -4.098 1.00 0.00 C ATOM 0 H ILE A 37 0.939 0.829 -8.728 1.00 0.00 H new ATOM 0 HA ILE A 37 -0.405 -0.278 -6.363 1.00 0.00 H new ATOM 0 HB ILE A 37 0.365 2.438 -7.432 1.00 0.00 H new ATOM 0 HG12 ILE A 37 1.583 1.095 -5.589 1.00 0.00 H new ATOM 0 HG13 ILE A 37 1.356 2.821 -5.385 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.164 3.636 -5.913 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -2.012 2.742 -7.197 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.972 2.096 -5.539 1.00 0.00 H new ATOM 0 HD11 ILE A 37 0.886 1.621 -3.300 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -0.591 2.403 -3.914 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.359 0.651 -4.122 1.00 0.00 H new ATOM 609 N LEU A 38 -2.602 -0.233 -7.414 1.00 0.00 N ATOM 610 CA LEU A 38 -3.913 -0.071 -7.990 1.00 0.00 C ATOM 611 C LEU A 38 -4.727 0.704 -6.988 1.00 0.00 C ATOM 612 O LEU A 38 -4.675 0.440 -5.789 1.00 0.00 O ATOM 613 CB LEU A 38 -4.622 -1.418 -8.291 1.00 0.00 C ATOM 614 CG LEU A 38 -3.849 -2.424 -9.143 1.00 0.00 C ATOM 615 CD1 LEU A 38 -4.631 -3.716 -9.295 1.00 0.00 C ATOM 616 CD2 LEU A 38 -3.537 -1.844 -10.498 1.00 0.00 C ATOM 0 H LEU A 38 -2.534 -0.873 -6.623 1.00 0.00 H new ATOM 0 HA LEU A 38 -3.817 0.441 -8.947 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.867 -1.893 -7.341 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.566 -1.202 -8.792 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.911 -2.645 -8.634 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -4.061 -4.417 -9.905 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -4.808 -4.152 -8.312 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.586 -3.509 -9.777 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -2.986 -2.576 -11.089 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.466 -1.591 -11.008 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.932 -0.945 -10.379 1.00 0.00 H new ATOM 628 N LYS A 39 -5.411 1.691 -7.454 1.00 0.00 N ATOM 629 CA LYS A 39 -6.286 2.470 -6.615 1.00 0.00 C ATOM 630 C LYS A 39 -7.662 2.371 -7.192 1.00 0.00 C ATOM 631 O LYS A 39 -7.842 2.658 -8.382 1.00 0.00 O ATOM 632 CB LYS A 39 -5.899 3.966 -6.579 1.00 0.00 C ATOM 633 CG LYS A 39 -4.521 4.336 -6.030 1.00 0.00 C ATOM 634 CD LYS A 39 -4.340 5.863 -6.089 1.00 0.00 C ATOM 635 CE LYS A 39 -2.905 6.327 -5.827 1.00 0.00 C ATOM 636 NZ LYS A 39 -2.443 6.114 -4.431 1.00 0.00 N ATOM 0 H LYS A 39 -5.387 1.990 -8.429 1.00 0.00 H new ATOM 0 HA LYS A 39 -6.219 2.082 -5.599 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -5.969 4.354 -7.595 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -6.647 4.491 -5.985 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -4.421 3.986 -5.002 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -3.742 3.844 -6.612 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -4.653 6.219 -7.071 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -5.001 6.326 -5.356 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -2.234 5.799 -6.505 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -2.828 7.388 -6.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -1.424 5.906 -4.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -2.621 6.972 -3.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -2.960 5.314 -4.012 1.00 0.00 H new ATOM 650 N ASN A 40 -8.623 1.949 -6.394 1.00 0.00 N ATOM 651 CA ASN A 40 -10.019 1.891 -6.872 1.00 0.00 C ATOM 652 C ASN A 40 -10.552 3.245 -7.210 1.00 0.00 C ATOM 653 O ASN A 40 -10.313 4.199 -6.504 1.00 0.00 O ATOM 654 CB ASN A 40 -10.985 1.299 -5.825 1.00 0.00 C ATOM 655 CG ASN A 40 -11.139 -0.192 -5.863 1.00 0.00 C ATOM 656 OD1 ASN A 40 -11.300 -0.824 -4.824 1.00 0.00 O ATOM 657 ND2 ASN A 40 -11.221 -0.744 -7.036 1.00 0.00 N ATOM 0 H ASN A 40 -8.484 1.644 -5.431 1.00 0.00 H new ATOM 0 HA ASN A 40 -9.976 1.252 -7.754 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -10.638 1.586 -4.832 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -11.966 1.752 -5.964 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -11.426 -1.740 -7.118 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -11.080 -0.182 -7.875 1.00 0.00 H new ATOM 664 N GLU A 41 -11.331 3.297 -8.270 1.00 0.00 N ATOM 665 CA GLU A 41 -12.032 4.428 -8.690 1.00 0.00 C ATOM 666 C GLU A 41 -13.144 4.723 -7.680 1.00 0.00 C ATOM 667 O GLU A 41 -13.624 5.839 -7.551 1.00 0.00 O ATOM 668 CB GLU A 41 -12.592 4.046 -10.020 1.00 0.00 C ATOM 669 CG GLU A 41 -11.601 4.116 -11.165 1.00 0.00 C ATOM 670 CD GLU A 41 -11.230 5.541 -11.507 1.00 0.00 C ATOM 671 OE1 GLU A 41 -10.362 6.125 -10.859 1.00 0.00 O ATOM 672 OE2 GLU A 41 -11.813 6.105 -12.447 1.00 0.00 O ATOM 0 H GLU A 41 -11.481 2.490 -8.876 1.00 0.00 H new ATOM 0 HA GLU A 41 -11.417 5.325 -8.762 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -12.983 3.031 -9.957 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -13.435 4.699 -10.246 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -10.701 3.561 -10.900 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -12.027 3.632 -12.043 1.00 0.00 H new ATOM 679 N VAL A 42 -13.503 3.685 -6.951 1.00 0.00 N ATOM 680 CA VAL A 42 -14.431 3.703 -5.910 1.00 0.00 C ATOM 681 C VAL A 42 -13.755 4.289 -4.663 1.00 0.00 C ATOM 682 O VAL A 42 -14.404 4.851 -3.778 1.00 0.00 O ATOM 683 CB VAL A 42 -14.792 2.226 -5.668 1.00 0.00 C ATOM 684 CG1 VAL A 42 -15.498 2.026 -4.398 1.00 0.00 C ATOM 685 CG2 VAL A 42 -15.584 1.665 -6.825 1.00 0.00 C ATOM 0 H VAL A 42 -13.109 2.757 -7.106 1.00 0.00 H new ATOM 0 HA VAL A 42 -15.314 4.301 -6.136 1.00 0.00 H new ATOM 0 HB VAL A 42 -13.853 1.676 -5.598 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -15.731 0.968 -4.274 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -14.866 2.358 -3.574 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -16.423 2.603 -4.401 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -15.826 0.621 -6.628 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -16.506 2.234 -6.945 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -14.993 1.735 -7.738 1.00 0.00 H new ATOM 695 N ASN A 43 -12.423 4.192 -4.664 1.00 0.00 N ATOM 696 CA ASN A 43 -11.555 4.552 -3.558 1.00 0.00 C ATOM 697 C ASN A 43 -11.895 3.652 -2.375 1.00 0.00 C ATOM 698 O ASN A 43 -11.834 4.028 -1.200 1.00 0.00 O ATOM 699 CB ASN A 43 -11.704 6.032 -3.256 1.00 0.00 C ATOM 700 CG ASN A 43 -10.778 6.546 -2.167 1.00 0.00 C ATOM 701 OD1 ASN A 43 -9.682 6.034 -1.981 1.00 0.00 O ATOM 702 ND2 ASN A 43 -11.210 7.543 -1.445 1.00 0.00 N ATOM 0 H ASN A 43 -11.906 3.845 -5.472 1.00 0.00 H new ATOM 0 HA ASN A 43 -10.504 4.396 -3.801 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -11.520 6.597 -4.170 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -12.735 6.229 -2.962 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -10.628 7.921 -0.697 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -12.129 7.945 -1.629 1.00 0.00 H new ATOM 709 N GLY A 44 -12.238 2.429 -2.724 1.00 0.00 N ATOM 710 CA GLY A 44 -12.575 1.448 -1.743 1.00 0.00 C ATOM 711 C GLY A 44 -11.341 0.772 -1.225 1.00 0.00 C ATOM 712 O GLY A 44 -10.942 0.982 -0.091 1.00 0.00 O ATOM 0 H GLY A 44 -12.287 2.101 -3.688 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -13.111 1.919 -0.919 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -13.246 0.707 -2.178 1.00 0.00 H new ATOM 716 N LYS A 45 -10.715 -0.007 -2.058 1.00 0.00 N ATOM 717 CA LYS A 45 -9.522 -0.706 -1.680 1.00 0.00 C ATOM 718 C LYS A 45 -8.419 -0.329 -2.636 1.00 0.00 C ATOM 719 O LYS A 45 -8.610 -0.330 -3.848 1.00 0.00 O ATOM 720 CB LYS A 45 -9.761 -2.224 -1.675 1.00 0.00 C ATOM 721 CG LYS A 45 -10.776 -2.690 -0.635 1.00 0.00 C ATOM 722 CD LYS A 45 -11.070 -4.178 -0.758 1.00 0.00 C ATOM 723 CE LYS A 45 -12.076 -4.631 0.298 1.00 0.00 C ATOM 724 NZ LYS A 45 -12.493 -6.038 0.108 1.00 0.00 N ATOM 0 H LYS A 45 -11.017 -0.176 -3.018 1.00 0.00 H new ATOM 0 HA LYS A 45 -9.232 -0.423 -0.668 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -10.102 -2.531 -2.664 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -8.813 -2.730 -1.494 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -10.397 -2.476 0.364 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -11.701 -2.126 -0.752 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -11.461 -4.393 -1.752 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -10.145 -4.744 -0.650 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -11.637 -4.515 1.289 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -12.954 -3.986 0.261 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -13.176 -6.301 0.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -12.937 -6.145 -0.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -11.660 -6.658 0.169 1.00 0.00 H new ATOM 738 N LEU A 46 -7.313 0.088 -2.104 1.00 0.00 N ATOM 739 CA LEU A 46 -6.213 0.446 -2.873 1.00 0.00 C ATOM 740 C LEU A 46 -5.118 -0.505 -2.499 1.00 0.00 C ATOM 741 O LEU A 46 -5.025 -0.904 -1.348 1.00 0.00 O ATOM 742 CB LEU A 46 -5.729 1.827 -2.520 1.00 0.00 C ATOM 743 CG LEU A 46 -6.746 2.973 -2.220 1.00 0.00 C ATOM 744 CD1 LEU A 46 -7.802 3.141 -3.299 1.00 0.00 C ATOM 745 CD2 LEU A 46 -7.366 2.873 -0.820 1.00 0.00 C ATOM 0 H LEU A 46 -7.169 0.183 -1.099 1.00 0.00 H new ATOM 0 HA LEU A 46 -6.479 0.421 -3.930 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -5.088 1.729 -1.644 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -5.097 2.165 -3.341 1.00 0.00 H new ATOM 0 HG LEU A 46 -6.152 3.887 -2.233 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -8.475 3.954 -3.026 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -7.319 3.373 -4.248 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -8.371 2.217 -3.398 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -8.064 3.697 -0.671 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -7.897 1.926 -0.724 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.578 2.925 -0.069 1.00 0.00 H new ATOM 757 N ARG A 47 -4.282 -0.803 -3.412 1.00 0.00 N ATOM 758 CA ARG A 47 -3.223 -1.818 -3.203 1.00 0.00 C ATOM 759 C ARG A 47 -1.892 -1.485 -3.803 1.00 0.00 C ATOM 760 O ARG A 47 -1.787 -0.749 -4.764 1.00 0.00 O ATOM 761 CB ARG A 47 -3.574 -3.139 -3.841 1.00 0.00 C ATOM 762 CG ARG A 47 -4.764 -3.160 -4.768 1.00 0.00 C ATOM 763 CD ARG A 47 -4.876 -4.519 -5.407 1.00 0.00 C ATOM 764 NE ARG A 47 -6.096 -4.705 -6.159 1.00 0.00 N ATOM 765 CZ ARG A 47 -6.534 -5.872 -6.632 1.00 0.00 C ATOM 766 NH1 ARG A 47 -5.766 -6.967 -6.551 1.00 0.00 N ATOM 767 NH2 ARG A 47 -7.731 -5.946 -7.198 1.00 0.00 N ATOM 0 H ARG A 47 -4.276 -0.375 -4.338 1.00 0.00 H new ATOM 0 HA ARG A 47 -3.157 -1.854 -2.116 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -2.705 -3.487 -4.399 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -3.752 -3.862 -3.045 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -5.674 -2.930 -4.214 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -4.655 -2.393 -5.535 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -4.024 -4.671 -6.069 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -4.817 -5.282 -4.631 1.00 0.00 H new ATOM 0 HE ARG A 47 -6.666 -3.879 -6.342 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -4.841 -6.911 -6.126 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -6.107 -7.857 -6.915 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -8.313 -5.112 -7.270 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -8.069 -6.837 -7.561 1.00 0.00 H new ATOM 781 N MET A 48 -0.906 -2.110 -3.224 1.00 0.00 N ATOM 782 CA MET A 48 0.425 -2.228 -3.726 1.00 0.00 C ATOM 783 C MET A 48 0.606 -3.669 -4.074 1.00 0.00 C ATOM 784 O MET A 48 0.453 -4.548 -3.212 1.00 0.00 O ATOM 785 CB MET A 48 1.513 -1.931 -2.659 1.00 0.00 C ATOM 786 CG MET A 48 1.846 -0.494 -2.436 1.00 0.00 C ATOM 787 SD MET A 48 3.278 -0.248 -1.369 1.00 0.00 S ATOM 788 CE MET A 48 3.601 1.489 -1.674 1.00 0.00 C ATOM 0 H MET A 48 -1.024 -2.581 -2.327 1.00 0.00 H new ATOM 0 HA MET A 48 0.538 -1.522 -4.549 1.00 0.00 H new ATOM 0 HB2 MET A 48 1.187 -2.358 -1.710 1.00 0.00 H new ATOM 0 HB3 MET A 48 2.426 -2.453 -2.947 1.00 0.00 H new ATOM 0 HG2 MET A 48 2.034 -0.019 -3.399 1.00 0.00 H new ATOM 0 HG3 MET A 48 0.984 0.007 -1.996 1.00 0.00 H new ATOM 0 HE1 MET A 48 4.342 1.852 -0.962 1.00 0.00 H new ATOM 0 HE2 MET A 48 3.979 1.616 -2.688 1.00 0.00 H new ATOM 0 HE3 MET A 48 2.678 2.057 -1.557 1.00 0.00 H new ATOM 798 N LEU A 49 0.870 -3.930 -5.278 1.00 0.00 N ATOM 799 CA LEU A 49 1.303 -5.248 -5.651 1.00 0.00 C ATOM 800 C LEU A 49 2.591 -5.204 -6.339 1.00 0.00 C ATOM 801 O LEU A 49 2.940 -4.231 -7.005 1.00 0.00 O ATOM 802 CB LEU A 49 0.382 -6.052 -6.495 1.00 0.00 C ATOM 803 CG LEU A 49 -0.008 -5.491 -7.867 1.00 0.00 C ATOM 804 CD1 LEU A 49 -0.534 -6.600 -8.713 1.00 0.00 C ATOM 805 CD2 LEU A 49 -1.076 -4.411 -7.741 1.00 0.00 C ATOM 0 H LEU A 49 0.802 -3.262 -6.046 1.00 0.00 H new ATOM 0 HA LEU A 49 1.352 -5.751 -4.685 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.839 -7.029 -6.651 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -0.534 -6.215 -5.928 1.00 0.00 H new ATOM 0 HG LEU A 49 0.877 -5.046 -8.322 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.814 -6.210 -9.691 1.00 0.00 H new ATOM 0 HD12 LEU A 49 0.236 -7.362 -8.833 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -1.409 -7.040 -8.234 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -1.331 -4.034 -8.731 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.966 -4.832 -7.273 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.696 -3.594 -7.128 1.00 0.00 H new ATOM 817 N MET A 50 3.287 -6.244 -6.202 1.00 0.00 N ATOM 818 CA MET A 50 4.484 -6.396 -6.727 1.00 0.00 C ATOM 819 C MET A 50 4.596 -7.755 -7.226 1.00 0.00 C ATOM 820 O MET A 50 4.333 -8.745 -6.552 1.00 0.00 O ATOM 821 CB MET A 50 5.547 -6.146 -5.732 1.00 0.00 C ATOM 822 CG MET A 50 5.271 -6.754 -4.359 1.00 0.00 C ATOM 823 SD MET A 50 4.303 -5.721 -3.234 1.00 0.00 S ATOM 824 CE MET A 50 5.429 -4.365 -2.958 1.00 0.00 C ATOM 0 H MET A 50 2.972 -7.055 -5.669 1.00 0.00 H new ATOM 0 HA MET A 50 4.609 -5.675 -7.534 1.00 0.00 H new ATOM 0 HB2 MET A 50 6.487 -6.546 -6.112 1.00 0.00 H new ATOM 0 HB3 MET A 50 5.680 -5.070 -5.621 1.00 0.00 H new ATOM 0 HG2 MET A 50 4.747 -7.700 -4.498 1.00 0.00 H new ATOM 0 HG3 MET A 50 6.225 -6.984 -3.884 1.00 0.00 H new ATOM 0 HE1 MET A 50 5.017 -3.698 -2.201 1.00 0.00 H new ATOM 0 HE2 MET A 50 6.389 -4.753 -2.616 1.00 0.00 H new ATOM 0 HE3 MET A 50 5.570 -3.814 -3.888 1.00 0.00 H new ATOM 834 N ARG A 51 4.915 -7.752 -8.357 1.00 0.00 N ATOM 835 CA ARG A 51 5.265 -8.871 -9.154 1.00 0.00 C ATOM 836 C ARG A 51 6.718 -8.824 -9.285 1.00 0.00 C ATOM 837 O ARG A 51 7.339 -7.754 -9.275 1.00 0.00 O ATOM 838 CB ARG A 51 4.633 -8.758 -10.526 1.00 0.00 C ATOM 839 CG ARG A 51 5.018 -9.783 -11.582 1.00 0.00 C ATOM 840 CD ARG A 51 4.713 -9.287 -12.996 1.00 0.00 C ATOM 841 NE ARG A 51 3.287 -9.086 -13.281 1.00 0.00 N ATOM 842 CZ ARG A 51 2.810 -8.505 -14.395 1.00 0.00 C ATOM 843 NH1 ARG A 51 3.645 -7.975 -15.295 1.00 0.00 N ATOM 844 NH2 ARG A 51 1.494 -8.458 -14.607 1.00 0.00 N ATOM 0 H ARG A 51 4.967 -6.881 -8.886 1.00 0.00 H new ATOM 0 HA ARG A 51 4.921 -9.802 -8.704 1.00 0.00 H new ATOM 0 HB2 ARG A 51 3.551 -8.801 -10.399 1.00 0.00 H new ATOM 0 HB3 ARG A 51 4.868 -7.769 -10.920 1.00 0.00 H new ATOM 0 HG2 ARG A 51 6.081 -10.009 -11.498 1.00 0.00 H new ATOM 0 HG3 ARG A 51 4.479 -10.713 -11.399 1.00 0.00 H new ATOM 0 HD2 ARG A 51 5.238 -8.346 -13.157 1.00 0.00 H new ATOM 0 HD3 ARG A 51 5.115 -10.003 -13.712 1.00 0.00 H new ATOM 0 HE ARG A 51 2.613 -9.409 -12.587 1.00 0.00 H new ATOM 0 HH11 ARG A 51 4.652 -8.010 -15.139 1.00 0.00 H new ATOM 0 HH12 ARG A 51 3.275 -7.536 -16.138 1.00 0.00 H new ATOM 0 HH21 ARG A 51 0.853 -8.862 -13.925 1.00 0.00 H new ATOM 0 HH22 ARG A 51 1.129 -8.018 -15.452 1.00 0.00 H new ATOM 858 N ARG A 52 7.250 -9.940 -9.377 1.00 0.00 N ATOM 859 CA ARG A 52 8.599 -10.075 -9.528 1.00 0.00 C ATOM 860 C ARG A 52 8.792 -10.016 -10.981 1.00 0.00 C ATOM 861 O ARG A 52 8.195 -10.765 -11.722 1.00 0.00 O ATOM 862 CB ARG A 52 9.068 -11.353 -8.854 1.00 0.00 C ATOM 863 CG ARG A 52 8.917 -11.352 -7.335 1.00 0.00 C ATOM 864 CD ARG A 52 9.368 -12.680 -6.722 1.00 0.00 C ATOM 865 NE ARG A 52 10.794 -12.967 -6.975 1.00 0.00 N ATOM 866 CZ ARG A 52 11.408 -14.143 -6.728 1.00 0.00 C ATOM 867 NH1 ARG A 52 10.709 -15.202 -6.303 1.00 0.00 N ATOM 868 NH2 ARG A 52 12.716 -14.255 -6.917 1.00 0.00 N ATOM 0 H ARG A 52 6.737 -10.821 -9.348 1.00 0.00 H new ATOM 0 HA ARG A 52 9.202 -9.304 -9.049 1.00 0.00 H new ATOM 0 HB2 ARG A 52 8.507 -12.193 -9.263 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.116 -11.518 -9.103 1.00 0.00 H new ATOM 0 HG2 ARG A 52 9.504 -10.537 -6.911 1.00 0.00 H new ATOM 0 HG3 ARG A 52 7.876 -11.165 -7.073 1.00 0.00 H new ATOM 0 HD2 ARG A 52 9.191 -12.658 -5.647 1.00 0.00 H new ATOM 0 HD3 ARG A 52 8.761 -13.489 -7.129 1.00 0.00 H new ATOM 0 HE ARG A 52 11.361 -12.216 -7.368 1.00 0.00 H new ATOM 0 HH11 ARG A 52 9.702 -15.125 -6.163 1.00 0.00 H new ATOM 0 HH12 ARG A 52 11.184 -16.086 -6.119 1.00 0.00 H new ATOM 0 HH21 ARG A 52 13.254 -13.454 -7.248 1.00 0.00 H new ATOM 0 HH22 ARG A 52 13.184 -15.142 -6.731 1.00 0.00 H new ATOM 882 N GLU A 53 9.581 -9.094 -11.352 1.00 0.00 N ATOM 883 CA GLU A 53 9.806 -8.689 -12.735 1.00 0.00 C ATOM 884 C GLU A 53 10.171 -9.757 -13.657 1.00 0.00 C ATOM 885 O GLU A 53 9.395 -10.057 -14.572 1.00 0.00 O ATOM 886 CB GLU A 53 10.669 -7.441 -12.841 1.00 0.00 C ATOM 887 CG GLU A 53 9.892 -6.149 -12.788 1.00 0.00 C ATOM 888 CD GLU A 53 8.894 -6.063 -13.909 1.00 0.00 C ATOM 889 OE1 GLU A 53 9.308 -5.994 -15.086 1.00 0.00 O ATOM 890 OE2 GLU A 53 7.683 -6.123 -13.645 1.00 0.00 O ATOM 0 H GLU A 53 10.133 -8.552 -10.687 1.00 0.00 H new ATOM 0 HA GLU A 53 8.819 -8.406 -13.101 1.00 0.00 H new ATOM 0 HB2 GLU A 53 11.399 -7.447 -12.031 1.00 0.00 H new ATOM 0 HB3 GLU A 53 11.229 -7.478 -13.775 1.00 0.00 H new ATOM 0 HG2 GLU A 53 9.375 -6.073 -11.832 1.00 0.00 H new ATOM 0 HG3 GLU A 53 10.580 -5.306 -12.846 1.00 0.00 H new ATOM 897 N GLN A 54 11.262 -10.375 -13.460 1.00 0.00 N ATOM 898 CA GLN A 54 11.594 -11.386 -14.390 1.00 0.00 C ATOM 899 C GLN A 54 10.872 -12.687 -14.034 1.00 0.00 C ATOM 900 O GLN A 54 10.886 -13.659 -14.783 1.00 0.00 O ATOM 901 CB GLN A 54 13.098 -11.617 -14.587 1.00 0.00 C ATOM 902 CG GLN A 54 13.923 -10.446 -15.139 1.00 0.00 C ATOM 903 CD GLN A 54 14.104 -9.295 -14.180 1.00 0.00 C ATOM 904 OE1 GLN A 54 15.026 -9.294 -13.369 1.00 0.00 O ATOM 905 NE2 GLN A 54 13.305 -8.287 -14.309 1.00 0.00 N ATOM 0 H GLN A 54 11.922 -10.215 -12.699 1.00 0.00 H new ATOM 0 HA GLN A 54 11.247 -11.024 -15.358 1.00 0.00 H new ATOM 0 HB2 GLN A 54 13.524 -11.906 -13.626 1.00 0.00 H new ATOM 0 HB3 GLN A 54 13.224 -12.465 -15.260 1.00 0.00 H new ATOM 0 HG2 GLN A 54 14.906 -10.817 -15.430 1.00 0.00 H new ATOM 0 HG3 GLN A 54 13.442 -10.075 -16.044 1.00 0.00 H new ATOM 0 HE21 GLN A 54 12.549 -8.320 -14.993 1.00 0.00 H new ATOM 0 HE22 GLN A 54 13.431 -7.459 -13.727 1.00 0.00 H new ATOM 914 N VAL A 55 10.239 -12.676 -12.890 1.00 0.00 N ATOM 915 CA VAL A 55 9.598 -13.817 -12.343 1.00 0.00 C ATOM 916 C VAL A 55 8.088 -13.860 -12.725 1.00 0.00 C ATOM 917 O VAL A 55 7.397 -14.858 -12.487 1.00 0.00 O ATOM 918 CB VAL A 55 9.803 -13.671 -10.808 1.00 0.00 C ATOM 919 CG1 VAL A 55 8.904 -14.570 -9.999 1.00 0.00 C ATOM 920 CG2 VAL A 55 11.260 -13.952 -10.459 1.00 0.00 C ATOM 0 H VAL A 55 10.160 -11.844 -12.306 1.00 0.00 H new ATOM 0 HA VAL A 55 10.011 -14.751 -12.725 1.00 0.00 H new ATOM 0 HB VAL A 55 9.537 -12.646 -10.549 1.00 0.00 H new ATOM 0 HG11 VAL A 55 9.098 -14.418 -8.937 1.00 0.00 H new ATOM 0 HG12 VAL A 55 7.862 -14.333 -10.215 1.00 0.00 H new ATOM 0 HG13 VAL A 55 9.100 -15.610 -10.259 1.00 0.00 H new ATOM 0 HG21 VAL A 55 11.403 -13.849 -9.383 1.00 0.00 H new ATOM 0 HG22 VAL A 55 11.518 -14.966 -10.764 1.00 0.00 H new ATOM 0 HG23 VAL A 55 11.902 -13.242 -10.980 1.00 0.00 H new ATOM 930 N LEU A 56 7.629 -12.791 -13.403 1.00 0.00 N ATOM 931 CA LEU A 56 6.319 -12.590 -13.970 1.00 0.00 C ATOM 932 C LEU A 56 5.140 -12.852 -12.976 1.00 0.00 C ATOM 933 O LEU A 56 3.953 -12.798 -13.318 1.00 0.00 O ATOM 934 CB LEU A 56 6.301 -13.587 -15.043 1.00 0.00 C ATOM 935 CG LEU A 56 5.006 -13.836 -15.673 1.00 0.00 C ATOM 936 CD1 LEU A 56 4.518 -12.633 -16.493 1.00 0.00 C ATOM 937 CD2 LEU A 56 4.949 -15.138 -16.428 1.00 0.00 C ATOM 0 H LEU A 56 8.233 -11.986 -13.572 1.00 0.00 H new ATOM 0 HA LEU A 56 6.170 -11.556 -14.280 1.00 0.00 H new ATOM 0 HB2 LEU A 56 7.002 -13.271 -15.815 1.00 0.00 H new ATOM 0 HB3 LEU A 56 6.673 -14.529 -14.641 1.00 0.00 H new ATOM 0 HG LEU A 56 4.291 -13.956 -14.859 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.552 -12.866 -16.942 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.415 -11.766 -15.841 1.00 0.00 H new ATOM 0 HD13 LEU A 56 5.240 -12.412 -17.280 1.00 0.00 H new ATOM 0 HD21 LEU A 56 3.960 -15.259 -16.870 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.701 -15.134 -17.217 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.144 -15.964 -15.744 1.00 0.00 H new ATOM 949 N LYS A 57 5.458 -12.985 -11.784 1.00 0.00 N ATOM 950 CA LYS A 57 4.463 -13.288 -10.818 1.00 0.00 C ATOM 951 C LYS A 57 4.369 -12.322 -9.627 1.00 0.00 C ATOM 952 O LYS A 57 5.304 -12.239 -8.816 1.00 0.00 O ATOM 953 CB LYS A 57 4.726 -14.699 -10.394 1.00 0.00 C ATOM 954 CG LYS A 57 3.702 -15.318 -9.441 1.00 0.00 C ATOM 955 CD LYS A 57 4.162 -16.702 -8.985 1.00 0.00 C ATOM 956 CE LYS A 57 3.169 -17.365 -8.034 1.00 0.00 C ATOM 957 NZ LYS A 57 1.885 -17.694 -8.687 1.00 0.00 N ATOM 0 H LYS A 57 6.406 -12.893 -11.419 1.00 0.00 H new ATOM 0 HA LYS A 57 3.480 -13.167 -11.274 1.00 0.00 H new ATOM 0 HB2 LYS A 57 4.783 -15.321 -11.288 1.00 0.00 H new ATOM 0 HB3 LYS A 57 5.705 -14.737 -9.917 1.00 0.00 H new ATOM 0 HG2 LYS A 57 3.565 -14.670 -8.575 1.00 0.00 H new ATOM 0 HG3 LYS A 57 2.735 -15.395 -9.938 1.00 0.00 H new ATOM 0 HD2 LYS A 57 4.305 -17.339 -9.858 1.00 0.00 H new ATOM 0 HD3 LYS A 57 5.130 -16.615 -8.491 1.00 0.00 H new ATOM 0 HE2 LYS A 57 3.611 -18.276 -7.632 1.00 0.00 H new ATOM 0 HE3 LYS A 57 2.983 -16.701 -7.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 1.142 -17.784 -7.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 1.630 -16.937 -9.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 1.978 -18.592 -9.203 1.00 0.00 H new ATOM 971 N VAL A 58 3.336 -11.460 -9.655 1.00 0.00 N ATOM 972 CA VAL A 58 2.755 -10.843 -8.453 1.00 0.00 C ATOM 973 C VAL A 58 2.898 -11.748 -7.235 1.00 0.00 C ATOM 974 O VAL A 58 2.327 -12.845 -7.141 1.00 0.00 O ATOM 975 CB VAL A 58 1.250 -10.442 -8.667 1.00 0.00 C ATOM 976 CG1 VAL A 58 0.396 -11.619 -9.125 1.00 0.00 C ATOM 977 CG2 VAL A 58 0.677 -9.830 -7.395 1.00 0.00 C ATOM 0 H VAL A 58 2.879 -11.171 -10.520 1.00 0.00 H new ATOM 0 HA VAL A 58 3.319 -9.929 -8.267 1.00 0.00 H new ATOM 0 HB VAL A 58 1.225 -9.699 -9.464 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.635 -11.290 -9.259 1.00 0.00 H new ATOM 0 HG12 VAL A 58 0.780 -12.001 -10.071 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.431 -12.408 -8.374 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -0.366 -9.558 -7.560 1.00 0.00 H new ATOM 0 HG22 VAL A 58 0.739 -10.554 -6.583 1.00 0.00 H new ATOM 0 HG23 VAL A 58 1.247 -8.939 -7.131 1.00 0.00 H new ATOM 987 N CYS A 59 3.690 -11.305 -6.342 1.00 0.00 N ATOM 988 CA CYS A 59 3.974 -12.037 -5.193 1.00 0.00 C ATOM 989 C CYS A 59 3.146 -11.492 -4.043 1.00 0.00 C ATOM 990 O CYS A 59 2.627 -12.273 -3.251 1.00 0.00 O ATOM 991 CB CYS A 59 5.482 -11.998 -4.905 1.00 0.00 C ATOM 992 SG CYS A 59 6.065 -13.116 -3.604 1.00 0.00 S ATOM 0 H CYS A 59 4.165 -10.404 -6.397 1.00 0.00 H new ATOM 0 HA CYS A 59 3.706 -13.085 -5.330 1.00 0.00 H new ATOM 0 HB2 CYS A 59 6.015 -12.234 -5.826 1.00 0.00 H new ATOM 0 HB3 CYS A 59 5.754 -10.979 -4.631 1.00 0.00 H new ATOM 0 HG CYS A 59 7.365 -13.144 -3.606 1.00 0.00 H new ATOM 998 N ALA A 60 2.891 -10.168 -4.024 1.00 0.00 N ATOM 999 CA ALA A 60 2.228 -9.597 -2.963 1.00 0.00 C ATOM 1000 C ALA A 60 1.277 -8.614 -3.419 1.00 0.00 C ATOM 1001 O ALA A 60 1.536 -7.881 -4.349 1.00 0.00 O ATOM 1002 CB ALA A 60 3.119 -8.953 -1.980 1.00 0.00 C ATOM 0 H ALA A 60 3.159 -9.518 -4.763 1.00 0.00 H new ATOM 0 HA ALA A 60 1.725 -10.427 -2.466 1.00 0.00 H new ATOM 0 HB1 ALA A 60 2.523 -8.526 -1.174 1.00 0.00 H new ATOM 0 HB2 ALA A 60 3.805 -9.694 -1.571 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.688 -8.162 -2.468 1.00 0.00 H new ATOM 1008 N ASN A 61 0.182 -8.686 -2.828 1.00 0.00 N ATOM 1009 CA ASN A 61 -0.884 -7.758 -2.962 1.00 0.00 C ATOM 1010 C ASN A 61 -1.269 -7.243 -1.601 1.00 0.00 C ATOM 1011 O ASN A 61 -2.007 -7.883 -0.853 1.00 0.00 O ATOM 1012 CB ASN A 61 -2.045 -8.406 -3.582 1.00 0.00 C ATOM 1013 CG ASN A 61 -3.231 -7.495 -3.838 1.00 0.00 C ATOM 1014 OD1 ASN A 61 -3.390 -6.995 -4.936 1.00 0.00 O ATOM 1015 ND2 ASN A 61 -4.043 -7.236 -2.824 1.00 0.00 N ATOM 0 H ASN A 61 -0.036 -9.444 -2.182 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.559 -6.932 -3.594 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -1.733 -8.845 -4.530 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -2.369 -9.226 -2.941 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -4.830 -6.600 -2.951 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -3.881 -7.672 -1.916 1.00 0.00 H new ATOM 1022 N HIS A 62 -0.734 -6.161 -1.270 1.00 0.00 N ATOM 1023 CA HIS A 62 -1.026 -5.494 0.000 1.00 0.00 C ATOM 1024 C HIS A 62 -1.834 -4.229 -0.217 1.00 0.00 C ATOM 1025 O HIS A 62 -1.464 -3.391 -1.001 1.00 0.00 O ATOM 1026 CB HIS A 62 0.260 -5.152 0.766 1.00 0.00 C ATOM 1027 CG HIS A 62 1.050 -6.342 1.173 1.00 0.00 C ATOM 1028 ND1 HIS A 62 1.026 -6.866 2.433 1.00 0.00 N ATOM 1029 CD2 HIS A 62 1.864 -7.127 0.463 1.00 0.00 C ATOM 1030 CE1 HIS A 62 1.782 -7.927 2.479 1.00 0.00 C ATOM 1031 NE2 HIS A 62 2.308 -8.118 1.291 1.00 0.00 N ATOM 0 H HIS A 62 -0.060 -5.665 -1.853 1.00 0.00 H new ATOM 0 HA HIS A 62 -1.613 -6.194 0.595 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.883 -4.510 0.143 1.00 0.00 H new ATOM 0 HB3 HIS A 62 0.000 -4.578 1.656 1.00 0.00 H new ATOM 0 HD2 HIS A 62 2.124 -7.001 -0.578 1.00 0.00 H new ATOM 0 HE1 HIS A 62 1.948 -8.545 3.349 1.00 0.00 H new ATOM 0 HE2 HIS A 62 2.939 -8.876 1.031 1.00 0.00 H new ATOM 1039 N TRP A 63 -2.923 -4.110 0.477 1.00 0.00 N ATOM 1040 CA TRP A 63 -3.745 -2.931 0.440 1.00 0.00 C ATOM 1041 C TRP A 63 -3.231 -1.889 1.393 1.00 0.00 C ATOM 1042 O TRP A 63 -2.826 -2.189 2.518 1.00 0.00 O ATOM 1043 CB TRP A 63 -5.185 -3.255 0.817 1.00 0.00 C ATOM 1044 CG TRP A 63 -5.867 -4.178 -0.135 1.00 0.00 C ATOM 1045 CD1 TRP A 63 -6.425 -3.845 -1.328 1.00 0.00 C ATOM 1046 CD2 TRP A 63 -6.078 -5.581 0.030 1.00 0.00 C ATOM 1047 NE1 TRP A 63 -6.962 -4.949 -1.924 1.00 0.00 N ATOM 1048 CE2 TRP A 63 -6.767 -6.032 -1.110 1.00 0.00 C ATOM 1049 CE3 TRP A 63 -5.749 -6.498 1.030 1.00 0.00 C ATOM 1050 CZ2 TRP A 63 -7.134 -7.360 -1.277 1.00 0.00 C ATOM 1051 CZ3 TRP A 63 -6.115 -7.815 0.863 1.00 0.00 C ATOM 1052 CH2 TRP A 63 -6.800 -8.235 -0.282 1.00 0.00 C ATOM 0 H TRP A 63 -3.275 -4.839 1.097 1.00 0.00 H new ATOM 0 HA TRP A 63 -3.710 -2.549 -0.580 1.00 0.00 H new ATOM 0 HB2 TRP A 63 -5.198 -3.701 1.812 1.00 0.00 H new ATOM 0 HB3 TRP A 63 -5.752 -2.326 0.876 1.00 0.00 H new ATOM 0 HD1 TRP A 63 -6.441 -2.849 -1.745 1.00 0.00 H new ATOM 0 HE1 TRP A 63 -7.432 -4.965 -2.829 1.00 0.00 H new ATOM 0 HE3 TRP A 63 -5.219 -6.181 1.916 1.00 0.00 H new ATOM 0 HZ2 TRP A 63 -7.663 -7.689 -2.159 1.00 0.00 H new ATOM 0 HZ3 TRP A 63 -5.869 -8.536 1.629 1.00 0.00 H new ATOM 0 HH2 TRP A 63 -7.071 -9.276 -0.382 1.00 0.00 H new ATOM 1063 N ILE A 64 -3.278 -0.672 0.947 1.00 0.00 N ATOM 1064 CA ILE A 64 -2.816 0.427 1.666 1.00 0.00 C ATOM 1065 C ILE A 64 -4.031 1.097 2.284 1.00 0.00 C ATOM 1066 O ILE A 64 -4.883 1.648 1.592 1.00 0.00 O ATOM 1067 CB ILE A 64 -1.905 1.362 0.736 1.00 0.00 C ATOM 1068 CG1 ILE A 64 -1.575 2.749 1.344 1.00 0.00 C ATOM 1069 CG2 ILE A 64 -2.462 1.503 -0.677 1.00 0.00 C ATOM 1070 CD1 ILE A 64 -2.718 3.717 1.301 1.00 0.00 C ATOM 0 H ILE A 64 -3.659 -0.430 0.032 1.00 0.00 H new ATOM 0 HA ILE A 64 -2.149 0.149 2.482 1.00 0.00 H new ATOM 0 HB ILE A 64 -0.956 0.830 0.675 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -1.263 2.616 2.380 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -0.728 3.178 0.808 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -1.806 2.146 -1.264 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.520 0.520 -1.145 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -3.458 1.943 -0.633 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -2.410 4.664 1.744 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -3.017 3.881 0.266 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -3.560 3.311 1.862 1.00 0.00 H new ATOM 1082 N THR A 65 -4.173 0.903 3.547 1.00 0.00 N ATOM 1083 CA THR A 65 -5.237 1.480 4.294 1.00 0.00 C ATOM 1084 C THR A 65 -4.766 1.867 5.649 1.00 0.00 C ATOM 1085 O THR A 65 -3.783 1.333 6.153 1.00 0.00 O ATOM 1086 CB THR A 65 -6.465 0.521 4.380 1.00 0.00 C ATOM 1087 OG1 THR A 65 -7.478 1.028 5.274 1.00 0.00 O ATOM 1088 CG2 THR A 65 -6.058 -0.893 4.793 1.00 0.00 C ATOM 0 H THR A 65 -3.541 0.327 4.103 1.00 0.00 H new ATOM 0 HA THR A 65 -5.566 2.378 3.772 1.00 0.00 H new ATOM 0 HB THR A 65 -6.887 0.472 3.376 1.00 0.00 H new ATOM 0 HG1 THR A 65 -8.155 0.336 5.427 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.943 -1.527 4.840 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.360 -1.299 4.061 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.580 -0.863 5.772 1.00 0.00 H new ATOM 1096 N THR A 66 -5.491 2.752 6.241 1.00 0.00 N ATOM 1097 CA THR A 66 -5.275 3.223 7.577 1.00 0.00 C ATOM 1098 C THR A 66 -5.751 2.168 8.591 1.00 0.00 C ATOM 1099 O THR A 66 -5.567 2.306 9.786 1.00 0.00 O ATOM 1100 CB THR A 66 -6.047 4.498 7.769 1.00 0.00 C ATOM 1101 OG1 THR A 66 -6.815 4.774 6.571 1.00 0.00 O ATOM 1102 CG2 THR A 66 -5.133 5.643 8.093 1.00 0.00 C ATOM 0 H THR A 66 -6.292 3.193 5.789 1.00 0.00 H new ATOM 0 HA THR A 66 -4.212 3.404 7.736 1.00 0.00 H new ATOM 0 HB THR A 66 -6.725 4.378 8.614 1.00 0.00 H new ATOM 0 HG1 THR A 66 -6.368 5.473 6.050 1.00 0.00 H new ATOM 0 HG21 THR A 66 -5.721 6.551 8.226 1.00 0.00 H new ATOM 0 HG22 THR A 66 -4.588 5.425 9.012 1.00 0.00 H new ATOM 0 HG23 THR A 66 -4.425 5.786 7.277 1.00 0.00 H new ATOM 1110 N THR A 67 -6.324 1.092 8.063 1.00 0.00 N ATOM 1111 CA THR A 67 -6.841 -0.034 8.832 1.00 0.00 C ATOM 1112 C THR A 67 -5.653 -0.970 9.153 1.00 0.00 C ATOM 1113 O THR A 67 -5.762 -2.039 9.777 1.00 0.00 O ATOM 1114 CB THR A 67 -7.914 -0.752 7.952 1.00 0.00 C ATOM 1115 OG1 THR A 67 -8.962 0.186 7.637 1.00 0.00 O ATOM 1116 CG2 THR A 67 -8.518 -1.979 8.629 1.00 0.00 C ATOM 0 H THR A 67 -6.445 0.976 7.057 1.00 0.00 H new ATOM 0 HA THR A 67 -7.304 0.277 9.769 1.00 0.00 H new ATOM 0 HB THR A 67 -7.414 -1.103 7.049 1.00 0.00 H new ATOM 0 HG1 THR A 67 -9.640 -0.255 7.083 1.00 0.00 H new ATOM 0 HG21 THR A 67 -9.256 -2.433 7.968 1.00 0.00 H new ATOM 0 HG22 THR A 67 -7.730 -2.701 8.844 1.00 0.00 H new ATOM 0 HG23 THR A 67 -9.000 -1.681 9.560 1.00 0.00 H new ATOM 1124 N MET A 68 -4.516 -0.505 8.768 1.00 0.00 N ATOM 1125 CA MET A 68 -3.340 -1.157 8.870 1.00 0.00 C ATOM 1126 C MET A 68 -2.333 -0.087 9.194 1.00 0.00 C ATOM 1127 O MET A 68 -2.620 1.113 9.076 1.00 0.00 O ATOM 1128 CB MET A 68 -3.044 -1.759 7.532 1.00 0.00 C ATOM 1129 CG MET A 68 -1.801 -2.619 7.479 1.00 0.00 C ATOM 1130 SD MET A 68 -1.310 -2.988 5.787 1.00 0.00 S ATOM 1131 CE MET A 68 -0.977 -1.344 5.150 1.00 0.00 C ATOM 0 H MET A 68 -4.421 0.418 8.345 1.00 0.00 H new ATOM 0 HA MET A 68 -3.335 -1.947 9.621 1.00 0.00 H new ATOM 0 HB2 MET A 68 -3.898 -2.362 7.225 1.00 0.00 H new ATOM 0 HB3 MET A 68 -2.943 -0.955 6.803 1.00 0.00 H new ATOM 0 HG2 MET A 68 -0.985 -2.109 7.991 1.00 0.00 H new ATOM 0 HG3 MET A 68 -1.981 -3.550 8.016 1.00 0.00 H new ATOM 0 HE1 MET A 68 -0.181 -1.396 4.407 1.00 0.00 H new ATOM 0 HE2 MET A 68 -1.879 -0.943 4.687 1.00 0.00 H new ATOM 0 HE3 MET A 68 -0.669 -0.693 5.968 1.00 0.00 H new ATOM 1141 N ASN A 69 -1.231 -0.499 9.589 1.00 0.00 N ATOM 1142 CA ASN A 69 -0.145 0.343 9.970 1.00 0.00 C ATOM 1143 C ASN A 69 1.121 -0.206 9.374 1.00 0.00 C ATOM 1144 O ASN A 69 1.275 -1.427 9.263 1.00 0.00 O ATOM 1145 CB ASN A 69 -0.055 0.299 11.482 1.00 0.00 C ATOM 1146 CG ASN A 69 1.043 1.162 12.081 1.00 0.00 C ATOM 1147 OD1 ASN A 69 2.161 0.708 12.313 1.00 0.00 O ATOM 1148 ND2 ASN A 69 0.729 2.409 12.336 1.00 0.00 N ATOM 0 H ASN A 69 -1.015 -1.492 9.672 1.00 0.00 H new ATOM 0 HA ASN A 69 -0.291 1.366 9.623 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -1.012 0.613 11.898 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.104 -0.734 11.792 1.00 0.00 H new ATOM 0 HD21 ASN A 69 1.423 3.037 12.740 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -0.210 2.751 12.130 1.00 0.00 H new ATOM 1155 N LEU A 70 1.980 0.677 8.936 1.00 0.00 N ATOM 1156 CA LEU A 70 3.219 0.344 8.482 1.00 0.00 C ATOM 1157 C LEU A 70 4.212 0.349 9.630 1.00 0.00 C ATOM 1158 O LEU A 70 4.278 1.257 10.449 1.00 0.00 O ATOM 1159 CB LEU A 70 3.604 1.178 7.262 1.00 0.00 C ATOM 1160 CG LEU A 70 3.430 2.698 7.271 1.00 0.00 C ATOM 1161 CD1 LEU A 70 4.209 3.303 8.375 1.00 0.00 C ATOM 1162 CD2 LEU A 70 3.962 3.190 5.980 1.00 0.00 C ATOM 0 H LEU A 70 1.785 1.678 8.902 1.00 0.00 H new ATOM 0 HA LEU A 70 3.224 -0.679 8.107 1.00 0.00 H new ATOM 0 HB2 LEU A 70 4.655 0.976 7.054 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.032 0.794 6.417 1.00 0.00 H new ATOM 0 HG LEU A 70 2.382 2.963 7.410 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.073 4.384 8.366 1.00 0.00 H new ATOM 0 HD12 LEU A 70 3.862 2.902 9.327 1.00 0.00 H new ATOM 0 HD13 LEU A 70 5.266 3.069 8.246 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.861 4.274 5.935 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.014 2.919 5.893 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.403 2.739 5.160 1.00 0.00 H new ATOM 1174 N LYS A 71 4.869 -0.674 9.713 1.00 0.00 N ATOM 1175 CA LYS A 71 5.788 -0.944 10.797 1.00 0.00 C ATOM 1176 C LYS A 71 7.199 -1.204 10.265 1.00 0.00 C ATOM 1177 O LYS A 71 7.369 -1.985 9.352 1.00 0.00 O ATOM 1178 CB LYS A 71 5.250 -2.143 11.590 1.00 0.00 C ATOM 1179 CG LYS A 71 6.058 -2.539 12.809 1.00 0.00 C ATOM 1180 CD LYS A 71 5.320 -3.591 13.613 1.00 0.00 C ATOM 1181 CE LYS A 71 6.079 -3.991 14.861 1.00 0.00 C ATOM 1182 NZ LYS A 71 6.251 -2.866 15.812 1.00 0.00 N ATOM 0 H LYS A 71 4.822 -1.423 9.022 1.00 0.00 H new ATOM 0 HA LYS A 71 5.860 -0.078 11.455 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.232 -1.917 11.909 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.192 -3.001 10.921 1.00 0.00 H new ATOM 0 HG2 LYS A 71 7.030 -2.924 12.500 1.00 0.00 H new ATOM 0 HG3 LYS A 71 6.245 -1.663 13.430 1.00 0.00 H new ATOM 0 HD2 LYS A 71 4.338 -3.210 13.893 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.155 -4.471 12.992 1.00 0.00 H new ATOM 0 HE2 LYS A 71 5.550 -4.804 15.358 1.00 0.00 H new ATOM 0 HE3 LYS A 71 7.059 -4.375 14.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 6.622 -3.227 16.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 6.919 -2.175 15.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 5.333 -2.406 15.975 1.00 0.00 H new ATOM 1196 N PRO A 72 8.222 -0.532 10.811 1.00 0.00 N ATOM 1197 CA PRO A 72 9.601 -0.705 10.361 1.00 0.00 C ATOM 1198 C PRO A 72 10.251 -1.983 10.928 1.00 0.00 C ATOM 1199 O PRO A 72 10.020 -2.364 12.083 1.00 0.00 O ATOM 1200 CB PRO A 72 10.306 0.543 10.895 1.00 0.00 C ATOM 1201 CG PRO A 72 9.545 0.918 12.125 1.00 0.00 C ATOM 1202 CD PRO A 72 8.123 0.448 11.917 1.00 0.00 C ATOM 0 HA PRO A 72 9.666 -0.816 9.279 1.00 0.00 H new ATOM 0 HB2 PRO A 72 11.352 0.338 11.125 1.00 0.00 H new ATOM 0 HB3 PRO A 72 10.293 1.349 10.161 1.00 0.00 H new ATOM 0 HG2 PRO A 72 9.982 0.451 13.008 1.00 0.00 H new ATOM 0 HG3 PRO A 72 9.577 1.996 12.286 1.00 0.00 H new ATOM 0 HD2 PRO A 72 7.719 -0.010 12.820 1.00 0.00 H new ATOM 0 HD3 PRO A 72 7.464 1.276 11.657 1.00 0.00 H new ATOM 1210 N LEU A 73 11.040 -2.643 10.107 1.00 0.00 N ATOM 1211 CA LEU A 73 11.729 -3.821 10.458 1.00 0.00 C ATOM 1212 C LEU A 73 13.115 -3.535 10.959 1.00 0.00 C ATOM 1213 O LEU A 73 13.592 -2.398 10.917 1.00 0.00 O ATOM 1214 CB LEU A 73 11.883 -4.710 9.235 1.00 0.00 C ATOM 1215 CG LEU A 73 12.015 -4.070 7.841 1.00 0.00 C ATOM 1216 CD1 LEU A 73 12.732 -5.027 6.904 1.00 0.00 C ATOM 1217 CD2 LEU A 73 10.646 -3.787 7.269 1.00 0.00 C ATOM 0 H LEU A 73 11.211 -2.345 9.147 1.00 0.00 H new ATOM 0 HA LEU A 73 11.145 -4.302 11.243 1.00 0.00 H new ATOM 0 HB2 LEU A 73 12.764 -5.332 9.393 1.00 0.00 H new ATOM 0 HB3 LEU A 73 11.022 -5.378 9.207 1.00 0.00 H new ATOM 0 HG LEU A 73 12.578 -3.142 7.938 1.00 0.00 H new ATOM 0 HD11 LEU A 73 12.824 -4.571 5.918 1.00 0.00 H new ATOM 0 HD12 LEU A 73 13.725 -5.245 7.297 1.00 0.00 H new ATOM 0 HD13 LEU A 73 12.162 -5.953 6.824 1.00 0.00 H new ATOM 0 HD21 LEU A 73 10.750 -3.334 6.283 1.00 0.00 H new ATOM 0 HD22 LEU A 73 10.088 -4.719 7.183 1.00 0.00 H new ATOM 0 HD23 LEU A 73 10.111 -3.103 7.928 1.00 0.00 H new ATOM 1229 N SER A 74 13.747 -4.567 11.443 1.00 0.00 N ATOM 1230 CA SER A 74 15.138 -4.538 11.741 1.00 0.00 C ATOM 1231 C SER A 74 15.892 -4.596 10.474 1.00 0.00 C ATOM 1232 O SER A 74 15.458 -5.270 9.522 1.00 0.00 O ATOM 1233 CB SER A 74 15.540 -5.745 12.514 1.00 0.00 C ATOM 1234 OG SER A 74 15.055 -5.712 13.851 1.00 0.00 O ATOM 0 H SER A 74 13.298 -5.461 11.642 1.00 0.00 H new ATOM 0 HA SER A 74 15.342 -3.632 12.312 1.00 0.00 H new ATOM 0 HB2 SER A 74 15.163 -6.637 12.014 1.00 0.00 H new ATOM 0 HB3 SER A 74 16.627 -5.822 12.525 1.00 0.00 H new ATOM 0 HG SER A 74 15.340 -6.523 14.322 1.00 0.00 H new ATOM 1240 N GLY A 75 16.987 -3.915 10.420 1.00 0.00 N ATOM 1241 CA GLY A 75 17.768 -3.992 9.256 1.00 0.00 C ATOM 1242 C GLY A 75 17.230 -3.070 8.164 1.00 0.00 C ATOM 1243 O GLY A 75 17.631 -3.139 7.000 1.00 0.00 O ATOM 0 H GLY A 75 17.348 -3.312 11.159 1.00 0.00 H new ATOM 0 HA2 GLY A 75 18.798 -3.721 9.488 1.00 0.00 H new ATOM 0 HA3 GLY A 75 17.782 -5.020 8.893 1.00 0.00 H new ATOM 1247 N SER A 76 16.278 -2.254 8.561 1.00 0.00 N ATOM 1248 CA SER A 76 15.692 -1.224 7.763 1.00 0.00 C ATOM 1249 C SER A 76 16.589 -0.013 7.719 1.00 0.00 C ATOM 1250 O SER A 76 17.292 0.320 8.683 1.00 0.00 O ATOM 1251 CB SER A 76 14.355 -0.853 8.419 1.00 0.00 C ATOM 1252 OG SER A 76 13.709 0.232 7.807 1.00 0.00 O ATOM 0 H SER A 76 15.879 -2.302 9.498 1.00 0.00 H new ATOM 0 HA SER A 76 15.549 -1.571 6.740 1.00 0.00 H new ATOM 0 HB2 SER A 76 13.695 -1.720 8.393 1.00 0.00 H new ATOM 0 HB3 SER A 76 14.529 -0.616 9.469 1.00 0.00 H new ATOM 0 HG SER A 76 12.749 0.047 7.742 1.00 0.00 H new ATOM 1258 N ASP A 77 16.581 0.595 6.598 1.00 0.00 N ATOM 1259 CA ASP A 77 17.173 1.842 6.357 1.00 0.00 C ATOM 1260 C ASP A 77 16.074 2.817 6.472 1.00 0.00 C ATOM 1261 O ASP A 77 16.166 3.816 7.194 1.00 0.00 O ATOM 1262 CB ASP A 77 17.815 1.940 4.955 1.00 0.00 C ATOM 1263 CG ASP A 77 16.980 1.407 3.776 1.00 0.00 C ATOM 1264 OD1 ASP A 77 15.980 0.686 4.006 1.00 0.00 O ATOM 1265 OD2 ASP A 77 17.341 1.681 2.618 1.00 0.00 O ATOM 0 H ASP A 77 16.129 0.205 5.771 1.00 0.00 H new ATOM 0 HA ASP A 77 17.983 2.019 7.064 1.00 0.00 H new ATOM 0 HB2 ASP A 77 18.050 2.986 4.760 1.00 0.00 H new ATOM 0 HB3 ASP A 77 18.761 1.399 4.975 1.00 0.00 H new ATOM 1270 N ARG A 78 15.020 2.479 5.775 1.00 0.00 N ATOM 1271 CA ARG A 78 13.798 3.177 5.797 1.00 0.00 C ATOM 1272 C ARG A 78 12.758 2.317 5.090 1.00 0.00 C ATOM 1273 O ARG A 78 11.905 2.787 4.379 1.00 0.00 O ATOM 1274 CB ARG A 78 13.949 4.549 5.181 1.00 0.00 C ATOM 1275 CG ARG A 78 12.941 5.539 5.708 1.00 0.00 C ATOM 1276 CD ARG A 78 13.056 5.705 7.212 1.00 0.00 C ATOM 1277 NE ARG A 78 12.222 6.789 7.681 1.00 0.00 N ATOM 1278 CZ ARG A 78 12.076 7.166 8.939 1.00 0.00 C ATOM 1279 NH1 ARG A 78 12.578 6.448 9.927 1.00 0.00 N ATOM 1280 NH2 ARG A 78 11.411 8.263 9.202 1.00 0.00 N ATOM 0 H ARG A 78 15.008 1.670 5.154 1.00 0.00 H new ATOM 0 HA ARG A 78 13.469 3.353 6.821 1.00 0.00 H new ATOM 0 HB2 ARG A 78 14.954 4.922 5.377 1.00 0.00 H new ATOM 0 HB3 ARG A 78 13.843 4.470 4.099 1.00 0.00 H new ATOM 0 HG2 ARG A 78 13.089 6.504 5.222 1.00 0.00 H new ATOM 0 HG3 ARG A 78 11.935 5.205 5.454 1.00 0.00 H new ATOM 0 HD2 ARG A 78 12.765 4.778 7.707 1.00 0.00 H new ATOM 0 HD3 ARG A 78 14.094 5.898 7.481 1.00 0.00 H new ATOM 0 HE ARG A 78 11.699 7.310 6.977 1.00 0.00 H new ATOM 0 HH11 ARG A 78 13.088 5.588 9.725 1.00 0.00 H new ATOM 0 HH12 ARG A 78 12.456 6.753 10.893 1.00 0.00 H new ATOM 0 HH21 ARG A 78 11.014 8.814 8.441 1.00 0.00 H new ATOM 0 HH22 ARG A 78 11.290 8.567 10.168 1.00 0.00 H new ATOM 1294 N ALA A 79 12.790 1.079 5.451 1.00 0.00 N ATOM 1295 CA ALA A 79 11.986 0.017 4.896 1.00 0.00 C ATOM 1296 C ALA A 79 10.911 -0.341 5.920 1.00 0.00 C ATOM 1297 O ALA A 79 11.170 -0.330 7.146 1.00 0.00 O ATOM 1298 CB ALA A 79 12.879 -1.190 4.720 1.00 0.00 C ATOM 0 H ALA A 79 13.414 0.750 6.187 1.00 0.00 H new ATOM 0 HA ALA A 79 11.538 0.317 3.949 1.00 0.00 H new ATOM 0 HB1 ALA A 79 12.300 -2.013 4.301 1.00 0.00 H new ATOM 0 HB2 ALA A 79 13.698 -0.942 4.045 1.00 0.00 H new ATOM 0 HB3 ALA A 79 13.284 -1.487 5.687 1.00 0.00 H new ATOM 1304 N TRP A 80 9.744 -0.684 5.441 1.00 0.00 N ATOM 1305 CA TRP A 80 8.575 -0.854 6.256 1.00 0.00 C ATOM 1306 C TRP A 80 7.802 -2.083 5.837 1.00 0.00 C ATOM 1307 O TRP A 80 7.988 -2.606 4.731 1.00 0.00 O ATOM 1308 CB TRP A 80 7.698 0.431 6.233 1.00 0.00 C ATOM 1309 CG TRP A 80 8.027 1.335 5.076 1.00 0.00 C ATOM 1310 CD1 TRP A 80 8.965 2.319 5.071 1.00 0.00 C ATOM 1311 CD2 TRP A 80 7.454 1.334 3.771 1.00 0.00 C ATOM 1312 NE1 TRP A 80 9.041 2.891 3.840 1.00 0.00 N ATOM 1313 CE2 TRP A 80 8.116 2.322 3.031 1.00 0.00 C ATOM 1314 CE3 TRP A 80 6.461 0.600 3.154 1.00 0.00 C ATOM 1315 CZ2 TRP A 80 7.821 2.587 1.718 1.00 0.00 C ATOM 1316 CZ3 TRP A 80 6.158 0.872 1.834 1.00 0.00 C ATOM 1317 CH2 TRP A 80 6.836 1.856 1.130 1.00 0.00 C ATOM 0 H TRP A 80 9.579 -0.856 4.449 1.00 0.00 H new ATOM 0 HA TRP A 80 8.888 -1.011 7.288 1.00 0.00 H new ATOM 0 HB2 TRP A 80 6.647 0.148 6.181 1.00 0.00 H new ATOM 0 HB3 TRP A 80 7.835 0.977 7.166 1.00 0.00 H new ATOM 0 HD1 TRP A 80 9.564 2.605 5.923 1.00 0.00 H new ATOM 0 HE1 TRP A 80 9.690 3.630 3.569 1.00 0.00 H new ATOM 0 HE3 TRP A 80 5.931 -0.172 3.693 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 8.353 3.350 1.169 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 5.379 0.308 1.341 1.00 0.00 H new ATOM 0 HH2 TRP A 80 6.578 2.045 0.098 1.00 0.00 H new ATOM 1328 N MET A 81 6.981 -2.526 6.723 1.00 0.00 N ATOM 1329 CA MET A 81 6.226 -3.700 6.623 1.00 0.00 C ATOM 1330 C MET A 81 4.861 -3.348 6.936 1.00 0.00 C ATOM 1331 O MET A 81 4.594 -2.365 7.624 1.00 0.00 O ATOM 1332 CB MET A 81 6.778 -4.765 7.581 1.00 0.00 C ATOM 1333 CG MET A 81 5.972 -6.051 7.796 1.00 0.00 C ATOM 1334 SD MET A 81 4.718 -5.925 9.088 1.00 0.00 S ATOM 1335 CE MET A 81 5.747 -5.700 10.528 1.00 0.00 C ATOM 0 H MET A 81 6.816 -2.030 7.599 1.00 0.00 H new ATOM 0 HA MET A 81 6.277 -4.127 5.621 1.00 0.00 H new ATOM 0 HB2 MET A 81 7.767 -5.051 7.223 1.00 0.00 H new ATOM 0 HB3 MET A 81 6.915 -4.294 8.555 1.00 0.00 H new ATOM 0 HG2 MET A 81 5.487 -6.324 6.859 1.00 0.00 H new ATOM 0 HG3 MET A 81 6.658 -6.860 8.048 1.00 0.00 H new ATOM 0 HE1 MET A 81 5.152 -5.853 11.428 1.00 0.00 H new ATOM 0 HE2 MET A 81 6.565 -6.420 10.507 1.00 0.00 H new ATOM 0 HE3 MET A 81 6.154 -4.689 10.530 1.00 0.00 H new ATOM 1345 N TRP A 82 4.035 -4.088 6.435 1.00 0.00 N ATOM 1346 CA TRP A 82 2.662 -3.867 6.555 1.00 0.00 C ATOM 1347 C TRP A 82 2.101 -5.202 6.893 1.00 0.00 C ATOM 1348 O TRP A 82 2.674 -6.240 6.455 1.00 0.00 O ATOM 1349 CB TRP A 82 2.016 -3.493 5.223 1.00 0.00 C ATOM 1350 CG TRP A 82 2.847 -2.728 4.264 1.00 0.00 C ATOM 1351 CD1 TRP A 82 3.096 -1.403 4.262 1.00 0.00 C ATOM 1352 CD2 TRP A 82 3.513 -3.272 3.126 1.00 0.00 C ATOM 1353 NE1 TRP A 82 3.869 -1.081 3.181 1.00 0.00 N ATOM 1354 CE2 TRP A 82 4.145 -2.220 2.473 1.00 0.00 C ATOM 1355 CE3 TRP A 82 3.631 -4.558 2.604 1.00 0.00 C ATOM 1356 CZ2 TRP A 82 4.889 -2.409 1.311 1.00 0.00 C ATOM 1357 CZ3 TRP A 82 4.367 -4.747 1.459 1.00 0.00 C ATOM 1358 CH2 TRP A 82 4.985 -3.679 0.824 1.00 0.00 C ATOM 0 H TRP A 82 4.277 -4.918 5.894 1.00 0.00 H new ATOM 0 HA TRP A 82 2.482 -3.068 7.275 1.00 0.00 H new ATOM 0 HB2 TRP A 82 1.693 -4.412 4.733 1.00 0.00 H new ATOM 0 HB3 TRP A 82 1.119 -2.911 5.433 1.00 0.00 H new ATOM 0 HD1 TRP A 82 2.739 -0.702 5.002 1.00 0.00 H new ATOM 0 HE1 TRP A 82 4.189 -0.143 2.941 1.00 0.00 H new ATOM 0 HE3 TRP A 82 3.151 -5.394 3.092 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 5.372 -1.581 0.814 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 4.466 -5.741 1.048 1.00 0.00 H new ATOM 0 HH2 TRP A 82 5.555 -3.858 -0.076 1.00 0.00 H new ATOM 1369 N LEU A 83 1.039 -5.264 7.604 1.00 0.00 N ATOM 1370 CA LEU A 83 0.467 -6.548 7.737 1.00 0.00 C ATOM 1371 C LEU A 83 -0.798 -6.632 6.895 1.00 0.00 C ATOM 1372 O LEU A 83 -1.748 -5.854 7.077 1.00 0.00 O ATOM 1373 CB LEU A 83 0.183 -6.940 9.185 1.00 0.00 C ATOM 1374 CG LEU A 83 -0.634 -5.958 10.059 1.00 0.00 C ATOM 1375 CD1 LEU A 83 -1.217 -6.703 11.243 1.00 0.00 C ATOM 1376 CD2 LEU A 83 0.264 -4.842 10.602 1.00 0.00 C ATOM 0 H LEU A 83 0.570 -4.492 8.078 1.00 0.00 H new ATOM 0 HA LEU A 83 1.203 -7.266 7.375 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -0.343 -7.895 9.175 1.00 0.00 H new ATOM 0 HB3 LEU A 83 1.140 -7.109 9.679 1.00 0.00 H new ATOM 0 HG LEU A 83 -1.423 -5.528 9.442 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -1.793 -6.013 11.860 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -1.869 -7.501 10.886 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -0.410 -7.132 11.836 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -0.330 -4.163 11.214 1.00 0.00 H new ATOM 0 HD22 LEU A 83 1.058 -5.277 11.209 1.00 0.00 H new ATOM 0 HD23 LEU A 83 0.703 -4.291 9.770 1.00 0.00 H new ATOM 1388 N ALA A 84 -0.824 -7.585 6.023 1.00 0.00 N ATOM 1389 CA ALA A 84 -1.924 -7.747 5.084 1.00 0.00 C ATOM 1390 C ALA A 84 -2.161 -9.170 4.737 1.00 0.00 C ATOM 1391 O ALA A 84 -1.304 -10.021 4.967 1.00 0.00 O ATOM 1392 CB ALA A 84 -1.715 -6.958 3.816 1.00 0.00 C ATOM 0 H ALA A 84 -0.088 -8.285 5.928 1.00 0.00 H new ATOM 0 HA ALA A 84 -2.803 -7.359 5.598 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.562 -7.112 3.148 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.630 -5.898 4.057 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -0.801 -7.293 3.326 1.00 0.00 H new ATOM 1398 N SER A 85 -3.297 -9.439 4.189 1.00 0.00 N ATOM 1399 CA SER A 85 -3.537 -10.648 3.580 1.00 0.00 C ATOM 1400 C SER A 85 -3.089 -10.611 2.186 1.00 0.00 C ATOM 1401 O SER A 85 -3.707 -10.039 1.282 1.00 0.00 O ATOM 1402 CB SER A 85 -4.928 -11.005 3.724 1.00 0.00 C ATOM 1403 OG SER A 85 -5.717 -9.857 4.040 1.00 0.00 O ATOM 0 H SER A 85 -4.085 -8.792 4.166 1.00 0.00 H new ATOM 0 HA SER A 85 -2.960 -11.433 4.068 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.289 -11.457 2.800 1.00 0.00 H new ATOM 0 HB3 SER A 85 -5.036 -11.754 4.509 1.00 0.00 H new ATOM 0 HG SER A 85 -6.656 -10.121 4.132 1.00 0.00 H new ATOM 1409 N ASP A 86 -1.987 -11.194 2.053 1.00 0.00 N ATOM 1410 CA ASP A 86 -1.282 -11.244 0.872 1.00 0.00 C ATOM 1411 C ASP A 86 -1.299 -12.675 0.257 1.00 0.00 C ATOM 1412 O ASP A 86 -1.648 -13.627 0.950 1.00 0.00 O ATOM 1413 CB ASP A 86 0.097 -10.597 1.056 1.00 0.00 C ATOM 1414 CG ASP A 86 1.008 -10.791 -0.037 1.00 0.00 C ATOM 1415 OD1 ASP A 86 0.553 -10.720 -1.176 1.00 0.00 O ATOM 1416 OD2 ASP A 86 2.203 -10.893 0.213 1.00 0.00 O ATOM 0 H ASP A 86 -1.524 -11.681 2.820 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.774 -10.641 0.109 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -0.038 -9.527 1.211 1.00 0.00 H new ATOM 0 HB3 ASP A 86 0.551 -10.996 1.963 1.00 0.00 H new ATOM 1421 N PHE A 87 -0.897 -12.775 -1.016 1.00 0.00 N ATOM 1422 CA PHE A 87 -0.936 -13.835 -1.888 1.00 0.00 C ATOM 1423 C PHE A 87 -2.175 -13.842 -2.766 1.00 0.00 C ATOM 1424 O PHE A 87 -3.151 -14.497 -2.541 1.00 0.00 O ATOM 1425 CB PHE A 87 -0.521 -15.114 -1.332 1.00 0.00 C ATOM 1426 CG PHE A 87 0.914 -15.194 -0.878 1.00 0.00 C ATOM 1427 CD1 PHE A 87 1.926 -15.452 -1.792 1.00 0.00 C ATOM 1428 CD2 PHE A 87 1.250 -15.036 0.457 1.00 0.00 C ATOM 1429 CE1 PHE A 87 3.238 -15.546 -1.383 1.00 0.00 C ATOM 1430 CE2 PHE A 87 2.561 -15.124 0.870 1.00 0.00 C ATOM 1431 CZ PHE A 87 3.557 -15.381 -0.051 1.00 0.00 C ATOM 0 H PHE A 87 -0.484 -11.962 -1.473 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.127 -13.655 -2.595 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -1.165 -15.347 -0.484 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -0.689 -15.887 -2.082 1.00 0.00 H new ATOM 0 HD1 PHE A 87 1.682 -15.581 -2.836 1.00 0.00 H new ATOM 0 HD2 PHE A 87 0.474 -14.841 1.183 1.00 0.00 H new ATOM 0 HE1 PHE A 87 4.016 -15.749 -2.104 1.00 0.00 H new ATOM 0 HE2 PHE A 87 2.810 -14.992 1.913 1.00 0.00 H new ATOM 0 HZ PHE A 87 4.585 -15.453 0.271 1.00 0.00 H new ATOM 1441 N SER A 88 -2.104 -12.975 -3.707 1.00 0.00 N ATOM 1442 CA SER A 88 -3.113 -12.686 -4.683 1.00 0.00 C ATOM 1443 C SER A 88 -3.172 -13.825 -5.647 1.00 0.00 C ATOM 1444 O SER A 88 -4.227 -14.244 -6.119 1.00 0.00 O ATOM 1445 CB SER A 88 -2.767 -11.367 -5.392 1.00 0.00 C ATOM 1446 OG SER A 88 -3.793 -10.948 -6.266 1.00 0.00 O ATOM 0 H SER A 88 -1.274 -12.396 -3.833 1.00 0.00 H new ATOM 0 HA SER A 88 -4.091 -12.569 -4.215 1.00 0.00 H new ATOM 0 HB2 SER A 88 -2.587 -10.592 -4.647 1.00 0.00 H new ATOM 0 HB3 SER A 88 -1.841 -11.490 -5.954 1.00 0.00 H new ATOM 0 HG SER A 88 -3.534 -10.106 -6.695 1.00 0.00 H new ATOM 1452 N ASP A 89 -1.995 -14.349 -5.896 1.00 0.00 N ATOM 1453 CA ASP A 89 -1.765 -15.357 -6.869 1.00 0.00 C ATOM 1454 C ASP A 89 -0.963 -16.406 -6.158 1.00 0.00 C ATOM 1455 O ASP A 89 -0.006 -16.984 -6.666 1.00 0.00 O ATOM 1456 CB ASP A 89 -1.026 -14.741 -8.073 1.00 0.00 C ATOM 1457 CG ASP A 89 -0.803 -15.681 -9.253 1.00 0.00 C ATOM 1458 OD1 ASP A 89 -1.781 -16.224 -9.797 1.00 0.00 O ATOM 1459 OD2 ASP A 89 0.347 -15.829 -9.710 1.00 0.00 O ATOM 0 H ASP A 89 -1.149 -14.066 -5.401 1.00 0.00 H new ATOM 0 HA ASP A 89 -2.677 -15.796 -7.274 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -1.591 -13.876 -8.421 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -0.057 -14.374 -7.734 1.00 0.00 H new ATOM 1464 N GLY A 90 -1.408 -16.637 -4.958 1.00 0.00 N ATOM 1465 CA GLY A 90 -0.742 -17.500 -4.057 1.00 0.00 C ATOM 1466 C GLY A 90 -1.625 -17.939 -2.937 1.00 0.00 C ATOM 1467 O GLY A 90 -1.322 -18.916 -2.240 1.00 0.00 O ATOM 0 H GLY A 90 -2.259 -16.219 -4.582 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -0.380 -18.375 -4.596 1.00 0.00 H new ATOM 0 HA3 GLY A 90 0.132 -16.992 -3.650 1.00 0.00 H new ATOM 1471 N ASP A 91 -2.650 -17.148 -2.727 1.00 0.00 N ATOM 1472 CA ASP A 91 -3.773 -17.386 -1.774 1.00 0.00 C ATOM 1473 C ASP A 91 -3.528 -16.677 -0.483 1.00 0.00 C ATOM 1474 O ASP A 91 -2.504 -16.869 0.150 1.00 0.00 O ATOM 1475 CB ASP A 91 -4.138 -18.858 -1.609 1.00 0.00 C ATOM 1476 CG ASP A 91 -5.108 -19.130 -0.477 1.00 0.00 C ATOM 1477 OD1 ASP A 91 -6.312 -18.827 -0.619 1.00 0.00 O ATOM 1478 OD2 ASP A 91 -4.692 -19.708 0.552 1.00 0.00 O ATOM 0 H ASP A 91 -2.754 -16.267 -3.230 1.00 0.00 H new ATOM 0 HA ASP A 91 -4.669 -16.949 -2.216 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -4.572 -19.221 -2.541 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -3.226 -19.431 -1.438 1.00 0.00 H new ATOM 1483 N ALA A 92 -4.477 -15.866 -0.101 1.00 0.00 N ATOM 1484 CA ALA A 92 -4.282 -14.869 0.919 1.00 0.00 C ATOM 1485 C ALA A 92 -4.211 -15.370 2.351 1.00 0.00 C ATOM 1486 O ALA A 92 -5.219 -15.804 2.948 1.00 0.00 O ATOM 1487 CB ALA A 92 -5.314 -13.769 0.785 1.00 0.00 C ATOM 0 H ALA A 92 -5.419 -15.878 -0.493 1.00 0.00 H new ATOM 0 HA ALA A 92 -3.280 -14.484 0.729 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -5.154 -13.023 1.563 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -5.220 -13.299 -0.194 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -6.313 -14.193 0.889 1.00 0.00 H new ATOM 1493 N LYS A 93 -3.015 -15.299 2.892 1.00 0.00 N ATOM 1494 CA LYS A 93 -2.733 -15.497 4.241 1.00 0.00 C ATOM 1495 C LYS A 93 -2.367 -14.134 4.776 1.00 0.00 C ATOM 1496 O LYS A 93 -1.764 -13.341 4.048 1.00 0.00 O ATOM 1497 CB LYS A 93 -1.499 -16.372 4.404 1.00 0.00 C ATOM 1498 CG LYS A 93 -1.635 -17.857 4.108 1.00 0.00 C ATOM 1499 CD LYS A 93 -1.499 -18.143 2.632 1.00 0.00 C ATOM 1500 CE LYS A 93 -1.670 -19.609 2.327 1.00 0.00 C ATOM 1501 NZ LYS A 93 -3.043 -20.076 2.584 1.00 0.00 N ATOM 0 H LYS A 93 -2.183 -15.087 2.342 1.00 0.00 H new ATOM 0 HA LYS A 93 -3.579 -15.964 4.745 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -0.718 -15.972 3.757 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -1.148 -16.267 5.430 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -0.873 -18.410 4.658 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -2.603 -18.212 4.460 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.243 -17.568 2.080 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -0.520 -17.812 2.286 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -1.415 -19.793 1.283 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -0.972 -20.188 2.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -3.126 -21.076 2.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -3.261 -19.973 3.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -3.713 -19.509 2.026 1.00 0.00 H new ATOM 1515 N LEU A 94 -2.729 -13.819 5.983 1.00 0.00 N ATOM 1516 CA LEU A 94 -2.275 -12.589 6.521 1.00 0.00 C ATOM 1517 C LEU A 94 -0.890 -12.786 7.045 1.00 0.00 C ATOM 1518 O LEU A 94 -0.605 -13.709 7.835 1.00 0.00 O ATOM 1519 CB LEU A 94 -3.273 -11.902 7.484 1.00 0.00 C ATOM 1520 CG LEU A 94 -3.688 -12.632 8.795 1.00 0.00 C ATOM 1521 CD1 LEU A 94 -2.618 -12.552 9.876 1.00 0.00 C ATOM 1522 CD2 LEU A 94 -5.010 -12.090 9.313 1.00 0.00 C ATOM 0 H LEU A 94 -3.321 -14.383 6.593 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.224 -11.845 5.726 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.847 -10.939 7.765 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -4.183 -11.696 6.921 1.00 0.00 H new ATOM 0 HG LEU A 94 -3.807 -13.686 8.545 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -2.961 -13.078 10.767 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -1.699 -13.013 9.514 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -2.427 -11.507 10.122 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.283 -12.613 10.230 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.911 -11.024 9.519 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -5.785 -12.244 8.563 1.00 0.00 H new ATOM 1534 N GLU A 95 -0.046 -11.996 6.537 1.00 0.00 N ATOM 1535 CA GLU A 95 1.285 -12.097 6.684 1.00 0.00 C ATOM 1536 C GLU A 95 1.787 -10.730 6.761 1.00 0.00 C ATOM 1537 O GLU A 95 1.100 -9.755 6.416 1.00 0.00 O ATOM 1538 CB GLU A 95 1.846 -12.885 5.499 1.00 0.00 C ATOM 1539 CG GLU A 95 3.293 -13.337 5.634 1.00 0.00 C ATOM 1540 CD GLU A 95 3.499 -14.283 6.769 1.00 0.00 C ATOM 1541 OE1 GLU A 95 3.591 -13.835 7.907 1.00 0.00 O ATOM 1542 OE2 GLU A 95 3.586 -15.510 6.522 1.00 0.00 O ATOM 0 H GLU A 95 -0.322 -11.201 5.961 1.00 0.00 H new ATOM 0 HA GLU A 95 1.588 -12.635 7.583 1.00 0.00 H new ATOM 0 HB2 GLU A 95 1.222 -13.765 5.344 1.00 0.00 H new ATOM 0 HB3 GLU A 95 1.759 -12.270 4.603 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.608 -13.815 4.706 1.00 0.00 H new ATOM 0 HG3 GLU A 95 3.930 -12.464 5.774 1.00 0.00 H new ATOM 1549 N GLN A 96 2.911 -10.653 7.204 1.00 0.00 N ATOM 1550 CA GLN A 96 3.542 -9.488 7.374 1.00 0.00 C ATOM 1551 C GLN A 96 4.637 -9.481 6.363 1.00 0.00 C ATOM 1552 O GLN A 96 5.529 -10.318 6.382 1.00 0.00 O ATOM 1553 CB GLN A 96 4.091 -9.367 8.793 1.00 0.00 C ATOM 1554 CG GLN A 96 3.017 -9.248 9.854 1.00 0.00 C ATOM 1555 CD GLN A 96 3.553 -9.203 11.269 1.00 0.00 C ATOM 1556 OE1 GLN A 96 4.683 -8.769 11.523 1.00 0.00 O ATOM 1557 NE2 GLN A 96 2.744 -9.613 12.206 1.00 0.00 N ATOM 0 H GLN A 96 3.462 -11.465 7.481 1.00 0.00 H new ATOM 0 HA GLN A 96 2.872 -8.639 7.240 1.00 0.00 H new ATOM 0 HB2 GLN A 96 4.708 -10.239 9.010 1.00 0.00 H new ATOM 0 HB3 GLN A 96 4.742 -8.494 8.848 1.00 0.00 H new ATOM 0 HG2 GLN A 96 2.435 -8.345 9.668 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.334 -10.092 9.762 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.818 -9.965 11.962 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.037 -9.581 13.183 1.00 0.00 H new ATOM 1566 N LEU A 97 4.536 -8.621 5.472 1.00 0.00 N ATOM 1567 CA LEU A 97 5.497 -8.462 4.481 1.00 0.00 C ATOM 1568 C LEU A 97 6.033 -7.080 4.462 1.00 0.00 C ATOM 1569 O LEU A 97 5.355 -6.138 4.842 1.00 0.00 O ATOM 1570 CB LEU A 97 4.960 -8.806 3.143 1.00 0.00 C ATOM 1571 CG LEU A 97 4.900 -10.280 2.775 1.00 0.00 C ATOM 1572 CD1 LEU A 97 3.604 -10.915 3.198 1.00 0.00 C ATOM 1573 CD2 LEU A 97 5.165 -10.481 1.313 1.00 0.00 C ATOM 0 H LEU A 97 3.751 -7.973 5.399 1.00 0.00 H new ATOM 0 HA LEU A 97 6.309 -9.149 4.718 1.00 0.00 H new ATOM 0 HB2 LEU A 97 3.952 -8.398 3.069 1.00 0.00 H new ATOM 0 HB3 LEU A 97 5.566 -8.296 2.395 1.00 0.00 H new ATOM 0 HG LEU A 97 5.691 -10.786 3.328 1.00 0.00 H new ATOM 0 HD11 LEU A 97 3.605 -11.968 2.915 1.00 0.00 H new ATOM 0 HD12 LEU A 97 3.493 -10.830 4.279 1.00 0.00 H new ATOM 0 HD13 LEU A 97 2.773 -10.408 2.707 1.00 0.00 H new ATOM 0 HD21 LEU A 97 5.116 -11.544 1.077 1.00 0.00 H new ATOM 0 HD22 LEU A 97 4.416 -9.945 0.730 1.00 0.00 H new ATOM 0 HD23 LEU A 97 6.156 -10.100 1.067 1.00 0.00 H new ATOM 1585 N ALA A 98 7.215 -6.967 3.985 1.00 0.00 N ATOM 1586 CA ALA A 98 7.926 -5.746 3.980 1.00 0.00 C ATOM 1587 C ALA A 98 8.402 -5.437 2.602 1.00 0.00 C ATOM 1588 O ALA A 98 8.400 -6.303 1.732 1.00 0.00 O ATOM 1589 CB ALA A 98 9.101 -5.838 4.931 1.00 0.00 C ATOM 0 H ALA A 98 7.730 -7.746 3.575 1.00 0.00 H new ATOM 0 HA ALA A 98 7.264 -4.944 4.308 1.00 0.00 H new ATOM 0 HB1 ALA A 98 9.648 -4.895 4.926 1.00 0.00 H new ATOM 0 HB2 ALA A 98 8.738 -6.041 5.939 1.00 0.00 H new ATOM 0 HB3 ALA A 98 9.763 -6.644 4.614 1.00 0.00 H new ATOM 1595 N ALA A 99 8.748 -4.221 2.389 1.00 0.00 N ATOM 1596 CA ALA A 99 9.351 -3.814 1.170 1.00 0.00 C ATOM 1597 C ALA A 99 10.443 -2.861 1.493 1.00 0.00 C ATOM 1598 O ALA A 99 10.381 -2.146 2.505 1.00 0.00 O ATOM 1599 CB ALA A 99 8.357 -3.183 0.215 1.00 0.00 C ATOM 0 H ALA A 99 8.619 -3.468 3.065 1.00 0.00 H new ATOM 0 HA ALA A 99 9.745 -4.694 0.661 1.00 0.00 H new ATOM 0 HB1 ALA A 99 8.869 -2.889 -0.701 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.573 -3.902 -0.022 1.00 0.00 H new ATOM 0 HB3 ALA A 99 7.913 -2.303 0.681 1.00 0.00 H new ATOM 1605 N LYS A 100 11.436 -2.850 0.683 1.00 0.00 N ATOM 1606 CA LYS A 100 12.516 -2.018 0.852 1.00 0.00 C ATOM 1607 C LYS A 100 12.850 -1.504 -0.463 1.00 0.00 C ATOM 1608 O LYS A 100 12.703 -2.172 -1.497 1.00 0.00 O ATOM 1609 CB LYS A 100 13.720 -2.730 1.438 1.00 0.00 C ATOM 1610 CG LYS A 100 14.951 -1.857 1.690 1.00 0.00 C ATOM 1611 CD LYS A 100 16.160 -2.682 2.086 1.00 0.00 C ATOM 1612 CE LYS A 100 17.372 -1.799 2.379 1.00 0.00 C ATOM 1613 NZ LYS A 100 17.674 -0.862 1.267 1.00 0.00 N ATOM 0 H LYS A 100 11.499 -3.451 -0.139 1.00 0.00 H new ATOM 0 HA LYS A 100 12.255 -1.228 1.556 1.00 0.00 H new ATOM 0 HB2 LYS A 100 13.424 -3.189 2.381 1.00 0.00 H new ATOM 0 HB3 LYS A 100 14.003 -3.539 0.765 1.00 0.00 H new ATOM 0 HG2 LYS A 100 15.181 -1.286 0.791 1.00 0.00 H new ATOM 0 HG3 LYS A 100 14.730 -1.137 2.478 1.00 0.00 H new ATOM 0 HD2 LYS A 100 15.922 -3.278 2.967 1.00 0.00 H new ATOM 0 HD3 LYS A 100 16.403 -3.380 1.285 1.00 0.00 H new ATOM 0 HE2 LYS A 100 17.191 -1.230 3.291 1.00 0.00 H new ATOM 0 HE3 LYS A 100 18.241 -2.430 2.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 18.651 -1.012 0.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 17.017 -1.035 0.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 17.566 0.118 1.599 1.00 0.00 H new ATOM 1627 N PHE A 101 13.232 -0.368 -0.414 1.00 0.00 N ATOM 1628 CA PHE A 101 13.674 0.367 -1.530 1.00 0.00 C ATOM 1629 C PHE A 101 15.177 0.490 -1.464 1.00 0.00 C ATOM 1630 O PHE A 101 15.765 0.229 -0.422 1.00 0.00 O ATOM 1631 CB PHE A 101 12.994 1.718 -1.575 1.00 0.00 C ATOM 1632 CG PHE A 101 11.558 1.671 -2.021 1.00 0.00 C ATOM 1633 CD1 PHE A 101 10.533 1.510 -1.107 1.00 0.00 C ATOM 1634 CD2 PHE A 101 11.239 1.798 -3.366 1.00 0.00 C ATOM 1635 CE1 PHE A 101 9.219 1.474 -1.523 1.00 0.00 C ATOM 1636 CE2 PHE A 101 9.927 1.762 -3.788 1.00 0.00 C ATOM 1637 CZ PHE A 101 8.916 1.601 -2.866 1.00 0.00 C ATOM 0 H PHE A 101 13.267 0.163 0.456 1.00 0.00 H new ATOM 0 HA PHE A 101 13.408 -0.150 -2.452 1.00 0.00 H new ATOM 0 HB2 PHE A 101 13.040 2.169 -0.584 1.00 0.00 H new ATOM 0 HB3 PHE A 101 13.551 2.370 -2.248 1.00 0.00 H new ATOM 0 HD1 PHE A 101 10.764 1.411 -0.057 1.00 0.00 H new ATOM 0 HD2 PHE A 101 12.029 1.927 -4.091 1.00 0.00 H new ATOM 0 HE1 PHE A 101 8.427 1.347 -0.800 1.00 0.00 H new ATOM 0 HE2 PHE A 101 9.693 1.860 -4.838 1.00 0.00 H new ATOM 0 HZ PHE A 101 7.887 1.574 -3.192 1.00 0.00 H new ATOM 1647 N LYS A 102 15.776 0.882 -2.565 1.00 0.00 N ATOM 1648 CA LYS A 102 17.233 0.960 -2.722 1.00 0.00 C ATOM 1649 C LYS A 102 17.931 1.702 -1.578 1.00 0.00 C ATOM 1650 O LYS A 102 18.909 1.210 -1.020 1.00 0.00 O ATOM 1651 CB LYS A 102 17.567 1.621 -4.062 1.00 0.00 C ATOM 1652 CG LYS A 102 17.037 0.852 -5.268 1.00 0.00 C ATOM 1653 CD LYS A 102 16.094 1.692 -6.132 1.00 0.00 C ATOM 1654 CE LYS A 102 16.805 2.888 -6.768 1.00 0.00 C ATOM 1655 NZ LYS A 102 15.941 3.637 -7.721 1.00 0.00 N ATOM 0 H LYS A 102 15.264 1.164 -3.401 1.00 0.00 H new ATOM 0 HA LYS A 102 17.611 -0.062 -2.697 1.00 0.00 H new ATOM 0 HB2 LYS A 102 17.154 2.630 -4.074 1.00 0.00 H new ATOM 0 HB3 LYS A 102 18.649 1.719 -4.150 1.00 0.00 H new ATOM 0 HG2 LYS A 102 17.876 0.513 -5.876 1.00 0.00 H new ATOM 0 HG3 LYS A 102 16.512 -0.039 -4.924 1.00 0.00 H new ATOM 0 HD2 LYS A 102 15.668 1.066 -6.916 1.00 0.00 H new ATOM 0 HD3 LYS A 102 15.264 2.047 -5.521 1.00 0.00 H new ATOM 0 HE2 LYS A 102 17.141 3.564 -5.982 1.00 0.00 H new ATOM 0 HE3 LYS A 102 17.696 2.539 -7.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 16.475 4.435 -8.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 15.640 3.003 -8.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 15.103 3.997 -7.221 1.00 0.00 H new ATOM 1669 N THR A 103 17.421 2.858 -1.240 1.00 0.00 N ATOM 1670 CA THR A 103 18.005 3.715 -0.232 1.00 0.00 C ATOM 1671 C THR A 103 16.868 4.337 0.550 1.00 0.00 C ATOM 1672 O THR A 103 15.712 4.253 0.090 1.00 0.00 O ATOM 1673 CB THR A 103 18.744 4.870 -0.936 1.00 0.00 C ATOM 1674 OG1 THR A 103 17.801 5.574 -1.748 1.00 0.00 O ATOM 1675 CG2 THR A 103 19.860 4.366 -1.820 1.00 0.00 C ATOM 0 H THR A 103 16.575 3.240 -1.662 1.00 0.00 H new ATOM 0 HA THR A 103 18.682 3.146 0.406 1.00 0.00 H new ATOM 0 HB THR A 103 19.181 5.516 -0.175 1.00 0.00 H new ATOM 0 HG1 THR A 103 18.272 6.026 -2.479 1.00 0.00 H new ATOM 0 HG21 THR A 103 20.356 5.211 -2.298 1.00 0.00 H new ATOM 0 HG22 THR A 103 20.582 3.816 -1.217 1.00 0.00 H new ATOM 0 HG23 THR A 103 19.449 3.707 -2.585 1.00 0.00 H new ATOM 1683 N PRO A 104 17.134 5.034 1.707 1.00 0.00 N ATOM 1684 CA PRO A 104 16.101 5.780 2.423 1.00 0.00 C ATOM 1685 C PRO A 104 15.565 6.931 1.605 1.00 0.00 C ATOM 1686 O PRO A 104 14.752 7.621 2.013 1.00 0.00 O ATOM 1687 CB PRO A 104 16.774 6.339 3.662 1.00 0.00 C ATOM 1688 CG PRO A 104 18.065 5.618 3.787 1.00 0.00 C ATOM 1689 CD PRO A 104 18.427 5.096 2.414 1.00 0.00 C ATOM 0 HA PRO A 104 15.260 5.125 2.650 1.00 0.00 H new ATOM 0 HB2 PRO A 104 16.934 7.413 3.568 1.00 0.00 H new ATOM 0 HB3 PRO A 104 16.154 6.186 4.545 1.00 0.00 H new ATOM 0 HG2 PRO A 104 18.842 6.284 4.161 1.00 0.00 H new ATOM 0 HG3 PRO A 104 17.979 4.797 4.499 1.00 0.00 H new ATOM 0 HD2 PRO A 104 19.129 5.758 1.907 1.00 0.00 H new ATOM 0 HD3 PRO A 104 18.899 4.115 2.471 1.00 0.00 H new ATOM 1697 N GLU A 105 16.097 7.148 0.501 1.00 0.00 N ATOM 1698 CA GLU A 105 15.589 8.138 -0.401 1.00 0.00 C ATOM 1699 C GLU A 105 14.283 7.622 -0.946 1.00 0.00 C ATOM 1700 O GLU A 105 13.228 8.258 -0.826 1.00 0.00 O ATOM 1701 CB GLU A 105 16.594 8.470 -1.509 1.00 0.00 C ATOM 1702 CG GLU A 105 16.067 9.421 -2.568 1.00 0.00 C ATOM 1703 CD GLU A 105 17.059 9.682 -3.669 1.00 0.00 C ATOM 1704 OE1 GLU A 105 17.342 8.769 -4.464 1.00 0.00 O ATOM 1705 OE2 GLU A 105 17.531 10.828 -3.800 1.00 0.00 O ATOM 0 H GLU A 105 16.918 6.650 0.158 1.00 0.00 H new ATOM 0 HA GLU A 105 15.424 9.079 0.123 1.00 0.00 H new ATOM 0 HB2 GLU A 105 17.484 8.907 -1.056 1.00 0.00 H new ATOM 0 HB3 GLU A 105 16.904 7.543 -1.992 1.00 0.00 H new ATOM 0 HG2 GLU A 105 15.155 9.007 -2.999 1.00 0.00 H new ATOM 0 HG3 GLU A 105 15.797 10.367 -2.098 1.00 0.00 H new ATOM 1712 N LEU A 106 14.367 6.416 -1.464 1.00 0.00 N ATOM 1713 CA LEU A 106 13.257 5.752 -2.062 1.00 0.00 C ATOM 1714 C LEU A 106 12.348 5.268 -0.976 1.00 0.00 C ATOM 1715 O LEU A 106 11.139 5.478 -0.992 1.00 0.00 O ATOM 1716 CB LEU A 106 13.730 4.612 -2.987 1.00 0.00 C ATOM 1717 CG LEU A 106 14.348 4.988 -4.343 1.00 0.00 C ATOM 1718 CD1 LEU A 106 13.446 5.927 -5.122 1.00 0.00 C ATOM 1719 CD2 LEU A 106 15.746 5.552 -4.196 1.00 0.00 C ATOM 0 H LEU A 106 15.229 5.870 -1.476 1.00 0.00 H new ATOM 0 HA LEU A 106 12.702 6.444 -2.695 1.00 0.00 H new ATOM 0 HB2 LEU A 106 14.464 4.021 -2.439 1.00 0.00 H new ATOM 0 HB3 LEU A 106 12.876 3.962 -3.179 1.00 0.00 H new ATOM 0 HG LEU A 106 14.439 4.067 -4.918 1.00 0.00 H new ATOM 0 HD11 LEU A 106 13.913 6.173 -6.076 1.00 0.00 H new ATOM 0 HD12 LEU A 106 12.486 5.443 -5.302 1.00 0.00 H new ATOM 0 HD13 LEU A 106 13.290 6.841 -4.548 1.00 0.00 H new ATOM 0 HD21 LEU A 106 16.142 5.803 -5.180 1.00 0.00 H new ATOM 0 HD22 LEU A 106 15.713 6.449 -3.578 1.00 0.00 H new ATOM 0 HD23 LEU A 106 16.390 4.810 -3.724 1.00 0.00 H new ATOM 1731 N ALA A 107 12.978 4.705 0.005 1.00 0.00 N ATOM 1732 CA ALA A 107 12.343 4.136 1.144 1.00 0.00 C ATOM 1733 C ALA A 107 11.686 5.223 2.019 1.00 0.00 C ATOM 1734 O ALA A 107 10.547 5.037 2.473 1.00 0.00 O ATOM 1735 CB ALA A 107 13.395 3.342 1.892 1.00 0.00 C ATOM 0 H ALA A 107 13.995 4.627 0.032 1.00 0.00 H new ATOM 0 HA ALA A 107 11.529 3.474 0.847 1.00 0.00 H new ATOM 0 HB1 ALA A 107 12.948 2.887 2.776 1.00 0.00 H new ATOM 0 HB2 ALA A 107 13.791 2.561 1.243 1.00 0.00 H new ATOM 0 HB3 ALA A 107 14.204 4.006 2.196 1.00 0.00 H new ATOM 1741 N GLU A 108 12.357 6.381 2.230 1.00 0.00 N ATOM 1742 CA GLU A 108 11.714 7.418 3.108 1.00 0.00 C ATOM 1743 C GLU A 108 10.514 8.070 2.421 1.00 0.00 C ATOM 1744 O GLU A 108 9.440 8.204 3.014 1.00 0.00 O ATOM 1745 CB GLU A 108 12.724 8.485 3.584 1.00 0.00 C ATOM 1746 CG GLU A 108 12.153 9.638 4.413 1.00 0.00 C ATOM 1747 CD GLU A 108 11.763 9.248 5.802 1.00 0.00 C ATOM 1748 OE1 GLU A 108 10.900 8.393 5.978 1.00 0.00 O ATOM 1749 OE2 GLU A 108 12.321 9.808 6.763 1.00 0.00 O ATOM 0 H GLU A 108 13.270 6.621 1.845 1.00 0.00 H new ATOM 0 HA GLU A 108 11.352 6.896 3.994 1.00 0.00 H new ATOM 0 HB2 GLU A 108 13.494 7.988 4.174 1.00 0.00 H new ATOM 0 HB3 GLU A 108 13.216 8.905 2.707 1.00 0.00 H new ATOM 0 HG2 GLU A 108 12.893 10.437 4.464 1.00 0.00 H new ATOM 0 HG3 GLU A 108 11.280 10.044 3.901 1.00 0.00 H new ATOM 1756 N GLU A 109 10.691 8.394 1.153 1.00 0.00 N ATOM 1757 CA GLU A 109 9.688 9.129 0.365 1.00 0.00 C ATOM 1758 C GLU A 109 8.405 8.360 0.299 1.00 0.00 C ATOM 1759 O GLU A 109 7.296 8.899 0.489 1.00 0.00 O ATOM 1760 CB GLU A 109 10.193 9.236 -1.042 1.00 0.00 C ATOM 1761 CG GLU A 109 9.628 10.411 -1.823 1.00 0.00 C ATOM 1762 CD GLU A 109 9.805 11.721 -1.094 1.00 0.00 C ATOM 1763 OE1 GLU A 109 10.913 12.292 -1.126 1.00 0.00 O ATOM 1764 OE2 GLU A 109 8.841 12.210 -0.484 1.00 0.00 O ATOM 0 H GLU A 109 11.534 8.159 0.629 1.00 0.00 H new ATOM 0 HA GLU A 109 9.521 10.102 0.828 1.00 0.00 H new ATOM 0 HB2 GLU A 109 11.280 9.319 -1.020 1.00 0.00 H new ATOM 0 HB3 GLU A 109 9.954 8.314 -1.572 1.00 0.00 H new ATOM 0 HG2 GLU A 109 10.119 10.469 -2.794 1.00 0.00 H new ATOM 0 HG3 GLU A 109 8.568 10.243 -2.012 1.00 0.00 H new ATOM 1771 N PHE A 110 8.563 7.107 0.037 1.00 0.00 N ATOM 1772 CA PHE A 110 7.489 6.219 -0.075 1.00 0.00 C ATOM 1773 C PHE A 110 6.770 5.958 1.242 1.00 0.00 C ATOM 1774 O PHE A 110 5.565 5.817 1.229 1.00 0.00 O ATOM 1775 CB PHE A 110 7.943 4.957 -0.723 1.00 0.00 C ATOM 1776 CG PHE A 110 7.734 4.912 -2.196 1.00 0.00 C ATOM 1777 CD1 PHE A 110 8.690 5.393 -3.066 1.00 0.00 C ATOM 1778 CD2 PHE A 110 6.570 4.366 -2.715 1.00 0.00 C ATOM 1779 CE1 PHE A 110 8.492 5.333 -4.424 1.00 0.00 C ATOM 1780 CE2 PHE A 110 6.364 4.304 -4.073 1.00 0.00 C ATOM 1781 CZ PHE A 110 7.326 4.786 -4.929 1.00 0.00 C ATOM 0 H PHE A 110 9.475 6.674 -0.107 1.00 0.00 H new ATOM 0 HA PHE A 110 6.742 6.696 -0.709 1.00 0.00 H new ATOM 0 HB2 PHE A 110 9.004 4.817 -0.514 1.00 0.00 H new ATOM 0 HB3 PHE A 110 7.415 4.119 -0.268 1.00 0.00 H new ATOM 0 HD1 PHE A 110 9.602 5.820 -2.676 1.00 0.00 H new ATOM 0 HD2 PHE A 110 5.815 3.984 -2.044 1.00 0.00 H new ATOM 0 HE1 PHE A 110 9.246 5.713 -5.097 1.00 0.00 H new ATOM 0 HE2 PHE A 110 5.452 3.879 -4.465 1.00 0.00 H new ATOM 0 HZ PHE A 110 7.171 4.738 -5.997 1.00 0.00 H new ATOM 1791 N LYS A 111 7.495 5.930 2.370 1.00 0.00 N ATOM 1792 CA LYS A 111 6.864 5.700 3.697 1.00 0.00 C ATOM 1793 C LYS A 111 5.854 6.775 3.950 1.00 0.00 C ATOM 1794 O LYS A 111 4.692 6.524 4.258 1.00 0.00 O ATOM 1795 CB LYS A 111 7.886 5.816 4.808 1.00 0.00 C ATOM 1796 CG LYS A 111 7.358 5.368 6.181 1.00 0.00 C ATOM 1797 CD LYS A 111 8.360 5.634 7.295 1.00 0.00 C ATOM 1798 CE LYS A 111 8.590 7.123 7.501 1.00 0.00 C ATOM 1799 NZ LYS A 111 7.401 7.830 8.035 1.00 0.00 N ATOM 0 H LYS A 111 8.506 6.061 2.401 1.00 0.00 H new ATOM 0 HA LYS A 111 6.419 4.705 3.686 1.00 0.00 H new ATOM 0 HB2 LYS A 111 8.759 5.216 4.551 1.00 0.00 H new ATOM 0 HB3 LYS A 111 8.219 6.851 4.877 1.00 0.00 H new ATOM 0 HG2 LYS A 111 6.427 5.891 6.399 1.00 0.00 H new ATOM 0 HG3 LYS A 111 7.126 4.304 6.150 1.00 0.00 H new ATOM 0 HD2 LYS A 111 7.999 5.190 8.223 1.00 0.00 H new ATOM 0 HD3 LYS A 111 9.307 5.149 7.056 1.00 0.00 H new ATOM 0 HE2 LYS A 111 9.426 7.263 8.186 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.877 7.574 6.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 7.355 8.787 7.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 6.541 7.304 7.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 7.472 7.896 9.070 1.00 0.00 H new ATOM 1813 N GLN A 112 6.343 7.972 3.797 1.00 0.00 N ATOM 1814 CA GLN A 112 5.590 9.207 3.983 1.00 0.00 C ATOM 1815 C GLN A 112 4.345 9.212 3.145 1.00 0.00 C ATOM 1816 O GLN A 112 3.259 9.472 3.641 1.00 0.00 O ATOM 1817 CB GLN A 112 6.416 10.328 3.472 1.00 0.00 C ATOM 1818 CG GLN A 112 7.733 10.562 4.211 1.00 0.00 C ATOM 1819 CD GLN A 112 7.527 10.970 5.659 1.00 0.00 C ATOM 1820 OE1 GLN A 112 7.473 10.135 6.564 1.00 0.00 O ATOM 1821 NE2 GLN A 112 7.409 12.245 5.887 1.00 0.00 N ATOM 0 H GLN A 112 7.314 8.135 3.529 1.00 0.00 H new ATOM 0 HA GLN A 112 5.340 9.297 5.040 1.00 0.00 H new ATOM 0 HB2 GLN A 112 6.637 10.144 2.420 1.00 0.00 H new ATOM 0 HB3 GLN A 112 5.825 11.243 3.519 1.00 0.00 H new ATOM 0 HG2 GLN A 112 8.332 9.652 4.176 1.00 0.00 H new ATOM 0 HG3 GLN A 112 8.301 11.337 3.697 1.00 0.00 H new ATOM 0 HE21 GLN A 112 7.459 12.908 5.114 1.00 0.00 H new ATOM 0 HE22 GLN A 112 7.267 12.582 6.839 1.00 0.00 H new ATOM 1830 N LYS A 113 4.531 8.918 1.868 1.00 0.00 N ATOM 1831 CA LYS A 113 3.462 8.940 0.890 1.00 0.00 C ATOM 1832 C LYS A 113 2.479 7.878 1.227 1.00 0.00 C ATOM 1833 O LYS A 113 1.278 8.048 1.091 1.00 0.00 O ATOM 1834 CB LYS A 113 4.032 8.632 -0.478 1.00 0.00 C ATOM 1835 CG LYS A 113 3.126 9.050 -1.636 1.00 0.00 C ATOM 1836 CD LYS A 113 3.757 8.756 -2.990 1.00 0.00 C ATOM 1837 CE LYS A 113 2.881 9.270 -4.128 1.00 0.00 C ATOM 1838 NZ LYS A 113 3.540 9.155 -5.454 1.00 0.00 N ATOM 0 H LYS A 113 5.437 8.655 1.481 1.00 0.00 H new ATOM 0 HA LYS A 113 2.986 9.921 0.892 1.00 0.00 H new ATOM 0 HB2 LYS A 113 4.993 9.135 -0.582 1.00 0.00 H new ATOM 0 HB3 LYS A 113 4.224 7.561 -0.548 1.00 0.00 H new ATOM 0 HG2 LYS A 113 2.174 8.525 -1.559 1.00 0.00 H new ATOM 0 HG3 LYS A 113 2.910 10.116 -1.561 1.00 0.00 H new ATOM 0 HD2 LYS A 113 4.741 9.222 -3.045 1.00 0.00 H new ATOM 0 HD3 LYS A 113 3.907 7.682 -3.099 1.00 0.00 H new ATOM 0 HE2 LYS A 113 1.945 8.711 -4.142 1.00 0.00 H new ATOM 0 HE3 LYS A 113 2.626 10.313 -3.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 2.902 9.518 -6.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 4.420 9.710 -5.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 3.760 8.157 -5.647 1.00 0.00 H new ATOM 1852 N PHE A 114 3.012 6.793 1.684 1.00 0.00 N ATOM 1853 CA PHE A 114 2.190 5.604 1.998 1.00 0.00 C ATOM 1854 C PHE A 114 1.241 5.897 3.152 1.00 0.00 C ATOM 1855 O PHE A 114 0.022 5.755 3.007 1.00 0.00 O ATOM 1856 CB PHE A 114 3.067 4.382 2.342 1.00 0.00 C ATOM 1857 CG PHE A 114 2.311 3.071 2.470 1.00 0.00 C ATOM 1858 CD1 PHE A 114 1.621 2.740 3.626 1.00 0.00 C ATOM 1859 CD2 PHE A 114 2.302 2.176 1.429 1.00 0.00 C ATOM 1860 CE1 PHE A 114 0.942 1.548 3.730 1.00 0.00 C ATOM 1861 CE2 PHE A 114 1.626 0.979 1.523 1.00 0.00 C ATOM 1862 CZ PHE A 114 0.946 0.664 2.674 1.00 0.00 C ATOM 0 H PHE A 114 4.010 6.676 1.858 1.00 0.00 H new ATOM 0 HA PHE A 114 1.609 5.367 1.107 1.00 0.00 H new ATOM 0 HB2 PHE A 114 3.830 4.271 1.571 1.00 0.00 H new ATOM 0 HB3 PHE A 114 3.587 4.578 3.280 1.00 0.00 H new ATOM 0 HD1 PHE A 114 1.616 3.429 4.458 1.00 0.00 H new ATOM 0 HD2 PHE A 114 2.834 2.414 0.520 1.00 0.00 H new ATOM 0 HE1 PHE A 114 0.408 1.306 4.637 1.00 0.00 H new ATOM 0 HE2 PHE A 114 1.631 0.289 0.692 1.00 0.00 H new ATOM 0 HZ PHE A 114 0.416 -0.274 2.751 1.00 0.00 H new ATOM 1872 N GLU A 115 1.786 6.366 4.261 1.00 0.00 N ATOM 1873 CA GLU A 115 0.977 6.688 5.423 1.00 0.00 C ATOM 1874 C GLU A 115 0.089 7.894 5.142 1.00 0.00 C ATOM 1875 O GLU A 115 -1.019 7.996 5.678 1.00 0.00 O ATOM 1876 CB GLU A 115 1.850 6.900 6.663 1.00 0.00 C ATOM 1877 CG GLU A 115 2.906 7.977 6.528 1.00 0.00 C ATOM 1878 CD GLU A 115 3.719 8.119 7.773 1.00 0.00 C ATOM 1879 OE1 GLU A 115 3.278 8.823 8.702 1.00 0.00 O ATOM 1880 OE2 GLU A 115 4.803 7.515 7.873 1.00 0.00 O ATOM 0 H GLU A 115 2.785 6.532 4.381 1.00 0.00 H new ATOM 0 HA GLU A 115 0.325 5.840 5.632 1.00 0.00 H new ATOM 0 HB2 GLU A 115 1.204 7.150 7.505 1.00 0.00 H new ATOM 0 HB3 GLU A 115 2.342 5.959 6.907 1.00 0.00 H new ATOM 0 HG2 GLU A 115 3.562 7.739 5.691 1.00 0.00 H new ATOM 0 HG3 GLU A 115 2.427 8.928 6.297 1.00 0.00 H new ATOM 1887 N GLU A 116 0.571 8.796 4.277 1.00 0.00 N ATOM 1888 CA GLU A 116 -0.171 9.960 3.900 1.00 0.00 C ATOM 1889 C GLU A 116 -1.426 9.539 3.202 1.00 0.00 C ATOM 1890 O GLU A 116 -2.502 9.954 3.577 1.00 0.00 O ATOM 1891 CB GLU A 116 0.603 10.879 2.979 1.00 0.00 C ATOM 1892 CG GLU A 116 0.067 12.298 2.973 1.00 0.00 C ATOM 1893 CD GLU A 116 0.404 12.987 4.272 1.00 0.00 C ATOM 1894 OE1 GLU A 116 1.517 13.541 4.377 1.00 0.00 O ATOM 1895 OE2 GLU A 116 -0.386 12.942 5.220 1.00 0.00 O ATOM 0 H GLU A 116 1.486 8.721 3.832 1.00 0.00 H new ATOM 0 HA GLU A 116 -0.387 10.510 4.816 1.00 0.00 H new ATOM 0 HB2 GLU A 116 1.650 10.893 3.283 1.00 0.00 H new ATOM 0 HB3 GLU A 116 0.571 10.480 1.965 1.00 0.00 H new ATOM 0 HG2 GLU A 116 0.494 12.852 2.137 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -1.013 12.286 2.829 1.00 0.00 H new ATOM 1902 N CYS A 117 -1.282 8.669 2.206 1.00 0.00 N ATOM 1903 CA CYS A 117 -2.352 8.157 1.499 1.00 0.00 C ATOM 1904 C CYS A 117 -3.303 7.423 2.411 1.00 0.00 C ATOM 1905 O CYS A 117 -4.501 7.502 2.227 1.00 0.00 O ATOM 1906 CB CYS A 117 -1.841 7.275 0.437 1.00 0.00 C ATOM 1907 SG CYS A 117 -0.999 8.115 -0.931 1.00 0.00 S ATOM 0 H CYS A 117 -0.376 8.319 1.894 1.00 0.00 H new ATOM 0 HA CYS A 117 -2.914 8.974 1.047 1.00 0.00 H new ATOM 0 HB2 CYS A 117 -1.150 6.560 0.883 1.00 0.00 H new ATOM 0 HB3 CYS A 117 -2.675 6.702 0.031 1.00 0.00 H new ATOM 0 HG CYS A 117 0.231 8.366 -0.595 1.00 0.00 H new ATOM 1913 N GLN A 118 -2.769 6.747 3.433 1.00 0.00 N ATOM 1914 CA GLN A 118 -3.622 6.052 4.368 1.00 0.00 C ATOM 1915 C GLN A 118 -4.526 7.055 5.051 1.00 0.00 C ATOM 1916 O GLN A 118 -5.713 6.841 5.151 1.00 0.00 O ATOM 1917 CB GLN A 118 -2.820 5.326 5.457 1.00 0.00 C ATOM 1918 CG GLN A 118 -1.927 4.204 4.999 1.00 0.00 C ATOM 1919 CD GLN A 118 -1.076 3.647 6.138 1.00 0.00 C ATOM 1920 OE1 GLN A 118 0.020 4.099 6.390 1.00 0.00 O ATOM 1921 NE2 GLN A 118 -1.570 2.671 6.829 1.00 0.00 N ATOM 0 H GLN A 118 -1.769 6.674 3.622 1.00 0.00 H new ATOM 0 HA GLN A 118 -4.190 5.313 3.803 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -2.205 6.062 5.975 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -3.522 4.926 6.188 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -2.537 3.405 4.578 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -1.276 4.562 4.202 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -2.494 2.303 6.603 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -1.035 2.270 7.600 1.00 0.00 H new ATOM 1930 N ARG A 119 -3.938 8.133 5.548 1.00 0.00 N ATOM 1931 CA ARG A 119 -4.698 9.147 6.260 1.00 0.00 C ATOM 1932 C ARG A 119 -5.594 9.982 5.379 1.00 0.00 C ATOM 1933 O ARG A 119 -6.762 10.195 5.632 1.00 0.00 O ATOM 1934 CB ARG A 119 -3.764 10.084 6.964 1.00 0.00 C ATOM 1935 CG ARG A 119 -2.742 9.436 7.848 1.00 0.00 C ATOM 1936 CD ARG A 119 -3.306 8.446 8.839 1.00 0.00 C ATOM 1937 NE ARG A 119 -2.238 7.955 9.710 1.00 0.00 N ATOM 1938 CZ ARG A 119 -2.386 7.223 10.818 1.00 0.00 C ATOM 1939 NH1 ARG A 119 -3.573 6.748 11.178 1.00 0.00 N ATOM 1940 NH2 ARG A 119 -1.326 6.966 11.565 1.00 0.00 N ATOM 0 H ARG A 119 -2.940 8.327 5.471 1.00 0.00 H new ATOM 0 HA ARG A 119 -5.332 8.595 6.954 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -3.244 10.681 6.215 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -4.355 10.773 7.567 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -2.010 8.926 7.222 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -2.208 10.213 8.395 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -4.086 8.919 9.436 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -3.769 7.613 8.311 1.00 0.00 H new ATOM 0 HE ARG A 119 -1.283 8.196 9.444 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -4.394 6.940 10.604 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -3.663 6.191 12.028 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -0.411 7.325 11.293 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -1.423 6.409 12.414 1.00 0.00 H new ATOM 1954 N LEU A 120 -5.003 10.434 4.391 1.00 0.00 N ATOM 1955 CA LEU A 120 -5.549 11.402 3.463 1.00 0.00 C ATOM 1956 C LEU A 120 -6.564 10.932 2.452 1.00 0.00 C ATOM 1957 O LEU A 120 -7.618 11.548 2.323 1.00 0.00 O ATOM 1958 CB LEU A 120 -4.479 12.357 2.885 1.00 0.00 C ATOM 1959 CG LEU A 120 -4.184 13.638 3.692 1.00 0.00 C ATOM 1960 CD1 LEU A 120 -3.650 13.328 5.076 1.00 0.00 C ATOM 1961 CD2 LEU A 120 -3.223 14.540 2.935 1.00 0.00 C ATOM 0 H LEU A 120 -4.054 10.148 4.149 1.00 0.00 H new ATOM 0 HA LEU A 120 -6.192 11.991 4.118 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -3.548 11.800 2.779 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -4.791 12.651 1.883 1.00 0.00 H new ATOM 0 HG LEU A 120 -5.130 14.164 3.821 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -3.456 14.259 5.608 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -4.385 12.741 5.627 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -2.724 12.760 4.990 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.028 15.438 3.522 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -2.287 14.010 2.761 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -3.664 14.820 1.978 1.00 0.00 H new ATOM 1973 N LEU A 121 -6.297 9.801 1.821 1.00 0.00 N ATOM 1974 CA LEU A 121 -7.090 9.281 0.680 1.00 0.00 C ATOM 1975 C LEU A 121 -8.542 8.983 1.076 1.00 0.00 C ATOM 1976 O LEU A 121 -9.448 8.913 0.264 1.00 0.00 O ATOM 1977 CB LEU A 121 -6.366 8.091 0.013 1.00 0.00 C ATOM 1978 CG LEU A 121 -6.998 7.464 -1.228 1.00 0.00 C ATOM 1979 CD1 LEU A 121 -7.160 8.482 -2.343 1.00 0.00 C ATOM 1980 CD2 LEU A 121 -6.142 6.317 -1.707 1.00 0.00 C ATOM 0 H LEU A 121 -5.516 9.197 2.078 1.00 0.00 H new ATOM 0 HA LEU A 121 -7.162 10.062 -0.077 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -5.362 8.420 -0.255 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -6.255 7.307 0.762 1.00 0.00 H new ATOM 0 HG LEU A 121 -7.989 7.100 -0.957 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -7.613 8.002 -3.211 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -7.801 9.295 -2.003 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -6.183 8.880 -2.617 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -6.594 5.871 -2.593 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -5.146 6.685 -1.954 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -6.067 5.566 -0.920 1.00 0.00 H new ATOM 1992 N LEU A 122 -8.703 8.835 2.323 1.00 0.00 N ATOM 1993 CA LEU A 122 -9.928 8.501 2.987 1.00 0.00 C ATOM 1994 C LEU A 122 -11.037 9.540 2.909 1.00 0.00 C ATOM 1995 O LEU A 122 -12.202 9.207 2.660 1.00 0.00 O ATOM 1996 CB LEU A 122 -9.541 8.610 4.382 1.00 0.00 C ATOM 1997 CG LEU A 122 -8.632 7.529 4.958 1.00 0.00 C ATOM 1998 CD1 LEU A 122 -8.482 7.725 6.458 1.00 0.00 C ATOM 1999 CD2 LEU A 122 -9.172 6.133 4.652 1.00 0.00 C ATOM 0 H LEU A 122 -7.929 8.950 2.978 1.00 0.00 H new ATOM 0 HA LEU A 122 -10.298 7.566 2.566 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -9.045 9.571 4.517 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -10.452 8.635 4.981 1.00 0.00 H new ATOM 0 HG LEU A 122 -7.653 7.617 4.487 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -7.832 6.950 6.863 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -8.046 8.704 6.655 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -9.461 7.662 6.933 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -8.503 5.383 5.075 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -10.164 6.023 5.090 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -9.235 5.996 3.573 1.00 0.00 H new ATOM 2011 N ASP A 123 -10.686 10.783 3.086 1.00 0.00 N ATOM 2012 CA ASP A 123 -11.702 11.825 3.294 1.00 0.00 C ATOM 2013 C ASP A 123 -12.079 12.428 1.997 1.00 0.00 C ATOM 2014 O ASP A 123 -13.119 13.058 1.840 1.00 0.00 O ATOM 2015 CB ASP A 123 -11.133 12.902 4.211 1.00 0.00 C ATOM 2016 CG ASP A 123 -12.148 13.927 4.654 1.00 0.00 C ATOM 2017 OD1 ASP A 123 -12.999 13.604 5.499 1.00 0.00 O ATOM 2018 OD2 ASP A 123 -12.101 15.089 4.184 1.00 0.00 O ATOM 0 H ASP A 123 -9.722 11.115 3.094 1.00 0.00 H new ATOM 0 HA ASP A 123 -12.587 11.382 3.750 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -10.704 12.425 5.092 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -10.318 13.411 3.696 1.00 0.00 H new ATOM 2023 N ILE A 124 -11.267 12.175 1.069 1.00 0.00 N ATOM 2024 CA ILE A 124 -11.350 12.764 -0.185 1.00 0.00 C ATOM 2025 C ILE A 124 -11.737 11.722 -1.238 1.00 0.00 C ATOM 2026 O ILE A 124 -11.364 10.562 -1.111 1.00 0.00 O ATOM 2027 CB ILE A 124 -9.999 13.467 -0.482 1.00 0.00 C ATOM 2028 CG1 ILE A 124 -8.770 12.536 -0.246 1.00 0.00 C ATOM 2029 CG2 ILE A 124 -9.863 14.736 0.335 1.00 0.00 C ATOM 2030 CD1 ILE A 124 -8.412 11.723 -1.471 1.00 0.00 C ATOM 0 H ILE A 124 -10.490 11.521 1.167 1.00 0.00 H new ATOM 0 HA ILE A 124 -12.135 13.519 -0.213 1.00 0.00 H new ATOM 0 HB ILE A 124 -10.007 13.722 -1.542 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -7.912 13.141 0.048 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -8.984 11.862 0.583 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -8.909 15.212 0.111 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -10.676 15.418 0.086 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -9.906 14.492 1.396 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -7.550 11.093 -1.251 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -9.258 11.095 -1.751 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -8.170 12.394 -2.295 1.00 0.00 H new ATOM 2042 N PRO A 125 -12.573 12.069 -2.208 1.00 0.00 N ATOM 2043 CA PRO A 125 -12.904 11.160 -3.300 1.00 0.00 C ATOM 2044 C PRO A 125 -11.686 10.980 -4.201 1.00 0.00 C ATOM 2045 O PRO A 125 -10.875 11.910 -4.346 1.00 0.00 O ATOM 2046 CB PRO A 125 -14.035 11.884 -4.055 1.00 0.00 C ATOM 2047 CG PRO A 125 -14.483 12.975 -3.139 1.00 0.00 C ATOM 2048 CD PRO A 125 -13.282 13.346 -2.327 1.00 0.00 C ATOM 0 HA PRO A 125 -13.200 10.167 -2.962 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -13.680 12.287 -5.003 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -14.854 11.202 -4.285 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -14.853 13.831 -3.703 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -15.298 12.638 -2.499 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -12.675 14.103 -2.823 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -13.559 13.749 -1.353 1.00 0.00 H new ATOM 2056 N LEU A 126 -11.526 9.821 -4.793 1.00 0.00 N ATOM 2057 CA LEU A 126 -10.393 9.613 -5.643 1.00 0.00 C ATOM 2058 C LEU A 126 -10.649 10.168 -7.016 1.00 0.00 C ATOM 2059 O LEU A 126 -11.310 9.544 -7.855 1.00 0.00 O ATOM 2060 CB LEU A 126 -9.969 8.171 -5.710 1.00 0.00 C ATOM 2061 CG LEU A 126 -8.711 7.911 -6.543 1.00 0.00 C ATOM 2062 CD1 LEU A 126 -7.583 8.874 -6.170 1.00 0.00 C ATOM 2063 CD2 LEU A 126 -8.254 6.541 -6.282 1.00 0.00 C ATOM 0 H LEU A 126 -12.156 9.024 -4.701 1.00 0.00 H new ATOM 0 HA LEU A 126 -9.560 10.157 -5.197 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -9.798 7.810 -4.696 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -10.789 7.584 -6.123 1.00 0.00 H new ATOM 0 HG LEU A 126 -8.958 8.057 -7.594 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -6.706 8.661 -6.781 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -7.907 9.900 -6.346 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -7.331 8.749 -5.117 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -7.358 6.339 -6.868 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -8.027 6.429 -5.222 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -9.037 5.837 -6.562 1.00 0.00 H new ATOM 2075 N GLN A 127 -10.196 11.364 -7.203 1.00 0.00 N ATOM 2076 CA GLN A 127 -10.311 12.073 -8.435 1.00 0.00 C ATOM 2077 C GLN A 127 -8.922 12.478 -8.858 1.00 0.00 C ATOM 2078 O GLN A 127 -7.970 12.343 -8.079 1.00 0.00 O ATOM 2079 CB GLN A 127 -11.131 13.342 -8.216 1.00 0.00 C ATOM 2080 CG GLN A 127 -12.501 13.106 -7.616 1.00 0.00 C ATOM 2081 CD GLN A 127 -13.255 14.395 -7.334 1.00 0.00 C ATOM 2082 OE1 GLN A 127 -14.058 14.460 -6.410 1.00 0.00 O ATOM 2083 NE2 GLN A 127 -13.010 15.420 -8.116 1.00 0.00 N ATOM 0 H GLN A 127 -9.718 11.894 -6.475 1.00 0.00 H new ATOM 0 HA GLN A 127 -10.793 11.449 -9.188 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -10.572 14.013 -7.563 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -11.249 13.853 -9.172 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -13.088 12.489 -8.296 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -12.394 12.544 -6.688 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -12.335 15.332 -8.876 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -13.494 16.305 -7.964 1.00 0.00 H new ATOM 2092 N THR A 128 -8.797 12.963 -10.050 1.00 0.00 N ATOM 2093 CA THR A 128 -7.565 13.509 -10.505 1.00 0.00 C ATOM 2094 C THR A 128 -7.560 14.967 -10.043 1.00 0.00 C ATOM 2095 O THR A 128 -8.495 15.709 -10.354 1.00 0.00 O ATOM 2096 CB THR A 128 -7.481 13.400 -12.045 1.00 0.00 C ATOM 2097 OG1 THR A 128 -7.628 12.004 -12.413 1.00 0.00 O ATOM 2098 CG2 THR A 128 -6.150 13.932 -12.572 1.00 0.00 C ATOM 0 H THR A 128 -9.551 12.991 -10.737 1.00 0.00 H new ATOM 0 HA THR A 128 -6.702 12.976 -10.106 1.00 0.00 H new ATOM 0 HB THR A 128 -8.275 14.003 -12.486 1.00 0.00 H new ATOM 0 HG1 THR A 128 -7.579 11.916 -13.388 1.00 0.00 H new ATOM 0 HG21 THR A 128 -6.126 13.840 -13.658 1.00 0.00 H new ATOM 0 HG22 THR A 128 -6.042 14.980 -12.294 1.00 0.00 H new ATOM 0 HG23 THR A 128 -5.331 13.356 -12.141 1.00 0.00 H new ATOM 2106 N PRO A 129 -6.554 15.384 -9.252 1.00 0.00 N ATOM 2107 CA PRO A 129 -6.537 16.704 -8.649 1.00 0.00 C ATOM 2108 C PRO A 129 -6.567 17.831 -9.667 1.00 0.00 C ATOM 2109 O PRO A 129 -5.790 17.869 -10.646 1.00 0.00 O ATOM 2110 CB PRO A 129 -5.248 16.729 -7.840 1.00 0.00 C ATOM 2111 CG PRO A 129 -4.417 15.711 -8.483 1.00 0.00 C ATOM 2112 CD PRO A 129 -5.354 14.625 -8.905 1.00 0.00 C ATOM 0 HA PRO A 129 -7.428 16.869 -8.043 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -4.775 17.710 -7.871 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -5.429 16.495 -6.791 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -3.886 16.124 -9.341 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -3.663 15.330 -7.795 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -4.969 14.059 -9.753 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -5.540 13.911 -8.103 1.00 0.00 H new ATOM 2120 N LYS A 130 -7.452 18.716 -9.424 1.00 0.00 N ATOM 2121 CA LYS A 130 -7.680 19.871 -10.224 1.00 0.00 C ATOM 2122 C LYS A 130 -8.333 20.858 -9.288 1.00 0.00 C ATOM 2123 O LYS A 130 -7.627 21.624 -8.645 1.00 0.00 O ATOM 2124 CB LYS A 130 -8.616 19.530 -11.432 1.00 0.00 C ATOM 2125 CG LYS A 130 -8.633 20.558 -12.584 1.00 0.00 C ATOM 2126 CD LYS A 130 -9.299 21.897 -12.249 1.00 0.00 C ATOM 2127 CE LYS A 130 -10.828 21.816 -12.193 1.00 0.00 C ATOM 2128 NZ LYS A 130 -11.352 20.980 -11.090 1.00 0.00 N ATOM 2129 OXT LYS A 130 -9.560 20.804 -9.123 1.00 0.00 O ATOM 0 H LYS A 130 -8.076 18.659 -8.619 1.00 0.00 H new ATOM 0 HA LYS A 130 -6.762 20.267 -10.658 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -8.316 18.564 -11.838 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -9.633 19.416 -11.057 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -7.606 20.748 -12.896 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -9.148 20.117 -13.437 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -8.925 22.250 -11.288 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -9.008 22.636 -12.995 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -11.230 22.824 -12.092 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -11.194 21.419 -13.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -12.279 21.343 -10.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -11.455 19.998 -11.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -10.691 21.010 -10.287 1.00 0.00 H new TER 2143 LYS A 130