USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 931 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 93 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 95 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 87 LYS NZ :NH3+ 178:sc= 1.04 (180deg=0) USER MOD Set 2.2: A 89 HIS : no HD1:sc= 1.01 K(o=4.2,f=-2.9!) USER MOD Set 2.3: A 119 THR OG1 : rot 89:sc= 2.19 USER MOD Set 3.1: A 81 HIS : no HE2:sc= 1.03 K(o=2.4,f=-2.8) USER MOD Set 3.2: A 83 SER OG : rot -40:sc= 1.37 USER MOD Set 4.1: A 73 CYS SG : rot 53:sc= 0.431 USER MOD Set 4.2: A 97 TYR OH : rot -58:sc= 0.0318 USER MOD Set 5.1: A 53 HIS : no HD1:sc= -0.952 X(o=-0.95,f=-0.87) USER MOD Set 5.2: A 94 SER OG : rot -170:sc= 0 USER MOD Set 6.1: A 28 HIS : no HD1:sc= 1.07 K(o=2.4,f=-5.1!) USER MOD Set 6.2: A 40 SER OG : rot -123:sc= 1.32 USER MOD Set 7.1: A 22 TYR OH : rot -80:sc= 1.03 USER MOD Set 7.2: A 102 HIS : no HE2:sc= -0.39 K(o=1.9,f=2.4) USER MOD Set 7.3: A 105 SER OG : rot 161:sc= 1.24 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 137:sc= 0.0727 (180deg=0) USER MOD Single : A 16 SER OG : rot 150:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 1.26 (180deg=1.26) USER MOD Single : A 29 SER OG : rot -63:sc= 1.1 USER MOD Single : A 33 SER OG : rot 180:sc= 0.627 USER MOD Single : A 41 LYS NZ :NH3+ -173:sc= 2.11 (180deg=1.96) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -174:sc= 1.24 (180deg=1.16) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot -7:sc= 0.989 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 90:sc= 1.29 USER MOD Single : A 64 MET CE :methyl -166:sc= -0.041 (180deg=-0.592) USER MOD Single : A 65 GLN : amide:sc= 1.13 K(o=1.1,f=-0.39) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= 1.15 K(o=1.2,f=-0.45) USER MOD Single : A 69 CYS SG : rot 19:sc= -0.697 USER MOD Single : A 71 CYS SG : rot 11:sc= -1.37 USER MOD Single : A 80 SER OG : rot 170:sc= -0.0241 USER MOD Single : A 82 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 GLN : amide:sc= 0.0409 K(o=0.041,f=-4.3!) USER MOD Single : A 86 LYS NZ :NH3+ -172:sc= 1.26 (180deg=1.19) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 THR OG1 : rot 160:sc=-0.00242 USER MOD Single : A 108 LYS NZ :NH3+ 158:sc= 2.42 (180deg=0.819) USER MOD Single : A 110 LYS NZ :NH3+ 179:sc= 1.34 (180deg=1.32) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 ASN : amide:sc= -0.194 K(o=-0.19,f=-0.92) USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.063 -7.861 -2.476 1.00 10.00 N ATOM 2 CA MET A 1 -0.755 -8.079 -1.813 1.00 10.00 C ATOM 3 C MET A 1 -0.175 -6.737 -1.360 1.00 10.00 C ATOM 4 O MET A 1 -0.403 -5.745 -2.046 1.00 10.00 O ATOM 5 CB MET A 1 0.215 -8.841 -2.738 1.00 10.00 C ATOM 6 CG MET A 1 1.449 -9.361 -1.989 1.00 10.00 C ATOM 7 SD MET A 1 1.080 -10.401 -0.548 1.00 10.00 S ATOM 8 CE MET A 1 0.571 -11.944 -1.357 1.00 10.00 C ATOM 0 H1 MET A 1 -2.122 -8.451 -3.331 1.00 10.00 H new ATOM 0 H2 MET A 1 -2.830 -8.120 -1.824 1.00 10.00 H new ATOM 0 H3 MET A 1 -2.156 -6.859 -2.739 1.00 10.00 H new ATOM 0 HA MET A 1 -0.903 -8.701 -0.930 1.00 10.00 H new ATOM 0 HB2 MET A 1 -0.308 -9.680 -3.197 1.00 10.00 H new ATOM 0 HB3 MET A 1 0.534 -8.183 -3.546 1.00 10.00 H new ATOM 0 HG2 MET A 1 2.065 -9.932 -2.684 1.00 10.00 H new ATOM 0 HG3 MET A 1 2.044 -8.509 -1.662 1.00 10.00 H new ATOM 0 HE1 MET A 1 0.312 -12.684 -0.599 1.00 10.00 H new ATOM 0 HE2 MET A 1 -0.296 -11.754 -1.990 1.00 10.00 H new ATOM 0 HE3 MET A 1 1.391 -12.322 -1.968 1.00 10.00 H new ATOM 20 N ALA A 2 0.529 -6.700 -0.223 1.00 10.00 N ATOM 21 CA ALA A 2 1.057 -5.472 0.372 1.00 10.00 C ATOM 22 C ALA A 2 2.402 -5.727 1.064 1.00 10.00 C ATOM 23 O ALA A 2 2.778 -6.886 1.282 1.00 10.00 O ATOM 24 CB ALA A 2 0.041 -4.925 1.384 1.00 10.00 C ATOM 0 H ALA A 2 0.750 -7.537 0.316 1.00 10.00 H new ATOM 0 HA ALA A 2 1.221 -4.741 -0.420 1.00 10.00 H new ATOM 0 HB1 ALA A 2 0.429 -4.010 1.831 1.00 10.00 H new ATOM 0 HB2 ALA A 2 -0.899 -4.710 0.876 1.00 10.00 H new ATOM 0 HB3 ALA A 2 -0.130 -5.666 2.165 1.00 10.00 H new ATOM 30 N VAL A 3 3.086 -4.632 1.382 1.00 10.00 N ATOM 31 CA VAL A 3 4.326 -4.522 2.128 1.00 10.00 C ATOM 32 C VAL A 3 4.218 -3.245 2.980 1.00 10.00 C ATOM 33 O VAL A 3 3.410 -2.365 2.671 1.00 10.00 O ATOM 34 CB VAL A 3 5.529 -4.438 1.158 1.00 10.00 C ATOM 35 CG1 VAL A 3 6.110 -5.824 0.844 1.00 10.00 C ATOM 36 CG2 VAL A 3 5.240 -3.708 -0.170 1.00 10.00 C ATOM 0 H VAL A 3 2.749 -3.713 1.094 1.00 10.00 H new ATOM 0 HA VAL A 3 4.485 -5.394 2.762 1.00 10.00 H new ATOM 0 HB VAL A 3 6.257 -3.837 1.703 1.00 10.00 H new ATOM 0 HG11 VAL A 3 6.952 -5.719 0.160 1.00 10.00 H new ATOM 0 HG12 VAL A 3 6.449 -6.294 1.767 1.00 10.00 H new ATOM 0 HG13 VAL A 3 5.342 -6.444 0.382 1.00 10.00 H new ATOM 0 HG21 VAL A 3 6.141 -3.699 -0.784 1.00 10.00 H new ATOM 0 HG22 VAL A 3 4.442 -4.225 -0.703 1.00 10.00 H new ATOM 0 HG23 VAL A 3 4.932 -2.683 0.038 1.00 10.00 H new ATOM 46 N ALA A 4 5.052 -3.119 4.015 1.00 10.00 N ATOM 47 CA ALA A 4 5.145 -1.949 4.882 1.00 10.00 C ATOM 48 C ALA A 4 6.555 -1.880 5.477 1.00 10.00 C ATOM 49 O ALA A 4 7.383 -2.757 5.220 1.00 10.00 O ATOM 50 CB ALA A 4 4.097 -2.048 5.999 1.00 10.00 C ATOM 0 H ALA A 4 5.704 -3.858 4.279 1.00 10.00 H new ATOM 0 HA ALA A 4 4.953 -1.043 4.306 1.00 10.00 H new ATOM 0 HB1 ALA A 4 4.169 -1.173 6.644 1.00 10.00 H new ATOM 0 HB2 ALA A 4 3.100 -2.094 5.560 1.00 10.00 H new ATOM 0 HB3 ALA A 4 4.276 -2.948 6.587 1.00 10.00 H new ATOM 56 N ASP A 5 6.806 -0.869 6.313 1.00 10.00 N ATOM 57 CA ASP A 5 8.055 -0.696 7.053 1.00 10.00 C ATOM 58 C ASP A 5 7.727 0.011 8.368 1.00 10.00 C ATOM 59 O ASP A 5 6.742 0.758 8.442 1.00 10.00 O ATOM 60 CB ASP A 5 9.055 0.130 6.229 1.00 10.00 C ATOM 61 CG ASP A 5 10.386 0.292 6.969 1.00 10.00 C ATOM 62 OD1 ASP A 5 10.498 1.285 7.724 1.00 10.00 O ATOM 63 OD2 ASP A 5 11.228 -0.617 6.844 1.00 10.00 O ATOM 0 H ASP A 5 6.127 -0.130 6.497 1.00 10.00 H new ATOM 0 HA ASP A 5 8.514 -1.664 7.253 1.00 10.00 H new ATOM 0 HB2 ASP A 5 9.227 -0.356 5.269 1.00 10.00 H new ATOM 0 HB3 ASP A 5 8.632 1.112 6.018 1.00 10.00 H new ATOM 68 N LEU A 6 8.517 -0.234 9.417 1.00 10.00 N ATOM 69 CA LEU A 6 8.301 0.336 10.743 1.00 10.00 C ATOM 70 C LEU A 6 8.300 1.870 10.745 1.00 10.00 C ATOM 71 O LEU A 6 7.685 2.456 11.642 1.00 10.00 O ATOM 72 CB LEU A 6 9.362 -0.200 11.718 1.00 10.00 C ATOM 73 CG LEU A 6 9.356 -1.727 11.920 1.00 10.00 C ATOM 74 CD1 LEU A 6 10.487 -2.118 12.873 1.00 10.00 C ATOM 75 CD2 LEU A 6 8.026 -2.250 12.486 1.00 10.00 C ATOM 0 H LEU A 6 9.334 -0.842 9.365 1.00 10.00 H new ATOM 0 HA LEU A 6 7.307 0.027 11.067 1.00 10.00 H new ATOM 0 HB2 LEU A 6 10.347 0.099 11.358 1.00 10.00 H new ATOM 0 HB3 LEU A 6 9.217 0.279 12.686 1.00 10.00 H new ATOM 0 HG LEU A 6 9.495 -2.179 10.938 1.00 10.00 H new ATOM 0 HD11 LEU A 6 10.484 -3.198 13.017 1.00 10.00 H new ATOM 0 HD12 LEU A 6 11.443 -1.811 12.449 1.00 10.00 H new ATOM 0 HD13 LEU A 6 10.341 -1.624 13.833 1.00 10.00 H new ATOM 0 HD21 LEU A 6 8.082 -3.332 12.606 1.00 10.00 H new ATOM 0 HD22 LEU A 6 7.835 -1.787 13.454 1.00 10.00 H new ATOM 0 HD23 LEU A 6 7.216 -2.003 11.799 1.00 10.00 H new ATOM 87 N ALA A 7 8.964 2.519 9.785 1.00 10.00 N ATOM 88 CA ALA A 7 8.925 3.970 9.650 1.00 10.00 C ATOM 89 C ALA A 7 7.540 4.471 9.225 1.00 10.00 C ATOM 90 O ALA A 7 7.157 5.578 9.594 1.00 10.00 O ATOM 91 CB ALA A 7 9.967 4.415 8.620 1.00 10.00 C ATOM 0 H ALA A 7 9.540 2.052 9.084 1.00 10.00 H new ATOM 0 HA ALA A 7 9.148 4.400 10.626 1.00 10.00 H new ATOM 0 HB1 ALA A 7 9.938 5.500 8.519 1.00 10.00 H new ATOM 0 HB2 ALA A 7 10.959 4.108 8.950 1.00 10.00 H new ATOM 0 HB3 ALA A 7 9.746 3.955 7.657 1.00 10.00 H new ATOM 97 N LEU A 8 6.801 3.678 8.437 1.00 10.00 N ATOM 98 CA LEU A 8 5.475 4.055 7.943 1.00 10.00 C ATOM 99 C LEU A 8 4.435 3.893 9.052 1.00 10.00 C ATOM 100 O LEU A 8 3.465 4.646 9.117 1.00 10.00 O ATOM 101 CB LEU A 8 5.063 3.180 6.741 1.00 10.00 C ATOM 102 CG LEU A 8 6.007 3.244 5.526 1.00 10.00 C ATOM 103 CD1 LEU A 8 5.486 2.320 4.419 1.00 10.00 C ATOM 104 CD2 LEU A 8 6.154 4.667 4.967 1.00 10.00 C ATOM 0 H LEU A 8 7.109 2.757 8.125 1.00 10.00 H new ATOM 0 HA LEU A 8 5.522 5.097 7.626 1.00 10.00 H new ATOM 0 HB2 LEU A 8 4.995 2.144 7.073 1.00 10.00 H new ATOM 0 HB3 LEU A 8 4.065 3.478 6.421 1.00 10.00 H new ATOM 0 HG LEU A 8 6.990 2.920 5.867 1.00 10.00 H new ATOM 0 HD11 LEU A 8 6.156 2.367 3.560 1.00 10.00 H new ATOM 0 HD12 LEU A 8 5.443 1.296 4.790 1.00 10.00 H new ATOM 0 HD13 LEU A 8 4.488 2.639 4.119 1.00 10.00 H new ATOM 0 HD21 LEU A 8 6.830 4.654 4.112 1.00 10.00 H new ATOM 0 HD22 LEU A 8 5.178 5.037 4.652 1.00 10.00 H new ATOM 0 HD23 LEU A 8 6.558 5.321 5.739 1.00 10.00 H new ATOM 116 N ILE A 9 4.622 2.876 9.896 1.00 10.00 N ATOM 117 CA ILE A 9 3.699 2.516 10.964 1.00 10.00 C ATOM 118 C ILE A 9 3.673 3.660 11.997 1.00 10.00 C ATOM 119 O ILE A 9 4.726 3.943 12.585 1.00 10.00 O ATOM 120 CB ILE A 9 4.123 1.139 11.524 1.00 10.00 C ATOM 121 CG1 ILE A 9 3.690 0.064 10.496 1.00 10.00 C ATOM 122 CG2 ILE A 9 3.523 0.845 12.915 1.00 10.00 C ATOM 123 CD1 ILE A 9 4.459 -1.252 10.605 1.00 10.00 C ATOM 0 H ILE A 9 5.440 2.268 9.851 1.00 10.00 H new ATOM 0 HA ILE A 9 2.671 2.402 10.619 1.00 10.00 H new ATOM 0 HB ILE A 9 5.204 1.132 11.667 1.00 10.00 H new ATOM 0 HG12 ILE A 9 2.627 -0.138 10.624 1.00 10.00 H new ATOM 0 HG13 ILE A 9 3.819 0.465 9.491 1.00 10.00 H new ATOM 0 HG21 ILE A 9 3.857 -0.135 13.255 1.00 10.00 H new ATOM 0 HG22 ILE A 9 3.853 1.606 13.622 1.00 10.00 H new ATOM 0 HG23 ILE A 9 2.435 0.856 12.852 1.00 10.00 H new ATOM 0 HD11 ILE A 9 4.095 -1.950 9.851 1.00 10.00 H new ATOM 0 HD12 ILE A 9 5.521 -1.067 10.446 1.00 10.00 H new ATOM 0 HD13 ILE A 9 4.310 -1.680 11.597 1.00 10.00 H new ATOM 135 N PRO A 10 2.504 4.295 12.246 1.00 10.00 N ATOM 136 CA PRO A 10 2.361 5.382 13.209 1.00 10.00 C ATOM 137 C PRO A 10 2.955 5.002 14.560 1.00 10.00 C ATOM 138 O PRO A 10 2.683 3.915 15.080 1.00 10.00 O ATOM 139 CB PRO A 10 0.859 5.671 13.320 1.00 10.00 C ATOM 140 CG PRO A 10 0.325 5.236 11.959 1.00 10.00 C ATOM 141 CD PRO A 10 1.217 4.048 11.604 1.00 10.00 C ATOM 0 HA PRO A 10 2.902 6.269 12.880 1.00 10.00 H new ATOM 0 HB2 PRO A 10 0.399 5.109 14.133 1.00 10.00 H new ATOM 0 HB3 PRO A 10 0.664 6.726 13.512 1.00 10.00 H new ATOM 0 HG2 PRO A 10 -0.726 4.951 12.010 1.00 10.00 H new ATOM 0 HG3 PRO A 10 0.403 6.034 11.221 1.00 10.00 H new ATOM 0 HD2 PRO A 10 0.779 3.114 11.957 1.00 10.00 H new ATOM 0 HD3 PRO A 10 1.332 3.958 10.524 1.00 10.00 H new ATOM 149 N ASP A 11 3.744 5.896 15.149 1.00 10.00 N ATOM 150 CA ASP A 11 4.538 5.586 16.339 1.00 10.00 C ATOM 151 C ASP A 11 3.725 5.749 17.628 1.00 10.00 C ATOM 152 O ASP A 11 3.864 4.978 18.576 1.00 10.00 O ATOM 153 CB ASP A 11 5.781 6.483 16.356 1.00 10.00 C ATOM 154 CG ASP A 11 6.913 5.803 17.119 1.00 10.00 C ATOM 155 OD1 ASP A 11 7.403 4.761 16.621 1.00 10.00 O ATOM 156 OD2 ASP A 11 7.314 6.274 18.203 1.00 10.00 O ATOM 0 H ASP A 11 3.853 6.854 14.817 1.00 10.00 H new ATOM 0 HA ASP A 11 4.841 4.540 16.294 1.00 10.00 H new ATOM 0 HB2 ASP A 11 6.098 6.696 15.335 1.00 10.00 H new ATOM 0 HB3 ASP A 11 5.542 7.439 16.822 1.00 10.00 H new ATOM 161 N VAL A 12 2.758 6.665 17.608 1.00 10.00 N ATOM 162 CA VAL A 12 1.825 6.956 18.687 1.00 10.00 C ATOM 163 C VAL A 12 0.454 7.108 18.031 1.00 10.00 C ATOM 164 O VAL A 12 0.358 7.771 16.996 1.00 10.00 O ATOM 165 CB VAL A 12 2.256 8.255 19.403 1.00 10.00 C ATOM 166 CG1 VAL A 12 1.318 8.634 20.561 1.00 10.00 C ATOM 167 CG2 VAL A 12 3.682 8.150 19.954 1.00 10.00 C ATOM 0 H VAL A 12 2.599 7.255 16.791 1.00 10.00 H new ATOM 0 HA VAL A 12 1.801 6.168 19.440 1.00 10.00 H new ATOM 0 HB VAL A 12 2.207 9.033 18.641 1.00 10.00 H new ATOM 0 HG11 VAL A 12 1.669 9.554 21.027 1.00 10.00 H new ATOM 0 HG12 VAL A 12 0.309 8.784 20.178 1.00 10.00 H new ATOM 0 HG13 VAL A 12 1.310 7.833 21.300 1.00 10.00 H new ATOM 0 HG21 VAL A 12 3.950 9.083 20.451 1.00 10.00 H new ATOM 0 HG22 VAL A 12 3.736 7.329 20.669 1.00 10.00 H new ATOM 0 HG23 VAL A 12 4.376 7.963 19.134 1.00 10.00 H new ATOM 177 N ASP A 13 -0.582 6.523 18.629 1.00 10.00 N ATOM 178 CA ASP A 13 -1.967 6.762 18.224 1.00 10.00 C ATOM 179 C ASP A 13 -2.833 6.612 19.469 1.00 10.00 C ATOM 180 O ASP A 13 -3.017 5.504 19.989 1.00 10.00 O ATOM 181 CB ASP A 13 -2.414 5.824 17.091 1.00 10.00 C ATOM 182 CG ASP A 13 -3.673 6.351 16.380 1.00 10.00 C ATOM 183 OD1 ASP A 13 -4.480 7.035 17.046 1.00 10.00 O ATOM 184 OD2 ASP A 13 -3.795 6.078 15.165 1.00 10.00 O ATOM 0 H ASP A 13 -0.486 5.871 19.407 1.00 10.00 H new ATOM 0 HA ASP A 13 -2.068 7.766 17.813 1.00 10.00 H new ATOM 0 HB2 ASP A 13 -1.606 5.716 16.368 1.00 10.00 H new ATOM 0 HB3 ASP A 13 -2.613 4.832 17.497 1.00 10.00 H new ATOM 189 N ILE A 14 -3.230 7.747 20.045 1.00 10.00 N ATOM 190 CA ILE A 14 -3.972 7.847 21.296 1.00 10.00 C ATOM 191 C ILE A 14 -5.071 8.901 21.115 1.00 10.00 C ATOM 192 O ILE A 14 -4.926 9.791 20.278 1.00 10.00 O ATOM 193 CB ILE A 14 -3.015 8.179 22.474 1.00 10.00 C ATOM 194 CG1 ILE A 14 -2.388 9.594 22.370 1.00 10.00 C ATOM 195 CG2 ILE A 14 -1.913 7.108 22.615 1.00 10.00 C ATOM 196 CD1 ILE A 14 -1.551 10.000 23.590 1.00 10.00 C ATOM 0 H ILE A 14 -3.033 8.659 19.633 1.00 10.00 H new ATOM 0 HA ILE A 14 -4.439 6.894 21.545 1.00 10.00 H new ATOM 0 HB ILE A 14 -3.631 8.174 23.373 1.00 10.00 H new ATOM 0 HG12 ILE A 14 -1.759 9.636 21.481 1.00 10.00 H new ATOM 0 HG13 ILE A 14 -3.186 10.324 22.231 1.00 10.00 H new ATOM 0 HG21 ILE A 14 -1.258 7.367 23.447 1.00 10.00 H new ATOM 0 HG22 ILE A 14 -2.371 6.137 22.802 1.00 10.00 H new ATOM 0 HG23 ILE A 14 -1.330 7.063 21.695 1.00 10.00 H new ATOM 0 HD11 ILE A 14 -1.148 11.001 23.438 1.00 10.00 H new ATOM 0 HD12 ILE A 14 -2.179 9.993 24.481 1.00 10.00 H new ATOM 0 HD13 ILE A 14 -0.730 9.295 23.719 1.00 10.00 H new ATOM 208 N ASP A 15 -6.118 8.849 21.942 1.00 10.00 N ATOM 209 CA ASP A 15 -7.174 9.878 21.975 1.00 10.00 C ATOM 210 C ASP A 15 -7.683 10.054 23.408 1.00 10.00 C ATOM 211 O ASP A 15 -8.879 10.168 23.673 1.00 10.00 O ATOM 212 CB ASP A 15 -8.299 9.546 20.978 1.00 10.00 C ATOM 213 CG ASP A 15 -9.282 10.717 20.773 1.00 10.00 C ATOM 214 OD1 ASP A 15 -8.841 11.880 20.829 1.00 10.00 O ATOM 215 OD2 ASP A 15 -10.480 10.425 20.502 1.00 10.00 O ATOM 0 H ASP A 15 -6.263 8.093 22.611 1.00 10.00 H new ATOM 0 HA ASP A 15 -6.758 10.834 21.656 1.00 10.00 H new ATOM 0 HB2 ASP A 15 -7.859 9.275 20.018 1.00 10.00 H new ATOM 0 HB3 ASP A 15 -8.848 8.675 21.334 1.00 10.00 H new ATOM 220 N SER A 16 -6.754 9.927 24.358 1.00 10.00 N ATOM 221 CA SER A 16 -6.963 9.836 25.798 1.00 10.00 C ATOM 222 C SER A 16 -7.324 11.192 26.449 1.00 10.00 C ATOM 223 O SER A 16 -6.697 11.597 27.432 1.00 10.00 O ATOM 224 CB SER A 16 -5.698 9.215 26.408 1.00 10.00 C ATOM 225 OG SER A 16 -5.187 8.157 25.596 1.00 10.00 O ATOM 0 H SER A 16 -5.763 9.882 24.119 1.00 10.00 H new ATOM 0 HA SER A 16 -7.829 9.205 25.998 1.00 10.00 H new ATOM 0 HB2 SER A 16 -4.935 9.984 26.526 1.00 10.00 H new ATOM 0 HB3 SER A 16 -5.923 8.834 27.404 1.00 10.00 H new ATOM 0 HG SER A 16 -4.214 8.106 25.700 1.00 10.00 H new ATOM 231 N ASP A 17 -8.322 11.893 25.906 1.00 10.00 N ATOM 232 CA ASP A 17 -8.873 13.164 26.412 1.00 10.00 C ATOM 233 C ASP A 17 -9.760 12.939 27.656 1.00 10.00 C ATOM 234 O ASP A 17 -10.871 13.442 27.801 1.00 10.00 O ATOM 235 CB ASP A 17 -9.615 13.888 25.274 1.00 10.00 C ATOM 236 CG ASP A 17 -10.084 15.303 25.672 1.00 10.00 C ATOM 237 OD1 ASP A 17 -9.244 16.050 26.234 1.00 10.00 O ATOM 238 OD2 ASP A 17 -11.244 15.660 25.357 1.00 10.00 O ATOM 0 H ASP A 17 -8.795 11.579 25.059 1.00 10.00 H new ATOM 0 HA ASP A 17 -8.057 13.806 26.743 1.00 10.00 H new ATOM 0 HB2 ASP A 17 -8.960 13.958 24.406 1.00 10.00 H new ATOM 0 HB3 ASP A 17 -10.479 13.295 24.974 1.00 10.00 H new ATOM 243 N GLY A 18 -9.311 12.047 28.539 1.00 10.00 N ATOM 244 CA GLY A 18 -9.974 11.557 29.735 1.00 10.00 C ATOM 245 C GLY A 18 -9.178 10.351 30.223 1.00 10.00 C ATOM 246 O GLY A 18 -8.203 9.959 29.579 1.00 10.00 O ATOM 0 H GLY A 18 -8.395 11.615 28.420 1.00 10.00 H new ATOM 0 HA2 GLY A 18 -10.009 12.331 30.501 1.00 10.00 H new ATOM 0 HA3 GLY A 18 -11.005 11.277 29.517 1.00 10.00 H new ATOM 250 N VAL A 19 -9.550 9.748 31.354 1.00 10.00 N ATOM 251 CA VAL A 19 -8.920 8.501 31.784 1.00 10.00 C ATOM 252 C VAL A 19 -9.290 7.418 30.767 1.00 10.00 C ATOM 253 O VAL A 19 -10.452 7.027 30.700 1.00 10.00 O ATOM 254 CB VAL A 19 -9.335 8.111 33.220 1.00 10.00 C ATOM 255 CG1 VAL A 19 -8.558 6.862 33.674 1.00 10.00 C ATOM 256 CG2 VAL A 19 -9.085 9.241 34.234 1.00 10.00 C ATOM 0 H VAL A 19 -10.275 10.098 31.981 1.00 10.00 H new ATOM 0 HA VAL A 19 -7.837 8.624 31.817 1.00 10.00 H new ATOM 0 HB VAL A 19 -10.406 7.910 33.192 1.00 10.00 H new ATOM 0 HG11 VAL A 19 -8.858 6.595 34.687 1.00 10.00 H new ATOM 0 HG12 VAL A 19 -8.777 6.033 33.001 1.00 10.00 H new ATOM 0 HG13 VAL A 19 -7.489 7.072 33.655 1.00 10.00 H new ATOM 0 HG21 VAL A 19 -9.394 8.914 35.227 1.00 10.00 H new ATOM 0 HG22 VAL A 19 -8.024 9.489 34.248 1.00 10.00 H new ATOM 0 HG23 VAL A 19 -9.660 10.121 33.947 1.00 10.00 H new ATOM 266 N PHE A 20 -8.313 6.902 30.016 1.00 10.00 N ATOM 267 CA PHE A 20 -8.512 5.813 29.068 1.00 10.00 C ATOM 268 C PHE A 20 -7.291 4.898 29.100 1.00 10.00 C ATOM 269 O PHE A 20 -6.150 5.353 29.208 1.00 10.00 O ATOM 270 CB PHE A 20 -8.773 6.362 27.656 1.00 10.00 C ATOM 271 CG PHE A 20 -10.131 7.030 27.496 1.00 10.00 C ATOM 272 CD1 PHE A 20 -11.301 6.245 27.456 1.00 10.00 C ATOM 273 CD2 PHE A 20 -10.241 8.432 27.417 1.00 10.00 C ATOM 274 CE1 PHE A 20 -12.565 6.856 27.348 1.00 10.00 C ATOM 275 CE2 PHE A 20 -11.501 9.044 27.297 1.00 10.00 C ATOM 276 CZ PHE A 20 -12.665 8.256 27.266 1.00 10.00 C ATOM 0 H PHE A 20 -7.350 7.237 30.053 1.00 10.00 H new ATOM 0 HA PHE A 20 -9.391 5.234 29.351 1.00 10.00 H new ATOM 0 HB2 PHE A 20 -7.993 7.082 27.407 1.00 10.00 H new ATOM 0 HB3 PHE A 20 -8.694 5.545 26.939 1.00 10.00 H new ATOM 0 HD1 PHE A 20 -11.228 5.169 27.508 1.00 10.00 H new ATOM 0 HD2 PHE A 20 -9.350 9.042 27.449 1.00 10.00 H new ATOM 0 HE1 PHE A 20 -13.458 6.249 27.328 1.00 10.00 H new ATOM 0 HE2 PHE A 20 -11.575 10.119 27.229 1.00 10.00 H new ATOM 0 HZ PHE A 20 -13.634 8.725 27.179 1.00 10.00 H new ATOM 286 N LYS A 21 -7.548 3.586 29.069 1.00 10.00 N ATOM 287 CA LYS A 21 -6.512 2.551 29.053 1.00 10.00 C ATOM 288 C LYS A 21 -5.626 2.726 27.818 1.00 10.00 C ATOM 289 O LYS A 21 -6.066 3.234 26.790 1.00 10.00 O ATOM 290 CB LYS A 21 -7.145 1.148 29.080 1.00 10.00 C ATOM 291 CG LYS A 21 -8.064 0.937 30.299 1.00 10.00 C ATOM 292 CD LYS A 21 -8.794 -0.413 30.240 1.00 10.00 C ATOM 293 CE LYS A 21 -9.810 -0.499 31.389 1.00 10.00 C ATOM 294 NZ LYS A 21 -10.635 -1.732 31.335 1.00 10.00 N ATOM 0 H LYS A 21 -8.496 3.209 29.054 1.00 10.00 H new ATOM 0 HA LYS A 21 -5.894 2.654 29.945 1.00 10.00 H new ATOM 0 HB2 LYS A 21 -7.719 0.994 28.166 1.00 10.00 H new ATOM 0 HB3 LYS A 21 -6.355 0.397 29.091 1.00 10.00 H new ATOM 0 HG2 LYS A 21 -7.472 0.990 31.213 1.00 10.00 H new ATOM 0 HG3 LYS A 21 -8.796 1.744 30.346 1.00 10.00 H new ATOM 0 HD2 LYS A 21 -9.303 -0.521 29.282 1.00 10.00 H new ATOM 0 HD3 LYS A 21 -8.076 -1.230 30.314 1.00 10.00 H new ATOM 0 HE2 LYS A 21 -9.280 -0.463 32.341 1.00 10.00 H new ATOM 0 HE3 LYS A 21 -10.464 0.372 31.356 1.00 10.00 H new ATOM 0 HZ1 LYS A 21 -11.303 -1.738 32.132 1.00 10.00 H new ATOM 0 HZ2 LYS A 21 -11.164 -1.757 30.440 1.00 10.00 H new ATOM 0 HZ3 LYS A 21 -10.017 -2.566 31.394 1.00 10.00 H new ATOM 308 N TYR A 22 -4.392 2.241 27.902 1.00 10.00 N ATOM 309 CA TYR A 22 -3.446 2.214 26.794 1.00 10.00 C ATOM 310 C TYR A 22 -2.552 0.988 26.952 1.00 10.00 C ATOM 311 O TYR A 22 -2.525 0.365 28.022 1.00 10.00 O ATOM 312 CB TYR A 22 -2.645 3.533 26.724 1.00 10.00 C ATOM 313 CG TYR A 22 -1.210 3.463 27.219 1.00 10.00 C ATOM 314 CD1 TYR A 22 -0.952 3.519 28.595 1.00 10.00 C ATOM 315 CD2 TYR A 22 -0.140 3.311 26.315 1.00 10.00 C ATOM 316 CE1 TYR A 22 0.362 3.441 29.080 1.00 10.00 C ATOM 317 CE2 TYR A 22 1.183 3.239 26.787 1.00 10.00 C ATOM 318 CZ TYR A 22 1.439 3.329 28.173 1.00 10.00 C ATOM 319 OH TYR A 22 2.717 3.332 28.639 1.00 10.00 O ATOM 0 H TYR A 22 -4.013 1.847 28.763 1.00 10.00 H new ATOM 0 HA TYR A 22 -3.974 2.134 25.844 1.00 10.00 H new ATOM 0 HB2 TYR A 22 -2.636 3.876 25.689 1.00 10.00 H new ATOM 0 HB3 TYR A 22 -3.174 4.288 27.306 1.00 10.00 H new ATOM 0 HD1 TYR A 22 -1.773 3.623 29.289 1.00 10.00 H new ATOM 0 HD2 TYR A 22 -0.337 3.249 25.255 1.00 10.00 H new ATOM 0 HE1 TYR A 22 0.550 3.466 30.143 1.00 10.00 H new ATOM 0 HE2 TYR A 22 2.000 3.115 26.092 1.00 10.00 H new ATOM 0 HH TYR A 22 2.997 4.254 28.820 1.00 10.00 H new ATOM 329 N VAL A 23 -1.819 0.650 25.894 1.00 10.00 N ATOM 330 CA VAL A 23 -0.912 -0.483 25.863 1.00 10.00 C ATOM 331 C VAL A 23 0.359 -0.073 25.101 1.00 10.00 C ATOM 332 O VAL A 23 0.313 0.763 24.191 1.00 10.00 O ATOM 333 CB VAL A 23 -1.680 -1.703 25.306 1.00 10.00 C ATOM 334 CG1 VAL A 23 -2.164 -1.494 23.869 1.00 10.00 C ATOM 335 CG2 VAL A 23 -0.895 -3.009 25.434 1.00 10.00 C ATOM 0 H VAL A 23 -1.843 1.171 25.017 1.00 10.00 H new ATOM 0 HA VAL A 23 -0.563 -0.788 26.850 1.00 10.00 H new ATOM 0 HB VAL A 23 -2.564 -1.795 25.936 1.00 10.00 H new ATOM 0 HG11 VAL A 23 -2.696 -2.383 23.531 1.00 10.00 H new ATOM 0 HG12 VAL A 23 -2.833 -0.634 23.832 1.00 10.00 H new ATOM 0 HG13 VAL A 23 -1.308 -1.315 23.219 1.00 10.00 H new ATOM 0 HG21 VAL A 23 -1.485 -3.830 25.026 1.00 10.00 H new ATOM 0 HG22 VAL A 23 0.041 -2.926 24.882 1.00 10.00 H new ATOM 0 HG23 VAL A 23 -0.681 -3.203 26.485 1.00 10.00 H new ATOM 345 N LEU A 24 1.492 -0.652 25.504 1.00 10.00 N ATOM 346 CA LEU A 24 2.804 -0.443 24.910 1.00 10.00 C ATOM 347 C LEU A 24 3.137 -1.741 24.186 1.00 10.00 C ATOM 348 O LEU A 24 3.287 -2.778 24.835 1.00 10.00 O ATOM 349 CB LEU A 24 3.823 -0.108 26.019 1.00 10.00 C ATOM 350 CG LEU A 24 5.288 -0.014 25.546 1.00 10.00 C ATOM 351 CD1 LEU A 24 5.488 1.035 24.445 1.00 10.00 C ATOM 352 CD2 LEU A 24 6.184 0.333 26.740 1.00 10.00 C ATOM 0 H LEU A 24 1.516 -1.306 26.286 1.00 10.00 H new ATOM 0 HA LEU A 24 2.828 0.393 24.211 1.00 10.00 H new ATOM 0 HB2 LEU A 24 3.542 0.841 26.476 1.00 10.00 H new ATOM 0 HB3 LEU A 24 3.755 -0.869 26.797 1.00 10.00 H new ATOM 0 HG LEU A 24 5.556 -0.983 25.126 1.00 10.00 H new ATOM 0 HD11 LEU A 24 6.537 1.058 24.151 1.00 10.00 H new ATOM 0 HD12 LEU A 24 4.874 0.778 23.582 1.00 10.00 H new ATOM 0 HD13 LEU A 24 5.195 2.016 24.819 1.00 10.00 H new ATOM 0 HD21 LEU A 24 7.221 0.400 26.410 1.00 10.00 H new ATOM 0 HD22 LEU A 24 5.875 1.289 27.161 1.00 10.00 H new ATOM 0 HD23 LEU A 24 6.095 -0.444 27.500 1.00 10.00 H new ATOM 364 N ILE A 25 3.228 -1.697 22.863 1.00 10.00 N ATOM 365 CA ILE A 25 3.298 -2.893 22.035 1.00 10.00 C ATOM 366 C ILE A 25 4.625 -2.841 21.286 1.00 10.00 C ATOM 367 O ILE A 25 4.983 -1.794 20.743 1.00 10.00 O ATOM 368 CB ILE A 25 2.084 -2.972 21.075 1.00 10.00 C ATOM 369 CG1 ILE A 25 0.728 -2.665 21.758 1.00 10.00 C ATOM 370 CG2 ILE A 25 2.032 -4.364 20.429 1.00 10.00 C ATOM 371 CD1 ILE A 25 -0.483 -2.786 20.819 1.00 10.00 C ATOM 0 H ILE A 25 3.255 -0.826 22.332 1.00 10.00 H new ATOM 0 HA ILE A 25 3.254 -3.796 22.644 1.00 10.00 H new ATOM 0 HB ILE A 25 2.232 -2.198 20.322 1.00 10.00 H new ATOM 0 HG12 ILE A 25 0.593 -3.346 22.599 1.00 10.00 H new ATOM 0 HG13 ILE A 25 0.759 -1.655 22.167 1.00 10.00 H new ATOM 0 HG21 ILE A 25 1.178 -4.420 19.754 1.00 10.00 H new ATOM 0 HG22 ILE A 25 2.950 -4.540 19.868 1.00 10.00 H new ATOM 0 HG23 ILE A 25 1.931 -5.122 21.206 1.00 10.00 H new ATOM 0 HD11 ILE A 25 -1.395 -2.556 21.370 1.00 10.00 H new ATOM 0 HD12 ILE A 25 -0.373 -2.086 19.991 1.00 10.00 H new ATOM 0 HD13 ILE A 25 -0.541 -3.802 20.429 1.00 10.00 H new ATOM 383 N ARG A 26 5.358 -3.951 21.258 1.00 10.00 N ATOM 384 CA ARG A 26 6.509 -4.104 20.388 1.00 10.00 C ATOM 385 C ARG A 26 5.992 -4.655 19.073 1.00 10.00 C ATOM 386 O ARG A 26 5.185 -5.581 19.071 1.00 10.00 O ATOM 387 CB ARG A 26 7.544 -5.021 21.053 1.00 10.00 C ATOM 388 CG ARG A 26 8.734 -5.326 20.127 1.00 10.00 C ATOM 389 CD ARG A 26 9.901 -5.953 20.896 1.00 10.00 C ATOM 390 NE ARG A 26 10.568 -4.952 21.739 1.00 10.00 N ATOM 391 CZ ARG A 26 11.393 -5.167 22.764 1.00 10.00 C ATOM 392 NH1 ARG A 26 11.705 -6.401 23.177 1.00 10.00 N ATOM 393 NH2 ARG A 26 11.909 -4.105 23.365 1.00 10.00 N ATOM 0 H ARG A 26 5.167 -4.767 21.840 1.00 10.00 H new ATOM 0 HA ARG A 26 7.018 -3.158 20.204 1.00 10.00 H new ATOM 0 HB2 ARG A 26 7.908 -4.551 21.967 1.00 10.00 H new ATOM 0 HB3 ARG A 26 7.064 -5.955 21.344 1.00 10.00 H new ATOM 0 HG2 ARG A 26 8.415 -6.002 19.334 1.00 10.00 H new ATOM 0 HG3 ARG A 26 9.067 -4.406 19.646 1.00 10.00 H new ATOM 0 HD2 ARG A 26 9.536 -6.772 21.516 1.00 10.00 H new ATOM 0 HD3 ARG A 26 10.618 -6.380 20.194 1.00 10.00 H new ATOM 0 HE ARG A 26 10.377 -3.976 21.513 1.00 10.00 H new ATOM 0 HH11 ARG A 26 11.308 -7.213 22.704 1.00 10.00 H new ATOM 0 HH12 ARG A 26 12.340 -6.530 23.965 1.00 10.00 H new ATOM 0 HH21 ARG A 26 11.670 -3.168 23.039 1.00 10.00 H new ATOM 0 HH22 ARG A 26 12.545 -4.224 24.154 1.00 10.00 H new ATOM 407 N VAL A 27 6.454 -4.098 17.968 1.00 10.00 N ATOM 408 CA VAL A 27 6.125 -4.514 16.620 1.00 10.00 C ATOM 409 C VAL A 27 7.389 -5.165 16.074 1.00 10.00 C ATOM 410 O VAL A 27 8.475 -4.598 16.213 1.00 10.00 O ATOM 411 CB VAL A 27 5.721 -3.285 15.782 1.00 10.00 C ATOM 412 CG1 VAL A 27 5.184 -3.706 14.410 1.00 10.00 C ATOM 413 CG2 VAL A 27 4.655 -2.424 16.468 1.00 10.00 C ATOM 0 H VAL A 27 7.098 -3.307 17.989 1.00 10.00 H new ATOM 0 HA VAL A 27 5.285 -5.208 16.590 1.00 10.00 H new ATOM 0 HB VAL A 27 6.630 -2.694 15.671 1.00 10.00 H new ATOM 0 HG11 VAL A 27 4.907 -2.819 13.840 1.00 10.00 H new ATOM 0 HG12 VAL A 27 5.955 -4.257 13.871 1.00 10.00 H new ATOM 0 HG13 VAL A 27 4.308 -4.341 14.541 1.00 10.00 H new ATOM 0 HG21 VAL A 27 4.410 -1.573 15.832 1.00 10.00 H new ATOM 0 HG22 VAL A 27 3.759 -3.021 16.637 1.00 10.00 H new ATOM 0 HG23 VAL A 27 5.037 -2.064 17.423 1.00 10.00 H new ATOM 423 N HIS A 28 7.251 -6.327 15.449 1.00 10.00 N ATOM 424 CA HIS A 28 8.312 -7.041 14.760 1.00 10.00 C ATOM 425 C HIS A 28 7.963 -6.984 13.277 1.00 10.00 C ATOM 426 O HIS A 28 6.826 -7.279 12.906 1.00 10.00 O ATOM 427 CB HIS A 28 8.356 -8.498 15.241 1.00 10.00 C ATOM 428 CG HIS A 28 8.562 -8.662 16.727 1.00 10.00 C ATOM 429 ND1 HIS A 28 9.698 -8.338 17.429 1.00 10.00 N ATOM 430 CD2 HIS A 28 7.675 -9.205 17.621 1.00 10.00 C ATOM 431 CE1 HIS A 28 9.511 -8.702 18.706 1.00 10.00 C ATOM 432 NE2 HIS A 28 8.286 -9.221 18.883 1.00 10.00 N ATOM 0 H HIS A 28 6.357 -6.817 15.408 1.00 10.00 H new ATOM 0 HA HIS A 28 9.289 -6.600 14.954 1.00 10.00 H new ATOM 0 HB2 HIS A 28 7.424 -8.988 14.960 1.00 10.00 H new ATOM 0 HB3 HIS A 28 9.159 -9.016 14.717 1.00 10.00 H new ATOM 0 HD2 HIS A 28 6.680 -9.558 17.393 1.00 10.00 H new ATOM 0 HE1 HIS A 28 10.248 -8.592 19.488 1.00 10.00 H new ATOM 0 HE2 HIS A 28 7.882 -9.558 19.757 1.00 10.00 H new ATOM 440 N SER A 29 8.900 -6.555 12.434 1.00 10.00 N ATOM 441 CA SER A 29 8.653 -6.445 11.005 1.00 10.00 C ATOM 442 C SER A 29 8.740 -7.812 10.324 1.00 10.00 C ATOM 443 O SER A 29 9.547 -8.658 10.703 1.00 10.00 O ATOM 444 CB SER A 29 9.587 -5.402 10.380 1.00 10.00 C ATOM 445 OG SER A 29 10.953 -5.684 10.598 1.00 10.00 O ATOM 0 H SER A 29 9.839 -6.278 12.721 1.00 10.00 H new ATOM 0 HA SER A 29 7.634 -6.093 10.847 1.00 10.00 H new ATOM 0 HB2 SER A 29 9.399 -5.350 9.308 1.00 10.00 H new ATOM 0 HB3 SER A 29 9.354 -4.420 10.792 1.00 10.00 H new ATOM 0 HG SER A 29 11.143 -5.657 11.559 1.00 10.00 H new ATOM 451 N ALA A 30 7.916 -7.999 9.294 1.00 10.00 N ATOM 452 CA ALA A 30 7.968 -9.090 8.332 1.00 10.00 C ATOM 453 C ALA A 30 7.232 -8.596 7.072 1.00 10.00 C ATOM 454 O ALA A 30 6.123 -9.052 6.786 1.00 10.00 O ATOM 455 CB ALA A 30 7.336 -10.352 8.923 1.00 10.00 C ATOM 0 H ALA A 30 7.151 -7.353 9.101 1.00 10.00 H new ATOM 0 HA ALA A 30 8.993 -9.362 8.078 1.00 10.00 H new ATOM 0 HB1 ALA A 30 7.382 -11.159 8.192 1.00 10.00 H new ATOM 0 HB2 ALA A 30 7.880 -10.645 9.821 1.00 10.00 H new ATOM 0 HB3 ALA A 30 6.295 -10.153 9.178 1.00 10.00 H new ATOM 461 N PRO A 31 7.804 -7.598 6.360 1.00 10.00 N ATOM 462 CA PRO A 31 7.136 -6.853 5.291 1.00 10.00 C ATOM 463 C PRO A 31 6.402 -7.732 4.279 1.00 10.00 C ATOM 464 O PRO A 31 5.313 -7.397 3.828 1.00 10.00 O ATOM 465 CB PRO A 31 8.240 -6.032 4.615 1.00 10.00 C ATOM 466 CG PRO A 31 9.223 -5.778 5.754 1.00 10.00 C ATOM 467 CD PRO A 31 9.147 -7.070 6.565 1.00 10.00 C ATOM 0 HA PRO A 31 6.347 -6.231 5.714 1.00 10.00 H new ATOM 0 HB2 PRO A 31 8.705 -6.579 3.795 1.00 10.00 H new ATOM 0 HB3 PRO A 31 7.854 -5.101 4.199 1.00 10.00 H new ATOM 0 HG2 PRO A 31 10.231 -5.592 5.384 1.00 10.00 H new ATOM 0 HG3 PRO A 31 8.937 -4.910 6.349 1.00 10.00 H new ATOM 0 HD2 PRO A 31 9.901 -7.783 6.233 1.00 10.00 H new ATOM 0 HD3 PRO A 31 9.333 -6.878 7.622 1.00 10.00 H new ATOM 475 N ARG A 32 6.993 -8.869 3.914 1.00 10.00 N ATOM 476 CA ARG A 32 6.390 -9.874 3.054 1.00 10.00 C ATOM 477 C ARG A 32 6.823 -11.230 3.592 1.00 10.00 C ATOM 478 O ARG A 32 7.743 -11.307 4.403 1.00 10.00 O ATOM 479 CB ARG A 32 6.812 -9.622 1.588 1.00 10.00 C ATOM 480 CG ARG A 32 5.995 -10.320 0.484 1.00 10.00 C ATOM 481 CD ARG A 32 4.484 -10.039 0.531 1.00 10.00 C ATOM 482 NE ARG A 32 3.780 -10.968 1.436 1.00 10.00 N ATOM 483 CZ ARG A 32 2.949 -10.647 2.440 1.00 10.00 C ATOM 484 NH1 ARG A 32 2.587 -9.388 2.682 1.00 10.00 N ATOM 485 NH2 ARG A 32 2.486 -11.628 3.212 1.00 10.00 N ATOM 0 H ARG A 32 7.933 -9.119 4.220 1.00 10.00 H new ATOM 0 HA ARG A 32 5.301 -9.833 3.057 1.00 10.00 H new ATOM 0 HB2 ARG A 32 6.774 -8.548 1.407 1.00 10.00 H new ATOM 0 HB3 ARG A 32 7.853 -9.927 1.480 1.00 10.00 H new ATOM 0 HG2 ARG A 32 6.379 -10.007 -0.487 1.00 10.00 H new ATOM 0 HG3 ARG A 32 6.154 -11.396 0.558 1.00 10.00 H new ATOM 0 HD2 ARG A 32 4.315 -9.014 0.860 1.00 10.00 H new ATOM 0 HD3 ARG A 32 4.067 -10.124 -0.473 1.00 10.00 H new ATOM 0 HE ARG A 32 3.943 -11.963 1.282 1.00 10.00 H new ATOM 0 HH11 ARG A 32 2.943 -8.633 2.096 1.00 10.00 H new ATOM 0 HH12 ARG A 32 1.953 -9.179 3.454 1.00 10.00 H new ATOM 0 HH21 ARG A 32 2.764 -12.593 3.033 1.00 10.00 H new ATOM 0 HH22 ARG A 32 1.853 -11.415 3.983 1.00 10.00 H new ATOM 499 N SER A 33 6.195 -12.290 3.088 1.00 10.00 N ATOM 500 CA SER A 33 6.295 -13.663 3.566 1.00 10.00 C ATOM 501 C SER A 33 7.734 -14.209 3.650 1.00 10.00 C ATOM 502 O SER A 33 7.968 -15.148 4.399 1.00 10.00 O ATOM 503 CB SER A 33 5.408 -14.531 2.657 1.00 10.00 C ATOM 504 OG SER A 33 4.195 -13.856 2.294 1.00 10.00 O ATOM 0 H SER A 33 5.567 -12.206 2.289 1.00 10.00 H new ATOM 0 HA SER A 33 5.950 -13.691 4.600 1.00 10.00 H new ATOM 0 HB2 SER A 33 5.961 -14.796 1.755 1.00 10.00 H new ATOM 0 HB3 SER A 33 5.166 -15.463 3.168 1.00 10.00 H new ATOM 0 HG SER A 33 3.658 -14.437 1.715 1.00 10.00 H new ATOM 510 N GLY A 34 8.685 -13.623 2.913 1.00 10.00 N ATOM 511 CA GLY A 34 10.112 -13.917 3.015 1.00 10.00 C ATOM 512 C GLY A 34 10.965 -12.664 2.799 1.00 10.00 C ATOM 513 O GLY A 34 12.031 -12.751 2.195 1.00 10.00 O ATOM 0 H GLY A 34 8.474 -12.913 2.212 1.00 10.00 H new ATOM 0 HA2 GLY A 34 10.327 -14.339 3.997 1.00 10.00 H new ATOM 0 HA3 GLY A 34 10.382 -14.673 2.277 1.00 10.00 H new ATOM 517 N ALA A 35 10.467 -11.484 3.195 1.00 10.00 N ATOM 518 CA ALA A 35 11.216 -10.234 3.068 1.00 10.00 C ATOM 519 C ALA A 35 12.499 -10.276 3.923 1.00 10.00 C ATOM 520 O ALA A 35 12.470 -10.830 5.021 1.00 10.00 O ATOM 521 CB ALA A 35 10.334 -9.050 3.482 1.00 10.00 C ATOM 0 H ALA A 35 9.541 -11.373 3.609 1.00 10.00 H new ATOM 0 HA ALA A 35 11.508 -10.109 2.025 1.00 10.00 H new ATOM 0 HB1 ALA A 35 10.900 -8.123 3.384 1.00 10.00 H new ATOM 0 HB2 ALA A 35 9.455 -9.008 2.838 1.00 10.00 H new ATOM 0 HB3 ALA A 35 10.019 -9.176 4.518 1.00 10.00 H new ATOM 527 N PRO A 36 13.601 -9.639 3.483 1.00 10.00 N ATOM 528 CA PRO A 36 14.901 -9.675 4.158 1.00 10.00 C ATOM 529 C PRO A 36 14.984 -8.671 5.329 1.00 10.00 C ATOM 530 O PRO A 36 15.966 -7.940 5.452 1.00 10.00 O ATOM 531 CB PRO A 36 15.911 -9.402 3.031 1.00 10.00 C ATOM 532 CG PRO A 36 15.160 -8.412 2.144 1.00 10.00 C ATOM 533 CD PRO A 36 13.729 -8.946 2.205 1.00 10.00 C ATOM 0 HA PRO A 36 15.099 -10.629 4.646 1.00 10.00 H new ATOM 0 HB2 PRO A 36 16.840 -8.980 3.413 1.00 10.00 H new ATOM 0 HB3 PRO A 36 16.172 -10.312 2.492 1.00 10.00 H new ATOM 0 HG2 PRO A 36 15.231 -7.392 2.522 1.00 10.00 H new ATOM 0 HG3 PRO A 36 15.548 -8.402 1.125 1.00 10.00 H new ATOM 0 HD2 PRO A 36 13.008 -8.132 2.131 1.00 10.00 H new ATOM 0 HD3 PRO A 36 13.532 -9.624 1.374 1.00 10.00 H new ATOM 541 N ALA A 37 13.948 -8.591 6.167 1.00 10.00 N ATOM 542 CA ALA A 37 13.865 -7.659 7.283 1.00 10.00 C ATOM 543 C ALA A 37 13.151 -8.327 8.455 1.00 10.00 C ATOM 544 O ALA A 37 12.154 -9.017 8.252 1.00 10.00 O ATOM 545 CB ALA A 37 13.105 -6.408 6.833 1.00 10.00 C ATOM 0 H ALA A 37 13.126 -9.189 6.082 1.00 10.00 H new ATOM 0 HA ALA A 37 14.866 -7.371 7.605 1.00 10.00 H new ATOM 0 HB1 ALA A 37 13.038 -5.705 7.663 1.00 10.00 H new ATOM 0 HB2 ALA A 37 13.634 -5.940 6.002 1.00 10.00 H new ATOM 0 HB3 ALA A 37 12.101 -6.688 6.513 1.00 10.00 H new ATOM 551 N ALA A 38 13.667 -8.097 9.666 1.00 10.00 N ATOM 552 CA ALA A 38 13.144 -8.623 10.926 1.00 10.00 C ATOM 553 C ALA A 38 13.478 -7.666 12.086 1.00 10.00 C ATOM 554 O ALA A 38 13.678 -8.087 13.227 1.00 10.00 O ATOM 555 CB ALA A 38 13.713 -10.031 11.159 1.00 10.00 C ATOM 0 H ALA A 38 14.494 -7.515 9.798 1.00 10.00 H new ATOM 0 HA ALA A 38 12.058 -8.697 10.877 1.00 10.00 H new ATOM 0 HB1 ALA A 38 13.327 -10.429 12.097 1.00 10.00 H new ATOM 0 HB2 ALA A 38 13.416 -10.684 10.338 1.00 10.00 H new ATOM 0 HB3 ALA A 38 14.801 -9.981 11.207 1.00 10.00 H new ATOM 561 N GLU A 39 13.616 -6.370 11.789 1.00 10.00 N ATOM 562 CA GLU A 39 13.822 -5.322 12.789 1.00 10.00 C ATOM 563 C GLU A 39 12.550 -5.161 13.633 1.00 10.00 C ATOM 564 O GLU A 39 11.475 -5.613 13.228 1.00 10.00 O ATOM 565 CB GLU A 39 14.187 -3.996 12.095 1.00 10.00 C ATOM 566 CG GLU A 39 15.539 -4.068 11.365 1.00 10.00 C ATOM 567 CD GLU A 39 15.947 -2.711 10.766 1.00 10.00 C ATOM 568 OE1 GLU A 39 16.600 -1.941 11.504 1.00 10.00 O ATOM 569 OE2 GLU A 39 15.606 -2.467 9.591 1.00 10.00 O ATOM 0 H GLU A 39 13.587 -6.016 10.833 1.00 10.00 H new ATOM 0 HA GLU A 39 14.646 -5.602 13.446 1.00 10.00 H new ATOM 0 HB2 GLU A 39 13.405 -3.736 11.381 1.00 10.00 H new ATOM 0 HB3 GLU A 39 14.220 -3.198 12.837 1.00 10.00 H new ATOM 0 HG2 GLU A 39 16.309 -4.403 12.061 1.00 10.00 H new ATOM 0 HG3 GLU A 39 15.482 -4.812 10.570 1.00 10.00 H new ATOM 576 N SER A 40 12.642 -4.489 14.785 1.00 10.00 N ATOM 577 CA SER A 40 11.514 -4.255 15.685 1.00 10.00 C ATOM 578 C SER A 40 11.558 -2.832 16.254 1.00 10.00 C ATOM 579 O SER A 40 12.612 -2.202 16.264 1.00 10.00 O ATOM 580 CB SER A 40 11.546 -5.274 16.834 1.00 10.00 C ATOM 581 OG SER A 40 11.726 -6.609 16.379 1.00 10.00 O ATOM 0 H SER A 40 13.517 -4.087 15.121 1.00 10.00 H new ATOM 0 HA SER A 40 10.590 -4.373 15.119 1.00 10.00 H new ATOM 0 HB2 SER A 40 12.353 -5.016 17.520 1.00 10.00 H new ATOM 0 HB3 SER A 40 10.615 -5.209 17.398 1.00 10.00 H new ATOM 0 HG SER A 40 10.987 -7.166 16.700 1.00 10.00 H new ATOM 587 N LYS A 41 10.423 -2.331 16.750 1.00 10.00 N ATOM 588 CA LYS A 41 10.321 -1.077 17.510 1.00 10.00 C ATOM 589 C LYS A 41 9.175 -1.181 18.514 1.00 10.00 C ATOM 590 O LYS A 41 8.413 -2.142 18.448 1.00 10.00 O ATOM 591 CB LYS A 41 10.150 0.147 16.583 1.00 10.00 C ATOM 592 CG LYS A 41 8.767 0.294 15.913 1.00 10.00 C ATOM 593 CD LYS A 41 8.618 1.688 15.282 1.00 10.00 C ATOM 594 CE LYS A 41 7.211 1.901 14.707 1.00 10.00 C ATOM 595 NZ LYS A 41 7.014 3.297 14.257 1.00 10.00 N ATOM 0 H LYS A 41 9.524 -2.798 16.632 1.00 10.00 H new ATOM 0 HA LYS A 41 11.254 -0.925 18.052 1.00 10.00 H new ATOM 0 HB2 LYS A 41 10.350 1.048 17.162 1.00 10.00 H new ATOM 0 HB3 LYS A 41 10.908 0.096 15.801 1.00 10.00 H new ATOM 0 HG2 LYS A 41 8.644 -0.473 15.148 1.00 10.00 H new ATOM 0 HG3 LYS A 41 7.981 0.137 16.651 1.00 10.00 H new ATOM 0 HD2 LYS A 41 8.824 2.451 16.032 1.00 10.00 H new ATOM 0 HD3 LYS A 41 9.357 1.811 14.491 1.00 10.00 H new ATOM 0 HE2 LYS A 41 7.053 1.222 13.869 1.00 10.00 H new ATOM 0 HE3 LYS A 41 6.466 1.653 15.463 1.00 10.00 H new ATOM 0 HZ1 LYS A 41 6.020 3.437 13.985 1.00 10.00 H new ATOM 0 HZ2 LYS A 41 7.256 3.949 15.030 1.00 10.00 H new ATOM 0 HZ3 LYS A 41 7.627 3.488 13.439 1.00 10.00 H new ATOM 609 N GLU A 42 8.971 -0.172 19.355 1.00 10.00 N ATOM 610 CA GLU A 42 7.789 -0.068 20.202 1.00 10.00 C ATOM 611 C GLU A 42 6.835 0.960 19.593 1.00 10.00 C ATOM 612 O GLU A 42 7.288 1.903 18.941 1.00 10.00 O ATOM 613 CB GLU A 42 8.172 0.357 21.628 1.00 10.00 C ATOM 614 CG GLU A 42 8.886 -0.731 22.442 1.00 10.00 C ATOM 615 CD GLU A 42 10.337 -0.998 22.016 1.00 10.00 C ATOM 616 OE1 GLU A 42 11.120 -0.031 21.964 1.00 10.00 O ATOM 617 OE2 GLU A 42 10.672 -2.189 21.803 1.00 10.00 O ATOM 0 H GLU A 42 9.626 0.602 19.468 1.00 10.00 H new ATOM 0 HA GLU A 42 7.305 -1.043 20.259 1.00 10.00 H new ATOM 0 HB2 GLU A 42 8.817 1.234 21.572 1.00 10.00 H new ATOM 0 HB3 GLU A 42 7.269 0.658 22.159 1.00 10.00 H new ATOM 0 HG2 GLU A 42 8.877 -0.445 23.494 1.00 10.00 H new ATOM 0 HG3 GLU A 42 8.320 -1.659 22.359 1.00 10.00 H new ATOM 624 N ILE A 43 5.541 0.830 19.878 1.00 10.00 N ATOM 625 CA ILE A 43 4.502 1.803 19.558 1.00 10.00 C ATOM 626 C ILE A 43 3.604 2.014 20.778 1.00 10.00 C ATOM 627 O ILE A 43 3.448 1.120 21.614 1.00 10.00 O ATOM 628 CB ILE A 43 3.667 1.370 18.327 1.00 10.00 C ATOM 629 CG1 ILE A 43 2.939 0.019 18.532 1.00 10.00 C ATOM 630 CG2 ILE A 43 4.549 1.372 17.067 1.00 10.00 C ATOM 631 CD1 ILE A 43 1.956 -0.372 17.420 1.00 10.00 C ATOM 0 H ILE A 43 5.174 0.009 20.359 1.00 10.00 H new ATOM 0 HA ILE A 43 4.985 2.745 19.299 1.00 10.00 H new ATOM 0 HB ILE A 43 2.871 2.103 18.194 1.00 10.00 H new ATOM 0 HG12 ILE A 43 3.688 -0.768 18.626 1.00 10.00 H new ATOM 0 HG13 ILE A 43 2.397 0.057 19.477 1.00 10.00 H new ATOM 0 HG21 ILE A 43 3.954 1.066 16.206 1.00 10.00 H new ATOM 0 HG22 ILE A 43 4.942 2.375 16.899 1.00 10.00 H new ATOM 0 HG23 ILE A 43 5.377 0.676 17.201 1.00 10.00 H new ATOM 0 HD11 ILE A 43 1.500 -1.333 17.659 1.00 10.00 H new ATOM 0 HD12 ILE A 43 1.179 0.388 17.337 1.00 10.00 H new ATOM 0 HD13 ILE A 43 2.490 -0.449 16.473 1.00 10.00 H new ATOM 643 N VAL A 44 2.982 3.187 20.856 1.00 10.00 N ATOM 644 CA VAL A 44 2.041 3.546 21.915 1.00 10.00 C ATOM 645 C VAL A 44 0.653 3.537 21.276 1.00 10.00 C ATOM 646 O VAL A 44 0.453 4.185 20.240 1.00 10.00 O ATOM 647 CB VAL A 44 2.413 4.936 22.477 1.00 10.00 C ATOM 648 CG1 VAL A 44 1.522 5.350 23.657 1.00 10.00 C ATOM 649 CG2 VAL A 44 3.872 5.003 22.957 1.00 10.00 C ATOM 0 H VAL A 44 3.120 3.930 20.171 1.00 10.00 H new ATOM 0 HA VAL A 44 2.066 2.849 22.753 1.00 10.00 H new ATOM 0 HB VAL A 44 2.264 5.620 21.641 1.00 10.00 H new ATOM 0 HG11 VAL A 44 1.825 6.334 24.014 1.00 10.00 H new ATOM 0 HG12 VAL A 44 0.482 5.387 23.332 1.00 10.00 H new ATOM 0 HG13 VAL A 44 1.625 4.624 24.463 1.00 10.00 H new ATOM 0 HG21 VAL A 44 4.083 6.000 23.343 1.00 10.00 H new ATOM 0 HG22 VAL A 44 4.029 4.268 23.746 1.00 10.00 H new ATOM 0 HG23 VAL A 44 4.540 4.788 22.123 1.00 10.00 H new ATOM 659 N ARG A 45 -0.305 2.819 21.871 1.00 10.00 N ATOM 660 CA ARG A 45 -1.683 2.735 21.387 1.00 10.00 C ATOM 661 C ARG A 45 -2.610 2.991 22.569 1.00 10.00 C ATOM 662 O ARG A 45 -2.382 2.422 23.633 1.00 10.00 O ATOM 663 CB ARG A 45 -1.969 1.339 20.813 1.00 10.00 C ATOM 664 CG ARG A 45 -1.137 0.863 19.615 1.00 10.00 C ATOM 665 CD ARG A 45 -1.496 1.552 18.291 1.00 10.00 C ATOM 666 NE ARG A 45 -0.701 2.770 18.127 1.00 10.00 N ATOM 667 CZ ARG A 45 0.142 3.041 17.131 1.00 10.00 C ATOM 668 NH1 ARG A 45 0.077 2.419 15.956 1.00 10.00 N ATOM 669 NH2 ARG A 45 1.110 3.907 17.350 1.00 10.00 N ATOM 0 H ARG A 45 -0.140 2.272 22.716 1.00 10.00 H new ATOM 0 HA ARG A 45 -1.842 3.470 20.598 1.00 10.00 H new ATOM 0 HB2 ARG A 45 -1.839 0.615 21.617 1.00 10.00 H new ATOM 0 HB3 ARG A 45 -3.019 1.307 20.523 1.00 10.00 H new ATOM 0 HG2 ARG A 45 -0.082 1.035 19.828 1.00 10.00 H new ATOM 0 HG3 ARG A 45 -1.268 -0.213 19.500 1.00 10.00 H new ATOM 0 HD2 ARG A 45 -1.313 0.874 17.458 1.00 10.00 H new ATOM 0 HD3 ARG A 45 -2.558 1.797 18.275 1.00 10.00 H new ATOM 0 HE ARG A 45 -0.803 3.484 18.848 1.00 10.00 H new ATOM 0 HH11 ARG A 45 -0.636 1.708 15.794 1.00 10.00 H new ATOM 0 HH12 ARG A 45 0.740 2.654 15.217 1.00 10.00 H new ATOM 0 HH21 ARG A 45 1.200 4.351 18.264 1.00 10.00 H new ATOM 0 HH22 ARG A 45 1.770 4.133 16.606 1.00 10.00 H new ATOM 683 N GLY A 46 -3.640 3.814 22.392 1.00 10.00 N ATOM 684 CA GLY A 46 -4.469 4.300 23.491 1.00 10.00 C ATOM 685 C GLY A 46 -5.776 4.864 22.965 1.00 10.00 C ATOM 686 O GLY A 46 -6.121 6.009 23.255 1.00 10.00 O ATOM 0 H GLY A 46 -3.924 4.164 21.477 1.00 10.00 H new ATOM 0 HA2 GLY A 46 -4.672 3.487 24.188 1.00 10.00 H new ATOM 0 HA3 GLY A 46 -3.932 5.069 24.046 1.00 10.00 H new ATOM 690 N TYR A 47 -6.460 4.105 22.109 1.00 10.00 N ATOM 691 CA TYR A 47 -7.734 4.518 21.546 1.00 10.00 C ATOM 692 C TYR A 47 -8.798 4.516 22.640 1.00 10.00 C ATOM 693 O TYR A 47 -8.945 3.526 23.353 1.00 10.00 O ATOM 694 CB TYR A 47 -8.158 3.559 20.435 1.00 10.00 C ATOM 695 CG TYR A 47 -7.139 3.331 19.337 1.00 10.00 C ATOM 696 CD1 TYR A 47 -6.980 4.280 18.311 1.00 10.00 C ATOM 697 CD2 TYR A 47 -6.391 2.139 19.312 1.00 10.00 C ATOM 698 CE1 TYR A 47 -6.085 4.032 17.255 1.00 10.00 C ATOM 699 CE2 TYR A 47 -5.485 1.889 18.265 1.00 10.00 C ATOM 700 CZ TYR A 47 -5.328 2.842 17.232 1.00 10.00 C ATOM 701 OH TYR A 47 -4.477 2.599 16.201 1.00 10.00 O ATOM 0 H TYR A 47 -6.143 3.189 21.790 1.00 10.00 H new ATOM 0 HA TYR A 47 -7.627 5.521 21.132 1.00 10.00 H new ATOM 0 HB2 TYR A 47 -8.401 2.596 20.885 1.00 10.00 H new ATOM 0 HB3 TYR A 47 -9.073 3.940 19.982 1.00 10.00 H new ATOM 0 HD1 TYR A 47 -7.546 5.200 18.334 1.00 10.00 H new ATOM 0 HD2 TYR A 47 -6.513 1.412 20.101 1.00 10.00 H new ATOM 0 HE1 TYR A 47 -5.977 4.755 16.460 1.00 10.00 H new ATOM 0 HE2 TYR A 47 -4.912 0.974 18.250 1.00 10.00 H new ATOM 0 HH TYR A 47 -4.033 1.737 16.340 1.00 10.00 H new ATOM 711 N LYS A 48 -9.590 5.593 22.736 1.00 10.00 N ATOM 712 CA LYS A 48 -10.608 5.712 23.781 1.00 10.00 C ATOM 713 C LYS A 48 -11.732 4.680 23.658 1.00 10.00 C ATOM 714 O LYS A 48 -12.379 4.400 24.655 1.00 10.00 O ATOM 715 CB LYS A 48 -11.149 7.153 23.859 1.00 10.00 C ATOM 716 CG LYS A 48 -12.025 7.588 22.671 1.00 10.00 C ATOM 717 CD LYS A 48 -12.534 9.022 22.887 1.00 10.00 C ATOM 718 CE LYS A 48 -13.563 9.468 21.835 1.00 10.00 C ATOM 719 NZ LYS A 48 -13.019 9.475 20.457 1.00 10.00 N ATOM 0 H LYS A 48 -9.543 6.391 22.103 1.00 10.00 H new ATOM 0 HA LYS A 48 -10.113 5.484 24.725 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -11.730 7.257 24.776 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -10.304 7.838 23.937 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -11.451 7.533 21.746 1.00 10.00 H new ATOM 0 HG3 LYS A 48 -12.869 6.907 22.563 1.00 10.00 H new ATOM 0 HD2 LYS A 48 -12.983 9.095 23.878 1.00 10.00 H new ATOM 0 HD3 LYS A 48 -11.687 9.707 22.869 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -14.426 8.804 21.875 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -13.918 10.468 22.084 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -13.724 9.879 19.808 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -12.152 10.049 20.429 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -12.799 8.501 20.166 1.00 10.00 H new ATOM 733 N TRP A 49 -12.017 4.176 22.450 1.00 10.00 N ATOM 734 CA TRP A 49 -13.104 3.221 22.241 1.00 10.00 C ATOM 735 C TRP A 49 -12.835 1.861 22.900 1.00 10.00 C ATOM 736 O TRP A 49 -13.783 1.108 23.094 1.00 10.00 O ATOM 737 CB TRP A 49 -13.432 3.074 20.738 1.00 10.00 C ATOM 738 CG TRP A 49 -12.296 2.798 19.789 1.00 10.00 C ATOM 739 CD1 TRP A 49 -11.818 3.672 18.873 1.00 10.00 C ATOM 740 CD2 TRP A 49 -11.474 1.593 19.642 1.00 10.00 C ATOM 741 NE1 TRP A 49 -10.757 3.112 18.192 1.00 10.00 N ATOM 742 CE2 TRP A 49 -10.450 1.863 18.685 1.00 10.00 C ATOM 743 CE3 TRP A 49 -11.457 0.310 20.226 1.00 10.00 C ATOM 744 CZ2 TRP A 49 -9.404 0.969 18.420 1.00 10.00 C ATOM 745 CZ3 TRP A 49 -10.398 -0.589 19.992 1.00 10.00 C ATOM 746 CH2 TRP A 49 -9.350 -0.246 19.123 1.00 10.00 C ATOM 0 H TRP A 49 -11.505 4.418 21.602 1.00 10.00 H new ATOM 0 HA TRP A 49 -13.983 3.629 22.739 1.00 10.00 H new ATOM 0 HB2 TRP A 49 -14.158 2.268 20.632 1.00 10.00 H new ATOM 0 HB3 TRP A 49 -13.923 3.991 20.412 1.00 10.00 H new ATOM 0 HD1 TRP A 49 -12.210 4.663 18.700 1.00 10.00 H new ATOM 0 HE1 TRP A 49 -10.263 3.565 17.423 1.00 10.00 H new ATOM 0 HE3 TRP A 49 -12.273 0.010 20.866 1.00 10.00 H new ATOM 0 HZ2 TRP A 49 -8.650 1.211 17.686 1.00 10.00 H new ATOM 0 HZ3 TRP A 49 -10.392 -1.550 20.485 1.00 10.00 H new ATOM 0 HH2 TRP A 49 -8.509 -0.911 18.996 1.00 10.00 H new ATOM 757 N ALA A 50 -11.572 1.505 23.159 1.00 10.00 N ATOM 758 CA ALA A 50 -11.235 0.183 23.663 1.00 10.00 C ATOM 759 C ALA A 50 -11.724 0.019 25.100 1.00 10.00 C ATOM 760 O ALA A 50 -11.347 0.795 25.980 1.00 10.00 O ATOM 761 CB ALA A 50 -9.726 -0.041 23.568 1.00 10.00 C ATOM 0 H ALA A 50 -10.770 2.120 23.025 1.00 10.00 H new ATOM 0 HA ALA A 50 -11.735 -0.569 23.052 1.00 10.00 H new ATOM 0 HB1 ALA A 50 -9.481 -1.033 23.947 1.00 10.00 H new ATOM 0 HB2 ALA A 50 -9.411 0.038 22.527 1.00 10.00 H new ATOM 0 HB3 ALA A 50 -9.208 0.712 24.162 1.00 10.00 H new ATOM 767 N GLU A 51 -12.450 -1.068 25.357 1.00 10.00 N ATOM 768 CA GLU A 51 -12.881 -1.434 26.705 1.00 10.00 C ATOM 769 C GLU A 51 -11.699 -1.995 27.512 1.00 10.00 C ATOM 770 O GLU A 51 -11.679 -1.936 28.749 1.00 10.00 O ATOM 771 CB GLU A 51 -14.012 -2.475 26.625 1.00 10.00 C ATOM 772 CG GLU A 51 -15.334 -1.919 26.063 1.00 10.00 C ATOM 773 CD GLU A 51 -16.003 -0.893 27.000 1.00 10.00 C ATOM 774 OE1 GLU A 51 -16.692 -1.329 27.953 1.00 10.00 O ATOM 775 OE2 GLU A 51 -15.796 0.318 26.775 1.00 10.00 O ATOM 0 H GLU A 51 -12.756 -1.720 24.635 1.00 10.00 H new ATOM 0 HA GLU A 51 -13.252 -0.543 27.211 1.00 10.00 H new ATOM 0 HB2 GLU A 51 -13.684 -3.306 26.000 1.00 10.00 H new ATOM 0 HB3 GLU A 51 -14.193 -2.878 27.622 1.00 10.00 H new ATOM 0 HG2 GLU A 51 -15.143 -1.451 25.097 1.00 10.00 H new ATOM 0 HG3 GLU A 51 -16.023 -2.745 25.886 1.00 10.00 H new ATOM 782 N TYR A 52 -10.676 -2.541 26.840 1.00 10.00 N ATOM 783 CA TYR A 52 -9.529 -3.194 27.454 1.00 10.00 C ATOM 784 C TYR A 52 -8.288 -2.963 26.596 1.00 10.00 C ATOM 785 O TYR A 52 -8.368 -2.856 25.380 1.00 10.00 O ATOM 786 CB TYR A 52 -9.782 -4.707 27.580 1.00 10.00 C ATOM 787 CG TYR A 52 -10.891 -5.091 28.541 1.00 10.00 C ATOM 788 CD1 TYR A 52 -10.618 -5.212 29.918 1.00 10.00 C ATOM 789 CD2 TYR A 52 -12.193 -5.328 28.061 1.00 10.00 C ATOM 790 CE1 TYR A 52 -11.648 -5.553 30.814 1.00 10.00 C ATOM 791 CE2 TYR A 52 -13.228 -5.669 28.950 1.00 10.00 C ATOM 792 CZ TYR A 52 -12.957 -5.782 30.333 1.00 10.00 C ATOM 793 OH TYR A 52 -13.943 -6.102 31.212 1.00 10.00 O ATOM 0 H TYR A 52 -10.630 -2.536 25.821 1.00 10.00 H new ATOM 0 HA TYR A 52 -9.376 -2.772 28.447 1.00 10.00 H new ATOM 0 HB2 TYR A 52 -10.022 -5.104 26.594 1.00 10.00 H new ATOM 0 HB3 TYR A 52 -8.859 -5.189 27.902 1.00 10.00 H new ATOM 0 HD1 TYR A 52 -9.617 -5.043 30.286 1.00 10.00 H new ATOM 0 HD2 TYR A 52 -12.398 -5.247 27.004 1.00 10.00 H new ATOM 0 HE1 TYR A 52 -11.438 -5.640 31.870 1.00 10.00 H new ATOM 0 HE2 TYR A 52 -14.227 -5.844 28.577 1.00 10.00 H new ATOM 0 HH TYR A 52 -14.785 -6.227 30.727 1.00 10.00 H new ATOM 803 N HIS A 53 -7.123 -2.980 27.243 1.00 10.00 N ATOM 804 CA HIS A 53 -5.816 -3.017 26.582 1.00 10.00 C ATOM 805 C HIS A 53 -5.729 -4.188 25.592 1.00 10.00 C ATOM 806 O HIS A 53 -5.191 -4.022 24.501 1.00 10.00 O ATOM 807 CB HIS A 53 -4.718 -3.092 27.660 1.00 10.00 C ATOM 808 CG HIS A 53 -5.089 -3.983 28.828 1.00 10.00 C ATOM 809 ND1 HIS A 53 -5.256 -5.368 28.777 1.00 10.00 N ATOM 810 CD2 HIS A 53 -5.529 -3.537 30.043 1.00 10.00 C ATOM 811 CE1 HIS A 53 -5.734 -5.731 29.975 1.00 10.00 C ATOM 812 NE2 HIS A 53 -5.917 -4.649 30.754 1.00 10.00 N ATOM 0 H HIS A 53 -7.059 -2.968 28.261 1.00 10.00 H new ATOM 0 HA HIS A 53 -5.674 -2.109 25.997 1.00 10.00 H new ATOM 0 HB2 HIS A 53 -3.798 -3.461 27.207 1.00 10.00 H new ATOM 0 HB3 HIS A 53 -4.511 -2.088 28.029 1.00 10.00 H new ATOM 0 HD2 HIS A 53 -5.565 -2.511 30.379 1.00 10.00 H new ATOM 0 HE1 HIS A 53 -5.943 -6.748 30.273 1.00 10.00 H new ATOM 0 HE2 HIS A 53 -6.281 -4.653 31.707 1.00 10.00 H new ATOM 820 N ALA A 54 -6.321 -5.335 25.938 1.00 10.00 N ATOM 821 CA ALA A 54 -6.398 -6.495 25.064 1.00 10.00 C ATOM 822 C ALA A 54 -7.187 -6.213 23.779 1.00 10.00 C ATOM 823 O ALA A 54 -6.859 -6.795 22.751 1.00 10.00 O ATOM 824 CB ALA A 54 -7.020 -7.668 25.829 1.00 10.00 C ATOM 0 H ALA A 54 -6.764 -5.479 26.845 1.00 10.00 H new ATOM 0 HA ALA A 54 -5.383 -6.748 24.757 1.00 10.00 H new ATOM 0 HB1 ALA A 54 -7.079 -8.538 25.176 1.00 10.00 H new ATOM 0 HB2 ALA A 54 -6.403 -7.906 26.695 1.00 10.00 H new ATOM 0 HB3 ALA A 54 -8.022 -7.396 26.161 1.00 10.00 H new ATOM 830 N ASP A 55 -8.188 -5.326 23.822 1.00 10.00 N ATOM 831 CA ASP A 55 -8.984 -4.985 22.633 1.00 10.00 C ATOM 832 C ASP A 55 -8.120 -4.200 21.645 1.00 10.00 C ATOM 833 O ASP A 55 -8.146 -4.419 20.436 1.00 10.00 O ATOM 834 CB ASP A 55 -10.209 -4.139 23.027 1.00 10.00 C ATOM 835 CG ASP A 55 -11.287 -4.053 21.934 1.00 10.00 C ATOM 836 OD1 ASP A 55 -11.409 -5.002 21.137 1.00 10.00 O ATOM 837 OD2 ASP A 55 -12.027 -3.045 21.955 1.00 10.00 O ATOM 0 H ASP A 55 -8.468 -4.830 24.668 1.00 10.00 H new ATOM 0 HA ASP A 55 -9.329 -5.908 22.168 1.00 10.00 H new ATOM 0 HB2 ASP A 55 -10.653 -4.560 23.929 1.00 10.00 H new ATOM 0 HB3 ASP A 55 -9.877 -3.131 23.276 1.00 10.00 H new ATOM 842 N ILE A 56 -7.274 -3.306 22.185 1.00 10.00 N ATOM 843 CA ILE A 56 -6.292 -2.572 21.404 1.00 10.00 C ATOM 844 C ILE A 56 -5.312 -3.575 20.797 1.00 10.00 C ATOM 845 O ILE A 56 -5.083 -3.534 19.587 1.00 10.00 O ATOM 846 CB ILE A 56 -5.558 -1.516 22.270 1.00 10.00 C ATOM 847 CG1 ILE A 56 -6.528 -0.552 22.983 1.00 10.00 C ATOM 848 CG2 ILE A 56 -4.571 -0.738 21.390 1.00 10.00 C ATOM 849 CD1 ILE A 56 -5.871 0.459 23.934 1.00 10.00 C ATOM 0 H ILE A 56 -7.261 -3.079 23.179 1.00 10.00 H new ATOM 0 HA ILE A 56 -6.793 -2.024 20.606 1.00 10.00 H new ATOM 0 HB ILE A 56 -5.019 -2.045 23.056 1.00 10.00 H new ATOM 0 HG12 ILE A 56 -7.089 -0.003 22.227 1.00 10.00 H new ATOM 0 HG13 ILE A 56 -7.249 -1.142 23.549 1.00 10.00 H new ATOM 0 HG21 ILE A 56 -4.052 0.006 21.995 1.00 10.00 H new ATOM 0 HG22 ILE A 56 -3.844 -1.428 20.961 1.00 10.00 H new ATOM 0 HG23 ILE A 56 -5.114 -0.239 20.588 1.00 10.00 H new ATOM 0 HD11 ILE A 56 -6.639 1.088 24.383 1.00 10.00 H new ATOM 0 HD12 ILE A 56 -5.335 -0.075 24.719 1.00 10.00 H new ATOM 0 HD13 ILE A 56 -5.172 1.082 23.376 1.00 10.00 H new ATOM 861 N TYR A 57 -4.710 -4.439 21.627 1.00 10.00 N ATOM 862 CA TYR A 57 -3.714 -5.398 21.167 1.00 10.00 C ATOM 863 C TYR A 57 -4.260 -6.255 20.028 1.00 10.00 C ATOM 864 O TYR A 57 -3.577 -6.396 19.014 1.00 10.00 O ATOM 865 CB TYR A 57 -3.238 -6.283 22.325 1.00 10.00 C ATOM 866 CG TYR A 57 -2.315 -7.411 21.886 1.00 10.00 C ATOM 867 CD1 TYR A 57 -1.078 -7.115 21.282 1.00 10.00 C ATOM 868 CD2 TYR A 57 -2.712 -8.754 22.037 1.00 10.00 C ATOM 869 CE1 TYR A 57 -0.237 -8.150 20.840 1.00 10.00 C ATOM 870 CE2 TYR A 57 -1.879 -9.794 21.586 1.00 10.00 C ATOM 871 CZ TYR A 57 -0.637 -9.498 20.974 1.00 10.00 C ATOM 872 OH TYR A 57 0.143 -10.509 20.504 1.00 10.00 O ATOM 0 H TYR A 57 -4.903 -4.487 22.627 1.00 10.00 H new ATOM 0 HA TYR A 57 -2.860 -4.837 20.788 1.00 10.00 H new ATOM 0 HB2 TYR A 57 -2.719 -5.663 23.056 1.00 10.00 H new ATOM 0 HB3 TYR A 57 -4.106 -6.709 22.827 1.00 10.00 H new ATOM 0 HD1 TYR A 57 -0.774 -6.086 21.158 1.00 10.00 H new ATOM 0 HD2 TYR A 57 -3.659 -8.986 22.501 1.00 10.00 H new ATOM 0 HE1 TYR A 57 0.719 -7.914 20.396 1.00 10.00 H new ATOM 0 HE2 TYR A 57 -2.188 -10.822 21.707 1.00 10.00 H new ATOM 0 HH TYR A 57 0.899 -10.134 20.006 1.00 10.00 H new ATOM 882 N ASP A 58 -5.478 -6.779 20.169 1.00 10.00 N ATOM 883 CA ASP A 58 -6.091 -7.631 19.149 1.00 10.00 C ATOM 884 C ASP A 58 -6.264 -6.882 17.826 1.00 10.00 C ATOM 885 O ASP A 58 -5.830 -7.360 16.772 1.00 10.00 O ATOM 886 CB ASP A 58 -7.446 -8.163 19.633 1.00 10.00 C ATOM 887 CG ASP A 58 -8.123 -9.013 18.545 1.00 10.00 C ATOM 888 OD1 ASP A 58 -7.676 -10.169 18.361 1.00 10.00 O ATOM 889 OD2 ASP A 58 -9.044 -8.494 17.882 1.00 10.00 O ATOM 0 H ASP A 58 -6.065 -6.626 20.989 1.00 10.00 H new ATOM 0 HA ASP A 58 -5.420 -8.473 18.977 1.00 10.00 H new ATOM 0 HB2 ASP A 58 -7.306 -8.762 20.533 1.00 10.00 H new ATOM 0 HB3 ASP A 58 -8.093 -7.329 19.903 1.00 10.00 H new ATOM 894 N LYS A 59 -6.800 -5.651 17.876 1.00 10.00 N ATOM 895 CA LYS A 59 -7.054 -4.883 16.658 1.00 10.00 C ATOM 896 C LYS A 59 -5.733 -4.534 15.983 1.00 10.00 C ATOM 897 O LYS A 59 -5.603 -4.672 14.766 1.00 10.00 O ATOM 898 CB LYS A 59 -7.895 -3.637 16.987 1.00 10.00 C ATOM 899 CG LYS A 59 -8.392 -2.959 15.699 1.00 10.00 C ATOM 900 CD LYS A 59 -9.327 -1.783 16.002 1.00 10.00 C ATOM 901 CE LYS A 59 -9.914 -1.219 14.701 1.00 10.00 C ATOM 902 NZ LYS A 59 -10.859 -0.100 14.942 1.00 10.00 N ATOM 0 H LYS A 59 -7.061 -5.175 18.740 1.00 10.00 H new ATOM 0 HA LYS A 59 -7.631 -5.482 15.953 1.00 10.00 H new ATOM 0 HB2 LYS A 59 -8.746 -3.920 17.606 1.00 10.00 H new ATOM 0 HB3 LYS A 59 -7.299 -2.933 17.567 1.00 10.00 H new ATOM 0 HG2 LYS A 59 -7.538 -2.605 15.121 1.00 10.00 H new ATOM 0 HG3 LYS A 59 -8.914 -3.690 15.081 1.00 10.00 H new ATOM 0 HD2 LYS A 59 -10.132 -2.110 16.660 1.00 10.00 H new ATOM 0 HD3 LYS A 59 -8.780 -1.002 16.531 1.00 10.00 H new ATOM 0 HE2 LYS A 59 -9.103 -0.874 14.060 1.00 10.00 H new ATOM 0 HE3 LYS A 59 -10.428 -2.015 14.163 1.00 10.00 H new ATOM 0 HZ1 LYS A 59 -11.227 0.245 14.033 1.00 10.00 H new ATOM 0 HZ2 LYS A 59 -11.649 -0.433 15.531 1.00 10.00 H new ATOM 0 HZ3 LYS A 59 -10.364 0.673 15.431 1.00 10.00 H new ATOM 916 N VAL A 60 -4.767 -4.038 16.756 1.00 10.00 N ATOM 917 CA VAL A 60 -3.489 -3.584 16.230 1.00 10.00 C ATOM 918 C VAL A 60 -2.697 -4.769 15.676 1.00 10.00 C ATOM 919 O VAL A 60 -2.088 -4.617 14.624 1.00 10.00 O ATOM 920 CB VAL A 60 -2.742 -2.798 17.322 1.00 10.00 C ATOM 921 CG1 VAL A 60 -1.322 -2.386 16.901 1.00 10.00 C ATOM 922 CG2 VAL A 60 -3.523 -1.510 17.657 1.00 10.00 C ATOM 0 H VAL A 60 -4.854 -3.941 17.768 1.00 10.00 H new ATOM 0 HA VAL A 60 -3.637 -2.903 15.392 1.00 10.00 H new ATOM 0 HB VAL A 60 -2.666 -3.463 18.183 1.00 10.00 H new ATOM 0 HG11 VAL A 60 -0.847 -1.835 17.713 1.00 10.00 H new ATOM 0 HG12 VAL A 60 -0.736 -3.277 16.676 1.00 10.00 H new ATOM 0 HG13 VAL A 60 -1.374 -1.753 16.015 1.00 10.00 H new ATOM 0 HG21 VAL A 60 -2.993 -0.954 18.430 1.00 10.00 H new ATOM 0 HG22 VAL A 60 -3.610 -0.894 16.762 1.00 10.00 H new ATOM 0 HG23 VAL A 60 -4.519 -1.771 18.015 1.00 10.00 H new ATOM 932 N SER A 61 -2.717 -5.938 16.322 1.00 10.00 N ATOM 933 CA SER A 61 -2.068 -7.130 15.778 1.00 10.00 C ATOM 934 C SER A 61 -2.665 -7.497 14.417 1.00 10.00 C ATOM 935 O SER A 61 -1.916 -7.739 13.472 1.00 10.00 O ATOM 936 CB SER A 61 -2.197 -8.306 16.749 1.00 10.00 C ATOM 937 OG SER A 61 -1.650 -7.950 18.001 1.00 10.00 O ATOM 0 H SER A 61 -3.176 -6.083 17.222 1.00 10.00 H new ATOM 0 HA SER A 61 -1.010 -6.908 15.643 1.00 10.00 H new ATOM 0 HB2 SER A 61 -3.245 -8.582 16.864 1.00 10.00 H new ATOM 0 HB3 SER A 61 -1.680 -9.178 16.350 1.00 10.00 H new ATOM 0 HG SER A 61 -2.347 -7.546 18.559 1.00 10.00 H new ATOM 943 N GLY A 62 -3.997 -7.468 14.295 1.00 10.00 N ATOM 944 CA GLY A 62 -4.669 -7.732 13.032 1.00 10.00 C ATOM 945 C GLY A 62 -4.235 -6.729 11.964 1.00 10.00 C ATOM 946 O GLY A 62 -3.922 -7.116 10.838 1.00 10.00 O ATOM 0 H GLY A 62 -4.630 -7.262 15.068 1.00 10.00 H new ATOM 0 HA2 GLY A 62 -4.442 -8.745 12.699 1.00 10.00 H new ATOM 0 HA3 GLY A 62 -5.749 -7.677 13.171 1.00 10.00 H new ATOM 950 N ASP A 63 -4.209 -5.437 12.300 1.00 10.00 N ATOM 951 CA ASP A 63 -3.791 -4.398 11.363 1.00 10.00 C ATOM 952 C ASP A 63 -2.342 -4.602 10.938 1.00 10.00 C ATOM 953 O ASP A 63 -2.068 -4.645 9.742 1.00 10.00 O ATOM 954 CB ASP A 63 -3.980 -2.992 11.941 1.00 10.00 C ATOM 955 CG ASP A 63 -3.672 -1.941 10.863 1.00 10.00 C ATOM 956 OD1 ASP A 63 -4.597 -1.656 10.069 1.00 10.00 O ATOM 957 OD2 ASP A 63 -2.510 -1.478 10.803 1.00 10.00 O ATOM 0 H ASP A 63 -4.475 -5.087 13.220 1.00 10.00 H new ATOM 0 HA ASP A 63 -4.432 -4.484 10.486 1.00 10.00 H new ATOM 0 HB2 ASP A 63 -5.002 -2.870 12.299 1.00 10.00 H new ATOM 0 HB3 ASP A 63 -3.323 -2.850 12.799 1.00 10.00 H new ATOM 962 N MET A 64 -1.431 -4.825 11.887 1.00 10.00 N ATOM 963 CA MET A 64 -0.017 -5.018 11.605 1.00 10.00 C ATOM 964 C MET A 64 0.204 -6.222 10.701 1.00 10.00 C ATOM 965 O MET A 64 1.039 -6.149 9.802 1.00 10.00 O ATOM 966 CB MET A 64 0.789 -5.182 12.901 1.00 10.00 C ATOM 967 CG MET A 64 1.025 -3.850 13.620 1.00 10.00 C ATOM 968 SD MET A 64 1.810 -2.548 12.635 1.00 10.00 S ATOM 969 CE MET A 64 0.555 -1.265 12.849 1.00 10.00 C ATOM 0 H MET A 64 -1.661 -4.876 12.879 1.00 10.00 H new ATOM 0 HA MET A 64 0.335 -4.126 11.087 1.00 10.00 H new ATOM 0 HB2 MET A 64 0.261 -5.863 13.569 1.00 10.00 H new ATOM 0 HB3 MET A 64 1.750 -5.642 12.671 1.00 10.00 H new ATOM 0 HG2 MET A 64 0.065 -3.478 13.980 1.00 10.00 H new ATOM 0 HG3 MET A 64 1.643 -4.038 14.498 1.00 10.00 H new ATOM 0 HE1 MET A 64 0.722 -0.468 12.124 1.00 10.00 H new ATOM 0 HE2 MET A 64 -0.435 -1.695 12.694 1.00 10.00 H new ATOM 0 HE3 MET A 64 0.620 -0.857 13.858 1.00 10.00 H new ATOM 979 N GLN A 65 -0.544 -7.307 10.889 1.00 10.00 N ATOM 980 CA GLN A 65 -0.438 -8.485 10.041 1.00 10.00 C ATOM 981 C GLN A 65 -0.844 -8.151 8.600 1.00 10.00 C ATOM 982 O GLN A 65 -0.237 -8.675 7.664 1.00 10.00 O ATOM 983 CB GLN A 65 -1.262 -9.618 10.668 1.00 10.00 C ATOM 984 CG GLN A 65 -0.542 -10.185 11.912 1.00 10.00 C ATOM 985 CD GLN A 65 -1.433 -11.049 12.808 1.00 10.00 C ATOM 986 OE1 GLN A 65 -2.501 -11.508 12.409 1.00 10.00 O ATOM 987 NE2 GLN A 65 -1.018 -11.312 14.038 1.00 10.00 N ATOM 0 H GLN A 65 -1.238 -7.391 11.632 1.00 10.00 H new ATOM 0 HA GLN A 65 0.595 -8.827 9.980 1.00 10.00 H new ATOM 0 HB2 GLN A 65 -2.248 -9.247 10.949 1.00 10.00 H new ATOM 0 HB3 GLN A 65 -1.416 -10.411 9.937 1.00 10.00 H new ATOM 0 HG2 GLN A 65 0.312 -10.779 11.586 1.00 10.00 H new ATOM 0 HG3 GLN A 65 -0.148 -9.356 12.500 1.00 10.00 H new ATOM 0 HE21 GLN A 65 -0.132 -10.931 14.370 1.00 10.00 H new ATOM 0 HE22 GLN A 65 -1.585 -11.895 14.654 1.00 10.00 H new ATOM 996 N LYS A 66 -1.818 -7.255 8.394 1.00 10.00 N ATOM 997 CA LYS A 66 -2.126 -6.737 7.061 1.00 10.00 C ATOM 998 C LYS A 66 -1.018 -5.815 6.531 1.00 10.00 C ATOM 999 O LYS A 66 -0.817 -5.799 5.317 1.00 10.00 O ATOM 1000 CB LYS A 66 -3.488 -6.020 7.038 1.00 10.00 C ATOM 1001 CG LYS A 66 -4.646 -6.984 7.341 1.00 10.00 C ATOM 1002 CD LYS A 66 -6.031 -6.324 7.246 1.00 10.00 C ATOM 1003 CE LYS A 66 -6.245 -5.268 8.341 1.00 10.00 C ATOM 1004 NZ LYS A 66 -7.605 -4.673 8.292 1.00 10.00 N ATOM 0 H LYS A 66 -2.405 -6.875 9.137 1.00 10.00 H new ATOM 0 HA LYS A 66 -2.183 -7.598 6.395 1.00 10.00 H new ATOM 0 HB2 LYS A 66 -3.486 -5.213 7.770 1.00 10.00 H new ATOM 0 HB3 LYS A 66 -3.642 -5.563 6.060 1.00 10.00 H new ATOM 0 HG2 LYS A 66 -4.603 -7.822 6.645 1.00 10.00 H new ATOM 0 HG3 LYS A 66 -4.515 -7.394 8.342 1.00 10.00 H new ATOM 0 HD2 LYS A 66 -6.144 -5.858 6.267 1.00 10.00 H new ATOM 0 HD3 LYS A 66 -6.803 -7.089 7.325 1.00 10.00 H new ATOM 0 HE2 LYS A 66 -6.085 -5.724 9.318 1.00 10.00 H new ATOM 0 HE3 LYS A 66 -5.501 -4.479 8.232 1.00 10.00 H new ATOM 0 HZ1 LYS A 66 -7.702 -3.967 9.049 1.00 10.00 H new ATOM 0 HZ2 LYS A 66 -7.750 -4.215 7.370 1.00 10.00 H new ATOM 0 HZ3 LYS A 66 -8.316 -5.421 8.423 1.00 10.00 H new ATOM 1018 N GLN A 67 -0.328 -5.056 7.389 1.00 10.00 N ATOM 1019 CA GLN A 67 0.765 -4.185 6.954 1.00 10.00 C ATOM 1020 C GLN A 67 1.933 -5.043 6.447 1.00 10.00 C ATOM 1021 O GLN A 67 2.441 -4.838 5.349 1.00 10.00 O ATOM 1022 CB GLN A 67 1.264 -3.254 8.088 1.00 10.00 C ATOM 1023 CG GLN A 67 0.246 -2.302 8.734 1.00 10.00 C ATOM 1024 CD GLN A 67 -0.477 -1.355 7.779 1.00 10.00 C ATOM 1025 OE1 GLN A 67 -0.041 -1.085 6.664 1.00 10.00 O ATOM 1026 NE2 GLN A 67 -1.599 -0.814 8.216 1.00 10.00 N ATOM 0 H GLN A 67 -0.509 -5.029 8.392 1.00 10.00 H new ATOM 0 HA GLN A 67 0.380 -3.552 6.154 1.00 10.00 H new ATOM 0 HB2 GLN A 67 1.683 -3.880 8.875 1.00 10.00 H new ATOM 0 HB3 GLN A 67 2.081 -2.651 7.691 1.00 10.00 H new ATOM 0 HG2 GLN A 67 -0.500 -2.899 9.258 1.00 10.00 H new ATOM 0 HG3 GLN A 67 0.762 -1.705 9.486 1.00 10.00 H new ATOM 0 HE21 GLN A 67 -1.950 -1.047 9.145 1.00 10.00 H new ATOM 0 HE22 GLN A 67 -2.115 -0.163 7.625 1.00 10.00 H new ATOM 1035 N GLY A 68 2.370 -5.986 7.284 1.00 10.00 N ATOM 1036 CA GLY A 68 3.582 -6.768 7.110 1.00 10.00 C ATOM 1037 C GLY A 68 4.410 -6.748 8.392 1.00 10.00 C ATOM 1038 O GLY A 68 5.612 -6.488 8.348 1.00 10.00 O ATOM 0 H GLY A 68 1.864 -6.231 8.135 1.00 10.00 H new ATOM 0 HA2 GLY A 68 3.327 -7.795 6.849 1.00 10.00 H new ATOM 0 HA3 GLY A 68 4.168 -6.366 6.284 1.00 10.00 H new ATOM 1042 N CYS A 69 3.777 -6.900 9.557 1.00 10.00 N ATOM 1043 CA CYS A 69 4.395 -6.904 10.878 1.00 10.00 C ATOM 1044 C CYS A 69 3.585 -7.836 11.791 1.00 10.00 C ATOM 1045 O CYS A 69 2.522 -8.306 11.398 1.00 10.00 O ATOM 1046 CB CYS A 69 4.381 -5.472 11.438 1.00 10.00 C ATOM 1047 SG CYS A 69 5.611 -4.414 10.622 1.00 10.00 S ATOM 0 H CYS A 69 2.766 -7.030 9.603 1.00 10.00 H new ATOM 0 HA CYS A 69 5.425 -7.255 10.821 1.00 10.00 H new ATOM 0 HB2 CYS A 69 3.388 -5.041 11.308 1.00 10.00 H new ATOM 0 HB3 CYS A 69 4.579 -5.499 12.509 1.00 10.00 H new ATOM 0 HG CYS A 69 5.957 -4.946 9.488 1.00 10.00 H new ATOM 1053 N ASP A 70 4.040 -8.060 13.019 1.00 10.00 N ATOM 1054 CA ASP A 70 3.285 -8.759 14.065 1.00 10.00 C ATOM 1055 C ASP A 70 3.626 -8.128 15.416 1.00 10.00 C ATOM 1056 O ASP A 70 4.589 -7.357 15.491 1.00 10.00 O ATOM 1057 CB ASP A 70 3.597 -10.265 14.051 1.00 10.00 C ATOM 1058 CG ASP A 70 2.682 -11.052 15.005 1.00 10.00 C ATOM 1059 OD1 ASP A 70 1.493 -10.663 15.122 1.00 10.00 O ATOM 1060 OD2 ASP A 70 3.160 -12.048 15.584 1.00 10.00 O ATOM 0 H ASP A 70 4.964 -7.756 13.327 1.00 10.00 H new ATOM 0 HA ASP A 70 2.215 -8.656 13.882 1.00 10.00 H new ATOM 0 HB2 ASP A 70 3.481 -10.650 13.038 1.00 10.00 H new ATOM 0 HB3 ASP A 70 4.638 -10.422 14.335 1.00 10.00 H new ATOM 1065 N CYS A 71 2.862 -8.404 16.477 1.00 10.00 N ATOM 1066 CA CYS A 71 2.934 -7.671 17.736 1.00 10.00 C ATOM 1067 C CYS A 71 2.970 -8.570 18.972 1.00 10.00 C ATOM 1068 O CYS A 71 2.368 -9.639 18.997 1.00 10.00 O ATOM 1069 CB CYS A 71 1.697 -6.777 17.847 1.00 10.00 C ATOM 1070 SG CYS A 71 1.794 -5.372 16.711 1.00 10.00 S ATOM 0 H CYS A 71 2.169 -9.152 16.482 1.00 10.00 H new ATOM 0 HA CYS A 71 3.866 -7.105 17.716 1.00 10.00 H new ATOM 0 HB2 CYS A 71 0.803 -7.362 17.630 1.00 10.00 H new ATOM 0 HB3 CYS A 71 1.599 -6.414 18.870 1.00 10.00 H new ATOM 0 HG CYS A 71 2.786 -5.546 15.889 1.00 10.00 H new ATOM 1076 N GLU A 72 3.525 -8.026 20.055 1.00 10.00 N ATOM 1077 CA GLU A 72 3.503 -8.568 21.405 1.00 10.00 C ATOM 1078 C GLU A 72 3.484 -7.360 22.354 1.00 10.00 C ATOM 1079 O GLU A 72 4.104 -6.335 22.059 1.00 10.00 O ATOM 1080 CB GLU A 72 4.749 -9.448 21.599 1.00 10.00 C ATOM 1081 CG GLU A 72 4.933 -9.942 23.041 1.00 10.00 C ATOM 1082 CD GLU A 72 3.769 -10.825 23.536 1.00 10.00 C ATOM 1083 OE1 GLU A 72 2.709 -10.249 23.889 1.00 10.00 O ATOM 1084 OE2 GLU A 72 3.940 -12.064 23.550 1.00 10.00 O ATOM 0 H GLU A 72 4.031 -7.142 20.005 1.00 10.00 H new ATOM 0 HA GLU A 72 2.634 -9.195 21.602 1.00 10.00 H new ATOM 0 HB2 GLU A 72 4.683 -10.309 20.934 1.00 10.00 H new ATOM 0 HB3 GLU A 72 5.633 -8.883 21.302 1.00 10.00 H new ATOM 0 HG2 GLU A 72 5.863 -10.507 23.108 1.00 10.00 H new ATOM 0 HG3 GLU A 72 5.034 -9.082 23.702 1.00 10.00 H new ATOM 1091 N CYS A 73 2.756 -7.431 23.466 1.00 10.00 N ATOM 1092 CA CYS A 73 2.703 -6.346 24.438 1.00 10.00 C ATOM 1093 C CYS A 73 3.894 -6.425 25.387 1.00 10.00 C ATOM 1094 O CYS A 73 4.228 -7.487 25.900 1.00 10.00 O ATOM 1095 CB CYS A 73 1.402 -6.420 25.229 1.00 10.00 C ATOM 1096 SG CYS A 73 0.032 -6.065 24.105 1.00 10.00 S ATOM 0 H CYS A 73 2.188 -8.241 23.717 1.00 10.00 H new ATOM 0 HA CYS A 73 2.744 -5.396 23.905 1.00 10.00 H new ATOM 0 HB2 CYS A 73 1.283 -7.409 25.672 1.00 10.00 H new ATOM 0 HB3 CYS A 73 1.415 -5.703 26.050 1.00 10.00 H new ATOM 0 HG CYS A 73 0.103 -6.852 23.073 1.00 10.00 H new ATOM 1102 N LEU A 74 4.509 -5.272 25.663 1.00 10.00 N ATOM 1103 CA LEU A 74 5.521 -5.151 26.712 1.00 10.00 C ATOM 1104 C LEU A 74 4.859 -4.845 28.059 1.00 10.00 C ATOM 1105 O LEU A 74 5.435 -5.124 29.107 1.00 10.00 O ATOM 1106 CB LEU A 74 6.545 -4.053 26.366 1.00 10.00 C ATOM 1107 CG LEU A 74 7.327 -4.272 25.055 1.00 10.00 C ATOM 1108 CD1 LEU A 74 8.410 -3.193 24.934 1.00 10.00 C ATOM 1109 CD2 LEU A 74 8.001 -5.648 24.973 1.00 10.00 C ATOM 0 H LEU A 74 4.320 -4.401 25.167 1.00 10.00 H new ATOM 0 HA LEU A 74 6.048 -6.102 26.784 1.00 10.00 H new ATOM 0 HB2 LEU A 74 6.022 -3.098 26.303 1.00 10.00 H new ATOM 0 HB3 LEU A 74 7.258 -3.973 27.186 1.00 10.00 H new ATOM 0 HG LEU A 74 6.604 -4.214 24.242 1.00 10.00 H new ATOM 0 HD11 LEU A 74 8.968 -3.340 24.009 1.00 10.00 H new ATOM 0 HD12 LEU A 74 7.943 -2.208 24.923 1.00 10.00 H new ATOM 0 HD13 LEU A 74 9.090 -3.263 25.783 1.00 10.00 H new ATOM 0 HD21 LEU A 74 8.534 -5.736 24.026 1.00 10.00 H new ATOM 0 HD22 LEU A 74 8.706 -5.758 25.797 1.00 10.00 H new ATOM 0 HD23 LEU A 74 7.243 -6.429 25.037 1.00 10.00 H new ATOM 1121 N GLY A 75 3.664 -4.242 28.045 1.00 10.00 N ATOM 1122 CA GLY A 75 2.915 -3.871 29.237 1.00 10.00 C ATOM 1123 C GLY A 75 1.758 -2.954 28.859 1.00 10.00 C ATOM 1124 O GLY A 75 1.593 -2.618 27.685 1.00 10.00 O ATOM 0 H GLY A 75 3.185 -3.995 27.179 1.00 10.00 H new ATOM 0 HA2 GLY A 75 2.535 -4.765 29.731 1.00 10.00 H new ATOM 0 HA3 GLY A 75 3.571 -3.369 29.948 1.00 10.00 H new ATOM 1128 N GLY A 76 0.979 -2.494 29.836 1.00 10.00 N ATOM 1129 CA GLY A 76 -0.029 -1.464 29.614 1.00 10.00 C ATOM 1130 C GLY A 76 -0.201 -0.564 30.832 1.00 10.00 C ATOM 1131 O GLY A 76 0.477 -0.740 31.843 1.00 10.00 O ATOM 0 H GLY A 76 1.030 -2.824 30.800 1.00 10.00 H new ATOM 0 HA2 GLY A 76 0.254 -0.859 28.753 1.00 10.00 H new ATOM 0 HA3 GLY A 76 -0.982 -1.935 29.373 1.00 10.00 H new ATOM 1135 N GLY A 77 -1.135 0.379 30.730 1.00 10.00 N ATOM 1136 CA GLY A 77 -1.409 1.388 31.736 1.00 10.00 C ATOM 1137 C GLY A 77 -2.673 2.148 31.341 1.00 10.00 C ATOM 1138 O GLY A 77 -3.609 1.568 30.771 1.00 10.00 O ATOM 0 H GLY A 77 -1.740 0.459 29.913 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -1.539 0.921 32.712 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -0.567 2.075 31.821 1.00 10.00 H new ATOM 1142 N ARG A 78 -2.751 3.429 31.683 1.00 10.00 N ATOM 1143 CA ARG A 78 -3.772 4.368 31.225 1.00 10.00 C ATOM 1144 C ARG A 78 -3.110 5.723 31.037 1.00 10.00 C ATOM 1145 O ARG A 78 -2.093 6.007 31.661 1.00 10.00 O ATOM 1146 CB ARG A 78 -4.989 4.484 32.174 1.00 10.00 C ATOM 1147 CG ARG A 78 -4.681 4.447 33.686 1.00 10.00 C ATOM 1148 CD ARG A 78 -5.060 3.127 34.384 1.00 10.00 C ATOM 1149 NE ARG A 78 -4.761 1.932 33.569 1.00 10.00 N ATOM 1150 CZ ARG A 78 -4.484 0.701 34.008 1.00 10.00 C ATOM 1151 NH1 ARG A 78 -4.467 0.398 35.298 1.00 10.00 N ATOM 1152 NH2 ARG A 78 -4.246 -0.251 33.106 1.00 10.00 N ATOM 0 H ARG A 78 -2.076 3.861 32.314 1.00 10.00 H new ATOM 0 HA ARG A 78 -4.179 3.990 30.287 1.00 10.00 H new ATOM 0 HB2 ARG A 78 -5.508 5.417 31.953 1.00 10.00 H new ATOM 0 HB3 ARG A 78 -5.680 3.673 31.945 1.00 10.00 H new ATOM 0 HG2 ARG A 78 -3.616 4.627 33.831 1.00 10.00 H new ATOM 0 HG3 ARG A 78 -5.212 5.266 34.172 1.00 10.00 H new ATOM 0 HD2 ARG A 78 -4.524 3.057 35.330 1.00 10.00 H new ATOM 0 HD3 ARG A 78 -6.124 3.141 34.620 1.00 10.00 H new ATOM 0 HE ARG A 78 -4.767 2.061 32.557 1.00 10.00 H new ATOM 0 HH11 ARG A 78 -4.670 1.116 35.993 1.00 10.00 H new ATOM 0 HH12 ARG A 78 -4.251 -0.553 35.596 1.00 10.00 H new ATOM 0 HH21 ARG A 78 -4.278 -0.030 32.111 1.00 10.00 H new ATOM 0 HH22 ARG A 78 -4.032 -1.200 33.411 1.00 10.00 H new ATOM 1166 N ILE A 79 -3.696 6.543 30.180 1.00 10.00 N ATOM 1167 CA ILE A 79 -3.262 7.895 29.875 1.00 10.00 C ATOM 1168 C ILE A 79 -4.423 8.781 30.326 1.00 10.00 C ATOM 1169 O ILE A 79 -5.567 8.331 30.444 1.00 10.00 O ATOM 1170 CB ILE A 79 -2.913 8.013 28.366 1.00 10.00 C ATOM 1171 CG1 ILE A 79 -1.751 7.063 27.986 1.00 10.00 C ATOM 1172 CG2 ILE A 79 -2.540 9.453 27.960 1.00 10.00 C ATOM 1173 CD1 ILE A 79 -1.449 6.962 26.486 1.00 10.00 C ATOM 0 H ILE A 79 -4.526 6.270 29.654 1.00 10.00 H new ATOM 0 HA ILE A 79 -2.348 8.197 30.386 1.00 10.00 H new ATOM 0 HB ILE A 79 -3.814 7.726 27.823 1.00 10.00 H new ATOM 0 HG12 ILE A 79 -0.849 7.396 28.500 1.00 10.00 H new ATOM 0 HG13 ILE A 79 -1.982 6.066 28.361 1.00 10.00 H new ATOM 0 HG21 ILE A 79 -2.305 9.482 26.896 1.00 10.00 H new ATOM 0 HG22 ILE A 79 -3.380 10.118 28.164 1.00 10.00 H new ATOM 0 HG23 ILE A 79 -1.672 9.779 28.533 1.00 10.00 H new ATOM 0 HD11 ILE A 79 -0.620 6.272 26.327 1.00 10.00 H new ATOM 0 HD12 ILE A 79 -2.331 6.596 25.961 1.00 10.00 H new ATOM 0 HD13 ILE A 79 -1.181 7.946 26.102 1.00 10.00 H new ATOM 1185 N SER A 80 -4.150 10.045 30.629 1.00 10.00 N ATOM 1186 CA SER A 80 -5.157 11.046 30.932 1.00 10.00 C ATOM 1187 C SER A 80 -4.649 12.400 30.450 1.00 10.00 C ATOM 1188 O SER A 80 -3.450 12.677 30.540 1.00 10.00 O ATOM 1189 CB SER A 80 -5.440 11.052 32.440 1.00 10.00 C ATOM 1190 OG SER A 80 -5.808 9.754 32.872 1.00 10.00 O ATOM 0 H SER A 80 -3.197 10.407 30.671 1.00 10.00 H new ATOM 0 HA SER A 80 -6.094 10.821 30.423 1.00 10.00 H new ATOM 0 HB2 SER A 80 -4.556 11.387 32.982 1.00 10.00 H new ATOM 0 HB3 SER A 80 -6.239 11.759 32.665 1.00 10.00 H new ATOM 0 HG SER A 80 -5.829 9.729 33.851 1.00 10.00 H new ATOM 1196 N HIS A 81 -5.554 13.242 29.965 1.00 10.00 N ATOM 1197 CA HIS A 81 -5.279 14.575 29.456 1.00 10.00 C ATOM 1198 C HIS A 81 -6.603 15.334 29.434 1.00 10.00 C ATOM 1199 O HIS A 81 -7.665 14.725 29.316 1.00 10.00 O ATOM 1200 CB HIS A 81 -4.708 14.461 28.034 1.00 10.00 C ATOM 1201 CG HIS A 81 -4.422 15.772 27.345 1.00 10.00 C ATOM 1202 ND1 HIS A 81 -3.790 16.881 27.870 1.00 10.00 N ATOM 1203 CD2 HIS A 81 -4.740 16.075 26.047 1.00 10.00 C ATOM 1204 CE1 HIS A 81 -3.726 17.816 26.912 1.00 10.00 C ATOM 1205 NE2 HIS A 81 -4.311 17.380 25.784 1.00 10.00 N ATOM 0 H HIS A 81 -6.544 13.000 29.915 1.00 10.00 H new ATOM 0 HA HIS A 81 -4.554 15.098 30.080 1.00 10.00 H new ATOM 0 HB2 HIS A 81 -3.785 13.883 28.077 1.00 10.00 H new ATOM 0 HB3 HIS A 81 -5.411 13.894 27.423 1.00 10.00 H new ATOM 0 HD1 HIS A 81 -3.434 16.973 28.821 1.00 10.00 H new ATOM 0 HD2 HIS A 81 -5.237 15.419 25.347 1.00 10.00 H new ATOM 0 HE1 HIS A 81 -3.267 18.787 27.031 1.00 10.00 H new ATOM 1213 N GLN A 82 -6.535 16.657 29.571 1.00 10.00 N ATOM 1214 CA GLN A 82 -7.647 17.568 29.360 1.00 10.00 C ATOM 1215 C GLN A 82 -6.986 18.863 28.919 1.00 10.00 C ATOM 1216 O GLN A 82 -6.395 19.550 29.752 1.00 10.00 O ATOM 1217 CB GLN A 82 -8.455 17.721 30.663 1.00 10.00 C ATOM 1218 CG GLN A 82 -9.658 18.661 30.500 1.00 10.00 C ATOM 1219 CD GLN A 82 -10.526 18.685 31.755 1.00 10.00 C ATOM 1220 OE1 GLN A 82 -10.596 19.676 32.470 1.00 10.00 O ATOM 1221 NE2 GLN A 82 -11.186 17.577 32.079 1.00 10.00 N ATOM 0 H GLN A 82 -5.675 17.135 29.841 1.00 10.00 H new ATOM 0 HA GLN A 82 -8.365 17.223 28.616 1.00 10.00 H new ATOM 0 HB2 GLN A 82 -8.805 16.741 30.987 1.00 10.00 H new ATOM 0 HB3 GLN A 82 -7.803 18.103 31.449 1.00 10.00 H new ATOM 0 HG2 GLN A 82 -9.306 19.669 30.281 1.00 10.00 H new ATOM 0 HG3 GLN A 82 -10.258 18.341 29.648 1.00 10.00 H new ATOM 0 HE21 GLN A 82 -11.125 16.753 31.480 1.00 10.00 H new ATOM 0 HE22 GLN A 82 -11.753 17.551 32.926 1.00 10.00 H new ATOM 1230 N SER A 83 -7.009 19.169 27.624 1.00 10.00 N ATOM 1231 CA SER A 83 -6.235 20.255 27.026 1.00 10.00 C ATOM 1232 C SER A 83 -6.530 21.621 27.658 1.00 10.00 C ATOM 1233 O SER A 83 -5.685 22.511 27.626 1.00 10.00 O ATOM 1234 CB SER A 83 -6.506 20.274 25.516 1.00 10.00 C ATOM 1235 OG SER A 83 -6.566 18.963 24.989 1.00 10.00 O ATOM 0 H SER A 83 -7.577 18.659 26.947 1.00 10.00 H new ATOM 0 HA SER A 83 -5.179 20.067 27.218 1.00 10.00 H new ATOM 0 HB2 SER A 83 -7.445 20.791 25.319 1.00 10.00 H new ATOM 0 HB3 SER A 83 -5.721 20.836 25.010 1.00 10.00 H new ATOM 0 HG SER A 83 -5.872 18.411 25.406 1.00 10.00 H new ATOM 1241 N GLN A 84 -7.725 21.791 28.228 1.00 10.00 N ATOM 1242 CA GLN A 84 -8.179 23.006 28.888 1.00 10.00 C ATOM 1243 C GLN A 84 -7.586 23.168 30.302 1.00 10.00 C ATOM 1244 O GLN A 84 -7.803 24.217 30.901 1.00 10.00 O ATOM 1245 CB GLN A 84 -9.721 22.998 28.964 1.00 10.00 C ATOM 1246 CG GLN A 84 -10.452 22.877 27.608 1.00 10.00 C ATOM 1247 CD GLN A 84 -10.456 21.475 26.985 1.00 10.00 C ATOM 1248 OE1 GLN A 84 -10.164 20.483 27.645 1.00 10.00 O ATOM 1249 NE2 GLN A 84 -10.746 21.377 25.695 1.00 10.00 N ATOM 0 H GLN A 84 -8.428 21.052 28.240 1.00 10.00 H new ATOM 0 HA GLN A 84 -7.831 23.853 28.297 1.00 10.00 H new ATOM 0 HB2 GLN A 84 -10.032 22.169 29.600 1.00 10.00 H new ATOM 0 HB3 GLN A 84 -10.048 23.915 29.453 1.00 10.00 H new ATOM 0 HG2 GLN A 84 -11.485 23.200 27.741 1.00 10.00 H new ATOM 0 HG3 GLN A 84 -9.990 23.568 26.903 1.00 10.00 H new ATOM 0 HE21 GLN A 84 -10.987 22.212 25.161 1.00 10.00 H new ATOM 0 HE22 GLN A 84 -10.728 20.466 25.236 1.00 10.00 H new ATOM 1258 N ASP A 85 -6.878 22.162 30.837 1.00 10.00 N ATOM 1259 CA ASP A 85 -6.489 22.130 32.254 1.00 10.00 C ATOM 1260 C ASP A 85 -5.097 21.539 32.526 1.00 10.00 C ATOM 1261 O ASP A 85 -4.375 22.063 33.370 1.00 10.00 O ATOM 1262 CB ASP A 85 -7.532 21.322 33.037 1.00 10.00 C ATOM 1263 CG ASP A 85 -7.160 21.189 34.522 1.00 10.00 C ATOM 1264 OD1 ASP A 85 -7.315 22.179 35.265 1.00 10.00 O ATOM 1265 OD2 ASP A 85 -6.756 20.060 34.920 1.00 10.00 O ATOM 0 H ASP A 85 -6.561 21.353 30.303 1.00 10.00 H new ATOM 0 HA ASP A 85 -6.444 23.170 32.577 1.00 10.00 H new ATOM 0 HB2 ASP A 85 -8.505 21.804 32.949 1.00 10.00 H new ATOM 0 HB3 ASP A 85 -7.627 20.329 32.597 1.00 10.00 H new ATOM 1270 N LYS A 86 -4.668 20.470 31.838 1.00 10.00 N ATOM 1271 CA LYS A 86 -3.429 19.762 32.189 1.00 10.00 C ATOM 1272 C LYS A 86 -2.765 19.107 30.982 1.00 10.00 C ATOM 1273 O LYS A 86 -3.437 18.580 30.097 1.00 10.00 O ATOM 1274 CB LYS A 86 -3.704 18.718 33.293 1.00 10.00 C ATOM 1275 CG LYS A 86 -4.822 17.708 32.963 1.00 10.00 C ATOM 1276 CD LYS A 86 -4.857 16.513 33.930 1.00 10.00 C ATOM 1277 CE LYS A 86 -5.008 16.875 35.418 1.00 10.00 C ATOM 1278 NZ LYS A 86 -6.308 17.510 35.741 1.00 10.00 N ATOM 0 H LYS A 86 -5.161 20.078 31.036 1.00 10.00 H new ATOM 0 HA LYS A 86 -2.729 20.508 32.566 1.00 10.00 H new ATOM 0 HB2 LYS A 86 -2.784 18.168 33.491 1.00 10.00 H new ATOM 0 HB3 LYS A 86 -3.967 19.242 34.212 1.00 10.00 H new ATOM 0 HG2 LYS A 86 -5.785 18.218 32.990 1.00 10.00 H new ATOM 0 HG3 LYS A 86 -4.684 17.341 31.946 1.00 10.00 H new ATOM 0 HD2 LYS A 86 -5.683 15.861 33.646 1.00 10.00 H new ATOM 0 HD3 LYS A 86 -3.940 15.938 33.804 1.00 10.00 H new ATOM 0 HE2 LYS A 86 -4.895 15.972 36.017 1.00 10.00 H new ATOM 0 HE3 LYS A 86 -4.201 17.550 35.704 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 -6.293 17.850 36.724 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 -6.472 18.312 35.099 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 -7.072 16.814 35.627 1.00 10.00 H new ATOM 1292 N LYS A 87 -1.431 19.043 31.020 1.00 10.00 N ATOM 1293 CA LYS A 87 -0.619 18.258 30.088 1.00 10.00 C ATOM 1294 C LYS A 87 -0.955 16.770 30.190 1.00 10.00 C ATOM 1295 O LYS A 87 -1.634 16.348 31.133 1.00 10.00 O ATOM 1296 CB LYS A 87 0.888 18.562 30.261 1.00 10.00 C ATOM 1297 CG LYS A 87 1.445 18.690 31.693 1.00 10.00 C ATOM 1298 CD LYS A 87 1.244 17.458 32.590 1.00 10.00 C ATOM 1299 CE LYS A 87 1.906 17.701 33.954 1.00 10.00 C ATOM 1300 NZ LYS A 87 1.656 16.594 34.910 1.00 10.00 N ATOM 0 H LYS A 87 -0.876 19.545 31.713 1.00 10.00 H new ATOM 0 HA LYS A 87 -0.868 18.559 29.070 1.00 10.00 H new ATOM 0 HB2 LYS A 87 1.447 17.774 29.755 1.00 10.00 H new ATOM 0 HB3 LYS A 87 1.103 19.493 29.736 1.00 10.00 H new ATOM 0 HG2 LYS A 87 2.512 18.904 31.632 1.00 10.00 H new ATOM 0 HG3 LYS A 87 0.975 19.548 32.173 1.00 10.00 H new ATOM 0 HD2 LYS A 87 0.180 17.260 32.721 1.00 10.00 H new ATOM 0 HD3 LYS A 87 1.676 16.576 32.117 1.00 10.00 H new ATOM 0 HE2 LYS A 87 2.980 17.823 33.817 1.00 10.00 H new ATOM 0 HE3 LYS A 87 1.531 18.633 34.376 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 2.151 16.789 35.804 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 0.635 16.515 35.090 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 2.007 15.702 34.507 1.00 10.00 H new ATOM 1314 N ILE A 88 -0.459 15.970 29.252 1.00 10.00 N ATOM 1315 CA ILE A 88 -0.690 14.529 29.225 1.00 10.00 C ATOM 1316 C ILE A 88 0.019 13.906 30.438 1.00 10.00 C ATOM 1317 O ILE A 88 1.138 14.294 30.801 1.00 10.00 O ATOM 1318 CB ILE A 88 -0.215 13.939 27.872 1.00 10.00 C ATOM 1319 CG1 ILE A 88 -0.952 14.603 26.682 1.00 10.00 C ATOM 1320 CG2 ILE A 88 -0.437 12.411 27.837 1.00 10.00 C ATOM 1321 CD1 ILE A 88 -0.436 14.189 25.300 1.00 10.00 C ATOM 0 H ILE A 88 0.120 16.306 28.482 1.00 10.00 H new ATOM 0 HA ILE A 88 -1.753 14.298 29.299 1.00 10.00 H new ATOM 0 HB ILE A 88 0.851 14.147 27.778 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.012 14.359 26.747 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -0.867 15.685 26.778 1.00 10.00 H new ATOM 0 HG21 ILE A 88 -0.097 12.016 26.880 1.00 10.00 H new ATOM 0 HG22 ILE A 88 0.127 11.943 28.644 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -1.498 12.194 27.963 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -1.010 14.702 24.529 1.00 10.00 H new ATOM 0 HD12 ILE A 88 0.616 14.458 25.209 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.547 13.112 25.178 1.00 10.00 H new ATOM 1333 N HIS A 89 -0.607 12.909 31.061 1.00 10.00 N ATOM 1334 CA HIS A 89 -0.060 12.121 32.154 1.00 10.00 C ATOM 1335 C HIS A 89 -0.357 10.643 31.896 1.00 10.00 C ATOM 1336 O HIS A 89 -1.324 10.335 31.200 1.00 10.00 O ATOM 1337 CB HIS A 89 -0.671 12.594 33.479 1.00 10.00 C ATOM 1338 CG HIS A 89 0.035 12.022 34.682 1.00 10.00 C ATOM 1339 ND1 HIS A 89 1.301 12.359 35.103 1.00 10.00 N ATOM 1340 CD2 HIS A 89 -0.445 11.079 35.553 1.00 10.00 C ATOM 1341 CE1 HIS A 89 1.577 11.636 36.202 1.00 10.00 C ATOM 1342 NE2 HIS A 89 0.540 10.846 36.522 1.00 10.00 N ATOM 0 H HIS A 89 -1.550 12.619 30.803 1.00 10.00 H new ATOM 0 HA HIS A 89 1.020 12.251 32.217 1.00 10.00 H new ATOM 0 HB2 HIS A 89 -0.633 13.682 33.524 1.00 10.00 H new ATOM 0 HB3 HIS A 89 -1.723 12.310 33.511 1.00 10.00 H new ATOM 0 HD2 HIS A 89 -1.412 10.600 35.502 1.00 10.00 H new ATOM 0 HE1 HIS A 89 2.505 11.684 36.752 1.00 10.00 H new ATOM 0 HE2 HIS A 89 0.481 10.204 37.313 1.00 10.00 H new ATOM 1350 N VAL A 90 0.444 9.734 32.452 1.00 10.00 N ATOM 1351 CA VAL A 90 0.345 8.291 32.221 1.00 10.00 C ATOM 1352 C VAL A 90 0.594 7.567 33.554 1.00 10.00 C ATOM 1353 O VAL A 90 1.464 7.977 34.320 1.00 10.00 O ATOM 1354 CB VAL A 90 1.369 7.860 31.141 1.00 10.00 C ATOM 1355 CG1 VAL A 90 1.115 6.421 30.679 1.00 10.00 C ATOM 1356 CG2 VAL A 90 1.382 8.773 29.896 1.00 10.00 C ATOM 0 H VAL A 90 1.198 9.986 33.091 1.00 10.00 H new ATOM 0 HA VAL A 90 -0.648 8.028 31.856 1.00 10.00 H new ATOM 0 HB VAL A 90 2.340 7.942 31.629 1.00 10.00 H new ATOM 0 HG11 VAL A 90 1.849 6.147 29.921 1.00 10.00 H new ATOM 0 HG12 VAL A 90 1.202 5.745 31.530 1.00 10.00 H new ATOM 0 HG13 VAL A 90 0.113 6.346 30.257 1.00 10.00 H new ATOM 0 HG21 VAL A 90 2.123 8.408 29.185 1.00 10.00 H new ATOM 0 HG22 VAL A 90 0.397 8.766 29.429 1.00 10.00 H new ATOM 0 HG23 VAL A 90 1.635 9.791 30.194 1.00 10.00 H new ATOM 1366 N TYR A 91 -0.152 6.506 33.859 1.00 10.00 N ATOM 1367 CA TYR A 91 0.017 5.715 35.080 1.00 10.00 C ATOM 1368 C TYR A 91 -0.602 4.320 34.909 1.00 10.00 C ATOM 1369 O TYR A 91 -1.057 3.975 33.813 1.00 10.00 O ATOM 1370 CB TYR A 91 -0.586 6.470 36.286 1.00 10.00 C ATOM 1371 CG TYR A 91 -2.099 6.625 36.277 1.00 10.00 C ATOM 1372 CD1 TYR A 91 -2.708 7.590 35.451 1.00 10.00 C ATOM 1373 CD2 TYR A 91 -2.899 5.821 37.115 1.00 10.00 C ATOM 1374 CE1 TYR A 91 -4.104 7.768 35.477 1.00 10.00 C ATOM 1375 CE2 TYR A 91 -4.294 5.990 37.142 1.00 10.00 C ATOM 1376 CZ TYR A 91 -4.902 6.976 36.335 1.00 10.00 C ATOM 1377 OH TYR A 91 -6.253 7.140 36.368 1.00 10.00 O ATOM 0 H TYR A 91 -0.902 6.166 33.257 1.00 10.00 H new ATOM 0 HA TYR A 91 1.081 5.574 35.273 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -0.298 5.948 37.199 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -0.138 7.463 36.331 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -2.101 8.196 34.795 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -2.437 5.071 37.740 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -4.566 8.509 34.842 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -4.901 5.365 37.780 1.00 10.00 H new ATOM 0 HH TYR A 91 -6.643 6.513 37.012 1.00 10.00 H new ATOM 1387 N GLY A 92 -0.669 3.540 35.990 1.00 10.00 N ATOM 1388 CA GLY A 92 -1.399 2.281 36.024 1.00 10.00 C ATOM 1389 C GLY A 92 -0.513 1.094 35.666 1.00 10.00 C ATOM 1390 O GLY A 92 0.699 1.221 35.507 1.00 10.00 O ATOM 0 H GLY A 92 -0.212 3.771 36.872 1.00 10.00 H new ATOM 0 HA2 GLY A 92 -1.818 2.133 37.019 1.00 10.00 H new ATOM 0 HA3 GLY A 92 -2.237 2.330 35.329 1.00 10.00 H new ATOM 1394 N TYR A 93 -1.134 -0.076 35.541 1.00 10.00 N ATOM 1395 CA TYR A 93 -0.528 -1.284 35.003 1.00 10.00 C ATOM 1396 C TYR A 93 -1.655 -2.140 34.439 1.00 10.00 C ATOM 1397 O TYR A 93 -2.818 -1.958 34.807 1.00 10.00 O ATOM 1398 CB TYR A 93 0.287 -2.032 36.072 1.00 10.00 C ATOM 1399 CG TYR A 93 -0.459 -2.483 37.316 1.00 10.00 C ATOM 1400 CD1 TYR A 93 -0.559 -1.621 38.426 1.00 10.00 C ATOM 1401 CD2 TYR A 93 -0.984 -3.788 37.394 1.00 10.00 C ATOM 1402 CE1 TYR A 93 -1.181 -2.056 39.611 1.00 10.00 C ATOM 1403 CE2 TYR A 93 -1.603 -4.231 38.578 1.00 10.00 C ATOM 1404 CZ TYR A 93 -1.707 -3.368 39.693 1.00 10.00 C ATOM 1405 OH TYR A 93 -2.301 -3.814 40.835 1.00 10.00 O ATOM 0 H TYR A 93 -2.105 -0.210 35.822 1.00 10.00 H new ATOM 0 HA TYR A 93 0.183 -1.037 34.215 1.00 10.00 H new ATOM 0 HB2 TYR A 93 0.731 -2.911 35.606 1.00 10.00 H new ATOM 0 HB3 TYR A 93 1.109 -1.387 36.384 1.00 10.00 H new ATOM 0 HD1 TYR A 93 -0.156 -0.621 38.367 1.00 10.00 H new ATOM 0 HD2 TYR A 93 -0.911 -4.450 36.544 1.00 10.00 H new ATOM 0 HE1 TYR A 93 -1.257 -1.389 40.457 1.00 10.00 H new ATOM 0 HE2 TYR A 93 -2.000 -5.234 38.635 1.00 10.00 H new ATOM 0 HH TYR A 93 -2.603 -4.737 40.707 1.00 10.00 H new ATOM 1415 N SER A 94 -1.356 -3.085 33.553 1.00 10.00 N ATOM 1416 CA SER A 94 -2.365 -3.905 32.896 1.00 10.00 C ATOM 1417 C SER A 94 -2.026 -5.362 33.160 1.00 10.00 C ATOM 1418 O SER A 94 -1.063 -5.881 32.611 1.00 10.00 O ATOM 1419 CB SER A 94 -2.412 -3.557 31.408 1.00 10.00 C ATOM 1420 OG SER A 94 -2.885 -2.225 31.256 1.00 10.00 O ATOM 0 H SER A 94 -0.401 -3.304 33.270 1.00 10.00 H new ATOM 0 HA SER A 94 -3.364 -3.715 33.289 1.00 10.00 H new ATOM 0 HB2 SER A 94 -1.420 -3.656 30.967 1.00 10.00 H new ATOM 0 HB3 SER A 94 -3.066 -4.251 30.880 1.00 10.00 H new ATOM 0 HG SER A 94 -3.068 -2.049 30.309 1.00 10.00 H new ATOM 1426 N MET A 95 -2.816 -6.005 34.022 1.00 10.00 N ATOM 1427 CA MET A 95 -2.544 -7.334 34.583 1.00 10.00 C ATOM 1428 C MET A 95 -2.344 -8.423 33.519 1.00 10.00 C ATOM 1429 O MET A 95 -1.687 -9.420 33.800 1.00 10.00 O ATOM 1430 CB MET A 95 -3.685 -7.733 35.536 1.00 10.00 C ATOM 1431 CG MET A 95 -3.788 -6.803 36.753 1.00 10.00 C ATOM 1432 SD MET A 95 -5.200 -7.151 37.831 1.00 10.00 S ATOM 1433 CE MET A 95 -5.014 -5.811 39.041 1.00 10.00 C ATOM 0 H MET A 95 -3.691 -5.604 34.361 1.00 10.00 H new ATOM 0 HA MET A 95 -1.600 -7.259 35.123 1.00 10.00 H new ATOM 0 HB2 MET A 95 -4.629 -7.720 34.992 1.00 10.00 H new ATOM 0 HB3 MET A 95 -3.528 -8.756 35.877 1.00 10.00 H new ATOM 0 HG2 MET A 95 -2.871 -6.883 37.336 1.00 10.00 H new ATOM 0 HG3 MET A 95 -3.856 -5.772 36.405 1.00 10.00 H new ATOM 0 HE1 MET A 95 -5.809 -5.878 39.783 1.00 10.00 H new ATOM 0 HE2 MET A 95 -4.047 -5.900 39.536 1.00 10.00 H new ATOM 0 HE3 MET A 95 -5.074 -4.849 38.531 1.00 10.00 H new ATOM 1443 N ALA A 96 -2.881 -8.235 32.307 1.00 10.00 N ATOM 1444 CA ALA A 96 -2.679 -9.153 31.191 1.00 10.00 C ATOM 1445 C ALA A 96 -1.206 -9.253 30.762 1.00 10.00 C ATOM 1446 O ALA A 96 -0.833 -10.266 30.179 1.00 10.00 O ATOM 1447 CB ALA A 96 -3.544 -8.708 30.004 1.00 10.00 C ATOM 0 H ALA A 96 -3.471 -7.435 32.077 1.00 10.00 H new ATOM 0 HA ALA A 96 -2.977 -10.147 31.526 1.00 10.00 H new ATOM 0 HB1 ALA A 96 -3.395 -9.392 29.169 1.00 10.00 H new ATOM 0 HB2 ALA A 96 -4.594 -8.715 30.296 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -3.258 -7.700 29.703 1.00 10.00 H new ATOM 1453 N TYR A 97 -0.391 -8.222 31.020 1.00 10.00 N ATOM 1454 CA TYR A 97 0.962 -8.102 30.479 1.00 10.00 C ATOM 1455 C TYR A 97 1.950 -7.650 31.559 1.00 10.00 C ATOM 1456 O TYR A 97 2.990 -8.272 31.745 1.00 10.00 O ATOM 1457 CB TYR A 97 0.957 -7.089 29.318 1.00 10.00 C ATOM 1458 CG TYR A 97 -0.126 -7.274 28.269 1.00 10.00 C ATOM 1459 CD1 TYR A 97 -0.265 -8.504 27.598 1.00 10.00 C ATOM 1460 CD2 TYR A 97 -1.000 -6.208 27.969 1.00 10.00 C ATOM 1461 CE1 TYR A 97 -1.286 -8.683 26.650 1.00 10.00 C ATOM 1462 CE2 TYR A 97 -2.015 -6.375 27.012 1.00 10.00 C ATOM 1463 CZ TYR A 97 -2.166 -7.618 26.358 1.00 10.00 C ATOM 1464 OH TYR A 97 -3.166 -7.786 25.456 1.00 10.00 O ATOM 0 H TYR A 97 -0.659 -7.440 31.618 1.00 10.00 H new ATOM 0 HA TYR A 97 1.281 -9.080 30.118 1.00 10.00 H new ATOM 0 HB2 TYR A 97 0.859 -6.088 29.738 1.00 10.00 H new ATOM 0 HB3 TYR A 97 1.926 -7.133 28.821 1.00 10.00 H new ATOM 0 HD1 TYR A 97 0.417 -9.314 27.813 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -0.889 -5.261 28.476 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -1.398 -9.632 26.146 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -2.678 -5.555 26.777 1.00 10.00 H new ATOM 0 HH TYR A 97 -2.786 -8.051 24.592 1.00 10.00 H new ATOM 1474 N GLY A 98 1.620 -6.575 32.280 1.00 10.00 N ATOM 1475 CA GLY A 98 2.442 -5.948 33.303 1.00 10.00 C ATOM 1476 C GLY A 98 2.330 -4.425 33.190 1.00 10.00 C ATOM 1477 O GLY A 98 1.558 -3.922 32.361 1.00 10.00 O ATOM 0 H GLY A 98 0.726 -6.099 32.155 1.00 10.00 H new ATOM 0 HA2 GLY A 98 2.121 -6.274 34.292 1.00 10.00 H new ATOM 0 HA3 GLY A 98 3.481 -6.256 33.188 1.00 10.00 H new ATOM 1481 N PRO A 99 3.053 -3.664 34.026 1.00 10.00 N ATOM 1482 CA PRO A 99 3.191 -2.226 33.843 1.00 10.00 C ATOM 1483 C PRO A 99 3.925 -1.955 32.529 1.00 10.00 C ATOM 1484 O PRO A 99 4.954 -2.573 32.251 1.00 10.00 O ATOM 1485 CB PRO A 99 3.994 -1.724 35.048 1.00 10.00 C ATOM 1486 CG PRO A 99 4.772 -2.954 35.517 1.00 10.00 C ATOM 1487 CD PRO A 99 3.873 -4.130 35.135 1.00 10.00 C ATOM 0 HA PRO A 99 2.230 -1.715 33.787 1.00 10.00 H new ATOM 0 HB2 PRO A 99 4.664 -0.911 34.769 1.00 10.00 H new ATOM 0 HB3 PRO A 99 3.340 -1.343 35.832 1.00 10.00 H new ATOM 0 HG2 PRO A 99 5.745 -3.021 35.029 1.00 10.00 H new ATOM 0 HG3 PRO A 99 4.955 -2.924 36.591 1.00 10.00 H new ATOM 0 HD2 PRO A 99 4.467 -4.997 34.844 1.00 10.00 H new ATOM 0 HD3 PRO A 99 3.253 -4.437 35.977 1.00 10.00 H new ATOM 1495 N ALA A 100 3.408 -1.033 31.717 1.00 10.00 N ATOM 1496 CA ALA A 100 4.166 -0.521 30.591 1.00 10.00 C ATOM 1497 C ALA A 100 5.408 0.197 31.123 1.00 10.00 C ATOM 1498 O ALA A 100 5.410 0.764 32.217 1.00 10.00 O ATOM 1499 CB ALA A 100 3.302 0.422 29.751 1.00 10.00 C ATOM 0 H ALA A 100 2.476 -0.633 31.822 1.00 10.00 H new ATOM 0 HA ALA A 100 4.475 -1.343 29.946 1.00 10.00 H new ATOM 0 HB1 ALA A 100 3.885 0.798 28.910 1.00 10.00 H new ATOM 0 HB2 ALA A 100 2.432 -0.118 29.377 1.00 10.00 H new ATOM 0 HB3 ALA A 100 2.972 1.259 30.367 1.00 10.00 H new ATOM 1505 N GLN A 101 6.467 0.230 30.310 1.00 10.00 N ATOM 1506 CA GLN A 101 7.641 1.047 30.563 1.00 10.00 C ATOM 1507 C GLN A 101 7.280 2.478 30.160 1.00 10.00 C ATOM 1508 O GLN A 101 7.686 2.948 29.097 1.00 10.00 O ATOM 1509 CB GLN A 101 8.862 0.485 29.815 1.00 10.00 C ATOM 1510 CG GLN A 101 9.275 -0.892 30.359 1.00 10.00 C ATOM 1511 CD GLN A 101 10.544 -1.406 29.679 1.00 10.00 C ATOM 1512 OE1 GLN A 101 11.647 -1.240 30.180 1.00 10.00 O ATOM 1513 NE2 GLN A 101 10.419 -2.016 28.508 1.00 10.00 N ATOM 0 H GLN A 101 6.527 -0.317 29.451 1.00 10.00 H new ATOM 0 HA GLN A 101 7.926 1.038 31.615 1.00 10.00 H new ATOM 0 HB2 GLN A 101 8.632 0.403 28.753 1.00 10.00 H new ATOM 0 HB3 GLN A 101 9.697 1.179 29.908 1.00 10.00 H new ATOM 0 HG2 GLN A 101 9.439 -0.825 31.435 1.00 10.00 H new ATOM 0 HG3 GLN A 101 8.464 -1.604 30.204 1.00 10.00 H new ATOM 0 HE21 GLN A 101 9.494 -2.150 28.099 1.00 10.00 H new ATOM 0 HE22 GLN A 101 11.248 -2.352 28.017 1.00 10.00 H new ATOM 1522 N HIS A 102 6.449 3.137 30.973 1.00 10.00 N ATOM 1523 CA HIS A 102 5.816 4.416 30.655 1.00 10.00 C ATOM 1524 C HIS A 102 6.807 5.478 30.178 1.00 10.00 C ATOM 1525 O HIS A 102 6.439 6.279 29.332 1.00 10.00 O ATOM 1526 CB HIS A 102 5.047 4.959 31.866 1.00 10.00 C ATOM 1527 CG HIS A 102 4.034 4.009 32.450 1.00 10.00 C ATOM 1528 ND1 HIS A 102 4.126 3.363 33.660 1.00 10.00 N ATOM 1529 CD2 HIS A 102 2.844 3.637 31.890 1.00 10.00 C ATOM 1530 CE1 HIS A 102 3.023 2.609 33.811 1.00 10.00 C ATOM 1531 NE2 HIS A 102 2.206 2.744 32.750 1.00 10.00 N ATOM 0 H HIS A 102 6.192 2.784 31.895 1.00 10.00 H new ATOM 0 HA HIS A 102 5.130 4.210 29.833 1.00 10.00 H new ATOM 0 HB2 HIS A 102 5.763 5.227 32.643 1.00 10.00 H new ATOM 0 HB3 HIS A 102 4.537 5.877 31.573 1.00 10.00 H new ATOM 0 HD1 HIS A 102 4.895 3.442 34.326 1.00 10.00 H new ATOM 0 HD2 HIS A 102 2.461 3.978 30.939 1.00 10.00 H new ATOM 0 HE1 HIS A 102 2.820 1.981 34.666 1.00 10.00 H new ATOM 1539 N ALA A 103 8.063 5.458 30.646 1.00 10.00 N ATOM 1540 CA ALA A 103 9.087 6.401 30.202 1.00 10.00 C ATOM 1541 C ALA A 103 9.326 6.335 28.685 1.00 10.00 C ATOM 1542 O ALA A 103 9.569 7.363 28.059 1.00 10.00 O ATOM 1543 CB ALA A 103 10.393 6.132 30.959 1.00 10.00 C ATOM 0 H ALA A 103 8.392 4.788 31.341 1.00 10.00 H new ATOM 0 HA ALA A 103 8.730 7.407 30.423 1.00 10.00 H new ATOM 0 HB1 ALA A 103 11.157 6.835 30.628 1.00 10.00 H new ATOM 0 HB2 ALA A 103 10.225 6.255 32.029 1.00 10.00 H new ATOM 0 HB3 ALA A 103 10.726 5.114 30.759 1.00 10.00 H new ATOM 1549 N ILE A 104 9.244 5.137 28.089 1.00 10.00 N ATOM 1550 CA ILE A 104 9.353 4.966 26.642 1.00 10.00 C ATOM 1551 C ILE A 104 8.148 5.668 26.011 1.00 10.00 C ATOM 1552 O ILE A 104 8.289 6.492 25.109 1.00 10.00 O ATOM 1553 CB ILE A 104 9.423 3.460 26.267 1.00 10.00 C ATOM 1554 CG1 ILE A 104 10.627 2.776 26.960 1.00 10.00 C ATOM 1555 CG2 ILE A 104 9.487 3.288 24.736 1.00 10.00 C ATOM 1556 CD1 ILE A 104 10.795 1.287 26.630 1.00 10.00 C ATOM 0 H ILE A 104 9.101 4.265 28.599 1.00 10.00 H new ATOM 0 HA ILE A 104 10.273 5.410 26.263 1.00 10.00 H new ATOM 0 HB ILE A 104 8.516 2.972 26.623 1.00 10.00 H new ATOM 0 HG12 ILE A 104 11.539 3.302 26.677 1.00 10.00 H new ATOM 0 HG13 ILE A 104 10.518 2.885 28.039 1.00 10.00 H new ATOM 0 HG21 ILE A 104 9.536 2.227 24.491 1.00 10.00 H new ATOM 0 HG22 ILE A 104 8.597 3.725 24.283 1.00 10.00 H new ATOM 0 HG23 ILE A 104 10.374 3.791 24.350 1.00 10.00 H new ATOM 0 HD11 ILE A 104 11.662 0.893 27.159 1.00 10.00 H new ATOM 0 HD12 ILE A 104 9.903 0.743 26.939 1.00 10.00 H new ATOM 0 HD13 ILE A 104 10.939 1.166 25.556 1.00 10.00 H new ATOM 1568 N SER A 105 6.946 5.341 26.493 1.00 10.00 N ATOM 1569 CA SER A 105 5.710 5.904 25.986 1.00 10.00 C ATOM 1570 C SER A 105 5.686 7.437 26.081 1.00 10.00 C ATOM 1571 O SER A 105 5.307 8.075 25.101 1.00 10.00 O ATOM 1572 CB SER A 105 4.520 5.266 26.714 1.00 10.00 C ATOM 1573 OG SER A 105 4.697 3.857 26.833 1.00 10.00 O ATOM 0 H SER A 105 6.811 4.672 27.252 1.00 10.00 H new ATOM 0 HA SER A 105 5.637 5.672 24.924 1.00 10.00 H new ATOM 0 HB2 SER A 105 4.414 5.709 27.704 1.00 10.00 H new ATOM 0 HB3 SER A 105 3.599 5.477 26.170 1.00 10.00 H new ATOM 0 HG SER A 105 4.109 3.512 27.537 1.00 10.00 H new ATOM 1579 N THR A 106 6.096 8.036 27.199 1.00 10.00 N ATOM 1580 CA THR A 106 6.021 9.479 27.350 1.00 10.00 C ATOM 1581 C THR A 106 6.976 10.183 26.392 1.00 10.00 C ATOM 1582 O THR A 106 6.588 11.190 25.809 1.00 10.00 O ATOM 1583 CB THR A 106 6.246 9.899 28.811 1.00 10.00 C ATOM 1584 OG1 THR A 106 7.415 9.337 29.375 1.00 10.00 O ATOM 1585 CG2 THR A 106 5.070 9.452 29.683 1.00 10.00 C ATOM 0 H THR A 106 6.480 7.544 28.005 1.00 10.00 H new ATOM 0 HA THR A 106 5.013 9.795 27.083 1.00 10.00 H new ATOM 0 HB THR A 106 6.345 10.984 28.791 1.00 10.00 H new ATOM 0 HG1 THR A 106 7.686 9.862 30.157 1.00 10.00 H new ATOM 0 HG21 THR A 106 5.245 9.757 30.715 1.00 10.00 H new ATOM 0 HG22 THR A 106 4.152 9.913 29.319 1.00 10.00 H new ATOM 0 HG23 THR A 106 4.975 8.367 29.637 1.00 10.00 H new ATOM 1593 N GLU A 107 8.178 9.647 26.168 1.00 10.00 N ATOM 1594 CA GLU A 107 9.112 10.229 25.210 1.00 10.00 C ATOM 1595 C GLU A 107 8.565 10.118 23.783 1.00 10.00 C ATOM 1596 O GLU A 107 8.669 11.069 23.009 1.00 10.00 O ATOM 1597 CB GLU A 107 10.480 9.542 25.317 1.00 10.00 C ATOM 1598 CG GLU A 107 11.255 9.941 26.587 1.00 10.00 C ATOM 1599 CD GLU A 107 11.722 11.410 26.568 1.00 10.00 C ATOM 1600 OE1 GLU A 107 12.801 11.687 26.007 1.00 10.00 O ATOM 1601 OE2 GLU A 107 10.985 12.282 27.102 1.00 10.00 O ATOM 0 H GLU A 107 8.525 8.811 26.639 1.00 10.00 H new ATOM 0 HA GLU A 107 9.234 11.286 25.446 1.00 10.00 H new ATOM 0 HB2 GLU A 107 10.340 8.461 25.308 1.00 10.00 H new ATOM 0 HB3 GLU A 107 11.076 9.793 24.440 1.00 10.00 H new ATOM 0 HG2 GLU A 107 10.622 9.777 27.459 1.00 10.00 H new ATOM 0 HG3 GLU A 107 12.123 9.291 26.696 1.00 10.00 H new ATOM 1608 N LYS A 108 7.924 8.993 23.444 1.00 10.00 N ATOM 1609 CA LYS A 108 7.295 8.823 22.135 1.00 10.00 C ATOM 1610 C LYS A 108 6.142 9.810 21.958 1.00 10.00 C ATOM 1611 O LYS A 108 6.072 10.486 20.933 1.00 10.00 O ATOM 1612 CB LYS A 108 6.852 7.363 21.963 1.00 10.00 C ATOM 1613 CG LYS A 108 8.044 6.485 21.559 1.00 10.00 C ATOM 1614 CD LYS A 108 7.643 5.012 21.401 1.00 10.00 C ATOM 1615 CE LYS A 108 8.805 4.225 20.779 1.00 10.00 C ATOM 1616 NZ LYS A 108 8.762 4.240 19.298 1.00 10.00 N ATOM 0 H LYS A 108 7.829 8.187 24.062 1.00 10.00 H new ATOM 0 HA LYS A 108 8.017 9.045 21.349 1.00 10.00 H new ATOM 0 HB2 LYS A 108 6.421 6.995 22.894 1.00 10.00 H new ATOM 0 HB3 LYS A 108 6.072 7.300 21.204 1.00 10.00 H new ATOM 0 HG2 LYS A 108 8.462 6.850 20.621 1.00 10.00 H new ATOM 0 HG3 LYS A 108 8.828 6.569 22.311 1.00 10.00 H new ATOM 0 HD2 LYS A 108 7.383 4.589 22.372 1.00 10.00 H new ATOM 0 HD3 LYS A 108 6.757 4.931 20.771 1.00 10.00 H new ATOM 0 HE2 LYS A 108 9.751 4.648 21.118 1.00 10.00 H new ATOM 0 HE3 LYS A 108 8.773 3.194 21.131 1.00 10.00 H new ATOM 0 HZ1 LYS A 108 9.711 4.041 18.921 1.00 10.00 H new ATOM 0 HZ2 LYS A 108 8.097 3.514 18.963 1.00 10.00 H new ATOM 0 HZ3 LYS A 108 8.448 5.175 18.969 1.00 10.00 H new ATOM 1630 N ILE A 109 5.257 9.953 22.949 1.00 10.00 N ATOM 1631 CA ILE A 109 4.177 10.938 22.911 1.00 10.00 C ATOM 1632 C ILE A 109 4.797 12.332 22.755 1.00 10.00 C ATOM 1633 O ILE A 109 4.319 13.115 21.942 1.00 10.00 O ATOM 1634 CB ILE A 109 3.264 10.802 24.156 1.00 10.00 C ATOM 1635 CG1 ILE A 109 2.528 9.439 24.184 1.00 10.00 C ATOM 1636 CG2 ILE A 109 2.200 11.918 24.202 1.00 10.00 C ATOM 1637 CD1 ILE A 109 1.950 9.089 25.564 1.00 10.00 C ATOM 0 H ILE A 109 5.271 9.389 23.799 1.00 10.00 H new ATOM 0 HA ILE A 109 3.525 10.764 22.055 1.00 10.00 H new ATOM 0 HB ILE A 109 3.923 10.880 25.021 1.00 10.00 H new ATOM 0 HG12 ILE A 109 1.720 9.455 23.453 1.00 10.00 H new ATOM 0 HG13 ILE A 109 3.219 8.654 23.878 1.00 10.00 H new ATOM 0 HG21 ILE A 109 1.578 11.791 25.088 1.00 10.00 H new ATOM 0 HG22 ILE A 109 2.693 12.889 24.241 1.00 10.00 H new ATOM 0 HG23 ILE A 109 1.576 11.863 23.310 1.00 10.00 H new ATOM 0 HD11 ILE A 109 1.448 8.123 25.514 1.00 10.00 H new ATOM 0 HD12 ILE A 109 2.757 9.041 26.295 1.00 10.00 H new ATOM 0 HD13 ILE A 109 1.234 9.855 25.863 1.00 10.00 H new ATOM 1649 N LYS A 110 5.865 12.658 23.490 1.00 10.00 N ATOM 1650 CA LYS A 110 6.531 13.957 23.409 1.00 10.00 C ATOM 1651 C LYS A 110 7.069 14.198 21.997 1.00 10.00 C ATOM 1652 O LYS A 110 6.909 15.298 21.477 1.00 10.00 O ATOM 1653 CB LYS A 110 7.631 14.012 24.481 1.00 10.00 C ATOM 1654 CG LYS A 110 8.262 15.401 24.657 1.00 10.00 C ATOM 1655 CD LYS A 110 9.417 15.366 25.673 1.00 10.00 C ATOM 1656 CE LYS A 110 8.942 15.066 27.104 1.00 10.00 C ATOM 1657 NZ LYS A 110 10.069 14.720 28.000 1.00 10.00 N ATOM 0 H LYS A 110 6.293 12.021 24.162 1.00 10.00 H new ATOM 0 HA LYS A 110 5.823 14.762 23.606 1.00 10.00 H new ATOM 0 HB2 LYS A 110 7.211 13.691 25.434 1.00 10.00 H new ATOM 0 HB3 LYS A 110 8.413 13.299 24.221 1.00 10.00 H new ATOM 0 HG2 LYS A 110 8.631 15.760 23.696 1.00 10.00 H new ATOM 0 HG3 LYS A 110 7.503 16.108 24.991 1.00 10.00 H new ATOM 0 HD2 LYS A 110 10.140 14.609 25.369 1.00 10.00 H new ATOM 0 HD3 LYS A 110 9.935 16.325 25.660 1.00 10.00 H new ATOM 0 HE2 LYS A 110 8.416 15.934 27.501 1.00 10.00 H new ATOM 0 HE3 LYS A 110 8.228 14.242 27.084 1.00 10.00 H new ATOM 0 HZ1 LYS A 110 9.708 14.541 28.959 1.00 10.00 H new ATOM 0 HZ2 LYS A 110 10.545 13.866 27.645 1.00 10.00 H new ATOM 0 HZ3 LYS A 110 10.746 15.509 28.026 1.00 10.00 H new ATOM 1671 N ALA A 111 7.665 13.186 21.359 1.00 10.00 N ATOM 1672 CA ALA A 111 8.142 13.277 19.985 1.00 10.00 C ATOM 1673 C ALA A 111 6.990 13.512 18.998 1.00 10.00 C ATOM 1674 O ALA A 111 7.164 14.246 18.029 1.00 10.00 O ATOM 1675 CB ALA A 111 8.928 12.011 19.618 1.00 10.00 C ATOM 0 H ALA A 111 7.829 12.276 21.789 1.00 10.00 H new ATOM 0 HA ALA A 111 8.806 14.139 19.914 1.00 10.00 H new ATOM 0 HB1 ALA A 111 9.281 12.087 18.590 1.00 10.00 H new ATOM 0 HB2 ALA A 111 9.782 11.906 20.288 1.00 10.00 H new ATOM 0 HB3 ALA A 111 8.281 11.140 19.716 1.00 10.00 H new ATOM 1681 N LYS A 112 5.820 12.898 19.220 1.00 10.00 N ATOM 1682 CA LYS A 112 4.621 13.135 18.411 1.00 10.00 C ATOM 1683 C LYS A 112 4.017 14.526 18.687 1.00 10.00 C ATOM 1684 O LYS A 112 3.369 15.064 17.791 1.00 10.00 O ATOM 1685 CB LYS A 112 3.621 11.992 18.685 1.00 10.00 C ATOM 1686 CG LYS A 112 2.330 12.027 17.845 1.00 10.00 C ATOM 1687 CD LYS A 112 2.591 11.807 16.345 1.00 10.00 C ATOM 1688 CE LYS A 112 1.291 11.656 15.537 1.00 10.00 C ATOM 1689 NZ LYS A 112 0.510 12.917 15.438 1.00 10.00 N ATOM 0 H LYS A 112 5.680 12.220 19.969 1.00 10.00 H new ATOM 0 HA LYS A 112 4.880 13.135 17.352 1.00 10.00 H new ATOM 0 HB2 LYS A 112 4.124 11.042 18.507 1.00 10.00 H new ATOM 0 HB3 LYS A 112 3.348 12.016 19.740 1.00 10.00 H new ATOM 0 HG2 LYS A 112 1.645 11.260 18.207 1.00 10.00 H new ATOM 0 HG3 LYS A 112 1.835 12.988 17.986 1.00 10.00 H new ATOM 0 HD2 LYS A 112 3.164 12.647 15.952 1.00 10.00 H new ATOM 0 HD3 LYS A 112 3.203 10.915 16.213 1.00 10.00 H new ATOM 0 HE2 LYS A 112 1.534 11.307 14.533 1.00 10.00 H new ATOM 0 HE3 LYS A 112 0.671 10.888 16.000 1.00 10.00 H new ATOM 0 HZ1 LYS A 112 -0.353 12.748 14.882 1.00 10.00 H new ATOM 0 HZ2 LYS A 112 0.250 13.240 16.392 1.00 10.00 H new ATOM 0 HZ3 LYS A 112 1.086 13.646 14.971 1.00 10.00 H new ATOM 1703 N TYR A 113 4.183 15.040 19.909 1.00 10.00 N ATOM 1704 CA TYR A 113 3.544 16.228 20.477 1.00 10.00 C ATOM 1705 C TYR A 113 2.078 16.418 20.041 1.00 10.00 C ATOM 1706 O TYR A 113 1.742 17.427 19.424 1.00 10.00 O ATOM 1707 CB TYR A 113 4.430 17.488 20.357 1.00 10.00 C ATOM 1708 CG TYR A 113 4.941 17.863 18.974 1.00 10.00 C ATOM 1709 CD1 TYR A 113 6.146 17.309 18.499 1.00 10.00 C ATOM 1710 CD2 TYR A 113 4.253 18.803 18.183 1.00 10.00 C ATOM 1711 CE1 TYR A 113 6.642 17.657 17.230 1.00 10.00 C ATOM 1712 CE2 TYR A 113 4.743 19.161 16.914 1.00 10.00 C ATOM 1713 CZ TYR A 113 5.937 18.583 16.427 1.00 10.00 C ATOM 1714 OH TYR A 113 6.405 18.935 15.194 1.00 10.00 O ATOM 0 H TYR A 113 4.817 14.602 20.577 1.00 10.00 H new ATOM 0 HA TYR A 113 3.460 16.046 21.548 1.00 10.00 H new ATOM 0 HB2 TYR A 113 3.864 18.334 20.747 1.00 10.00 H new ATOM 0 HB3 TYR A 113 5.293 17.354 21.009 1.00 10.00 H new ATOM 0 HD1 TYR A 113 6.694 16.611 19.115 1.00 10.00 H new ATOM 0 HD2 TYR A 113 3.343 19.252 18.553 1.00 10.00 H new ATOM 0 HE1 TYR A 113 7.560 17.218 16.869 1.00 10.00 H new ATOM 0 HE2 TYR A 113 4.206 19.878 16.311 1.00 10.00 H new ATOM 0 HH TYR A 113 5.793 19.581 14.784 1.00 10.00 H new ATOM 1724 N PRO A 114 1.166 15.465 20.342 1.00 10.00 N ATOM 1725 CA PRO A 114 -0.267 15.708 20.175 1.00 10.00 C ATOM 1726 C PRO A 114 -0.729 16.864 21.088 1.00 10.00 C ATOM 1727 O PRO A 114 -1.683 17.563 20.754 1.00 10.00 O ATOM 1728 CB PRO A 114 -0.950 14.375 20.507 1.00 10.00 C ATOM 1729 CG PRO A 114 0.014 13.703 21.483 1.00 10.00 C ATOM 1730 CD PRO A 114 1.391 14.219 21.064 1.00 10.00 C ATOM 0 HA PRO A 114 -0.525 16.022 19.164 1.00 10.00 H new ATOM 0 HB2 PRO A 114 -1.931 14.529 20.957 1.00 10.00 H new ATOM 0 HB3 PRO A 114 -1.101 13.770 19.613 1.00 10.00 H new ATOM 0 HG2 PRO A 114 -0.214 13.969 22.515 1.00 10.00 H new ATOM 0 HG3 PRO A 114 -0.042 12.617 21.414 1.00 10.00 H new ATOM 0 HD2 PRO A 114 2.024 14.385 21.935 1.00 10.00 H new ATOM 0 HD3 PRO A 114 1.902 13.492 20.433 1.00 10.00 H new ATOM 1738 N ASP A 115 -0.025 17.057 22.204 1.00 10.00 N ATOM 1739 CA ASP A 115 -0.053 18.199 23.108 1.00 10.00 C ATOM 1740 C ASP A 115 1.368 18.294 23.675 1.00 10.00 C ATOM 1741 O ASP A 115 2.104 17.293 23.667 1.00 10.00 O ATOM 1742 CB ASP A 115 -1.073 17.996 24.237 1.00 10.00 C ATOM 1743 CG ASP A 115 -1.000 19.136 25.265 1.00 10.00 C ATOM 1744 OD1 ASP A 115 -1.048 20.307 24.823 1.00 10.00 O ATOM 1745 OD2 ASP A 115 -0.898 18.835 26.478 1.00 10.00 O ATOM 0 H ASP A 115 0.639 16.351 22.524 1.00 10.00 H new ATOM 0 HA ASP A 115 -0.354 19.110 22.591 1.00 10.00 H new ATOM 0 HB2 ASP A 115 -2.078 17.945 23.818 1.00 10.00 H new ATOM 0 HB3 ASP A 115 -0.886 17.043 24.733 1.00 10.00 H new ATOM 1750 N TYR A 116 1.792 19.485 24.093 1.00 10.00 N ATOM 1751 CA TYR A 116 3.157 19.712 24.541 1.00 10.00 C ATOM 1752 C TYR A 116 3.313 19.303 26.009 1.00 10.00 C ATOM 1753 O TYR A 116 2.471 19.616 26.845 1.00 10.00 O ATOM 1754 CB TYR A 116 3.545 21.177 24.303 1.00 10.00 C ATOM 1755 CG TYR A 116 3.544 21.560 22.830 1.00 10.00 C ATOM 1756 CD1 TYR A 116 4.592 21.127 21.993 1.00 10.00 C ATOM 1757 CD2 TYR A 116 2.481 22.308 22.287 1.00 10.00 C ATOM 1758 CE1 TYR A 116 4.575 21.432 20.621 1.00 10.00 C ATOM 1759 CE2 TYR A 116 2.457 22.619 20.915 1.00 10.00 C ATOM 1760 CZ TYR A 116 3.505 22.175 20.074 1.00 10.00 C ATOM 1761 OH TYR A 116 3.498 22.469 18.744 1.00 10.00 O ATOM 0 H TYR A 116 1.199 20.314 24.129 1.00 10.00 H new ATOM 0 HA TYR A 116 3.840 19.090 23.962 1.00 10.00 H new ATOM 0 HB2 TYR A 116 2.851 21.823 24.841 1.00 10.00 H new ATOM 0 HB3 TYR A 116 4.536 21.357 24.719 1.00 10.00 H new ATOM 0 HD1 TYR A 116 5.411 20.559 22.407 1.00 10.00 H new ATOM 0 HD2 TYR A 116 1.680 22.645 22.928 1.00 10.00 H new ATOM 0 HE1 TYR A 116 5.381 21.098 19.984 1.00 10.00 H new ATOM 0 HE2 TYR A 116 1.641 23.195 20.505 1.00 10.00 H new ATOM 0 HH TYR A 116 2.693 22.984 18.527 1.00 10.00 H new ATOM 1771 N GLU A 117 4.470 18.705 26.311 1.00 10.00 N ATOM 1772 CA GLU A 117 4.861 18.092 27.581 1.00 10.00 C ATOM 1773 C GLU A 117 4.020 16.855 27.944 1.00 10.00 C ATOM 1774 O GLU A 117 2.838 16.730 27.626 1.00 10.00 O ATOM 1775 CB GLU A 117 4.952 19.137 28.714 1.00 10.00 C ATOM 1776 CG GLU A 117 5.633 18.636 30.002 1.00 10.00 C ATOM 1777 CD GLU A 117 7.090 18.182 29.778 1.00 10.00 C ATOM 1778 OE1 GLU A 117 7.301 17.086 29.194 1.00 10.00 O ATOM 1779 OE2 GLU A 117 8.002 18.935 30.178 1.00 10.00 O ATOM 0 H GLU A 117 5.215 18.632 25.618 1.00 10.00 H new ATOM 0 HA GLU A 117 5.870 17.702 27.445 1.00 10.00 H new ATOM 0 HB2 GLU A 117 5.498 20.005 28.345 1.00 10.00 H new ATOM 0 HB3 GLU A 117 3.945 19.474 28.960 1.00 10.00 H new ATOM 0 HG2 GLU A 117 5.617 19.431 30.747 1.00 10.00 H new ATOM 0 HG3 GLU A 117 5.058 17.805 30.410 1.00 10.00 H new ATOM 1786 N VAL A 118 4.664 15.889 28.605 1.00 10.00 N ATOM 1787 CA VAL A 118 4.095 14.605 28.995 1.00 10.00 C ATOM 1788 C VAL A 118 4.742 14.217 30.331 1.00 10.00 C ATOM 1789 O VAL A 118 5.905 14.526 30.578 1.00 10.00 O ATOM 1790 CB VAL A 118 4.380 13.531 27.915 1.00 10.00 C ATOM 1791 CG1 VAL A 118 3.467 12.311 28.108 1.00 10.00 C ATOM 1792 CG2 VAL A 118 4.208 14.003 26.461 1.00 10.00 C ATOM 0 H VAL A 118 5.637 15.989 28.893 1.00 10.00 H new ATOM 0 HA VAL A 118 3.012 14.676 29.097 1.00 10.00 H new ATOM 0 HB VAL A 118 5.433 13.288 28.060 1.00 10.00 H new ATOM 0 HG11 VAL A 118 3.684 11.569 27.339 1.00 10.00 H new ATOM 0 HG12 VAL A 118 3.644 11.876 29.092 1.00 10.00 H new ATOM 0 HG13 VAL A 118 2.425 12.621 28.030 1.00 10.00 H new ATOM 0 HG21 VAL A 118 4.430 13.179 25.782 1.00 10.00 H new ATOM 0 HG22 VAL A 118 3.181 14.335 26.305 1.00 10.00 H new ATOM 0 HG23 VAL A 118 4.890 14.830 26.264 1.00 10.00 H new ATOM 1802 N THR A 119 4.022 13.501 31.198 1.00 10.00 N ATOM 1803 CA THR A 119 4.536 13.018 32.480 1.00 10.00 C ATOM 1804 C THR A 119 4.036 11.595 32.743 1.00 10.00 C ATOM 1805 O THR A 119 3.094 11.148 32.091 1.00 10.00 O ATOM 1806 CB THR A 119 4.109 13.985 33.603 1.00 10.00 C ATOM 1807 OG1 THR A 119 2.729 14.340 33.514 1.00 10.00 O ATOM 1808 CG2 THR A 119 4.916 15.282 33.599 1.00 10.00 C ATOM 0 H THR A 119 3.052 13.237 31.026 1.00 10.00 H new ATOM 0 HA THR A 119 5.625 12.986 32.453 1.00 10.00 H new ATOM 0 HB THR A 119 4.297 13.437 34.526 1.00 10.00 H new ATOM 0 HG1 THR A 119 2.192 13.694 34.019 1.00 10.00 H new ATOM 0 HG21 THR A 119 4.574 15.926 34.410 1.00 10.00 H new ATOM 0 HG22 THR A 119 5.973 15.053 33.738 1.00 10.00 H new ATOM 0 HG23 THR A 119 4.778 15.794 32.646 1.00 10.00 H new ATOM 1816 N TRP A 120 4.612 10.903 33.725 1.00 10.00 N ATOM 1817 CA TRP A 120 4.071 9.637 34.200 1.00 10.00 C ATOM 1818 C TRP A 120 4.325 9.456 35.693 1.00 10.00 C ATOM 1819 O TRP A 120 5.154 10.163 36.270 1.00 10.00 O ATOM 1820 CB TRP A 120 4.622 8.454 33.384 1.00 10.00 C ATOM 1821 CG TRP A 120 6.081 8.147 33.529 1.00 10.00 C ATOM 1822 CD1 TRP A 120 7.087 8.726 32.837 1.00 10.00 C ATOM 1823 CD2 TRP A 120 6.720 7.163 34.401 1.00 10.00 C ATOM 1824 NE1 TRP A 120 8.294 8.192 33.235 1.00 10.00 N ATOM 1825 CE2 TRP A 120 8.130 7.216 34.195 1.00 10.00 C ATOM 1826 CE3 TRP A 120 6.247 6.211 35.331 1.00 10.00 C ATOM 1827 CZ2 TRP A 120 9.022 6.382 34.887 1.00 10.00 C ATOM 1828 CZ3 TRP A 120 7.131 5.368 36.031 1.00 10.00 C ATOM 1829 CH2 TRP A 120 8.518 5.454 35.813 1.00 10.00 C ATOM 0 H TRP A 120 5.459 11.203 34.208 1.00 10.00 H new ATOM 0 HA TRP A 120 2.991 9.659 34.052 1.00 10.00 H new ATOM 0 HB2 TRP A 120 4.059 7.562 33.659 1.00 10.00 H new ATOM 0 HB3 TRP A 120 4.420 8.646 32.330 1.00 10.00 H new ATOM 0 HD1 TRP A 120 6.964 9.492 32.085 1.00 10.00 H new ATOM 0 HE1 TRP A 120 9.198 8.483 32.864 1.00 10.00 H new ATOM 0 HE3 TRP A 120 5.185 6.128 35.509 1.00 10.00 H new ATOM 0 HZ2 TRP A 120 10.085 6.453 34.709 1.00 10.00 H new ATOM 0 HZ3 TRP A 120 6.742 4.651 36.739 1.00 10.00 H new ATOM 0 HH2 TRP A 120 9.193 4.809 36.356 1.00 10.00 H new ATOM 1840 N ALA A 121 3.608 8.516 36.308 1.00 10.00 N ATOM 1841 CA ALA A 121 3.748 8.086 37.691 1.00 10.00 C ATOM 1842 C ALA A 121 3.332 6.612 37.788 1.00 10.00 C ATOM 1843 O ALA A 121 2.892 6.021 36.805 1.00 10.00 O ATOM 1844 CB ALA A 121 2.865 8.959 38.595 1.00 10.00 C ATOM 0 H ALA A 121 2.871 8.006 35.821 1.00 10.00 H new ATOM 0 HA ALA A 121 4.782 8.192 38.019 1.00 10.00 H new ATOM 0 HB1 ALA A 121 2.972 8.635 39.630 1.00 10.00 H new ATOM 0 HB2 ALA A 121 3.173 10.001 38.507 1.00 10.00 H new ATOM 0 HB3 ALA A 121 1.823 8.861 38.290 1.00 10.00 H new ATOM 1850 N ASN A 122 3.460 6.013 38.974 1.00 10.00 N ATOM 1851 CA ASN A 122 3.066 4.628 39.246 1.00 10.00 C ATOM 1852 C ASN A 122 2.388 4.560 40.620 1.00 10.00 C ATOM 1853 O ASN A 122 2.712 3.712 41.443 1.00 10.00 O ATOM 1854 CB ASN A 122 4.285 3.696 39.124 1.00 10.00 C ATOM 1855 CG ASN A 122 3.897 2.224 39.269 1.00 10.00 C ATOM 1856 OD1 ASN A 122 2.817 1.803 38.882 1.00 10.00 O ATOM 1857 ND2 ASN A 122 4.788 1.401 39.806 1.00 10.00 N ATOM 0 H ASN A 122 3.849 6.487 39.789 1.00 10.00 H new ATOM 0 HA ASN A 122 2.342 4.283 38.508 1.00 10.00 H new ATOM 0 HB2 ASN A 122 4.765 3.851 38.158 1.00 10.00 H new ATOM 0 HB3 ASN A 122 5.017 3.955 39.889 1.00 10.00 H new ATOM 0 HD21 ASN A 122 4.574 0.408 39.899 1.00 10.00 H new ATOM 0 HD22 ASN A 122 5.687 1.761 40.126 1.00 10.00 H new ATOM 1864 N ASP A 123 1.533 5.546 40.906 1.00 10.00 N ATOM 1865 CA ASP A 123 0.876 5.714 42.211 1.00 10.00 C ATOM 1866 C ASP A 123 -0.023 4.526 42.590 1.00 10.00 C ATOM 1867 O ASP A 123 -0.137 4.172 43.761 1.00 10.00 O ATOM 1868 CB ASP A 123 0.048 7.004 42.200 1.00 10.00 C ATOM 1869 CG ASP A 123 -0.688 7.210 43.531 1.00 10.00 C ATOM 1870 OD1 ASP A 123 -0.003 7.584 44.507 1.00 10.00 O ATOM 1871 OD2 ASP A 123 -1.929 7.061 43.532 1.00 10.00 O ATOM 0 H ASP A 123 1.272 6.263 40.229 1.00 10.00 H new ATOM 0 HA ASP A 123 1.663 5.767 42.963 1.00 10.00 H new ATOM 0 HB2 ASP A 123 0.701 7.855 42.008 1.00 10.00 H new ATOM 0 HB3 ASP A 123 -0.675 6.967 41.385 1.00 10.00 H new ATOM 1876 N GLY A 124 -0.603 3.862 41.587 1.00 10.00 N ATOM 1877 CA GLY A 124 -1.479 2.714 41.756 1.00 10.00 C ATOM 1878 C GLY A 124 -2.041 2.280 40.405 1.00 10.00 C ATOM 1879 O GLY A 124 -1.667 2.840 39.368 1.00 10.00 O ATOM 0 H GLY A 124 -0.468 4.120 40.610 1.00 10.00 H new ATOM 0 HA2 GLY A 124 -0.929 1.891 42.211 1.00 10.00 H new ATOM 0 HA3 GLY A 124 -2.294 2.966 42.434 1.00 10.00 H new ATOM 1883 N TYR A 125 -2.876 1.233 40.427 1.00 10.00 N ATOM 1884 CA TYR A 125 -3.633 0.779 39.261 1.00 10.00 C ATOM 1885 C TYR A 125 -4.499 1.925 38.728 1.00 10.00 C ATOM 1886 O TYR A 125 -4.592 2.027 37.482 1.00 10.00 O ATOM 1887 CB TYR A 125 -4.489 -0.444 39.627 1.00 10.00 C ATOM 1888 CG TYR A 125 -5.229 -1.061 38.452 1.00 10.00 C ATOM 1889 CD1 TYR A 125 -4.578 -1.991 37.619 1.00 10.00 C ATOM 1890 CD2 TYR A 125 -6.567 -0.708 38.190 1.00 10.00 C ATOM 1891 CE1 TYR A 125 -5.265 -2.578 36.541 1.00 10.00 C ATOM 1892 CE2 TYR A 125 -7.256 -1.282 37.105 1.00 10.00 C ATOM 1893 CZ TYR A 125 -6.607 -2.226 36.277 1.00 10.00 C ATOM 1894 OH TYR A 125 -7.248 -2.773 35.200 1.00 10.00 O ATOM 1895 OXT TYR A 125 -5.109 2.634 39.553 1.00 10.00 O ATOM 0 H TYR A 125 -3.044 0.675 41.264 1.00 10.00 H new ATOM 0 HA TYR A 125 -2.941 0.478 38.474 1.00 10.00 H new ATOM 0 HB2 TYR A 125 -3.847 -1.202 40.076 1.00 10.00 H new ATOM 0 HB3 TYR A 125 -5.215 -0.151 40.386 1.00 10.00 H new ATOM 0 HD1 TYR A 125 -3.548 -2.254 37.808 1.00 10.00 H new ATOM 0 HD2 TYR A 125 -7.068 0.008 38.826 1.00 10.00 H new ATOM 0 HE1 TYR A 125 -4.765 -3.300 35.913 1.00 10.00 H new ATOM 0 HE2 TYR A 125 -8.280 -1.001 36.905 1.00 10.00 H new ATOM 0 HH TYR A 125 -8.165 -2.431 35.157 1.00 10.00 H new TER 1905 TYR A 125