USER MOD reduce.3.24.130724 H: found=0, std=0, add=881, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 879 hydrogens (32 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 NoAdj-H: A 18 HIS HE2 : A 18 HIS NE2 : A 105 HECFE :(H bumps) USER MOD NoAdj-H: A 105 HEC HAC : A 105 HEC CAC : A 17 CYS SG :(H bumps) USER MOD NoAdj-H: A 105 HEC HAB : A 105 HEC CAB : A 14 CYS SG :(H bumps) USER MOD Set 1.1: A 102 THR OG1 : rot 59:sc= 1.13 USER MOD Set 1.2: A 103 ASN : amide:sc= 3.13 K(o=4.3,f=-3.1!) USER MOD Set 2.1: A 49 THR OG1 : rot 25:sc= 1.06 USER MOD Set 2.2: A 52 ASN : amide:sc= -0.0905 K(o=3.3,f=-0.23) USER MOD Set 2.3: A 53 LYS NZ :NH3+ -172:sc= -1.59! (180deg=-2.02!) USER MOD Set 2.4: A 78 THR OG1 : rot -69:sc= 1.25 USER MOD Set 2.5: A 105 HEC O2D : rot 169:sc= 2.66 USER MOD Set 3.1: A 39 LYS NZ :NH3+ 134:sc= 1.26 (180deg=-0.136) USER MOD Set 3.2: A 42 GLN : amide:sc= 0.705 K(o=2,f=-5.7) USER MOD Set 4.1: A 31 ASN : amide:sc= -0.828 K(o=-2.2,f=-12!) USER MOD Set 4.2: A 33 HIS : no HE2:sc= -1.37 K(o=-2.2,f=-6.8!) USER MOD Set 5.1: A 27 LYS NZ :NH3+ -137:sc= 1.11 (180deg=0) USER MOD Set 5.2: A 28 THR OG1 : rot -150:sc= 0.948 USER MOD Set 6.1: A 19 THR OG1 : rot -17:sc= 1.81 USER MOD Set 6.2: A 25 LYS NZ :NH3+ 143:sc= 1.86 (180deg=1.28) USER MOD Single : A 1 GLY N :NH3+ 155:sc= 1.96 (180deg=0.209!) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 162:sc= 1.21 (180deg=0.426) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -0.0291 X(o=-0.029,f=-0.029) USER MOD Single : A 13 LYS NZ :NH3+ 177:sc= 0.995 (180deg=0.952) USER MOD Single : A 16 GLN : amide:sc= -0.0714 K(o=-0.071,f=-2.9!) USER MOD Single : A 22 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00982) USER MOD Single : A 26 HIS : no HE2:sc= -0.0267 K(o=-0.027,f=-1.8) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0.0354 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= 1.15 K(o=1.1,f=-0.0069) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 54:sc= 0.566 USER MOD Single : A 60 LYS NZ :NH3+ 172:sc= 1.28 (180deg=1.17) USER MOD Single : A 63 THR OG1 : rot -141:sc= 1.31 USER MOD Single : A 65 MET CE :methyl -165:sc= -1.27 (180deg=-2.58) USER MOD Single : A 67 TYR OH : rot -128:sc= 0.485 USER MOD Single : A 70 ASN : amide:sc= 0.0367 K(o=0.037,f=-5.9!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 166:sc= 1.14 (180deg=0.00101) USER MOD Single : A 74 TYR OH : rot 15:sc= -0.203 USER MOD Single : A 79 LYS NZ :NH3+ -158:sc= 1.24 (180deg=0.988) USER MOD Single : A 80 MET CE :methyl 157:sc= -0.19 (180deg=-1.41) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ -166:sc= 2.24 (180deg=1.83) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.046 USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ -122:sc= 0.232 (180deg=-0.919) USER MOD Single : A 100 LYS NZ :NH3+ -178:sc= 1.11 (180deg=1.08) USER MOD Single : A 105 HEC O2A : rot -95:sc= 1.33 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.694 1.394 -0.679 1.00 10.00 N ATOM 2 CA GLY A 1 1.469 0.295 0.279 1.00 10.00 C ATOM 3 C GLY A 1 0.909 0.760 1.616 1.00 10.00 C ATOM 4 O GLY A 1 1.658 0.800 2.583 1.00 10.00 O ATOM 0 H1 GLY A 1 2.430 1.116 -1.360 1.00 10.00 H new ATOM 0 H2 GLY A 1 0.810 1.597 -1.188 1.00 10.00 H new ATOM 0 H3 GLY A 1 2.001 2.245 -0.166 1.00 10.00 H new ATOM 0 HA2 GLY A 1 0.782 -0.426 -0.163 1.00 10.00 H new ATOM 0 HA3 GLY A 1 2.411 -0.226 0.450 1.00 10.00 H new ATOM 10 N ASP A 2 -0.396 1.044 1.684 1.00 10.00 N ATOM 11 CA ASP A 2 -1.174 1.227 2.921 1.00 10.00 C ATOM 12 C ASP A 2 -2.302 0.184 3.058 1.00 10.00 C ATOM 13 O ASP A 2 -2.845 -0.290 2.062 1.00 10.00 O ATOM 14 CB ASP A 2 -1.805 2.627 2.930 1.00 10.00 C ATOM 15 CG ASP A 2 -2.643 2.895 4.177 1.00 10.00 C ATOM 16 OD1 ASP A 2 -2.234 2.445 5.271 1.00 10.00 O ATOM 17 OD2 ASP A 2 -3.741 3.459 3.995 1.00 10.00 O ATOM 0 H ASP A 2 -0.966 1.158 0.846 1.00 10.00 H new ATOM 0 HA ASP A 2 -0.485 1.102 3.757 1.00 10.00 H new ATOM 0 HB2 ASP A 2 -1.016 3.376 2.861 1.00 10.00 H new ATOM 0 HB3 ASP A 2 -2.432 2.743 2.046 1.00 10.00 H new ATOM 22 N VAL A 3 -2.714 -0.096 4.299 1.00 10.00 N ATOM 23 CA VAL A 3 -3.887 -0.913 4.638 1.00 10.00 C ATOM 24 C VAL A 3 -5.198 -0.233 4.220 1.00 10.00 C ATOM 25 O VAL A 3 -5.986 -0.832 3.493 1.00 10.00 O ATOM 26 CB VAL A 3 -3.861 -1.340 6.126 1.00 10.00 C ATOM 27 CG1 VAL A 3 -3.634 -0.197 7.127 1.00 10.00 C ATOM 28 CG2 VAL A 3 -5.134 -2.093 6.540 1.00 10.00 C ATOM 0 H VAL A 3 -2.224 0.251 5.124 1.00 10.00 H new ATOM 0 HA VAL A 3 -3.838 -1.833 4.056 1.00 10.00 H new ATOM 0 HB VAL A 3 -2.994 -1.998 6.176 1.00 10.00 H new ATOM 0 HG11 VAL A 3 -3.632 -0.596 8.141 1.00 10.00 H new ATOM 0 HG12 VAL A 3 -2.675 0.280 6.923 1.00 10.00 H new ATOM 0 HG13 VAL A 3 -4.433 0.538 7.028 1.00 10.00 H new ATOM 0 HG21 VAL A 3 -5.067 -2.371 7.592 1.00 10.00 H new ATOM 0 HG22 VAL A 3 -6.002 -1.451 6.389 1.00 10.00 H new ATOM 0 HG23 VAL A 3 -5.238 -2.993 5.933 1.00 10.00 H new ATOM 38 N GLU A 4 -5.433 1.021 4.608 1.00 10.00 N ATOM 39 CA GLU A 4 -6.627 1.785 4.247 1.00 10.00 C ATOM 40 C GLU A 4 -6.710 2.115 2.763 1.00 10.00 C ATOM 41 O GLU A 4 -7.755 1.858 2.155 1.00 10.00 O ATOM 42 CB GLU A 4 -6.715 3.032 5.116 1.00 10.00 C ATOM 43 CG GLU A 4 -7.785 2.944 6.206 1.00 10.00 C ATOM 44 CD GLU A 4 -7.825 1.614 6.968 1.00 10.00 C ATOM 45 OE1 GLU A 4 -6.888 1.352 7.749 1.00 10.00 O ATOM 46 OE2 GLU A 4 -8.808 0.869 6.735 1.00 10.00 O ATOM 0 H GLU A 4 -4.784 1.545 5.195 1.00 10.00 H new ATOM 0 HA GLU A 4 -7.494 1.153 4.440 1.00 10.00 H new ATOM 0 HB2 GLU A 4 -5.746 3.208 5.583 1.00 10.00 H new ATOM 0 HB3 GLU A 4 -6.925 3.893 4.481 1.00 10.00 H new ATOM 0 HG2 GLU A 4 -7.621 3.750 6.921 1.00 10.00 H new ATOM 0 HG3 GLU A 4 -8.761 3.114 5.751 1.00 10.00 H new ATOM 53 N LYS A 5 -5.626 2.615 2.146 1.00 10.00 N ATOM 54 CA LYS A 5 -5.618 2.793 0.683 1.00 10.00 C ATOM 55 C LYS A 5 -5.741 1.457 -0.065 1.00 10.00 C ATOM 56 O LYS A 5 -6.099 1.461 -1.238 1.00 10.00 O ATOM 57 CB LYS A 5 -4.373 3.554 0.210 1.00 10.00 C ATOM 58 CG LYS A 5 -4.057 4.839 1.004 1.00 10.00 C ATOM 59 CD LYS A 5 -4.598 6.124 0.367 1.00 10.00 C ATOM 60 CE LYS A 5 -6.110 6.224 0.587 1.00 10.00 C ATOM 61 NZ LYS A 5 -6.675 7.430 -0.050 1.00 10.00 N ATOM 0 H LYS A 5 -4.767 2.896 2.620 1.00 10.00 H new ATOM 0 HA LYS A 5 -6.497 3.392 0.444 1.00 10.00 H new ATOM 0 HB2 LYS A 5 -3.513 2.887 0.269 1.00 10.00 H new ATOM 0 HB3 LYS A 5 -4.502 3.816 -0.840 1.00 10.00 H new ATOM 0 HG2 LYS A 5 -4.471 4.743 2.008 1.00 10.00 H new ATOM 0 HG3 LYS A 5 -2.976 4.928 1.112 1.00 10.00 H new ATOM 0 HD2 LYS A 5 -4.101 6.992 0.801 1.00 10.00 H new ATOM 0 HD3 LYS A 5 -4.377 6.131 -0.700 1.00 10.00 H new ATOM 0 HE2 LYS A 5 -6.596 5.337 0.182 1.00 10.00 H new ATOM 0 HE3 LYS A 5 -6.322 6.244 1.656 1.00 10.00 H new ATOM 0 HZ1 LYS A 5 -7.700 7.464 0.120 1.00 10.00 H new ATOM 0 HZ2 LYS A 5 -6.229 8.278 0.354 1.00 10.00 H new ATOM 0 HZ3 LYS A 5 -6.495 7.399 -1.074 1.00 10.00 H new ATOM 75 N GLY A 6 -5.518 0.326 0.618 1.00 10.00 N ATOM 76 CA GLY A 6 -5.565 -1.022 0.055 1.00 10.00 C ATOM 77 C GLY A 6 -6.948 -1.637 0.148 1.00 10.00 C ATOM 78 O GLY A 6 -7.483 -2.122 -0.850 1.00 10.00 O ATOM 0 H GLY A 6 -5.292 0.329 1.613 1.00 10.00 H new ATOM 0 HA2 GLY A 6 -5.254 -0.988 -0.989 1.00 10.00 H new ATOM 0 HA3 GLY A 6 -4.851 -1.657 0.579 1.00 10.00 H new ATOM 82 N LYS A 7 -7.565 -1.580 1.331 1.00 10.00 N ATOM 83 CA LYS A 7 -8.891 -2.143 1.534 1.00 10.00 C ATOM 84 C LYS A 7 -9.961 -1.439 0.694 1.00 10.00 C ATOM 85 O LYS A 7 -10.830 -2.095 0.128 1.00 10.00 O ATOM 86 CB LYS A 7 -9.183 -2.221 3.036 1.00 10.00 C ATOM 87 CG LYS A 7 -9.477 -0.898 3.758 1.00 10.00 C ATOM 88 CD LYS A 7 -10.950 -0.870 4.162 1.00 10.00 C ATOM 89 CE LYS A 7 -11.305 0.247 5.133 1.00 10.00 C ATOM 90 NZ LYS A 7 -12.762 0.217 5.387 1.00 10.00 N ATOM 0 H LYS A 7 -7.161 -1.147 2.162 1.00 10.00 H new ATOM 0 HA LYS A 7 -8.920 -3.166 1.158 1.00 10.00 H new ATOM 0 HB2 LYS A 7 -10.036 -2.883 3.181 1.00 10.00 H new ATOM 0 HB3 LYS A 7 -8.329 -2.690 3.523 1.00 10.00 H new ATOM 0 HG2 LYS A 7 -8.843 -0.801 4.639 1.00 10.00 H new ATOM 0 HG3 LYS A 7 -9.249 -0.054 3.106 1.00 10.00 H new ATOM 0 HD2 LYS A 7 -11.560 -0.765 3.265 1.00 10.00 H new ATOM 0 HD3 LYS A 7 -11.210 -1.827 4.614 1.00 10.00 H new ATOM 0 HE2 LYS A 7 -10.757 0.123 6.067 1.00 10.00 H new ATOM 0 HE3 LYS A 7 -11.014 1.213 4.719 1.00 10.00 H new ATOM 0 HZ1 LYS A 7 -12.974 0.751 6.254 1.00 10.00 H new ATOM 0 HZ2 LYS A 7 -13.263 0.647 4.584 1.00 10.00 H new ATOM 0 HZ3 LYS A 7 -13.074 -0.768 5.503 1.00 10.00 H new ATOM 104 N LYS A 8 -9.831 -0.119 0.493 1.00 10.00 N ATOM 105 CA LYS A 8 -10.715 0.658 -0.390 1.00 10.00 C ATOM 106 C LYS A 8 -10.587 0.277 -1.870 1.00 10.00 C ATOM 107 O LYS A 8 -11.610 0.206 -2.543 1.00 10.00 O ATOM 108 CB LYS A 8 -10.557 2.169 -0.137 1.00 10.00 C ATOM 109 CG LYS A 8 -9.191 2.770 -0.514 1.00 10.00 C ATOM 110 CD LYS A 8 -9.069 3.369 -1.923 1.00 10.00 C ATOM 111 CE LYS A 8 -9.963 4.604 -2.065 1.00 10.00 C ATOM 112 NZ LYS A 8 -9.604 5.414 -3.249 1.00 10.00 N ATOM 0 H LYS A 8 -9.106 0.442 0.940 1.00 10.00 H new ATOM 0 HA LYS A 8 -11.739 0.392 -0.129 1.00 10.00 H new ATOM 0 HB2 LYS A 8 -11.331 2.695 -0.695 1.00 10.00 H new ATOM 0 HB3 LYS A 8 -10.739 2.363 0.920 1.00 10.00 H new ATOM 0 HG2 LYS A 8 -8.950 3.549 0.209 1.00 10.00 H new ATOM 0 HG3 LYS A 8 -8.435 1.992 -0.408 1.00 10.00 H new ATOM 0 HD2 LYS A 8 -8.032 3.640 -2.120 1.00 10.00 H new ATOM 0 HD3 LYS A 8 -9.350 2.623 -2.666 1.00 10.00 H new ATOM 0 HE2 LYS A 8 -11.004 4.291 -2.142 1.00 10.00 H new ATOM 0 HE3 LYS A 8 -9.880 5.217 -1.168 1.00 10.00 H new ATOM 0 HZ1 LYS A 8 -10.233 6.240 -3.308 1.00 10.00 H new ATOM 0 HZ2 LYS A 8 -8.618 5.735 -3.164 1.00 10.00 H new ATOM 0 HZ3 LYS A 8 -9.708 4.838 -4.108 1.00 10.00 H new ATOM 126 N ILE A 9 -9.376 0.000 -2.382 1.00 10.00 N ATOM 127 CA ILE A 9 -9.200 -0.459 -3.772 1.00 10.00 C ATOM 128 C ILE A 9 -9.594 -1.935 -3.920 1.00 10.00 C ATOM 129 O ILE A 9 -10.226 -2.303 -4.912 1.00 10.00 O ATOM 130 CB ILE A 9 -7.797 -0.111 -4.329 1.00 10.00 C ATOM 131 CG1 ILE A 9 -7.697 -0.276 -5.864 1.00 10.00 C ATOM 132 CG2 ILE A 9 -6.644 -0.815 -3.613 1.00 10.00 C ATOM 133 CD1 ILE A 9 -7.264 -1.651 -6.401 1.00 10.00 C ATOM 0 H ILE A 9 -8.506 0.085 -1.856 1.00 10.00 H new ATOM 0 HA ILE A 9 -9.891 0.096 -4.407 1.00 10.00 H new ATOM 0 HB ILE A 9 -7.680 0.950 -4.109 1.00 10.00 H new ATOM 0 HG12 ILE A 9 -8.671 -0.038 -6.293 1.00 10.00 H new ATOM 0 HG13 ILE A 9 -6.994 0.468 -6.238 1.00 10.00 H new ATOM 0 HG21 ILE A 9 -5.698 -0.516 -4.065 1.00 10.00 H new ATOM 0 HG22 ILE A 9 -6.646 -0.537 -2.559 1.00 10.00 H new ATOM 0 HG23 ILE A 9 -6.764 -1.895 -3.704 1.00 10.00 H new ATOM 0 HD11 ILE A 9 -7.237 -1.624 -7.490 1.00 10.00 H new ATOM 0 HD12 ILE A 9 -6.273 -1.895 -6.019 1.00 10.00 H new ATOM 0 HD13 ILE A 9 -7.975 -2.410 -6.075 1.00 10.00 H new ATOM 145 N PHE A 10 -9.362 -2.764 -2.891 1.00 10.00 N ATOM 146 CA PHE A 10 -9.929 -4.107 -2.830 1.00 10.00 C ATOM 147 C PHE A 10 -11.454 -4.050 -2.953 1.00 10.00 C ATOM 148 O PHE A 10 -12.033 -4.685 -3.833 1.00 10.00 O ATOM 149 CB PHE A 10 -9.488 -4.839 -1.558 1.00 10.00 C ATOM 150 CG PHE A 10 -9.931 -6.291 -1.534 1.00 10.00 C ATOM 151 CD1 PHE A 10 -11.232 -6.631 -1.113 1.00 10.00 C ATOM 152 CD2 PHE A 10 -9.043 -7.307 -1.934 1.00 10.00 C ATOM 153 CE1 PHE A 10 -11.650 -7.972 -1.114 1.00 10.00 C ATOM 154 CE2 PHE A 10 -9.454 -8.650 -1.909 1.00 10.00 C ATOM 155 CZ PHE A 10 -10.757 -8.984 -1.504 1.00 10.00 C ATOM 0 H PHE A 10 -8.781 -2.520 -2.089 1.00 10.00 H new ATOM 0 HA PHE A 10 -9.547 -4.680 -3.675 1.00 10.00 H new ATOM 0 HB2 PHE A 10 -8.402 -4.793 -1.475 1.00 10.00 H new ATOM 0 HB3 PHE A 10 -9.896 -4.325 -0.688 1.00 10.00 H new ATOM 0 HD1 PHE A 10 -11.911 -5.857 -0.788 1.00 10.00 H new ATOM 0 HD2 PHE A 10 -8.045 -7.054 -2.260 1.00 10.00 H new ATOM 0 HE1 PHE A 10 -12.657 -8.225 -0.815 1.00 10.00 H new ATOM 0 HE2 PHE A 10 -8.766 -9.429 -2.202 1.00 10.00 H new ATOM 0 HZ PHE A 10 -11.072 -10.017 -1.492 1.00 10.00 H new ATOM 165 N VAL A 11 -12.120 -3.232 -2.133 1.00 10.00 N ATOM 166 CA VAL A 11 -13.575 -3.062 -2.210 1.00 10.00 C ATOM 167 C VAL A 11 -14.056 -2.448 -3.540 1.00 10.00 C ATOM 168 O VAL A 11 -15.241 -2.520 -3.857 1.00 10.00 O ATOM 169 CB VAL A 11 -14.088 -2.312 -0.956 1.00 10.00 C ATOM 170 CG1 VAL A 11 -15.549 -1.841 -1.008 1.00 10.00 C ATOM 171 CG2 VAL A 11 -13.984 -3.241 0.263 1.00 10.00 C ATOM 0 H VAL A 11 -11.673 -2.675 -1.405 1.00 10.00 H new ATOM 0 HA VAL A 11 -14.026 -4.054 -2.210 1.00 10.00 H new ATOM 0 HB VAL A 11 -13.460 -1.423 -0.899 1.00 10.00 H new ATOM 0 HG11 VAL A 11 -15.800 -1.329 -0.079 1.00 10.00 H new ATOM 0 HG12 VAL A 11 -15.681 -1.157 -1.846 1.00 10.00 H new ATOM 0 HG13 VAL A 11 -16.205 -2.702 -1.136 1.00 10.00 H new ATOM 0 HG21 VAL A 11 -14.344 -2.719 1.150 1.00 10.00 H new ATOM 0 HG22 VAL A 11 -14.590 -4.131 0.095 1.00 10.00 H new ATOM 0 HG23 VAL A 11 -12.944 -3.533 0.410 1.00 10.00 H new ATOM 181 N GLN A 12 -13.145 -1.926 -4.368 1.00 10.00 N ATOM 182 CA GLN A 12 -13.457 -1.336 -5.669 1.00 10.00 C ATOM 183 C GLN A 12 -13.521 -2.403 -6.763 1.00 10.00 C ATOM 184 O GLN A 12 -14.452 -2.387 -7.564 1.00 10.00 O ATOM 185 CB GLN A 12 -12.407 -0.274 -6.044 1.00 10.00 C ATOM 186 CG GLN A 12 -12.879 0.695 -7.137 1.00 10.00 C ATOM 187 CD GLN A 12 -13.952 1.653 -6.631 1.00 10.00 C ATOM 188 OE1 GLN A 12 -13.667 2.647 -5.981 1.00 10.00 O ATOM 189 NE2 GLN A 12 -15.216 1.383 -6.902 1.00 10.00 N ATOM 0 H GLN A 12 -12.150 -1.903 -4.145 1.00 10.00 H new ATOM 0 HA GLN A 12 -14.436 -0.864 -5.590 1.00 10.00 H new ATOM 0 HB2 GLN A 12 -12.144 0.296 -5.153 1.00 10.00 H new ATOM 0 HB3 GLN A 12 -11.499 -0.775 -6.381 1.00 10.00 H new ATOM 0 HG2 GLN A 12 -12.028 1.267 -7.506 1.00 10.00 H new ATOM 0 HG3 GLN A 12 -13.270 0.126 -7.981 1.00 10.00 H new ATOM 0 HE21 GLN A 12 -15.455 0.553 -7.445 1.00 10.00 H new ATOM 0 HE22 GLN A 12 -15.953 2.004 -6.569 1.00 10.00 H new ATOM 198 N LYS A 13 -12.507 -3.287 -6.819 1.00 10.00 N ATOM 199 CA LYS A 13 -12.294 -4.217 -7.941 1.00 10.00 C ATOM 200 C LYS A 13 -11.938 -5.663 -7.576 1.00 10.00 C ATOM 201 O LYS A 13 -11.698 -6.481 -8.459 1.00 10.00 O ATOM 202 CB LYS A 13 -11.314 -3.598 -8.941 1.00 10.00 C ATOM 203 CG LYS A 13 -9.900 -3.402 -8.373 1.00 10.00 C ATOM 204 CD LYS A 13 -8.943 -3.013 -9.501 1.00 10.00 C ATOM 205 CE LYS A 13 -9.145 -1.571 -9.967 1.00 10.00 C ATOM 206 NZ LYS A 13 -8.524 -1.335 -11.289 1.00 10.00 N ATOM 0 H LYS A 13 -11.808 -3.375 -6.081 1.00 10.00 H new ATOM 0 HA LYS A 13 -13.272 -4.342 -8.407 1.00 10.00 H new ATOM 0 HB2 LYS A 13 -11.257 -4.235 -9.824 1.00 10.00 H new ATOM 0 HB3 LYS A 13 -11.702 -2.634 -9.268 1.00 10.00 H new ATOM 0 HG2 LYS A 13 -9.909 -2.627 -7.607 1.00 10.00 H new ATOM 0 HG3 LYS A 13 -9.559 -4.320 -7.894 1.00 10.00 H new ATOM 0 HD2 LYS A 13 -7.915 -3.142 -9.162 1.00 10.00 H new ATOM 0 HD3 LYS A 13 -9.087 -3.688 -10.345 1.00 10.00 H new ATOM 0 HE2 LYS A 13 -10.211 -1.351 -10.021 1.00 10.00 H new ATOM 0 HE3 LYS A 13 -8.715 -0.888 -9.235 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 -8.723 -0.362 -11.598 1.00 10.00 H new ATOM 0 HZ2 LYS A 13 -7.495 -1.472 -11.219 1.00 10.00 H new ATOM 0 HZ3 LYS A 13 -8.916 -2.005 -11.981 1.00 10.00 H new ATOM 220 N CYS A 14 -11.944 -5.997 -6.288 1.00 10.00 N ATOM 221 CA CYS A 14 -11.733 -7.343 -5.761 1.00 10.00 C ATOM 222 C CYS A 14 -12.975 -7.851 -5.027 1.00 10.00 C ATOM 223 O CYS A 14 -13.372 -9.007 -5.203 1.00 10.00 O ATOM 224 CB CYS A 14 -10.552 -7.302 -4.796 1.00 10.00 C ATOM 225 SG CYS A 14 -9.002 -6.559 -5.402 1.00 10.00 S ATOM 0 H CYS A 14 -12.103 -5.309 -5.552 1.00 10.00 H new ATOM 0 HA CYS A 14 -11.532 -8.022 -6.590 1.00 10.00 H new ATOM 0 HB2 CYS A 14 -10.863 -6.755 -3.906 1.00 10.00 H new ATOM 0 HB3 CYS A 14 -10.336 -8.324 -4.483 1.00 10.00 H new ATOM 230 N ALA A 15 -13.625 -6.984 -4.232 1.00 10.00 N ATOM 231 CA ALA A 15 -14.837 -7.362 -3.500 1.00 10.00 C ATOM 232 C ALA A 15 -15.962 -7.891 -4.406 1.00 10.00 C ATOM 233 O ALA A 15 -16.720 -8.751 -3.964 1.00 10.00 O ATOM 234 CB ALA A 15 -15.331 -6.210 -2.630 1.00 10.00 C ATOM 0 H ALA A 15 -13.329 -6.019 -4.083 1.00 10.00 H new ATOM 0 HA ALA A 15 -14.553 -8.194 -2.855 1.00 10.00 H new ATOM 0 HB1 ALA A 15 -16.231 -6.516 -2.097 1.00 10.00 H new ATOM 0 HB2 ALA A 15 -14.558 -5.940 -1.911 1.00 10.00 H new ATOM 0 HB3 ALA A 15 -15.557 -5.349 -3.260 1.00 10.00 H new ATOM 240 N GLN A 16 -15.998 -7.468 -5.679 1.00 10.00 N ATOM 241 CA GLN A 16 -16.874 -7.960 -6.744 1.00 10.00 C ATOM 242 C GLN A 16 -16.817 -9.477 -7.004 1.00 10.00 C ATOM 243 O GLN A 16 -17.714 -10.009 -7.653 1.00 10.00 O ATOM 244 CB GLN A 16 -16.543 -7.185 -8.026 1.00 10.00 C ATOM 245 CG GLN A 16 -15.144 -7.476 -8.595 1.00 10.00 C ATOM 246 CD GLN A 16 -14.954 -6.822 -9.959 1.00 10.00 C ATOM 247 OE1 GLN A 16 -14.508 -5.693 -10.076 1.00 10.00 O ATOM 248 NE2 GLN A 16 -15.300 -7.505 -11.033 1.00 10.00 N ATOM 0 H GLN A 16 -15.377 -6.729 -6.008 1.00 10.00 H new ATOM 0 HA GLN A 16 -17.897 -7.787 -6.411 1.00 10.00 H new ATOM 0 HB2 GLN A 16 -17.288 -7.424 -8.784 1.00 10.00 H new ATOM 0 HB3 GLN A 16 -16.626 -6.117 -7.823 1.00 10.00 H new ATOM 0 HG2 GLN A 16 -14.385 -7.109 -7.904 1.00 10.00 H new ATOM 0 HG3 GLN A 16 -15.001 -8.553 -8.683 1.00 10.00 H new ATOM 0 HE21 GLN A 16 -15.673 -8.450 -10.938 1.00 10.00 H new ATOM 0 HE22 GLN A 16 -15.194 -7.089 -11.958 1.00 10.00 H new ATOM 257 N CYS A 17 -15.790 -10.164 -6.489 1.00 10.00 N ATOM 258 CA CYS A 17 -15.550 -11.590 -6.682 1.00 10.00 C ATOM 259 C CYS A 17 -15.003 -12.278 -5.414 1.00 10.00 C ATOM 260 O CYS A 17 -15.036 -13.502 -5.331 1.00 10.00 O ATOM 261 CB CYS A 17 -14.543 -11.752 -7.822 1.00 10.00 C ATOM 262 SG CYS A 17 -15.122 -11.393 -9.512 1.00 10.00 S ATOM 0 H CYS A 17 -15.080 -9.721 -5.906 1.00 10.00 H new ATOM 0 HA CYS A 17 -16.501 -12.067 -6.916 1.00 10.00 H new ATOM 0 HB2 CYS A 17 -13.691 -11.104 -7.613 1.00 10.00 H new ATOM 0 HB3 CYS A 17 -14.175 -12.778 -7.803 1.00 10.00 H new ATOM 267 N HIS A 18 -14.535 -11.519 -4.411 1.00 10.00 N ATOM 268 CA HIS A 18 -13.957 -12.063 -3.183 1.00 10.00 C ATOM 269 C HIS A 18 -14.559 -11.499 -1.877 1.00 10.00 C ATOM 270 O HIS A 18 -14.328 -12.085 -0.827 1.00 10.00 O ATOM 271 CB HIS A 18 -12.445 -11.835 -3.253 1.00 10.00 C ATOM 272 CG HIS A 18 -11.755 -12.552 -4.379 1.00 10.00 C ATOM 273 ND1 HIS A 18 -11.433 -13.882 -4.377 1.00 10.00 N ATOM 274 CD2 HIS A 18 -11.154 -11.979 -5.464 1.00 10.00 C ATOM 275 CE1 HIS A 18 -10.603 -14.090 -5.415 1.00 10.00 C ATOM 276 NE2 HIS A 18 -10.424 -12.976 -6.126 1.00 10.00 N ATOM 0 H HIS A 18 -14.550 -10.499 -4.435 1.00 10.00 H new ATOM 0 HA HIS A 18 -14.200 -13.125 -3.135 1.00 10.00 H new ATOM 0 HB2 HIS A 18 -12.256 -10.766 -3.351 1.00 10.00 H new ATOM 0 HB3 HIS A 18 -11.999 -12.152 -2.310 1.00 10.00 H new ATOM 0 HD1 HIS A 18 -11.761 -14.584 -3.713 1.00 10.00 H new ATOM 0 HD2 HIS A 18 -11.228 -10.943 -5.759 1.00 10.00 H new ATOM 0 HE1 HIS A 18 -10.140 -15.039 -5.644 1.00 10.00 H new ATOM 284 N THR A 19 -15.330 -10.401 -1.931 1.00 10.00 N ATOM 285 CA THR A 19 -16.185 -9.775 -0.892 1.00 10.00 C ATOM 286 C THR A 19 -15.704 -9.708 0.587 1.00 10.00 C ATOM 287 O THR A 19 -16.514 -9.349 1.442 1.00 10.00 O ATOM 288 CB THR A 19 -17.620 -10.332 -1.027 1.00 10.00 C ATOM 289 OG1 THR A 19 -18.502 -9.659 -0.152 1.00 10.00 O ATOM 290 CG2 THR A 19 -17.703 -11.826 -0.733 1.00 10.00 C ATOM 0 H THR A 19 -15.379 -9.866 -2.798 1.00 10.00 H new ATOM 0 HA THR A 19 -16.122 -8.712 -1.126 1.00 10.00 H new ATOM 0 HB THR A 19 -17.909 -10.167 -2.065 1.00 10.00 H new ATOM 0 HG1 THR A 19 -17.985 -9.184 0.532 1.00 10.00 H new ATOM 0 HG21 THR A 19 -18.734 -12.162 -0.843 1.00 10.00 H new ATOM 0 HG22 THR A 19 -17.067 -12.370 -1.432 1.00 10.00 H new ATOM 0 HG23 THR A 19 -17.367 -12.015 0.286 1.00 10.00 H new ATOM 298 N VAL A 20 -14.438 -9.994 0.920 1.00 10.00 N ATOM 299 CA VAL A 20 -13.972 -10.356 2.280 1.00 10.00 C ATOM 300 C VAL A 20 -14.114 -9.283 3.379 1.00 10.00 C ATOM 301 O VAL A 20 -14.105 -9.630 4.556 1.00 10.00 O ATOM 302 CB VAL A 20 -12.519 -10.884 2.198 1.00 10.00 C ATOM 303 CG1 VAL A 20 -11.473 -9.767 2.114 1.00 10.00 C ATOM 304 CG2 VAL A 20 -12.153 -11.811 3.363 1.00 10.00 C ATOM 0 H VAL A 20 -13.682 -9.982 0.236 1.00 10.00 H new ATOM 0 HA VAL A 20 -14.661 -11.132 2.614 1.00 10.00 H new ATOM 0 HB VAL A 20 -12.498 -11.454 1.269 1.00 10.00 H new ATOM 0 HG11 VAL A 20 -10.476 -10.205 2.059 1.00 10.00 H new ATOM 0 HG12 VAL A 20 -11.654 -9.165 1.224 1.00 10.00 H new ATOM 0 HG13 VAL A 20 -11.543 -9.135 3.000 1.00 10.00 H new ATOM 0 HG21 VAL A 20 -11.123 -12.148 3.250 1.00 10.00 H new ATOM 0 HG22 VAL A 20 -12.256 -11.271 4.304 1.00 10.00 H new ATOM 0 HG23 VAL A 20 -12.819 -12.674 3.365 1.00 10.00 H new ATOM 314 N GLU A 21 -14.330 -8.001 3.048 1.00 10.00 N ATOM 315 CA GLU A 21 -14.706 -6.967 4.037 1.00 10.00 C ATOM 316 C GLU A 21 -16.194 -7.073 4.469 1.00 10.00 C ATOM 317 O GLU A 21 -16.702 -6.225 5.202 1.00 10.00 O ATOM 318 CB GLU A 21 -14.316 -5.563 3.517 1.00 10.00 C ATOM 319 CG GLU A 21 -14.160 -4.530 4.659 1.00 10.00 C ATOM 320 CD GLU A 21 -13.581 -3.173 4.232 1.00 10.00 C ATOM 321 OE1 GLU A 21 -12.832 -3.122 3.235 1.00 10.00 O ATOM 322 OE2 GLU A 21 -13.849 -2.167 4.937 1.00 10.00 O ATOM 0 H GLU A 21 -14.251 -7.648 2.094 1.00 10.00 H new ATOM 0 HA GLU A 21 -14.138 -7.143 4.950 1.00 10.00 H new ATOM 0 HB2 GLU A 21 -13.380 -5.631 2.963 1.00 10.00 H new ATOM 0 HB3 GLU A 21 -15.076 -5.214 2.817 1.00 10.00 H new ATOM 0 HG2 GLU A 21 -15.136 -4.364 5.115 1.00 10.00 H new ATOM 0 HG3 GLU A 21 -13.517 -4.956 5.429 1.00 10.00 H new ATOM 329 N LYS A 22 -16.900 -8.126 4.032 1.00 10.00 N ATOM 330 CA LYS A 22 -18.320 -8.441 4.237 1.00 10.00 C ATOM 331 C LYS A 22 -18.479 -9.976 4.185 1.00 10.00 C ATOM 332 O LYS A 22 -17.483 -10.700 4.149 1.00 10.00 O ATOM 333 CB LYS A 22 -19.181 -7.755 3.148 1.00 10.00 C ATOM 334 CG LYS A 22 -19.036 -6.229 3.005 1.00 10.00 C ATOM 335 CD LYS A 22 -19.560 -5.450 4.226 1.00 10.00 C ATOM 336 CE LYS A 22 -18.881 -4.082 4.367 1.00 10.00 C ATOM 337 NZ LYS A 22 -19.112 -3.214 3.190 1.00 10.00 N ATOM 0 H LYS A 22 -16.446 -8.848 3.472 1.00 10.00 H new ATOM 0 HA LYS A 22 -18.659 -8.070 5.204 1.00 10.00 H new ATOM 0 HB2 LYS A 22 -18.939 -8.210 2.188 1.00 10.00 H new ATOM 0 HB3 LYS A 22 -20.228 -7.979 3.352 1.00 10.00 H new ATOM 0 HG2 LYS A 22 -17.985 -5.984 2.850 1.00 10.00 H new ATOM 0 HG3 LYS A 22 -19.574 -5.902 2.116 1.00 10.00 H new ATOM 0 HD2 LYS A 22 -20.637 -5.313 4.134 1.00 10.00 H new ATOM 0 HD3 LYS A 22 -19.389 -6.035 5.130 1.00 10.00 H new ATOM 0 HE2 LYS A 22 -19.255 -3.584 5.261 1.00 10.00 H new ATOM 0 HE3 LYS A 22 -17.809 -4.224 4.506 1.00 10.00 H new ATOM 0 HZ1 LYS A 22 -18.692 -2.278 3.361 1.00 10.00 H new ATOM 0 HZ2 LYS A 22 -18.673 -3.643 2.351 1.00 10.00 H new ATOM 0 HZ3 LYS A 22 -20.134 -3.110 3.031 1.00 10.00 H new ATOM 351 N GLY A 23 -19.712 -10.498 4.211 1.00 10.00 N ATOM 352 CA GLY A 23 -19.992 -11.934 4.156 1.00 10.00 C ATOM 353 C GLY A 23 -19.303 -12.611 2.966 1.00 10.00 C ATOM 354 O GLY A 23 -19.359 -12.114 1.843 1.00 10.00 O ATOM 0 H GLY A 23 -20.553 -9.924 4.272 1.00 10.00 H new ATOM 0 HA2 GLY A 23 -19.659 -12.403 5.082 1.00 10.00 H new ATOM 0 HA3 GLY A 23 -21.069 -12.091 4.088 1.00 10.00 H new ATOM 358 N GLY A 24 -18.669 -13.756 3.205 1.00 10.00 N ATOM 359 CA GLY A 24 -17.763 -14.440 2.273 1.00 10.00 C ATOM 360 C GLY A 24 -18.410 -15.235 1.137 1.00 10.00 C ATOM 361 O GLY A 24 -18.089 -16.406 0.938 1.00 10.00 O ATOM 0 H GLY A 24 -18.773 -14.257 4.088 1.00 10.00 H new ATOM 0 HA2 GLY A 24 -17.103 -13.693 1.831 1.00 10.00 H new ATOM 0 HA3 GLY A 24 -17.135 -15.120 2.848 1.00 10.00 H new ATOM 365 N LYS A 25 -19.279 -14.583 0.364 1.00 10.00 N ATOM 366 CA LYS A 25 -19.840 -15.113 -0.897 1.00 10.00 C ATOM 367 C LYS A 25 -18.721 -15.352 -1.929 1.00 10.00 C ATOM 368 O LYS A 25 -18.389 -14.461 -2.712 1.00 10.00 O ATOM 369 CB LYS A 25 -20.931 -14.224 -1.539 1.00 10.00 C ATOM 370 CG LYS A 25 -22.222 -13.930 -0.747 1.00 10.00 C ATOM 371 CD LYS A 25 -22.143 -12.760 0.245 1.00 10.00 C ATOM 372 CE LYS A 25 -21.746 -11.428 -0.420 1.00 10.00 C ATOM 373 NZ LYS A 25 -21.132 -10.495 0.547 1.00 10.00 N ATOM 0 H LYS A 25 -19.625 -13.652 0.594 1.00 10.00 H new ATOM 0 HA LYS A 25 -20.322 -16.050 -0.618 1.00 10.00 H new ATOM 0 HB2 LYS A 25 -20.472 -13.267 -1.785 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -21.222 -14.690 -2.481 1.00 10.00 H new ATOM 0 HG2 LYS A 25 -23.024 -13.727 -1.457 1.00 10.00 H new ATOM 0 HG3 LYS A 25 -22.503 -14.829 -0.198 1.00 10.00 H new ATOM 0 HD2 LYS A 25 -23.110 -12.641 0.734 1.00 10.00 H new ATOM 0 HD3 LYS A 25 -21.419 -13.000 1.024 1.00 10.00 H new ATOM 0 HE2 LYS A 25 -21.046 -11.622 -1.233 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -22.628 -10.965 -0.862 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -20.368 -9.965 0.081 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -21.853 -9.830 0.894 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 -20.743 -11.032 1.348 1.00 10.00 H new ATOM 387 N HIS A 26 -18.150 -16.558 -1.962 1.00 10.00 N ATOM 388 CA HIS A 26 -17.179 -17.003 -2.971 1.00 10.00 C ATOM 389 C HIS A 26 -17.817 -17.182 -4.369 1.00 10.00 C ATOM 390 O HIS A 26 -17.926 -18.294 -4.900 1.00 10.00 O ATOM 391 CB HIS A 26 -16.457 -18.269 -2.476 1.00 10.00 C ATOM 392 CG HIS A 26 -17.390 -19.320 -1.936 1.00 10.00 C ATOM 393 ND1 HIS A 26 -18.341 -19.984 -2.669 1.00 10.00 N ATOM 394 CD2 HIS A 26 -17.522 -19.696 -0.628 1.00 10.00 C ATOM 395 CE1 HIS A 26 -19.036 -20.763 -1.822 1.00 10.00 C ATOM 396 NE2 HIS A 26 -18.573 -20.615 -0.569 1.00 10.00 N ATOM 0 H HIS A 26 -18.355 -17.276 -1.267 1.00 10.00 H new ATOM 0 HA HIS A 26 -16.433 -16.219 -3.100 1.00 10.00 H new ATOM 0 HB2 HIS A 26 -15.881 -18.694 -3.298 1.00 10.00 H new ATOM 0 HB3 HIS A 26 -15.746 -17.991 -1.698 1.00 10.00 H new ATOM 0 HD1 HIS A 26 -18.493 -19.902 -3.674 1.00 10.00 H new ATOM 0 HD2 HIS A 26 -16.926 -19.348 0.203 1.00 10.00 H new ATOM 0 HE1 HIS A 26 -19.849 -21.414 -2.107 1.00 10.00 H new ATOM 404 N LYS A 27 -18.261 -16.069 -4.965 1.00 10.00 N ATOM 405 CA LYS A 27 -18.792 -15.983 -6.326 1.00 10.00 C ATOM 406 C LYS A 27 -17.647 -15.566 -7.259 1.00 10.00 C ATOM 407 O LYS A 27 -17.108 -14.475 -7.134 1.00 10.00 O ATOM 408 CB LYS A 27 -19.978 -14.989 -6.360 1.00 10.00 C ATOM 409 CG LYS A 27 -20.987 -15.217 -7.507 1.00 10.00 C ATOM 410 CD LYS A 27 -20.319 -15.367 -8.878 1.00 10.00 C ATOM 411 CE LYS A 27 -21.278 -15.392 -10.066 1.00 10.00 C ATOM 412 NZ LYS A 27 -20.530 -15.765 -11.290 1.00 10.00 N ATOM 0 H LYS A 27 -18.259 -15.167 -4.490 1.00 10.00 H new ATOM 0 HA LYS A 27 -19.178 -16.945 -6.664 1.00 10.00 H new ATOM 0 HB2 LYS A 27 -20.510 -15.049 -5.411 1.00 10.00 H new ATOM 0 HB3 LYS A 27 -19.582 -13.977 -6.440 1.00 10.00 H new ATOM 0 HG2 LYS A 27 -21.572 -16.112 -7.295 1.00 10.00 H new ATOM 0 HG3 LYS A 27 -21.685 -14.381 -7.540 1.00 10.00 H new ATOM 0 HD2 LYS A 27 -19.617 -14.545 -9.015 1.00 10.00 H new ATOM 0 HD3 LYS A 27 -19.736 -16.288 -8.882 1.00 10.00 H new ATOM 0 HE2 LYS A 27 -22.081 -16.106 -9.885 1.00 10.00 H new ATOM 0 HE3 LYS A 27 -21.743 -14.414 -10.194 1.00 10.00 H new ATOM 0 HZ1 LYS A 27 -20.829 -15.156 -12.079 1.00 10.00 H new ATOM 0 HZ2 LYS A 27 -19.511 -15.642 -11.125 1.00 10.00 H new ATOM 0 HZ3 LYS A 27 -20.725 -16.759 -11.527 1.00 10.00 H new ATOM 426 N THR A 28 -17.283 -16.428 -8.210 1.00 10.00 N ATOM 427 CA THR A 28 -16.151 -16.303 -9.148 1.00 10.00 C ATOM 428 C THR A 28 -14.751 -16.145 -8.522 1.00 10.00 C ATOM 429 O THR A 28 -13.797 -16.469 -9.218 1.00 10.00 O ATOM 430 CB THR A 28 -16.437 -15.246 -10.246 1.00 10.00 C ATOM 431 OG1 THR A 28 -17.750 -15.403 -10.743 1.00 10.00 O ATOM 432 CG2 THR A 28 -15.563 -15.403 -11.495 1.00 10.00 C ATOM 0 H THR A 28 -17.802 -17.293 -8.361 1.00 10.00 H new ATOM 0 HA THR A 28 -16.090 -17.285 -9.617 1.00 10.00 H new ATOM 0 HB THR A 28 -16.250 -14.290 -9.756 1.00 10.00 H new ATOM 0 HG1 THR A 28 -17.782 -15.116 -11.680 1.00 10.00 H new ATOM 0 HG21 THR A 28 -15.820 -14.629 -12.218 1.00 10.00 H new ATOM 0 HG22 THR A 28 -14.513 -15.307 -11.219 1.00 10.00 H new ATOM 0 HG23 THR A 28 -15.734 -16.384 -11.938 1.00 10.00 H new ATOM 440 N GLY A 29 -14.584 -15.828 -7.228 1.00 10.00 N ATOM 441 CA GLY A 29 -13.310 -15.968 -6.506 1.00 10.00 C ATOM 442 C GLY A 29 -13.454 -16.619 -5.110 1.00 10.00 C ATOM 443 O GLY A 29 -14.465 -16.416 -4.438 1.00 10.00 O ATOM 0 H GLY A 29 -15.339 -15.463 -6.647 1.00 10.00 H new ATOM 0 HA2 GLY A 29 -12.626 -16.567 -7.107 1.00 10.00 H new ATOM 0 HA3 GLY A 29 -12.857 -14.983 -6.393 1.00 10.00 H new ATOM 447 N PRO A 30 -12.450 -17.375 -4.614 1.00 10.00 N ATOM 448 CA PRO A 30 -12.507 -18.074 -3.325 1.00 10.00 C ATOM 449 C PRO A 30 -12.166 -17.146 -2.136 1.00 10.00 C ATOM 450 O PRO A 30 -11.151 -17.340 -1.474 1.00 10.00 O ATOM 451 CB PRO A 30 -11.512 -19.232 -3.460 1.00 10.00 C ATOM 452 CG PRO A 30 -10.435 -18.631 -4.350 1.00 10.00 C ATOM 453 CD PRO A 30 -11.214 -17.726 -5.298 1.00 10.00 C ATOM 0 HA PRO A 30 -13.514 -18.430 -3.106 1.00 10.00 H new ATOM 0 HB2 PRO A 30 -11.115 -19.542 -2.493 1.00 10.00 H new ATOM 0 HB3 PRO A 30 -11.970 -20.111 -3.913 1.00 10.00 H new ATOM 0 HG2 PRO A 30 -9.704 -18.068 -3.770 1.00 10.00 H new ATOM 0 HG3 PRO A 30 -9.887 -19.402 -4.892 1.00 10.00 H new ATOM 0 HD2 PRO A 30 -10.639 -16.833 -5.542 1.00 10.00 H new ATOM 0 HD3 PRO A 30 -11.423 -18.237 -6.238 1.00 10.00 H new ATOM 461 N ASN A 31 -13.040 -16.169 -1.846 1.00 10.00 N ATOM 462 CA ASN A 31 -13.252 -15.427 -0.576 1.00 10.00 C ATOM 463 C ASN A 31 -12.065 -14.814 0.237 1.00 10.00 C ATOM 464 O ASN A 31 -12.330 -14.038 1.148 1.00 10.00 O ATOM 465 CB ASN A 31 -14.127 -16.304 0.342 1.00 10.00 C ATOM 466 CG ASN A 31 -13.337 -17.481 0.887 1.00 10.00 C ATOM 467 OD1 ASN A 31 -12.563 -17.319 1.810 1.00 10.00 O ATOM 468 ND2 ASN A 31 -13.449 -18.666 0.315 1.00 10.00 N ATOM 0 H ASN A 31 -13.686 -15.840 -2.564 1.00 10.00 H new ATOM 0 HA ASN A 31 -13.709 -14.503 -0.932 1.00 10.00 H new ATOM 0 HB2 ASN A 31 -14.508 -15.704 1.168 1.00 10.00 H new ATOM 0 HB3 ASN A 31 -14.992 -16.668 -0.213 1.00 10.00 H new ATOM 0 HD21 ASN A 31 -12.885 -19.448 0.648 1.00 10.00 H new ATOM 0 HD22 ASN A 31 -14.099 -18.799 -0.459 1.00 10.00 H new ATOM 475 N LEU A 32 -10.793 -15.118 -0.047 1.00 10.00 N ATOM 476 CA LEU A 32 -9.566 -14.714 0.665 1.00 10.00 C ATOM 477 C LEU A 32 -9.485 -15.043 2.181 1.00 10.00 C ATOM 478 O LEU A 32 -8.819 -14.353 2.953 1.00 10.00 O ATOM 479 CB LEU A 32 -9.131 -13.278 0.283 1.00 10.00 C ATOM 480 CG LEU A 32 -8.287 -13.228 -1.008 1.00 10.00 C ATOM 481 CD1 LEU A 32 -9.149 -13.169 -2.259 1.00 10.00 C ATOM 482 CD2 LEU A 32 -7.368 -12.008 -1.006 1.00 10.00 C ATOM 0 H LEU A 32 -10.572 -15.705 -0.852 1.00 10.00 H new ATOM 0 HA LEU A 32 -8.801 -15.392 0.287 1.00 10.00 H new ATOM 0 HB2 LEU A 32 -10.018 -12.657 0.155 1.00 10.00 H new ATOM 0 HB3 LEU A 32 -8.556 -12.848 1.103 1.00 10.00 H new ATOM 0 HG LEU A 32 -7.702 -14.148 -1.025 1.00 10.00 H new ATOM 0 HD11 LEU A 32 -8.509 -13.135 -3.141 1.00 10.00 H new ATOM 0 HD12 LEU A 32 -9.784 -14.054 -2.305 1.00 10.00 H new ATOM 0 HD13 LEU A 32 -9.773 -12.276 -2.229 1.00 10.00 H new ATOM 0 HD21 LEU A 32 -6.782 -11.992 -1.925 1.00 10.00 H new ATOM 0 HD22 LEU A 32 -7.968 -11.100 -0.943 1.00 10.00 H new ATOM 0 HD23 LEU A 32 -6.697 -12.059 -0.149 1.00 10.00 H new ATOM 494 N HIS A 33 -10.010 -16.202 2.586 1.00 10.00 N ATOM 495 CA HIS A 33 -9.762 -16.857 3.879 1.00 10.00 C ATOM 496 C HIS A 33 -8.268 -17.045 4.209 1.00 10.00 C ATOM 497 O HIS A 33 -7.606 -17.915 3.644 1.00 10.00 O ATOM 498 CB HIS A 33 -10.438 -18.245 3.881 1.00 10.00 C ATOM 499 CG HIS A 33 -10.252 -19.060 2.610 1.00 10.00 C ATOM 500 ND1 HIS A 33 -9.300 -18.859 1.626 1.00 10.00 N ATOM 501 CD2 HIS A 33 -11.148 -19.976 2.136 1.00 10.00 C ATOM 502 CE1 HIS A 33 -9.668 -19.585 0.554 1.00 10.00 C ATOM 503 NE2 HIS A 33 -10.784 -20.286 0.822 1.00 10.00 N ATOM 0 H HIS A 33 -10.649 -16.736 1.997 1.00 10.00 H new ATOM 0 HA HIS A 33 -10.178 -16.197 4.640 1.00 10.00 H new ATOM 0 HB2 HIS A 33 -10.049 -18.819 4.722 1.00 10.00 H new ATOM 0 HB3 HIS A 33 -11.506 -18.111 4.054 1.00 10.00 H new ATOM 0 HD1 HIS A 33 -8.471 -18.269 1.700 1.00 10.00 H new ATOM 0 HD2 HIS A 33 -11.987 -20.387 2.679 1.00 10.00 H new ATOM 0 HE1 HIS A 33 -9.141 -19.602 -0.389 1.00 10.00 H new ATOM 511 N GLY A 34 -7.745 -16.273 5.172 1.00 10.00 N ATOM 512 CA GLY A 34 -6.519 -16.596 5.916 1.00 10.00 C ATOM 513 C GLY A 34 -5.277 -16.905 5.072 1.00 10.00 C ATOM 514 O GLY A 34 -4.495 -17.774 5.446 1.00 10.00 O ATOM 0 H GLY A 34 -8.169 -15.392 5.461 1.00 10.00 H new ATOM 0 HA2 GLY A 34 -6.287 -15.758 6.574 1.00 10.00 H new ATOM 0 HA3 GLY A 34 -6.722 -17.456 6.554 1.00 10.00 H new ATOM 518 N LEU A 35 -5.112 -16.232 3.928 1.00 10.00 N ATOM 519 CA LEU A 35 -3.900 -16.203 3.098 1.00 10.00 C ATOM 520 C LEU A 35 -2.670 -15.671 3.893 1.00 10.00 C ATOM 521 O LEU A 35 -2.756 -15.433 5.093 1.00 10.00 O ATOM 522 CB LEU A 35 -4.240 -15.384 1.826 1.00 10.00 C ATOM 523 CG LEU A 35 -4.767 -16.208 0.634 1.00 10.00 C ATOM 524 CD1 LEU A 35 -6.209 -16.661 0.851 1.00 10.00 C ATOM 525 CD2 LEU A 35 -4.740 -15.354 -0.631 1.00 10.00 C ATOM 0 H LEU A 35 -5.860 -15.662 3.534 1.00 10.00 H new ATOM 0 HA LEU A 35 -3.599 -17.207 2.797 1.00 10.00 H new ATOM 0 HB2 LEU A 35 -4.986 -14.633 2.086 1.00 10.00 H new ATOM 0 HB3 LEU A 35 -3.345 -14.848 1.509 1.00 10.00 H new ATOM 0 HG LEU A 35 -4.125 -17.083 0.539 1.00 10.00 H new ATOM 0 HD11 LEU A 35 -6.543 -17.238 -0.011 1.00 10.00 H new ATOM 0 HD12 LEU A 35 -6.265 -17.280 1.746 1.00 10.00 H new ATOM 0 HD13 LEU A 35 -6.850 -15.788 0.973 1.00 10.00 H new ATOM 0 HD21 LEU A 35 -5.113 -15.938 -1.472 1.00 10.00 H new ATOM 0 HD22 LEU A 35 -5.371 -14.476 -0.491 1.00 10.00 H new ATOM 0 HD23 LEU A 35 -3.717 -15.037 -0.834 1.00 10.00 H new ATOM 537 N PHE A 36 -1.504 -15.504 3.251 1.00 10.00 N ATOM 538 CA PHE A 36 -0.223 -15.148 3.889 1.00 10.00 C ATOM 539 C PHE A 36 0.236 -16.185 4.925 1.00 10.00 C ATOM 540 O PHE A 36 0.361 -15.924 6.119 1.00 10.00 O ATOM 541 CB PHE A 36 -0.205 -13.692 4.369 1.00 10.00 C ATOM 542 CG PHE A 36 -0.218 -12.709 3.216 1.00 10.00 C ATOM 543 CD1 PHE A 36 -1.437 -12.310 2.639 1.00 10.00 C ATOM 544 CD2 PHE A 36 0.998 -12.260 2.667 1.00 10.00 C ATOM 545 CE1 PHE A 36 -1.439 -11.502 1.490 1.00 10.00 C ATOM 546 CE2 PHE A 36 0.995 -11.419 1.543 1.00 10.00 C ATOM 547 CZ PHE A 36 -0.222 -11.063 0.941 1.00 10.00 C ATOM 0 H PHE A 36 -1.422 -15.616 2.241 1.00 10.00 H new ATOM 0 HA PHE A 36 0.549 -15.194 3.121 1.00 10.00 H new ATOM 0 HB2 PHE A 36 -1.069 -13.511 5.008 1.00 10.00 H new ATOM 0 HB3 PHE A 36 0.683 -13.523 4.978 1.00 10.00 H new ATOM 0 HD1 PHE A 36 -2.372 -12.625 3.079 1.00 10.00 H new ATOM 0 HD2 PHE A 36 1.935 -12.563 3.111 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -2.374 -11.219 1.029 1.00 10.00 H new ATOM 0 HE2 PHE A 36 1.926 -11.047 1.143 1.00 10.00 H new ATOM 0 HZ PHE A 36 -0.223 -10.449 0.052 1.00 10.00 H new ATOM 557 N GLY A 37 0.523 -17.383 4.406 1.00 10.00 N ATOM 558 CA GLY A 37 1.068 -18.538 5.124 1.00 10.00 C ATOM 559 C GLY A 37 0.287 -19.828 4.857 1.00 10.00 C ATOM 560 O GLY A 37 0.880 -20.900 4.757 1.00 10.00 O ATOM 0 H GLY A 37 0.372 -17.583 3.417 1.00 10.00 H new ATOM 0 HA2 GLY A 37 2.109 -18.682 4.833 1.00 10.00 H new ATOM 0 HA3 GLY A 37 1.062 -18.330 6.194 1.00 10.00 H new ATOM 564 N ARG A 38 -1.038 -19.725 4.695 1.00 10.00 N ATOM 565 CA ARG A 38 -1.902 -20.814 4.217 1.00 10.00 C ATOM 566 C ARG A 38 -1.582 -21.151 2.751 1.00 10.00 C ATOM 567 O ARG A 38 -1.148 -20.296 1.974 1.00 10.00 O ATOM 568 CB ARG A 38 -3.361 -20.368 4.419 1.00 10.00 C ATOM 569 CG ARG A 38 -4.472 -21.381 4.077 1.00 10.00 C ATOM 570 CD ARG A 38 -5.861 -20.707 4.006 1.00 10.00 C ATOM 571 NE ARG A 38 -6.450 -20.712 2.646 1.00 10.00 N ATOM 572 CZ ARG A 38 -5.925 -20.239 1.524 1.00 10.00 C ATOM 573 NH1 ARG A 38 -4.792 -19.598 1.511 1.00 10.00 N ATOM 574 NH2 ARG A 38 -6.496 -20.429 0.364 1.00 10.00 N ATOM 0 H ARG A 38 -1.550 -18.866 4.896 1.00 10.00 H new ATOM 0 HA ARG A 38 -1.730 -21.732 4.779 1.00 10.00 H new ATOM 0 HB2 ARG A 38 -3.482 -20.077 5.462 1.00 10.00 H new ATOM 0 HB3 ARG A 38 -3.525 -19.474 3.818 1.00 10.00 H new ATOM 0 HG2 ARG A 38 -4.249 -21.856 3.122 1.00 10.00 H new ATOM 0 HG3 ARG A 38 -4.489 -22.170 4.829 1.00 10.00 H new ATOM 0 HD2 ARG A 38 -6.540 -21.218 4.689 1.00 10.00 H new ATOM 0 HD3 ARG A 38 -5.775 -19.677 4.353 1.00 10.00 H new ATOM 0 HE ARG A 38 -7.376 -21.132 2.563 1.00 10.00 H new ATOM 0 HH11 ARG A 38 -4.281 -19.447 2.381 1.00 10.00 H new ATOM 0 HH12 ARG A 38 -4.415 -19.247 0.631 1.00 10.00 H new ATOM 0 HH21 ARG A 38 -7.369 -20.953 0.305 1.00 10.00 H new ATOM 0 HH22 ARG A 38 -6.069 -20.053 -0.482 1.00 10.00 H new ATOM 588 N LYS A 39 -1.875 -22.399 2.364 1.00 10.00 N ATOM 589 CA LYS A 39 -1.632 -22.966 1.032 1.00 10.00 C ATOM 590 C LYS A 39 -2.434 -22.235 -0.060 1.00 10.00 C ATOM 591 O LYS A 39 -3.258 -21.359 0.212 1.00 10.00 O ATOM 592 CB LYS A 39 -2.038 -24.456 1.013 1.00 10.00 C ATOM 593 CG LYS A 39 -1.530 -25.314 2.182 1.00 10.00 C ATOM 594 CD LYS A 39 -1.906 -26.784 1.927 1.00 10.00 C ATOM 595 CE LYS A 39 -1.794 -27.672 3.172 1.00 10.00 C ATOM 596 NZ LYS A 39 -2.804 -27.307 4.195 1.00 10.00 N ATOM 0 H LYS A 39 -2.307 -23.070 2.999 1.00 10.00 H new ATOM 0 HA LYS A 39 -0.568 -22.850 0.824 1.00 10.00 H new ATOM 0 HB2 LYS A 39 -3.126 -24.514 0.993 1.00 10.00 H new ATOM 0 HB3 LYS A 39 -1.679 -24.897 0.083 1.00 10.00 H new ATOM 0 HG2 LYS A 39 -0.449 -25.214 2.280 1.00 10.00 H new ATOM 0 HG3 LYS A 39 -1.968 -24.971 3.119 1.00 10.00 H new ATOM 0 HD2 LYS A 39 -2.928 -26.829 1.550 1.00 10.00 H new ATOM 0 HD3 LYS A 39 -1.260 -27.185 1.146 1.00 10.00 H new ATOM 0 HE2 LYS A 39 -1.924 -28.716 2.888 1.00 10.00 H new ATOM 0 HE3 LYS A 39 -0.795 -27.579 3.597 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 -3.258 -28.169 4.558 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 -2.339 -26.805 4.978 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 -3.524 -26.690 3.767 1.00 10.00 H new ATOM 610 N THR A 40 -2.254 -22.644 -1.312 1.00 10.00 N ATOM 611 CA THR A 40 -3.243 -22.394 -2.362 1.00 10.00 C ATOM 612 C THR A 40 -4.543 -23.147 -2.040 1.00 10.00 C ATOM 613 O THR A 40 -4.521 -24.178 -1.365 1.00 10.00 O ATOM 614 CB THR A 40 -2.717 -22.879 -3.720 1.00 10.00 C ATOM 615 OG1 THR A 40 -1.316 -22.794 -3.814 1.00 10.00 O ATOM 616 CG2 THR A 40 -3.269 -22.030 -4.859 1.00 10.00 C ATOM 0 H THR A 40 -1.429 -23.153 -1.628 1.00 10.00 H new ATOM 0 HA THR A 40 -3.432 -21.322 -2.408 1.00 10.00 H new ATOM 0 HB THR A 40 -3.041 -23.917 -3.798 1.00 10.00 H new ATOM 0 HG1 THR A 40 -1.027 -23.115 -4.694 1.00 10.00 H new ATOM 0 HG21 THR A 40 -2.879 -22.397 -5.808 1.00 10.00 H new ATOM 0 HG22 THR A 40 -4.357 -22.093 -4.865 1.00 10.00 H new ATOM 0 HG23 THR A 40 -2.966 -20.992 -4.719 1.00 10.00 H new ATOM 624 N GLY A 41 -5.679 -22.691 -2.570 1.00 10.00 N ATOM 625 CA GLY A 41 -6.924 -23.455 -2.509 1.00 10.00 C ATOM 626 C GLY A 41 -7.612 -23.364 -1.148 1.00 10.00 C ATOM 627 O GLY A 41 -8.077 -22.291 -0.768 1.00 10.00 O ATOM 0 H GLY A 41 -5.761 -21.793 -3.048 1.00 10.00 H new ATOM 0 HA2 GLY A 41 -7.605 -23.093 -3.279 1.00 10.00 H new ATOM 0 HA3 GLY A 41 -6.714 -24.500 -2.735 1.00 10.00 H new ATOM 631 N GLN A 42 -7.739 -24.489 -0.432 1.00 10.00 N ATOM 632 CA GLN A 42 -8.491 -24.668 0.830 1.00 10.00 C ATOM 633 C GLN A 42 -9.986 -24.251 0.818 1.00 10.00 C ATOM 634 O GLN A 42 -10.687 -24.531 1.787 1.00 10.00 O ATOM 635 CB GLN A 42 -7.744 -23.988 1.997 1.00 10.00 C ATOM 636 CG GLN A 42 -6.327 -24.522 2.291 1.00 10.00 C ATOM 637 CD GLN A 42 -6.247 -25.912 2.934 1.00 10.00 C ATOM 638 OE1 GLN A 42 -5.164 -26.457 3.123 1.00 10.00 O ATOM 639 NE2 GLN A 42 -7.345 -26.528 3.333 1.00 10.00 N ATOM 0 H GLN A 42 -7.294 -25.356 -0.732 1.00 10.00 H new ATOM 0 HA GLN A 42 -8.529 -25.749 0.966 1.00 10.00 H new ATOM 0 HB2 GLN A 42 -7.673 -22.921 1.785 1.00 10.00 H new ATOM 0 HB3 GLN A 42 -8.346 -24.094 2.899 1.00 10.00 H new ATOM 0 HG2 GLN A 42 -5.769 -24.545 1.355 1.00 10.00 H new ATOM 0 HG3 GLN A 42 -5.822 -23.812 2.946 1.00 10.00 H new ATOM 0 HE21 GLN A 42 -8.256 -26.093 3.186 1.00 10.00 H new ATOM 0 HE22 GLN A 42 -7.282 -27.439 3.788 1.00 10.00 H new ATOM 648 N ALA A 43 -10.472 -23.624 -0.258 1.00 10.00 N ATOM 649 CA ALA A 43 -11.845 -23.201 -0.516 1.00 10.00 C ATOM 650 C ALA A 43 -12.865 -24.362 -0.459 1.00 10.00 C ATOM 651 O ALA A 43 -12.502 -25.516 -0.700 1.00 10.00 O ATOM 652 CB ALA A 43 -11.849 -22.560 -1.910 1.00 10.00 C ATOM 0 H ALA A 43 -9.859 -23.380 -1.036 1.00 10.00 H new ATOM 0 HA ALA A 43 -12.157 -22.504 0.262 1.00 10.00 H new ATOM 0 HB1 ALA A 43 -12.857 -22.225 -2.153 1.00 10.00 H new ATOM 0 HB2 ALA A 43 -11.170 -21.707 -1.920 1.00 10.00 H new ATOM 0 HB3 ALA A 43 -11.522 -23.292 -2.648 1.00 10.00 H new ATOM 658 N PRO A 44 -14.162 -24.060 -0.242 1.00 10.00 N ATOM 659 CA PRO A 44 -15.259 -24.981 -0.542 1.00 10.00 C ATOM 660 C PRO A 44 -15.431 -25.159 -2.066 1.00 10.00 C ATOM 661 O PRO A 44 -14.656 -24.617 -2.854 1.00 10.00 O ATOM 662 CB PRO A 44 -16.484 -24.353 0.134 1.00 10.00 C ATOM 663 CG PRO A 44 -16.201 -22.858 0.024 1.00 10.00 C ATOM 664 CD PRO A 44 -14.688 -22.775 0.203 1.00 10.00 C ATOM 0 HA PRO A 44 -15.084 -25.990 -0.169 1.00 10.00 H new ATOM 0 HB2 PRO A 44 -17.410 -24.628 -0.371 1.00 10.00 H new ATOM 0 HB3 PRO A 44 -16.581 -24.671 1.172 1.00 10.00 H new ATOM 0 HG2 PRO A 44 -16.515 -22.459 -0.941 1.00 10.00 H new ATOM 0 HG3 PRO A 44 -16.729 -22.291 0.791 1.00 10.00 H new ATOM 0 HD2 PRO A 44 -14.270 -21.957 -0.384 1.00 10.00 H new ATOM 0 HD3 PRO A 44 -14.428 -22.586 1.244 1.00 10.00 H new ATOM 672 N GLY A 45 -16.465 -25.902 -2.491 1.00 10.00 N ATOM 673 CA GLY A 45 -16.761 -26.321 -3.874 1.00 10.00 C ATOM 674 C GLY A 45 -17.057 -25.224 -4.915 1.00 10.00 C ATOM 675 O GLY A 45 -17.778 -25.479 -5.877 1.00 10.00 O ATOM 0 H GLY A 45 -17.164 -26.250 -1.835 1.00 10.00 H new ATOM 0 HA2 GLY A 45 -15.913 -26.904 -4.235 1.00 10.00 H new ATOM 0 HA3 GLY A 45 -17.619 -26.992 -3.843 1.00 10.00 H new ATOM 679 N PHE A 46 -16.510 -24.019 -4.748 1.00 10.00 N ATOM 680 CA PHE A 46 -16.451 -22.959 -5.750 1.00 10.00 C ATOM 681 C PHE A 46 -15.580 -23.417 -6.943 1.00 10.00 C ATOM 682 O PHE A 46 -14.457 -23.885 -6.765 1.00 10.00 O ATOM 683 CB PHE A 46 -15.926 -21.678 -5.062 1.00 10.00 C ATOM 684 CG PHE A 46 -14.984 -20.853 -5.910 1.00 10.00 C ATOM 685 CD1 PHE A 46 -15.488 -19.984 -6.887 1.00 10.00 C ATOM 686 CD2 PHE A 46 -13.599 -21.044 -5.793 1.00 10.00 C ATOM 687 CE1 PHE A 46 -14.611 -19.369 -7.793 1.00 10.00 C ATOM 688 CE2 PHE A 46 -12.720 -20.381 -6.665 1.00 10.00 C ATOM 689 CZ PHE A 46 -13.226 -19.554 -7.679 1.00 10.00 C ATOM 0 H PHE A 46 -16.076 -23.745 -3.867 1.00 10.00 H new ATOM 0 HA PHE A 46 -17.436 -22.738 -6.161 1.00 10.00 H new ATOM 0 HB2 PHE A 46 -16.777 -21.058 -4.778 1.00 10.00 H new ATOM 0 HB3 PHE A 46 -15.415 -21.959 -4.141 1.00 10.00 H new ATOM 0 HD1 PHE A 46 -16.549 -19.788 -6.942 1.00 10.00 H new ATOM 0 HD2 PHE A 46 -13.208 -21.702 -5.031 1.00 10.00 H new ATOM 0 HE1 PHE A 46 -15.006 -18.749 -8.584 1.00 10.00 H new ATOM 0 HE2 PHE A 46 -11.653 -20.508 -6.555 1.00 10.00 H new ATOM 0 HZ PHE A 46 -12.553 -19.063 -8.367 1.00 10.00 H new ATOM 699 N THR A 47 -16.110 -23.309 -8.167 1.00 10.00 N ATOM 700 CA THR A 47 -15.466 -23.805 -9.393 1.00 10.00 C ATOM 701 C THR A 47 -14.278 -22.934 -9.826 1.00 10.00 C ATOM 702 O THR A 47 -14.433 -21.734 -10.065 1.00 10.00 O ATOM 703 CB THR A 47 -16.492 -23.887 -10.537 1.00 10.00 C ATOM 704 OG1 THR A 47 -17.673 -24.515 -10.088 1.00 10.00 O ATOM 705 CG2 THR A 47 -15.966 -24.703 -11.720 1.00 10.00 C ATOM 0 H THR A 47 -17.013 -22.867 -8.338 1.00 10.00 H new ATOM 0 HA THR A 47 -15.080 -24.799 -9.169 1.00 10.00 H new ATOM 0 HB THR A 47 -16.684 -22.863 -10.857 1.00 10.00 H new ATOM 0 HG1 THR A 47 -18.319 -24.560 -10.823 1.00 10.00 H new ATOM 0 HG21 THR A 47 -16.722 -24.735 -12.505 1.00 10.00 H new ATOM 0 HG22 THR A 47 -15.060 -24.238 -12.108 1.00 10.00 H new ATOM 0 HG23 THR A 47 -15.741 -25.718 -11.391 1.00 10.00 H new ATOM 713 N TYR A 48 -13.107 -23.556 -9.995 1.00 10.00 N ATOM 714 CA TYR A 48 -11.822 -22.926 -10.317 1.00 10.00 C ATOM 715 C TYR A 48 -11.000 -23.744 -11.332 1.00 10.00 C ATOM 716 O TYR A 48 -11.428 -24.827 -11.719 1.00 10.00 O ATOM 717 CB TYR A 48 -11.069 -22.725 -8.998 1.00 10.00 C ATOM 718 CG TYR A 48 -10.912 -23.921 -8.057 1.00 10.00 C ATOM 719 CD1 TYR A 48 -10.391 -25.162 -8.488 1.00 10.00 C ATOM 720 CD2 TYR A 48 -11.219 -23.753 -6.691 1.00 10.00 C ATOM 721 CE1 TYR A 48 -10.105 -26.178 -7.556 1.00 10.00 C ATOM 722 CE2 TYR A 48 -10.930 -24.761 -5.754 1.00 10.00 C ATOM 723 CZ TYR A 48 -10.336 -25.965 -6.182 1.00 10.00 C ATOM 724 OH TYR A 48 -9.927 -26.883 -5.267 1.00 10.00 O ATOM 0 H TYR A 48 -13.025 -24.569 -9.906 1.00 10.00 H new ATOM 0 HA TYR A 48 -11.994 -21.967 -10.805 1.00 10.00 H new ATOM 0 HB2 TYR A 48 -10.071 -22.359 -9.239 1.00 10.00 H new ATOM 0 HB3 TYR A 48 -11.574 -21.933 -8.445 1.00 10.00 H new ATOM 0 HD1 TYR A 48 -10.211 -25.332 -9.539 1.00 10.00 H new ATOM 0 HD2 TYR A 48 -11.683 -22.836 -6.359 1.00 10.00 H new ATOM 0 HE1 TYR A 48 -9.707 -27.123 -7.895 1.00 10.00 H new ATOM 0 HE2 TYR A 48 -11.163 -24.613 -4.710 1.00 10.00 H new ATOM 0 HH TYR A 48 -10.166 -26.577 -4.367 1.00 10.00 H new ATOM 734 N THR A 49 -9.813 -23.268 -11.750 1.00 10.00 N ATOM 735 CA THR A 49 -8.840 -24.115 -12.474 1.00 10.00 C ATOM 736 C THR A 49 -7.952 -24.891 -11.490 1.00 10.00 C ATOM 737 O THR A 49 -7.081 -24.299 -10.842 1.00 10.00 O ATOM 738 CB THR A 49 -7.991 -23.334 -13.496 1.00 10.00 C ATOM 739 OG1 THR A 49 -7.034 -22.511 -12.875 1.00 10.00 O ATOM 740 CG2 THR A 49 -8.840 -22.459 -14.421 1.00 10.00 C ATOM 0 H THR A 49 -9.503 -22.308 -11.601 1.00 10.00 H new ATOM 0 HA THR A 49 -9.426 -24.828 -13.054 1.00 10.00 H new ATOM 0 HB THR A 49 -7.489 -24.101 -14.086 1.00 10.00 H new ATOM 0 HG1 THR A 49 -6.822 -22.868 -11.987 1.00 10.00 H new ATOM 0 HG21 THR A 49 -8.191 -21.932 -15.120 1.00 10.00 H new ATOM 0 HG22 THR A 49 -9.538 -23.086 -14.976 1.00 10.00 H new ATOM 0 HG23 THR A 49 -9.397 -21.735 -13.827 1.00 10.00 H new ATOM 748 N ASP A 50 -8.176 -26.199 -11.345 1.00 10.00 N ATOM 749 CA ASP A 50 -7.599 -27.063 -10.304 1.00 10.00 C ATOM 750 C ASP A 50 -6.066 -27.084 -10.225 1.00 10.00 C ATOM 751 O ASP A 50 -5.527 -27.291 -9.135 1.00 10.00 O ATOM 752 CB ASP A 50 -8.105 -28.494 -10.523 1.00 10.00 C ATOM 753 CG ASP A 50 -9.630 -28.547 -10.529 1.00 10.00 C ATOM 754 OD1 ASP A 50 -10.191 -28.100 -11.555 1.00 10.00 O ATOM 755 OD2 ASP A 50 -10.189 -28.960 -9.491 1.00 10.00 O ATOM 0 H ASP A 50 -8.792 -26.711 -11.977 1.00 10.00 H new ATOM 0 HA ASP A 50 -7.927 -26.637 -9.356 1.00 10.00 H new ATOM 0 HB2 ASP A 50 -7.722 -28.877 -11.469 1.00 10.00 H new ATOM 0 HB3 ASP A 50 -7.719 -29.143 -9.737 1.00 10.00 H new ATOM 760 N ALA A 51 -5.373 -26.872 -11.351 1.00 10.00 N ATOM 761 CA ALA A 51 -3.916 -26.933 -11.460 1.00 10.00 C ATOM 762 C ALA A 51 -3.221 -26.024 -10.434 1.00 10.00 C ATOM 763 O ALA A 51 -2.429 -26.506 -9.629 1.00 10.00 O ATOM 764 CB ALA A 51 -3.512 -26.597 -12.901 1.00 10.00 C ATOM 0 H ALA A 51 -5.827 -26.647 -12.236 1.00 10.00 H new ATOM 0 HA ALA A 51 -3.583 -27.944 -11.226 1.00 10.00 H new ATOM 0 HB1 ALA A 51 -2.427 -26.639 -12.994 1.00 10.00 H new ATOM 0 HB2 ALA A 51 -3.963 -27.318 -13.583 1.00 10.00 H new ATOM 0 HB3 ALA A 51 -3.859 -25.594 -13.152 1.00 10.00 H new ATOM 770 N ASN A 52 -3.571 -24.730 -10.424 1.00 10.00 N ATOM 771 CA ASN A 52 -3.113 -23.726 -9.458 1.00 10.00 C ATOM 772 C ASN A 52 -3.220 -24.235 -8.010 1.00 10.00 C ATOM 773 O ASN A 52 -2.213 -24.288 -7.305 1.00 10.00 O ATOM 774 CB ASN A 52 -3.919 -22.433 -9.722 1.00 10.00 C ATOM 775 CG ASN A 52 -3.665 -21.296 -8.728 1.00 10.00 C ATOM 776 OD1 ASN A 52 -2.703 -21.281 -7.983 1.00 10.00 O ATOM 777 ND2 ASN A 52 -4.520 -20.295 -8.695 1.00 10.00 N ATOM 0 H ASN A 52 -4.208 -24.340 -11.119 1.00 10.00 H new ATOM 0 HA ASN A 52 -2.052 -23.515 -9.589 1.00 10.00 H new ATOM 0 HB2 ASN A 52 -3.686 -22.077 -10.725 1.00 10.00 H new ATOM 0 HB3 ASN A 52 -4.981 -22.676 -9.709 1.00 10.00 H new ATOM 0 HD21 ASN A 52 -4.372 -19.519 -8.050 1.00 10.00 H new ATOM 0 HD22 ASN A 52 -5.330 -20.296 -9.314 1.00 10.00 H new ATOM 784 N LYS A 53 -4.423 -24.659 -7.588 1.00 10.00 N ATOM 785 CA LYS A 53 -4.676 -25.166 -6.233 1.00 10.00 C ATOM 786 C LYS A 53 -3.765 -26.342 -5.914 1.00 10.00 C ATOM 787 O LYS A 53 -3.010 -26.291 -4.945 1.00 10.00 O ATOM 788 CB LYS A 53 -6.148 -25.538 -6.006 1.00 10.00 C ATOM 789 CG LYS A 53 -7.038 -24.324 -5.701 1.00 10.00 C ATOM 790 CD LYS A 53 -7.710 -23.703 -6.918 1.00 10.00 C ATOM 791 CE LYS A 53 -6.910 -22.587 -7.575 1.00 10.00 C ATOM 792 NZ LYS A 53 -7.440 -22.367 -8.931 1.00 10.00 N ATOM 0 H LYS A 53 -5.251 -24.659 -8.183 1.00 10.00 H new ATOM 0 HA LYS A 53 -4.448 -24.351 -5.546 1.00 10.00 H new ATOM 0 HB2 LYS A 53 -6.529 -26.046 -6.892 1.00 10.00 H new ATOM 0 HB3 LYS A 53 -6.214 -26.246 -5.180 1.00 10.00 H new ATOM 0 HG2 LYS A 53 -7.809 -24.626 -4.992 1.00 10.00 H new ATOM 0 HG3 LYS A 53 -6.433 -23.562 -5.209 1.00 10.00 H new ATOM 0 HD2 LYS A 53 -7.894 -24.485 -7.655 1.00 10.00 H new ATOM 0 HD3 LYS A 53 -8.682 -23.310 -6.621 1.00 10.00 H new ATOM 0 HE2 LYS A 53 -6.983 -21.672 -6.987 1.00 10.00 H new ATOM 0 HE3 LYS A 53 -5.854 -22.854 -7.620 1.00 10.00 H new ATOM 0 HZ1 LYS A 53 -6.822 -21.705 -9.442 1.00 10.00 H new ATOM 0 HZ2 LYS A 53 -7.475 -23.273 -9.441 1.00 10.00 H new ATOM 0 HZ3 LYS A 53 -8.398 -21.968 -8.869 1.00 10.00 H new ATOM 806 N ASN A 54 -3.824 -27.392 -6.736 1.00 10.00 N ATOM 807 CA ASN A 54 -3.082 -28.616 -6.505 1.00 10.00 C ATOM 808 C ASN A 54 -1.554 -28.434 -6.593 1.00 10.00 C ATOM 809 O ASN A 54 -0.820 -29.217 -5.994 1.00 10.00 O ATOM 810 CB ASN A 54 -3.589 -29.668 -7.500 1.00 10.00 C ATOM 811 CG ASN A 54 -4.972 -30.187 -7.137 1.00 10.00 C ATOM 812 OD1 ASN A 54 -5.122 -31.129 -6.380 1.00 10.00 O ATOM 813 ND2 ASN A 54 -6.020 -29.586 -7.659 1.00 10.00 N ATOM 0 H ASN A 54 -4.393 -27.409 -7.582 1.00 10.00 H new ATOM 0 HA ASN A 54 -3.259 -28.944 -5.481 1.00 10.00 H new ATOM 0 HB2 ASN A 54 -3.617 -29.235 -8.500 1.00 10.00 H new ATOM 0 HB3 ASN A 54 -2.888 -30.502 -7.533 1.00 10.00 H new ATOM 0 HD21 ASN A 54 -6.960 -29.909 -7.430 1.00 10.00 H new ATOM 0 HD22 ASN A 54 -5.892 -28.797 -8.293 1.00 10.00 H new ATOM 820 N LYS A 55 -1.057 -27.396 -7.290 1.00 10.00 N ATOM 821 CA LYS A 55 0.363 -27.018 -7.288 1.00 10.00 C ATOM 822 C LYS A 55 0.847 -26.520 -5.915 1.00 10.00 C ATOM 823 O LYS A 55 2.044 -26.578 -5.656 1.00 10.00 O ATOM 824 CB LYS A 55 0.620 -25.984 -8.407 1.00 10.00 C ATOM 825 CG LYS A 55 2.089 -25.798 -8.840 1.00 10.00 C ATOM 826 CD LYS A 55 2.597 -26.800 -9.891 1.00 10.00 C ATOM 827 CE LYS A 55 2.728 -28.225 -9.343 1.00 10.00 C ATOM 828 NZ LYS A 55 3.421 -29.118 -10.302 1.00 10.00 N ATOM 0 H LYS A 55 -1.636 -26.793 -7.874 1.00 10.00 H new ATOM 0 HA LYS A 55 0.953 -27.912 -7.491 1.00 10.00 H new ATOM 0 HB2 LYS A 55 0.039 -26.275 -9.282 1.00 10.00 H new ATOM 0 HB3 LYS A 55 0.236 -25.019 -8.076 1.00 10.00 H new ATOM 0 HG2 LYS A 55 2.209 -24.790 -9.236 1.00 10.00 H new ATOM 0 HG3 LYS A 55 2.723 -25.871 -7.956 1.00 10.00 H new ATOM 0 HD2 LYS A 55 1.915 -26.804 -10.741 1.00 10.00 H new ATOM 0 HD3 LYS A 55 3.567 -26.469 -10.263 1.00 10.00 H new ATOM 0 HE2 LYS A 55 3.278 -28.204 -8.402 1.00 10.00 H new ATOM 0 HE3 LYS A 55 1.737 -28.624 -9.125 1.00 10.00 H new ATOM 0 HZ1 LYS A 55 3.492 -30.074 -9.898 1.00 10.00 H new ATOM 0 HZ2 LYS A 55 2.883 -29.157 -11.191 1.00 10.00 H new ATOM 0 HZ3 LYS A 55 4.375 -28.751 -10.491 1.00 10.00 H new ATOM 842 N GLY A 56 -0.055 -26.072 -5.028 1.00 10.00 N ATOM 843 CA GLY A 56 0.227 -25.872 -3.597 1.00 10.00 C ATOM 844 C GLY A 56 1.184 -24.722 -3.252 1.00 10.00 C ATOM 845 O GLY A 56 1.616 -24.614 -2.103 1.00 10.00 O ATOM 0 H GLY A 56 -1.013 -25.835 -5.287 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -0.718 -25.698 -3.082 1.00 10.00 H new ATOM 0 HA3 GLY A 56 0.643 -26.797 -3.197 1.00 10.00 H new ATOM 849 N ILE A 57 1.492 -23.858 -4.228 1.00 10.00 N ATOM 850 CA ILE A 57 2.503 -22.787 -4.223 1.00 10.00 C ATOM 851 C ILE A 57 2.462 -21.784 -3.054 1.00 10.00 C ATOM 852 O ILE A 57 3.417 -21.034 -2.908 1.00 10.00 O ATOM 853 CB ILE A 57 2.535 -22.061 -5.589 1.00 10.00 C ATOM 854 CG1 ILE A 57 1.184 -21.516 -6.104 1.00 10.00 C ATOM 855 CG2 ILE A 57 3.110 -23.001 -6.660 1.00 10.00 C ATOM 856 CD1 ILE A 57 0.568 -20.410 -5.245 1.00 10.00 C ATOM 0 H ILE A 57 0.998 -23.892 -5.120 1.00 10.00 H new ATOM 0 HA ILE A 57 3.439 -23.318 -4.051 1.00 10.00 H new ATOM 0 HB ILE A 57 3.161 -21.186 -5.412 1.00 10.00 H new ATOM 0 HG12 ILE A 57 1.324 -21.135 -7.116 1.00 10.00 H new ATOM 0 HG13 ILE A 57 0.476 -22.342 -6.169 1.00 10.00 H new ATOM 0 HG21 ILE A 57 3.132 -22.487 -7.621 1.00 10.00 H new ATOM 0 HG22 ILE A 57 4.123 -23.293 -6.382 1.00 10.00 H new ATOM 0 HG23 ILE A 57 2.484 -23.890 -6.738 1.00 10.00 H new ATOM 0 HD11 ILE A 57 -0.377 -20.091 -5.685 1.00 10.00 H new ATOM 0 HD12 ILE A 57 0.390 -20.788 -4.238 1.00 10.00 H new ATOM 0 HD13 ILE A 57 1.251 -19.562 -5.199 1.00 10.00 H new ATOM 868 N THR A 58 1.449 -21.851 -2.180 1.00 10.00 N ATOM 869 CA THR A 58 1.287 -21.135 -0.902 1.00 10.00 C ATOM 870 C THR A 58 1.309 -19.602 -0.991 1.00 10.00 C ATOM 871 O THR A 58 2.267 -18.956 -1.416 1.00 10.00 O ATOM 872 CB THR A 58 2.311 -21.686 0.107 1.00 10.00 C ATOM 873 OG1 THR A 58 2.075 -23.077 0.245 1.00 10.00 O ATOM 874 CG2 THR A 58 2.190 -21.079 1.506 1.00 10.00 C ATOM 0 H THR A 58 0.651 -22.460 -2.363 1.00 10.00 H new ATOM 0 HA THR A 58 0.273 -21.334 -0.555 1.00 10.00 H new ATOM 0 HB THR A 58 3.300 -21.440 -0.280 1.00 10.00 H new ATOM 0 HG1 THR A 58 2.091 -23.501 -0.638 1.00 10.00 H new ATOM 0 HG21 THR A 58 2.945 -21.517 2.159 1.00 10.00 H new ATOM 0 HG22 THR A 58 2.341 -20.001 1.449 1.00 10.00 H new ATOM 0 HG23 THR A 58 1.198 -21.286 1.908 1.00 10.00 H new ATOM 882 N TRP A 59 0.181 -19.000 -0.600 1.00 10.00 N ATOM 883 CA TRP A 59 -0.030 -17.561 -0.695 1.00 10.00 C ATOM 884 C TRP A 59 0.713 -16.788 0.383 1.00 10.00 C ATOM 885 O TRP A 59 0.491 -17.007 1.574 1.00 10.00 O ATOM 886 CB TRP A 59 -1.519 -17.238 -0.718 1.00 10.00 C ATOM 887 CG TRP A 59 -2.175 -17.703 -1.977 1.00 10.00 C ATOM 888 CD1 TRP A 59 -3.283 -18.468 -2.055 1.00 10.00 C ATOM 889 CD2 TRP A 59 -1.734 -17.495 -3.357 1.00 10.00 C ATOM 890 NE1 TRP A 59 -3.542 -18.763 -3.376 1.00 10.00 N ATOM 891 CE2 TRP A 59 -2.609 -18.214 -4.222 1.00 10.00 C ATOM 892 CE3 TRP A 59 -0.672 -16.793 -3.966 1.00 10.00 C ATOM 893 CZ2 TRP A 59 -2.434 -18.262 -5.611 1.00 10.00 C ATOM 894 CZ3 TRP A 59 -0.450 -16.879 -5.346 1.00 10.00 C ATOM 895 CH2 TRP A 59 -1.327 -17.606 -6.170 1.00 10.00 C ATOM 0 H TRP A 59 -0.613 -19.505 -0.207 1.00 10.00 H new ATOM 0 HA TRP A 59 0.398 -17.228 -1.641 1.00 10.00 H new ATOM 0 HB2 TRP A 59 -2.005 -17.707 0.138 1.00 10.00 H new ATOM 0 HB3 TRP A 59 -1.658 -16.162 -0.613 1.00 10.00 H new ATOM 0 HD1 TRP A 59 -3.875 -18.798 -1.214 1.00 10.00 H new ATOM 0 HE1 TRP A 59 -4.334 -19.324 -3.689 1.00 10.00 H new ATOM 0 HE3 TRP A 59 -0.021 -16.181 -3.359 1.00 10.00 H new ATOM 0 HZ2 TRP A 59 -3.136 -18.792 -6.238 1.00 10.00 H new ATOM 0 HZ3 TRP A 59 0.404 -16.382 -5.782 1.00 10.00 H new ATOM 0 HH2 TRP A 59 -1.148 -17.659 -7.234 1.00 10.00 H new ATOM 906 N LYS A 60 1.595 -15.888 -0.065 1.00 10.00 N ATOM 907 CA LYS A 60 2.494 -15.057 0.733 1.00 10.00 C ATOM 908 C LYS A 60 3.113 -13.945 -0.131 1.00 10.00 C ATOM 909 O LYS A 60 2.833 -13.854 -1.325 1.00 10.00 O ATOM 910 CB LYS A 60 3.552 -15.956 1.397 1.00 10.00 C ATOM 911 CG LYS A 60 4.417 -16.775 0.419 1.00 10.00 C ATOM 912 CD LYS A 60 5.912 -16.557 0.659 1.00 10.00 C ATOM 913 CE LYS A 60 6.360 -16.967 2.069 1.00 10.00 C ATOM 914 NZ LYS A 60 7.154 -15.889 2.709 1.00 10.00 N ATOM 0 H LYS A 60 1.705 -15.711 -1.064 1.00 10.00 H new ATOM 0 HA LYS A 60 1.938 -14.554 1.524 1.00 10.00 H new ATOM 0 HB2 LYS A 60 4.208 -15.332 2.004 1.00 10.00 H new ATOM 0 HB3 LYS A 60 3.048 -16.644 2.076 1.00 10.00 H new ATOM 0 HG2 LYS A 60 4.183 -17.834 0.527 1.00 10.00 H new ATOM 0 HG3 LYS A 60 4.169 -16.496 -0.605 1.00 10.00 H new ATOM 0 HD2 LYS A 60 6.479 -17.127 -0.077 1.00 10.00 H new ATOM 0 HD3 LYS A 60 6.150 -15.505 0.500 1.00 10.00 H new ATOM 0 HE2 LYS A 60 5.487 -17.192 2.681 1.00 10.00 H new ATOM 0 HE3 LYS A 60 6.955 -17.879 2.015 1.00 10.00 H new ATOM 0 HZ1 LYS A 60 7.330 -16.132 3.705 1.00 10.00 H new ATOM 0 HZ2 LYS A 60 8.062 -15.785 2.213 1.00 10.00 H new ATOM 0 HZ3 LYS A 60 6.628 -14.993 2.659 1.00 10.00 H new ATOM 928 N GLU A 61 3.947 -13.093 0.468 1.00 10.00 N ATOM 929 CA GLU A 61 4.454 -11.842 -0.123 1.00 10.00 C ATOM 930 C GLU A 61 5.444 -12.033 -1.281 1.00 10.00 C ATOM 931 O GLU A 61 5.714 -11.101 -2.020 1.00 10.00 O ATOM 932 CB GLU A 61 5.067 -11.021 1.023 1.00 10.00 C ATOM 933 CG GLU A 61 4.889 -9.502 0.913 1.00 10.00 C ATOM 934 CD GLU A 61 4.628 -8.951 2.317 1.00 10.00 C ATOM 935 OE1 GLU A 61 5.596 -8.695 3.065 1.00 10.00 O ATOM 936 OE2 GLU A 61 3.453 -8.982 2.751 1.00 10.00 O ATOM 0 H GLU A 61 4.303 -13.256 1.410 1.00 10.00 H new ATOM 0 HA GLU A 61 3.620 -11.318 -0.591 1.00 10.00 H new ATOM 0 HB2 GLU A 61 4.626 -11.354 1.962 1.00 10.00 H new ATOM 0 HB3 GLU A 61 6.133 -11.242 1.076 1.00 10.00 H new ATOM 0 HG2 GLU A 61 5.780 -9.044 0.484 1.00 10.00 H new ATOM 0 HG3 GLU A 61 4.058 -9.263 0.250 1.00 10.00 H new ATOM 943 N GLU A 62 5.966 -13.240 -1.482 1.00 10.00 N ATOM 944 CA GLU A 62 6.623 -13.637 -2.732 1.00 10.00 C ATOM 945 C GLU A 62 5.593 -13.943 -3.836 1.00 10.00 C ATOM 946 O GLU A 62 5.590 -13.357 -4.919 1.00 10.00 O ATOM 947 CB GLU A 62 7.532 -14.847 -2.451 1.00 10.00 C ATOM 948 CG GLU A 62 8.705 -14.508 -1.506 1.00 10.00 C ATOM 949 CD GLU A 62 8.921 -15.591 -0.443 1.00 10.00 C ATOM 950 OE1 GLU A 62 9.080 -16.771 -0.822 1.00 10.00 O ATOM 951 OE2 GLU A 62 8.844 -15.249 0.761 1.00 10.00 O ATOM 0 H GLU A 62 5.947 -13.979 -0.779 1.00 10.00 H new ATOM 0 HA GLU A 62 7.231 -12.811 -3.100 1.00 10.00 H new ATOM 0 HB2 GLU A 62 6.937 -15.648 -2.012 1.00 10.00 H new ATOM 0 HB3 GLU A 62 7.928 -15.224 -3.394 1.00 10.00 H new ATOM 0 HG2 GLU A 62 9.617 -14.387 -2.090 1.00 10.00 H new ATOM 0 HG3 GLU A 62 8.511 -13.554 -1.016 1.00 10.00 H new ATOM 958 N THR A 63 4.714 -14.905 -3.558 1.00 10.00 N ATOM 959 CA THR A 63 3.845 -15.575 -4.527 1.00 10.00 C ATOM 960 C THR A 63 2.677 -14.711 -4.969 1.00 10.00 C ATOM 961 O THR A 63 2.338 -14.733 -6.145 1.00 10.00 O ATOM 962 CB THR A 63 3.385 -16.927 -3.950 1.00 10.00 C ATOM 963 OG1 THR A 63 2.611 -16.771 -2.778 1.00 10.00 O ATOM 964 CG2 THR A 63 4.598 -17.780 -3.561 1.00 10.00 C ATOM 0 H THR A 63 4.582 -15.255 -2.609 1.00 10.00 H new ATOM 0 HA THR A 63 4.422 -15.756 -5.434 1.00 10.00 H new ATOM 0 HB THR A 63 2.789 -17.402 -4.729 1.00 10.00 H new ATOM 0 HG1 THR A 63 2.842 -17.475 -2.137 1.00 10.00 H new ATOM 0 HG21 THR A 63 4.258 -18.733 -3.155 1.00 10.00 H new ATOM 0 HG22 THR A 63 5.214 -17.961 -4.442 1.00 10.00 H new ATOM 0 HG23 THR A 63 5.186 -17.254 -2.809 1.00 10.00 H new ATOM 972 N LEU A 64 2.083 -13.917 -4.078 1.00 10.00 N ATOM 973 CA LEU A 64 1.055 -12.925 -4.393 1.00 10.00 C ATOM 974 C LEU A 64 1.605 -11.636 -5.027 1.00 10.00 C ATOM 975 O LEU A 64 0.825 -10.845 -5.569 1.00 10.00 O ATOM 976 CB LEU A 64 0.228 -12.642 -3.122 1.00 10.00 C ATOM 977 CG LEU A 64 -1.295 -12.751 -3.310 1.00 10.00 C ATOM 978 CD1 LEU A 64 -1.985 -12.657 -1.945 1.00 10.00 C ATOM 979 CD2 LEU A 64 -1.840 -11.627 -4.193 1.00 10.00 C ATOM 0 H LEU A 64 2.312 -13.948 -3.084 1.00 10.00 H new ATOM 0 HA LEU A 64 0.411 -13.347 -5.164 1.00 10.00 H new ATOM 0 HB2 LEU A 64 0.535 -13.339 -2.342 1.00 10.00 H new ATOM 0 HB3 LEU A 64 0.466 -11.640 -2.766 1.00 10.00 H new ATOM 0 HG LEU A 64 -1.497 -13.708 -3.791 1.00 10.00 H new ATOM 0 HD11 LEU A 64 -3.064 -12.734 -2.077 1.00 10.00 H new ATOM 0 HD12 LEU A 64 -1.639 -13.469 -1.306 1.00 10.00 H new ATOM 0 HD13 LEU A 64 -1.744 -11.701 -1.480 1.00 10.00 H new ATOM 0 HD21 LEU A 64 -2.919 -11.740 -4.301 1.00 10.00 H new ATOM 0 HD22 LEU A 64 -1.620 -10.664 -3.733 1.00 10.00 H new ATOM 0 HD23 LEU A 64 -1.370 -11.675 -5.175 1.00 10.00 H new ATOM 991 N MET A 65 2.930 -11.428 -5.014 1.00 10.00 N ATOM 992 CA MET A 65 3.571 -10.509 -5.954 1.00 10.00 C ATOM 993 C MET A 65 3.413 -11.118 -7.348 1.00 10.00 C ATOM 994 O MET A 65 2.608 -10.629 -8.142 1.00 10.00 O ATOM 995 CB MET A 65 5.039 -10.187 -5.583 1.00 10.00 C ATOM 996 CG MET A 65 5.252 -8.718 -5.168 1.00 10.00 C ATOM 997 SD MET A 65 5.296 -8.321 -3.405 1.00 10.00 S ATOM 998 CE MET A 65 3.705 -9.012 -2.916 1.00 10.00 C ATOM 0 H MET A 65 3.572 -11.883 -4.365 1.00 10.00 H new ATOM 0 HA MET A 65 3.086 -9.533 -5.919 1.00 10.00 H new ATOM 0 HB2 MET A 65 5.352 -10.838 -4.766 1.00 10.00 H new ATOM 0 HB3 MET A 65 5.680 -10.414 -6.435 1.00 10.00 H new ATOM 0 HG2 MET A 65 6.191 -8.382 -5.608 1.00 10.00 H new ATOM 0 HG3 MET A 65 4.457 -8.126 -5.622 1.00 10.00 H new ATOM 0 HE1 MET A 65 3.432 -8.636 -1.930 1.00 10.00 H new ATOM 0 HE2 MET A 65 2.944 -8.720 -3.639 1.00 10.00 H new ATOM 0 HE3 MET A 65 3.775 -10.099 -2.883 1.00 10.00 H new ATOM 1008 N GLU A 66 4.060 -12.267 -7.572 1.00 10.00 N ATOM 1009 CA GLU A 66 4.131 -12.938 -8.873 1.00 10.00 C ATOM 1010 C GLU A 66 2.732 -13.167 -9.460 1.00 10.00 C ATOM 1011 O GLU A 66 2.478 -12.871 -10.628 1.00 10.00 O ATOM 1012 CB GLU A 66 4.885 -14.277 -8.706 1.00 10.00 C ATOM 1013 CG GLU A 66 6.150 -14.409 -9.565 1.00 10.00 C ATOM 1014 CD GLU A 66 5.903 -14.275 -11.072 1.00 10.00 C ATOM 1015 OE1 GLU A 66 5.583 -15.282 -11.750 1.00 10.00 O ATOM 1016 OE2 GLU A 66 6.116 -13.167 -11.615 1.00 10.00 O ATOM 0 H GLU A 66 4.560 -12.767 -6.837 1.00 10.00 H new ATOM 0 HA GLU A 66 4.671 -12.301 -9.574 1.00 10.00 H new ATOM 0 HB2 GLU A 66 5.159 -14.396 -7.658 1.00 10.00 H new ATOM 0 HB3 GLU A 66 4.207 -15.094 -8.953 1.00 10.00 H new ATOM 0 HG2 GLU A 66 6.866 -13.647 -9.256 1.00 10.00 H new ATOM 0 HG3 GLU A 66 6.610 -15.377 -9.368 1.00 10.00 H new ATOM 1023 N TYR A 67 1.809 -13.652 -8.623 1.00 10.00 N ATOM 1024 CA TYR A 67 0.456 -13.985 -9.030 1.00 10.00 C ATOM 1025 C TYR A 67 -0.373 -12.767 -9.444 1.00 10.00 C ATOM 1026 O TYR A 67 -0.896 -12.772 -10.552 1.00 10.00 O ATOM 1027 CB TYR A 67 -0.228 -14.780 -7.925 1.00 10.00 C ATOM 1028 CG TYR A 67 -1.695 -15.086 -8.177 1.00 10.00 C ATOM 1029 CD1 TYR A 67 -2.059 -16.093 -9.091 1.00 10.00 C ATOM 1030 CD2 TYR A 67 -2.696 -14.379 -7.485 1.00 10.00 C ATOM 1031 CE1 TYR A 67 -3.413 -16.417 -9.286 1.00 10.00 C ATOM 1032 CE2 TYR A 67 -4.056 -14.655 -7.723 1.00 10.00 C ATOM 1033 CZ TYR A 67 -4.418 -15.683 -8.622 1.00 10.00 C ATOM 1034 OH TYR A 67 -5.727 -15.967 -8.859 1.00 10.00 O ATOM 0 H TYR A 67 1.991 -13.823 -7.634 1.00 10.00 H new ATOM 0 HA TYR A 67 0.528 -14.600 -9.927 1.00 10.00 H new ATOM 0 HB2 TYR A 67 0.307 -15.720 -7.788 1.00 10.00 H new ATOM 0 HB3 TYR A 67 -0.142 -14.225 -6.991 1.00 10.00 H new ATOM 0 HD1 TYR A 67 -1.295 -16.619 -9.645 1.00 10.00 H new ATOM 0 HD2 TYR A 67 -2.419 -13.621 -6.768 1.00 10.00 H new ATOM 0 HE1 TYR A 67 -3.684 -17.229 -9.945 1.00 10.00 H new ATOM 0 HE2 TYR A 67 -4.821 -14.082 -7.219 1.00 10.00 H new ATOM 0 HH TYR A 67 -6.204 -15.143 -9.090 1.00 10.00 H new ATOM 1044 N LEU A 68 -0.537 -11.734 -8.602 1.00 10.00 N ATOM 1045 CA LEU A 68 -1.341 -10.579 -9.039 1.00 10.00 C ATOM 1046 C LEU A 68 -0.648 -9.770 -10.153 1.00 10.00 C ATOM 1047 O LEU A 68 -1.350 -9.180 -10.969 1.00 10.00 O ATOM 1048 CB LEU A 68 -1.770 -9.699 -7.847 1.00 10.00 C ATOM 1049 CG LEU A 68 -3.289 -9.525 -7.648 1.00 10.00 C ATOM 1050 CD1 LEU A 68 -3.968 -8.838 -8.837 1.00 10.00 C ATOM 1051 CD2 LEU A 68 -3.998 -10.848 -7.345 1.00 10.00 C ATOM 0 H LEU A 68 -0.147 -11.671 -7.662 1.00 10.00 H new ATOM 0 HA LEU A 68 -2.255 -10.976 -9.481 1.00 10.00 H new ATOM 0 HB2 LEU A 68 -1.351 -10.126 -6.936 1.00 10.00 H new ATOM 0 HB3 LEU A 68 -1.324 -8.712 -7.971 1.00 10.00 H new ATOM 0 HG LEU A 68 -3.386 -8.875 -6.778 1.00 10.00 H new ATOM 0 HD11 LEU A 68 -5.036 -8.743 -8.641 1.00 10.00 H new ATOM 0 HD12 LEU A 68 -3.536 -7.848 -8.981 1.00 10.00 H new ATOM 0 HD13 LEU A 68 -3.816 -9.434 -9.737 1.00 10.00 H new ATOM 0 HD21 LEU A 68 -5.065 -10.667 -7.214 1.00 10.00 H new ATOM 0 HD22 LEU A 68 -3.846 -11.540 -8.173 1.00 10.00 H new ATOM 0 HD23 LEU A 68 -3.588 -11.280 -6.432 1.00 10.00 H new ATOM 1063 N GLU A 69 0.692 -9.760 -10.247 1.00 10.00 N ATOM 1064 CA GLU A 69 1.395 -9.200 -11.402 1.00 10.00 C ATOM 1065 C GLU A 69 1.177 -9.977 -12.711 1.00 10.00 C ATOM 1066 O GLU A 69 0.999 -9.335 -13.747 1.00 10.00 O ATOM 1067 CB GLU A 69 2.875 -9.068 -11.032 1.00 10.00 C ATOM 1068 CG GLU A 69 3.051 -7.847 -10.115 1.00 10.00 C ATOM 1069 CD GLU A 69 4.017 -8.069 -8.951 1.00 10.00 C ATOM 1070 OE1 GLU A 69 5.176 -8.468 -9.184 1.00 10.00 O ATOM 1071 OE2 GLU A 69 3.553 -7.821 -7.812 1.00 10.00 O ATOM 0 H GLU A 69 1.310 -10.138 -9.528 1.00 10.00 H new ATOM 0 HA GLU A 69 0.974 -8.219 -11.622 1.00 10.00 H new ATOM 0 HB2 GLU A 69 3.220 -9.971 -10.528 1.00 10.00 H new ATOM 0 HB3 GLU A 69 3.480 -8.954 -11.932 1.00 10.00 H new ATOM 0 HG2 GLU A 69 3.407 -7.007 -10.712 1.00 10.00 H new ATOM 0 HG3 GLU A 69 2.077 -7.564 -9.715 1.00 10.00 H new ATOM 1078 N ASN A 70 1.111 -11.319 -12.690 1.00 10.00 N ATOM 1079 CA ASN A 70 0.632 -12.116 -13.826 1.00 10.00 C ATOM 1080 C ASN A 70 0.261 -13.555 -13.398 1.00 10.00 C ATOM 1081 O ASN A 70 1.137 -14.422 -13.288 1.00 10.00 O ATOM 1082 CB ASN A 70 1.667 -12.143 -14.962 1.00 10.00 C ATOM 1083 CG ASN A 70 1.083 -12.720 -16.250 1.00 10.00 C ATOM 1084 OD1 ASN A 70 0.294 -13.657 -16.258 1.00 10.00 O ATOM 1085 ND2 ASN A 70 1.464 -12.180 -17.389 1.00 10.00 N ATOM 0 H ASN A 70 1.389 -11.879 -11.884 1.00 10.00 H new ATOM 0 HA ASN A 70 -0.272 -11.634 -14.197 1.00 10.00 H new ATOM 0 HB2 ASN A 70 2.028 -11.132 -15.148 1.00 10.00 H new ATOM 0 HB3 ASN A 70 2.528 -12.737 -14.655 1.00 10.00 H new ATOM 0 HD21 ASN A 70 1.102 -12.542 -18.271 1.00 10.00 H new ATOM 0 HD22 ASN A 70 2.121 -11.400 -17.389 1.00 10.00 H new ATOM 1092 N PRO A 71 -1.038 -13.848 -13.200 1.00 10.00 N ATOM 1093 CA PRO A 71 -1.468 -15.086 -12.563 1.00 10.00 C ATOM 1094 C PRO A 71 -1.254 -16.292 -13.480 1.00 10.00 C ATOM 1095 O PRO A 71 -0.683 -17.295 -13.057 1.00 10.00 O ATOM 1096 CB PRO A 71 -2.936 -14.843 -12.197 1.00 10.00 C ATOM 1097 CG PRO A 71 -3.428 -13.807 -13.201 1.00 10.00 C ATOM 1098 CD PRO A 71 -2.175 -12.973 -13.451 1.00 10.00 C ATOM 0 HA PRO A 71 -0.886 -15.331 -11.675 1.00 10.00 H new ATOM 0 HB2 PRO A 71 -3.517 -15.763 -12.263 1.00 10.00 H new ATOM 0 HB3 PRO A 71 -3.032 -14.478 -11.174 1.00 10.00 H new ATOM 0 HG2 PRO A 71 -3.797 -14.271 -14.116 1.00 10.00 H new ATOM 0 HG3 PRO A 71 -4.243 -13.205 -12.798 1.00 10.00 H new ATOM 0 HD2 PRO A 71 -2.157 -12.597 -14.474 1.00 10.00 H new ATOM 0 HD3 PRO A 71 -2.149 -12.105 -12.792 1.00 10.00 H new ATOM 1106 N LYS A 72 -1.659 -16.163 -14.751 1.00 10.00 N ATOM 1107 CA LYS A 72 -1.572 -17.183 -15.792 1.00 10.00 C ATOM 1108 C LYS A 72 -0.129 -17.465 -16.249 1.00 10.00 C ATOM 1109 O LYS A 72 0.134 -18.542 -16.777 1.00 10.00 O ATOM 1110 CB LYS A 72 -2.439 -16.739 -16.971 1.00 10.00 C ATOM 1111 CG LYS A 72 -3.935 -16.682 -16.613 1.00 10.00 C ATOM 1112 CD LYS A 72 -4.824 -16.355 -17.819 1.00 10.00 C ATOM 1113 CE LYS A 72 -4.594 -14.921 -18.315 1.00 10.00 C ATOM 1114 NZ LYS A 72 -5.457 -14.601 -19.476 1.00 10.00 N ATOM 0 H LYS A 72 -2.077 -15.298 -15.093 1.00 10.00 H new ATOM 0 HA LYS A 72 -1.935 -18.124 -15.378 1.00 10.00 H new ATOM 0 HB2 LYS A 72 -2.112 -15.756 -17.309 1.00 10.00 H new ATOM 0 HB3 LYS A 72 -2.294 -17.427 -17.804 1.00 10.00 H new ATOM 0 HG2 LYS A 72 -4.240 -17.640 -16.192 1.00 10.00 H new ATOM 0 HG3 LYS A 72 -4.090 -15.930 -15.839 1.00 10.00 H new ATOM 0 HD2 LYS A 72 -4.617 -17.058 -18.626 1.00 10.00 H new ATOM 0 HD3 LYS A 72 -5.871 -16.483 -17.546 1.00 10.00 H new ATOM 0 HE2 LYS A 72 -4.796 -14.219 -17.506 1.00 10.00 H new ATOM 0 HE3 LYS A 72 -3.548 -14.795 -18.593 1.00 10.00 H new ATOM 0 HZ1 LYS A 72 -5.275 -13.625 -19.785 1.00 10.00 H new ATOM 0 HZ2 LYS A 72 -5.246 -15.256 -20.256 1.00 10.00 H new ATOM 0 HZ3 LYS A 72 -6.456 -14.698 -19.203 1.00 10.00 H new ATOM 1128 N LYS A 73 0.806 -16.521 -16.047 1.00 10.00 N ATOM 1129 CA LYS A 73 2.254 -16.778 -16.112 1.00 10.00 C ATOM 1130 C LYS A 73 2.708 -17.578 -14.895 1.00 10.00 C ATOM 1131 O LYS A 73 3.370 -18.597 -15.060 1.00 10.00 O ATOM 1132 CB LYS A 73 3.046 -15.463 -16.194 1.00 10.00 C ATOM 1133 CG LYS A 73 4.565 -15.693 -16.312 1.00 10.00 C ATOM 1134 CD LYS A 73 5.360 -14.383 -16.430 1.00 10.00 C ATOM 1135 CE LYS A 73 5.374 -13.535 -15.149 1.00 10.00 C ATOM 1136 NZ LYS A 73 6.189 -14.126 -14.065 1.00 10.00 N ATOM 0 H LYS A 73 0.576 -15.551 -15.832 1.00 10.00 H new ATOM 0 HA LYS A 73 2.450 -17.357 -17.015 1.00 10.00 H new ATOM 0 HB2 LYS A 73 2.701 -14.889 -17.054 1.00 10.00 H new ATOM 0 HB3 LYS A 73 2.841 -14.864 -15.307 1.00 10.00 H new ATOM 0 HG2 LYS A 73 4.913 -16.246 -15.439 1.00 10.00 H new ATOM 0 HG3 LYS A 73 4.767 -16.315 -17.184 1.00 10.00 H new ATOM 0 HD2 LYS A 73 6.388 -14.619 -16.707 1.00 10.00 H new ATOM 0 HD3 LYS A 73 4.940 -13.788 -17.241 1.00 10.00 H new ATOM 0 HE2 LYS A 73 5.758 -12.542 -15.383 1.00 10.00 H new ATOM 0 HE3 LYS A 73 4.351 -13.406 -14.796 1.00 10.00 H new ATOM 0 HZ1 LYS A 73 6.354 -13.413 -13.327 1.00 10.00 H new ATOM 0 HZ2 LYS A 73 5.685 -14.938 -13.655 1.00 10.00 H new ATOM 0 HZ3 LYS A 73 7.101 -14.443 -14.450 1.00 10.00 H new ATOM 1150 N TYR A 74 2.396 -17.081 -13.692 1.00 10.00 N ATOM 1151 CA TYR A 74 2.881 -17.670 -12.446 1.00 10.00 C ATOM 1152 C TYR A 74 2.457 -19.139 -12.275 1.00 10.00 C ATOM 1153 O TYR A 74 3.277 -19.965 -11.879 1.00 10.00 O ATOM 1154 CB TYR A 74 2.486 -16.799 -11.249 1.00 10.00 C ATOM 1155 CG TYR A 74 3.005 -17.352 -9.932 1.00 10.00 C ATOM 1156 CD1 TYR A 74 4.376 -17.643 -9.780 1.00 10.00 C ATOM 1157 CD2 TYR A 74 2.119 -17.621 -8.874 1.00 10.00 C ATOM 1158 CE1 TYR A 74 4.852 -18.222 -8.592 1.00 10.00 C ATOM 1159 CE2 TYR A 74 2.585 -18.197 -7.680 1.00 10.00 C ATOM 1160 CZ TYR A 74 3.955 -18.514 -7.546 1.00 10.00 C ATOM 1161 OH TYR A 74 4.422 -19.111 -6.420 1.00 10.00 O ATOM 0 H TYR A 74 1.802 -16.262 -13.559 1.00 10.00 H new ATOM 0 HA TYR A 74 3.970 -17.691 -12.496 1.00 10.00 H new ATOM 0 HB2 TYR A 74 2.873 -15.790 -11.394 1.00 10.00 H new ATOM 0 HB3 TYR A 74 1.400 -16.720 -11.204 1.00 10.00 H new ATOM 0 HD1 TYR A 74 5.064 -17.419 -10.582 1.00 10.00 H new ATOM 0 HD2 TYR A 74 1.071 -17.383 -8.980 1.00 10.00 H new ATOM 0 HE1 TYR A 74 5.903 -18.443 -8.481 1.00 10.00 H new ATOM 0 HE2 TYR A 74 1.900 -18.396 -6.869 1.00 10.00 H new ATOM 0 HH TYR A 74 5.400 -19.049 -6.398 1.00 10.00 H new ATOM 1171 N ILE A 75 1.210 -19.480 -12.629 1.00 10.00 N ATOM 1172 CA ILE A 75 0.724 -20.864 -12.713 1.00 10.00 C ATOM 1173 C ILE A 75 -0.240 -21.063 -13.901 1.00 10.00 C ATOM 1174 O ILE A 75 -0.904 -20.114 -14.317 1.00 10.00 O ATOM 1175 CB ILE A 75 0.030 -21.303 -11.403 1.00 10.00 C ATOM 1176 CG1 ILE A 75 -1.094 -20.350 -10.947 1.00 10.00 C ATOM 1177 CG2 ILE A 75 1.031 -21.640 -10.285 1.00 10.00 C ATOM 1178 CD1 ILE A 75 -0.728 -19.173 -10.057 1.00 10.00 C ATOM 0 H ILE A 75 0.499 -18.790 -12.869 1.00 10.00 H new ATOM 0 HA ILE A 75 1.602 -21.490 -12.872 1.00 10.00 H new ATOM 0 HB ILE A 75 -0.478 -22.237 -11.643 1.00 10.00 H new ATOM 0 HG12 ILE A 75 -1.576 -19.953 -11.841 1.00 10.00 H new ATOM 0 HG13 ILE A 75 -1.840 -20.945 -10.420 1.00 10.00 H new ATOM 0 HG21 ILE A 75 0.488 -21.942 -9.389 1.00 10.00 H new ATOM 0 HG22 ILE A 75 1.678 -22.455 -10.609 1.00 10.00 H new ATOM 0 HG23 ILE A 75 1.638 -20.762 -10.063 1.00 10.00 H new ATOM 0 HD11 ILE A 75 -1.626 -18.600 -9.824 1.00 10.00 H new ATOM 0 HD12 ILE A 75 -0.282 -19.541 -9.133 1.00 10.00 H new ATOM 0 HD13 ILE A 75 -0.013 -18.533 -10.575 1.00 10.00 H new ATOM 1190 N PRO A 76 -0.381 -22.296 -14.431 1.00 10.00 N ATOM 1191 CA PRO A 76 -1.305 -22.580 -15.527 1.00 10.00 C ATOM 1192 C PRO A 76 -2.784 -22.558 -15.095 1.00 10.00 C ATOM 1193 O PRO A 76 -3.141 -22.914 -13.972 1.00 10.00 O ATOM 1194 CB PRO A 76 -0.891 -23.960 -16.052 1.00 10.00 C ATOM 1195 CG PRO A 76 -0.296 -24.642 -14.822 1.00 10.00 C ATOM 1196 CD PRO A 76 0.391 -23.487 -14.096 1.00 10.00 C ATOM 0 HA PRO A 76 -1.241 -21.809 -16.295 1.00 10.00 H new ATOM 0 HB2 PRO A 76 -1.744 -24.513 -16.445 1.00 10.00 H new ATOM 0 HB3 PRO A 76 -0.163 -23.881 -16.859 1.00 10.00 H new ATOM 0 HG2 PRO A 76 -1.065 -25.107 -14.205 1.00 10.00 H new ATOM 0 HG3 PRO A 76 0.411 -25.426 -15.096 1.00 10.00 H new ATOM 0 HD2 PRO A 76 0.405 -23.654 -13.019 1.00 10.00 H new ATOM 0 HD3 PRO A 76 1.428 -23.385 -14.416 1.00 10.00 H new ATOM 1204 N GLY A 77 -3.645 -22.199 -16.052 1.00 10.00 N ATOM 1205 CA GLY A 77 -5.097 -22.120 -15.944 1.00 10.00 C ATOM 1206 C GLY A 77 -5.551 -20.696 -15.629 1.00 10.00 C ATOM 1207 O GLY A 77 -5.639 -19.859 -16.522 1.00 10.00 O ATOM 0 H GLY A 77 -3.320 -21.939 -16.983 1.00 10.00 H new ATOM 0 HA2 GLY A 77 -5.552 -22.452 -16.877 1.00 10.00 H new ATOM 0 HA3 GLY A 77 -5.443 -22.796 -15.162 1.00 10.00 H new ATOM 1211 N THR A 78 -5.854 -20.467 -14.352 1.00 10.00 N ATOM 1212 CA THR A 78 -6.388 -19.273 -13.697 1.00 10.00 C ATOM 1213 C THR A 78 -7.378 -18.441 -14.518 1.00 10.00 C ATOM 1214 O THR A 78 -7.022 -17.455 -15.162 1.00 10.00 O ATOM 1215 CB THR A 78 -5.291 -18.452 -13.004 1.00 10.00 C ATOM 1216 OG1 THR A 78 -4.680 -19.254 -12.019 1.00 10.00 O ATOM 1217 CG2 THR A 78 -5.896 -17.255 -12.269 1.00 10.00 C ATOM 0 H THR A 78 -5.713 -21.209 -13.666 1.00 10.00 H new ATOM 0 HA THR A 78 -7.031 -19.661 -12.907 1.00 10.00 H new ATOM 0 HB THR A 78 -4.585 -18.117 -13.764 1.00 10.00 H new ATOM 0 HG1 THR A 78 -5.315 -19.418 -11.291 1.00 10.00 H new ATOM 0 HG21 THR A 78 -5.102 -16.686 -11.785 1.00 10.00 H new ATOM 0 HG22 THR A 78 -6.417 -16.616 -12.982 1.00 10.00 H new ATOM 0 HG23 THR A 78 -6.600 -17.608 -11.516 1.00 10.00 H new ATOM 1225 N LYS A 79 -8.672 -18.773 -14.379 1.00 10.00 N ATOM 1226 CA LYS A 79 -9.801 -17.990 -14.910 1.00 10.00 C ATOM 1227 C LYS A 79 -10.096 -16.680 -14.150 1.00 10.00 C ATOM 1228 O LYS A 79 -11.187 -16.128 -14.275 1.00 10.00 O ATOM 1229 CB LYS A 79 -11.051 -18.877 -15.098 1.00 10.00 C ATOM 1230 CG LYS A 79 -11.757 -19.338 -13.807 1.00 10.00 C ATOM 1231 CD LYS A 79 -13.069 -20.064 -14.157 1.00 10.00 C ATOM 1232 CE LYS A 79 -13.731 -20.738 -12.949 1.00 10.00 C ATOM 1233 NZ LYS A 79 -14.318 -19.786 -11.973 1.00 10.00 N ATOM 0 H LYS A 79 -8.970 -19.613 -13.883 1.00 10.00 H new ATOM 0 HA LYS A 79 -9.486 -17.644 -15.894 1.00 10.00 H new ATOM 0 HB2 LYS A 79 -11.771 -18.330 -15.706 1.00 10.00 H new ATOM 0 HB3 LYS A 79 -10.762 -19.762 -15.665 1.00 10.00 H new ATOM 0 HG2 LYS A 79 -11.103 -20.002 -13.242 1.00 10.00 H new ATOM 0 HG3 LYS A 79 -11.966 -18.479 -13.170 1.00 10.00 H new ATOM 0 HD2 LYS A 79 -13.767 -19.349 -14.593 1.00 10.00 H new ATOM 0 HD3 LYS A 79 -12.867 -20.817 -14.919 1.00 10.00 H new ATOM 0 HE2 LYS A 79 -14.514 -21.408 -13.304 1.00 10.00 H new ATOM 0 HE3 LYS A 79 -12.991 -21.355 -12.439 1.00 10.00 H new ATOM 0 HZ1 LYS A 79 -14.405 -20.249 -11.046 1.00 10.00 H new ATOM 0 HZ2 LYS A 79 -13.702 -18.953 -11.887 1.00 10.00 H new ATOM 0 HZ3 LYS A 79 -15.259 -19.488 -12.301 1.00 10.00 H new ATOM 1247 N MET A 80 -9.136 -16.151 -13.381 1.00 10.00 N ATOM 1248 CA MET A 80 -9.163 -14.771 -12.888 1.00 10.00 C ATOM 1249 C MET A 80 -8.930 -13.814 -14.070 1.00 10.00 C ATOM 1250 O MET A 80 -7.823 -13.314 -14.286 1.00 10.00 O ATOM 1251 CB MET A 80 -8.147 -14.590 -11.745 1.00 10.00 C ATOM 1252 CG MET A 80 -8.195 -13.183 -11.147 1.00 10.00 C ATOM 1253 SD MET A 80 -7.276 -13.008 -9.596 1.00 10.00 S ATOM 1254 CE MET A 80 -6.851 -11.255 -9.733 1.00 10.00 C ATOM 0 H MET A 80 -8.313 -16.674 -13.082 1.00 10.00 H new ATOM 0 HA MET A 80 -10.138 -14.534 -12.462 1.00 10.00 H new ATOM 0 HB2 MET A 80 -8.348 -15.322 -10.963 1.00 10.00 H new ATOM 0 HB3 MET A 80 -7.143 -14.790 -12.119 1.00 10.00 H new ATOM 0 HG2 MET A 80 -7.796 -12.476 -11.875 1.00 10.00 H new ATOM 0 HG3 MET A 80 -9.236 -12.909 -10.973 1.00 10.00 H new ATOM 0 HE1 MET A 80 -6.653 -10.850 -8.741 1.00 10.00 H new ATOM 0 HE2 MET A 80 -5.962 -11.144 -10.354 1.00 10.00 H new ATOM 0 HE3 MET A 80 -7.681 -10.714 -10.187 1.00 10.00 H new ATOM 1264 N ILE A 81 -9.983 -13.593 -14.869 1.00 10.00 N ATOM 1265 CA ILE A 81 -9.979 -12.711 -16.043 1.00 10.00 C ATOM 1266 C ILE A 81 -9.865 -11.246 -15.589 1.00 10.00 C ATOM 1267 O ILE A 81 -10.848 -10.508 -15.540 1.00 10.00 O ATOM 1268 CB ILE A 81 -11.203 -12.969 -16.961 1.00 10.00 C ATOM 1269 CG1 ILE A 81 -11.420 -14.459 -17.321 1.00 10.00 C ATOM 1270 CG2 ILE A 81 -11.089 -12.151 -18.263 1.00 10.00 C ATOM 1271 CD1 ILE A 81 -10.200 -15.200 -17.890 1.00 10.00 C ATOM 0 H ILE A 81 -10.888 -14.037 -14.711 1.00 10.00 H new ATOM 0 HA ILE A 81 -9.106 -12.937 -16.655 1.00 10.00 H new ATOM 0 HB ILE A 81 -12.068 -12.651 -16.380 1.00 10.00 H new ATOM 0 HG12 ILE A 81 -11.753 -14.984 -16.426 1.00 10.00 H new ATOM 0 HG13 ILE A 81 -12.230 -14.522 -18.048 1.00 10.00 H new ATOM 0 HG21 ILE A 81 -11.957 -12.346 -18.893 1.00 10.00 H new ATOM 0 HG22 ILE A 81 -11.047 -11.089 -18.023 1.00 10.00 H new ATOM 0 HG23 ILE A 81 -10.183 -12.439 -18.795 1.00 10.00 H new ATOM 0 HD11 ILE A 81 -10.470 -16.234 -18.105 1.00 10.00 H new ATOM 0 HD12 ILE A 81 -9.874 -14.712 -18.808 1.00 10.00 H new ATOM 0 HD13 ILE A 81 -9.390 -15.180 -17.161 1.00 10.00 H new ATOM 1283 N PHE A 82 -8.640 -10.842 -15.243 1.00 10.00 N ATOM 1284 CA PHE A 82 -8.320 -9.511 -14.740 1.00 10.00 C ATOM 1285 C PHE A 82 -6.814 -9.208 -14.833 1.00 10.00 C ATOM 1286 O PHE A 82 -6.405 -8.436 -15.697 1.00 10.00 O ATOM 1287 CB PHE A 82 -8.818 -9.364 -13.292 1.00 10.00 C ATOM 1288 CG PHE A 82 -8.582 -7.977 -12.760 1.00 10.00 C ATOM 1289 CD1 PHE A 82 -9.174 -6.867 -13.393 1.00 10.00 C ATOM 1290 CD2 PHE A 82 -7.692 -7.799 -11.696 1.00 10.00 C ATOM 1291 CE1 PHE A 82 -8.824 -5.569 -12.994 1.00 10.00 C ATOM 1292 CE2 PHE A 82 -7.336 -6.501 -11.296 1.00 10.00 C ATOM 1293 CZ PHE A 82 -7.889 -5.391 -11.961 1.00 10.00 C ATOM 0 H PHE A 82 -7.824 -11.451 -15.308 1.00 10.00 H new ATOM 0 HA PHE A 82 -8.831 -8.783 -15.369 1.00 10.00 H new ATOM 0 HB2 PHE A 82 -9.883 -9.594 -13.248 1.00 10.00 H new ATOM 0 HB3 PHE A 82 -8.309 -10.089 -12.657 1.00 10.00 H new ATOM 0 HD1 PHE A 82 -9.895 -7.015 -14.183 1.00 10.00 H new ATOM 0 HD2 PHE A 82 -7.280 -8.656 -11.184 1.00 10.00 H new ATOM 0 HE1 PHE A 82 -9.270 -4.712 -13.477 1.00 10.00 H new ATOM 0 HE2 PHE A 82 -6.641 -6.355 -10.482 1.00 10.00 H new ATOM 0 HZ PHE A 82 -7.592 -4.393 -11.674 1.00 10.00 H new ATOM 1303 N ALA A 83 -5.995 -9.837 -13.976 1.00 10.00 N ATOM 1304 CA ALA A 83 -4.572 -9.572 -13.715 1.00 10.00 C ATOM 1305 C ALA A 83 -4.172 -8.087 -13.511 1.00 10.00 C ATOM 1306 O ALA A 83 -3.802 -7.703 -12.405 1.00 10.00 O ATOM 1307 CB ALA A 83 -3.744 -10.243 -14.819 1.00 10.00 C ATOM 0 H ALA A 83 -6.339 -10.606 -13.401 1.00 10.00 H new ATOM 0 HA ALA A 83 -4.355 -10.005 -12.739 1.00 10.00 H new ATOM 0 HB1 ALA A 83 -2.684 -10.058 -14.643 1.00 10.00 H new ATOM 0 HB2 ALA A 83 -3.931 -11.317 -14.812 1.00 10.00 H new ATOM 0 HB3 ALA A 83 -4.028 -9.832 -15.788 1.00 10.00 H new ATOM 1313 N GLY A 84 -4.198 -7.267 -14.568 1.00 10.00 N ATOM 1314 CA GLY A 84 -3.601 -5.930 -14.653 1.00 10.00 C ATOM 1315 C GLY A 84 -4.257 -4.900 -13.730 1.00 10.00 C ATOM 1316 O GLY A 84 -5.161 -4.179 -14.150 1.00 10.00 O ATOM 0 H GLY A 84 -4.663 -7.534 -15.436 1.00 10.00 H new ATOM 0 HA2 GLY A 84 -2.541 -6.000 -14.409 1.00 10.00 H new ATOM 0 HA3 GLY A 84 -3.669 -5.577 -15.682 1.00 10.00 H new ATOM 1320 N ILE A 85 -3.796 -4.823 -12.477 1.00 10.00 N ATOM 1321 CA ILE A 85 -4.531 -4.158 -11.398 1.00 10.00 C ATOM 1322 C ILE A 85 -4.751 -2.652 -11.592 1.00 10.00 C ATOM 1323 O ILE A 85 -5.903 -2.222 -11.487 1.00 10.00 O ATOM 1324 CB ILE A 85 -3.941 -4.506 -10.015 1.00 10.00 C ATOM 1325 CG1 ILE A 85 -4.875 -3.939 -8.925 1.00 10.00 C ATOM 1326 CG2 ILE A 85 -2.484 -4.045 -9.809 1.00 10.00 C ATOM 1327 CD1 ILE A 85 -4.578 -4.488 -7.535 1.00 10.00 C ATOM 0 H ILE A 85 -2.903 -5.220 -12.183 1.00 10.00 H new ATOM 0 HA ILE A 85 -5.539 -4.569 -11.443 1.00 10.00 H new ATOM 0 HB ILE A 85 -3.889 -5.593 -9.946 1.00 10.00 H new ATOM 0 HG12 ILE A 85 -4.784 -2.853 -8.907 1.00 10.00 H new ATOM 0 HG13 ILE A 85 -5.908 -4.168 -9.186 1.00 10.00 H new ATOM 0 HG21 ILE A 85 -2.150 -4.330 -8.811 1.00 10.00 H new ATOM 0 HG22 ILE A 85 -1.844 -4.517 -10.555 1.00 10.00 H new ATOM 0 HG23 ILE A 85 -2.427 -2.962 -9.915 1.00 10.00 H new ATOM 0 HD11 ILE A 85 -5.269 -4.050 -6.815 1.00 10.00 H new ATOM 0 HD12 ILE A 85 -4.697 -5.572 -7.539 1.00 10.00 H new ATOM 0 HD13 ILE A 85 -3.555 -4.236 -7.255 1.00 10.00 H new ATOM 1339 N LYS A 86 -3.665 -1.894 -11.827 1.00 10.00 N ATOM 1340 CA LYS A 86 -3.496 -0.432 -11.976 1.00 10.00 C ATOM 1341 C LYS A 86 -2.001 -0.077 -11.823 1.00 10.00 C ATOM 1342 O LYS A 86 -1.157 -0.970 -11.852 1.00 10.00 O ATOM 1343 CB LYS A 86 -4.437 0.373 -11.047 1.00 10.00 C ATOM 1344 CG LYS A 86 -5.815 0.645 -11.679 1.00 10.00 C ATOM 1345 CD LYS A 86 -6.092 2.094 -12.095 1.00 10.00 C ATOM 1346 CE LYS A 86 -6.530 2.945 -10.898 1.00 10.00 C ATOM 1347 NZ LYS A 86 -7.564 3.927 -11.293 1.00 10.00 N ATOM 0 H LYS A 86 -2.761 -2.354 -11.931 1.00 10.00 H new ATOM 0 HA LYS A 86 -3.804 -0.133 -12.978 1.00 10.00 H new ATOM 0 HB2 LYS A 86 -4.573 -0.174 -10.114 1.00 10.00 H new ATOM 0 HB3 LYS A 86 -3.965 1.323 -10.795 1.00 10.00 H new ATOM 0 HG2 LYS A 86 -5.921 0.009 -12.558 1.00 10.00 H new ATOM 0 HG3 LYS A 86 -6.584 0.339 -10.970 1.00 10.00 H new ATOM 0 HD2 LYS A 86 -5.195 2.524 -12.540 1.00 10.00 H new ATOM 0 HD3 LYS A 86 -6.868 2.113 -12.860 1.00 10.00 H new ATOM 0 HE2 LYS A 86 -6.919 2.299 -10.111 1.00 10.00 H new ATOM 0 HE3 LYS A 86 -5.667 3.467 -10.484 1.00 10.00 H new ATOM 0 HZ1 LYS A 86 -7.843 4.490 -10.464 1.00 10.00 H new ATOM 0 HZ2 LYS A 86 -7.182 4.557 -12.027 1.00 10.00 H new ATOM 0 HZ3 LYS A 86 -8.395 3.425 -11.666 1.00 10.00 H new ATOM 1361 N LYS A 87 -1.678 1.222 -11.719 1.00 10.00 N ATOM 1362 CA LYS A 87 -0.358 1.845 -11.915 1.00 10.00 C ATOM 1363 C LYS A 87 0.758 1.238 -11.055 1.00 10.00 C ATOM 1364 O LYS A 87 1.665 0.622 -11.607 1.00 10.00 O ATOM 1365 CB LYS A 87 -0.440 3.376 -11.705 1.00 10.00 C ATOM 1366 CG LYS A 87 -1.074 4.158 -12.869 1.00 10.00 C ATOM 1367 CD LYS A 87 -2.610 4.080 -12.941 1.00 10.00 C ATOM 1368 CE LYS A 87 -3.106 3.626 -14.324 1.00 10.00 C ATOM 1369 NZ LYS A 87 -3.382 4.784 -15.207 1.00 10.00 N ATOM 0 H LYS A 87 -2.385 1.916 -11.478 1.00 10.00 H new ATOM 0 HA LYS A 87 -0.082 1.633 -12.948 1.00 10.00 H new ATOM 0 HB2 LYS A 87 -1.013 3.573 -10.799 1.00 10.00 H new ATOM 0 HB3 LYS A 87 0.566 3.759 -11.535 1.00 10.00 H new ATOM 0 HG2 LYS A 87 -0.781 5.205 -12.787 1.00 10.00 H new ATOM 0 HG3 LYS A 87 -0.661 3.784 -13.806 1.00 10.00 H new ATOM 0 HD2 LYS A 87 -2.973 3.387 -12.182 1.00 10.00 H new ATOM 0 HD3 LYS A 87 -3.033 5.057 -12.708 1.00 10.00 H new ATOM 0 HE2 LYS A 87 -2.358 2.983 -14.788 1.00 10.00 H new ATOM 0 HE3 LYS A 87 -4.011 3.030 -14.210 1.00 10.00 H new ATOM 0 HZ1 LYS A 87 -3.715 4.444 -16.132 1.00 10.00 H new ATOM 0 HZ2 LYS A 87 -4.114 5.383 -14.775 1.00 10.00 H new ATOM 0 HZ3 LYS A 87 -2.511 5.338 -15.335 1.00 10.00 H new ATOM 1383 N LYS A 88 0.734 1.460 -9.730 1.00 10.00 N ATOM 1384 CA LYS A 88 1.828 1.055 -8.824 1.00 10.00 C ATOM 1385 C LYS A 88 1.453 1.038 -7.351 1.00 10.00 C ATOM 1386 O LYS A 88 1.730 0.031 -6.704 1.00 10.00 O ATOM 1387 CB LYS A 88 3.069 1.961 -9.024 1.00 10.00 C ATOM 1388 CG LYS A 88 4.276 1.254 -9.671 1.00 10.00 C ATOM 1389 CD LYS A 88 5.386 0.797 -8.706 1.00 10.00 C ATOM 1390 CE LYS A 88 5.201 -0.598 -8.093 1.00 10.00 C ATOM 1391 NZ LYS A 88 4.393 -0.598 -6.852 1.00 10.00 N ATOM 0 H LYS A 88 -0.041 1.924 -9.256 1.00 10.00 H new ATOM 0 HA LYS A 88 2.055 0.025 -9.099 1.00 10.00 H new ATOM 0 HB2 LYS A 88 2.786 2.812 -9.644 1.00 10.00 H new ATOM 0 HB3 LYS A 88 3.373 2.359 -8.056 1.00 10.00 H new ATOM 0 HG2 LYS A 88 3.913 0.382 -10.215 1.00 10.00 H new ATOM 0 HG3 LYS A 88 4.716 1.928 -10.406 1.00 10.00 H new ATOM 0 HD2 LYS A 88 6.336 0.816 -9.239 1.00 10.00 H new ATOM 0 HD3 LYS A 88 5.460 1.523 -7.896 1.00 10.00 H new ATOM 0 HE2 LYS A 88 4.724 -1.248 -8.827 1.00 10.00 H new ATOM 0 HE3 LYS A 88 6.181 -1.024 -7.879 1.00 10.00 H new ATOM 0 HZ1 LYS A 88 4.502 -1.511 -6.366 1.00 10.00 H new ATOM 0 HZ2 LYS A 88 4.717 0.168 -6.227 1.00 10.00 H new ATOM 0 HZ3 LYS A 88 3.391 -0.450 -7.090 1.00 10.00 H new ATOM 1405 N THR A 89 0.880 2.113 -6.808 1.00 10.00 N ATOM 1406 CA THR A 89 0.574 2.207 -5.373 1.00 10.00 C ATOM 1407 C THR A 89 -0.415 1.115 -4.963 1.00 10.00 C ATOM 1408 O THR A 89 -0.166 0.363 -4.029 1.00 10.00 O ATOM 1409 CB THR A 89 0.010 3.596 -5.016 1.00 10.00 C ATOM 1410 OG1 THR A 89 0.552 4.584 -5.868 1.00 10.00 O ATOM 1411 CG2 THR A 89 0.360 3.989 -3.583 1.00 10.00 C ATOM 0 H THR A 89 0.615 2.940 -7.343 1.00 10.00 H new ATOM 0 HA THR A 89 1.504 2.064 -4.823 1.00 10.00 H new ATOM 0 HB THR A 89 -1.072 3.535 -5.131 1.00 10.00 H new ATOM 0 HG1 THR A 89 0.183 5.460 -5.630 1.00 10.00 H new ATOM 0 HG21 THR A 89 -0.053 4.974 -3.365 1.00 10.00 H new ATOM 0 HG22 THR A 89 -0.060 3.258 -2.892 1.00 10.00 H new ATOM 0 HG23 THR A 89 1.444 4.016 -3.468 1.00 10.00 H new ATOM 1419 N GLU A 90 -1.479 0.956 -5.753 1.00 10.00 N ATOM 1420 CA GLU A 90 -2.631 0.088 -5.482 1.00 10.00 C ATOM 1421 C GLU A 90 -2.224 -1.392 -5.341 1.00 10.00 C ATOM 1422 O GLU A 90 -2.777 -2.129 -4.524 1.00 10.00 O ATOM 1423 CB GLU A 90 -3.636 0.280 -6.631 1.00 10.00 C ATOM 1424 CG GLU A 90 -4.208 1.710 -6.684 1.00 10.00 C ATOM 1425 CD GLU A 90 -4.779 2.031 -8.066 1.00 10.00 C ATOM 1426 OE1 GLU A 90 -5.882 1.527 -8.377 1.00 10.00 O ATOM 1427 OE2 GLU A 90 -4.095 2.752 -8.831 1.00 10.00 O ATOM 0 H GLU A 90 -1.567 1.451 -6.641 1.00 10.00 H new ATOM 0 HA GLU A 90 -3.080 0.365 -4.528 1.00 10.00 H new ATOM 0 HB2 GLU A 90 -3.147 0.053 -7.578 1.00 10.00 H new ATOM 0 HB3 GLU A 90 -4.454 -0.431 -6.516 1.00 10.00 H new ATOM 0 HG2 GLU A 90 -4.989 1.819 -5.931 1.00 10.00 H new ATOM 0 HG3 GLU A 90 -3.425 2.426 -6.437 1.00 10.00 H new ATOM 1434 N ARG A 91 -1.201 -1.802 -6.104 1.00 10.00 N ATOM 1435 CA ARG A 91 -0.532 -3.106 -6.057 1.00 10.00 C ATOM 1436 C ARG A 91 0.134 -3.374 -4.704 1.00 10.00 C ATOM 1437 O ARG A 91 0.024 -4.490 -4.193 1.00 10.00 O ATOM 1438 CB ARG A 91 0.474 -3.145 -7.224 1.00 10.00 C ATOM 1439 CG ARG A 91 1.561 -4.227 -7.197 1.00 10.00 C ATOM 1440 CD ARG A 91 1.046 -5.638 -7.461 1.00 10.00 C ATOM 1441 NE ARG A 91 0.528 -6.324 -6.261 1.00 10.00 N ATOM 1442 CZ ARG A 91 0.485 -7.641 -6.133 1.00 10.00 C ATOM 1443 NH1 ARG A 91 1.126 -8.449 -6.930 1.00 10.00 N ATOM 1444 NH2 ARG A 91 -0.212 -8.213 -5.187 1.00 10.00 N ATOM 0 H ARG A 91 -0.795 -1.193 -6.814 1.00 10.00 H new ATOM 0 HA ARG A 91 -1.265 -3.906 -6.166 1.00 10.00 H new ATOM 0 HB2 ARG A 91 -0.091 -3.261 -8.149 1.00 10.00 H new ATOM 0 HB3 ARG A 91 0.969 -2.175 -7.272 1.00 10.00 H new ATOM 0 HG2 ARG A 91 2.319 -3.984 -7.942 1.00 10.00 H new ATOM 0 HG3 ARG A 91 2.053 -4.208 -6.224 1.00 10.00 H new ATOM 0 HD2 ARG A 91 0.255 -5.591 -8.209 1.00 10.00 H new ATOM 0 HD3 ARG A 91 1.853 -6.234 -7.887 1.00 10.00 H new ATOM 0 HE ARG A 91 0.185 -5.753 -5.489 1.00 10.00 H new ATOM 0 HH11 ARG A 91 1.691 -8.073 -7.691 1.00 10.00 H new ATOM 0 HH12 ARG A 91 1.063 -9.458 -6.792 1.00 10.00 H new ATOM 0 HH21 ARG A 91 -0.739 -7.643 -4.526 1.00 10.00 H new ATOM 0 HH22 ARG A 91 -0.229 -9.230 -5.110 1.00 10.00 H new ATOM 1458 N GLU A 92 0.829 -2.378 -4.148 1.00 10.00 N ATOM 1459 CA GLU A 92 1.429 -2.418 -2.809 1.00 10.00 C ATOM 1460 C GLU A 92 0.347 -2.345 -1.734 1.00 10.00 C ATOM 1461 O GLU A 92 0.418 -3.058 -0.736 1.00 10.00 O ATOM 1462 CB GLU A 92 2.342 -1.211 -2.599 1.00 10.00 C ATOM 1463 CG GLU A 92 3.466 -1.001 -3.617 1.00 10.00 C ATOM 1464 CD GLU A 92 3.938 0.461 -3.633 1.00 10.00 C ATOM 1465 OE1 GLU A 92 3.603 1.207 -2.678 1.00 10.00 O ATOM 1466 OE2 GLU A 92 4.595 0.809 -4.644 1.00 10.00 O ATOM 0 H GLU A 92 0.995 -1.495 -4.630 1.00 10.00 H new ATOM 0 HA GLU A 92 1.989 -3.350 -2.733 1.00 10.00 H new ATOM 0 HB2 GLU A 92 1.721 -0.315 -2.591 1.00 10.00 H new ATOM 0 HB3 GLU A 92 2.793 -1.296 -1.610 1.00 10.00 H new ATOM 0 HG2 GLU A 92 4.305 -1.654 -3.376 1.00 10.00 H new ATOM 0 HG3 GLU A 92 3.118 -1.284 -4.610 1.00 10.00 H new ATOM 1473 N ASP A 93 -0.635 -1.456 -1.925 1.00 10.00 N ATOM 1474 CA ASP A 93 -1.717 -1.203 -0.986 1.00 10.00 C ATOM 1475 C ASP A 93 -2.502 -2.491 -0.717 1.00 10.00 C ATOM 1476 O ASP A 93 -2.731 -2.842 0.435 1.00 10.00 O ATOM 1477 CB ASP A 93 -2.610 -0.071 -1.515 1.00 10.00 C ATOM 1478 CG ASP A 93 -1.914 1.277 -1.709 1.00 10.00 C ATOM 1479 OD1 ASP A 93 -0.973 1.564 -0.934 1.00 10.00 O ATOM 1480 OD2 ASP A 93 -2.349 2.033 -2.607 1.00 10.00 O ATOM 0 H ASP A 93 -0.694 -0.879 -2.764 1.00 10.00 H new ATOM 0 HA ASP A 93 -1.306 -0.877 -0.030 1.00 10.00 H new ATOM 0 HB2 ASP A 93 -3.035 -0.382 -2.469 1.00 10.00 H new ATOM 0 HB3 ASP A 93 -3.442 0.065 -0.825 1.00 10.00 H new ATOM 1485 N LEU A 94 -2.817 -3.269 -1.758 1.00 10.00 N ATOM 1486 CA LEU A 94 -3.403 -4.603 -1.616 1.00 10.00 C ATOM 1487 C LEU A 94 -2.626 -5.532 -0.692 1.00 10.00 C ATOM 1488 O LEU A 94 -3.222 -6.203 0.150 1.00 10.00 O ATOM 1489 CB LEU A 94 -3.484 -5.261 -3.003 1.00 10.00 C ATOM 1490 CG LEU A 94 -4.910 -5.610 -3.420 1.00 10.00 C ATOM 1491 CD1 LEU A 94 -5.730 -4.341 -3.627 1.00 10.00 C ATOM 1492 CD2 LEU A 94 -4.795 -6.399 -4.718 1.00 10.00 C ATOM 0 H LEU A 94 -2.671 -2.988 -2.728 1.00 10.00 H new ATOM 0 HA LEU A 94 -4.385 -4.458 -1.166 1.00 10.00 H new ATOM 0 HB2 LEU A 94 -3.050 -4.589 -3.743 1.00 10.00 H new ATOM 0 HB3 LEU A 94 -2.880 -6.168 -3.004 1.00 10.00 H new ATOM 0 HG LEU A 94 -5.418 -6.194 -2.652 1.00 10.00 H new ATOM 0 HD11 LEU A 94 -6.744 -4.608 -3.924 1.00 10.00 H new ATOM 0 HD12 LEU A 94 -5.762 -3.773 -2.697 1.00 10.00 H new ATOM 0 HD13 LEU A 94 -5.271 -3.734 -4.408 1.00 10.00 H new ATOM 0 HD21 LEU A 94 -5.790 -6.677 -5.064 1.00 10.00 H new ATOM 0 HD22 LEU A 94 -4.305 -5.786 -5.474 1.00 10.00 H new ATOM 0 HD23 LEU A 94 -4.207 -7.300 -4.545 1.00 10.00 H new ATOM 1504 N ILE A 95 -1.307 -5.596 -0.881 1.00 10.00 N ATOM 1505 CA ILE A 95 -0.425 -6.425 -0.068 1.00 10.00 C ATOM 1506 C ILE A 95 -0.433 -5.909 1.371 1.00 10.00 C ATOM 1507 O ILE A 95 -0.649 -6.693 2.292 1.00 10.00 O ATOM 1508 CB ILE A 95 0.980 -6.480 -0.704 1.00 10.00 C ATOM 1509 CG1 ILE A 95 0.927 -7.215 -2.060 1.00 10.00 C ATOM 1510 CG2 ILE A 95 2.029 -7.099 0.237 1.00 10.00 C ATOM 1511 CD1 ILE A 95 0.568 -8.710 -1.989 1.00 10.00 C ATOM 0 H ILE A 95 -0.821 -5.070 -1.607 1.00 10.00 H new ATOM 0 HA ILE A 95 -0.780 -7.455 -0.034 1.00 10.00 H new ATOM 0 HB ILE A 95 1.301 -5.453 -0.880 1.00 10.00 H new ATOM 0 HG12 ILE A 95 0.198 -6.714 -2.697 1.00 10.00 H new ATOM 0 HG13 ILE A 95 1.897 -7.115 -2.546 1.00 10.00 H new ATOM 0 HG21 ILE A 95 2.999 -7.114 -0.259 1.00 10.00 H new ATOM 0 HG22 ILE A 95 2.096 -6.504 1.148 1.00 10.00 H new ATOM 0 HG23 ILE A 95 1.735 -8.118 0.490 1.00 10.00 H new ATOM 0 HD11 ILE A 95 0.558 -9.130 -2.995 1.00 10.00 H new ATOM 0 HD12 ILE A 95 1.308 -9.234 -1.384 1.00 10.00 H new ATOM 0 HD13 ILE A 95 -0.417 -8.827 -1.538 1.00 10.00 H new ATOM 1523 N ALA A 96 -0.287 -4.593 1.557 1.00 10.00 N ATOM 1524 CA ALA A 96 -0.309 -3.953 2.872 1.00 10.00 C ATOM 1525 C ALA A 96 -1.643 -4.169 3.604 1.00 10.00 C ATOM 1526 O ALA A 96 -1.655 -4.405 4.812 1.00 10.00 O ATOM 1527 CB ALA A 96 0.016 -2.467 2.698 1.00 10.00 C ATOM 0 H ALA A 96 -0.149 -3.937 0.788 1.00 10.00 H new ATOM 0 HA ALA A 96 0.447 -4.416 3.505 1.00 10.00 H new ATOM 0 HB1 ALA A 96 0.003 -1.975 3.671 1.00 10.00 H new ATOM 0 HB2 ALA A 96 1.004 -2.361 2.250 1.00 10.00 H new ATOM 0 HB3 ALA A 96 -0.728 -2.005 2.049 1.00 10.00 H new ATOM 1533 N TYR A 97 -2.760 -4.149 2.868 1.00 10.00 N ATOM 1534 CA TYR A 97 -4.081 -4.517 3.359 1.00 10.00 C ATOM 1535 C TYR A 97 -4.159 -5.994 3.741 1.00 10.00 C ATOM 1536 O TYR A 97 -4.395 -6.309 4.907 1.00 10.00 O ATOM 1537 CB TYR A 97 -5.129 -4.118 2.310 1.00 10.00 C ATOM 1538 CG TYR A 97 -6.462 -4.834 2.398 1.00 10.00 C ATOM 1539 CD1 TYR A 97 -7.167 -4.901 3.615 1.00 10.00 C ATOM 1540 CD2 TYR A 97 -6.973 -5.479 1.258 1.00 10.00 C ATOM 1541 CE1 TYR A 97 -8.398 -5.580 3.674 1.00 10.00 C ATOM 1542 CE2 TYR A 97 -8.170 -6.208 1.340 1.00 10.00 C ATOM 1543 CZ TYR A 97 -8.903 -6.239 2.540 1.00 10.00 C ATOM 1544 OH TYR A 97 -10.079 -6.912 2.609 1.00 10.00 O ATOM 0 H TYR A 97 -2.764 -3.868 1.888 1.00 10.00 H new ATOM 0 HA TYR A 97 -4.288 -3.973 4.281 1.00 10.00 H new ATOM 0 HB2 TYR A 97 -5.308 -3.046 2.394 1.00 10.00 H new ATOM 0 HB3 TYR A 97 -4.709 -4.294 1.320 1.00 10.00 H new ATOM 0 HD1 TYR A 97 -6.764 -4.433 4.501 1.00 10.00 H new ATOM 0 HD2 TYR A 97 -6.444 -5.414 0.319 1.00 10.00 H new ATOM 0 HE1 TYR A 97 -8.959 -5.595 4.597 1.00 10.00 H new ATOM 0 HE2 TYR A 97 -8.530 -6.748 0.477 1.00 10.00 H new ATOM 0 HH TYR A 97 -10.281 -7.308 1.736 1.00 10.00 H new ATOM 1554 N LEU A 98 -3.982 -6.908 2.783 1.00 10.00 N ATOM 1555 CA LEU A 98 -4.231 -8.328 3.016 1.00 10.00 C ATOM 1556 C LEU A 98 -3.262 -8.931 4.037 1.00 10.00 C ATOM 1557 O LEU A 98 -3.702 -9.738 4.849 1.00 10.00 O ATOM 1558 CB LEU A 98 -4.241 -9.086 1.680 1.00 10.00 C ATOM 1559 CG LEU A 98 -5.469 -8.717 0.823 1.00 10.00 C ATOM 1560 CD1 LEU A 98 -5.280 -9.163 -0.622 1.00 10.00 C ATOM 1561 CD2 LEU A 98 -6.763 -9.334 1.369 1.00 10.00 C ATOM 0 H LEU A 98 -3.667 -6.687 1.839 1.00 10.00 H new ATOM 0 HA LEU A 98 -5.218 -8.433 3.465 1.00 10.00 H new ATOM 0 HB2 LEU A 98 -3.330 -8.859 1.126 1.00 10.00 H new ATOM 0 HB3 LEU A 98 -4.240 -10.159 1.871 1.00 10.00 H new ATOM 0 HG LEU A 98 -5.558 -7.631 0.865 1.00 10.00 H new ATOM 0 HD11 LEU A 98 -6.160 -8.891 -1.205 1.00 10.00 H new ATOM 0 HD12 LEU A 98 -4.401 -8.674 -1.042 1.00 10.00 H new ATOM 0 HD13 LEU A 98 -5.144 -10.244 -0.654 1.00 10.00 H new ATOM 0 HD21 LEU A 98 -7.600 -9.046 0.733 1.00 10.00 H new ATOM 0 HD22 LEU A 98 -6.672 -10.420 1.380 1.00 10.00 H new ATOM 0 HD23 LEU A 98 -6.938 -8.975 2.383 1.00 10.00 H new ATOM 1573 N LYS A 99 -2.003 -8.463 4.096 1.00 10.00 N ATOM 1574 CA LYS A 99 -1.014 -8.844 5.122 1.00 10.00 C ATOM 1575 C LYS A 99 -1.432 -8.445 6.549 1.00 10.00 C ATOM 1576 O LYS A 99 -0.879 -8.966 7.520 1.00 10.00 O ATOM 1577 CB LYS A 99 0.348 -8.244 4.722 1.00 10.00 C ATOM 1578 CG LYS A 99 1.568 -8.641 5.569 1.00 10.00 C ATOM 1579 CD LYS A 99 1.806 -10.158 5.626 1.00 10.00 C ATOM 1580 CE LYS A 99 3.242 -10.471 6.067 1.00 10.00 C ATOM 1581 NZ LYS A 99 4.182 -10.407 4.923 1.00 10.00 N ATOM 0 H LYS A 99 -1.636 -7.795 3.418 1.00 10.00 H new ATOM 0 HA LYS A 99 -0.944 -9.931 5.156 1.00 10.00 H new ATOM 0 HB2 LYS A 99 0.550 -8.524 3.688 1.00 10.00 H new ATOM 0 HB3 LYS A 99 0.259 -7.158 4.747 1.00 10.00 H new ATOM 0 HG2 LYS A 99 2.456 -8.157 5.162 1.00 10.00 H new ATOM 0 HG3 LYS A 99 1.435 -8.264 6.583 1.00 10.00 H new ATOM 0 HD2 LYS A 99 1.100 -10.615 6.320 1.00 10.00 H new ATOM 0 HD3 LYS A 99 1.619 -10.597 4.646 1.00 10.00 H new ATOM 0 HE2 LYS A 99 3.552 -9.762 6.835 1.00 10.00 H new ATOM 0 HE3 LYS A 99 3.279 -11.464 6.516 1.00 10.00 H new ATOM 0 HZ1 LYS A 99 4.666 -11.322 4.820 1.00 10.00 H new ATOM 0 HZ2 LYS A 99 3.655 -10.194 4.052 1.00 10.00 H new ATOM 0 HZ3 LYS A 99 4.886 -9.660 5.093 1.00 10.00 H new ATOM 1595 N LYS A 100 -2.439 -7.570 6.688 1.00 10.00 N ATOM 1596 CA LYS A 100 -3.207 -7.381 7.920 1.00 10.00 C ATOM 1597 C LYS A 100 -4.486 -8.211 7.898 1.00 10.00 C ATOM 1598 O LYS A 100 -4.625 -9.086 8.741 1.00 10.00 O ATOM 1599 CB LYS A 100 -3.468 -5.883 8.193 1.00 10.00 C ATOM 1600 CG LYS A 100 -2.198 -5.142 8.650 1.00 10.00 C ATOM 1601 CD LYS A 100 -1.807 -5.529 10.085 1.00 10.00 C ATOM 1602 CE LYS A 100 -0.341 -5.224 10.397 1.00 10.00 C ATOM 1603 NZ LYS A 100 0.100 -6.003 11.577 1.00 10.00 N ATOM 0 H LYS A 100 -2.746 -6.963 5.928 1.00 10.00 H new ATOM 0 HA LYS A 100 -2.612 -7.746 8.757 1.00 10.00 H new ATOM 0 HB2 LYS A 100 -3.854 -5.413 7.289 1.00 10.00 H new ATOM 0 HB3 LYS A 100 -4.239 -5.784 8.958 1.00 10.00 H new ATOM 0 HG2 LYS A 100 -1.376 -5.374 7.973 1.00 10.00 H new ATOM 0 HG3 LYS A 100 -2.363 -4.066 8.594 1.00 10.00 H new ATOM 0 HD2 LYS A 100 -2.444 -4.992 10.788 1.00 10.00 H new ATOM 0 HD3 LYS A 100 -1.993 -6.593 10.234 1.00 10.00 H new ATOM 0 HE2 LYS A 100 0.281 -5.469 9.536 1.00 10.00 H new ATOM 0 HE3 LYS A 100 -0.216 -4.158 10.587 1.00 10.00 H new ATOM 0 HZ1 LYS A 100 1.087 -5.764 11.802 1.00 10.00 H new ATOM 0 HZ2 LYS A 100 -0.506 -5.774 12.391 1.00 10.00 H new ATOM 0 HZ3 LYS A 100 0.029 -7.019 11.368 1.00 10.00 H new ATOM 1617 N ALA A 101 -5.379 -8.017 6.927 1.00 10.00 N ATOM 1618 CA ALA A 101 -6.732 -8.584 6.949 1.00 10.00 C ATOM 1619 C ALA A 101 -6.831 -10.121 7.034 1.00 10.00 C ATOM 1620 O ALA A 101 -7.882 -10.639 7.408 1.00 10.00 O ATOM 1621 CB ALA A 101 -7.499 -8.043 5.745 1.00 10.00 C ATOM 0 H ALA A 101 -5.184 -7.458 6.096 1.00 10.00 H new ATOM 0 HA ALA A 101 -7.179 -8.263 7.890 1.00 10.00 H new ATOM 0 HB1 ALA A 101 -8.509 -8.453 5.743 1.00 10.00 H new ATOM 0 HB2 ALA A 101 -7.549 -6.956 5.804 1.00 10.00 H new ATOM 0 HB3 ALA A 101 -6.988 -8.333 4.827 1.00 10.00 H new ATOM 1627 N THR A 102 -5.756 -10.864 6.749 1.00 10.00 N ATOM 1628 CA THR A 102 -5.657 -12.308 7.026 1.00 10.00 C ATOM 1629 C THR A 102 -5.439 -12.669 8.506 1.00 10.00 C ATOM 1630 O THR A 102 -5.441 -13.851 8.842 1.00 10.00 O ATOM 1631 CB THR A 102 -4.563 -12.952 6.158 1.00 10.00 C ATOM 1632 OG1 THR A 102 -3.328 -12.265 6.207 1.00 10.00 O ATOM 1633 CG2 THR A 102 -5.023 -12.952 4.695 1.00 10.00 C ATOM 0 H THR A 102 -4.918 -10.478 6.314 1.00 10.00 H new ATOM 0 HA THR A 102 -6.634 -12.714 6.766 1.00 10.00 H new ATOM 0 HB THR A 102 -4.410 -13.957 6.552 1.00 10.00 H new ATOM 0 HG1 THR A 102 -3.006 -12.236 7.132 1.00 10.00 H new ATOM 0 HG21 THR A 102 -4.253 -13.407 4.072 1.00 10.00 H new ATOM 0 HG22 THR A 102 -5.947 -13.522 4.604 1.00 10.00 H new ATOM 0 HG23 THR A 102 -5.196 -11.927 4.368 1.00 10.00 H new ATOM 1641 N ASN A 103 -5.266 -11.676 9.388 1.00 10.00 N ATOM 1642 CA ASN A 103 -4.790 -11.820 10.768 1.00 10.00 C ATOM 1643 C ASN A 103 -5.274 -10.712 11.731 1.00 10.00 C ATOM 1644 O ASN A 103 -5.314 -10.964 12.934 1.00 10.00 O ATOM 1645 CB ASN A 103 -3.237 -11.905 10.782 1.00 10.00 C ATOM 1646 CG ASN A 103 -2.501 -11.159 9.667 1.00 10.00 C ATOM 1647 OD1 ASN A 103 -2.505 -11.591 8.519 1.00 10.00 O ATOM 1648 ND2 ASN A 103 -1.799 -10.070 9.929 1.00 10.00 N ATOM 0 H ASN A 103 -5.464 -10.705 9.146 1.00 10.00 H new ATOM 0 HA ASN A 103 -5.229 -12.744 11.143 1.00 10.00 H new ATOM 0 HB2 ASN A 103 -2.883 -11.522 11.739 1.00 10.00 H new ATOM 0 HB3 ASN A 103 -2.953 -12.956 10.734 1.00 10.00 H new ATOM 0 HD21 ASN A 103 -1.277 -9.609 9.184 1.00 10.00 H new ATOM 0 HD22 ASN A 103 -1.780 -9.691 10.876 1.00 10.00 H new ATOM 1655 N GLU A 104 -5.664 -9.527 11.239 1.00 10.00 N ATOM 1656 CA GLU A 104 -5.777 -8.258 11.977 1.00 10.00 C ATOM 1657 C GLU A 104 -6.668 -7.257 11.222 1.00 10.00 C ATOM 1658 O GLU A 104 -7.549 -6.679 11.892 1.00 10.00 O ATOM 1659 CB GLU A 104 -4.380 -7.616 12.099 1.00 10.00 C ATOM 1660 CG GLU A 104 -3.388 -8.309 13.045 1.00 10.00 C ATOM 1661 CD GLU A 104 -1.983 -7.752 12.820 1.00 10.00 C ATOM 1662 OE1 GLU A 104 -1.639 -6.691 13.395 1.00 10.00 O ATOM 1663 OE2 GLU A 104 -1.245 -8.314 11.968 1.00 10.00 O ATOM 1664 OXT GLU A 104 -6.446 -7.073 10.002 1.00 10.00 O ATOM 0 H GLU A 104 -5.924 -9.421 10.258 1.00 10.00 H new ATOM 0 HA GLU A 104 -6.208 -8.477 12.954 1.00 10.00 H new ATOM 0 HB2 GLU A 104 -3.934 -7.578 11.105 1.00 10.00 H new ATOM 0 HB3 GLU A 104 -4.506 -6.586 12.432 1.00 10.00 H new ATOM 0 HG2 GLU A 104 -3.689 -8.153 14.081 1.00 10.00 H new ATOM 0 HG3 GLU A 104 -3.395 -9.385 12.870 1.00 10.00 H new TER 1671 GLU A 104 HETATM 1672 FE HEC A 105 -9.099 -13.125 -7.627 1.00 10.00 FE HETATM 1673 CHA HEC A 105 -8.205 -16.386 -6.918 1.00 10.00 C HETATM 1674 CHB HEC A 105 -6.964 -12.054 -5.251 1.00 10.00 C HETATM 1675 CHC HEC A 105 -9.893 -9.958 -8.435 1.00 10.00 C HETATM 1676 CHD HEC A 105 -11.511 -14.272 -9.709 1.00 10.00 C HETATM 1677 NA HEC A 105 -7.836 -14.044 -6.357 1.00 10.00 N HETATM 1678 C1A HEC A 105 -7.589 -15.395 -6.176 1.00 10.00 C HETATM 1679 C2A HEC A 105 -6.571 -15.620 -5.150 1.00 10.00 C HETATM 1680 C3A HEC A 105 -6.155 -14.381 -4.775 1.00 10.00 C HETATM 1681 C4A HEC A 105 -6.997 -13.419 -5.472 1.00 10.00 C HETATM 1682 CMA HEC A 105 -5.041 -14.016 -3.821 1.00 10.00 C HETATM 1683 CAA HEC A 105 -6.034 -16.965 -4.661 1.00 10.00 C HETATM 1684 CBA HEC A 105 -7.065 -17.909 -3.998 1.00 10.00 C HETATM 1685 CGA HEC A 105 -6.473 -19.114 -3.256 1.00 10.00 C HETATM 1686 O1A HEC A 105 -6.016 -20.061 -3.936 1.00 10.00 O HETATM 1687 O2A HEC A 105 -6.437 -19.068 -2.007 1.00 10.00 O HETATM 1688 NB HEC A 105 -8.591 -11.370 -6.941 1.00 10.00 N HETATM 1689 C1B HEC A 105 -7.727 -11.107 -5.913 1.00 10.00 C HETATM 1690 C2B HEC A 105 -7.662 -9.682 -5.645 1.00 10.00 C HETATM 1691 C3B HEC A 105 -8.428 -9.062 -6.594 1.00 10.00 C HETATM 1692 C4B HEC A 105 -9.001 -10.135 -7.393 1.00 10.00 C HETATM 1693 CMB HEC A 105 -6.811 -9.092 -4.544 1.00 10.00 C HETATM 1694 CAB HEC A 105 -8.633 -7.569 -6.855 1.00 10.00 C HETATM 1695 CBB HEC A 105 -7.469 -7.001 -7.671 1.00 10.00 C HETATM 1696 NC HEC A 105 -10.512 -12.302 -8.683 1.00 10.00 N HETATM 1697 C1C HEC A 105 -10.651 -10.969 -8.986 1.00 10.00 C HETATM 1698 C2C HEC A 105 -11.818 -10.735 -9.814 1.00 10.00 C HETATM 1699 C3C HEC A 105 -12.431 -11.940 -9.942 1.00 10.00 C HETATM 1700 C4C HEC A 105 -11.496 -12.921 -9.415 1.00 10.00 C HETATM 1701 CMC HEC A 105 -12.300 -9.368 -10.251 1.00 10.00 C HETATM 1702 CAC HEC A 105 -13.825 -12.245 -10.461 1.00 10.00 C HETATM 1703 CBC HEC A 105 -13.963 -12.088 -11.983 1.00 10.00 C HETATM 1704 ND HEC A 105 -9.737 -14.942 -8.175 1.00 10.00 N HETATM 1705 C1D HEC A 105 -10.648 -15.209 -9.175 1.00 10.00 C HETATM 1706 C2D HEC A 105 -10.576 -16.606 -9.586 1.00 10.00 C HETATM 1707 C3D HEC A 105 -9.777 -17.227 -8.688 1.00 10.00 C HETATM 1708 C4D HEC A 105 -9.198 -16.177 -7.861 1.00 10.00 C HETATM 1709 CMD HEC A 105 -11.245 -17.244 -10.784 1.00 10.00 C HETATM 1710 CAD HEC A 105 -9.430 -18.704 -8.638 1.00 10.00 C HETATM 1711 CBD HEC A 105 -7.985 -19.009 -9.094 1.00 10.00 C HETATM 1712 CGD HEC A 105 -7.803 -19.907 -10.317 1.00 10.00 C HETATM 1713 O1D HEC A 105 -8.793 -20.383 -10.919 1.00 10.00 O HETATM 1714 O2D HEC A 105 -6.615 -20.228 -10.541 1.00 10.00 O HETATM 0 HMD3 HEC A 105 -12.326 -17.127 -10.703 1.00 10.00 H new HETATM 0 HMD2 HEC A 105 -10.895 -16.761 -11.696 1.00 10.00 H new HETATM 0 HMD1 HEC A 105 -10.997 -18.305 -10.817 1.00 10.00 H new HETATM 0 HMC3 HEC A 105 -12.533 -8.766 -9.372 1.00 10.00 H new HETATM 0 HMC2 HEC A 105 -11.520 -8.876 -10.831 1.00 10.00 H new HETATM 0 HMC1 HEC A 105 -13.195 -9.477 -10.864 1.00 10.00 H new HETATM 0 HMB3 HEC A 105 -7.128 -9.497 -3.583 1.00 10.00 H new HETATM 0 HMB2 HEC A 105 -5.765 -9.345 -4.717 1.00 10.00 H new HETATM 0 HMB1 HEC A 105 -6.925 -8.008 -4.537 1.00 10.00 H new HETATM 0 HMA3 HEC A 105 -5.251 -14.438 -2.838 1.00 10.00 H new HETATM 0 HMA2 HEC A 105 -4.098 -14.415 -4.194 1.00 10.00 H new HETATM 0 HMA1 HEC A 105 -4.970 -12.931 -3.742 1.00 10.00 H new HETATM 0 HBD2 HEC A 105 -7.490 -18.060 -9.298 1.00 10.00 H new HETATM 0 HBD1 HEC A 105 -7.459 -19.470 -8.258 1.00 10.00 H new HETATM 0 HBC3 HEC A 105 -13.728 -11.062 -12.266 1.00 10.00 H new HETATM 0 HBC2 HEC A 105 -13.274 -12.769 -12.483 1.00 10.00 H new HETATM 0 HBC1 HEC A 105 -14.985 -12.322 -12.282 1.00 10.00 H new HETATM 0 HBB3 HEC A 105 -6.538 -7.139 -7.121 1.00 10.00 H new HETATM 0 HBB2 HEC A 105 -7.407 -7.521 -8.627 1.00 10.00 H new HETATM 0 HBB1 HEC A 105 -7.633 -5.938 -7.847 1.00 10.00 H new HETATM 0 HBA2 HEC A 105 -7.663 -17.329 -3.295 1.00 10.00 H new HETATM 0 HBA1 HEC A 105 -7.744 -18.276 -4.768 1.00 10.00 H new HETATM 0 HAD2 HEC A 105 -9.566 -19.068 -7.620 1.00 10.00 H new HETATM 0 HAD1 HEC A 105 -10.127 -19.255 -9.269 1.00 10.00 H new HETATM 0 HAA2 HEC A 105 -5.588 -17.485 -5.509 1.00 10.00 H new HETATM 0 HAA1 HEC A 105 -5.233 -16.775 -3.946 1.00 10.00 H new HETATM 0 HHD HEC A 105 -12.261 -14.625 -10.416 1.00 10.00 H new HETATM 0 HHC HEC A 105 -10.004 -8.955 -8.847 1.00 10.00 H new HETATM 0 HHB HEC A 105 -6.276 -11.691 -4.487 1.00 10.00 H new HETATM 0 HHA HEC A 105 -7.884 -17.413 -6.747 1.00 10.00 H new HETATM 0 H2D HEC A 105 -6.590 -20.936 -11.218 1.00 10.00 H new HETATM 0 H2A HEC A 105 -5.558 -18.745 -1.717 1.00 10.00 H new