USER MOD reduce.3.24.130724 H: found=0, std=0, add=1110, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1105 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 87 GLN : amide:sc= 0.252 K(o=1.4,f=0.87) USER MOD Set 1.2: A 150 THR OG1 : rot 133:sc= 1.17 USER MOD Set 2.1: A 124 TYR OH : rot 129:sc= 0.027 USER MOD Set 2.2: A 129 GLN : amide:sc= 0.0491 K(o=0.076,f=-1) USER MOD Set 3.1: A 77 SER OG : rot -102:sc= 1.66 USER MOD Set 3.2: A 110 GLN : amide:sc= -5.51! C(o=-3.8!,f=-7!) USER MOD Set 4.1: A 50 THR OG1 : rot 11:sc= 1.31 USER MOD Set 4.2: A 61 LYS NZ :NH3+ -153:sc= 2.4 (180deg=0.781) USER MOD Set 4.3: A 75 THR OG1 : rot -94:sc= -1.82! USER MOD Set 5.1: A 19 SER OG : rot -142:sc= 2.06 USER MOD Set 5.2: A 47 THR OG1 : rot -60:sc= -1.68! USER MOD Set 5.3: A 48 HIS : no HE2:sc= -0.0448 K(o=0.34,f=-9!) USER MOD Set 6.1: A 23 THR OG1 : rot 140:sc= 1.04 USER MOD Set 6.2: A 57 MET CE :methyl 170:sc= 0 (180deg=0) USER MOD Set 6.3: A 59 HIS : no HE2:sc= 0.691 K(o=1.7,f=-7.6!) USER MOD Set 7.1: A 13 HIS : no HD1:sc= -7.24! C(o=-9.4!,f=-9.2!) USER MOD Set 7.2: A 103 THR OG1 : rot 139:sc= 1.12 USER MOD Set 7.3: A 105 GLN : amide:sc= -3.33! K(o=-9.4!,f=-12) USER MOD Single : A 1 SER N :NH3+ -142:sc= 0.0279 (180deg=0) USER MOD Single : A 1 SER OG : rot 144:sc= 1.36 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 LYS NZ :NH3+ -153:sc= -5.53! (180deg=-6!) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 16:sc= 0.914 USER MOD Single : A 16 ASN : amide:sc= -1.49! C(o=-1.5!,f=-3.7!) USER MOD Single : A 17 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00384) USER MOD Single : A 32 SER OG : rot -158:sc= 0.267 USER MOD Single : A 35 GLN : amide:sc= -3.59! K(o=-3.6!,f=-1.4) USER MOD Single : A 39 GLN : amide:sc=-0.00851 K(o=-0.0085,f=-0.52) USER MOD Single : A 41 LYS NZ :NH3+ 151:sc= 1.39 (180deg=1.11) USER MOD Single : A 51 TYR OH : rot 55:sc= -1.46! USER MOD Single : A 52 ASN : amide:sc= 0.0308 K(o=0.031,f=-9.3!) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 158:sc= 1.25 (180deg=1.23) USER MOD Single : A 64 LYS NZ :NH3+ 164:sc= 1.33 (180deg=1.13) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ 153:sc= 1.24 (180deg=1.17) USER MOD Single : A 79 SER OG : rot -40:sc= -2.14 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 88 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 90 SER OG : rot 180:sc= -0.132 USER MOD Single : A 91 TYR OH : rot 24:sc= -0.267 USER MOD Single : A 98 MET CE :methyl -167:sc= -0.461 (180deg=-1.18) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 MET CE :methyl 167:sc= -0.75 (180deg=-1.67) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot -111:sc= 0.387 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 100:sc= -0.121 USER MOD Single : A 125 ASN : amide:sc= -3.07! K(o=-3.1!,f=-0.58) USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 THR OG1 : rot -41:sc= -0.0813 USER MOD Single : A 134 LYS NZ :NH3+ -134:sc= 0.893! (180deg=0.356) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 142 LYS NZ :NH3+ -156:sc= 1.3 (180deg=0.945) USER MOD Single : A 151 SER OG : rot -34:sc= -2.09! USER MOD Single : A 154 LYS NZ :NH3+ -170:sc= -0.0137 (180deg=-0.158) USER MOD Single : A 155 GLN : amide:sc= 0.001 K(o=0.001,f=-0.65) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 26.184 2.969 11.893 1.00 3.53 N ATOM 2 CA SER A 1 24.796 3.242 11.480 1.00 2.82 C ATOM 3 C SER A 1 23.977 1.958 11.513 1.00 1.84 C ATOM 4 O SER A 1 24.484 0.879 11.197 1.00 1.68 O ATOM 5 CB SER A 1 24.782 3.852 10.075 1.00 3.37 C ATOM 6 OG SER A 1 25.500 3.045 9.154 1.00 4.10 O ATOM 0 H1 SER A 1 26.537 3.761 12.468 1.00 3.53 H new ATOM 0 H2 SER A 1 26.214 2.094 12.454 1.00 3.53 H new ATOM 0 H3 SER A 1 26.782 2.860 11.049 1.00 3.53 H new ATOM 0 HA SER A 1 24.350 3.953 12.175 1.00 2.82 H new ATOM 0 HB2 SER A 1 23.752 3.966 9.736 1.00 3.37 H new ATOM 0 HB3 SER A 1 25.220 4.850 10.105 1.00 3.37 H new ATOM 0 HG SER A 1 25.051 3.064 8.283 1.00 4.10 H new ATOM 14 N SER A 2 22.715 2.070 11.900 1.00 1.72 N ATOM 15 CA SER A 2 21.842 0.914 11.988 1.00 1.06 C ATOM 16 C SER A 2 21.247 0.605 10.619 1.00 0.92 C ATOM 17 O SER A 2 20.065 0.833 10.378 1.00 1.65 O ATOM 18 CB SER A 2 20.729 1.163 13.011 1.00 1.60 C ATOM 19 OG SER A 2 19.991 -0.021 13.272 1.00 2.37 O ATOM 0 H SER A 2 22.274 2.953 12.158 1.00 1.72 H new ATOM 0 HA SER A 2 22.427 0.056 12.318 1.00 1.06 H new ATOM 0 HB2 SER A 2 21.163 1.535 13.939 1.00 1.60 H new ATOM 0 HB3 SER A 2 20.058 1.937 12.640 1.00 1.60 H new ATOM 0 HG SER A 2 19.289 0.169 13.929 1.00 2.37 H new ATOM 25 N GLU A 3 22.078 0.098 9.719 1.00 0.72 N ATOM 26 CA GLU A 3 21.637 -0.237 8.371 1.00 0.65 C ATOM 27 C GLU A 3 21.891 -1.712 8.078 1.00 0.56 C ATOM 28 O GLU A 3 22.933 -2.077 7.530 1.00 0.70 O ATOM 29 CB GLU A 3 22.350 0.648 7.346 1.00 1.06 C ATOM 30 CG GLU A 3 22.122 2.136 7.569 1.00 1.63 C ATOM 31 CD GLU A 3 22.913 3.001 6.613 1.00 1.81 C ATOM 32 OE1 GLU A 3 24.138 3.153 6.813 1.00 2.08 O ATOM 33 OE2 GLU A 3 22.312 3.529 5.652 1.00 2.19 O ATOM 0 H GLU A 3 23.064 -0.091 9.898 1.00 0.72 H new ATOM 0 HA GLU A 3 20.565 -0.055 8.299 1.00 0.65 H new ATOM 0 HB2 GLU A 3 23.420 0.443 7.382 1.00 1.06 H new ATOM 0 HB3 GLU A 3 22.007 0.381 6.346 1.00 1.06 H new ATOM 0 HG2 GLU A 3 21.060 2.357 7.458 1.00 1.63 H new ATOM 0 HG3 GLU A 3 22.395 2.391 8.593 1.00 1.63 H new ATOM 40 N PRO A 4 20.950 -2.583 8.472 1.00 0.41 N ATOM 41 CA PRO A 4 21.066 -4.016 8.269 1.00 0.39 C ATOM 42 C PRO A 4 20.401 -4.493 6.978 1.00 0.39 C ATOM 43 O PRO A 4 19.990 -3.689 6.135 1.00 0.50 O ATOM 44 CB PRO A 4 20.333 -4.575 9.485 1.00 0.39 C ATOM 45 CG PRO A 4 19.290 -3.552 9.825 1.00 0.44 C ATOM 46 CD PRO A 4 19.702 -2.248 9.174 1.00 0.41 C ATOM 0 HA PRO A 4 22.103 -4.337 8.173 1.00 0.39 H new ATOM 0 HB2 PRO A 4 19.879 -5.540 9.261 1.00 0.39 H new ATOM 0 HB3 PRO A 4 21.017 -4.731 10.319 1.00 0.39 H new ATOM 0 HG2 PRO A 4 18.311 -3.868 9.464 1.00 0.44 H new ATOM 0 HG3 PRO A 4 19.208 -3.432 10.905 1.00 0.44 H new ATOM 0 HD2 PRO A 4 18.939 -1.888 8.484 1.00 0.41 H new ATOM 0 HD3 PRO A 4 19.858 -1.463 9.914 1.00 0.41 H new ATOM 54 N ALA A 5 20.310 -5.808 6.835 1.00 0.37 N ATOM 55 CA ALA A 5 19.664 -6.427 5.689 1.00 0.45 C ATOM 56 C ALA A 5 18.155 -6.237 5.755 1.00 0.22 C ATOM 57 O ALA A 5 17.615 -5.918 6.814 1.00 0.43 O ATOM 58 CB ALA A 5 20.011 -7.907 5.628 1.00 0.76 C ATOM 0 H ALA A 5 20.682 -6.475 7.511 1.00 0.37 H new ATOM 0 HA ALA A 5 20.029 -5.944 4.783 1.00 0.45 H new ATOM 0 HB1 ALA A 5 19.522 -8.360 4.766 1.00 0.76 H new ATOM 0 HB2 ALA A 5 21.091 -8.024 5.536 1.00 0.76 H new ATOM 0 HB3 ALA A 5 19.670 -8.399 6.539 1.00 0.76 H new ATOM 64 N LYS A 6 17.499 -6.374 4.605 1.00 0.31 N ATOM 65 CA LYS A 6 16.038 -6.302 4.517 1.00 0.15 C ATOM 66 C LYS A 6 15.376 -7.133 5.627 1.00 0.14 C ATOM 67 O LYS A 6 15.351 -8.361 5.556 1.00 0.20 O ATOM 68 CB LYS A 6 15.544 -6.823 3.152 1.00 0.17 C ATOM 69 CG LYS A 6 16.485 -6.590 1.965 1.00 0.17 C ATOM 70 CD LYS A 6 16.874 -5.131 1.780 1.00 0.24 C ATOM 71 CE LYS A 6 15.670 -4.256 1.481 1.00 0.23 C ATOM 72 NZ LYS A 6 14.902 -4.763 0.317 1.00 0.66 N ATOM 0 H LYS A 6 17.960 -6.537 3.710 1.00 0.31 H new ATOM 0 HA LYS A 6 15.760 -5.254 4.633 1.00 0.15 H new ATOM 0 HB2 LYS A 6 15.359 -7.894 3.239 1.00 0.17 H new ATOM 0 HB3 LYS A 6 14.587 -6.351 2.930 1.00 0.17 H new ATOM 0 HG2 LYS A 6 17.388 -7.184 2.105 1.00 0.17 H new ATOM 0 HG3 LYS A 6 16.005 -6.949 1.054 1.00 0.17 H new ATOM 0 HD2 LYS A 6 17.369 -4.771 2.682 1.00 0.24 H new ATOM 0 HD3 LYS A 6 17.594 -5.048 0.966 1.00 0.24 H new ATOM 0 HE2 LYS A 6 15.022 -4.217 2.356 1.00 0.23 H new ATOM 0 HE3 LYS A 6 16.001 -3.236 1.283 1.00 0.23 H new ATOM 0 HZ1 LYS A 6 14.405 -3.973 -0.142 1.00 0.66 H new ATOM 0 HZ2 LYS A 6 15.553 -5.204 -0.363 1.00 0.66 H new ATOM 0 HZ3 LYS A 6 14.209 -5.468 0.639 1.00 0.66 H new ATOM 86 N LEU A 7 14.854 -6.464 6.653 1.00 0.14 N ATOM 87 CA LEU A 7 14.169 -7.157 7.741 1.00 0.14 C ATOM 88 C LEU A 7 12.671 -7.188 7.476 1.00 0.13 C ATOM 89 O LEU A 7 12.090 -6.174 7.095 1.00 0.10 O ATOM 90 CB LEU A 7 14.440 -6.458 9.075 1.00 0.15 C ATOM 91 CG LEU A 7 15.912 -6.300 9.454 1.00 0.19 C ATOM 92 CD1 LEU A 7 16.043 -5.464 10.718 1.00 0.20 C ATOM 93 CD2 LEU A 7 16.569 -7.659 9.639 1.00 0.24 C ATOM 0 H LEU A 7 14.892 -5.450 6.753 1.00 0.14 H new ATOM 0 HA LEU A 7 14.548 -8.178 7.794 1.00 0.14 H new ATOM 0 HB2 LEU A 7 13.984 -5.469 9.045 1.00 0.15 H new ATOM 0 HB3 LEU A 7 13.938 -7.017 9.865 1.00 0.15 H new ATOM 0 HG LEU A 7 16.425 -5.784 8.642 1.00 0.19 H new ATOM 0 HD11 LEU A 7 17.097 -5.359 10.977 1.00 0.20 H new ATOM 0 HD12 LEU A 7 15.611 -4.478 10.548 1.00 0.20 H new ATOM 0 HD13 LEU A 7 15.515 -5.955 11.536 1.00 0.20 H new ATOM 0 HD21 LEU A 7 17.616 -7.523 9.908 1.00 0.24 H new ATOM 0 HD22 LEU A 7 16.058 -8.205 10.432 1.00 0.24 H new ATOM 0 HD23 LEU A 7 16.504 -8.224 8.709 1.00 0.24 H new ATOM 105 N ASP A 8 12.062 -8.353 7.683 1.00 0.21 N ATOM 106 CA ASP A 8 10.635 -8.564 7.409 1.00 0.24 C ATOM 107 C ASP A 8 9.764 -7.508 8.088 1.00 0.21 C ATOM 108 O ASP A 8 9.842 -7.307 9.301 1.00 0.29 O ATOM 109 CB ASP A 8 10.220 -9.966 7.868 1.00 0.37 C ATOM 110 CG ASP A 8 8.724 -10.213 7.762 1.00 0.52 C ATOM 111 OD1 ASP A 8 8.050 -10.245 8.814 1.00 0.64 O ATOM 112 OD2 ASP A 8 8.219 -10.398 6.632 1.00 0.65 O ATOM 0 H ASP A 8 12.539 -9.179 8.045 1.00 0.21 H new ATOM 0 HA ASP A 8 10.484 -8.471 6.334 1.00 0.24 H new ATOM 0 HB2 ASP A 8 10.747 -10.708 7.269 1.00 0.37 H new ATOM 0 HB3 ASP A 8 10.533 -10.110 8.902 1.00 0.37 H new ATOM 117 N LEU A 9 8.950 -6.829 7.287 1.00 0.18 N ATOM 118 CA LEU A 9 8.089 -5.765 7.779 1.00 0.16 C ATOM 119 C LEU A 9 6.671 -6.284 8.009 1.00 0.18 C ATOM 120 O LEU A 9 6.420 -7.486 7.921 1.00 0.26 O ATOM 121 CB LEU A 9 8.049 -4.624 6.761 1.00 0.13 C ATOM 122 CG LEU A 9 7.773 -3.236 7.341 1.00 0.14 C ATOM 123 CD1 LEU A 9 9.031 -2.664 7.960 1.00 0.13 C ATOM 124 CD2 LEU A 9 7.226 -2.311 6.277 1.00 0.20 C ATOM 0 H LEU A 9 8.870 -7.001 6.285 1.00 0.18 H new ATOM 0 HA LEU A 9 8.491 -5.404 8.726 1.00 0.16 H new ATOM 0 HB2 LEU A 9 9.003 -4.596 6.235 1.00 0.13 H new ATOM 0 HB3 LEU A 9 7.282 -4.848 6.019 1.00 0.13 H new ATOM 0 HG LEU A 9 7.020 -3.331 8.123 1.00 0.14 H new ATOM 0 HD11 LEU A 9 8.819 -1.676 8.368 1.00 0.13 H new ATOM 0 HD12 LEU A 9 9.374 -3.321 8.759 1.00 0.13 H new ATOM 0 HD13 LEU A 9 9.807 -2.583 7.199 1.00 0.13 H new ATOM 0 HD21 LEU A 9 7.037 -1.329 6.711 1.00 0.20 H new ATOM 0 HD22 LEU A 9 7.951 -2.217 5.469 1.00 0.20 H new ATOM 0 HD23 LEU A 9 6.295 -2.719 5.883 1.00 0.20 H new ATOM 136 N SER A 10 5.745 -5.382 8.293 1.00 0.18 N ATOM 137 CA SER A 10 4.351 -5.747 8.439 1.00 0.21 C ATOM 138 C SER A 10 3.677 -5.819 7.068 1.00 0.19 C ATOM 139 O SER A 10 2.976 -6.783 6.762 1.00 0.24 O ATOM 140 CB SER A 10 3.647 -4.731 9.333 1.00 0.25 C ATOM 141 OG SER A 10 4.393 -4.506 10.517 1.00 1.21 O ATOM 0 H SER A 10 5.938 -4.389 8.427 1.00 0.18 H new ATOM 0 HA SER A 10 4.283 -6.731 8.903 1.00 0.21 H new ATOM 0 HB2 SER A 10 3.518 -3.792 8.794 1.00 0.25 H new ATOM 0 HB3 SER A 10 2.650 -5.092 9.588 1.00 0.25 H new ATOM 0 HG SER A 10 3.927 -3.851 11.077 1.00 1.21 H new ATOM 147 N CYS A 11 3.908 -4.806 6.237 1.00 0.15 N ATOM 148 CA CYS A 11 3.365 -4.796 4.892 1.00 0.15 C ATOM 149 C CYS A 11 4.502 -4.860 3.882 1.00 0.14 C ATOM 150 O CYS A 11 5.344 -3.971 3.822 1.00 0.12 O ATOM 151 CB CYS A 11 2.501 -3.548 4.652 1.00 0.17 C ATOM 152 SG CYS A 11 3.397 -1.954 4.651 1.00 0.19 S ATOM 0 H CYS A 11 4.466 -3.986 6.475 1.00 0.15 H new ATOM 0 HA CYS A 11 2.725 -5.670 4.769 1.00 0.15 H new ATOM 0 HB2 CYS A 11 1.993 -3.659 3.694 1.00 0.17 H new ATOM 0 HB3 CYS A 11 1.729 -3.510 5.420 1.00 0.17 H new ATOM 157 N VAL A 12 4.570 -5.953 3.145 1.00 0.15 N ATOM 158 CA VAL A 12 5.511 -6.076 2.042 1.00 0.13 C ATOM 159 C VAL A 12 5.039 -7.137 1.058 1.00 0.16 C ATOM 160 O VAL A 12 4.679 -8.243 1.457 1.00 0.21 O ATOM 161 CB VAL A 12 6.969 -6.366 2.517 1.00 0.11 C ATOM 162 CG1 VAL A 12 6.987 -7.045 3.878 1.00 0.12 C ATOM 163 CG2 VAL A 12 7.726 -7.212 1.505 1.00 0.12 C ATOM 0 H VAL A 12 3.982 -6.774 3.290 1.00 0.15 H new ATOM 0 HA VAL A 12 5.538 -5.110 1.539 1.00 0.13 H new ATOM 0 HB VAL A 12 7.470 -5.402 2.606 1.00 0.11 H new ATOM 0 HG11 VAL A 12 8.018 -7.232 4.178 1.00 0.12 H new ATOM 0 HG12 VAL A 12 6.507 -6.399 4.613 1.00 0.12 H new ATOM 0 HG13 VAL A 12 6.449 -7.991 3.820 1.00 0.12 H new ATOM 0 HG21 VAL A 12 8.737 -7.395 1.868 1.00 0.12 H new ATOM 0 HG22 VAL A 12 7.212 -8.163 1.369 1.00 0.12 H new ATOM 0 HG23 VAL A 12 7.772 -6.685 0.552 1.00 0.12 H new ATOM 173 N HIS A 13 4.991 -6.763 -0.216 1.00 0.17 N ATOM 174 CA HIS A 13 4.627 -7.684 -1.295 1.00 0.24 C ATOM 175 C HIS A 13 5.333 -9.033 -1.143 1.00 0.37 C ATOM 176 O HIS A 13 4.675 -10.064 -1.064 1.00 0.98 O ATOM 177 CB HIS A 13 4.991 -7.057 -2.639 1.00 0.32 C ATOM 178 CG HIS A 13 3.867 -6.291 -3.251 1.00 0.47 C ATOM 179 ND1 HIS A 13 2.860 -6.884 -3.970 1.00 0.68 N ATOM 180 CD2 HIS A 13 3.586 -4.973 -3.230 1.00 0.83 C ATOM 181 CE1 HIS A 13 2.010 -5.962 -4.362 1.00 1.01 C ATOM 182 NE2 HIS A 13 2.425 -4.788 -3.921 1.00 1.09 N ATOM 0 H HIS A 13 5.202 -5.817 -0.533 1.00 0.17 H new ATOM 0 HA HIS A 13 3.553 -7.863 -1.245 1.00 0.24 H new ATOM 0 HB2 HIS A 13 5.844 -6.393 -2.504 1.00 0.32 H new ATOM 0 HB3 HIS A 13 5.304 -7.843 -3.327 1.00 0.32 H new ATOM 0 HD2 HIS A 13 4.174 -4.203 -2.752 1.00 0.83 H new ATOM 0 HE1 HIS A 13 1.119 -6.135 -4.948 1.00 1.01 H new ATOM 0 HE2 HIS A 13 1.956 -3.895 -4.072 1.00 1.09 H new ATOM 190 N SER A 14 6.665 -9.014 -1.098 1.00 0.37 N ATOM 191 CA SER A 14 7.486 -10.228 -0.945 1.00 0.35 C ATOM 192 C SER A 14 7.126 -11.313 -1.970 1.00 0.52 C ATOM 193 O SER A 14 7.300 -12.504 -1.720 1.00 1.14 O ATOM 194 CB SER A 14 7.406 -10.784 0.491 1.00 0.30 C ATOM 195 OG SER A 14 6.073 -11.072 0.883 1.00 1.16 O ATOM 0 H SER A 14 7.213 -8.156 -1.166 1.00 0.37 H new ATOM 0 HA SER A 14 8.516 -9.931 -1.140 1.00 0.35 H new ATOM 0 HB2 SER A 14 8.007 -11.691 0.561 1.00 0.30 H new ATOM 0 HB3 SER A 14 7.838 -10.061 1.183 1.00 0.30 H new ATOM 0 HG SER A 14 5.499 -11.107 0.089 1.00 1.16 H new ATOM 201 N ASP A 15 6.613 -10.891 -3.118 1.00 0.25 N ATOM 202 CA ASP A 15 6.392 -11.795 -4.244 1.00 0.31 C ATOM 203 C ASP A 15 7.042 -11.209 -5.481 1.00 0.28 C ATOM 204 O ASP A 15 6.685 -11.541 -6.612 1.00 0.55 O ATOM 205 CB ASP A 15 4.901 -12.027 -4.504 1.00 0.48 C ATOM 206 CG ASP A 15 4.226 -12.852 -3.425 1.00 1.66 C ATOM 207 OD1 ASP A 15 3.492 -12.269 -2.599 1.00 2.50 O ATOM 208 OD2 ASP A 15 4.446 -14.081 -3.385 1.00 2.26 O ATOM 0 H ASP A 15 6.340 -9.924 -3.296 1.00 0.25 H new ATOM 0 HA ASP A 15 6.837 -12.760 -4.001 1.00 0.31 H new ATOM 0 HB2 ASP A 15 4.398 -11.063 -4.582 1.00 0.48 H new ATOM 0 HB3 ASP A 15 4.780 -12.528 -5.464 1.00 0.48 H new ATOM 213 N ASN A 16 7.996 -10.319 -5.230 1.00 0.23 N ATOM 214 CA ASN A 16 8.726 -9.605 -6.274 1.00 0.21 C ATOM 215 C ASN A 16 7.801 -8.639 -7.009 1.00 0.19 C ATOM 216 O ASN A 16 7.289 -8.933 -8.091 1.00 0.22 O ATOM 217 CB ASN A 16 9.415 -10.571 -7.254 1.00 0.23 C ATOM 218 CG ASN A 16 10.358 -11.532 -6.559 1.00 1.06 C ATOM 219 OD1 ASN A 16 10.929 -11.214 -5.517 1.00 2.09 O ATOM 220 ND2 ASN A 16 10.537 -12.707 -7.133 1.00 0.95 N ATOM 0 H ASN A 16 8.288 -10.069 -4.285 1.00 0.23 H new ATOM 0 HA ASN A 16 9.514 -9.026 -5.791 1.00 0.21 H new ATOM 0 HB2 ASN A 16 8.656 -11.138 -7.793 1.00 0.23 H new ATOM 0 HB3 ASN A 16 9.970 -9.996 -7.996 1.00 0.23 H new ATOM 0 HD21 ASN A 16 11.168 -13.389 -6.712 1.00 0.95 H new ATOM 0 HD22 ASN A 16 10.045 -12.933 -7.997 1.00 0.95 H new ATOM 227 N LYS A 17 7.597 -7.473 -6.404 1.00 0.19 N ATOM 228 CA LYS A 17 6.735 -6.444 -6.967 1.00 0.19 C ATOM 229 C LYS A 17 7.289 -5.056 -6.713 1.00 0.21 C ATOM 230 O LYS A 17 7.911 -4.796 -5.683 1.00 0.28 O ATOM 231 CB LYS A 17 5.329 -6.509 -6.365 1.00 0.23 C ATOM 232 CG LYS A 17 4.428 -7.581 -6.945 1.00 0.25 C ATOM 233 CD LYS A 17 3.984 -7.205 -8.345 1.00 0.25 C ATOM 234 CE LYS A 17 2.678 -7.870 -8.729 1.00 0.43 C ATOM 235 NZ LYS A 17 2.755 -9.356 -8.708 1.00 0.93 N ATOM 0 H LYS A 17 8.023 -7.217 -5.513 1.00 0.19 H new ATOM 0 HA LYS A 17 6.691 -6.632 -8.040 1.00 0.19 H new ATOM 0 HB2 LYS A 17 5.418 -6.674 -5.291 1.00 0.23 H new ATOM 0 HB3 LYS A 17 4.848 -5.540 -6.500 1.00 0.23 H new ATOM 0 HG2 LYS A 17 4.957 -8.534 -6.969 1.00 0.25 H new ATOM 0 HG3 LYS A 17 3.556 -7.716 -6.305 1.00 0.25 H new ATOM 0 HD2 LYS A 17 3.872 -6.123 -8.410 1.00 0.25 H new ATOM 0 HD3 LYS A 17 4.758 -7.489 -9.058 1.00 0.25 H new ATOM 0 HE2 LYS A 17 1.895 -7.542 -8.045 1.00 0.43 H new ATOM 0 HE3 LYS A 17 2.388 -7.541 -9.727 1.00 0.43 H new ATOM 0 HZ1 LYS A 17 1.844 -9.755 -9.012 1.00 0.93 H new ATOM 0 HZ2 LYS A 17 3.505 -9.674 -9.355 1.00 0.93 H new ATOM 0 HZ3 LYS A 17 2.970 -9.679 -7.743 1.00 0.93 H new ATOM 249 N GLY A 18 7.026 -4.164 -7.648 1.00 0.19 N ATOM 250 CA GLY A 18 7.435 -2.788 -7.497 1.00 0.20 C ATOM 251 C GLY A 18 6.326 -1.842 -7.886 1.00 0.15 C ATOM 252 O GLY A 18 5.218 -2.287 -8.173 1.00 0.15 O ATOM 0 H GLY A 18 6.532 -4.370 -8.516 1.00 0.19 H new ATOM 0 HA2 GLY A 18 7.727 -2.604 -6.463 1.00 0.20 H new ATOM 0 HA3 GLY A 18 8.313 -2.597 -8.115 1.00 0.20 H new ATOM 256 N SER A 19 6.605 -0.546 -7.914 1.00 0.19 N ATOM 257 CA SER A 19 5.584 0.423 -8.255 1.00 0.18 C ATOM 258 C SER A 19 6.132 1.465 -9.196 1.00 0.22 C ATOM 259 O SER A 19 7.332 1.724 -9.232 1.00 0.36 O ATOM 260 CB SER A 19 5.071 1.127 -7.009 1.00 0.21 C ATOM 261 OG SER A 19 4.031 2.044 -7.311 1.00 1.22 O ATOM 0 H SER A 19 7.521 -0.149 -7.706 1.00 0.19 H new ATOM 0 HA SER A 19 4.769 -0.118 -8.735 1.00 0.18 H new ATOM 0 HB2 SER A 19 4.707 0.386 -6.297 1.00 0.21 H new ATOM 0 HB3 SER A 19 5.893 1.656 -6.526 1.00 0.21 H new ATOM 0 HG SER A 19 4.127 2.843 -6.751 1.00 1.22 H new ATOM 267 N ARG A 20 5.229 2.070 -9.921 1.00 0.18 N ATOM 268 CA ARG A 20 5.559 3.168 -10.803 1.00 0.20 C ATOM 269 C ARG A 20 5.075 4.444 -10.148 1.00 0.17 C ATOM 270 O ARG A 20 3.892 4.573 -9.832 1.00 0.16 O ATOM 271 CB ARG A 20 4.908 2.992 -12.172 1.00 0.24 C ATOM 272 CG ARG A 20 4.974 1.569 -12.685 1.00 0.31 C ATOM 273 CD ARG A 20 4.863 1.517 -14.192 1.00 0.40 C ATOM 274 NE ARG A 20 4.638 0.154 -14.670 1.00 0.58 N ATOM 275 CZ ARG A 20 5.194 -0.369 -15.760 1.00 0.97 C ATOM 276 NH1 ARG A 20 6.052 0.340 -16.486 1.00 2.03 N ATOM 277 NH2 ARG A 20 4.895 -1.610 -16.122 1.00 0.92 N ATOM 0 H ARG A 20 4.241 1.818 -9.920 1.00 0.18 H new ATOM 0 HA ARG A 20 6.637 3.203 -10.964 1.00 0.20 H new ATOM 0 HB2 ARG A 20 3.865 3.302 -12.114 1.00 0.24 H new ATOM 0 HB3 ARG A 20 5.398 3.653 -12.888 1.00 0.24 H new ATOM 0 HG2 ARG A 20 5.913 1.112 -12.372 1.00 0.31 H new ATOM 0 HG3 ARG A 20 4.170 0.983 -12.240 1.00 0.31 H new ATOM 0 HD2 ARG A 20 4.044 2.157 -14.519 1.00 0.40 H new ATOM 0 HD3 ARG A 20 5.775 1.913 -14.638 1.00 0.40 H new ATOM 0 HE ARG A 20 4.009 -0.439 -14.129 1.00 0.58 H new ATOM 0 HH11 ARG A 20 6.289 1.293 -16.209 1.00 2.03 H new ATOM 0 HH12 ARG A 20 6.474 -0.069 -17.320 1.00 2.03 H new ATOM 0 HH21 ARG A 20 4.241 -2.160 -15.565 1.00 0.92 H new ATOM 0 HH22 ARG A 20 5.319 -2.014 -16.957 1.00 0.92 H new ATOM 291 N ALA A 21 5.999 5.358 -9.938 1.00 0.17 N ATOM 292 CA ALA A 21 5.761 6.574 -9.181 1.00 0.15 C ATOM 293 C ALA A 21 7.108 7.246 -8.978 1.00 0.17 C ATOM 294 O ALA A 21 8.132 6.562 -8.981 1.00 0.20 O ATOM 295 CB ALA A 21 5.088 6.257 -7.843 1.00 0.17 C ATOM 0 H ALA A 21 6.952 5.278 -10.293 1.00 0.17 H new ATOM 0 HA ALA A 21 5.086 7.240 -9.719 1.00 0.15 H new ATOM 0 HB1 ALA A 21 4.919 7.182 -7.292 1.00 0.17 H new ATOM 0 HB2 ALA A 21 4.133 5.763 -8.024 1.00 0.17 H new ATOM 0 HB3 ALA A 21 5.732 5.600 -7.259 1.00 0.17 H new ATOM 301 N PRO A 22 7.145 8.574 -8.797 1.00 0.17 N ATOM 302 CA PRO A 22 8.399 9.317 -8.783 1.00 0.18 C ATOM 303 C PRO A 22 9.239 8.961 -7.576 1.00 0.16 C ATOM 304 O PRO A 22 8.791 9.111 -6.437 1.00 0.16 O ATOM 305 CB PRO A 22 7.966 10.788 -8.715 1.00 0.21 C ATOM 306 CG PRO A 22 6.503 10.783 -9.005 1.00 0.22 C ATOM 307 CD PRO A 22 6.001 9.452 -8.533 1.00 0.21 C ATOM 0 HA PRO A 22 9.014 9.094 -9.655 1.00 0.18 H new ATOM 0 HB2 PRO A 22 8.170 11.213 -7.732 1.00 0.21 H new ATOM 0 HB3 PRO A 22 8.509 11.392 -9.442 1.00 0.21 H new ATOM 0 HG2 PRO A 22 5.998 11.598 -8.487 1.00 0.22 H new ATOM 0 HG3 PRO A 22 6.314 10.917 -10.070 1.00 0.22 H new ATOM 0 HD2 PRO A 22 5.737 9.469 -7.476 1.00 0.21 H new ATOM 0 HD3 PRO A 22 5.112 9.136 -9.079 1.00 0.21 H new ATOM 315 N THR A 23 10.433 8.450 -7.822 1.00 0.16 N ATOM 316 CA THR A 23 11.363 8.188 -6.749 1.00 0.15 C ATOM 317 C THR A 23 11.794 9.508 -6.134 1.00 0.14 C ATOM 318 O THR A 23 12.560 10.269 -6.730 1.00 0.18 O ATOM 319 CB THR A 23 12.599 7.410 -7.238 1.00 0.17 C ATOM 320 OG1 THR A 23 12.191 6.164 -7.827 1.00 0.18 O ATOM 321 CG2 THR A 23 13.558 7.143 -6.084 1.00 0.17 C ATOM 0 H THR A 23 10.776 8.211 -8.752 1.00 0.16 H new ATOM 0 HA THR A 23 10.861 7.569 -6.005 1.00 0.15 H new ATOM 0 HB THR A 23 13.113 8.014 -7.986 1.00 0.17 H new ATOM 0 HG1 THR A 23 12.731 5.987 -8.626 1.00 0.18 H new ATOM 0 HG21 THR A 23 14.424 6.592 -6.451 1.00 0.17 H new ATOM 0 HG22 THR A 23 13.885 8.091 -5.656 1.00 0.17 H new ATOM 0 HG23 THR A 23 13.052 6.555 -5.319 1.00 0.17 H new ATOM 329 N ILE A 24 11.260 9.785 -4.966 1.00 0.12 N ATOM 330 CA ILE A 24 11.517 11.030 -4.276 1.00 0.12 C ATOM 331 C ILE A 24 12.953 11.078 -3.770 1.00 0.14 C ATOM 332 O ILE A 24 13.374 10.215 -3.000 1.00 0.15 O ATOM 333 CB ILE A 24 10.558 11.197 -3.091 1.00 0.11 C ATOM 334 CG1 ILE A 24 9.139 10.844 -3.514 1.00 0.11 C ATOM 335 CG2 ILE A 24 10.614 12.618 -2.569 1.00 0.13 C ATOM 336 CD1 ILE A 24 8.172 10.784 -2.359 1.00 0.13 C ATOM 0 H ILE A 24 10.634 9.153 -4.467 1.00 0.12 H new ATOM 0 HA ILE A 24 11.359 11.843 -4.985 1.00 0.12 H new ATOM 0 HB ILE A 24 10.863 10.521 -2.292 1.00 0.11 H new ATOM 0 HG12 ILE A 24 8.788 11.582 -4.235 1.00 0.11 H new ATOM 0 HG13 ILE A 24 9.148 9.880 -4.023 1.00 0.11 H new ATOM 0 HG21 ILE A 24 9.929 12.724 -1.728 1.00 0.13 H new ATOM 0 HG22 ILE A 24 11.628 12.846 -2.242 1.00 0.13 H new ATOM 0 HG23 ILE A 24 10.325 13.308 -3.361 1.00 0.13 H new ATOM 0 HD11 ILE A 24 7.179 10.528 -2.729 1.00 0.13 H new ATOM 0 HD12 ILE A 24 8.501 10.026 -1.648 1.00 0.13 H new ATOM 0 HD13 ILE A 24 8.136 11.755 -1.864 1.00 0.13 H new ATOM 348 N GLY A 25 13.697 12.081 -4.207 1.00 0.14 N ATOM 349 CA GLY A 25 15.085 12.206 -3.804 1.00 0.16 C ATOM 350 C GLY A 25 15.946 11.084 -4.353 1.00 0.16 C ATOM 351 O GLY A 25 15.801 10.693 -5.513 1.00 0.24 O ATOM 0 H GLY A 25 13.366 12.813 -4.835 1.00 0.14 H new ATOM 0 HA2 GLY A 25 15.476 13.163 -4.148 1.00 0.16 H new ATOM 0 HA3 GLY A 25 15.146 12.209 -2.716 1.00 0.16 H new ATOM 355 N GLU A 26 16.838 10.567 -3.524 1.00 0.17 N ATOM 356 CA GLU A 26 17.696 9.460 -3.918 1.00 0.16 C ATOM 357 C GLU A 26 17.338 8.211 -3.122 1.00 0.16 C ATOM 358 O GLU A 26 16.904 8.307 -1.974 1.00 0.21 O ATOM 359 CB GLU A 26 19.165 9.813 -3.692 1.00 0.26 C ATOM 360 CG GLU A 26 19.671 10.933 -4.583 1.00 1.20 C ATOM 361 CD GLU A 26 19.565 10.600 -6.056 1.00 1.83 C ATOM 362 OE1 GLU A 26 18.898 11.352 -6.795 1.00 2.41 O ATOM 363 OE2 GLU A 26 20.157 9.588 -6.487 1.00 2.09 O ATOM 0 H GLU A 26 16.988 10.897 -2.571 1.00 0.17 H new ATOM 0 HA GLU A 26 17.542 9.266 -4.979 1.00 0.16 H new ATOM 0 HB2 GLU A 26 19.304 10.100 -2.650 1.00 0.26 H new ATOM 0 HB3 GLU A 26 19.773 8.924 -3.861 1.00 0.26 H new ATOM 0 HG2 GLU A 26 19.103 11.840 -4.378 1.00 1.20 H new ATOM 0 HG3 GLU A 26 20.711 11.146 -4.337 1.00 1.20 H new ATOM 370 N PRO A 27 17.505 7.017 -3.716 1.00 0.13 N ATOM 371 CA PRO A 27 17.213 5.767 -3.041 1.00 0.13 C ATOM 372 C PRO A 27 18.286 5.398 -2.039 1.00 0.14 C ATOM 373 O PRO A 27 19.453 5.750 -2.197 1.00 0.20 O ATOM 374 CB PRO A 27 17.161 4.724 -4.158 1.00 0.14 C ATOM 375 CG PRO A 27 17.326 5.480 -5.434 1.00 0.14 C ATOM 376 CD PRO A 27 17.989 6.779 -5.077 1.00 0.14 C ATOM 0 HA PRO A 27 16.284 5.835 -2.475 1.00 0.13 H new ATOM 0 HB2 PRO A 27 17.952 3.984 -4.038 1.00 0.14 H new ATOM 0 HB3 PRO A 27 16.214 4.184 -4.144 1.00 0.14 H new ATOM 0 HG2 PRO A 27 17.933 4.917 -6.143 1.00 0.14 H new ATOM 0 HG3 PRO A 27 16.361 5.655 -5.909 1.00 0.14 H new ATOM 0 HD2 PRO A 27 19.076 6.704 -5.114 1.00 0.14 H new ATOM 0 HD3 PRO A 27 17.702 7.582 -5.756 1.00 0.14 H new ATOM 384 N VAL A 28 17.877 4.674 -1.022 1.00 0.13 N ATOM 385 CA VAL A 28 18.775 4.290 0.052 1.00 0.13 C ATOM 386 C VAL A 28 19.175 2.835 -0.097 1.00 0.13 C ATOM 387 O VAL A 28 18.370 1.944 0.148 1.00 0.10 O ATOM 388 CB VAL A 28 18.107 4.467 1.422 1.00 0.13 C ATOM 389 CG1 VAL A 28 19.143 4.830 2.471 1.00 0.16 C ATOM 390 CG2 VAL A 28 17.007 5.511 1.352 1.00 0.14 C ATOM 0 H VAL A 28 16.921 4.335 -0.913 1.00 0.13 H new ATOM 0 HA VAL A 28 19.652 4.934 -0.009 1.00 0.13 H new ATOM 0 HB VAL A 28 17.649 3.521 1.711 1.00 0.13 H new ATOM 0 HG11 VAL A 28 18.655 4.952 3.438 1.00 0.16 H new ATOM 0 HG12 VAL A 28 19.887 4.036 2.538 1.00 0.16 H new ATOM 0 HG13 VAL A 28 19.633 5.763 2.191 1.00 0.16 H new ATOM 0 HG21 VAL A 28 16.547 5.621 2.334 1.00 0.14 H new ATOM 0 HG22 VAL A 28 17.431 6.466 1.041 1.00 0.14 H new ATOM 0 HG23 VAL A 28 16.253 5.197 0.631 1.00 0.14 H new ATOM 400 N PRO A 29 20.407 2.564 -0.513 1.00 0.17 N ATOM 401 CA PRO A 29 20.878 1.204 -0.712 1.00 0.17 C ATOM 402 C PRO A 29 21.377 0.563 0.569 1.00 0.17 C ATOM 403 O PRO A 29 21.816 1.253 1.495 1.00 0.20 O ATOM 404 CB PRO A 29 22.012 1.395 -1.691 1.00 0.20 C ATOM 405 CG PRO A 29 22.613 2.695 -1.281 1.00 0.23 C ATOM 406 CD PRO A 29 21.456 3.554 -0.821 1.00 0.21 C ATOM 0 HA PRO A 29 20.090 0.536 -1.060 1.00 0.17 H new ATOM 0 HB2 PRO A 29 22.735 0.582 -1.630 1.00 0.20 H new ATOM 0 HB3 PRO A 29 21.653 1.426 -2.720 1.00 0.20 H new ATOM 0 HG2 PRO A 29 23.339 2.555 -0.480 1.00 0.23 H new ATOM 0 HG3 PRO A 29 23.141 3.162 -2.113 1.00 0.23 H new ATOM 0 HD2 PRO A 29 21.718 4.149 0.054 1.00 0.21 H new ATOM 0 HD3 PRO A 29 21.138 4.251 -1.597 1.00 0.21 H new ATOM 414 N ASP A 30 21.293 -0.759 0.608 1.00 0.17 N ATOM 415 CA ASP A 30 21.761 -1.541 1.741 1.00 0.20 C ATOM 416 C ASP A 30 21.010 -1.128 3.010 1.00 0.18 C ATOM 417 O ASP A 30 21.607 -0.796 4.036 1.00 0.28 O ATOM 418 CB ASP A 30 23.279 -1.375 1.892 1.00 0.27 C ATOM 419 CG ASP A 30 23.918 -2.468 2.731 1.00 0.37 C ATOM 420 OD1 ASP A 30 24.283 -3.523 2.179 1.00 0.47 O ATOM 421 OD2 ASP A 30 24.055 -2.279 3.961 1.00 0.48 O ATOM 0 H ASP A 30 20.898 -1.320 -0.147 1.00 0.17 H new ATOM 0 HA ASP A 30 21.557 -2.598 1.570 1.00 0.20 H new ATOM 0 HB2 ASP A 30 23.738 -1.369 0.903 1.00 0.27 H new ATOM 0 HB3 ASP A 30 23.489 -0.407 2.347 1.00 0.27 H new ATOM 426 N VAL A 31 19.681 -1.142 2.914 1.00 0.12 N ATOM 427 CA VAL A 31 18.816 -0.758 4.023 1.00 0.12 C ATOM 428 C VAL A 31 17.735 -1.792 4.218 1.00 0.12 C ATOM 429 O VAL A 31 17.402 -2.548 3.306 1.00 0.13 O ATOM 430 CB VAL A 31 18.160 0.633 3.832 1.00 0.12 C ATOM 431 CG1 VAL A 31 19.226 1.672 3.562 1.00 0.14 C ATOM 432 CG2 VAL A 31 17.095 0.634 2.733 1.00 0.10 C ATOM 0 H VAL A 31 19.179 -1.418 2.070 1.00 0.12 H new ATOM 0 HA VAL A 31 19.454 -0.698 4.904 1.00 0.12 H new ATOM 0 HB VAL A 31 17.643 0.885 4.758 1.00 0.12 H new ATOM 0 HG11 VAL A 31 18.758 2.647 3.429 1.00 0.14 H new ATOM 0 HG12 VAL A 31 19.916 1.713 4.405 1.00 0.14 H new ATOM 0 HG13 VAL A 31 19.773 1.405 2.658 1.00 0.14 H new ATOM 0 HG21 VAL A 31 16.668 1.633 2.641 1.00 0.10 H new ATOM 0 HG22 VAL A 31 17.550 0.345 1.785 1.00 0.10 H new ATOM 0 HG23 VAL A 31 16.308 -0.075 2.989 1.00 0.10 H new ATOM 442 N SER A 32 17.189 -1.815 5.410 1.00 0.16 N ATOM 443 CA SER A 32 16.174 -2.769 5.766 1.00 0.16 C ATOM 444 C SER A 32 14.808 -2.289 5.292 1.00 0.16 C ATOM 445 O SER A 32 14.660 -1.128 4.903 1.00 0.18 O ATOM 446 CB SER A 32 16.186 -2.959 7.277 1.00 0.18 C ATOM 447 OG SER A 32 15.108 -3.764 7.713 1.00 0.19 O ATOM 0 H SER A 32 17.439 -1.170 6.160 1.00 0.16 H new ATOM 0 HA SER A 32 16.378 -3.724 5.281 1.00 0.16 H new ATOM 0 HB2 SER A 32 17.128 -3.418 7.578 1.00 0.18 H new ATOM 0 HB3 SER A 32 16.135 -1.986 7.766 1.00 0.18 H new ATOM 0 HG SER A 32 14.932 -3.589 8.661 1.00 0.19 H new ATOM 453 N LEU A 33 13.811 -3.165 5.326 1.00 0.14 N ATOM 454 CA LEU A 33 12.453 -2.762 5.001 1.00 0.14 C ATOM 455 C LEU A 33 12.012 -1.748 6.028 1.00 0.13 C ATOM 456 O LEU A 33 11.411 -0.728 5.711 1.00 0.13 O ATOM 457 CB LEU A 33 11.499 -3.961 5.016 1.00 0.14 C ATOM 458 CG LEU A 33 11.985 -5.200 4.263 1.00 0.14 C ATOM 459 CD1 LEU A 33 10.873 -6.233 4.160 1.00 0.16 C ATOM 460 CD2 LEU A 33 12.495 -4.818 2.893 1.00 0.14 C ATOM 0 H LEU A 33 13.917 -4.149 5.573 1.00 0.14 H new ATOM 0 HA LEU A 33 12.432 -2.336 3.998 1.00 0.14 H new ATOM 0 HB2 LEU A 33 11.309 -4.239 6.053 1.00 0.14 H new ATOM 0 HB3 LEU A 33 10.545 -3.649 4.590 1.00 0.14 H new ATOM 0 HG LEU A 33 12.809 -5.645 4.821 1.00 0.14 H new ATOM 0 HD11 LEU A 33 11.238 -7.107 3.621 1.00 0.16 H new ATOM 0 HD12 LEU A 33 10.557 -6.529 5.160 1.00 0.16 H new ATOM 0 HD13 LEU A 33 10.026 -5.804 3.625 1.00 0.16 H new ATOM 0 HD21 LEU A 33 12.837 -5.711 2.370 1.00 0.14 H new ATOM 0 HD22 LEU A 33 11.692 -4.349 2.324 1.00 0.14 H new ATOM 0 HD23 LEU A 33 13.324 -4.118 2.996 1.00 0.14 H new ATOM 472 N GLU A 34 12.393 -2.027 7.261 1.00 0.14 N ATOM 473 CA GLU A 34 12.024 -1.201 8.390 1.00 0.14 C ATOM 474 C GLU A 34 12.732 0.147 8.329 1.00 0.14 C ATOM 475 O GLU A 34 12.210 1.158 8.799 1.00 0.19 O ATOM 476 CB GLU A 34 12.356 -1.935 9.689 1.00 0.15 C ATOM 477 CG GLU A 34 12.037 -3.421 9.634 1.00 0.16 C ATOM 478 CD GLU A 34 11.807 -4.014 11.006 1.00 0.23 C ATOM 479 OE1 GLU A 34 10.776 -3.702 11.631 1.00 0.43 O ATOM 480 OE2 GLU A 34 12.659 -4.803 11.466 1.00 0.43 O ATOM 0 H GLU A 34 12.967 -2.834 7.505 1.00 0.14 H new ATOM 0 HA GLU A 34 10.951 -1.010 8.356 1.00 0.14 H new ATOM 0 HB2 GLU A 34 13.415 -1.805 9.912 1.00 0.15 H new ATOM 0 HB3 GLU A 34 11.799 -1.480 10.509 1.00 0.15 H new ATOM 0 HG2 GLU A 34 11.149 -3.577 9.021 1.00 0.16 H new ATOM 0 HG3 GLU A 34 12.857 -3.948 9.147 1.00 0.16 H new ATOM 487 N GLN A 35 13.916 0.157 7.733 1.00 0.13 N ATOM 488 CA GLN A 35 14.659 1.394 7.550 1.00 0.14 C ATOM 489 C GLN A 35 14.086 2.188 6.393 1.00 0.12 C ATOM 490 O GLN A 35 13.945 3.405 6.469 1.00 0.15 O ATOM 491 CB GLN A 35 16.140 1.122 7.301 1.00 0.17 C ATOM 492 CG GLN A 35 16.936 2.389 7.051 1.00 0.24 C ATOM 493 CD GLN A 35 18.233 2.413 7.819 1.00 0.69 C ATOM 494 OE1 GLN A 35 18.734 3.473 8.184 1.00 1.45 O ATOM 495 NE2 GLN A 35 18.781 1.241 8.072 1.00 0.67 N ATOM 0 H GLN A 35 14.381 -0.675 7.369 1.00 0.13 H new ATOM 0 HA GLN A 35 14.565 1.973 8.469 1.00 0.14 H new ATOM 0 HB2 GLN A 35 16.558 0.599 8.161 1.00 0.17 H new ATOM 0 HB3 GLN A 35 16.244 0.458 6.443 1.00 0.17 H new ATOM 0 HG2 GLN A 35 17.146 2.479 5.985 1.00 0.24 H new ATOM 0 HG3 GLN A 35 16.335 3.254 7.331 1.00 0.24 H new ATOM 0 HE21 GLN A 35 18.328 0.386 7.749 1.00 0.67 H new ATOM 0 HE22 GLN A 35 19.658 1.189 8.591 1.00 0.67 H new ATOM 504 N CYS A 36 13.751 1.494 5.322 1.00 0.10 N ATOM 505 CA CYS A 36 13.192 2.147 4.155 1.00 0.09 C ATOM 506 C CYS A 36 11.791 2.665 4.464 1.00 0.10 C ATOM 507 O CYS A 36 11.362 3.696 3.941 1.00 0.10 O ATOM 508 CB CYS A 36 13.169 1.195 2.966 1.00 0.08 C ATOM 509 SG CYS A 36 12.278 1.858 1.526 1.00 0.08 S ATOM 0 H CYS A 36 13.856 0.483 5.236 1.00 0.10 H new ATOM 0 HA CYS A 36 13.824 2.996 3.893 1.00 0.09 H new ATOM 0 HB2 CYS A 36 14.194 0.964 2.675 1.00 0.08 H new ATOM 0 HB3 CYS A 36 12.705 0.257 3.270 1.00 0.08 H new ATOM 514 N ALA A 37 11.087 1.954 5.336 1.00 0.11 N ATOM 515 CA ALA A 37 9.796 2.407 5.821 1.00 0.12 C ATOM 516 C ALA A 37 9.959 3.714 6.588 1.00 0.14 C ATOM 517 O ALA A 37 9.136 4.626 6.478 1.00 0.16 O ATOM 518 CB ALA A 37 9.151 1.337 6.696 1.00 0.14 C ATOM 0 H ALA A 37 11.392 1.060 5.721 1.00 0.11 H new ATOM 0 HA ALA A 37 9.139 2.586 4.970 1.00 0.12 H new ATOM 0 HB1 ALA A 37 8.184 1.692 7.052 1.00 0.14 H new ATOM 0 HB2 ALA A 37 9.011 0.426 6.114 1.00 0.14 H new ATOM 0 HB3 ALA A 37 9.796 1.127 7.549 1.00 0.14 H new ATOM 524 N ALA A 38 11.048 3.803 7.345 1.00 0.15 N ATOM 525 CA ALA A 38 11.382 5.013 8.080 1.00 0.16 C ATOM 526 C ALA A 38 11.816 6.116 7.118 1.00 0.15 C ATOM 527 O ALA A 38 11.612 7.299 7.372 1.00 0.19 O ATOM 528 CB ALA A 38 12.484 4.718 9.089 1.00 0.19 C ATOM 0 H ALA A 38 11.718 3.043 7.464 1.00 0.15 H new ATOM 0 HA ALA A 38 10.498 5.357 8.617 1.00 0.16 H new ATOM 0 HB1 ALA A 38 12.730 5.628 9.636 1.00 0.19 H new ATOM 0 HB2 ALA A 38 12.142 3.955 9.789 1.00 0.19 H new ATOM 0 HB3 ALA A 38 13.370 4.359 8.565 1.00 0.19 H new ATOM 534 N GLN A 39 12.409 5.703 6.006 1.00 0.11 N ATOM 535 CA GLN A 39 12.855 6.620 4.964 1.00 0.10 C ATOM 536 C GLN A 39 11.680 7.379 4.366 1.00 0.10 C ATOM 537 O GLN A 39 11.746 8.593 4.174 1.00 0.11 O ATOM 538 CB GLN A 39 13.596 5.828 3.878 1.00 0.09 C ATOM 539 CG GLN A 39 13.964 6.628 2.642 1.00 0.10 C ATOM 540 CD GLN A 39 14.778 7.870 2.953 1.00 0.13 C ATOM 541 OE1 GLN A 39 15.544 7.905 3.918 1.00 0.43 O ATOM 542 NE2 GLN A 39 14.612 8.897 2.135 1.00 0.47 N ATOM 0 H GLN A 39 12.595 4.721 5.800 1.00 0.11 H new ATOM 0 HA GLN A 39 13.531 7.354 5.402 1.00 0.10 H new ATOM 0 HB2 GLN A 39 14.507 5.414 4.309 1.00 0.09 H new ATOM 0 HB3 GLN A 39 12.974 4.985 3.576 1.00 0.09 H new ATOM 0 HG2 GLN A 39 14.530 5.992 1.961 1.00 0.10 H new ATOM 0 HG3 GLN A 39 13.052 6.920 2.122 1.00 0.10 H new ATOM 0 HE21 GLN A 39 13.967 8.823 1.348 1.00 0.47 H new ATOM 0 HE22 GLN A 39 15.129 9.762 2.291 1.00 0.47 H new ATOM 551 N CYS A 40 10.600 6.668 4.095 1.00 0.10 N ATOM 552 CA CYS A 40 9.406 7.280 3.532 1.00 0.11 C ATOM 553 C CYS A 40 8.742 8.186 4.557 1.00 0.14 C ATOM 554 O CYS A 40 7.983 9.089 4.211 1.00 0.17 O ATOM 555 CB CYS A 40 8.446 6.192 3.057 1.00 0.12 C ATOM 556 SG CYS A 40 6.878 6.795 2.349 1.00 0.16 S ATOM 0 H CYS A 40 10.524 5.664 4.256 1.00 0.10 H new ATOM 0 HA CYS A 40 9.686 7.894 2.676 1.00 0.11 H new ATOM 0 HB2 CYS A 40 8.954 5.583 2.309 1.00 0.12 H new ATOM 0 HB3 CYS A 40 8.218 5.538 3.899 1.00 0.12 H new ATOM 561 N LYS A 41 9.048 7.952 5.822 1.00 0.14 N ATOM 562 CA LYS A 41 8.559 8.810 6.883 1.00 0.18 C ATOM 563 C LYS A 41 9.482 10.012 7.057 1.00 0.19 C ATOM 564 O LYS A 41 9.068 11.055 7.560 1.00 0.27 O ATOM 565 CB LYS A 41 8.441 8.027 8.190 1.00 0.20 C ATOM 566 CG LYS A 41 7.451 6.877 8.112 1.00 0.22 C ATOM 567 CD LYS A 41 7.478 6.032 9.372 1.00 0.28 C ATOM 568 CE LYS A 41 6.539 4.843 9.264 1.00 0.32 C ATOM 569 NZ LYS A 41 5.105 5.247 9.276 1.00 1.15 N ATOM 0 H LYS A 41 9.631 7.177 6.137 1.00 0.14 H new ATOM 0 HA LYS A 41 7.568 9.172 6.611 1.00 0.18 H new ATOM 0 HB2 LYS A 41 9.422 7.636 8.461 1.00 0.20 H new ATOM 0 HB3 LYS A 41 8.137 8.706 8.987 1.00 0.20 H new ATOM 0 HG2 LYS A 41 6.446 7.271 7.958 1.00 0.22 H new ATOM 0 HG3 LYS A 41 7.684 6.253 7.249 1.00 0.22 H new ATOM 0 HD2 LYS A 41 8.493 5.680 9.554 1.00 0.28 H new ATOM 0 HD3 LYS A 41 7.195 6.644 10.228 1.00 0.28 H new ATOM 0 HE2 LYS A 41 6.752 4.298 8.344 1.00 0.32 H new ATOM 0 HE3 LYS A 41 6.728 4.159 10.091 1.00 0.32 H new ATOM 0 HZ1 LYS A 41 4.545 4.556 8.736 1.00 1.15 H new ATOM 0 HZ2 LYS A 41 4.762 5.280 10.257 1.00 1.15 H new ATOM 0 HZ3 LYS A 41 5.006 6.187 8.843 1.00 1.15 H new ATOM 583 N ALA A 42 10.732 9.863 6.626 1.00 0.16 N ATOM 584 CA ALA A 42 11.695 10.947 6.699 1.00 0.17 C ATOM 585 C ALA A 42 11.464 11.952 5.579 1.00 0.16 C ATOM 586 O ALA A 42 11.665 13.152 5.759 1.00 0.19 O ATOM 587 CB ALA A 42 13.110 10.395 6.631 1.00 0.17 C ATOM 0 H ALA A 42 11.097 9.000 6.223 1.00 0.16 H new ATOM 0 HA ALA A 42 11.563 11.462 7.650 1.00 0.17 H new ATOM 0 HB1 ALA A 42 13.824 11.217 6.687 1.00 0.17 H new ATOM 0 HB2 ALA A 42 13.275 9.714 7.466 1.00 0.17 H new ATOM 0 HB3 ALA A 42 13.247 9.859 5.692 1.00 0.17 H new ATOM 593 N VAL A 43 11.023 11.464 4.427 1.00 0.14 N ATOM 594 CA VAL A 43 10.738 12.337 3.301 1.00 0.15 C ATOM 595 C VAL A 43 9.237 12.596 3.178 1.00 0.18 C ATOM 596 O VAL A 43 8.438 11.670 3.047 1.00 0.21 O ATOM 597 CB VAL A 43 11.298 11.772 1.971 1.00 0.13 C ATOM 598 CG1 VAL A 43 10.835 10.344 1.732 1.00 0.13 C ATOM 599 CG2 VAL A 43 10.904 12.661 0.804 1.00 0.16 C ATOM 0 H VAL A 43 10.856 10.473 4.250 1.00 0.14 H new ATOM 0 HA VAL A 43 11.243 13.283 3.496 1.00 0.15 H new ATOM 0 HB VAL A 43 12.385 11.760 2.050 1.00 0.13 H new ATOM 0 HG11 VAL A 43 11.247 9.981 0.791 1.00 0.13 H new ATOM 0 HG12 VAL A 43 11.179 9.709 2.548 1.00 0.13 H new ATOM 0 HG13 VAL A 43 9.746 10.317 1.686 1.00 0.13 H new ATOM 0 HG21 VAL A 43 11.307 12.247 -0.121 1.00 0.16 H new ATOM 0 HG22 VAL A 43 9.817 12.712 0.736 1.00 0.16 H new ATOM 0 HG23 VAL A 43 11.305 13.663 0.958 1.00 0.16 H new ATOM 609 N ASP A 44 8.856 13.860 3.257 1.00 0.27 N ATOM 610 CA ASP A 44 7.459 14.238 3.118 1.00 0.34 C ATOM 611 C ASP A 44 7.083 14.320 1.657 1.00 0.32 C ATOM 612 O ASP A 44 7.813 14.888 0.840 1.00 0.39 O ATOM 613 CB ASP A 44 7.166 15.560 3.826 1.00 0.49 C ATOM 614 CG ASP A 44 7.350 15.454 5.325 1.00 0.57 C ATOM 615 OD1 ASP A 44 8.201 16.188 5.878 1.00 0.63 O ATOM 616 OD2 ASP A 44 6.647 14.645 5.960 1.00 0.70 O ATOM 0 H ASP A 44 9.493 14.641 3.416 1.00 0.27 H new ATOM 0 HA ASP A 44 6.852 13.468 3.594 1.00 0.34 H new ATOM 0 HB2 ASP A 44 7.825 16.335 3.434 1.00 0.49 H new ATOM 0 HB3 ASP A 44 6.144 15.870 3.607 1.00 0.49 H new ATOM 621 N GLY A 45 5.940 13.751 1.339 1.00 0.29 N ATOM 622 CA GLY A 45 5.521 13.644 -0.032 1.00 0.27 C ATOM 623 C GLY A 45 5.567 12.211 -0.508 1.00 0.22 C ATOM 624 O GLY A 45 5.395 11.931 -1.692 1.00 0.21 O ATOM 0 H GLY A 45 5.287 13.356 2.016 1.00 0.29 H new ATOM 0 HA2 GLY A 45 4.508 14.032 -0.137 1.00 0.27 H new ATOM 0 HA3 GLY A 45 6.165 14.259 -0.661 1.00 0.27 H new ATOM 628 N CYS A 46 5.767 11.300 0.432 1.00 0.19 N ATOM 629 CA CYS A 46 5.903 9.885 0.124 1.00 0.15 C ATOM 630 C CYS A 46 4.710 9.125 0.676 1.00 0.14 C ATOM 631 O CYS A 46 4.328 9.307 1.828 1.00 0.19 O ATOM 632 CB CYS A 46 7.199 9.328 0.728 1.00 0.14 C ATOM 633 SG CYS A 46 7.405 7.529 0.534 1.00 0.13 S ATOM 0 H CYS A 46 5.839 11.519 1.425 1.00 0.19 H new ATOM 0 HA CYS A 46 5.942 9.763 -0.958 1.00 0.15 H new ATOM 0 HB2 CYS A 46 8.047 9.831 0.264 1.00 0.14 H new ATOM 0 HB3 CYS A 46 7.225 9.572 1.790 1.00 0.14 H new ATOM 638 N THR A 47 4.096 8.303 -0.152 1.00 0.12 N ATOM 639 CA THR A 47 2.956 7.523 0.292 1.00 0.12 C ATOM 640 C THR A 47 3.304 6.047 0.338 1.00 0.12 C ATOM 641 O THR A 47 2.711 5.275 1.093 1.00 0.13 O ATOM 642 CB THR A 47 1.740 7.728 -0.623 1.00 0.13 C ATOM 643 OG1 THR A 47 1.996 7.157 -1.917 1.00 0.18 O ATOM 644 CG2 THR A 47 1.427 9.212 -0.762 1.00 0.12 C ATOM 0 H THR A 47 4.363 8.158 -1.126 1.00 0.12 H new ATOM 0 HA THR A 47 2.700 7.870 1.293 1.00 0.12 H new ATOM 0 HB THR A 47 0.880 7.229 -0.178 1.00 0.13 H new ATOM 0 HG1 THR A 47 2.776 7.593 -2.318 1.00 0.18 H new ATOM 0 HG21 THR A 47 0.563 9.342 -1.413 1.00 0.12 H new ATOM 0 HG22 THR A 47 1.208 9.631 0.220 1.00 0.12 H new ATOM 0 HG23 THR A 47 2.286 9.726 -1.192 1.00 0.12 H new ATOM 652 N HIS A 48 4.274 5.659 -0.471 1.00 0.13 N ATOM 653 CA HIS A 48 4.684 4.267 -0.539 1.00 0.14 C ATOM 654 C HIS A 48 6.114 4.177 -1.021 1.00 0.13 C ATOM 655 O HIS A 48 6.635 5.104 -1.635 1.00 0.20 O ATOM 656 CB HIS A 48 3.757 3.450 -1.453 1.00 0.15 C ATOM 657 CG HIS A 48 3.865 3.776 -2.910 1.00 0.14 C ATOM 658 ND1 HIS A 48 3.422 4.957 -3.459 1.00 0.17 N ATOM 659 CD2 HIS A 48 4.364 3.051 -3.937 1.00 0.16 C ATOM 660 CE1 HIS A 48 3.643 4.943 -4.758 1.00 0.17 C ATOM 661 NE2 HIS A 48 4.214 3.797 -5.078 1.00 0.17 N ATOM 0 H HIS A 48 4.791 6.285 -1.088 1.00 0.13 H new ATOM 0 HA HIS A 48 4.614 3.843 0.463 1.00 0.14 H new ATOM 0 HB2 HIS A 48 3.975 2.391 -1.315 1.00 0.15 H new ATOM 0 HB3 HIS A 48 2.726 3.607 -1.135 1.00 0.15 H new ATOM 0 HD1 HIS A 48 2.990 5.723 -2.942 1.00 0.17 H new ATOM 0 HD2 HIS A 48 4.801 2.065 -3.871 1.00 0.16 H new ATOM 0 HE1 HIS A 48 3.397 5.738 -5.447 1.00 0.17 H new ATOM 669 N PHE A 49 6.728 3.052 -0.758 1.00 0.13 N ATOM 670 CA PHE A 49 8.126 2.851 -1.076 1.00 0.13 C ATOM 671 C PHE A 49 8.314 1.542 -1.816 1.00 0.13 C ATOM 672 O PHE A 49 7.395 0.726 -1.911 1.00 0.18 O ATOM 673 CB PHE A 49 8.964 2.861 0.210 1.00 0.13 C ATOM 674 CG PHE A 49 8.232 2.271 1.385 1.00 0.14 C ATOM 675 CD1 PHE A 49 7.646 1.024 1.297 1.00 0.21 C ATOM 676 CD2 PHE A 49 8.106 2.978 2.564 1.00 0.18 C ATOM 677 CE1 PHE A 49 6.947 0.499 2.362 1.00 0.27 C ATOM 678 CE2 PHE A 49 7.415 2.456 3.634 1.00 0.22 C ATOM 679 CZ PHE A 49 6.832 1.216 3.533 1.00 0.25 C ATOM 0 H PHE A 49 6.278 2.249 -0.319 1.00 0.13 H new ATOM 0 HA PHE A 49 8.461 3.664 -1.720 1.00 0.13 H new ATOM 0 HB2 PHE A 49 9.885 2.302 0.043 1.00 0.13 H new ATOM 0 HB3 PHE A 49 9.251 3.886 0.444 1.00 0.13 H new ATOM 0 HD1 PHE A 49 7.736 0.454 0.384 1.00 0.21 H new ATOM 0 HD2 PHE A 49 8.557 3.956 2.648 1.00 0.18 H new ATOM 0 HE1 PHE A 49 6.489 -0.475 2.279 1.00 0.27 H new ATOM 0 HE2 PHE A 49 7.331 3.020 4.551 1.00 0.22 H new ATOM 0 HZ PHE A 49 6.285 0.805 4.369 1.00 0.25 H new ATOM 689 N THR A 50 9.496 1.361 -2.348 1.00 0.11 N ATOM 690 CA THR A 50 9.861 0.130 -2.998 1.00 0.11 C ATOM 691 C THR A 50 11.222 -0.327 -2.507 1.00 0.10 C ATOM 692 O THR A 50 12.248 0.278 -2.833 1.00 0.11 O ATOM 693 CB THR A 50 9.893 0.282 -4.532 1.00 0.14 C ATOM 694 OG1 THR A 50 8.597 0.670 -5.019 1.00 0.15 O ATOM 695 CG2 THR A 50 10.318 -1.020 -5.196 1.00 0.19 C ATOM 0 H THR A 50 10.234 2.065 -2.342 1.00 0.11 H new ATOM 0 HA THR A 50 9.104 -0.614 -2.748 1.00 0.11 H new ATOM 0 HB THR A 50 10.620 1.055 -4.781 1.00 0.14 H new ATOM 0 HG1 THR A 50 8.026 0.923 -4.264 1.00 0.15 H new ATOM 0 HG21 THR A 50 10.333 -0.889 -6.278 1.00 0.19 H new ATOM 0 HG22 THR A 50 11.314 -1.297 -4.850 1.00 0.19 H new ATOM 0 HG23 THR A 50 9.612 -1.808 -4.936 1.00 0.19 H new ATOM 703 N TYR A 51 11.232 -1.372 -1.703 1.00 0.11 N ATOM 704 CA TYR A 51 12.474 -1.974 -1.287 1.00 0.13 C ATOM 705 C TYR A 51 12.902 -2.946 -2.338 1.00 0.18 C ATOM 706 O TYR A 51 12.152 -3.838 -2.714 1.00 0.41 O ATOM 707 CB TYR A 51 12.358 -2.772 0.010 1.00 0.20 C ATOM 708 CG TYR A 51 11.297 -2.345 0.991 1.00 0.11 C ATOM 709 CD1 TYR A 51 11.412 -1.167 1.689 1.00 0.23 C ATOM 710 CD2 TYR A 51 10.220 -3.176 1.271 1.00 0.09 C ATOM 711 CE1 TYR A 51 10.484 -0.818 2.647 1.00 0.33 C ATOM 712 CE2 TYR A 51 9.280 -2.830 2.213 1.00 0.18 C ATOM 713 CZ TYR A 51 9.423 -1.652 2.901 1.00 0.31 C ATOM 714 OH TYR A 51 8.518 -1.321 3.865 1.00 0.46 O ATOM 0 H TYR A 51 10.395 -1.818 -1.328 1.00 0.11 H new ATOM 0 HA TYR A 51 13.178 -1.157 -1.133 1.00 0.13 H new ATOM 0 HB2 TYR A 51 12.177 -3.815 -0.251 1.00 0.20 H new ATOM 0 HB3 TYR A 51 13.322 -2.733 0.517 1.00 0.20 H new ATOM 0 HD1 TYR A 51 12.241 -0.505 1.484 1.00 0.23 H new ATOM 0 HD2 TYR A 51 10.119 -4.111 0.739 1.00 0.09 H new ATOM 0 HE1 TYR A 51 10.591 0.107 3.195 1.00 0.33 H new ATOM 0 HE2 TYR A 51 8.439 -3.478 2.409 1.00 0.18 H new ATOM 0 HH TYR A 51 8.158 -0.428 3.683 1.00 0.46 H new ATOM 724 N ASN A 52 14.097 -2.793 -2.811 1.00 0.10 N ATOM 725 CA ASN A 52 14.646 -3.797 -3.662 1.00 0.12 C ATOM 726 C ASN A 52 15.382 -4.785 -2.784 1.00 0.13 C ATOM 727 O ASN A 52 16.358 -4.433 -2.153 1.00 0.17 O ATOM 728 CB ASN A 52 15.572 -3.167 -4.674 1.00 0.14 C ATOM 729 CG ASN A 52 15.794 -4.077 -5.862 1.00 0.15 C ATOM 730 OD1 ASN A 52 16.748 -4.846 -5.892 1.00 0.17 O ATOM 731 ND2 ASN A 52 14.887 -4.021 -6.829 1.00 0.16 N ATOM 0 H ASN A 52 14.704 -1.994 -2.626 1.00 0.10 H new ATOM 0 HA ASN A 52 13.862 -4.311 -4.218 1.00 0.12 H new ATOM 0 HB2 ASN A 52 15.152 -2.220 -5.013 1.00 0.14 H new ATOM 0 HB3 ASN A 52 16.529 -2.941 -4.203 1.00 0.14 H new ATOM 0 HD21 ASN A 52 14.968 -4.634 -7.640 1.00 0.16 H new ATOM 0 HD22 ASN A 52 14.109 -3.365 -6.761 1.00 0.16 H new ATOM 738 N ASP A 53 14.857 -5.985 -2.658 1.00 0.12 N ATOM 739 CA ASP A 53 15.463 -7.007 -1.824 1.00 0.14 C ATOM 740 C ASP A 53 16.795 -7.464 -2.412 1.00 0.17 C ATOM 741 O ASP A 53 17.686 -7.906 -1.689 1.00 0.23 O ATOM 742 CB ASP A 53 14.490 -8.178 -1.666 1.00 0.14 C ATOM 743 CG ASP A 53 15.064 -9.312 -0.849 1.00 0.25 C ATOM 744 OD1 ASP A 53 14.952 -9.256 0.393 1.00 0.36 O ATOM 745 OD2 ASP A 53 15.610 -10.265 -1.442 1.00 0.30 O ATOM 0 H ASP A 53 14.001 -6.281 -3.128 1.00 0.12 H new ATOM 0 HA ASP A 53 15.671 -6.592 -0.838 1.00 0.14 H new ATOM 0 HB2 ASP A 53 13.575 -7.822 -1.192 1.00 0.14 H new ATOM 0 HB3 ASP A 53 14.214 -8.551 -2.653 1.00 0.14 H new ATOM 750 N ASP A 54 16.933 -7.300 -3.720 1.00 0.18 N ATOM 751 CA ASP A 54 18.155 -7.679 -4.418 1.00 0.22 C ATOM 752 C ASP A 54 19.265 -6.647 -4.188 1.00 0.25 C ATOM 753 O ASP A 54 20.373 -6.995 -3.787 1.00 0.37 O ATOM 754 CB ASP A 54 17.877 -7.832 -5.917 1.00 0.23 C ATOM 755 CG ASP A 54 19.100 -8.282 -6.690 1.00 0.31 C ATOM 756 OD1 ASP A 54 19.871 -7.414 -7.152 1.00 0.46 O ATOM 757 OD2 ASP A 54 19.293 -9.510 -6.841 1.00 0.31 O ATOM 0 H ASP A 54 16.211 -6.905 -4.322 1.00 0.18 H new ATOM 0 HA ASP A 54 18.494 -8.634 -4.018 1.00 0.22 H new ATOM 0 HB2 ASP A 54 17.073 -8.554 -6.063 1.00 0.23 H new ATOM 0 HB3 ASP A 54 17.528 -6.880 -6.318 1.00 0.23 H new ATOM 762 N SER A 55 18.951 -5.373 -4.417 1.00 0.17 N ATOM 763 CA SER A 55 19.927 -4.298 -4.306 1.00 0.19 C ATOM 764 C SER A 55 19.840 -3.627 -2.944 1.00 0.19 C ATOM 765 O SER A 55 20.561 -2.670 -2.655 1.00 0.24 O ATOM 766 CB SER A 55 19.681 -3.275 -5.409 1.00 0.21 C ATOM 767 OG SER A 55 19.895 -3.837 -6.694 1.00 0.28 O ATOM 0 H SER A 55 18.017 -5.061 -4.683 1.00 0.17 H new ATOM 0 HA SER A 55 20.927 -4.719 -4.414 1.00 0.19 H new ATOM 0 HB2 SER A 55 18.659 -2.901 -5.339 1.00 0.21 H new ATOM 0 HB3 SER A 55 20.343 -2.421 -5.269 1.00 0.21 H new ATOM 0 HG SER A 55 19.728 -3.158 -7.380 1.00 0.28 H new ATOM 773 N LYS A 56 18.960 -4.172 -2.105 1.00 0.16 N ATOM 774 CA LYS A 56 18.647 -3.625 -0.792 1.00 0.16 C ATOM 775 C LYS A 56 18.432 -2.116 -0.826 1.00 0.14 C ATOM 776 O LYS A 56 18.685 -1.425 0.153 1.00 0.17 O ATOM 777 CB LYS A 56 19.762 -4.010 0.153 1.00 0.21 C ATOM 778 CG LYS A 56 20.083 -5.487 0.057 1.00 0.29 C ATOM 779 CD LYS A 56 21.483 -5.801 0.521 1.00 0.50 C ATOM 780 CE LYS A 56 22.543 -5.167 -0.372 1.00 1.20 C ATOM 781 NZ LYS A 56 23.910 -5.355 0.173 1.00 1.31 N ATOM 0 H LYS A 56 18.438 -5.020 -2.325 1.00 0.16 H new ATOM 0 HA LYS A 56 17.702 -4.043 -0.444 1.00 0.16 H new ATOM 0 HB2 LYS A 56 20.654 -3.427 -0.077 1.00 0.21 H new ATOM 0 HB3 LYS A 56 19.475 -3.764 1.176 1.00 0.21 H new ATOM 0 HG2 LYS A 56 19.369 -6.051 0.657 1.00 0.29 H new ATOM 0 HG3 LYS A 56 19.963 -5.816 -0.975 1.00 0.29 H new ATOM 0 HD2 LYS A 56 21.613 -5.446 1.544 1.00 0.50 H new ATOM 0 HD3 LYS A 56 21.624 -6.882 0.538 1.00 0.50 H new ATOM 0 HE2 LYS A 56 22.486 -5.604 -1.369 1.00 1.20 H new ATOM 0 HE3 LYS A 56 22.338 -4.102 -0.479 1.00 1.20 H new ATOM 0 HZ1 LYS A 56 24.606 -5.260 -0.594 1.00 1.31 H new ATOM 0 HZ2 LYS A 56 24.096 -4.635 0.900 1.00 1.31 H new ATOM 0 HZ3 LYS A 56 23.988 -6.302 0.596 1.00 1.31 H new ATOM 795 N MET A 57 17.917 -1.623 -1.945 1.00 0.12 N ATOM 796 CA MET A 57 17.784 -0.191 -2.150 1.00 0.13 C ATOM 797 C MET A 57 16.358 0.256 -1.869 1.00 0.13 C ATOM 798 O MET A 57 15.399 -0.465 -2.157 1.00 0.22 O ATOM 799 CB MET A 57 18.203 0.177 -3.574 1.00 0.13 C ATOM 800 CG MET A 57 17.166 -0.102 -4.642 1.00 0.14 C ATOM 801 SD MET A 57 17.750 0.336 -6.290 1.00 0.24 S ATOM 802 CE MET A 57 16.466 -0.382 -7.312 1.00 1.62 C ATOM 0 H MET A 57 17.586 -2.195 -2.722 1.00 0.12 H new ATOM 0 HA MET A 57 18.442 0.328 -1.454 1.00 0.13 H new ATOM 0 HB2 MET A 57 18.452 1.238 -3.600 1.00 0.13 H new ATOM 0 HB3 MET A 57 19.113 -0.370 -3.821 1.00 0.13 H new ATOM 0 HG2 MET A 57 16.901 -1.159 -4.621 1.00 0.14 H new ATOM 0 HG3 MET A 57 16.258 0.458 -4.419 1.00 0.14 H new ATOM 0 HE1 MET A 57 16.589 -0.045 -8.341 1.00 1.62 H new ATOM 0 HE2 MET A 57 16.537 -1.469 -7.275 1.00 1.62 H new ATOM 0 HE3 MET A 57 15.489 -0.069 -6.942 1.00 1.62 H new ATOM 812 N CYS A 58 16.232 1.431 -1.288 1.00 0.08 N ATOM 813 CA CYS A 58 14.941 1.974 -0.926 1.00 0.07 C ATOM 814 C CYS A 58 14.506 3.055 -1.896 1.00 0.07 C ATOM 815 O CYS A 58 15.080 4.139 -1.924 1.00 0.09 O ATOM 816 CB CYS A 58 14.988 2.556 0.477 1.00 0.08 C ATOM 817 SG CYS A 58 13.452 3.399 0.958 1.00 0.08 S ATOM 0 H CYS A 58 17.020 2.035 -1.054 1.00 0.08 H new ATOM 0 HA CYS A 58 14.220 1.158 -0.964 1.00 0.07 H new ATOM 0 HB2 CYS A 58 15.193 1.756 1.188 1.00 0.08 H new ATOM 0 HB3 CYS A 58 15.817 3.261 0.543 1.00 0.08 H new ATOM 822 N HIS A 59 13.496 2.761 -2.690 1.00 0.08 N ATOM 823 CA HIS A 59 12.927 3.752 -3.588 1.00 0.08 C ATOM 824 C HIS A 59 11.655 4.339 -2.989 1.00 0.08 C ATOM 825 O HIS A 59 10.578 3.763 -3.132 1.00 0.09 O ATOM 826 CB HIS A 59 12.613 3.132 -4.954 1.00 0.10 C ATOM 827 CG HIS A 59 13.723 3.225 -5.956 1.00 0.12 C ATOM 828 ND1 HIS A 59 13.660 4.022 -7.082 1.00 0.16 N ATOM 829 CD2 HIS A 59 14.913 2.588 -6.020 1.00 0.14 C ATOM 830 CE1 HIS A 59 14.760 3.867 -7.792 1.00 0.18 C ATOM 831 NE2 HIS A 59 15.536 3.005 -7.168 1.00 0.17 N ATOM 0 H HIS A 59 13.051 1.844 -2.733 1.00 0.08 H new ATOM 0 HA HIS A 59 13.661 4.546 -3.724 1.00 0.08 H new ATOM 0 HB2 HIS A 59 12.359 2.082 -4.811 1.00 0.10 H new ATOM 0 HB3 HIS A 59 11.730 3.621 -5.365 1.00 0.10 H new ATOM 0 HD1 HIS A 59 12.883 4.636 -7.327 1.00 0.16 H new ATOM 0 HD2 HIS A 59 15.301 1.882 -5.301 1.00 0.14 H new ATOM 0 HE1 HIS A 59 14.986 4.362 -8.725 1.00 0.18 H new ATOM 839 N VAL A 60 11.785 5.474 -2.315 1.00 0.07 N ATOM 840 CA VAL A 60 10.620 6.194 -1.813 1.00 0.07 C ATOM 841 C VAL A 60 9.880 6.817 -2.980 1.00 0.08 C ATOM 842 O VAL A 60 10.494 7.428 -3.852 1.00 0.09 O ATOM 843 CB VAL A 60 10.988 7.298 -0.790 1.00 0.07 C ATOM 844 CG1 VAL A 60 11.035 6.732 0.622 1.00 0.08 C ATOM 845 CG2 VAL A 60 12.321 7.941 -1.143 1.00 0.09 C ATOM 0 H VAL A 60 12.680 5.915 -2.104 1.00 0.07 H new ATOM 0 HA VAL A 60 9.991 5.471 -1.292 1.00 0.07 H new ATOM 0 HB VAL A 60 10.213 8.064 -0.831 1.00 0.07 H new ATOM 0 HG11 VAL A 60 11.295 7.525 1.323 1.00 0.08 H new ATOM 0 HG12 VAL A 60 10.059 6.323 0.883 1.00 0.08 H new ATOM 0 HG13 VAL A 60 11.785 5.942 0.673 1.00 0.08 H new ATOM 0 HG21 VAL A 60 12.558 8.713 -0.411 1.00 0.09 H new ATOM 0 HG22 VAL A 60 13.104 7.182 -1.137 1.00 0.09 H new ATOM 0 HG23 VAL A 60 12.258 8.389 -2.135 1.00 0.09 H new ATOM 855 N LYS A 61 8.573 6.646 -3.017 1.00 0.09 N ATOM 856 CA LYS A 61 7.795 7.090 -4.157 1.00 0.11 C ATOM 857 C LYS A 61 6.598 7.921 -3.728 1.00 0.11 C ATOM 858 O LYS A 61 6.200 7.918 -2.559 1.00 0.11 O ATOM 859 CB LYS A 61 7.360 5.885 -4.988 1.00 0.14 C ATOM 860 CG LYS A 61 8.516 5.249 -5.741 1.00 0.13 C ATOM 861 CD LYS A 61 8.123 3.944 -6.410 1.00 0.22 C ATOM 862 CE LYS A 61 9.276 3.386 -7.235 1.00 0.20 C ATOM 863 NZ LYS A 61 9.242 1.910 -7.360 1.00 1.22 N ATOM 0 H LYS A 61 8.030 6.205 -2.275 1.00 0.09 H new ATOM 0 HA LYS A 61 8.424 7.733 -4.772 1.00 0.11 H new ATOM 0 HB2 LYS A 61 6.904 5.142 -4.334 1.00 0.14 H new ATOM 0 HB3 LYS A 61 6.595 6.196 -5.699 1.00 0.14 H new ATOM 0 HG2 LYS A 61 8.881 5.945 -6.496 1.00 0.13 H new ATOM 0 HG3 LYS A 61 9.339 5.067 -5.050 1.00 0.13 H new ATOM 0 HD2 LYS A 61 7.827 3.217 -5.653 1.00 0.22 H new ATOM 0 HD3 LYS A 61 7.257 4.106 -7.052 1.00 0.22 H new ATOM 0 HE2 LYS A 61 9.250 3.829 -8.230 1.00 0.20 H new ATOM 0 HE3 LYS A 61 10.219 3.684 -6.778 1.00 0.20 H new ATOM 0 HZ1 LYS A 61 10.208 1.551 -7.503 1.00 1.22 H new ATOM 0 HZ2 LYS A 61 8.844 1.497 -6.492 1.00 1.22 H new ATOM 0 HZ3 LYS A 61 8.650 1.644 -8.173 1.00 1.22 H new ATOM 877 N GLU A 62 6.012 8.606 -4.693 1.00 0.10 N ATOM 878 CA GLU A 62 4.941 9.549 -4.417 1.00 0.11 C ATOM 879 C GLU A 62 3.581 8.900 -4.597 1.00 0.12 C ATOM 880 O GLU A 62 3.485 7.772 -5.076 1.00 0.12 O ATOM 881 CB GLU A 62 5.030 10.802 -5.290 1.00 0.12 C ATOM 882 CG GLU A 62 6.402 11.452 -5.305 1.00 0.12 C ATOM 883 CD GLU A 62 6.350 12.912 -5.709 1.00 0.17 C ATOM 884 OE1 GLU A 62 6.736 13.240 -6.849 1.00 0.39 O ATOM 885 OE2 GLU A 62 5.922 13.745 -4.885 1.00 0.40 O ATOM 0 H GLU A 62 6.260 8.527 -5.679 1.00 0.10 H new ATOM 0 HA GLU A 62 5.061 9.853 -3.377 1.00 0.11 H new ATOM 0 HB2 GLU A 62 4.753 10.540 -6.311 1.00 0.12 H new ATOM 0 HB3 GLU A 62 4.299 11.530 -4.938 1.00 0.12 H new ATOM 0 HG2 GLU A 62 6.851 11.368 -4.315 1.00 0.12 H new ATOM 0 HG3 GLU A 62 7.049 10.911 -5.995 1.00 0.12 H new ATOM 892 N GLY A 63 2.555 9.628 -4.186 1.00 0.13 N ATOM 893 CA GLY A 63 1.205 9.108 -4.034 1.00 0.13 C ATOM 894 C GLY A 63 0.719 8.132 -5.089 1.00 0.14 C ATOM 895 O GLY A 63 1.036 8.243 -6.276 1.00 0.18 O ATOM 0 H GLY A 63 2.639 10.615 -3.944 1.00 0.13 H new ATOM 0 HA2 GLY A 63 1.138 8.618 -3.063 1.00 0.13 H new ATOM 0 HA3 GLY A 63 0.517 9.953 -4.012 1.00 0.13 H new ATOM 899 N LYS A 64 -0.102 7.195 -4.608 1.00 0.16 N ATOM 900 CA LYS A 64 -0.692 6.124 -5.406 1.00 0.16 C ATOM 901 C LYS A 64 0.339 5.161 -5.985 1.00 0.15 C ATOM 902 O LYS A 64 1.226 5.539 -6.748 1.00 0.17 O ATOM 903 CB LYS A 64 -1.587 6.691 -6.489 1.00 0.19 C ATOM 904 CG LYS A 64 -2.870 7.270 -5.928 1.00 0.30 C ATOM 905 CD LYS A 64 -3.562 8.171 -6.923 1.00 0.73 C ATOM 906 CE LYS A 64 -2.912 9.542 -6.975 1.00 0.54 C ATOM 907 NZ LYS A 64 -3.618 10.453 -7.916 1.00 1.10 N ATOM 0 H LYS A 64 -0.380 7.162 -3.627 1.00 0.16 H new ATOM 0 HA LYS A 64 -1.301 5.531 -4.724 1.00 0.16 H new ATOM 0 HB2 LYS A 64 -1.048 7.466 -7.034 1.00 0.19 H new ATOM 0 HB3 LYS A 64 -1.828 5.906 -7.206 1.00 0.19 H new ATOM 0 HG2 LYS A 64 -3.541 6.459 -5.644 1.00 0.30 H new ATOM 0 HG3 LYS A 64 -2.649 7.833 -5.021 1.00 0.30 H new ATOM 0 HD2 LYS A 64 -3.531 7.714 -7.912 1.00 0.73 H new ATOM 0 HD3 LYS A 64 -4.613 8.275 -6.652 1.00 0.73 H new ATOM 0 HE2 LYS A 64 -2.909 9.981 -5.977 1.00 0.54 H new ATOM 0 HE3 LYS A 64 -1.871 9.439 -7.281 1.00 0.54 H new ATOM 0 HZ1 LYS A 64 -3.329 11.435 -7.731 1.00 1.10 H new ATOM 0 HZ2 LYS A 64 -3.374 10.199 -8.894 1.00 1.10 H new ATOM 0 HZ3 LYS A 64 -4.645 10.363 -7.781 1.00 1.10 H new ATOM 921 N PRO A 65 0.227 3.882 -5.604 1.00 0.17 N ATOM 922 CA PRO A 65 1.084 2.831 -6.108 1.00 0.19 C ATOM 923 C PRO A 65 0.620 2.313 -7.458 1.00 0.22 C ATOM 924 O PRO A 65 -0.557 2.401 -7.810 1.00 0.52 O ATOM 925 CB PRO A 65 1.000 1.743 -5.039 1.00 0.32 C ATOM 926 CG PRO A 65 -0.285 1.975 -4.316 1.00 0.35 C ATOM 927 CD PRO A 65 -0.762 3.369 -4.652 1.00 0.19 C ATOM 0 HA PRO A 65 2.102 3.180 -6.278 1.00 0.19 H new ATOM 0 HB2 PRO A 65 1.020 0.751 -5.490 1.00 0.32 H new ATOM 0 HB3 PRO A 65 1.848 1.801 -4.356 1.00 0.32 H new ATOM 0 HG2 PRO A 65 -1.029 1.235 -4.613 1.00 0.35 H new ATOM 0 HG3 PRO A 65 -0.142 1.870 -3.241 1.00 0.35 H new ATOM 0 HD2 PRO A 65 -1.760 3.351 -5.089 1.00 0.19 H new ATOM 0 HD3 PRO A 65 -0.815 3.995 -3.761 1.00 0.19 H new ATOM 935 N ASP A 66 1.565 1.782 -8.197 1.00 0.22 N ATOM 936 CA ASP A 66 1.335 1.293 -9.539 1.00 0.21 C ATOM 937 C ASP A 66 2.152 0.022 -9.716 1.00 0.20 C ATOM 938 O ASP A 66 3.268 0.049 -10.229 1.00 0.19 O ATOM 939 CB ASP A 66 1.761 2.353 -10.549 1.00 0.21 C ATOM 940 CG ASP A 66 1.229 2.081 -11.942 1.00 0.25 C ATOM 941 OD1 ASP A 66 0.295 2.777 -12.375 1.00 0.40 O ATOM 942 OD2 ASP A 66 1.744 1.159 -12.610 1.00 0.34 O ATOM 0 H ASP A 66 2.529 1.675 -7.880 1.00 0.22 H new ATOM 0 HA ASP A 66 0.278 1.079 -9.700 1.00 0.21 H new ATOM 0 HB2 ASP A 66 1.410 3.329 -10.215 1.00 0.21 H new ATOM 0 HB3 ASP A 66 2.849 2.400 -10.583 1.00 0.21 H new ATOM 947 N LEU A 67 1.598 -1.070 -9.235 1.00 0.21 N ATOM 948 CA LEU A 67 2.328 -2.310 -9.069 1.00 0.20 C ATOM 949 C LEU A 67 2.656 -3.016 -10.377 1.00 0.22 C ATOM 950 O LEU A 67 1.833 -3.100 -11.290 1.00 0.27 O ATOM 951 CB LEU A 67 1.530 -3.214 -8.150 1.00 0.23 C ATOM 952 CG LEU A 67 1.332 -2.622 -6.760 1.00 0.26 C ATOM 953 CD1 LEU A 67 0.413 -3.485 -5.925 1.00 0.31 C ATOM 954 CD2 LEU A 67 2.683 -2.448 -6.092 1.00 0.28 C ATOM 0 H LEU A 67 0.621 -1.124 -8.946 1.00 0.21 H new ATOM 0 HA LEU A 67 3.297 -2.067 -8.632 1.00 0.20 H new ATOM 0 HB2 LEU A 67 0.556 -3.410 -8.598 1.00 0.23 H new ATOM 0 HB3 LEU A 67 2.039 -4.174 -8.061 1.00 0.23 H new ATOM 0 HG LEU A 67 0.855 -1.646 -6.853 1.00 0.26 H new ATOM 0 HD11 LEU A 67 0.290 -3.038 -4.939 1.00 0.31 H new ATOM 0 HD12 LEU A 67 -0.559 -3.560 -6.413 1.00 0.31 H new ATOM 0 HD13 LEU A 67 0.844 -4.481 -5.821 1.00 0.31 H new ATOM 0 HD21 LEU A 67 2.545 -2.025 -5.097 1.00 0.28 H new ATOM 0 HD22 LEU A 67 3.175 -3.417 -6.009 1.00 0.28 H new ATOM 0 HD23 LEU A 67 3.301 -1.777 -6.689 1.00 0.28 H new ATOM 966 N TYR A 68 3.881 -3.517 -10.435 1.00 0.19 N ATOM 967 CA TYR A 68 4.368 -4.293 -11.569 1.00 0.21 C ATOM 968 C TYR A 68 5.334 -5.366 -11.083 1.00 0.22 C ATOM 969 O TYR A 68 5.802 -5.313 -9.941 1.00 0.21 O ATOM 970 CB TYR A 68 5.070 -3.395 -12.598 1.00 0.22 C ATOM 971 CG TYR A 68 6.309 -2.700 -12.074 1.00 0.21 C ATOM 972 CD1 TYR A 68 6.241 -1.406 -11.588 1.00 0.22 C ATOM 973 CD2 TYR A 68 7.541 -3.339 -12.062 1.00 0.25 C ATOM 974 CE1 TYR A 68 7.364 -0.767 -11.106 1.00 0.24 C ATOM 975 CE2 TYR A 68 8.671 -2.706 -11.580 1.00 0.28 C ATOM 976 CZ TYR A 68 8.575 -1.419 -11.101 1.00 0.27 C ATOM 977 OH TYR A 68 9.687 -0.780 -10.610 1.00 0.33 O ATOM 0 H TYR A 68 4.570 -3.397 -9.693 1.00 0.19 H new ATOM 0 HA TYR A 68 3.510 -4.761 -12.052 1.00 0.21 H new ATOM 0 HB2 TYR A 68 5.344 -3.999 -13.463 1.00 0.22 H new ATOM 0 HB3 TYR A 68 4.364 -2.641 -12.947 1.00 0.22 H new ATOM 0 HD1 TYR A 68 5.293 -0.888 -11.586 1.00 0.22 H new ATOM 0 HD2 TYR A 68 7.618 -4.349 -12.436 1.00 0.25 H new ATOM 0 HE1 TYR A 68 7.293 0.244 -10.733 1.00 0.24 H new ATOM 0 HE2 TYR A 68 9.622 -3.217 -11.579 1.00 0.28 H new ATOM 0 HH TYR A 68 10.462 -1.376 -10.676 1.00 0.33 H new ATOM 987 N ASP A 69 5.632 -6.325 -11.951 1.00 0.28 N ATOM 988 CA ASP A 69 6.561 -7.406 -11.629 1.00 0.31 C ATOM 989 C ASP A 69 7.980 -6.874 -11.471 1.00 0.25 C ATOM 990 O ASP A 69 8.555 -6.321 -12.405 1.00 0.31 O ATOM 991 CB ASP A 69 6.528 -8.481 -12.719 1.00 0.44 C ATOM 992 CG ASP A 69 7.490 -9.619 -12.440 1.00 1.40 C ATOM 993 OD1 ASP A 69 8.580 -9.646 -13.052 1.00 2.32 O ATOM 994 OD2 ASP A 69 7.174 -10.483 -11.599 1.00 1.40 O ATOM 0 H ASP A 69 5.241 -6.377 -12.892 1.00 0.28 H new ATOM 0 HA ASP A 69 6.248 -7.848 -10.683 1.00 0.31 H new ATOM 0 HB2 ASP A 69 5.516 -8.877 -12.804 1.00 0.44 H new ATOM 0 HB3 ASP A 69 6.774 -8.028 -13.679 1.00 0.44 H new ATOM 999 N LEU A 70 8.529 -7.046 -10.282 1.00 0.21 N ATOM 1000 CA LEU A 70 9.862 -6.560 -9.962 1.00 0.18 C ATOM 1001 C LEU A 70 10.630 -7.640 -9.217 1.00 0.17 C ATOM 1002 O LEU A 70 10.369 -7.876 -8.051 1.00 0.17 O ATOM 1003 CB LEU A 70 9.756 -5.287 -9.107 1.00 0.15 C ATOM 1004 CG LEU A 70 11.074 -4.750 -8.543 1.00 0.16 C ATOM 1005 CD1 LEU A 70 12.131 -4.647 -9.632 1.00 0.21 C ATOM 1006 CD2 LEU A 70 10.854 -3.394 -7.893 1.00 0.17 C ATOM 0 H LEU A 70 8.065 -7.526 -9.511 1.00 0.21 H new ATOM 0 HA LEU A 70 10.396 -6.319 -10.881 1.00 0.18 H new ATOM 0 HB2 LEU A 70 9.295 -4.505 -9.710 1.00 0.15 H new ATOM 0 HB3 LEU A 70 9.081 -5.487 -8.275 1.00 0.15 H new ATOM 0 HG LEU A 70 11.431 -5.450 -7.788 1.00 0.16 H new ATOM 0 HD11 LEU A 70 13.057 -4.263 -9.205 1.00 0.21 H new ATOM 0 HD12 LEU A 70 12.310 -5.633 -10.060 1.00 0.21 H new ATOM 0 HD13 LEU A 70 11.784 -3.971 -10.413 1.00 0.21 H new ATOM 0 HD21 LEU A 70 11.799 -3.023 -7.496 1.00 0.17 H new ATOM 0 HD22 LEU A 70 10.472 -2.693 -8.635 1.00 0.17 H new ATOM 0 HD23 LEU A 70 10.133 -3.492 -7.081 1.00 0.17 H new ATOM 1018 N THR A 71 11.556 -8.307 -9.894 1.00 0.26 N ATOM 1019 CA THR A 71 12.313 -9.393 -9.282 1.00 0.29 C ATOM 1020 C THR A 71 13.072 -8.915 -8.048 1.00 0.22 C ATOM 1021 O THR A 71 13.922 -8.027 -8.131 1.00 0.26 O ATOM 1022 CB THR A 71 13.315 -10.006 -10.265 1.00 0.42 C ATOM 1023 OG1 THR A 71 12.667 -10.275 -11.517 1.00 0.48 O ATOM 1024 CG2 THR A 71 13.889 -11.292 -9.697 1.00 0.49 C ATOM 0 H THR A 71 11.801 -8.116 -10.866 1.00 0.26 H new ATOM 0 HA THR A 71 11.585 -10.150 -8.991 1.00 0.29 H new ATOM 0 HB THR A 71 14.128 -9.298 -10.425 1.00 0.42 H new ATOM 0 HG1 THR A 71 13.313 -10.665 -12.142 1.00 0.48 H new ATOM 0 HG21 THR A 71 14.600 -11.717 -10.406 1.00 0.49 H new ATOM 0 HG22 THR A 71 14.397 -11.079 -8.757 1.00 0.49 H new ATOM 0 HG23 THR A 71 13.082 -12.004 -9.521 1.00 0.49 H new ATOM 1032 N GLY A 72 12.750 -9.506 -6.905 1.00 0.17 N ATOM 1033 CA GLY A 72 13.346 -9.082 -5.654 1.00 0.12 C ATOM 1034 C GLY A 72 12.705 -7.812 -5.160 1.00 0.13 C ATOM 1035 O GLY A 72 13.141 -7.208 -4.187 1.00 0.14 O ATOM 0 H GLY A 72 12.084 -10.274 -6.822 1.00 0.17 H new ATOM 0 HA2 GLY A 72 13.231 -9.867 -4.907 1.00 0.12 H new ATOM 0 HA3 GLY A 72 14.416 -8.926 -5.790 1.00 0.12 H new ATOM 1039 N GLY A 73 11.665 -7.403 -5.852 1.00 0.15 N ATOM 1040 CA GLY A 73 10.957 -6.206 -5.498 1.00 0.16 C ATOM 1041 C GLY A 73 10.057 -6.402 -4.310 1.00 0.14 C ATOM 1042 O GLY A 73 9.273 -7.352 -4.244 1.00 0.15 O ATOM 0 H GLY A 73 11.293 -7.890 -6.668 1.00 0.15 H new ATOM 0 HA2 GLY A 73 11.674 -5.414 -5.281 1.00 0.16 H new ATOM 0 HA3 GLY A 73 10.363 -5.873 -6.349 1.00 0.16 H new ATOM 1046 N LYS A 74 10.169 -5.501 -3.372 1.00 0.15 N ATOM 1047 CA LYS A 74 9.307 -5.499 -2.214 1.00 0.13 C ATOM 1048 C LYS A 74 8.724 -4.108 -2.031 1.00 0.12 C ATOM 1049 O LYS A 74 9.370 -3.212 -1.510 1.00 0.12 O ATOM 1050 CB LYS A 74 10.087 -5.959 -0.970 1.00 0.13 C ATOM 1051 CG LYS A 74 10.428 -7.444 -0.996 1.00 0.18 C ATOM 1052 CD LYS A 74 11.263 -7.887 0.196 1.00 0.22 C ATOM 1053 CE LYS A 74 11.538 -9.386 0.125 1.00 0.33 C ATOM 1054 NZ LYS A 74 12.419 -9.863 1.222 1.00 0.38 N ATOM 0 H LYS A 74 10.857 -4.748 -3.386 1.00 0.15 H new ATOM 0 HA LYS A 74 8.485 -6.201 -2.359 1.00 0.13 H new ATOM 0 HB2 LYS A 74 11.008 -5.382 -0.892 1.00 0.13 H new ATOM 0 HB3 LYS A 74 9.498 -5.743 -0.078 1.00 0.13 H new ATOM 0 HG2 LYS A 74 9.504 -8.022 -1.020 1.00 0.18 H new ATOM 0 HG3 LYS A 74 10.969 -7.670 -1.915 1.00 0.18 H new ATOM 0 HD2 LYS A 74 12.205 -7.338 0.212 1.00 0.22 H new ATOM 0 HD3 LYS A 74 10.740 -7.650 1.123 1.00 0.22 H new ATOM 0 HE2 LYS A 74 10.592 -9.926 0.164 1.00 0.33 H new ATOM 0 HE3 LYS A 74 12.000 -9.621 -0.834 1.00 0.33 H new ATOM 0 HZ1 LYS A 74 12.220 -10.865 1.416 1.00 0.38 H new ATOM 0 HZ2 LYS A 74 13.414 -9.756 0.939 1.00 0.38 H new ATOM 0 HZ3 LYS A 74 12.240 -9.302 2.079 1.00 0.38 H new ATOM 1068 N THR A 75 7.499 -3.935 -2.481 1.00 0.14 N ATOM 1069 CA THR A 75 6.825 -2.653 -2.390 1.00 0.15 C ATOM 1070 C THR A 75 5.697 -2.720 -1.370 1.00 0.16 C ATOM 1071 O THR A 75 5.137 -3.795 -1.130 1.00 0.22 O ATOM 1072 CB THR A 75 6.292 -2.212 -3.781 1.00 0.19 C ATOM 1073 OG1 THR A 75 7.372 -1.712 -4.568 1.00 0.26 O ATOM 1074 CG2 THR A 75 5.198 -1.155 -3.668 1.00 0.23 C ATOM 0 H THR A 75 6.944 -4.672 -2.917 1.00 0.14 H new ATOM 0 HA THR A 75 7.545 -1.906 -2.056 1.00 0.15 H new ATOM 0 HB THR A 75 5.852 -3.086 -4.262 1.00 0.19 H new ATOM 0 HG1 THR A 75 7.428 -0.739 -4.466 1.00 0.26 H new ATOM 0 HG21 THR A 75 4.856 -0.877 -4.665 1.00 0.23 H new ATOM 0 HG22 THR A 75 4.362 -1.557 -3.096 1.00 0.23 H new ATOM 0 HG23 THR A 75 5.594 -0.274 -3.162 1.00 0.23 H new ATOM 1082 N ALA A 76 5.414 -1.587 -0.737 1.00 0.14 N ATOM 1083 CA ALA A 76 4.307 -1.473 0.188 1.00 0.13 C ATOM 1084 C ALA A 76 4.053 -0.007 0.514 1.00 0.13 C ATOM 1085 O ALA A 76 4.767 0.882 0.040 1.00 0.15 O ATOM 1086 CB ALA A 76 4.582 -2.275 1.453 1.00 0.14 C ATOM 0 H ALA A 76 5.948 -0.726 -0.855 1.00 0.14 H new ATOM 0 HA ALA A 76 3.411 -1.884 -0.278 1.00 0.13 H new ATOM 0 HB1 ALA A 76 3.739 -2.177 2.136 1.00 0.14 H new ATOM 0 HB2 ALA A 76 4.720 -3.325 1.195 1.00 0.14 H new ATOM 0 HB3 ALA A 76 5.484 -1.898 1.934 1.00 0.14 H new ATOM 1092 N SER A 77 3.030 0.232 1.307 1.00 0.14 N ATOM 1093 CA SER A 77 2.664 1.574 1.732 1.00 0.13 C ATOM 1094 C SER A 77 3.455 1.996 2.964 1.00 0.15 C ATOM 1095 O SER A 77 3.893 1.160 3.749 1.00 0.18 O ATOM 1096 CB SER A 77 1.166 1.610 2.023 1.00 0.15 C ATOM 1097 OG SER A 77 0.859 2.351 3.195 1.00 0.27 O ATOM 0 H SER A 77 2.424 -0.499 1.679 1.00 0.14 H new ATOM 0 HA SER A 77 2.902 2.277 0.933 1.00 0.13 H new ATOM 0 HB2 SER A 77 0.644 2.048 1.172 1.00 0.15 H new ATOM 0 HB3 SER A 77 0.796 0.591 2.134 1.00 0.15 H new ATOM 0 HG SER A 77 0.682 1.734 3.935 1.00 0.27 H new ATOM 1103 N ARG A 78 3.604 3.314 3.124 1.00 0.15 N ATOM 1104 CA ARG A 78 4.358 3.904 4.231 1.00 0.18 C ATOM 1105 C ARG A 78 3.779 3.508 5.584 1.00 0.18 C ATOM 1106 O ARG A 78 4.440 3.631 6.617 1.00 0.21 O ATOM 1107 CB ARG A 78 4.352 5.425 4.112 1.00 0.18 C ATOM 1108 CG ARG A 78 2.959 6.035 4.150 1.00 0.14 C ATOM 1109 CD ARG A 78 3.015 7.545 4.285 1.00 0.19 C ATOM 1110 NE ARG A 78 3.802 7.966 5.448 1.00 0.21 N ATOM 1111 CZ ARG A 78 4.622 9.021 5.471 1.00 0.40 C ATOM 1112 NH1 ARG A 78 4.851 9.727 4.378 1.00 0.60 N ATOM 1113 NH2 ARG A 78 5.224 9.358 6.603 1.00 0.43 N ATOM 0 H ARG A 78 3.204 4.003 2.487 1.00 0.15 H new ATOM 0 HA ARG A 78 5.378 3.525 4.170 1.00 0.18 H new ATOM 0 HB2 ARG A 78 4.946 5.847 4.923 1.00 0.18 H new ATOM 0 HB3 ARG A 78 4.839 5.710 3.179 1.00 0.18 H new ATOM 0 HG2 ARG A 78 2.420 5.770 3.240 1.00 0.14 H new ATOM 0 HG3 ARG A 78 2.400 5.615 4.986 1.00 0.14 H new ATOM 0 HD2 ARG A 78 3.447 7.974 3.381 1.00 0.19 H new ATOM 0 HD3 ARG A 78 2.002 7.939 4.371 1.00 0.19 H new ATOM 0 HE ARG A 78 3.718 7.414 6.301 1.00 0.21 H new ATOM 0 HH11 ARG A 78 4.399 9.469 3.501 1.00 0.60 H new ATOM 0 HH12 ARG A 78 5.480 10.530 4.412 1.00 0.60 H new ATOM 0 HH21 ARG A 78 5.060 8.813 7.450 1.00 0.43 H new ATOM 0 HH22 ARG A 78 5.851 10.162 6.627 1.00 0.43 H new ATOM 1127 N SER A 79 2.528 3.093 5.575 1.00 0.17 N ATOM 1128 CA SER A 79 1.886 2.581 6.763 1.00 0.20 C ATOM 1129 C SER A 79 1.385 1.163 6.516 1.00 0.20 C ATOM 1130 O SER A 79 0.696 0.908 5.526 1.00 0.31 O ATOM 1131 CB SER A 79 0.725 3.487 7.157 1.00 0.22 C ATOM 1132 OG SER A 79 1.153 4.828 7.299 1.00 1.00 O ATOM 0 H SER A 79 1.933 3.102 4.747 1.00 0.17 H new ATOM 0 HA SER A 79 2.610 2.560 7.577 1.00 0.20 H new ATOM 0 HB2 SER A 79 -0.058 3.430 6.401 1.00 0.22 H new ATOM 0 HB3 SER A 79 0.290 3.139 8.094 1.00 0.22 H new ATOM 0 HG SER A 79 2.029 4.847 7.738 1.00 1.00 H new ATOM 1138 N CYS A 80 1.741 0.246 7.397 1.00 0.15 N ATOM 1139 CA CYS A 80 1.289 -1.133 7.282 1.00 0.16 C ATOM 1140 C CYS A 80 0.189 -1.405 8.295 1.00 0.18 C ATOM 1141 O CYS A 80 -0.443 -2.464 8.276 1.00 0.29 O ATOM 1142 CB CYS A 80 2.454 -2.090 7.512 1.00 0.19 C ATOM 1143 SG CYS A 80 3.953 -1.670 6.579 1.00 0.20 S ATOM 0 H CYS A 80 2.342 0.429 8.201 1.00 0.15 H new ATOM 0 HA CYS A 80 0.896 -1.291 6.278 1.00 0.16 H new ATOM 0 HB2 CYS A 80 2.693 -2.105 8.575 1.00 0.19 H new ATOM 0 HB3 CYS A 80 2.141 -3.098 7.241 1.00 0.19 H new ATOM 1148 N ASP A 81 -0.035 -0.436 9.175 1.00 0.20 N ATOM 1149 CA ASP A 81 -1.064 -0.541 10.200 1.00 0.23 C ATOM 1150 C ASP A 81 -2.448 -0.675 9.585 1.00 0.20 C ATOM 1151 O ASP A 81 -2.729 -0.107 8.529 1.00 0.24 O ATOM 1152 CB ASP A 81 -1.035 0.680 11.123 1.00 0.31 C ATOM 1153 CG ASP A 81 0.005 0.558 12.216 1.00 0.99 C ATOM 1154 OD1 ASP A 81 1.167 0.946 11.988 1.00 1.78 O ATOM 1155 OD2 ASP A 81 -0.338 0.077 13.316 1.00 1.03 O ATOM 0 H ASP A 81 0.489 0.439 9.198 1.00 0.20 H new ATOM 0 HA ASP A 81 -0.852 -1.439 10.781 1.00 0.23 H new ATOM 0 HB2 ASP A 81 -0.833 1.573 10.532 1.00 0.31 H new ATOM 0 HB3 ASP A 81 -2.018 0.813 11.575 1.00 0.31 H new ATOM 1160 N ARG A 82 -3.303 -1.436 10.249 1.00 0.19 N ATOM 1161 CA ARG A 82 -4.679 -1.610 9.812 1.00 0.18 C ATOM 1162 C ARG A 82 -5.638 -1.059 10.858 1.00 0.18 C ATOM 1163 O ARG A 82 -6.831 -1.355 10.840 1.00 0.29 O ATOM 1164 CB ARG A 82 -4.990 -3.087 9.566 1.00 0.25 C ATOM 1165 CG ARG A 82 -4.180 -3.719 8.448 1.00 0.37 C ATOM 1166 CD ARG A 82 -4.696 -5.115 8.141 1.00 0.53 C ATOM 1167 NE ARG A 82 -3.998 -5.742 7.019 1.00 1.31 N ATOM 1168 CZ ARG A 82 -4.542 -6.681 6.243 1.00 1.74 C ATOM 1169 NH1 ARG A 82 -5.789 -7.083 6.461 1.00 1.65 N ATOM 1170 NH2 ARG A 82 -3.840 -7.220 5.253 1.00 2.65 N ATOM 0 H ARG A 82 -3.066 -1.947 11.099 1.00 0.19 H new ATOM 0 HA ARG A 82 -4.807 -1.063 8.878 1.00 0.18 H new ATOM 0 HB2 ARG A 82 -4.811 -3.642 10.487 1.00 0.25 H new ATOM 0 HB3 ARG A 82 -6.050 -3.189 9.333 1.00 0.25 H new ATOM 0 HG2 ARG A 82 -4.238 -3.099 7.554 1.00 0.37 H new ATOM 0 HG3 ARG A 82 -3.130 -3.768 8.735 1.00 0.37 H new ATOM 0 HD2 ARG A 82 -4.587 -5.741 9.027 1.00 0.53 H new ATOM 0 HD3 ARG A 82 -5.761 -5.063 7.917 1.00 0.53 H new ATOM 0 HE ARG A 82 -3.043 -5.445 6.819 1.00 1.31 H new ATOM 0 HH11 ARG A 82 -6.331 -6.674 7.222 1.00 1.65 H new ATOM 0 HH12 ARG A 82 -6.205 -7.801 5.867 1.00 1.65 H new ATOM 0 HH21 ARG A 82 -2.881 -6.916 5.084 1.00 2.65 H new ATOM 0 HH22 ARG A 82 -4.260 -7.938 4.662 1.00 2.65 H new ATOM 1184 N SER A 83 -5.107 -0.244 11.760 1.00 0.18 N ATOM 1185 CA SER A 83 -5.877 0.287 12.881 1.00 0.26 C ATOM 1186 C SER A 83 -7.049 1.158 12.429 1.00 0.23 C ATOM 1187 O SER A 83 -8.002 1.362 13.182 1.00 0.27 O ATOM 1188 CB SER A 83 -4.958 1.094 13.792 1.00 0.40 C ATOM 1189 OG SER A 83 -3.866 0.307 14.233 1.00 1.28 O ATOM 0 H SER A 83 -4.136 0.067 11.737 1.00 0.18 H new ATOM 0 HA SER A 83 -6.297 -0.563 13.420 1.00 0.26 H new ATOM 0 HB2 SER A 83 -4.588 1.970 13.259 1.00 0.40 H new ATOM 0 HB3 SER A 83 -5.520 1.458 14.652 1.00 0.40 H new ATOM 0 HG SER A 83 -3.289 0.845 14.814 1.00 1.28 H new ATOM 1195 N CYS A 84 -6.990 1.669 11.208 1.00 0.20 N ATOM 1196 CA CYS A 84 -8.039 2.546 10.715 1.00 0.20 C ATOM 1197 C CYS A 84 -8.929 1.816 9.713 1.00 0.18 C ATOM 1198 O CYS A 84 -9.883 2.390 9.182 1.00 0.22 O ATOM 1199 CB CYS A 84 -7.438 3.811 10.083 1.00 0.25 C ATOM 1200 SG CYS A 84 -6.567 3.549 8.501 1.00 0.28 S ATOM 0 H CYS A 84 -6.234 1.493 10.546 1.00 0.20 H new ATOM 0 HA CYS A 84 -8.655 2.847 11.563 1.00 0.20 H new ATOM 0 HB2 CYS A 84 -8.238 4.534 9.924 1.00 0.25 H new ATOM 0 HB3 CYS A 84 -6.742 4.257 10.793 1.00 0.25 H new ATOM 1205 N PHE A 85 -8.632 0.539 9.482 1.00 0.16 N ATOM 1206 CA PHE A 85 -9.364 -0.249 8.501 1.00 0.16 C ATOM 1207 C PHE A 85 -10.597 -0.903 9.117 1.00 0.17 C ATOM 1208 O PHE A 85 -10.729 -1.011 10.338 1.00 0.21 O ATOM 1209 CB PHE A 85 -8.480 -1.353 7.911 1.00 0.15 C ATOM 1210 CG PHE A 85 -7.292 -0.881 7.112 1.00 0.15 C ATOM 1211 CD1 PHE A 85 -7.106 0.454 6.797 1.00 0.17 C ATOM 1212 CD2 PHE A 85 -6.354 -1.799 6.674 1.00 0.16 C ATOM 1213 CE1 PHE A 85 -6.005 0.860 6.062 1.00 0.18 C ATOM 1214 CE2 PHE A 85 -5.257 -1.401 5.941 1.00 0.18 C ATOM 1215 CZ PHE A 85 -5.079 -0.073 5.635 1.00 0.18 C ATOM 0 H PHE A 85 -7.889 0.031 9.962 1.00 0.16 H new ATOM 0 HA PHE A 85 -9.672 0.441 7.715 1.00 0.16 H new ATOM 0 HB2 PHE A 85 -8.120 -1.980 8.727 1.00 0.15 H new ATOM 0 HB3 PHE A 85 -9.097 -1.985 7.272 1.00 0.15 H new ATOM 0 HD1 PHE A 85 -7.827 1.187 7.128 1.00 0.17 H new ATOM 0 HD2 PHE A 85 -6.484 -2.845 6.910 1.00 0.16 H new ATOM 0 HE1 PHE A 85 -5.870 1.904 5.823 1.00 0.18 H new ATOM 0 HE2 PHE A 85 -4.537 -2.133 5.607 1.00 0.18 H new ATOM 0 HZ PHE A 85 -4.218 0.240 5.063 1.00 0.18 H new ATOM 1225 N GLU A 86 -11.483 -1.337 8.244 1.00 0.16 N ATOM 1226 CA GLU A 86 -12.644 -2.123 8.611 1.00 0.17 C ATOM 1227 C GLU A 86 -12.567 -3.460 7.882 1.00 0.16 C ATOM 1228 O GLU A 86 -12.717 -3.508 6.664 1.00 0.17 O ATOM 1229 CB GLU A 86 -13.936 -1.396 8.212 1.00 0.20 C ATOM 1230 CG GLU A 86 -14.128 -0.042 8.875 1.00 0.34 C ATOM 1231 CD GLU A 86 -15.453 0.600 8.503 1.00 1.22 C ATOM 1232 OE1 GLU A 86 -15.495 1.368 7.522 1.00 2.18 O ATOM 1233 OE2 GLU A 86 -16.464 0.336 9.195 1.00 1.18 O ATOM 0 H GLU A 86 -11.416 -1.151 7.243 1.00 0.16 H new ATOM 0 HA GLU A 86 -12.655 -2.274 9.690 1.00 0.17 H new ATOM 0 HB2 GLU A 86 -13.943 -1.261 7.130 1.00 0.20 H new ATOM 0 HB3 GLU A 86 -14.787 -2.031 8.459 1.00 0.20 H new ATOM 0 HG2 GLU A 86 -14.075 -0.159 9.957 1.00 0.34 H new ATOM 0 HG3 GLU A 86 -13.312 0.620 8.586 1.00 0.34 H new ATOM 1240 N GLN A 87 -12.293 -4.538 8.598 1.00 0.17 N ATOM 1241 CA GLN A 87 -12.213 -5.843 7.967 1.00 0.18 C ATOM 1242 C GLN A 87 -13.586 -6.474 7.824 1.00 0.14 C ATOM 1243 O GLN A 87 -14.507 -6.165 8.583 1.00 0.16 O ATOM 1244 CB GLN A 87 -11.292 -6.782 8.739 1.00 0.27 C ATOM 1245 CG GLN A 87 -9.842 -6.336 8.736 1.00 0.36 C ATOM 1246 CD GLN A 87 -8.889 -7.452 9.106 1.00 0.55 C ATOM 1247 OE1 GLN A 87 -8.591 -7.667 10.280 1.00 0.70 O ATOM 1248 NE2 GLN A 87 -8.399 -8.166 8.105 1.00 0.87 N ATOM 0 H GLN A 87 -12.124 -4.536 9.604 1.00 0.17 H new ATOM 0 HA GLN A 87 -11.795 -5.687 6.972 1.00 0.18 H new ATOM 0 HB2 GLN A 87 -11.640 -6.856 9.769 1.00 0.27 H new ATOM 0 HB3 GLN A 87 -11.359 -7.781 8.308 1.00 0.27 H new ATOM 0 HG2 GLN A 87 -9.585 -5.956 7.747 1.00 0.36 H new ATOM 0 HG3 GLN A 87 -9.718 -5.510 9.437 1.00 0.36 H new ATOM 0 HE21 GLN A 87 -8.673 -7.954 7.146 1.00 0.87 H new ATOM 0 HE22 GLN A 87 -7.748 -8.928 8.293 1.00 0.87 H new ATOM 1257 N HIS A 88 -13.699 -7.356 6.840 1.00 0.14 N ATOM 1258 CA HIS A 88 -14.931 -8.083 6.548 1.00 0.16 C ATOM 1259 C HIS A 88 -16.032 -7.147 6.095 1.00 0.15 C ATOM 1260 O HIS A 88 -17.173 -7.257 6.530 1.00 0.18 O ATOM 1261 CB HIS A 88 -15.425 -8.891 7.742 1.00 0.20 C ATOM 1262 CG HIS A 88 -14.395 -9.798 8.333 1.00 0.25 C ATOM 1263 ND1 HIS A 88 -14.288 -10.046 9.682 1.00 0.42 N ATOM 1264 CD2 HIS A 88 -13.411 -10.510 7.745 1.00 0.37 C ATOM 1265 CE1 HIS A 88 -13.280 -10.870 9.897 1.00 0.43 C ATOM 1266 NE2 HIS A 88 -12.734 -11.166 8.737 1.00 0.37 N ATOM 0 H HIS A 88 -12.929 -7.591 6.213 1.00 0.14 H new ATOM 0 HA HIS A 88 -14.687 -8.774 5.741 1.00 0.16 H new ATOM 0 HB2 HIS A 88 -15.774 -8.204 8.513 1.00 0.20 H new ATOM 0 HB3 HIS A 88 -16.284 -9.487 7.434 1.00 0.20 H new ATOM 0 HD2 HIS A 88 -13.197 -10.554 6.687 1.00 0.37 H new ATOM 0 HE1 HIS A 88 -12.958 -11.238 10.860 1.00 0.43 H new ATOM 0 HE2 HIS A 88 -11.935 -11.785 8.599 1.00 0.37 H new ATOM 1274 N VAL A 89 -15.688 -6.228 5.225 1.00 0.14 N ATOM 1275 CA VAL A 89 -16.649 -5.289 4.691 1.00 0.14 C ATOM 1276 C VAL A 89 -16.165 -4.748 3.361 1.00 0.15 C ATOM 1277 O VAL A 89 -15.005 -4.360 3.218 1.00 0.17 O ATOM 1278 CB VAL A 89 -16.927 -4.145 5.686 1.00 0.16 C ATOM 1279 CG1 VAL A 89 -15.667 -3.786 6.432 1.00 0.15 C ATOM 1280 CG2 VAL A 89 -17.491 -2.919 4.994 1.00 0.20 C ATOM 0 H VAL A 89 -14.740 -6.109 4.868 1.00 0.14 H new ATOM 0 HA VAL A 89 -17.590 -5.815 4.531 1.00 0.14 H new ATOM 0 HB VAL A 89 -17.677 -4.499 6.393 1.00 0.16 H new ATOM 0 HG11 VAL A 89 -15.876 -2.977 7.132 1.00 0.15 H new ATOM 0 HG12 VAL A 89 -15.309 -4.657 6.981 1.00 0.15 H new ATOM 0 HG13 VAL A 89 -14.904 -3.464 5.723 1.00 0.15 H new ATOM 0 HG21 VAL A 89 -17.673 -2.137 5.731 1.00 0.20 H new ATOM 0 HG22 VAL A 89 -16.778 -2.560 4.252 1.00 0.20 H new ATOM 0 HG23 VAL A 89 -18.428 -3.178 4.501 1.00 0.20 H new ATOM 1290 N SER A 90 -17.052 -4.758 2.389 1.00 0.17 N ATOM 1291 CA SER A 90 -16.703 -4.376 1.041 1.00 0.20 C ATOM 1292 C SER A 90 -17.584 -3.239 0.552 1.00 0.22 C ATOM 1293 O SER A 90 -18.800 -3.255 0.747 1.00 0.21 O ATOM 1294 CB SER A 90 -16.848 -5.583 0.113 1.00 0.22 C ATOM 1295 OG SER A 90 -16.344 -5.312 -1.182 1.00 0.30 O ATOM 0 H SER A 90 -18.028 -5.029 2.511 1.00 0.17 H new ATOM 0 HA SER A 90 -15.669 -4.031 1.035 1.00 0.20 H new ATOM 0 HB2 SER A 90 -16.318 -6.435 0.539 1.00 0.22 H new ATOM 0 HB3 SER A 90 -17.899 -5.864 0.043 1.00 0.22 H new ATOM 0 HG SER A 90 -16.451 -6.105 -1.747 1.00 0.30 H new ATOM 1301 N TYR A 91 -16.967 -2.242 -0.052 1.00 0.28 N ATOM 1302 CA TYR A 91 -17.709 -1.215 -0.755 1.00 0.28 C ATOM 1303 C TYR A 91 -17.477 -1.409 -2.244 1.00 0.32 C ATOM 1304 O TYR A 91 -16.337 -1.368 -2.701 1.00 0.38 O ATOM 1305 CB TYR A 91 -17.246 0.183 -0.336 1.00 0.33 C ATOM 1306 CG TYR A 91 -17.225 0.428 1.162 1.00 0.33 C ATOM 1307 CD1 TYR A 91 -16.190 -0.047 1.960 1.00 0.32 C ATOM 1308 CD2 TYR A 91 -18.231 1.158 1.773 1.00 0.39 C ATOM 1309 CE1 TYR A 91 -16.164 0.200 3.319 1.00 0.36 C ATOM 1310 CE2 TYR A 91 -18.212 1.405 3.130 1.00 0.43 C ATOM 1311 CZ TYR A 91 -17.176 0.926 3.898 1.00 0.39 C ATOM 1312 OH TYR A 91 -17.158 1.177 5.252 1.00 0.46 O ATOM 0 H TYR A 91 -15.954 -2.122 -0.070 1.00 0.28 H new ATOM 0 HA TYR A 91 -18.768 -1.299 -0.513 1.00 0.28 H new ATOM 0 HB2 TYR A 91 -16.244 0.351 -0.731 1.00 0.33 H new ATOM 0 HB3 TYR A 91 -17.900 0.921 -0.801 1.00 0.33 H new ATOM 0 HD1 TYR A 91 -15.392 -0.619 1.509 1.00 0.32 H new ATOM 0 HD2 TYR A 91 -19.045 1.541 1.176 1.00 0.39 H new ATOM 0 HE1 TYR A 91 -15.352 -0.176 3.923 1.00 0.36 H new ATOM 0 HE2 TYR A 91 -19.008 1.973 3.588 1.00 0.43 H new ATOM 0 HH TYR A 91 -16.237 1.125 5.582 1.00 0.46 H new ATOM 1322 N GLU A 92 -18.545 -1.617 -3.001 1.00 0.30 N ATOM 1323 CA GLU A 92 -18.409 -1.929 -4.419 1.00 0.36 C ATOM 1324 C GLU A 92 -19.396 -1.143 -5.264 1.00 0.32 C ATOM 1325 O GLU A 92 -19.023 -0.578 -6.289 1.00 0.32 O ATOM 1326 CB GLU A 92 -18.586 -3.430 -4.654 1.00 0.45 C ATOM 1327 CG GLU A 92 -17.507 -4.278 -4.003 1.00 0.51 C ATOM 1328 CD GLU A 92 -17.796 -5.760 -4.098 1.00 0.68 C ATOM 1329 OE1 GLU A 92 -18.615 -6.263 -3.298 1.00 0.91 O ATOM 1330 OE2 GLU A 92 -17.199 -6.431 -4.964 1.00 1.12 O ATOM 0 H GLU A 92 -19.506 -1.576 -2.663 1.00 0.30 H new ATOM 0 HA GLU A 92 -17.405 -1.637 -4.726 1.00 0.36 H new ATOM 0 HB2 GLU A 92 -19.559 -3.737 -4.270 1.00 0.45 H new ATOM 0 HB3 GLU A 92 -18.591 -3.623 -5.727 1.00 0.45 H new ATOM 0 HG2 GLU A 92 -16.549 -4.067 -4.478 1.00 0.51 H new ATOM 0 HG3 GLU A 92 -17.412 -3.996 -2.954 1.00 0.51 H new ATOM 1337 N GLY A 93 -20.648 -1.098 -4.826 1.00 0.31 N ATOM 1338 CA GLY A 93 -21.659 -0.343 -5.548 1.00 0.30 C ATOM 1339 C GLY A 93 -21.335 1.137 -5.610 1.00 0.28 C ATOM 1340 O GLY A 93 -21.830 1.857 -6.482 1.00 0.28 O ATOM 0 H GLY A 93 -20.983 -1.569 -3.986 1.00 0.31 H new ATOM 0 HA2 GLY A 93 -21.749 -0.736 -6.561 1.00 0.30 H new ATOM 0 HA3 GLY A 93 -22.627 -0.481 -5.065 1.00 0.30 H new ATOM 1344 N ALA A 94 -20.508 1.587 -4.673 1.00 0.28 N ATOM 1345 CA ALA A 94 -20.057 2.968 -4.633 1.00 0.28 C ATOM 1346 C ALA A 94 -19.258 3.298 -5.886 1.00 0.29 C ATOM 1347 O ALA A 94 -18.356 2.545 -6.262 1.00 0.33 O ATOM 1348 CB ALA A 94 -19.206 3.204 -3.391 1.00 0.28 C ATOM 0 H ALA A 94 -20.134 1.005 -3.923 1.00 0.28 H new ATOM 0 HA ALA A 94 -20.929 3.621 -4.593 1.00 0.28 H new ATOM 0 HB1 ALA A 94 -18.873 4.242 -3.370 1.00 0.28 H new ATOM 0 HB2 ALA A 94 -19.797 2.995 -2.500 1.00 0.28 H new ATOM 0 HB3 ALA A 94 -18.338 2.545 -3.414 1.00 0.28 H new ATOM 1354 N PRO A 95 -19.600 4.407 -6.560 1.00 0.33 N ATOM 1355 CA PRO A 95 -18.872 4.873 -7.743 1.00 0.37 C ATOM 1356 C PRO A 95 -17.376 4.964 -7.479 1.00 0.32 C ATOM 1357 O PRO A 95 -16.934 5.692 -6.581 1.00 0.31 O ATOM 1358 CB PRO A 95 -19.464 6.260 -8.002 1.00 0.47 C ATOM 1359 CG PRO A 95 -20.834 6.192 -7.427 1.00 0.52 C ATOM 1360 CD PRO A 95 -20.731 5.292 -6.228 1.00 0.43 C ATOM 0 HA PRO A 95 -18.976 4.196 -8.591 1.00 0.37 H new ATOM 0 HB2 PRO A 95 -18.871 7.040 -7.525 1.00 0.47 H new ATOM 0 HB3 PRO A 95 -19.491 6.487 -9.068 1.00 0.47 H new ATOM 0 HG2 PRO A 95 -21.188 7.183 -7.143 1.00 0.52 H new ATOM 0 HG3 PRO A 95 -21.544 5.796 -8.153 1.00 0.52 H new ATOM 0 HD2 PRO A 95 -20.544 5.858 -5.316 1.00 0.43 H new ATOM 0 HD3 PRO A 95 -21.650 4.727 -6.070 1.00 0.43 H new ATOM 1368 N ASP A 96 -16.606 4.211 -8.250 1.00 0.33 N ATOM 1369 CA ASP A 96 -15.166 4.141 -8.053 1.00 0.33 C ATOM 1370 C ASP A 96 -14.528 5.477 -8.343 1.00 0.35 C ATOM 1371 O ASP A 96 -15.023 6.260 -9.155 1.00 0.48 O ATOM 1372 CB ASP A 96 -14.511 3.092 -8.950 1.00 0.43 C ATOM 1373 CG ASP A 96 -15.395 1.904 -9.233 1.00 0.51 C ATOM 1374 OD1 ASP A 96 -15.155 0.825 -8.655 1.00 0.71 O ATOM 1375 OD2 ASP A 96 -16.343 2.050 -10.026 1.00 0.59 O ATOM 0 H ASP A 96 -16.955 3.639 -9.019 1.00 0.33 H new ATOM 0 HA ASP A 96 -15.009 3.860 -7.012 1.00 0.33 H new ATOM 0 HB2 ASP A 96 -14.229 3.558 -9.894 1.00 0.43 H new ATOM 0 HB3 ASP A 96 -13.591 2.746 -8.479 1.00 0.43 H new ATOM 1380 N VAL A 97 -13.431 5.727 -7.670 1.00 0.28 N ATOM 1381 CA VAL A 97 -12.686 6.952 -7.854 1.00 0.29 C ATOM 1382 C VAL A 97 -11.317 6.649 -8.451 1.00 0.29 C ATOM 1383 O VAL A 97 -10.632 7.539 -8.954 1.00 0.32 O ATOM 1384 CB VAL A 97 -12.538 7.696 -6.513 1.00 0.28 C ATOM 1385 CG1 VAL A 97 -13.901 8.138 -6.010 1.00 0.30 C ATOM 1386 CG2 VAL A 97 -11.871 6.800 -5.485 1.00 0.24 C ATOM 0 H VAL A 97 -13.029 5.091 -6.981 1.00 0.28 H new ATOM 0 HA VAL A 97 -13.232 7.594 -8.545 1.00 0.29 H new ATOM 0 HB VAL A 97 -11.914 8.576 -6.668 1.00 0.28 H new ATOM 0 HG11 VAL A 97 -13.786 8.663 -5.062 1.00 0.30 H new ATOM 0 HG12 VAL A 97 -14.360 8.804 -6.740 1.00 0.30 H new ATOM 0 HG13 VAL A 97 -14.537 7.264 -5.866 1.00 0.30 H new ATOM 0 HG21 VAL A 97 -11.773 7.338 -4.542 1.00 0.24 H new ATOM 0 HG22 VAL A 97 -12.478 5.908 -5.332 1.00 0.24 H new ATOM 0 HG23 VAL A 97 -10.883 6.510 -5.842 1.00 0.24 H new ATOM 1396 N MET A 98 -10.931 5.377 -8.399 1.00 0.27 N ATOM 1397 CA MET A 98 -9.646 4.931 -8.930 1.00 0.27 C ATOM 1398 C MET A 98 -9.766 3.539 -9.531 1.00 0.27 C ATOM 1399 O MET A 98 -10.746 2.832 -9.286 1.00 0.27 O ATOM 1400 CB MET A 98 -8.596 4.894 -7.823 1.00 0.26 C ATOM 1401 CG MET A 98 -8.324 6.238 -7.182 1.00 0.36 C ATOM 1402 SD MET A 98 -7.486 7.383 -8.293 1.00 1.01 S ATOM 1403 CE MET A 98 -6.012 6.451 -8.705 1.00 0.65 C ATOM 0 H MET A 98 -11.495 4.631 -7.991 1.00 0.27 H new ATOM 0 HA MET A 98 -9.344 5.638 -9.703 1.00 0.27 H new ATOM 0 HB2 MET A 98 -8.921 4.195 -7.052 1.00 0.26 H new ATOM 0 HB3 MET A 98 -7.664 4.505 -8.234 1.00 0.26 H new ATOM 0 HG2 MET A 98 -9.267 6.678 -6.857 1.00 0.36 H new ATOM 0 HG3 MET A 98 -7.715 6.093 -6.289 1.00 0.36 H new ATOM 0 HE1 MET A 98 -5.291 7.107 -9.192 1.00 0.65 H new ATOM 0 HE2 MET A 98 -5.574 6.042 -7.795 1.00 0.65 H new ATOM 0 HE3 MET A 98 -6.274 5.636 -9.379 1.00 0.65 H new ATOM 1413 N THR A 99 -8.766 3.158 -10.314 1.00 0.31 N ATOM 1414 CA THR A 99 -8.671 1.820 -10.862 1.00 0.32 C ATOM 1415 C THR A 99 -8.192 0.847 -9.788 1.00 0.28 C ATOM 1416 O THR A 99 -7.272 1.164 -9.031 1.00 0.30 O ATOM 1417 CB THR A 99 -7.679 1.803 -12.040 1.00 0.38 C ATOM 1418 OG1 THR A 99 -8.076 2.767 -13.024 1.00 0.45 O ATOM 1419 CG2 THR A 99 -7.603 0.426 -12.672 1.00 0.41 C ATOM 0 H THR A 99 -7.998 3.772 -10.585 1.00 0.31 H new ATOM 0 HA THR A 99 -9.657 1.516 -11.212 1.00 0.32 H new ATOM 0 HB THR A 99 -6.691 2.057 -11.656 1.00 0.38 H new ATOM 0 HG1 THR A 99 -7.441 2.753 -13.770 1.00 0.45 H new ATOM 0 HG21 THR A 99 -6.895 0.445 -13.501 1.00 0.41 H new ATOM 0 HG22 THR A 99 -7.272 -0.298 -11.928 1.00 0.41 H new ATOM 0 HG23 THR A 99 -8.588 0.141 -13.042 1.00 0.41 H new ATOM 1427 N ALA A 100 -8.826 -0.321 -9.716 1.00 0.27 N ATOM 1428 CA ALA A 100 -8.439 -1.342 -8.754 1.00 0.24 C ATOM 1429 C ALA A 100 -7.003 -1.790 -8.975 1.00 0.24 C ATOM 1430 O ALA A 100 -6.459 -1.671 -10.073 1.00 0.34 O ATOM 1431 CB ALA A 100 -9.361 -2.542 -8.842 1.00 0.25 C ATOM 0 H ALA A 100 -9.610 -0.581 -10.314 1.00 0.27 H new ATOM 0 HA ALA A 100 -8.520 -0.900 -7.761 1.00 0.24 H new ATOM 0 HB1 ALA A 100 -9.052 -3.292 -8.114 1.00 0.25 H new ATOM 0 HB2 ALA A 100 -10.384 -2.231 -8.631 1.00 0.25 H new ATOM 0 HB3 ALA A 100 -9.310 -2.967 -9.844 1.00 0.25 H new ATOM 1437 N MET A 101 -6.407 -2.325 -7.927 1.00 0.17 N ATOM 1438 CA MET A 101 -5.025 -2.754 -7.969 1.00 0.17 C ATOM 1439 C MET A 101 -4.906 -4.156 -7.406 1.00 0.14 C ATOM 1440 O MET A 101 -5.752 -4.591 -6.649 1.00 0.15 O ATOM 1441 CB MET A 101 -4.161 -1.800 -7.158 1.00 0.21 C ATOM 1442 CG MET A 101 -2.671 -2.092 -7.241 1.00 0.26 C ATOM 1443 SD MET A 101 -1.964 -1.714 -8.861 1.00 1.07 S ATOM 1444 CE MET A 101 -2.379 0.021 -9.035 1.00 0.90 C ATOM 0 H MET A 101 -6.865 -2.473 -7.028 1.00 0.17 H new ATOM 0 HA MET A 101 -4.683 -2.752 -9.004 1.00 0.17 H new ATOM 0 HB2 MET A 101 -4.341 -0.782 -7.502 1.00 0.21 H new ATOM 0 HB3 MET A 101 -4.472 -1.843 -6.114 1.00 0.21 H new ATOM 0 HG2 MET A 101 -2.150 -1.512 -6.479 1.00 0.26 H new ATOM 0 HG3 MET A 101 -2.500 -3.144 -7.013 1.00 0.26 H new ATOM 0 HE1 MET A 101 -1.817 0.448 -9.865 1.00 0.90 H new ATOM 0 HE2 MET A 101 -3.447 0.122 -9.230 1.00 0.90 H new ATOM 0 HE3 MET A 101 -2.126 0.550 -8.116 1.00 0.90 H new ATOM 1454 N VAL A 102 -3.874 -4.859 -7.795 1.00 0.15 N ATOM 1455 CA VAL A 102 -3.623 -6.199 -7.278 1.00 0.14 C ATOM 1456 C VAL A 102 -2.368 -6.209 -6.403 1.00 0.14 C ATOM 1457 O VAL A 102 -1.259 -5.964 -6.883 1.00 0.18 O ATOM 1458 CB VAL A 102 -3.494 -7.227 -8.423 1.00 0.15 C ATOM 1459 CG1 VAL A 102 -3.040 -8.582 -7.898 1.00 0.16 C ATOM 1460 CG2 VAL A 102 -4.818 -7.363 -9.162 1.00 0.16 C ATOM 0 H VAL A 102 -3.184 -4.532 -8.472 1.00 0.15 H new ATOM 0 HA VAL A 102 -4.478 -6.487 -6.666 1.00 0.14 H new ATOM 0 HB VAL A 102 -2.737 -6.864 -9.118 1.00 0.15 H new ATOM 0 HG11 VAL A 102 -2.958 -9.285 -8.727 1.00 0.16 H new ATOM 0 HG12 VAL A 102 -2.069 -8.478 -7.414 1.00 0.16 H new ATOM 0 HG13 VAL A 102 -3.767 -8.955 -7.177 1.00 0.16 H new ATOM 0 HG21 VAL A 102 -4.713 -8.091 -9.967 1.00 0.16 H new ATOM 0 HG22 VAL A 102 -5.589 -7.698 -8.468 1.00 0.16 H new ATOM 0 HG23 VAL A 102 -5.102 -6.398 -9.581 1.00 0.16 H new ATOM 1470 N THR A 103 -2.558 -6.491 -5.119 1.00 0.15 N ATOM 1471 CA THR A 103 -1.483 -6.441 -4.135 1.00 0.14 C ATOM 1472 C THR A 103 -1.747 -7.451 -3.020 1.00 0.15 C ATOM 1473 O THR A 103 -2.858 -7.957 -2.902 1.00 0.18 O ATOM 1474 CB THR A 103 -1.351 -5.022 -3.536 1.00 0.15 C ATOM 1475 OG1 THR A 103 -0.337 -4.993 -2.524 1.00 0.18 O ATOM 1476 CG2 THR A 103 -2.673 -4.554 -2.956 1.00 0.19 C ATOM 0 H THR A 103 -3.462 -6.761 -4.731 1.00 0.15 H new ATOM 0 HA THR A 103 -0.549 -6.693 -4.637 1.00 0.14 H new ATOM 0 HB THR A 103 -1.065 -4.345 -4.341 1.00 0.15 H new ATOM 0 HG1 THR A 103 0.189 -4.171 -2.611 1.00 0.18 H new ATOM 0 HG21 THR A 103 -2.554 -3.553 -2.541 1.00 0.19 H new ATOM 0 HG22 THR A 103 -3.428 -4.534 -3.742 1.00 0.19 H new ATOM 0 HG23 THR A 103 -2.987 -5.239 -2.168 1.00 0.19 H new ATOM 1484 N SER A 104 -0.730 -7.768 -2.216 1.00 0.16 N ATOM 1485 CA SER A 104 -0.899 -8.750 -1.154 1.00 0.19 C ATOM 1486 C SER A 104 -1.058 -8.073 0.208 1.00 0.18 C ATOM 1487 O SER A 104 -0.972 -8.722 1.250 1.00 0.26 O ATOM 1488 CB SER A 104 0.289 -9.704 -1.145 1.00 0.25 C ATOM 1489 OG SER A 104 0.490 -10.253 -2.438 1.00 1.03 O ATOM 0 H SER A 104 0.204 -7.364 -2.281 1.00 0.16 H new ATOM 0 HA SER A 104 -1.811 -9.315 -1.347 1.00 0.19 H new ATOM 0 HB2 SER A 104 1.186 -9.175 -0.824 1.00 0.25 H new ATOM 0 HB3 SER A 104 0.116 -10.504 -0.426 1.00 0.25 H new ATOM 0 HG SER A 104 1.257 -10.863 -2.419 1.00 1.03 H new ATOM 1495 N GLN A 105 -1.278 -6.765 0.192 1.00 0.15 N ATOM 1496 CA GLN A 105 -1.513 -6.009 1.416 1.00 0.14 C ATOM 1497 C GLN A 105 -2.512 -4.895 1.183 1.00 0.13 C ATOM 1498 O GLN A 105 -2.506 -4.248 0.140 1.00 0.15 O ATOM 1499 CB GLN A 105 -0.216 -5.401 1.960 1.00 0.15 C ATOM 1500 CG GLN A 105 0.692 -4.791 0.898 1.00 0.15 C ATOM 1501 CD GLN A 105 1.598 -5.821 0.246 1.00 0.24 C ATOM 1502 OE1 GLN A 105 1.994 -5.674 -0.901 1.00 0.67 O ATOM 1503 NE2 GLN A 105 1.911 -6.887 0.965 1.00 0.21 N ATOM 0 H GLN A 105 -1.299 -6.203 -0.659 1.00 0.15 H new ATOM 0 HA GLN A 105 -1.912 -6.712 2.147 1.00 0.14 H new ATOM 0 HB2 GLN A 105 -0.469 -4.631 2.689 1.00 0.15 H new ATOM 0 HB3 GLN A 105 0.338 -6.175 2.492 1.00 0.15 H new ATOM 0 HG2 GLN A 105 0.080 -4.313 0.133 1.00 0.15 H new ATOM 0 HG3 GLN A 105 1.302 -4.010 1.351 1.00 0.15 H new ATOM 0 HE21 GLN A 105 1.564 -6.978 1.920 1.00 0.21 H new ATOM 0 HE22 GLN A 105 2.500 -7.617 0.565 1.00 0.21 H new ATOM 1512 N SER A 106 -3.349 -4.654 2.182 1.00 0.13 N ATOM 1513 CA SER A 106 -4.314 -3.571 2.122 1.00 0.13 C ATOM 1514 C SER A 106 -3.598 -2.236 2.261 1.00 0.14 C ATOM 1515 O SER A 106 -4.189 -1.176 2.040 1.00 0.15 O ATOM 1516 CB SER A 106 -5.362 -3.728 3.230 1.00 0.17 C ATOM 1517 OG SER A 106 -6.377 -2.743 3.124 1.00 1.31 O ATOM 0 H SER A 106 -3.377 -5.197 3.045 1.00 0.13 H new ATOM 0 HA SER A 106 -4.823 -3.604 1.159 1.00 0.13 H new ATOM 0 HB2 SER A 106 -5.809 -4.721 3.173 1.00 0.17 H new ATOM 0 HB3 SER A 106 -4.879 -3.652 4.204 1.00 0.17 H new ATOM 0 HG SER A 106 -6.306 -2.117 3.875 1.00 1.31 H new ATOM 1523 N ALA A 107 -2.320 -2.300 2.632 1.00 0.14 N ATOM 1524 CA ALA A 107 -1.496 -1.117 2.763 1.00 0.16 C ATOM 1525 C ALA A 107 -1.434 -0.343 1.451 1.00 0.14 C ATOM 1526 O ALA A 107 -1.613 0.874 1.432 1.00 0.15 O ATOM 1527 CB ALA A 107 -0.104 -1.519 3.201 1.00 0.20 C ATOM 0 H ALA A 107 -1.836 -3.172 2.847 1.00 0.14 H new ATOM 0 HA ALA A 107 -1.940 -0.464 3.514 1.00 0.16 H new ATOM 0 HB1 ALA A 107 0.518 -0.629 3.300 1.00 0.20 H new ATOM 0 HB2 ALA A 107 -0.159 -2.032 4.161 1.00 0.20 H new ATOM 0 HB3 ALA A 107 0.333 -2.186 2.458 1.00 0.20 H new ATOM 1533 N ASP A 108 -1.200 -1.060 0.355 1.00 0.14 N ATOM 1534 CA ASP A 108 -1.064 -0.451 -0.955 1.00 0.15 C ATOM 1535 C ASP A 108 -2.321 0.329 -1.322 1.00 0.13 C ATOM 1536 O ASP A 108 -2.246 1.450 -1.826 1.00 0.14 O ATOM 1537 CB ASP A 108 -0.799 -1.539 -1.988 1.00 0.17 C ATOM 1538 CG ASP A 108 0.649 -1.612 -2.438 1.00 0.51 C ATOM 1539 OD1 ASP A 108 1.306 -0.542 -2.485 1.00 0.83 O ATOM 1540 OD2 ASP A 108 1.129 -2.722 -2.743 1.00 0.98 O ATOM 0 H ASP A 108 -1.100 -2.075 0.355 1.00 0.14 H new ATOM 0 HA ASP A 108 -0.228 0.248 -0.937 1.00 0.15 H new ATOM 0 HB2 ASP A 108 -1.090 -2.503 -1.570 1.00 0.17 H new ATOM 0 HB3 ASP A 108 -1.432 -1.364 -2.858 1.00 0.17 H new ATOM 1545 N CYS A 109 -3.482 -0.254 -1.037 1.00 0.11 N ATOM 1546 CA CYS A 109 -4.752 0.402 -1.322 1.00 0.11 C ATOM 1547 C CYS A 109 -4.915 1.646 -0.448 1.00 0.10 C ATOM 1548 O CYS A 109 -5.525 2.635 -0.858 1.00 0.11 O ATOM 1549 CB CYS A 109 -5.929 -0.549 -1.075 1.00 0.13 C ATOM 1550 SG CYS A 109 -5.551 -2.322 -1.298 1.00 0.14 S ATOM 0 H CYS A 109 -3.569 -1.176 -0.610 1.00 0.11 H new ATOM 0 HA CYS A 109 -4.749 0.693 -2.373 1.00 0.11 H new ATOM 0 HB2 CYS A 109 -6.293 -0.396 -0.059 1.00 0.13 H new ATOM 0 HB3 CYS A 109 -6.742 -0.279 -1.749 1.00 0.13 H new ATOM 1555 N GLN A 110 -4.350 1.590 0.756 1.00 0.10 N ATOM 1556 CA GLN A 110 -4.398 2.707 1.688 1.00 0.10 C ATOM 1557 C GLN A 110 -3.612 3.889 1.138 1.00 0.10 C ATOM 1558 O GLN A 110 -4.130 4.999 1.038 1.00 0.13 O ATOM 1559 CB GLN A 110 -3.847 2.270 3.047 1.00 0.12 C ATOM 1560 CG GLN A 110 -3.406 3.413 3.946 1.00 0.13 C ATOM 1561 CD GLN A 110 -2.847 2.916 5.258 1.00 0.26 C ATOM 1562 OE1 GLN A 110 -3.541 2.848 6.266 1.00 1.33 O ATOM 1563 NE2 GLN A 110 -1.589 2.533 5.246 1.00 0.80 N ATOM 0 H GLN A 110 -3.850 0.774 1.108 1.00 0.10 H new ATOM 0 HA GLN A 110 -5.433 3.022 1.817 1.00 0.10 H new ATOM 0 HB2 GLN A 110 -4.611 1.691 3.565 1.00 0.12 H new ATOM 0 HB3 GLN A 110 -2.999 1.605 2.884 1.00 0.12 H new ATOM 0 HG2 GLN A 110 -2.651 4.008 3.432 1.00 0.13 H new ATOM 0 HG3 GLN A 110 -4.254 4.071 4.139 1.00 0.13 H new ATOM 0 HE21 GLN A 110 -1.042 2.604 4.388 1.00 0.80 H new ATOM 0 HE22 GLN A 110 -1.160 2.164 6.095 1.00 0.80 H new ATOM 1572 N ALA A 111 -2.369 3.635 0.753 1.00 0.10 N ATOM 1573 CA ALA A 111 -1.517 4.673 0.191 1.00 0.11 C ATOM 1574 C ALA A 111 -2.073 5.170 -1.139 1.00 0.11 C ATOM 1575 O ALA A 111 -1.835 6.311 -1.531 1.00 0.13 O ATOM 1576 CB ALA A 111 -0.097 4.164 0.026 1.00 0.15 C ATOM 0 H ALA A 111 -1.928 2.718 0.820 1.00 0.10 H new ATOM 0 HA ALA A 111 -1.501 5.514 0.884 1.00 0.11 H new ATOM 0 HB1 ALA A 111 0.526 4.953 -0.395 1.00 0.15 H new ATOM 0 HB2 ALA A 111 0.299 3.869 0.998 1.00 0.15 H new ATOM 0 HB3 ALA A 111 -0.094 3.304 -0.643 1.00 0.15 H new ATOM 1582 N ALA A 112 -2.780 4.294 -1.844 1.00 0.10 N ATOM 1583 CA ALA A 112 -3.455 4.674 -3.073 1.00 0.13 C ATOM 1584 C ALA A 112 -4.526 5.719 -2.806 1.00 0.13 C ATOM 1585 O ALA A 112 -4.471 6.833 -3.324 1.00 0.19 O ATOM 1586 CB ALA A 112 -4.084 3.455 -3.720 1.00 0.17 C ATOM 0 H ALA A 112 -2.899 3.315 -1.583 1.00 0.10 H new ATOM 0 HA ALA A 112 -2.713 5.102 -3.747 1.00 0.13 H new ATOM 0 HB1 ALA A 112 -4.587 3.751 -4.640 1.00 0.17 H new ATOM 0 HB2 ALA A 112 -3.309 2.724 -3.949 1.00 0.17 H new ATOM 0 HB3 ALA A 112 -4.809 3.013 -3.036 1.00 0.17 H new ATOM 1592 N CYS A 113 -5.482 5.360 -1.970 1.00 0.12 N ATOM 1593 CA CYS A 113 -6.646 6.195 -1.753 1.00 0.14 C ATOM 1594 C CYS A 113 -6.305 7.441 -0.941 1.00 0.13 C ATOM 1595 O CYS A 113 -6.810 8.528 -1.221 1.00 0.15 O ATOM 1596 CB CYS A 113 -7.740 5.395 -1.060 1.00 0.17 C ATOM 1597 SG CYS A 113 -9.343 6.242 -1.034 1.00 0.25 S ATOM 0 H CYS A 113 -5.474 4.495 -1.430 1.00 0.12 H new ATOM 0 HA CYS A 113 -7.004 6.527 -2.727 1.00 0.14 H new ATOM 0 HB2 CYS A 113 -7.853 4.435 -1.564 1.00 0.17 H new ATOM 0 HB3 CYS A 113 -7.432 5.184 -0.036 1.00 0.17 H new ATOM 1602 N ALA A 114 -5.419 7.292 0.038 1.00 0.14 N ATOM 1603 CA ALA A 114 -5.070 8.400 0.922 1.00 0.16 C ATOM 1604 C ALA A 114 -4.250 9.464 0.196 1.00 0.17 C ATOM 1605 O ALA A 114 -4.056 10.571 0.704 1.00 0.25 O ATOM 1606 CB ALA A 114 -4.310 7.885 2.132 1.00 0.18 C ATOM 0 H ALA A 114 -4.931 6.419 0.240 1.00 0.14 H new ATOM 0 HA ALA A 114 -5.998 8.866 1.253 1.00 0.16 H new ATOM 0 HB1 ALA A 114 -4.055 8.720 2.784 1.00 0.18 H new ATOM 0 HB2 ALA A 114 -4.932 7.176 2.678 1.00 0.18 H new ATOM 0 HB3 ALA A 114 -3.397 7.389 1.804 1.00 0.18 H new ATOM 1612 N ALA A 115 -3.768 9.132 -0.990 1.00 0.16 N ATOM 1613 CA ALA A 115 -2.959 10.056 -1.762 1.00 0.19 C ATOM 1614 C ALA A 115 -3.802 10.846 -2.747 1.00 0.22 C ATOM 1615 O ALA A 115 -3.438 11.953 -3.139 1.00 0.31 O ATOM 1616 CB ALA A 115 -1.873 9.311 -2.508 1.00 0.18 C ATOM 0 H ALA A 115 -3.924 8.229 -1.438 1.00 0.16 H new ATOM 0 HA ALA A 115 -2.504 10.756 -1.061 1.00 0.19 H new ATOM 0 HB1 ALA A 115 -1.275 10.019 -3.082 1.00 0.18 H new ATOM 0 HB2 ALA A 115 -1.234 8.790 -1.795 1.00 0.18 H new ATOM 0 HB3 ALA A 115 -2.327 8.587 -3.184 1.00 0.18 H new ATOM 1622 N ASP A 116 -4.929 10.281 -3.145 1.00 0.22 N ATOM 1623 CA ASP A 116 -5.740 10.888 -4.185 1.00 0.26 C ATOM 1624 C ASP A 116 -6.707 11.905 -3.588 1.00 0.28 C ATOM 1625 O ASP A 116 -7.327 11.657 -2.551 1.00 0.31 O ATOM 1626 CB ASP A 116 -6.513 9.823 -4.955 1.00 0.30 C ATOM 1627 CG ASP A 116 -7.051 10.339 -6.275 1.00 0.40 C ATOM 1628 OD1 ASP A 116 -8.231 10.746 -6.319 1.00 0.44 O ATOM 1629 OD2 ASP A 116 -6.303 10.329 -7.275 1.00 0.51 O ATOM 0 H ASP A 116 -5.301 9.410 -2.767 1.00 0.22 H new ATOM 0 HA ASP A 116 -5.073 11.403 -4.876 1.00 0.26 H new ATOM 0 HB2 ASP A 116 -5.862 8.969 -5.140 1.00 0.30 H new ATOM 0 HB3 ASP A 116 -7.341 9.466 -4.343 1.00 0.30 H new ATOM 1634 N PRO A 117 -6.854 13.058 -4.250 1.00 0.30 N ATOM 1635 CA PRO A 117 -7.677 14.169 -3.760 1.00 0.34 C ATOM 1636 C PRO A 117 -9.167 13.899 -3.916 1.00 0.35 C ATOM 1637 O PRO A 117 -10.001 14.624 -3.376 1.00 0.40 O ATOM 1638 CB PRO A 117 -7.258 15.325 -4.663 1.00 0.38 C ATOM 1639 CG PRO A 117 -6.877 14.665 -5.941 1.00 0.36 C ATOM 1640 CD PRO A 117 -6.228 13.369 -5.547 1.00 0.31 C ATOM 0 HA PRO A 117 -7.529 14.352 -2.696 1.00 0.34 H new ATOM 0 HB2 PRO A 117 -8.073 16.034 -4.808 1.00 0.38 H new ATOM 0 HB3 PRO A 117 -6.423 15.882 -4.237 1.00 0.38 H new ATOM 0 HG2 PRO A 117 -7.751 14.491 -6.568 1.00 0.36 H new ATOM 0 HG3 PRO A 117 -6.191 15.288 -6.515 1.00 0.36 H new ATOM 0 HD2 PRO A 117 -6.414 12.586 -6.282 1.00 0.31 H new ATOM 0 HD3 PRO A 117 -5.147 13.471 -5.458 1.00 0.31 H new ATOM 1648 N SER A 118 -9.489 12.859 -4.662 1.00 0.36 N ATOM 1649 CA SER A 118 -10.868 12.508 -4.927 1.00 0.40 C ATOM 1650 C SER A 118 -11.201 11.116 -4.404 1.00 0.35 C ATOM 1651 O SER A 118 -12.259 10.568 -4.709 1.00 0.32 O ATOM 1652 CB SER A 118 -11.135 12.596 -6.428 1.00 0.46 C ATOM 1653 OG SER A 118 -11.433 13.928 -6.815 1.00 1.13 O ATOM 0 H SER A 118 -8.806 12.239 -5.098 1.00 0.36 H new ATOM 0 HA SER A 118 -11.512 13.214 -4.402 1.00 0.40 H new ATOM 0 HB2 SER A 118 -10.263 12.240 -6.977 1.00 0.46 H new ATOM 0 HB3 SER A 118 -11.966 11.942 -6.692 1.00 0.46 H new ATOM 0 HG SER A 118 -11.598 13.959 -7.780 1.00 1.13 H new ATOM 1659 N CYS A 119 -10.313 10.548 -3.600 1.00 0.35 N ATOM 1660 CA CYS A 119 -10.552 9.226 -3.049 1.00 0.31 C ATOM 1661 C CYS A 119 -10.872 9.317 -1.564 1.00 0.32 C ATOM 1662 O CYS A 119 -10.205 10.037 -0.818 1.00 0.37 O ATOM 1663 CB CYS A 119 -9.350 8.309 -3.274 1.00 0.31 C ATOM 1664 SG CYS A 119 -9.717 6.543 -3.004 1.00 0.31 S ATOM 0 H CYS A 119 -9.432 10.977 -3.319 1.00 0.35 H new ATOM 0 HA CYS A 119 -11.409 8.798 -3.569 1.00 0.31 H new ATOM 0 HB2 CYS A 119 -8.986 8.444 -4.293 1.00 0.31 H new ATOM 0 HB3 CYS A 119 -8.544 8.610 -2.605 1.00 0.31 H new ATOM 1669 N GLU A 120 -11.902 8.592 -1.147 1.00 0.28 N ATOM 1670 CA GLU A 120 -12.343 8.610 0.240 1.00 0.29 C ATOM 1671 C GLU A 120 -12.029 7.292 0.915 1.00 0.27 C ATOM 1672 O GLU A 120 -11.359 7.250 1.947 1.00 0.32 O ATOM 1673 CB GLU A 120 -13.851 8.861 0.317 1.00 0.29 C ATOM 1674 CG GLU A 120 -14.302 10.077 -0.464 1.00 0.31 C ATOM 1675 CD GLU A 120 -13.861 11.387 0.166 1.00 0.36 C ATOM 1676 OE1 GLU A 120 -14.655 12.350 0.163 1.00 0.53 O ATOM 1677 OE2 GLU A 120 -12.720 11.471 0.667 1.00 0.70 O ATOM 0 H GLU A 120 -12.449 7.982 -1.754 1.00 0.28 H new ATOM 0 HA GLU A 120 -11.812 9.414 0.750 1.00 0.29 H new ATOM 0 HB2 GLU A 120 -14.377 7.983 -0.058 1.00 0.29 H new ATOM 0 HB3 GLU A 120 -14.138 8.983 1.361 1.00 0.29 H new ATOM 0 HG2 GLU A 120 -13.907 10.017 -1.478 1.00 0.31 H new ATOM 0 HG3 GLU A 120 -15.389 10.067 -0.544 1.00 0.31 H new ATOM 1684 N ILE A 121 -12.526 6.216 0.328 1.00 0.21 N ATOM 1685 CA ILE A 121 -12.405 4.905 0.943 1.00 0.19 C ATOM 1686 C ILE A 121 -11.835 3.878 -0.036 1.00 0.15 C ATOM 1687 O ILE A 121 -11.702 4.138 -1.234 1.00 0.15 O ATOM 1688 CB ILE A 121 -13.775 4.405 1.467 1.00 0.21 C ATOM 1689 CG1 ILE A 121 -14.676 3.935 0.321 1.00 0.21 C ATOM 1690 CG2 ILE A 121 -14.485 5.500 2.244 1.00 0.27 C ATOM 1691 CD1 ILE A 121 -14.654 2.442 0.100 1.00 0.21 C ATOM 0 H ILE A 121 -13.014 6.224 -0.568 1.00 0.21 H new ATOM 0 HA ILE A 121 -11.717 5.012 1.782 1.00 0.19 H new ATOM 0 HB ILE A 121 -13.578 3.560 2.126 1.00 0.21 H new ATOM 0 HG12 ILE A 121 -15.700 4.247 0.525 1.00 0.21 H new ATOM 0 HG13 ILE A 121 -14.368 4.433 -0.598 1.00 0.21 H new ATOM 0 HG21 ILE A 121 -15.445 5.128 2.603 1.00 0.27 H new ATOM 0 HG22 ILE A 121 -13.871 5.800 3.094 1.00 0.27 H new ATOM 0 HG23 ILE A 121 -14.649 6.359 1.594 1.00 0.27 H new ATOM 0 HD11 ILE A 121 -15.316 2.187 -0.727 1.00 0.21 H new ATOM 0 HD12 ILE A 121 -13.639 2.124 -0.137 1.00 0.21 H new ATOM 0 HD13 ILE A 121 -14.991 1.935 1.004 1.00 0.21 H new ATOM 1703 N PHE A 122 -11.548 2.696 0.488 1.00 0.13 N ATOM 1704 CA PHE A 122 -11.016 1.598 -0.307 1.00 0.13 C ATOM 1705 C PHE A 122 -11.359 0.262 0.339 1.00 0.12 C ATOM 1706 O PHE A 122 -11.823 0.217 1.478 1.00 0.20 O ATOM 1707 CB PHE A 122 -9.496 1.722 -0.472 1.00 0.14 C ATOM 1708 CG PHE A 122 -8.746 1.817 0.826 1.00 0.15 C ATOM 1709 CD1 PHE A 122 -8.306 0.674 1.467 1.00 0.17 C ATOM 1710 CD2 PHE A 122 -8.478 3.050 1.399 1.00 0.15 C ATOM 1711 CE1 PHE A 122 -7.615 0.755 2.658 1.00 0.20 C ATOM 1712 CE2 PHE A 122 -7.788 3.138 2.590 1.00 0.18 C ATOM 1713 CZ PHE A 122 -7.357 1.989 3.220 1.00 0.20 C ATOM 0 H PHE A 122 -11.677 2.470 1.474 1.00 0.13 H new ATOM 0 HA PHE A 122 -11.475 1.646 -1.295 1.00 0.13 H new ATOM 0 HB2 PHE A 122 -9.130 0.860 -1.029 1.00 0.14 H new ATOM 0 HB3 PHE A 122 -9.277 2.605 -1.072 1.00 0.14 H new ATOM 0 HD1 PHE A 122 -8.506 -0.293 1.030 1.00 0.17 H new ATOM 0 HD2 PHE A 122 -8.813 3.952 0.908 1.00 0.15 H new ATOM 0 HE1 PHE A 122 -7.277 -0.145 3.150 1.00 0.20 H new ATOM 0 HE2 PHE A 122 -7.586 4.104 3.028 1.00 0.18 H new ATOM 0 HZ PHE A 122 -6.818 2.055 4.153 1.00 0.20 H new ATOM 1723 N THR A 123 -11.147 -0.816 -0.397 1.00 0.13 N ATOM 1724 CA THR A 123 -11.334 -2.166 0.129 1.00 0.13 C ATOM 1725 C THR A 123 -10.374 -3.137 -0.545 1.00 0.13 C ATOM 1726 O THR A 123 -10.317 -3.231 -1.770 1.00 0.22 O ATOM 1727 CB THR A 123 -12.782 -2.679 -0.063 1.00 0.15 C ATOM 1728 OG1 THR A 123 -13.718 -1.708 0.427 1.00 0.17 O ATOM 1729 CG2 THR A 123 -12.991 -4.004 0.671 1.00 0.16 C ATOM 0 H THR A 123 -10.842 -0.786 -1.370 1.00 0.13 H new ATOM 0 HA THR A 123 -11.130 -2.114 1.198 1.00 0.13 H new ATOM 0 HB THR A 123 -12.947 -2.838 -1.129 1.00 0.15 H new ATOM 0 HG1 THR A 123 -14.080 -1.194 -0.325 1.00 0.17 H new ATOM 0 HG21 THR A 123 -14.015 -4.345 0.522 1.00 0.16 H new ATOM 0 HG22 THR A 123 -12.300 -4.750 0.279 1.00 0.16 H new ATOM 0 HG23 THR A 123 -12.807 -3.863 1.736 1.00 0.16 H new ATOM 1737 N TYR A 124 -9.613 -3.835 0.271 1.00 0.12 N ATOM 1738 CA TYR A 124 -8.668 -4.820 -0.196 1.00 0.12 C ATOM 1739 C TYR A 124 -9.250 -6.222 -0.082 1.00 0.10 C ATOM 1740 O TYR A 124 -9.510 -6.719 1.008 1.00 0.09 O ATOM 1741 CB TYR A 124 -7.369 -4.712 0.604 1.00 0.13 C ATOM 1742 CG TYR A 124 -6.445 -5.899 0.447 1.00 0.13 C ATOM 1743 CD1 TYR A 124 -6.181 -6.735 1.524 1.00 0.15 C ATOM 1744 CD2 TYR A 124 -5.846 -6.186 -0.772 1.00 0.17 C ATOM 1745 CE1 TYR A 124 -5.344 -7.824 1.392 1.00 0.17 C ATOM 1746 CE2 TYR A 124 -5.008 -7.274 -0.911 1.00 0.20 C ATOM 1747 CZ TYR A 124 -4.761 -8.089 0.173 1.00 0.20 C ATOM 1748 OH TYR A 124 -3.930 -9.175 0.039 1.00 0.23 O ATOM 0 H TYR A 124 -9.635 -3.732 1.286 1.00 0.12 H new ATOM 0 HA TYR A 124 -8.454 -4.629 -1.247 1.00 0.12 H new ATOM 0 HB2 TYR A 124 -6.840 -3.810 0.296 1.00 0.13 H new ATOM 0 HB3 TYR A 124 -7.614 -4.593 1.659 1.00 0.13 H new ATOM 0 HD1 TYR A 124 -6.638 -6.529 2.481 1.00 0.15 H new ATOM 0 HD2 TYR A 124 -6.038 -5.549 -1.623 1.00 0.17 H new ATOM 0 HE1 TYR A 124 -5.147 -8.464 2.239 1.00 0.17 H new ATOM 0 HE2 TYR A 124 -4.548 -7.486 -1.865 1.00 0.20 H new ATOM 0 HH TYR A 124 -4.215 -9.712 -0.729 1.00 0.23 H new ATOM 1758 N ASN A 125 -9.476 -6.823 -1.228 1.00 0.13 N ATOM 1759 CA ASN A 125 -9.862 -8.210 -1.337 1.00 0.14 C ATOM 1760 C ASN A 125 -8.666 -9.083 -1.032 1.00 0.16 C ATOM 1761 O ASN A 125 -7.735 -9.181 -1.825 1.00 0.20 O ATOM 1762 CB ASN A 125 -10.371 -8.465 -2.754 1.00 0.20 C ATOM 1763 CG ASN A 125 -11.818 -8.051 -2.941 1.00 0.34 C ATOM 1764 OD1 ASN A 125 -12.547 -8.642 -3.731 1.00 0.66 O ATOM 1765 ND2 ASN A 125 -12.239 -7.027 -2.216 1.00 0.24 N ATOM 0 H ASN A 125 -9.395 -6.351 -2.128 1.00 0.13 H new ATOM 0 HA ASN A 125 -10.654 -8.446 -0.626 1.00 0.14 H new ATOM 0 HB2 ASN A 125 -9.747 -7.920 -3.463 1.00 0.20 H new ATOM 0 HB3 ASN A 125 -10.268 -9.525 -2.987 1.00 0.20 H new ATOM 0 HD21 ASN A 125 -13.202 -6.702 -2.303 1.00 0.24 H new ATOM 0 HD22 ASN A 125 -11.601 -6.563 -1.570 1.00 0.24 H new ATOM 1772 N GLU A 126 -8.697 -9.703 0.126 1.00 0.17 N ATOM 1773 CA GLU A 126 -7.581 -10.487 0.616 1.00 0.20 C ATOM 1774 C GLU A 126 -7.561 -11.853 -0.053 1.00 0.23 C ATOM 1775 O GLU A 126 -6.606 -12.613 0.093 1.00 0.30 O ATOM 1776 CB GLU A 126 -7.682 -10.634 2.133 1.00 0.22 C ATOM 1777 CG GLU A 126 -8.199 -9.379 2.814 1.00 0.23 C ATOM 1778 CD GLU A 126 -7.970 -9.374 4.306 1.00 0.31 C ATOM 1779 OE1 GLU A 126 -8.562 -10.219 5.004 1.00 0.50 O ATOM 1780 OE2 GLU A 126 -7.216 -8.506 4.790 1.00 0.57 O ATOM 0 H GLU A 126 -9.498 -9.679 0.758 1.00 0.17 H new ATOM 0 HA GLU A 126 -6.650 -9.974 0.373 1.00 0.20 H new ATOM 0 HB2 GLU A 126 -8.343 -11.468 2.369 1.00 0.22 H new ATOM 0 HB3 GLU A 126 -6.700 -10.882 2.535 1.00 0.22 H new ATOM 0 HG2 GLU A 126 -7.711 -8.508 2.375 1.00 0.23 H new ATOM 0 HG3 GLU A 126 -9.266 -9.280 2.617 1.00 0.23 H new ATOM 1787 N HIS A 127 -8.627 -12.167 -0.778 1.00 0.21 N ATOM 1788 CA HIS A 127 -8.687 -13.415 -1.520 1.00 0.23 C ATOM 1789 C HIS A 127 -8.187 -13.189 -2.933 1.00 0.26 C ATOM 1790 O HIS A 127 -7.304 -13.892 -3.416 1.00 0.35 O ATOM 1791 CB HIS A 127 -10.108 -13.970 -1.558 1.00 0.25 C ATOM 1792 CG HIS A 127 -10.184 -15.389 -2.028 1.00 0.71 C ATOM 1793 ND1 HIS A 127 -10.839 -15.767 -3.179 1.00 1.26 N ATOM 1794 CD2 HIS A 127 -9.691 -16.528 -1.489 1.00 0.95 C ATOM 1795 CE1 HIS A 127 -10.746 -17.073 -3.325 1.00 1.74 C ATOM 1796 NE2 HIS A 127 -10.055 -17.558 -2.314 1.00 1.56 N ATOM 0 H HIS A 127 -9.455 -11.578 -0.867 1.00 0.21 H new ATOM 0 HA HIS A 127 -8.053 -14.144 -1.015 1.00 0.23 H new ATOM 0 HB2 HIS A 127 -10.542 -13.903 -0.561 1.00 0.25 H new ATOM 0 HB3 HIS A 127 -10.716 -13.346 -2.213 1.00 0.25 H new ATOM 0 HD2 HIS A 127 -9.117 -16.609 -0.578 1.00 0.95 H new ATOM 0 HE1 HIS A 127 -11.166 -17.649 -4.137 1.00 1.74 H new ATOM 0 HE2 HIS A 127 -9.828 -18.542 -2.169 1.00 1.56 H new ATOM 1804 N ASP A 128 -8.758 -12.184 -3.582 1.00 0.25 N ATOM 1805 CA ASP A 128 -8.415 -11.855 -4.960 1.00 0.29 C ATOM 1806 C ASP A 128 -7.098 -11.100 -5.023 1.00 0.27 C ATOM 1807 O ASP A 128 -6.558 -10.863 -6.107 1.00 0.32 O ATOM 1808 CB ASP A 128 -9.517 -11.005 -5.606 1.00 0.32 C ATOM 1809 CG ASP A 128 -10.863 -11.700 -5.614 1.00 0.72 C ATOM 1810 OD1 ASP A 128 -11.139 -12.458 -6.565 1.00 0.72 O ATOM 1811 OD2 ASP A 128 -11.654 -11.484 -4.675 1.00 1.33 O ATOM 0 H ASP A 128 -9.468 -11.577 -3.172 1.00 0.25 H new ATOM 0 HA ASP A 128 -8.317 -12.792 -5.508 1.00 0.29 H new ATOM 0 HB2 ASP A 128 -9.604 -10.061 -5.069 1.00 0.32 H new ATOM 0 HB3 ASP A 128 -9.231 -10.764 -6.630 1.00 0.32 H new ATOM 1816 N GLN A 129 -6.602 -10.724 -3.840 1.00 0.21 N ATOM 1817 CA GLN A 129 -5.371 -9.949 -3.700 1.00 0.21 C ATOM 1818 C GLN A 129 -5.541 -8.626 -4.428 1.00 0.18 C ATOM 1819 O GLN A 129 -4.692 -8.220 -5.212 1.00 0.18 O ATOM 1820 CB GLN A 129 -4.168 -10.719 -4.265 1.00 0.30 C ATOM 1821 CG GLN A 129 -4.099 -12.177 -3.829 1.00 0.53 C ATOM 1822 CD GLN A 129 -3.884 -12.353 -2.337 1.00 0.72 C ATOM 1823 OE1 GLN A 129 -3.236 -11.538 -1.682 1.00 1.75 O ATOM 1824 NE2 GLN A 129 -4.422 -13.430 -1.792 1.00 0.69 N ATOM 0 H GLN A 129 -7.047 -10.951 -2.951 1.00 0.21 H new ATOM 0 HA GLN A 129 -5.179 -9.768 -2.642 1.00 0.21 H new ATOM 0 HB2 GLN A 129 -4.204 -10.678 -5.354 1.00 0.30 H new ATOM 0 HB3 GLN A 129 -3.252 -10.216 -3.957 1.00 0.30 H new ATOM 0 HG2 GLN A 129 -5.023 -12.678 -4.116 1.00 0.53 H new ATOM 0 HG3 GLN A 129 -3.289 -12.671 -4.366 1.00 0.53 H new ATOM 0 HE21 GLN A 129 -4.953 -14.083 -2.369 1.00 0.69 H new ATOM 0 HE22 GLN A 129 -4.307 -13.609 -0.794 1.00 0.69 H new ATOM 1833 N LYS A 130 -6.650 -7.951 -4.162 1.00 0.17 N ATOM 1834 CA LYS A 130 -7.063 -6.843 -4.999 1.00 0.16 C ATOM 1835 C LYS A 130 -7.586 -5.664 -4.188 1.00 0.18 C ATOM 1836 O LYS A 130 -8.238 -5.835 -3.176 1.00 0.26 O ATOM 1837 CB LYS A 130 -8.151 -7.324 -5.948 1.00 0.18 C ATOM 1838 CG LYS A 130 -8.260 -6.488 -7.208 1.00 0.18 C ATOM 1839 CD LYS A 130 -9.437 -6.906 -8.073 1.00 0.22 C ATOM 1840 CE LYS A 130 -10.767 -6.608 -7.400 1.00 0.26 C ATOM 1841 NZ LYS A 130 -11.921 -6.986 -8.261 1.00 1.15 N ATOM 0 H LYS A 130 -7.273 -8.152 -3.379 1.00 0.17 H new ATOM 0 HA LYS A 130 -6.188 -6.496 -5.549 1.00 0.16 H new ATOM 0 HB2 LYS A 130 -7.951 -8.360 -6.223 1.00 0.18 H new ATOM 0 HB3 LYS A 130 -9.109 -7.311 -5.428 1.00 0.18 H new ATOM 0 HG2 LYS A 130 -8.365 -5.437 -6.937 1.00 0.18 H new ATOM 0 HG3 LYS A 130 -7.338 -6.578 -7.783 1.00 0.18 H new ATOM 0 HD2 LYS A 130 -9.389 -6.385 -9.029 1.00 0.22 H new ATOM 0 HD3 LYS A 130 -9.369 -7.972 -8.288 1.00 0.22 H new ATOM 0 HE2 LYS A 130 -10.826 -7.149 -6.456 1.00 0.26 H new ATOM 0 HE3 LYS A 130 -10.824 -5.546 -7.162 1.00 0.26 H new ATOM 0 HZ1 LYS A 130 -12.809 -6.767 -7.767 1.00 1.15 H new ATOM 0 HZ2 LYS A 130 -11.880 -6.451 -9.152 1.00 1.15 H new ATOM 0 HZ3 LYS A 130 -11.881 -8.005 -8.467 1.00 1.15 H new ATOM 1855 N CYS A 131 -7.318 -4.470 -4.669 1.00 0.16 N ATOM 1856 CA CYS A 131 -7.814 -3.256 -4.060 1.00 0.16 C ATOM 1857 C CYS A 131 -9.036 -2.770 -4.820 1.00 0.14 C ATOM 1858 O CYS A 131 -9.222 -3.119 -5.979 1.00 0.20 O ATOM 1859 CB CYS A 131 -6.752 -2.157 -4.107 1.00 0.20 C ATOM 1860 SG CYS A 131 -5.178 -2.549 -3.282 1.00 0.26 S ATOM 0 H CYS A 131 -6.746 -4.313 -5.499 1.00 0.16 H new ATOM 0 HA CYS A 131 -8.068 -3.473 -3.022 1.00 0.16 H new ATOM 0 HB2 CYS A 131 -6.545 -1.921 -5.151 1.00 0.20 H new ATOM 0 HB3 CYS A 131 -7.166 -1.257 -3.652 1.00 0.20 H new ATOM 1865 N THR A 132 -9.863 -1.985 -4.162 1.00 0.17 N ATOM 1866 CA THR A 132 -10.948 -1.271 -4.815 1.00 0.18 C ATOM 1867 C THR A 132 -11.054 0.116 -4.197 1.00 0.19 C ATOM 1868 O THR A 132 -10.866 0.261 -2.991 1.00 0.25 O ATOM 1869 CB THR A 132 -12.298 -2.008 -4.677 1.00 0.20 C ATOM 1870 OG1 THR A 132 -12.476 -2.465 -3.330 1.00 0.22 O ATOM 1871 CG2 THR A 132 -12.398 -3.188 -5.632 1.00 0.25 C ATOM 0 H THR A 132 -9.804 -1.821 -3.157 1.00 0.17 H new ATOM 0 HA THR A 132 -10.725 -1.207 -5.880 1.00 0.18 H new ATOM 0 HB THR A 132 -13.085 -1.298 -4.933 1.00 0.20 H new ATOM 0 HG1 THR A 132 -11.629 -2.824 -2.992 1.00 0.22 H new ATOM 0 HG21 THR A 132 -13.362 -3.679 -5.503 1.00 0.25 H new ATOM 0 HG22 THR A 132 -12.305 -2.834 -6.659 1.00 0.25 H new ATOM 0 HG23 THR A 132 -11.598 -3.897 -5.419 1.00 0.25 H new ATOM 1879 N PHE A 133 -11.318 1.134 -5.007 1.00 0.17 N ATOM 1880 CA PHE A 133 -11.321 2.508 -4.506 1.00 0.18 C ATOM 1881 C PHE A 133 -12.633 3.196 -4.835 1.00 0.18 C ATOM 1882 O PHE A 133 -13.019 3.293 -6.001 1.00 0.20 O ATOM 1883 CB PHE A 133 -10.157 3.280 -5.116 1.00 0.19 C ATOM 1884 CG PHE A 133 -8.849 2.562 -4.973 1.00 0.18 C ATOM 1885 CD1 PHE A 133 -8.280 1.924 -6.058 1.00 0.18 C ATOM 1886 CD2 PHE A 133 -8.179 2.542 -3.760 1.00 0.19 C ATOM 1887 CE1 PHE A 133 -7.069 1.279 -5.939 1.00 0.18 C ATOM 1888 CE2 PHE A 133 -6.968 1.893 -3.635 1.00 0.19 C ATOM 1889 CZ PHE A 133 -6.446 1.205 -4.692 1.00 0.18 C ATOM 0 H PHE A 133 -11.530 1.040 -6.000 1.00 0.17 H new ATOM 0 HA PHE A 133 -11.209 2.485 -3.422 1.00 0.18 H new ATOM 0 HB2 PHE A 133 -10.357 3.456 -6.173 1.00 0.19 H new ATOM 0 HB3 PHE A 133 -10.085 4.257 -4.639 1.00 0.19 H new ATOM 0 HD1 PHE A 133 -8.790 1.931 -7.010 1.00 0.18 H new ATOM 0 HD2 PHE A 133 -8.609 3.040 -2.904 1.00 0.19 H new ATOM 0 HE1 PHE A 133 -6.604 0.833 -6.806 1.00 0.18 H new ATOM 0 HE2 PHE A 133 -6.432 1.929 -2.698 1.00 0.19 H new ATOM 0 HZ PHE A 133 -5.556 0.607 -4.564 1.00 0.18 H new ATOM 1899 N LYS A 134 -13.295 3.702 -3.810 1.00 0.18 N ATOM 1900 CA LYS A 134 -14.641 4.242 -3.946 1.00 0.20 C ATOM 1901 C LYS A 134 -14.750 5.585 -3.240 1.00 0.21 C ATOM 1902 O LYS A 134 -14.048 5.845 -2.260 1.00 0.20 O ATOM 1903 CB LYS A 134 -15.668 3.255 -3.383 1.00 0.21 C ATOM 1904 CG LYS A 134 -16.061 2.134 -4.350 1.00 0.26 C ATOM 1905 CD LYS A 134 -14.935 1.155 -4.624 1.00 0.55 C ATOM 1906 CE LYS A 134 -15.443 -0.075 -5.355 1.00 0.56 C ATOM 1907 NZ LYS A 134 -16.384 0.260 -6.460 1.00 0.72 N ATOM 0 H LYS A 134 -12.919 3.751 -2.863 1.00 0.18 H new ATOM 0 HA LYS A 134 -14.849 4.393 -5.005 1.00 0.20 H new ATOM 0 HB2 LYS A 134 -15.266 2.810 -2.473 1.00 0.21 H new ATOM 0 HB3 LYS A 134 -16.565 3.805 -3.099 1.00 0.21 H new ATOM 0 HG2 LYS A 134 -16.913 1.592 -3.939 1.00 0.26 H new ATOM 0 HG3 LYS A 134 -16.388 2.574 -5.292 1.00 0.26 H new ATOM 0 HD2 LYS A 134 -14.163 1.642 -5.219 1.00 0.55 H new ATOM 0 HD3 LYS A 134 -14.472 0.857 -3.683 1.00 0.55 H new ATOM 0 HE2 LYS A 134 -14.595 -0.628 -5.760 1.00 0.56 H new ATOM 0 HE3 LYS A 134 -15.943 -0.734 -4.645 1.00 0.56 H new ATOM 0 HZ1 LYS A 134 -17.212 -0.367 -6.413 1.00 0.72 H new ATOM 0 HZ2 LYS A 134 -16.692 1.249 -6.366 1.00 0.72 H new ATOM 0 HZ3 LYS A 134 -15.905 0.132 -7.374 1.00 0.72 H new ATOM 1921 N GLY A 135 -15.615 6.442 -3.758 1.00 0.25 N ATOM 1922 CA GLY A 135 -15.781 7.760 -3.187 1.00 0.29 C ATOM 1923 C GLY A 135 -16.977 7.848 -2.271 1.00 0.31 C ATOM 1924 O GLY A 135 -17.406 6.845 -1.699 1.00 0.35 O ATOM 0 H GLY A 135 -16.206 6.247 -4.566 1.00 0.25 H new ATOM 0 HA2 GLY A 135 -14.882 8.027 -2.632 1.00 0.29 H new ATOM 0 HA3 GLY A 135 -15.888 8.489 -3.990 1.00 0.29 H new ATOM 1928 N ARG A 136 -17.527 9.047 -2.147 1.00 0.33 N ATOM 1929 CA ARG A 136 -18.648 9.289 -1.252 1.00 0.40 C ATOM 1930 C ARG A 136 -19.900 8.571 -1.737 1.00 0.39 C ATOM 1931 O ARG A 136 -20.090 8.364 -2.941 1.00 0.43 O ATOM 1932 CB ARG A 136 -18.899 10.783 -1.100 1.00 0.51 C ATOM 1933 CG ARG A 136 -17.716 11.506 -0.486 1.00 0.55 C ATOM 1934 CD ARG A 136 -18.141 12.770 0.226 1.00 1.03 C ATOM 1935 NE ARG A 136 -17.005 13.447 0.850 1.00 1.91 N ATOM 1936 CZ ARG A 136 -17.119 14.400 1.774 1.00 2.55 C ATOM 1937 NH1 ARG A 136 -18.317 14.761 2.218 1.00 2.53 N ATOM 1938 NH2 ARG A 136 -16.032 14.979 2.270 1.00 3.44 N ATOM 0 H ARG A 136 -17.213 9.872 -2.658 1.00 0.33 H new ATOM 0 HA ARG A 136 -18.394 8.886 -0.272 1.00 0.40 H new ATOM 0 HB2 ARG A 136 -19.118 11.214 -2.077 1.00 0.51 H new ATOM 0 HB3 ARG A 136 -19.780 10.940 -0.478 1.00 0.51 H new ATOM 0 HG2 ARG A 136 -17.211 10.844 0.218 1.00 0.55 H new ATOM 0 HG3 ARG A 136 -16.995 11.752 -1.266 1.00 0.55 H new ATOM 0 HD2 ARG A 136 -18.621 13.444 -0.484 1.00 1.03 H new ATOM 0 HD3 ARG A 136 -18.883 12.527 0.987 1.00 1.03 H new ATOM 0 HE ARG A 136 -16.067 13.172 0.560 1.00 1.91 H new ATOM 0 HH11 ARG A 136 -19.154 14.308 1.852 1.00 2.53 H new ATOM 0 HH12 ARG A 136 -18.400 15.491 2.926 1.00 2.53 H new ATOM 0 HH21 ARG A 136 -15.109 14.694 1.944 1.00 3.44 H new ATOM 0 HH22 ARG A 136 -16.120 15.709 2.977 1.00 3.44 H new ATOM 1952 N GLY A 137 -20.748 8.190 -0.794 1.00 0.37 N ATOM 1953 CA GLY A 137 -21.886 7.355 -1.109 1.00 0.37 C ATOM 1954 C GLY A 137 -21.612 5.917 -0.731 1.00 0.33 C ATOM 1955 O GLY A 137 -22.468 5.041 -0.863 1.00 0.35 O ATOM 0 H GLY A 137 -20.667 8.447 0.190 1.00 0.37 H new ATOM 0 HA2 GLY A 137 -22.766 7.715 -0.577 1.00 0.37 H new ATOM 0 HA3 GLY A 137 -22.108 7.421 -2.174 1.00 0.37 H new ATOM 1959 N PHE A 138 -20.402 5.693 -0.238 1.00 0.31 N ATOM 1960 CA PHE A 138 -19.927 4.369 0.117 1.00 0.30 C ATOM 1961 C PHE A 138 -20.705 3.789 1.297 1.00 0.35 C ATOM 1962 O PHE A 138 -20.861 2.577 1.406 1.00 0.38 O ATOM 1963 CB PHE A 138 -18.428 4.438 0.439 1.00 0.29 C ATOM 1964 CG PHE A 138 -18.095 5.317 1.620 1.00 0.33 C ATOM 1965 CD1 PHE A 138 -17.921 6.683 1.463 1.00 0.36 C ATOM 1966 CD2 PHE A 138 -17.952 4.772 2.886 1.00 0.38 C ATOM 1967 CE1 PHE A 138 -17.611 7.487 2.543 1.00 0.42 C ATOM 1968 CE2 PHE A 138 -17.642 5.569 3.971 1.00 0.43 C ATOM 1969 CZ PHE A 138 -17.492 6.946 3.792 1.00 0.44 C ATOM 0 H PHE A 138 -19.719 6.433 -0.073 1.00 0.31 H new ATOM 0 HA PHE A 138 -20.088 3.704 -0.731 1.00 0.30 H new ATOM 0 HB2 PHE A 138 -18.062 3.430 0.634 1.00 0.29 H new ATOM 0 HB3 PHE A 138 -17.895 4.807 -0.437 1.00 0.29 H new ATOM 0 HD1 PHE A 138 -18.029 7.125 0.483 1.00 0.36 H new ATOM 0 HD2 PHE A 138 -18.085 3.709 3.026 1.00 0.38 H new ATOM 0 HE1 PHE A 138 -17.462 8.547 2.399 1.00 0.42 H new ATOM 0 HE2 PHE A 138 -17.517 5.131 4.950 1.00 0.43 H new ATOM 0 HZ PHE A 138 -17.282 7.582 4.639 1.00 0.44 H new ATOM 1979 N SER A 139 -21.209 4.661 2.162 1.00 0.41 N ATOM 1980 CA SER A 139 -21.912 4.234 3.366 1.00 0.50 C ATOM 1981 C SER A 139 -23.174 3.444 3.021 1.00 0.44 C ATOM 1982 O SER A 139 -23.566 2.532 3.749 1.00 0.49 O ATOM 1983 CB SER A 139 -22.266 5.454 4.214 1.00 0.60 C ATOM 1984 OG SER A 139 -21.133 6.289 4.392 1.00 1.47 O ATOM 0 H SER A 139 -21.143 5.673 2.051 1.00 0.41 H new ATOM 0 HA SER A 139 -21.254 3.576 3.934 1.00 0.50 H new ATOM 0 HB2 SER A 139 -23.066 6.017 3.734 1.00 0.60 H new ATOM 0 HB3 SER A 139 -22.642 5.131 5.185 1.00 0.60 H new ATOM 0 HG SER A 139 -21.381 7.065 4.936 1.00 1.47 H new ATOM 1990 N ALA A 140 -23.799 3.790 1.902 1.00 0.37 N ATOM 1991 CA ALA A 140 -24.999 3.107 1.452 1.00 0.38 C ATOM 1992 C ALA A 140 -24.641 1.802 0.765 1.00 0.39 C ATOM 1993 O ALA A 140 -25.327 0.791 0.912 1.00 0.53 O ATOM 1994 CB ALA A 140 -25.775 4.002 0.507 1.00 0.39 C ATOM 0 H ALA A 140 -23.490 4.544 1.289 1.00 0.37 H new ATOM 0 HA ALA A 140 -25.621 2.880 2.318 1.00 0.38 H new ATOM 0 HB1 ALA A 140 -26.674 3.485 0.172 1.00 0.39 H new ATOM 0 HB2 ALA A 140 -26.055 4.920 1.023 1.00 0.39 H new ATOM 0 HB3 ALA A 140 -25.154 4.246 -0.355 1.00 0.39 H new ATOM 2000 N PHE A 141 -23.544 1.827 0.028 1.00 0.31 N ATOM 2001 CA PHE A 141 -23.086 0.664 -0.710 1.00 0.30 C ATOM 2002 C PHE A 141 -22.072 -0.118 0.115 1.00 0.30 C ATOM 2003 O PHE A 141 -21.102 -0.663 -0.413 1.00 0.31 O ATOM 2004 CB PHE A 141 -22.476 1.099 -2.042 1.00 0.28 C ATOM 2005 CG PHE A 141 -23.459 1.783 -2.952 1.00 0.28 C ATOM 2006 CD1 PHE A 141 -24.365 1.046 -3.694 1.00 0.30 C ATOM 2007 CD2 PHE A 141 -23.476 3.164 -3.063 1.00 0.29 C ATOM 2008 CE1 PHE A 141 -25.269 1.671 -4.532 1.00 0.33 C ATOM 2009 CE2 PHE A 141 -24.377 3.795 -3.898 1.00 0.31 C ATOM 2010 CZ PHE A 141 -25.274 3.048 -4.633 1.00 0.32 C ATOM 0 H PHE A 141 -22.949 2.649 -0.075 1.00 0.31 H new ATOM 0 HA PHE A 141 -23.937 0.014 -0.913 1.00 0.30 H new ATOM 0 HB2 PHE A 141 -21.641 1.773 -1.849 1.00 0.28 H new ATOM 0 HB3 PHE A 141 -22.069 0.225 -2.550 1.00 0.28 H new ATOM 0 HD1 PHE A 141 -24.366 -0.031 -3.617 1.00 0.30 H new ATOM 0 HD2 PHE A 141 -22.776 3.754 -2.490 1.00 0.29 H new ATOM 0 HE1 PHE A 141 -25.970 1.084 -5.107 1.00 0.33 H new ATOM 0 HE2 PHE A 141 -24.379 4.872 -3.975 1.00 0.31 H new ATOM 0 HZ PHE A 141 -25.979 3.540 -5.287 1.00 0.32 H new ATOM 2020 N LYS A 142 -22.304 -0.151 1.416 1.00 0.31 N ATOM 2021 CA LYS A 142 -21.427 -0.850 2.336 1.00 0.30 C ATOM 2022 C LYS A 142 -21.924 -2.267 2.595 1.00 0.28 C ATOM 2023 O LYS A 142 -23.088 -2.478 2.936 1.00 0.35 O ATOM 2024 CB LYS A 142 -21.336 -0.082 3.651 1.00 0.32 C ATOM 2025 CG LYS A 142 -20.386 -0.705 4.654 1.00 0.37 C ATOM 2026 CD LYS A 142 -20.247 0.164 5.885 1.00 0.38 C ATOM 2027 CE LYS A 142 -19.202 -0.386 6.837 1.00 0.46 C ATOM 2028 NZ LYS A 142 -18.934 0.541 7.969 1.00 0.50 N ATOM 0 H LYS A 142 -23.101 0.304 1.861 1.00 0.31 H new ATOM 0 HA LYS A 142 -20.437 -0.913 1.884 1.00 0.30 H new ATOM 0 HB2 LYS A 142 -21.014 0.939 3.444 1.00 0.32 H new ATOM 0 HB3 LYS A 142 -22.330 -0.019 4.095 1.00 0.32 H new ATOM 0 HG2 LYS A 142 -20.750 -1.691 4.941 1.00 0.37 H new ATOM 0 HG3 LYS A 142 -19.408 -0.848 4.194 1.00 0.37 H new ATOM 0 HD2 LYS A 142 -19.974 1.177 5.588 1.00 0.38 H new ATOM 0 HD3 LYS A 142 -21.208 0.230 6.396 1.00 0.38 H new ATOM 0 HE2 LYS A 142 -19.538 -1.347 7.227 1.00 0.46 H new ATOM 0 HE3 LYS A 142 -18.276 -0.569 6.292 1.00 0.46 H new ATOM 0 HZ1 LYS A 142 -17.984 0.358 8.350 1.00 0.50 H new ATOM 0 HZ2 LYS A 142 -18.988 1.524 7.633 1.00 0.50 H new ATOM 0 HZ3 LYS A 142 -19.642 0.391 8.716 1.00 0.50 H new ATOM 2042 N GLU A 143 -21.029 -3.228 2.449 1.00 0.25 N ATOM 2043 CA GLU A 143 -21.364 -4.630 2.654 1.00 0.25 C ATOM 2044 C GLU A 143 -20.615 -5.163 3.866 1.00 0.23 C ATOM 2045 O GLU A 143 -19.405 -5.345 3.813 1.00 0.23 O ATOM 2046 CB GLU A 143 -20.995 -5.457 1.416 1.00 0.29 C ATOM 2047 CG GLU A 143 -21.796 -6.740 1.287 1.00 0.33 C ATOM 2048 CD GLU A 143 -21.564 -7.439 -0.040 1.00 0.43 C ATOM 2049 OE1 GLU A 143 -20.672 -8.307 -0.124 1.00 0.73 O ATOM 2050 OE2 GLU A 143 -22.278 -7.117 -1.013 1.00 0.52 O ATOM 0 H GLU A 143 -20.057 -3.063 2.187 1.00 0.25 H new ATOM 0 HA GLU A 143 -22.438 -4.712 2.823 1.00 0.25 H new ATOM 0 HB2 GLU A 143 -21.149 -4.850 0.524 1.00 0.29 H new ATOM 0 HB3 GLU A 143 -19.934 -5.702 1.455 1.00 0.29 H new ATOM 0 HG2 GLU A 143 -21.529 -7.414 2.101 1.00 0.33 H new ATOM 0 HG3 GLU A 143 -22.857 -6.515 1.395 1.00 0.33 H new ATOM 2057 N ARG A 144 -21.324 -5.393 4.959 1.00 0.23 N ATOM 2058 CA ARG A 144 -20.691 -5.882 6.177 1.00 0.23 C ATOM 2059 C ARG A 144 -20.787 -7.399 6.267 1.00 0.23 C ATOM 2060 O ARG A 144 -21.828 -7.983 5.964 1.00 0.29 O ATOM 2061 CB ARG A 144 -21.319 -5.248 7.423 1.00 0.30 C ATOM 2062 CG ARG A 144 -21.123 -3.740 7.516 1.00 0.35 C ATOM 2063 CD ARG A 144 -22.178 -2.973 6.731 1.00 0.34 C ATOM 2064 NE ARG A 144 -23.509 -3.112 7.321 1.00 0.49 N ATOM 2065 CZ ARG A 144 -24.644 -2.766 6.711 1.00 0.57 C ATOM 2066 NH1 ARG A 144 -24.625 -2.273 5.477 1.00 0.71 N ATOM 2067 NH2 ARG A 144 -25.802 -2.921 7.339 1.00 0.77 N ATOM 0 H ARG A 144 -22.332 -5.251 5.030 1.00 0.23 H new ATOM 0 HA ARG A 144 -19.640 -5.596 6.135 1.00 0.23 H new ATOM 0 HB2 ARG A 144 -22.387 -5.466 7.430 1.00 0.30 H new ATOM 0 HB3 ARG A 144 -20.892 -5.715 8.310 1.00 0.30 H new ATOM 0 HG2 ARG A 144 -21.158 -3.435 8.562 1.00 0.35 H new ATOM 0 HG3 ARG A 144 -20.133 -3.480 7.141 1.00 0.35 H new ATOM 0 HD2 ARG A 144 -21.906 -1.918 6.694 1.00 0.34 H new ATOM 0 HD3 ARG A 144 -22.198 -3.334 5.703 1.00 0.34 H new ATOM 0 HE ARG A 144 -23.574 -3.500 8.262 1.00 0.49 H new ATOM 0 HH11 ARG A 144 -23.737 -2.156 4.988 1.00 0.71 H new ATOM 0 HH12 ARG A 144 -25.498 -2.011 5.019 1.00 0.71 H new ATOM 0 HH21 ARG A 144 -25.822 -3.303 8.284 1.00 0.77 H new ATOM 0 HH22 ARG A 144 -26.672 -2.658 6.877 1.00 0.77 H new ATOM 2081 N GLY A 145 -19.697 -8.027 6.680 1.00 0.21 N ATOM 2082 CA GLY A 145 -19.674 -9.470 6.827 1.00 0.25 C ATOM 2083 C GLY A 145 -19.109 -10.154 5.603 1.00 0.22 C ATOM 2084 O GLY A 145 -19.498 -11.270 5.263 1.00 0.25 O ATOM 0 H GLY A 145 -18.822 -7.561 6.918 1.00 0.21 H new ATOM 0 HA2 GLY A 145 -19.077 -9.736 7.699 1.00 0.25 H new ATOM 0 HA3 GLY A 145 -20.686 -9.832 7.010 1.00 0.25 H new ATOM 2088 N VAL A 146 -18.185 -9.480 4.942 1.00 0.19 N ATOM 2089 CA VAL A 146 -17.591 -9.992 3.718 1.00 0.18 C ATOM 2090 C VAL A 146 -16.258 -10.669 4.014 1.00 0.17 C ATOM 2091 O VAL A 146 -15.315 -10.030 4.473 1.00 0.17 O ATOM 2092 CB VAL A 146 -17.377 -8.857 2.699 1.00 0.16 C ATOM 2093 CG1 VAL A 146 -16.864 -9.397 1.374 1.00 0.17 C ATOM 2094 CG2 VAL A 146 -18.663 -8.079 2.492 1.00 0.20 C ATOM 0 H VAL A 146 -17.827 -8.571 5.234 1.00 0.19 H new ATOM 0 HA VAL A 146 -18.278 -10.724 3.293 1.00 0.18 H new ATOM 0 HB VAL A 146 -16.622 -8.183 3.102 1.00 0.16 H new ATOM 0 HG11 VAL A 146 -16.723 -8.572 0.675 1.00 0.17 H new ATOM 0 HG12 VAL A 146 -15.913 -9.906 1.532 1.00 0.17 H new ATOM 0 HG13 VAL A 146 -17.588 -10.101 0.963 1.00 0.17 H new ATOM 0 HG21 VAL A 146 -18.493 -7.281 1.769 1.00 0.20 H new ATOM 0 HG22 VAL A 146 -19.437 -8.749 2.118 1.00 0.20 H new ATOM 0 HG23 VAL A 146 -18.984 -7.647 3.440 1.00 0.20 H new ATOM 2104 N LEU A 147 -16.185 -11.964 3.764 1.00 0.21 N ATOM 2105 CA LEU A 147 -14.970 -12.714 4.035 1.00 0.22 C ATOM 2106 C LEU A 147 -13.927 -12.476 2.965 1.00 0.21 C ATOM 2107 O LEU A 147 -14.174 -12.691 1.776 1.00 0.23 O ATOM 2108 CB LEU A 147 -15.255 -14.201 4.118 1.00 0.29 C ATOM 2109 CG LEU A 147 -16.289 -14.601 5.166 1.00 0.35 C ATOM 2110 CD1 LEU A 147 -16.490 -16.106 5.170 1.00 0.41 C ATOM 2111 CD2 LEU A 147 -15.861 -14.115 6.539 1.00 0.37 C ATOM 0 H LEU A 147 -16.949 -12.517 3.375 1.00 0.21 H new ATOM 0 HA LEU A 147 -14.588 -12.363 4.993 1.00 0.22 H new ATOM 0 HB2 LEU A 147 -15.597 -14.545 3.142 1.00 0.29 H new ATOM 0 HB3 LEU A 147 -14.322 -14.723 4.332 1.00 0.29 H new ATOM 0 HG LEU A 147 -17.240 -14.131 4.913 1.00 0.35 H new ATOM 0 HD11 LEU A 147 -17.231 -16.372 5.924 1.00 0.41 H new ATOM 0 HD12 LEU A 147 -16.838 -16.429 4.189 1.00 0.41 H new ATOM 0 HD13 LEU A 147 -15.545 -16.599 5.400 1.00 0.41 H new ATOM 0 HD21 LEU A 147 -16.608 -14.407 7.277 1.00 0.37 H new ATOM 0 HD22 LEU A 147 -14.900 -14.559 6.799 1.00 0.37 H new ATOM 0 HD23 LEU A 147 -15.767 -13.029 6.528 1.00 0.37 H new ATOM 2123 N GLY A 148 -12.760 -12.043 3.389 1.00 0.22 N ATOM 2124 CA GLY A 148 -11.671 -11.867 2.469 1.00 0.24 C ATOM 2125 C GLY A 148 -11.562 -10.464 1.958 1.00 0.19 C ATOM 2126 O GLY A 148 -11.106 -10.251 0.842 1.00 0.19 O ATOM 0 H GLY A 148 -12.547 -11.809 4.359 1.00 0.22 H new ATOM 0 HA2 GLY A 148 -10.738 -12.143 2.961 1.00 0.24 H new ATOM 0 HA3 GLY A 148 -11.800 -12.546 1.626 1.00 0.24 H new ATOM 2130 N VAL A 149 -11.998 -9.501 2.749 1.00 0.17 N ATOM 2131 CA VAL A 149 -11.853 -8.110 2.370 1.00 0.13 C ATOM 2132 C VAL A 149 -11.540 -7.247 3.574 1.00 0.13 C ATOM 2133 O VAL A 149 -11.938 -7.541 4.705 1.00 0.17 O ATOM 2134 CB VAL A 149 -13.103 -7.548 1.670 1.00 0.13 C ATOM 2135 CG1 VAL A 149 -13.417 -8.302 0.393 1.00 0.15 C ATOM 2136 CG2 VAL A 149 -14.279 -7.574 2.608 1.00 0.15 C ATOM 0 H VAL A 149 -12.451 -9.655 3.650 1.00 0.17 H new ATOM 0 HA VAL A 149 -11.024 -8.081 1.663 1.00 0.13 H new ATOM 0 HB VAL A 149 -12.896 -6.514 1.393 1.00 0.13 H new ATOM 0 HG11 VAL A 149 -14.306 -7.876 -0.072 1.00 0.15 H new ATOM 0 HG12 VAL A 149 -12.574 -8.222 -0.294 1.00 0.15 H new ATOM 0 HG13 VAL A 149 -13.597 -9.352 0.625 1.00 0.15 H new ATOM 0 HG21 VAL A 149 -15.157 -7.174 2.101 1.00 0.15 H new ATOM 0 HG22 VAL A 149 -14.475 -8.601 2.918 1.00 0.15 H new ATOM 0 HG23 VAL A 149 -14.058 -6.966 3.485 1.00 0.15 H new ATOM 2146 N THR A 150 -10.823 -6.187 3.304 1.00 0.13 N ATOM 2147 CA THR A 150 -10.463 -5.208 4.298 1.00 0.15 C ATOM 2148 C THR A 150 -10.661 -3.815 3.731 1.00 0.14 C ATOM 2149 O THR A 150 -10.035 -3.447 2.747 1.00 0.15 O ATOM 2150 CB THR A 150 -8.997 -5.384 4.733 1.00 0.17 C ATOM 2151 OG1 THR A 150 -8.860 -6.540 5.571 1.00 0.20 O ATOM 2152 CG2 THR A 150 -8.496 -4.143 5.457 1.00 0.19 C ATOM 0 H THR A 150 -10.467 -5.976 2.372 1.00 0.13 H new ATOM 0 HA THR A 150 -11.102 -5.347 5.170 1.00 0.15 H new ATOM 0 HB THR A 150 -8.390 -5.527 3.839 1.00 0.17 H new ATOM 0 HG1 THR A 150 -8.100 -7.077 5.265 1.00 0.20 H new ATOM 0 HG21 THR A 150 -7.458 -4.290 5.755 1.00 0.19 H new ATOM 0 HG22 THR A 150 -8.564 -3.282 4.793 1.00 0.19 H new ATOM 0 HG23 THR A 150 -9.106 -3.967 6.343 1.00 0.19 H new ATOM 2160 N SER A 151 -11.517 -3.034 4.346 1.00 0.15 N ATOM 2161 CA SER A 151 -11.805 -1.717 3.832 1.00 0.16 C ATOM 2162 C SER A 151 -11.145 -0.658 4.688 1.00 0.20 C ATOM 2163 O SER A 151 -10.739 -0.922 5.810 1.00 0.45 O ATOM 2164 CB SER A 151 -13.314 -1.486 3.771 1.00 0.20 C ATOM 2165 OG SER A 151 -13.896 -1.540 5.059 1.00 1.06 O ATOM 0 H SER A 151 -12.022 -3.285 5.196 1.00 0.15 H new ATOM 0 HA SER A 151 -11.402 -1.646 2.822 1.00 0.16 H new ATOM 0 HB2 SER A 151 -13.517 -0.515 3.318 1.00 0.20 H new ATOM 0 HB3 SER A 151 -13.773 -2.239 3.130 1.00 0.20 H new ATOM 0 HG SER A 151 -13.416 -2.195 5.608 1.00 1.06 H new ATOM 2171 N GLY A 152 -11.004 0.525 4.135 1.00 0.14 N ATOM 2172 CA GLY A 152 -10.451 1.627 4.876 1.00 0.15 C ATOM 2173 C GLY A 152 -11.133 2.912 4.504 1.00 0.13 C ATOM 2174 O GLY A 152 -10.995 3.387 3.380 1.00 0.15 O ATOM 0 H GLY A 152 -11.266 0.745 3.174 1.00 0.14 H new ATOM 0 HA2 GLY A 152 -10.564 1.446 5.945 1.00 0.15 H new ATOM 0 HA3 GLY A 152 -9.382 1.706 4.677 1.00 0.15 H new ATOM 2178 N PRO A 153 -11.914 3.481 5.416 1.00 0.16 N ATOM 2179 CA PRO A 153 -12.636 4.716 5.171 1.00 0.19 C ATOM 2180 C PRO A 153 -11.823 5.946 5.554 1.00 0.19 C ATOM 2181 O PRO A 153 -12.383 7.016 5.808 1.00 0.24 O ATOM 2182 CB PRO A 153 -13.840 4.558 6.092 1.00 0.23 C ATOM 2183 CG PRO A 153 -13.298 3.831 7.278 1.00 0.25 C ATOM 2184 CD PRO A 153 -12.184 2.952 6.768 1.00 0.22 C ATOM 0 HA PRO A 153 -12.883 4.867 4.120 1.00 0.19 H new ATOM 0 HB2 PRO A 153 -14.256 5.525 6.373 1.00 0.23 H new ATOM 0 HB3 PRO A 153 -14.639 3.995 5.610 1.00 0.23 H new ATOM 0 HG2 PRO A 153 -12.928 4.531 8.027 1.00 0.25 H new ATOM 0 HG3 PRO A 153 -14.075 3.235 7.756 1.00 0.25 H new ATOM 0 HD2 PRO A 153 -11.302 3.013 7.406 1.00 0.22 H new ATOM 0 HD3 PRO A 153 -12.483 1.904 6.736 1.00 0.22 H new ATOM 2192 N LYS A 154 -10.504 5.791 5.596 1.00 0.17 N ATOM 2193 CA LYS A 154 -9.630 6.846 6.084 1.00 0.17 C ATOM 2194 C LYS A 154 -8.276 6.832 5.383 1.00 0.18 C ATOM 2195 O LYS A 154 -8.079 6.122 4.397 1.00 0.21 O ATOM 2196 CB LYS A 154 -9.437 6.708 7.601 1.00 0.19 C ATOM 2197 CG LYS A 154 -10.635 7.154 8.421 1.00 0.21 C ATOM 2198 CD LYS A 154 -10.446 6.867 9.891 1.00 0.29 C ATOM 2199 CE LYS A 154 -11.679 7.266 10.672 1.00 0.40 C ATOM 2200 NZ LYS A 154 -11.908 8.735 10.647 1.00 0.70 N ATOM 0 H LYS A 154 -10.019 4.945 5.298 1.00 0.17 H new ATOM 0 HA LYS A 154 -10.108 7.800 5.861 1.00 0.17 H new ATOM 0 HB2 LYS A 154 -9.217 5.666 7.835 1.00 0.19 H new ATOM 0 HB3 LYS A 154 -8.567 7.293 7.901 1.00 0.19 H new ATOM 0 HG2 LYS A 154 -10.797 8.222 8.277 1.00 0.21 H new ATOM 0 HG3 LYS A 154 -11.530 6.645 8.063 1.00 0.21 H new ATOM 0 HD2 LYS A 154 -10.243 5.806 10.037 1.00 0.29 H new ATOM 0 HD3 LYS A 154 -9.579 7.412 10.265 1.00 0.29 H new ATOM 0 HE2 LYS A 154 -12.550 6.757 10.258 1.00 0.40 H new ATOM 0 HE3 LYS A 154 -11.576 6.933 11.705 1.00 0.40 H new ATOM 0 HZ1 LYS A 154 -12.656 8.981 11.326 1.00 0.70 H new ATOM 0 HZ2 LYS A 154 -11.029 9.228 10.905 1.00 0.70 H new ATOM 0 HZ3 LYS A 154 -12.199 9.025 9.692 1.00 0.70 H new ATOM 2214 N GLN A 155 -7.353 7.628 5.911 1.00 0.18 N ATOM 2215 CA GLN A 155 -6.011 7.753 5.356 1.00 0.18 C ATOM 2216 C GLN A 155 -5.085 6.678 5.914 1.00 0.15 C ATOM 2217 O GLN A 155 -5.539 5.666 6.439 1.00 0.17 O ATOM 2218 CB GLN A 155 -5.435 9.125 5.706 1.00 0.20 C ATOM 2219 CG GLN A 155 -6.322 10.287 5.307 1.00 0.23 C ATOM 2220 CD GLN A 155 -6.389 10.488 3.805 1.00 0.75 C ATOM 2221 OE1 GLN A 155 -7.254 9.933 3.126 1.00 1.78 O ATOM 2222 NE2 GLN A 155 -5.467 11.277 3.280 1.00 0.92 N ATOM 0 H GLN A 155 -7.515 8.205 6.736 1.00 0.18 H new ATOM 0 HA GLN A 155 -6.081 7.635 4.275 1.00 0.18 H new ATOM 0 HB2 GLN A 155 -5.257 9.169 6.780 1.00 0.20 H new ATOM 0 HB3 GLN A 155 -4.467 9.236 5.218 1.00 0.20 H new ATOM 0 HG2 GLN A 155 -7.328 10.119 5.691 1.00 0.23 H new ATOM 0 HG3 GLN A 155 -5.950 11.199 5.775 1.00 0.23 H new ATOM 0 HE21 GLN A 155 -4.769 11.716 3.881 1.00 0.92 H new ATOM 0 HE22 GLN A 155 -5.453 11.446 2.274 1.00 0.92 H new ATOM 2231 N PHE A 156 -3.785 6.919 5.786 1.00 0.14 N ATOM 2232 CA PHE A 156 -2.768 6.084 6.419 1.00 0.11 C ATOM 2233 C PHE A 156 -3.074 5.959 7.907 1.00 0.14 C ATOM 2234 O PHE A 156 -3.032 6.953 8.622 1.00 0.20 O ATOM 2235 CB PHE A 156 -1.390 6.717 6.259 1.00 0.11 C ATOM 2236 CG PHE A 156 -1.076 7.218 4.873 1.00 0.14 C ATOM 2237 CD1 PHE A 156 -0.381 6.420 3.978 1.00 0.23 C ATOM 2238 CD2 PHE A 156 -1.474 8.481 4.464 1.00 0.24 C ATOM 2239 CE1 PHE A 156 -0.088 6.874 2.707 1.00 0.27 C ATOM 2240 CE2 PHE A 156 -1.184 8.937 3.194 1.00 0.30 C ATOM 2241 CZ PHE A 156 -0.502 8.149 2.317 1.00 0.26 C ATOM 0 H PHE A 156 -3.406 7.695 5.243 1.00 0.14 H new ATOM 0 HA PHE A 156 -2.775 5.103 5.944 1.00 0.11 H new ATOM 0 HB2 PHE A 156 -1.306 7.549 6.958 1.00 0.11 H new ATOM 0 HB3 PHE A 156 -0.635 5.984 6.544 1.00 0.11 H new ATOM 0 HD1 PHE A 156 -0.065 5.432 4.278 1.00 0.23 H new ATOM 0 HD2 PHE A 156 -2.018 9.116 5.148 1.00 0.24 H new ATOM 0 HE1 PHE A 156 0.458 6.246 2.019 1.00 0.27 H new ATOM 0 HE2 PHE A 156 -1.500 9.925 2.894 1.00 0.30 H new ATOM 0 HZ PHE A 156 -0.282 8.509 1.323 1.00 0.26 H new ATOM 2251 N CYS A 157 -3.378 4.751 8.372 1.00 0.17 N ATOM 2252 CA CYS A 157 -3.757 4.537 9.775 1.00 0.24 C ATOM 2253 C CYS A 157 -2.691 5.054 10.743 1.00 0.37 C ATOM 2254 O CYS A 157 -2.972 5.308 11.913 1.00 0.81 O ATOM 2255 CB CYS A 157 -3.990 3.051 10.063 1.00 0.28 C ATOM 2256 SG CYS A 157 -5.110 2.199 8.911 1.00 0.31 S ATOM 0 H CYS A 157 -3.371 3.904 7.804 1.00 0.17 H new ATOM 0 HA CYS A 157 -4.680 5.096 9.929 1.00 0.24 H new ATOM 0 HB2 CYS A 157 -3.027 2.541 10.051 1.00 0.28 H new ATOM 0 HB3 CYS A 157 -4.390 2.952 11.072 1.00 0.28 H new ATOM 2261 N ASP A 158 -1.469 5.198 10.257 1.00 0.42 N ATOM 2262 CA ASP A 158 -0.359 5.632 11.096 1.00 0.51 C ATOM 2263 C ASP A 158 -0.080 7.124 10.916 1.00 0.40 C ATOM 2264 O ASP A 158 0.458 7.773 11.810 1.00 0.53 O ATOM 2265 CB ASP A 158 0.890 4.815 10.752 1.00 0.71 C ATOM 2266 CG ASP A 158 2.108 5.211 11.564 1.00 1.00 C ATOM 2267 OD1 ASP A 158 2.213 4.788 12.732 1.00 1.24 O ATOM 2268 OD2 ASP A 158 2.981 5.921 11.027 1.00 1.43 O ATOM 0 H ASP A 158 -1.218 5.021 9.284 1.00 0.42 H new ATOM 0 HA ASP A 158 -0.628 5.467 12.139 1.00 0.51 H new ATOM 0 HB2 ASP A 158 0.681 3.758 10.916 1.00 0.71 H new ATOM 0 HB3 ASP A 158 1.114 4.935 9.692 1.00 0.71 H new ATOM 2273 N GLU A 159 -0.484 7.670 9.776 1.00 0.31 N ATOM 2274 CA GLU A 159 -0.082 9.013 9.387 1.00 0.41 C ATOM 2275 C GLU A 159 -1.257 9.994 9.412 1.00 0.55 C ATOM 2276 O GLU A 159 -1.066 11.194 9.615 1.00 0.98 O ATOM 2277 CB GLU A 159 0.502 8.967 7.976 1.00 0.49 C ATOM 2278 CG GLU A 159 1.481 7.823 7.748 1.00 0.49 C ATOM 2279 CD GLU A 159 2.831 8.020 8.415 1.00 0.57 C ATOM 2280 OE1 GLU A 159 3.782 7.272 8.105 1.00 0.83 O ATOM 2281 OE2 GLU A 159 2.939 8.922 9.279 1.00 0.95 O ATOM 0 H GLU A 159 -1.091 7.201 9.104 1.00 0.31 H new ATOM 0 HA GLU A 159 0.660 9.363 10.105 1.00 0.41 H new ATOM 0 HB2 GLU A 159 -0.314 8.882 7.259 1.00 0.49 H new ATOM 0 HB3 GLU A 159 1.008 9.911 7.772 1.00 0.49 H new ATOM 0 HG2 GLU A 159 1.036 6.899 8.118 1.00 0.49 H new ATOM 0 HG3 GLU A 159 1.632 7.697 6.676 1.00 0.49 H new ATOM 2288 N GLY A 160 -2.466 9.490 9.196 1.00 0.40 N ATOM 2289 CA GLY A 160 -3.611 10.371 9.052 1.00 0.49 C ATOM 2290 C GLY A 160 -4.915 9.765 9.538 1.00 0.53 C ATOM 2291 O GLY A 160 -5.679 10.412 10.256 1.00 0.75 O ATOM 0 H GLY A 160 -2.674 8.494 9.118 1.00 0.40 H new ATOM 0 HA2 GLY A 160 -3.421 11.292 9.604 1.00 0.49 H new ATOM 0 HA3 GLY A 160 -3.717 10.645 8.002 1.00 0.49 H new ATOM 2295 N GLY A 161 -5.178 8.531 9.133 1.00 0.39 N ATOM 2296 CA GLY A 161 -6.420 7.876 9.492 1.00 0.53 C ATOM 2297 C GLY A 161 -6.560 7.657 10.984 1.00 0.67 C ATOM 2298 O GLY A 161 -7.699 7.684 11.485 1.00 1.29 O ATOM 2299 OXT GLY A 161 -5.532 7.454 11.665 1.00 1.35 O ATOM 0 H GLY A 161 -4.550 7.969 8.559 1.00 0.39 H new ATOM 0 HA2 GLY A 161 -7.258 8.477 9.138 1.00 0.53 H new ATOM 0 HA3 GLY A 161 -6.479 6.915 8.982 1.00 0.53 H new TER 2303 GLY A 161