USER MOD reduce.3.24.130724 H: found=0, std=0, add=775, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 771 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 9 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot -98:sc= 0.268 USER MOD Single : A 6 SER OG : rot -27:sc= 0.95 USER MOD Single : A 8 ASN : amide:sc= -0.504 K(o=-0.5,f=-5!) USER MOD Single : A 14 ASN : amide:sc= -0.387 K(o=-0.39,f=-4.4!) USER MOD Single : A 27 CYS SG : rot 90:sc= -5.01! USER MOD Single : A 28 SER OG : rot 66:sc= 0.016 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= -3.38! C(o=-3.4!,f=-5.8!) USER MOD Single : A 46 MET CE :methyl 154:sc= 0 (180deg=-0.216) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 GLN : amide:sc= -0.176 K(o=-0.18,f=-1.1) USER MOD Single : A 56 SER OG : rot 22:sc= 0.279 USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 GLN : amide:sc= -0.0629 K(o=-0.063,f=-1.4) USER MOD Single : A 66 SER OG : rot -160:sc= -1.87 USER MOD Single : A 67 GLN : amide:sc= -2.09! K(o=-2.1!,f=-1.1) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 159:sc= -0.0308 (180deg=-0.116) USER MOD Single : A 77 HIS : no HD1:sc= -2.4 X(o=-2.4,f=-2.5!) USER MOD Single : A 78 LYS NZ :NH3+ -146:sc= 0.165 (180deg=0.0138) USER MOD Single : A 83 HIS : no HD1:sc= -0.753 X(o=-0.75,f=-1.2) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 145:sc= -0.0214 (180deg=-1.59) USER MOD Single : A 91 SER OG : rot 180:sc= -0.129 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot -64:sc= 1.21 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -0.648 27.285 7.400 1.00 0.00 N ATOM 2 CA GLY A 1 -0.325 25.913 7.742 1.00 0.00 C ATOM 3 C GLY A 1 -0.491 25.629 9.222 1.00 0.00 C ATOM 4 O GLY A 1 0.459 25.229 9.895 1.00 0.00 O ATOM 0 H1 GLY A 1 -0.519 27.428 6.378 1.00 0.00 H new ATOM 0 H2 GLY A 1 -1.637 27.483 7.655 1.00 0.00 H new ATOM 0 H3 GLY A 1 -0.021 27.930 7.922 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.965 25.240 7.172 1.00 0.00 H new ATOM 0 HA3 GLY A 1 0.703 25.701 7.448 1.00 0.00 H new ATOM 8 N SER A 2 -1.701 25.837 9.730 1.00 0.00 N ATOM 9 CA SER A 2 -1.988 25.607 11.142 1.00 0.00 C ATOM 10 C SER A 2 -3.448 25.213 11.342 1.00 0.00 C ATOM 11 O SER A 2 -4.288 25.438 10.471 1.00 0.00 O ATOM 12 CB SER A 2 -1.668 26.859 11.960 1.00 0.00 C ATOM 13 OG SER A 2 -1.017 26.523 13.172 1.00 0.00 O ATOM 0 H SER A 2 -2.499 26.164 9.185 1.00 0.00 H new ATOM 0 HA SER A 2 -1.358 24.787 11.487 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.034 27.527 11.376 1.00 0.00 H new ATOM 0 HB3 SER A 2 -2.589 27.401 12.176 1.00 0.00 H new ATOM 0 HG SER A 2 -0.822 27.340 13.676 1.00 0.00 H new ATOM 19 N SER A 3 -3.742 24.623 12.496 1.00 0.00 N ATOM 20 CA SER A 3 -5.099 24.194 12.811 1.00 0.00 C ATOM 21 C SER A 3 -6.110 25.278 12.447 1.00 0.00 C ATOM 22 O SER A 3 -7.098 25.015 11.763 1.00 0.00 O ATOM 23 CB SER A 3 -5.217 23.851 14.298 1.00 0.00 C ATOM 24 OG SER A 3 -5.700 22.531 14.480 1.00 0.00 O ATOM 0 H SER A 3 -3.058 24.431 13.228 1.00 0.00 H new ATOM 0 HA SER A 3 -5.317 23.304 12.221 1.00 0.00 H new ATOM 0 HB2 SER A 3 -4.243 23.955 14.777 1.00 0.00 H new ATOM 0 HB3 SER A 3 -5.889 24.558 14.785 1.00 0.00 H new ATOM 0 HG SER A 3 -5.765 22.336 15.438 1.00 0.00 H new ATOM 30 N GLY A 4 -5.854 26.497 12.911 1.00 0.00 N ATOM 31 CA GLY A 4 -6.751 27.602 12.625 1.00 0.00 C ATOM 32 C GLY A 4 -6.342 28.373 11.385 1.00 0.00 C ATOM 33 O GLY A 4 -5.612 29.361 11.473 1.00 0.00 O ATOM 0 H GLY A 4 -5.042 26.739 13.479 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.763 27.220 12.494 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -6.773 28.279 13.479 1.00 0.00 H new ATOM 37 N SER A 5 -6.812 27.921 10.227 1.00 0.00 N ATOM 38 CA SER A 5 -6.486 28.571 8.964 1.00 0.00 C ATOM 39 C SER A 5 -7.708 28.623 8.049 1.00 0.00 C ATOM 40 O SER A 5 -8.090 29.688 7.565 1.00 0.00 O ATOM 41 CB SER A 5 -5.343 27.833 8.265 1.00 0.00 C ATOM 42 OG SER A 5 -5.676 26.475 8.037 1.00 0.00 O ATOM 0 H SER A 5 -7.420 27.107 10.138 1.00 0.00 H new ATOM 0 HA SER A 5 -6.171 29.592 9.180 1.00 0.00 H new ATOM 0 HB2 SER A 5 -5.118 28.320 7.316 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.441 27.892 8.875 1.00 0.00 H new ATOM 0 HG SER A 5 -5.287 25.920 8.745 1.00 0.00 H new ATOM 48 N SER A 6 -8.314 27.464 7.816 1.00 0.00 N ATOM 49 CA SER A 6 -9.489 27.375 6.958 1.00 0.00 C ATOM 50 C SER A 6 -9.208 27.986 5.588 1.00 0.00 C ATOM 51 O SER A 6 -8.110 28.474 5.328 1.00 0.00 O ATOM 52 CB SER A 6 -10.679 28.081 7.610 1.00 0.00 C ATOM 53 OG SER A 6 -10.586 29.487 7.453 1.00 0.00 O ATOM 0 H SER A 6 -8.011 26.573 8.209 1.00 0.00 H new ATOM 0 HA SER A 6 -9.731 26.321 6.824 1.00 0.00 H new ATOM 0 HB2 SER A 6 -11.607 27.723 7.165 1.00 0.00 H new ATOM 0 HB3 SER A 6 -10.717 27.832 8.670 1.00 0.00 H new ATOM 0 HG SER A 6 -9.645 29.744 7.362 1.00 0.00 H new ATOM 59 N GLY A 7 -10.212 27.955 4.717 1.00 0.00 N ATOM 60 CA GLY A 7 -10.054 28.510 3.385 1.00 0.00 C ATOM 61 C GLY A 7 -10.368 27.501 2.297 1.00 0.00 C ATOM 62 O GLY A 7 -11.365 26.785 2.375 1.00 0.00 O ATOM 0 H GLY A 7 -11.131 27.556 4.909 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -10.708 29.375 3.275 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -9.031 28.867 3.262 1.00 0.00 H new ATOM 66 N ASN A 8 -9.515 27.447 1.280 1.00 0.00 N ATOM 67 CA ASN A 8 -9.707 26.519 0.169 1.00 0.00 C ATOM 68 C ASN A 8 -8.366 26.052 -0.387 1.00 0.00 C ATOM 69 O ASN A 8 -7.340 26.703 -0.191 1.00 0.00 O ATOM 70 CB ASN A 8 -10.528 27.182 -0.939 1.00 0.00 C ATOM 71 CG ASN A 8 -11.248 26.170 -1.808 1.00 0.00 C ATOM 72 OD1 ASN A 8 -10.619 25.344 -2.470 1.00 0.00 O ATOM 73 ND2 ASN A 8 -12.575 26.229 -1.811 1.00 0.00 N ATOM 0 H ASN A 8 -8.684 28.034 1.201 1.00 0.00 H new ATOM 0 HA ASN A 8 -10.248 25.650 0.543 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -11.257 27.858 -0.492 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -9.870 27.789 -1.561 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -13.113 25.573 -2.377 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -13.056 26.930 -1.247 1.00 0.00 H new ATOM 80 N SER A 9 -8.383 24.919 -1.083 1.00 0.00 N ATOM 81 CA SER A 9 -7.168 24.362 -1.666 1.00 0.00 C ATOM 82 C SER A 9 -7.499 23.447 -2.840 1.00 0.00 C ATOM 83 O SER A 9 -8.478 22.699 -2.822 1.00 0.00 O ATOM 84 CB SER A 9 -6.379 23.587 -0.608 1.00 0.00 C ATOM 85 OG SER A 9 -5.753 22.448 -1.172 1.00 0.00 O ATOM 0 H SER A 9 -9.225 24.369 -1.257 1.00 0.00 H new ATOM 0 HA SER A 9 -6.558 25.188 -2.032 1.00 0.00 H new ATOM 0 HB2 SER A 9 -5.626 24.237 -0.163 1.00 0.00 H new ATOM 0 HB3 SER A 9 -7.048 23.278 0.195 1.00 0.00 H new ATOM 0 HG SER A 9 -5.254 21.971 -0.476 1.00 0.00 H new ATOM 91 N PRO A 10 -6.665 23.506 -3.889 1.00 0.00 N ATOM 92 CA PRO A 10 -6.848 22.691 -5.093 1.00 0.00 C ATOM 93 C PRO A 10 -6.578 21.211 -4.837 1.00 0.00 C ATOM 94 O PRO A 10 -7.392 20.354 -5.180 1.00 0.00 O ATOM 95 CB PRO A 10 -5.816 23.261 -6.068 1.00 0.00 C ATOM 96 CG PRO A 10 -4.766 23.861 -5.199 1.00 0.00 C ATOM 97 CD PRO A 10 -5.479 24.375 -3.980 1.00 0.00 C ATOM 0 HA PRO A 10 -7.873 22.734 -5.462 1.00 0.00 H new ATOM 0 HB2 PRO A 10 -5.403 22.481 -6.708 1.00 0.00 H new ATOM 0 HB3 PRO A 10 -6.262 24.009 -6.724 1.00 0.00 H new ATOM 0 HG2 PRO A 10 -4.014 23.120 -4.927 1.00 0.00 H new ATOM 0 HG3 PRO A 10 -4.246 24.668 -5.716 1.00 0.00 H new ATOM 0 HD2 PRO A 10 -4.856 24.300 -3.088 1.00 0.00 H new ATOM 0 HD3 PRO A 10 -5.756 25.424 -4.088 1.00 0.00 H new ATOM 105 N ASP A 11 -5.431 20.920 -4.233 1.00 0.00 N ATOM 106 CA ASP A 11 -5.055 19.544 -3.930 1.00 0.00 C ATOM 107 C ASP A 11 -3.582 19.457 -3.542 1.00 0.00 C ATOM 108 O ASP A 11 -2.719 19.214 -4.386 1.00 0.00 O ATOM 109 CB ASP A 11 -5.332 18.640 -5.133 1.00 0.00 C ATOM 110 CG ASP A 11 -4.992 19.309 -6.450 1.00 0.00 C ATOM 111 OD1 ASP A 11 -3.829 19.194 -6.890 1.00 0.00 O ATOM 112 OD2 ASP A 11 -5.889 19.947 -7.041 1.00 0.00 O ATOM 0 H ASP A 11 -4.746 21.618 -3.944 1.00 0.00 H new ATOM 0 HA ASP A 11 -5.656 19.206 -3.086 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -4.753 17.722 -5.035 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -6.384 18.354 -5.135 1.00 0.00 H new ATOM 117 N THR A 12 -3.302 19.657 -2.258 1.00 0.00 N ATOM 118 CA THR A 12 -1.934 19.604 -1.756 1.00 0.00 C ATOM 119 C THR A 12 -1.852 18.793 -0.468 1.00 0.00 C ATOM 120 O THR A 12 -1.054 19.098 0.418 1.00 0.00 O ATOM 121 CB THR A 12 -1.374 21.015 -1.499 1.00 0.00 C ATOM 122 OG1 THR A 12 -2.147 21.671 -0.487 1.00 0.00 O ATOM 123 CG2 THR A 12 -1.390 21.845 -2.773 1.00 0.00 C ATOM 0 H THR A 12 -4.005 19.857 -1.546 1.00 0.00 H new ATOM 0 HA THR A 12 -1.334 19.119 -2.526 1.00 0.00 H new ATOM 0 HB THR A 12 -0.342 20.916 -1.162 1.00 0.00 H new ATOM 0 HG1 THR A 12 -1.784 22.567 -0.328 1.00 0.00 H new ATOM 0 HG21 THR A 12 -0.990 22.837 -2.566 1.00 0.00 H new ATOM 0 HG22 THR A 12 -0.778 21.358 -3.532 1.00 0.00 H new ATOM 0 HG23 THR A 12 -2.414 21.935 -3.136 1.00 0.00 H new ATOM 131 N ALA A 13 -2.680 17.759 -0.371 1.00 0.00 N ATOM 132 CA ALA A 13 -2.698 16.903 0.808 1.00 0.00 C ATOM 133 C ALA A 13 -2.932 15.445 0.425 1.00 0.00 C ATOM 134 O ALA A 13 -3.131 15.126 -0.746 1.00 0.00 O ATOM 135 CB ALA A 13 -3.768 17.372 1.785 1.00 0.00 C ATOM 0 H ALA A 13 -3.348 17.494 -1.095 1.00 0.00 H new ATOM 0 HA ALA A 13 -1.724 16.973 1.292 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -3.770 16.723 2.661 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -3.556 18.396 2.092 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -4.744 17.333 1.302 1.00 0.00 H new ATOM 141 N ASN A 14 -2.904 14.565 1.421 1.00 0.00 N ATOM 142 CA ASN A 14 -3.111 13.141 1.188 1.00 0.00 C ATOM 143 C ASN A 14 -2.172 12.626 0.100 1.00 0.00 C ATOM 144 O ASN A 14 -2.507 12.649 -1.085 1.00 0.00 O ATOM 145 CB ASN A 14 -4.565 12.874 0.791 1.00 0.00 C ATOM 146 CG ASN A 14 -5.552 13.509 1.751 1.00 0.00 C ATOM 147 OD1 ASN A 14 -5.552 14.726 1.942 1.00 0.00 O ATOM 148 ND2 ASN A 14 -6.400 12.688 2.358 1.00 0.00 N ATOM 0 H ASN A 14 -2.740 14.813 2.397 1.00 0.00 H new ATOM 0 HA ASN A 14 -2.891 12.610 2.114 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -4.741 13.258 -0.214 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -4.737 11.798 0.756 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -7.088 13.059 3.013 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -6.364 11.686 2.169 1.00 0.00 H new ATOM 155 N ASP A 15 -0.999 12.160 0.512 1.00 0.00 N ATOM 156 CA ASP A 15 -0.012 11.637 -0.427 1.00 0.00 C ATOM 157 C ASP A 15 -0.284 10.168 -0.738 1.00 0.00 C ATOM 158 O ASP A 15 -0.036 9.703 -1.850 1.00 0.00 O ATOM 159 CB ASP A 15 1.398 11.799 0.141 1.00 0.00 C ATOM 160 CG ASP A 15 1.528 11.228 1.540 1.00 0.00 C ATOM 161 OD1 ASP A 15 1.015 10.115 1.776 1.00 0.00 O ATOM 162 OD2 ASP A 15 2.141 11.897 2.399 1.00 0.00 O ATOM 0 H ASP A 15 -0.708 12.133 1.489 1.00 0.00 H new ATOM 0 HA ASP A 15 -0.089 12.206 -1.353 1.00 0.00 H new ATOM 0 HB2 ASP A 15 2.111 11.304 -0.518 1.00 0.00 H new ATOM 0 HB3 ASP A 15 1.661 12.857 0.158 1.00 0.00 H new ATOM 167 N GLY A 16 -0.794 9.442 0.252 1.00 0.00 N ATOM 168 CA GLY A 16 -1.088 8.034 0.064 1.00 0.00 C ATOM 169 C GLY A 16 -0.018 7.134 0.647 1.00 0.00 C ATOM 170 O GLY A 16 0.360 6.132 0.040 1.00 0.00 O ATOM 0 H GLY A 16 -1.009 9.804 1.181 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.046 7.801 0.528 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -1.191 7.827 -1.001 1.00 0.00 H new ATOM 174 N PHE A 17 0.475 7.493 1.829 1.00 0.00 N ATOM 175 CA PHE A 17 1.511 6.712 2.494 1.00 0.00 C ATOM 176 C PHE A 17 0.902 5.544 3.264 1.00 0.00 C ATOM 177 O PHE A 17 -0.257 5.595 3.678 1.00 0.00 O ATOM 178 CB PHE A 17 2.318 7.599 3.444 1.00 0.00 C ATOM 179 CG PHE A 17 3.738 7.812 3.005 1.00 0.00 C ATOM 180 CD1 PHE A 17 4.675 6.799 3.129 1.00 0.00 C ATOM 181 CD2 PHE A 17 4.136 9.026 2.469 1.00 0.00 C ATOM 182 CE1 PHE A 17 5.982 6.991 2.726 1.00 0.00 C ATOM 183 CE2 PHE A 17 5.442 9.225 2.063 1.00 0.00 C ATOM 184 CZ PHE A 17 6.367 8.206 2.192 1.00 0.00 C ATOM 0 H PHE A 17 0.173 8.320 2.345 1.00 0.00 H new ATOM 0 HA PHE A 17 2.176 6.312 1.729 1.00 0.00 H new ATOM 0 HB2 PHE A 17 1.824 8.567 3.532 1.00 0.00 H new ATOM 0 HB3 PHE A 17 2.317 7.149 4.437 1.00 0.00 H new ATOM 0 HD1 PHE A 17 4.380 5.847 3.546 1.00 0.00 H new ATOM 0 HD2 PHE A 17 3.418 9.826 2.367 1.00 0.00 H new ATOM 0 HE1 PHE A 17 6.702 6.193 2.828 1.00 0.00 H new ATOM 0 HE2 PHE A 17 5.739 10.176 1.645 1.00 0.00 H new ATOM 0 HZ PHE A 17 7.388 8.359 1.876 1.00 0.00 H new ATOM 194 N VAL A 18 1.691 4.490 3.453 1.00 0.00 N ATOM 195 CA VAL A 18 1.231 3.309 4.173 1.00 0.00 C ATOM 196 C VAL A 18 2.365 2.676 4.971 1.00 0.00 C ATOM 197 O VAL A 18 3.538 2.821 4.626 1.00 0.00 O ATOM 198 CB VAL A 18 0.644 2.258 3.212 1.00 0.00 C ATOM 199 CG1 VAL A 18 -0.632 2.778 2.567 1.00 0.00 C ATOM 200 CG2 VAL A 18 1.668 1.875 2.155 1.00 0.00 C ATOM 0 H VAL A 18 2.652 4.431 3.117 1.00 0.00 H new ATOM 0 HA VAL A 18 0.450 3.640 4.857 1.00 0.00 H new ATOM 0 HB VAL A 18 0.394 1.365 3.785 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.032 2.022 1.891 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -1.367 2.999 3.341 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.412 3.686 2.006 1.00 0.00 H new ATOM 0 HG21 VAL A 18 1.238 1.132 1.484 1.00 0.00 H new ATOM 0 HG22 VAL A 18 1.950 2.760 1.584 1.00 0.00 H new ATOM 0 HG23 VAL A 18 2.552 1.459 2.639 1.00 0.00 H new ATOM 210 N ARG A 19 2.008 1.973 6.040 1.00 0.00 N ATOM 211 CA ARG A 19 2.996 1.316 6.889 1.00 0.00 C ATOM 212 C ARG A 19 2.770 -0.193 6.919 1.00 0.00 C ATOM 213 O ARG A 19 1.641 -0.660 7.072 1.00 0.00 O ATOM 214 CB ARG A 19 2.935 1.881 8.309 1.00 0.00 C ATOM 215 CG ARG A 19 3.910 1.219 9.269 1.00 0.00 C ATOM 216 CD ARG A 19 3.317 1.091 10.664 1.00 0.00 C ATOM 217 NE ARG A 19 4.336 1.207 11.705 1.00 0.00 N ATOM 218 CZ ARG A 19 4.780 2.368 12.172 1.00 0.00 C ATOM 219 NH1 ARG A 19 4.298 3.507 11.694 1.00 0.00 N ATOM 220 NH2 ARG A 19 5.709 2.392 13.119 1.00 0.00 N ATOM 0 H ARG A 19 1.042 1.843 6.340 1.00 0.00 H new ATOM 0 HA ARG A 19 3.984 1.509 6.471 1.00 0.00 H new ATOM 0 HB2 ARG A 19 3.141 2.951 8.275 1.00 0.00 H new ATOM 0 HB3 ARG A 19 1.922 1.764 8.695 1.00 0.00 H new ATOM 0 HG2 ARG A 19 4.178 0.231 8.894 1.00 0.00 H new ATOM 0 HG3 ARG A 19 4.830 1.802 9.315 1.00 0.00 H new ATOM 0 HD2 ARG A 19 2.561 1.863 10.809 1.00 0.00 H new ATOM 0 HD3 ARG A 19 2.812 0.129 10.756 1.00 0.00 H new ATOM 0 HE ARG A 19 4.728 0.349 12.094 1.00 0.00 H new ATOM 0 HH11 ARG A 19 3.584 3.493 10.966 1.00 0.00 H new ATOM 0 HH12 ARG A 19 4.641 4.397 12.055 1.00 0.00 H new ATOM 0 HH21 ARG A 19 6.083 1.518 13.489 1.00 0.00 H new ATOM 0 HH22 ARG A 19 6.049 3.284 13.477 1.00 0.00 H new ATOM 234 N LEU A 20 3.852 -0.949 6.772 1.00 0.00 N ATOM 235 CA LEU A 20 3.773 -2.407 6.781 1.00 0.00 C ATOM 236 C LEU A 20 4.369 -2.975 8.065 1.00 0.00 C ATOM 237 O LEU A 20 5.347 -2.447 8.595 1.00 0.00 O ATOM 238 CB LEU A 20 4.502 -2.985 5.567 1.00 0.00 C ATOM 239 CG LEU A 20 4.409 -2.168 4.278 1.00 0.00 C ATOM 240 CD1 LEU A 20 5.085 -2.904 3.131 1.00 0.00 C ATOM 241 CD2 LEU A 20 2.956 -1.869 3.939 1.00 0.00 C ATOM 0 H LEU A 20 4.794 -0.578 6.645 1.00 0.00 H new ATOM 0 HA LEU A 20 2.722 -2.690 6.733 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.555 -3.104 5.823 1.00 0.00 H new ATOM 0 HB3 LEU A 20 4.107 -3.982 5.371 1.00 0.00 H new ATOM 0 HG LEU A 20 4.927 -1.221 4.432 1.00 0.00 H new ATOM 0 HD11 LEU A 20 5.009 -2.308 2.221 1.00 0.00 H new ATOM 0 HD12 LEU A 20 6.136 -3.067 3.372 1.00 0.00 H new ATOM 0 HD13 LEU A 20 4.595 -3.865 2.977 1.00 0.00 H new ATOM 0 HD21 LEU A 20 2.909 -1.287 3.019 1.00 0.00 H new ATOM 0 HD22 LEU A 20 2.414 -2.805 3.804 1.00 0.00 H new ATOM 0 HD23 LEU A 20 2.502 -1.301 4.751 1.00 0.00 H new ATOM 253 N ARG A 21 3.775 -4.057 8.559 1.00 0.00 N ATOM 254 CA ARG A 21 4.248 -4.697 9.780 1.00 0.00 C ATOM 255 C ARG A 21 4.185 -6.217 9.655 1.00 0.00 C ATOM 256 O ARG A 21 3.133 -6.784 9.366 1.00 0.00 O ATOM 257 CB ARG A 21 3.415 -4.239 10.979 1.00 0.00 C ATOM 258 CG ARG A 21 4.169 -3.326 11.931 1.00 0.00 C ATOM 259 CD ARG A 21 3.526 -3.304 13.308 1.00 0.00 C ATOM 260 NE ARG A 21 4.032 -4.372 14.166 1.00 0.00 N ATOM 261 CZ ARG A 21 5.226 -4.344 14.748 1.00 0.00 C ATOM 262 NH1 ARG A 21 6.031 -3.307 14.566 1.00 0.00 N ATOM 263 NH2 ARG A 21 5.615 -5.355 15.514 1.00 0.00 N ATOM 0 H ARG A 21 2.966 -4.508 8.132 1.00 0.00 H new ATOM 0 HA ARG A 21 5.286 -4.403 9.935 1.00 0.00 H new ATOM 0 HB2 ARG A 21 2.528 -3.719 10.617 1.00 0.00 H new ATOM 0 HB3 ARG A 21 3.070 -5.116 11.527 1.00 0.00 H new ATOM 0 HG2 ARG A 21 5.203 -3.661 12.016 1.00 0.00 H new ATOM 0 HG3 ARG A 21 4.194 -2.315 11.524 1.00 0.00 H new ATOM 0 HD2 ARG A 21 3.714 -2.340 13.780 1.00 0.00 H new ATOM 0 HD3 ARG A 21 2.445 -3.403 13.205 1.00 0.00 H new ATOM 0 HE ARG A 21 3.436 -5.184 14.327 1.00 0.00 H new ATOM 0 HH11 ARG A 21 5.734 -2.528 13.978 1.00 0.00 H new ATOM 0 HH12 ARG A 21 6.947 -3.288 15.014 1.00 0.00 H new ATOM 0 HH21 ARG A 21 4.997 -6.154 15.656 1.00 0.00 H new ATOM 0 HH22 ARG A 21 6.532 -5.333 15.961 1.00 0.00 H new ATOM 277 N GLY A 22 5.322 -6.871 9.875 1.00 0.00 N ATOM 278 CA GLY A 22 5.375 -8.319 9.782 1.00 0.00 C ATOM 279 C GLY A 22 5.977 -8.794 8.475 1.00 0.00 C ATOM 280 O GLY A 22 5.569 -9.822 7.932 1.00 0.00 O ATOM 0 H GLY A 22 6.207 -6.424 10.116 1.00 0.00 H new ATOM 0 HA2 GLY A 22 5.961 -8.712 10.613 1.00 0.00 H new ATOM 0 HA3 GLY A 22 4.368 -8.724 9.883 1.00 0.00 H new ATOM 284 N LEU A 23 6.950 -8.045 7.967 1.00 0.00 N ATOM 285 CA LEU A 23 7.609 -8.394 6.713 1.00 0.00 C ATOM 286 C LEU A 23 8.394 -9.694 6.854 1.00 0.00 C ATOM 287 O LEU A 23 8.932 -10.011 7.915 1.00 0.00 O ATOM 288 CB LEU A 23 8.543 -7.265 6.273 1.00 0.00 C ATOM 289 CG LEU A 23 7.876 -5.925 5.962 1.00 0.00 C ATOM 290 CD1 LEU A 23 8.918 -4.890 5.566 1.00 0.00 C ATOM 291 CD2 LEU A 23 6.838 -6.088 4.863 1.00 0.00 C ATOM 0 H LEU A 23 7.300 -7.192 8.404 1.00 0.00 H new ATOM 0 HA LEU A 23 6.840 -8.537 5.954 1.00 0.00 H new ATOM 0 HB2 LEU A 23 9.283 -7.106 7.057 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.084 -7.593 5.386 1.00 0.00 H new ATOM 0 HG LEU A 23 7.370 -5.575 6.862 1.00 0.00 H new ATOM 0 HD11 LEU A 23 8.425 -3.942 5.348 1.00 0.00 H new ATOM 0 HD12 LEU A 23 9.624 -4.752 6.385 1.00 0.00 H new ATOM 0 HD13 LEU A 23 9.453 -5.233 4.680 1.00 0.00 H new ATOM 0 HD21 LEU A 23 6.374 -5.124 4.655 1.00 0.00 H new ATOM 0 HD22 LEU A 23 7.320 -6.461 3.959 1.00 0.00 H new ATOM 0 HD23 LEU A 23 6.075 -6.796 5.186 1.00 0.00 H new ATOM 303 N PRO A 24 8.464 -10.465 5.760 1.00 0.00 N ATOM 304 CA PRO A 24 9.184 -11.743 5.735 1.00 0.00 C ATOM 305 C PRO A 24 10.696 -11.558 5.821 1.00 0.00 C ATOM 306 O PRO A 24 11.203 -10.444 5.682 1.00 0.00 O ATOM 307 CB PRO A 24 8.795 -12.344 4.382 1.00 0.00 C ATOM 308 CG PRO A 24 8.447 -11.171 3.532 1.00 0.00 C ATOM 309 CD PRO A 24 7.846 -10.150 4.460 1.00 0.00 C ATOM 0 HA PRO A 24 8.926 -12.373 6.586 1.00 0.00 H new ATOM 0 HB2 PRO A 24 9.618 -12.915 3.951 1.00 0.00 H new ATOM 0 HB3 PRO A 24 7.951 -13.026 4.480 1.00 0.00 H new ATOM 0 HG2 PRO A 24 9.332 -10.773 3.035 1.00 0.00 H new ATOM 0 HG3 PRO A 24 7.741 -11.451 2.750 1.00 0.00 H new ATOM 0 HD2 PRO A 24 8.076 -9.133 4.142 1.00 0.00 H new ATOM 0 HD3 PRO A 24 6.760 -10.234 4.500 1.00 0.00 H new ATOM 317 N PHE A 25 11.408 -12.655 6.050 1.00 0.00 N ATOM 318 CA PHE A 25 12.863 -12.613 6.155 1.00 0.00 C ATOM 319 C PHE A 25 13.490 -12.169 4.836 1.00 0.00 C ATOM 320 O PHE A 25 13.375 -12.852 3.820 1.00 0.00 O ATOM 321 CB PHE A 25 13.406 -13.986 6.554 1.00 0.00 C ATOM 322 CG PHE A 25 14.375 -13.937 7.700 1.00 0.00 C ATOM 323 CD1 PHE A 25 13.976 -13.473 8.943 1.00 0.00 C ATOM 324 CD2 PHE A 25 15.686 -14.354 7.535 1.00 0.00 C ATOM 325 CE1 PHE A 25 14.866 -13.427 10.000 1.00 0.00 C ATOM 326 CE2 PHE A 25 16.581 -14.310 8.588 1.00 0.00 C ATOM 327 CZ PHE A 25 16.170 -13.846 9.822 1.00 0.00 C ATOM 0 H PHE A 25 11.003 -13.584 6.167 1.00 0.00 H new ATOM 0 HA PHE A 25 13.127 -11.888 6.925 1.00 0.00 H new ATOM 0 HB2 PHE A 25 12.572 -14.634 6.822 1.00 0.00 H new ATOM 0 HB3 PHE A 25 13.897 -14.438 5.692 1.00 0.00 H new ATOM 0 HD1 PHE A 25 12.958 -13.143 9.088 1.00 0.00 H new ATOM 0 HD2 PHE A 25 16.013 -14.718 6.572 1.00 0.00 H new ATOM 0 HE1 PHE A 25 14.542 -13.064 10.964 1.00 0.00 H new ATOM 0 HE2 PHE A 25 17.600 -14.638 8.446 1.00 0.00 H new ATOM 0 HZ PHE A 25 16.867 -13.811 10.646 1.00 0.00 H new ATOM 337 N GLY A 26 14.155 -11.018 4.863 1.00 0.00 N ATOM 338 CA GLY A 26 14.791 -10.501 3.665 1.00 0.00 C ATOM 339 C GLY A 26 13.832 -9.716 2.792 1.00 0.00 C ATOM 340 O GLY A 26 14.078 -9.531 1.599 1.00 0.00 O ATOM 0 H GLY A 26 14.265 -10.435 5.692 1.00 0.00 H new ATOM 0 HA2 GLY A 26 15.626 -9.861 3.948 1.00 0.00 H new ATOM 0 HA3 GLY A 26 15.205 -11.330 3.091 1.00 0.00 H new ATOM 344 N CYS A 27 12.736 -9.256 3.385 1.00 0.00 N ATOM 345 CA CYS A 27 11.735 -8.490 2.653 1.00 0.00 C ATOM 346 C CYS A 27 12.331 -7.195 2.110 1.00 0.00 C ATOM 347 O CYS A 27 12.969 -6.439 2.842 1.00 0.00 O ATOM 348 CB CYS A 27 10.541 -8.176 3.556 1.00 0.00 C ATOM 349 SG CYS A 27 9.252 -7.189 2.759 1.00 0.00 S ATOM 0 H CYS A 27 12.518 -9.400 4.371 1.00 0.00 H new ATOM 0 HA CYS A 27 11.396 -9.094 1.811 1.00 0.00 H new ATOM 0 HB2 CYS A 27 10.104 -9.113 3.902 1.00 0.00 H new ATOM 0 HB3 CYS A 27 10.897 -7.645 4.439 1.00 0.00 H new ATOM 0 HG CYS A 27 8.390 -7.979 2.190 1.00 0.00 H new ATOM 355 N SER A 28 12.122 -6.948 0.820 1.00 0.00 N ATOM 356 CA SER A 28 12.644 -5.747 0.178 1.00 0.00 C ATOM 357 C SER A 28 11.619 -5.158 -0.787 1.00 0.00 C ATOM 358 O SER A 28 10.514 -5.681 -0.932 1.00 0.00 O ATOM 359 CB SER A 28 13.940 -6.066 -0.570 1.00 0.00 C ATOM 360 OG SER A 28 14.914 -6.607 0.307 1.00 0.00 O ATOM 0 H SER A 28 11.595 -7.563 0.200 1.00 0.00 H new ATOM 0 HA SER A 28 12.852 -5.011 0.954 1.00 0.00 H new ATOM 0 HB2 SER A 28 13.735 -6.774 -1.373 1.00 0.00 H new ATOM 0 HB3 SER A 28 14.328 -5.160 -1.035 1.00 0.00 H new ATOM 0 HG SER A 28 14.608 -7.476 0.640 1.00 0.00 H new ATOM 366 N LYS A 29 11.994 -4.066 -1.444 1.00 0.00 N ATOM 367 CA LYS A 29 11.110 -3.405 -2.397 1.00 0.00 C ATOM 368 C LYS A 29 10.771 -4.332 -3.559 1.00 0.00 C ATOM 369 O LYS A 29 9.637 -4.355 -4.035 1.00 0.00 O ATOM 370 CB LYS A 29 11.762 -2.125 -2.925 1.00 0.00 C ATOM 371 CG LYS A 29 11.701 -0.963 -1.948 1.00 0.00 C ATOM 372 CD LYS A 29 12.940 -0.088 -2.044 1.00 0.00 C ATOM 373 CE LYS A 29 13.743 -0.117 -0.753 1.00 0.00 C ATOM 374 NZ LYS A 29 14.861 -1.098 -0.817 1.00 0.00 N ATOM 0 H LYS A 29 12.905 -3.620 -1.334 1.00 0.00 H new ATOM 0 HA LYS A 29 10.186 -3.148 -1.879 1.00 0.00 H new ATOM 0 HB2 LYS A 29 12.805 -2.331 -3.166 1.00 0.00 H new ATOM 0 HB3 LYS A 29 11.271 -1.834 -3.854 1.00 0.00 H new ATOM 0 HG2 LYS A 29 10.814 -0.363 -2.150 1.00 0.00 H new ATOM 0 HG3 LYS A 29 11.602 -1.345 -0.932 1.00 0.00 H new ATOM 0 HD2 LYS A 29 13.564 -0.429 -2.870 1.00 0.00 H new ATOM 0 HD3 LYS A 29 12.646 0.937 -2.268 1.00 0.00 H new ATOM 0 HE2 LYS A 29 14.143 0.877 -0.552 1.00 0.00 H new ATOM 0 HE3 LYS A 29 13.085 -0.370 0.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 15.384 -1.088 0.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 14.478 -2.050 -0.984 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 15.503 -0.842 -1.594 1.00 0.00 H new ATOM 388 N GLU A 30 11.761 -5.096 -4.010 1.00 0.00 N ATOM 389 CA GLU A 30 11.566 -6.025 -5.117 1.00 0.00 C ATOM 390 C GLU A 30 10.376 -6.943 -4.851 1.00 0.00 C ATOM 391 O GLU A 30 9.693 -7.373 -5.780 1.00 0.00 O ATOM 392 CB GLU A 30 12.829 -6.860 -5.340 1.00 0.00 C ATOM 393 CG GLU A 30 14.006 -6.054 -5.863 1.00 0.00 C ATOM 394 CD GLU A 30 14.307 -6.342 -7.322 1.00 0.00 C ATOM 395 OE1 GLU A 30 13.932 -7.431 -7.802 1.00 0.00 O ATOM 396 OE2 GLU A 30 14.917 -5.475 -7.983 1.00 0.00 O ATOM 0 H GLU A 30 12.706 -5.090 -3.626 1.00 0.00 H new ATOM 0 HA GLU A 30 11.361 -5.443 -6.016 1.00 0.00 H new ATOM 0 HB2 GLU A 30 13.112 -7.333 -4.400 1.00 0.00 H new ATOM 0 HB3 GLU A 30 12.606 -7.661 -6.045 1.00 0.00 H new ATOM 0 HG2 GLU A 30 13.797 -4.991 -5.742 1.00 0.00 H new ATOM 0 HG3 GLU A 30 14.889 -6.275 -5.263 1.00 0.00 H new ATOM 403 N GLU A 31 10.135 -7.238 -3.579 1.00 0.00 N ATOM 404 CA GLU A 31 9.029 -8.106 -3.191 1.00 0.00 C ATOM 405 C GLU A 31 7.761 -7.293 -2.945 1.00 0.00 C ATOM 406 O GLU A 31 6.651 -7.824 -3.004 1.00 0.00 O ATOM 407 CB GLU A 31 9.391 -8.901 -1.935 1.00 0.00 C ATOM 408 CG GLU A 31 10.144 -10.188 -2.226 1.00 0.00 C ATOM 409 CD GLU A 31 9.248 -11.276 -2.783 1.00 0.00 C ATOM 410 OE1 GLU A 31 8.535 -11.007 -3.772 1.00 0.00 O ATOM 411 OE2 GLU A 31 9.258 -12.396 -2.230 1.00 0.00 O ATOM 0 H GLU A 31 10.691 -6.889 -2.798 1.00 0.00 H new ATOM 0 HA GLU A 31 8.841 -8.801 -4.009 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.998 -8.275 -1.281 1.00 0.00 H new ATOM 0 HB3 GLU A 31 8.478 -9.140 -1.390 1.00 0.00 H new ATOM 0 HG2 GLU A 31 10.945 -9.983 -2.937 1.00 0.00 H new ATOM 0 HG3 GLU A 31 10.615 -10.544 -1.310 1.00 0.00 H new ATOM 418 N ILE A 32 7.935 -6.006 -2.668 1.00 0.00 N ATOM 419 CA ILE A 32 6.805 -5.121 -2.413 1.00 0.00 C ATOM 420 C ILE A 32 6.123 -4.712 -3.714 1.00 0.00 C ATOM 421 O ILE A 32 4.949 -5.010 -3.933 1.00 0.00 O ATOM 422 CB ILE A 32 7.243 -3.853 -1.656 1.00 0.00 C ATOM 423 CG1 ILE A 32 7.741 -4.217 -0.255 1.00 0.00 C ATOM 424 CG2 ILE A 32 6.092 -2.861 -1.574 1.00 0.00 C ATOM 425 CD1 ILE A 32 8.416 -3.069 0.463 1.00 0.00 C ATOM 0 H ILE A 32 8.847 -5.552 -2.614 1.00 0.00 H new ATOM 0 HA ILE A 32 6.101 -5.678 -1.795 1.00 0.00 H new ATOM 0 HB ILE A 32 8.062 -3.385 -2.203 1.00 0.00 H new ATOM 0 HG12 ILE A 32 6.898 -4.564 0.343 1.00 0.00 H new ATOM 0 HG13 ILE A 32 8.441 -5.049 -0.332 1.00 0.00 H new ATOM 0 HG21 ILE A 32 6.417 -1.970 -1.036 1.00 0.00 H new ATOM 0 HG22 ILE A 32 5.779 -2.583 -2.580 1.00 0.00 H new ATOM 0 HG23 ILE A 32 5.255 -3.318 -1.046 1.00 0.00 H new ATOM 0 HD11 ILE A 32 8.743 -3.399 1.449 1.00 0.00 H new ATOM 0 HD12 ILE A 32 9.279 -2.736 -0.114 1.00 0.00 H new ATOM 0 HD13 ILE A 32 7.712 -2.244 0.571 1.00 0.00 H new ATOM 437 N VAL A 33 6.868 -4.027 -4.577 1.00 0.00 N ATOM 438 CA VAL A 33 6.336 -3.579 -5.858 1.00 0.00 C ATOM 439 C VAL A 33 5.333 -4.581 -6.417 1.00 0.00 C ATOM 440 O VAL A 33 4.248 -4.204 -6.862 1.00 0.00 O ATOM 441 CB VAL A 33 7.461 -3.366 -6.889 1.00 0.00 C ATOM 442 CG1 VAL A 33 6.884 -3.233 -8.290 1.00 0.00 C ATOM 443 CG2 VAL A 33 8.291 -2.144 -6.527 1.00 0.00 C ATOM 0 H VAL A 33 7.841 -3.771 -4.412 1.00 0.00 H new ATOM 0 HA VAL A 33 5.834 -2.629 -5.677 1.00 0.00 H new ATOM 0 HB VAL A 33 8.114 -4.238 -6.873 1.00 0.00 H new ATOM 0 HG11 VAL A 33 7.694 -3.083 -9.004 1.00 0.00 H new ATOM 0 HG12 VAL A 33 6.338 -4.141 -8.546 1.00 0.00 H new ATOM 0 HG13 VAL A 33 6.207 -2.380 -8.325 1.00 0.00 H new ATOM 0 HG21 VAL A 33 9.081 -2.009 -7.266 1.00 0.00 H new ATOM 0 HG22 VAL A 33 7.652 -1.261 -6.513 1.00 0.00 H new ATOM 0 HG23 VAL A 33 8.736 -2.285 -5.542 1.00 0.00 H new ATOM 453 N GLN A 34 5.700 -5.857 -6.390 1.00 0.00 N ATOM 454 CA GLN A 34 4.831 -6.914 -6.895 1.00 0.00 C ATOM 455 C GLN A 34 3.669 -7.166 -5.939 1.00 0.00 C ATOM 456 O GLN A 34 2.534 -7.375 -6.367 1.00 0.00 O ATOM 457 CB GLN A 34 5.627 -8.204 -7.100 1.00 0.00 C ATOM 458 CG GLN A 34 6.040 -8.441 -8.544 1.00 0.00 C ATOM 459 CD GLN A 34 5.186 -9.487 -9.232 1.00 0.00 C ATOM 460 OE1 GLN A 34 5.167 -10.651 -8.830 1.00 0.00 O ATOM 461 NE2 GLN A 34 4.472 -9.078 -10.273 1.00 0.00 N ATOM 0 H GLN A 34 6.594 -6.185 -6.024 1.00 0.00 H new ATOM 0 HA GLN A 34 4.426 -6.590 -7.854 1.00 0.00 H new ATOM 0 HB2 GLN A 34 6.520 -8.173 -6.476 1.00 0.00 H new ATOM 0 HB3 GLN A 34 5.028 -9.049 -6.759 1.00 0.00 H new ATOM 0 HG2 GLN A 34 5.973 -7.503 -9.095 1.00 0.00 H new ATOM 0 HG3 GLN A 34 7.084 -8.754 -8.572 1.00 0.00 H new ATOM 0 HE21 GLN A 34 4.518 -8.104 -10.572 1.00 0.00 H new ATOM 0 HE22 GLN A 34 3.877 -9.738 -10.774 1.00 0.00 H new ATOM 470 N PHE A 35 3.961 -7.143 -4.642 1.00 0.00 N ATOM 471 CA PHE A 35 2.941 -7.370 -3.626 1.00 0.00 C ATOM 472 C PHE A 35 1.771 -6.407 -3.805 1.00 0.00 C ATOM 473 O PHE A 35 0.648 -6.693 -3.389 1.00 0.00 O ATOM 474 CB PHE A 35 3.540 -7.208 -2.227 1.00 0.00 C ATOM 475 CG PHE A 35 2.508 -7.014 -1.153 1.00 0.00 C ATOM 476 CD1 PHE A 35 1.831 -8.097 -0.619 1.00 0.00 C ATOM 477 CD2 PHE A 35 2.217 -5.746 -0.676 1.00 0.00 C ATOM 478 CE1 PHE A 35 0.881 -7.922 0.370 1.00 0.00 C ATOM 479 CE2 PHE A 35 1.269 -5.563 0.314 1.00 0.00 C ATOM 480 CZ PHE A 35 0.600 -6.652 0.836 1.00 0.00 C ATOM 0 H PHE A 35 4.895 -6.970 -4.271 1.00 0.00 H new ATOM 0 HA PHE A 35 2.571 -8.389 -3.740 1.00 0.00 H new ATOM 0 HB2 PHE A 35 4.137 -8.089 -1.992 1.00 0.00 H new ATOM 0 HB3 PHE A 35 4.218 -6.354 -2.227 1.00 0.00 H new ATOM 0 HD1 PHE A 35 2.048 -9.092 -0.980 1.00 0.00 H new ATOM 0 HD2 PHE A 35 2.737 -4.891 -1.082 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.360 -8.776 0.777 1.00 0.00 H new ATOM 0 HE2 PHE A 35 1.052 -4.570 0.678 1.00 0.00 H new ATOM 0 HZ PHE A 35 -0.142 -6.511 1.608 1.00 0.00 H new ATOM 490 N PHE A 36 2.042 -5.264 -4.426 1.00 0.00 N ATOM 491 CA PHE A 36 1.013 -4.258 -4.659 1.00 0.00 C ATOM 492 C PHE A 36 0.616 -4.217 -6.131 1.00 0.00 C ATOM 493 O PHE A 36 0.284 -3.159 -6.667 1.00 0.00 O ATOM 494 CB PHE A 36 1.508 -2.879 -4.214 1.00 0.00 C ATOM 495 CG PHE A 36 1.440 -2.668 -2.728 1.00 0.00 C ATOM 496 CD1 PHE A 36 0.255 -2.874 -2.040 1.00 0.00 C ATOM 497 CD2 PHE A 36 2.561 -2.265 -2.021 1.00 0.00 C ATOM 498 CE1 PHE A 36 0.189 -2.681 -0.673 1.00 0.00 C ATOM 499 CE2 PHE A 36 2.501 -2.072 -0.654 1.00 0.00 C ATOM 500 CZ PHE A 36 1.313 -2.279 0.021 1.00 0.00 C ATOM 0 H PHE A 36 2.966 -5.011 -4.777 1.00 0.00 H new ATOM 0 HA PHE A 36 0.136 -4.529 -4.072 1.00 0.00 H new ATOM 0 HB2 PHE A 36 2.538 -2.748 -4.545 1.00 0.00 H new ATOM 0 HB3 PHE A 36 0.914 -2.111 -4.709 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -0.627 -3.189 -2.578 1.00 0.00 H new ATOM 0 HD2 PHE A 36 3.492 -2.100 -2.544 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -0.741 -2.844 -0.148 1.00 0.00 H new ATOM 0 HE2 PHE A 36 3.382 -1.760 -0.113 1.00 0.00 H new ATOM 0 HZ PHE A 36 1.264 -2.127 1.089 1.00 0.00 H new ATOM 510 N SER A 37 0.653 -5.377 -6.780 1.00 0.00 N ATOM 511 CA SER A 37 0.300 -5.474 -8.192 1.00 0.00 C ATOM 512 C SER A 37 -1.028 -4.778 -8.470 1.00 0.00 C ATOM 513 O SER A 37 -1.992 -4.934 -7.722 1.00 0.00 O ATOM 514 CB SER A 37 0.220 -6.940 -8.619 1.00 0.00 C ATOM 515 OG SER A 37 -0.972 -7.544 -8.147 1.00 0.00 O ATOM 0 H SER A 37 0.924 -6.262 -6.351 1.00 0.00 H new ATOM 0 HA SER A 37 1.078 -4.976 -8.771 1.00 0.00 H new ATOM 0 HB2 SER A 37 0.260 -7.008 -9.706 1.00 0.00 H new ATOM 0 HB3 SER A 37 1.084 -7.482 -8.233 1.00 0.00 H new ATOM 0 HG SER A 37 -1.000 -8.480 -8.435 1.00 0.00 H new ATOM 521 N GLY A 38 -1.071 -4.007 -9.553 1.00 0.00 N ATOM 522 CA GLY A 38 -2.285 -3.298 -9.912 1.00 0.00 C ATOM 523 C GLY A 38 -2.272 -1.855 -9.447 1.00 0.00 C ATOM 524 O GLY A 38 -2.968 -1.008 -10.009 1.00 0.00 O ATOM 0 H GLY A 38 -0.286 -3.861 -10.188 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -2.413 -3.327 -10.994 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -3.143 -3.809 -9.476 1.00 0.00 H new ATOM 528 N LEU A 39 -1.481 -1.574 -8.417 1.00 0.00 N ATOM 529 CA LEU A 39 -1.382 -0.223 -7.876 1.00 0.00 C ATOM 530 C LEU A 39 -0.170 0.505 -8.447 1.00 0.00 C ATOM 531 O LEU A 39 0.838 -0.116 -8.782 1.00 0.00 O ATOM 532 CB LEU A 39 -1.291 -0.270 -6.350 1.00 0.00 C ATOM 533 CG LEU A 39 -2.470 -0.920 -5.626 1.00 0.00 C ATOM 534 CD1 LEU A 39 -1.975 -1.894 -4.567 1.00 0.00 C ATOM 535 CD2 LEU A 39 -3.364 0.140 -5.002 1.00 0.00 C ATOM 0 H LEU A 39 -0.899 -2.263 -7.940 1.00 0.00 H new ATOM 0 HA LEU A 39 -2.280 0.324 -8.164 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -0.382 -0.807 -6.077 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -1.182 0.750 -5.981 1.00 0.00 H new ATOM 0 HG LEU A 39 -3.057 -1.477 -6.356 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -2.828 -2.347 -4.062 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -1.378 -2.673 -5.040 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -1.364 -1.360 -3.839 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -4.198 -0.342 -4.491 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -2.788 0.725 -4.285 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -3.748 0.798 -5.782 1.00 0.00 H new ATOM 547 N GLU A 40 -0.276 1.826 -8.554 1.00 0.00 N ATOM 548 CA GLU A 40 0.814 2.639 -9.083 1.00 0.00 C ATOM 549 C GLU A 40 1.525 3.391 -7.963 1.00 0.00 C ATOM 550 O GLU A 40 0.964 4.309 -7.364 1.00 0.00 O ATOM 551 CB GLU A 40 0.282 3.629 -10.122 1.00 0.00 C ATOM 552 CG GLU A 40 1.163 4.854 -10.300 1.00 0.00 C ATOM 553 CD GLU A 40 0.715 5.731 -11.454 1.00 0.00 C ATOM 554 OE1 GLU A 40 -0.505 5.955 -11.590 1.00 0.00 O ATOM 555 OE2 GLU A 40 1.587 6.194 -12.219 1.00 0.00 O ATOM 0 H GLU A 40 -1.104 2.356 -8.282 1.00 0.00 H new ATOM 0 HA GLU A 40 1.532 1.973 -9.561 1.00 0.00 H new ATOM 0 HB2 GLU A 40 0.184 3.120 -11.081 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -0.717 3.950 -9.828 1.00 0.00 H new ATOM 0 HG2 GLU A 40 1.156 5.439 -9.380 1.00 0.00 H new ATOM 0 HG3 GLU A 40 2.192 4.536 -10.468 1.00 0.00 H new ATOM 562 N ILE A 41 2.763 2.996 -7.686 1.00 0.00 N ATOM 563 CA ILE A 41 3.552 3.634 -6.639 1.00 0.00 C ATOM 564 C ILE A 41 4.573 4.599 -7.230 1.00 0.00 C ATOM 565 O ILE A 41 4.991 4.451 -8.379 1.00 0.00 O ATOM 566 CB ILE A 41 4.287 2.592 -5.775 1.00 0.00 C ATOM 567 CG1 ILE A 41 3.319 1.497 -5.324 1.00 0.00 C ATOM 568 CG2 ILE A 41 4.935 3.262 -4.574 1.00 0.00 C ATOM 569 CD1 ILE A 41 3.971 0.141 -5.167 1.00 0.00 C ATOM 0 H ILE A 41 3.241 2.237 -8.172 1.00 0.00 H new ATOM 0 HA ILE A 41 2.854 4.188 -6.011 1.00 0.00 H new ATOM 0 HB ILE A 41 5.071 2.132 -6.376 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.871 1.788 -4.374 1.00 0.00 H new ATOM 0 HG13 ILE A 41 2.508 1.420 -6.048 1.00 0.00 H new ATOM 0 HG21 ILE A 41 5.450 2.512 -3.973 1.00 0.00 H new ATOM 0 HG22 ILE A 41 5.652 4.008 -4.917 1.00 0.00 H new ATOM 0 HG23 ILE A 41 4.168 3.746 -3.970 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.225 -0.586 -4.845 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.395 -0.172 -6.121 1.00 0.00 H new ATOM 0 HD13 ILE A 41 4.763 0.202 -4.421 1.00 0.00 H new ATOM 581 N VAL A 42 4.973 5.588 -6.438 1.00 0.00 N ATOM 582 CA VAL A 42 5.948 6.578 -6.881 1.00 0.00 C ATOM 583 C VAL A 42 7.368 6.028 -6.791 1.00 0.00 C ATOM 584 O VAL A 42 7.694 5.225 -5.918 1.00 0.00 O ATOM 585 CB VAL A 42 5.855 7.870 -6.049 1.00 0.00 C ATOM 586 CG1 VAL A 42 4.547 8.593 -6.329 1.00 0.00 C ATOM 587 CG2 VAL A 42 5.993 7.559 -4.565 1.00 0.00 C ATOM 0 H VAL A 42 4.637 5.725 -5.485 1.00 0.00 H new ATOM 0 HA VAL A 42 5.716 6.808 -7.921 1.00 0.00 H new ATOM 0 HB VAL A 42 6.675 8.527 -6.338 1.00 0.00 H new ATOM 0 HG11 VAL A 42 4.500 9.504 -5.732 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.492 8.850 -7.387 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.710 7.945 -6.069 1.00 0.00 H new ATOM 0 HG21 VAL A 42 5.925 8.484 -3.992 1.00 0.00 H new ATOM 0 HG22 VAL A 42 5.195 6.883 -4.259 1.00 0.00 H new ATOM 0 HG23 VAL A 42 6.958 7.088 -4.380 1.00 0.00 H new ATOM 597 N PRO A 43 8.233 6.473 -7.714 1.00 0.00 N ATOM 598 CA PRO A 43 9.633 6.040 -7.758 1.00 0.00 C ATOM 599 C PRO A 43 10.447 6.587 -6.591 1.00 0.00 C ATOM 600 O PRO A 43 10.515 7.797 -6.381 1.00 0.00 O ATOM 601 CB PRO A 43 10.141 6.620 -9.081 1.00 0.00 C ATOM 602 CG PRO A 43 9.261 7.793 -9.344 1.00 0.00 C ATOM 603 CD PRO A 43 7.913 7.432 -8.783 1.00 0.00 C ATOM 0 HA PRO A 43 9.727 4.956 -7.686 1.00 0.00 H new ATOM 0 HB2 PRO A 43 11.187 6.919 -9.007 1.00 0.00 H new ATOM 0 HB3 PRO A 43 10.075 5.888 -9.885 1.00 0.00 H new ATOM 0 HG2 PRO A 43 9.654 8.691 -8.868 1.00 0.00 H new ATOM 0 HG3 PRO A 43 9.196 8.001 -10.412 1.00 0.00 H new ATOM 0 HD2 PRO A 43 7.392 8.307 -8.395 1.00 0.00 H new ATOM 0 HD3 PRO A 43 7.268 6.988 -9.541 1.00 0.00 H new ATOM 611 N ASN A 44 11.063 5.686 -5.831 1.00 0.00 N ATOM 612 CA ASN A 44 11.873 6.079 -4.683 1.00 0.00 C ATOM 613 C ASN A 44 10.989 6.519 -3.520 1.00 0.00 C ATOM 614 O ASN A 44 11.398 7.328 -2.689 1.00 0.00 O ATOM 615 CB ASN A 44 12.828 7.209 -5.070 1.00 0.00 C ATOM 616 CG ASN A 44 13.413 7.024 -6.457 1.00 0.00 C ATOM 617 OD1 ASN A 44 12.783 7.364 -7.459 1.00 0.00 O ATOM 618 ND2 ASN A 44 14.623 6.482 -6.522 1.00 0.00 N ATOM 0 H ASN A 44 11.017 4.679 -5.990 1.00 0.00 H new ATOM 0 HA ASN A 44 12.455 5.214 -4.366 1.00 0.00 H new ATOM 0 HB2 ASN A 44 12.297 8.160 -5.027 1.00 0.00 H new ATOM 0 HB3 ASN A 44 13.637 7.262 -4.342 1.00 0.00 H new ATOM 0 HD21 ASN A 44 15.067 6.332 -7.428 1.00 0.00 H new ATOM 0 HD22 ASN A 44 15.109 6.215 -5.666 1.00 0.00 H new ATOM 625 N GLY A 45 9.774 5.981 -3.470 1.00 0.00 N ATOM 626 CA GLY A 45 8.852 6.331 -2.405 1.00 0.00 C ATOM 627 C GLY A 45 8.650 5.198 -1.418 1.00 0.00 C ATOM 628 O GLY A 45 7.541 4.980 -0.932 1.00 0.00 O ATOM 0 H GLY A 45 9.412 5.310 -4.147 1.00 0.00 H new ATOM 0 HA2 GLY A 45 9.228 7.207 -1.876 1.00 0.00 H new ATOM 0 HA3 GLY A 45 7.891 6.608 -2.837 1.00 0.00 H new ATOM 632 N MET A 46 9.725 4.473 -1.124 1.00 0.00 N ATOM 633 CA MET A 46 9.660 3.356 -0.189 1.00 0.00 C ATOM 634 C MET A 46 10.795 3.430 0.827 1.00 0.00 C ATOM 635 O MET A 46 11.936 3.733 0.477 1.00 0.00 O ATOM 636 CB MET A 46 9.721 2.026 -0.944 1.00 0.00 C ATOM 637 CG MET A 46 8.654 1.889 -2.018 1.00 0.00 C ATOM 638 SD MET A 46 9.349 1.796 -3.679 1.00 0.00 S ATOM 639 CE MET A 46 8.160 0.725 -4.484 1.00 0.00 C ATOM 0 H MET A 46 10.650 4.639 -1.520 1.00 0.00 H new ATOM 0 HA MET A 46 8.713 3.418 0.346 1.00 0.00 H new ATOM 0 HB2 MET A 46 10.704 1.923 -1.404 1.00 0.00 H new ATOM 0 HB3 MET A 46 9.615 1.208 -0.232 1.00 0.00 H new ATOM 0 HG2 MET A 46 8.063 0.994 -1.825 1.00 0.00 H new ATOM 0 HG3 MET A 46 7.974 2.739 -1.960 1.00 0.00 H new ATOM 0 HE1 MET A 46 8.157 0.925 -5.555 1.00 0.00 H new ATOM 0 HE2 MET A 46 8.432 -0.316 -4.310 1.00 0.00 H new ATOM 0 HE3 MET A 46 7.167 0.913 -4.077 1.00 0.00 H new ATOM 649 N THR A 47 10.476 3.151 2.087 1.00 0.00 N ATOM 650 CA THR A 47 11.469 3.188 3.153 1.00 0.00 C ATOM 651 C THR A 47 11.461 1.892 3.956 1.00 0.00 C ATOM 652 O THR A 47 10.414 1.447 4.426 1.00 0.00 O ATOM 653 CB THR A 47 11.224 4.371 4.108 1.00 0.00 C ATOM 654 OG1 THR A 47 11.453 5.608 3.424 1.00 0.00 O ATOM 655 CG2 THR A 47 12.134 4.283 5.324 1.00 0.00 C ATOM 0 H THR A 47 9.537 2.897 2.394 1.00 0.00 H new ATOM 0 HA THR A 47 12.441 3.311 2.676 1.00 0.00 H new ATOM 0 HB THR A 47 10.188 4.328 4.445 1.00 0.00 H new ATOM 0 HG1 THR A 47 11.293 6.355 4.037 1.00 0.00 H new ATOM 0 HG21 THR A 47 11.943 5.129 5.984 1.00 0.00 H new ATOM 0 HG22 THR A 47 11.937 3.354 5.859 1.00 0.00 H new ATOM 0 HG23 THR A 47 13.175 4.303 5.002 1.00 0.00 H new ATOM 663 N LEU A 48 12.635 1.291 4.110 1.00 0.00 N ATOM 664 CA LEU A 48 12.765 0.045 4.858 1.00 0.00 C ATOM 665 C LEU A 48 13.924 0.120 5.846 1.00 0.00 C ATOM 666 O LEU A 48 15.076 -0.153 5.511 1.00 0.00 O ATOM 667 CB LEU A 48 12.972 -1.130 3.900 1.00 0.00 C ATOM 668 CG LEU A 48 11.730 -1.961 3.578 1.00 0.00 C ATOM 669 CD1 LEU A 48 11.371 -1.837 2.105 1.00 0.00 C ATOM 670 CD2 LEU A 48 11.951 -3.418 3.955 1.00 0.00 C ATOM 0 H LEU A 48 13.511 1.646 3.727 1.00 0.00 H new ATOM 0 HA LEU A 48 11.843 -0.110 5.419 1.00 0.00 H new ATOM 0 HB2 LEU A 48 13.378 -0.743 2.965 1.00 0.00 H new ATOM 0 HB3 LEU A 48 13.727 -1.791 4.326 1.00 0.00 H new ATOM 0 HG LEU A 48 10.897 -1.577 4.167 1.00 0.00 H new ATOM 0 HD11 LEU A 48 10.484 -2.435 1.895 1.00 0.00 H new ATOM 0 HD12 LEU A 48 11.169 -0.793 1.866 1.00 0.00 H new ATOM 0 HD13 LEU A 48 12.202 -2.194 1.497 1.00 0.00 H new ATOM 0 HD21 LEU A 48 11.057 -3.995 3.719 1.00 0.00 H new ATOM 0 HD22 LEU A 48 12.797 -3.815 3.394 1.00 0.00 H new ATOM 0 HD23 LEU A 48 12.158 -3.490 5.023 1.00 0.00 H new ATOM 682 N PRO A 49 13.614 0.498 7.095 1.00 0.00 N ATOM 683 CA PRO A 49 14.616 0.616 8.159 1.00 0.00 C ATOM 684 C PRO A 49 15.156 -0.741 8.599 1.00 0.00 C ATOM 685 O PRO A 49 14.685 -1.785 8.147 1.00 0.00 O ATOM 686 CB PRO A 49 13.845 1.280 9.301 1.00 0.00 C ATOM 687 CG PRO A 49 12.421 0.916 9.059 1.00 0.00 C ATOM 688 CD PRO A 49 12.262 0.839 7.565 1.00 0.00 C ATOM 0 HA PRO A 49 15.491 1.179 7.834 1.00 0.00 H new ATOM 0 HB2 PRO A 49 14.186 0.919 10.271 1.00 0.00 H new ATOM 0 HB3 PRO A 49 13.984 2.361 9.296 1.00 0.00 H new ATOM 0 HG2 PRO A 49 12.177 -0.038 9.527 1.00 0.00 H new ATOM 0 HG3 PRO A 49 11.750 1.662 9.485 1.00 0.00 H new ATOM 0 HD2 PRO A 49 11.533 0.081 7.277 1.00 0.00 H new ATOM 0 HD3 PRO A 49 11.919 1.786 7.148 1.00 0.00 H new ATOM 696 N VAL A 50 16.148 -0.720 9.484 1.00 0.00 N ATOM 697 CA VAL A 50 16.751 -1.948 9.985 1.00 0.00 C ATOM 698 C VAL A 50 17.131 -1.813 11.456 1.00 0.00 C ATOM 699 O VAL A 50 17.129 -0.713 12.010 1.00 0.00 O ATOM 700 CB VAL A 50 18.006 -2.329 9.177 1.00 0.00 C ATOM 701 CG1 VAL A 50 17.614 -2.933 7.837 1.00 0.00 C ATOM 702 CG2 VAL A 50 18.903 -1.115 8.982 1.00 0.00 C ATOM 0 H VAL A 50 16.551 0.135 9.868 1.00 0.00 H new ATOM 0 HA VAL A 50 16.004 -2.734 9.875 1.00 0.00 H new ATOM 0 HB VAL A 50 18.565 -3.079 9.737 1.00 0.00 H new ATOM 0 HG11 VAL A 50 18.513 -3.196 7.280 1.00 0.00 H new ATOM 0 HG12 VAL A 50 17.015 -3.828 8.003 1.00 0.00 H new ATOM 0 HG13 VAL A 50 17.033 -2.208 7.267 1.00 0.00 H new ATOM 0 HG21 VAL A 50 19.785 -1.402 8.409 1.00 0.00 H new ATOM 0 HG22 VAL A 50 18.356 -0.341 8.443 1.00 0.00 H new ATOM 0 HG23 VAL A 50 19.211 -0.730 9.954 1.00 0.00 H new ATOM 712 N ASP A 51 17.453 -2.938 12.084 1.00 0.00 N ATOM 713 CA ASP A 51 17.837 -2.946 13.491 1.00 0.00 C ATOM 714 C ASP A 51 19.207 -2.303 13.685 1.00 0.00 C ATOM 715 O ASP A 51 19.725 -1.639 12.788 1.00 0.00 O ATOM 716 CB ASP A 51 17.850 -4.377 14.031 1.00 0.00 C ATOM 717 CG ASP A 51 16.761 -4.620 15.056 1.00 0.00 C ATOM 718 OD1 ASP A 51 16.711 -3.872 16.055 1.00 0.00 O ATOM 719 OD2 ASP A 51 15.959 -5.557 14.861 1.00 0.00 O ATOM 0 H ASP A 51 17.456 -3.857 11.641 1.00 0.00 H new ATOM 0 HA ASP A 51 17.101 -2.364 14.046 1.00 0.00 H new ATOM 0 HB2 ASP A 51 17.728 -5.075 13.203 1.00 0.00 H new ATOM 0 HB3 ASP A 51 18.821 -4.583 14.481 1.00 0.00 H new ATOM 724 N PHE A 52 19.788 -2.505 14.863 1.00 0.00 N ATOM 725 CA PHE A 52 21.096 -1.944 15.176 1.00 0.00 C ATOM 726 C PHE A 52 22.200 -2.690 14.432 1.00 0.00 C ATOM 727 O PHE A 52 23.274 -2.142 14.183 1.00 0.00 O ATOM 728 CB PHE A 52 21.353 -2.002 16.684 1.00 0.00 C ATOM 729 CG PHE A 52 20.098 -2.104 17.501 1.00 0.00 C ATOM 730 CD1 PHE A 52 19.326 -0.981 17.754 1.00 0.00 C ATOM 731 CD2 PHE A 52 19.688 -3.323 18.017 1.00 0.00 C ATOM 732 CE1 PHE A 52 18.170 -1.072 18.507 1.00 0.00 C ATOM 733 CE2 PHE A 52 18.533 -3.420 18.771 1.00 0.00 C ATOM 734 CZ PHE A 52 17.773 -2.293 19.015 1.00 0.00 C ATOM 0 H PHE A 52 19.373 -3.053 15.616 1.00 0.00 H new ATOM 0 HA PHE A 52 21.103 -0.903 14.853 1.00 0.00 H new ATOM 0 HB2 PHE A 52 21.991 -2.858 16.903 1.00 0.00 H new ATOM 0 HB3 PHE A 52 21.902 -1.110 16.986 1.00 0.00 H new ATOM 0 HD1 PHE A 52 19.631 -0.024 17.358 1.00 0.00 H new ATOM 0 HD2 PHE A 52 20.278 -4.208 17.828 1.00 0.00 H new ATOM 0 HE1 PHE A 52 17.578 -0.189 18.698 1.00 0.00 H new ATOM 0 HE2 PHE A 52 18.226 -4.376 19.169 1.00 0.00 H new ATOM 0 HZ PHE A 52 16.870 -2.367 19.602 1.00 0.00 H new ATOM 744 N GLN A 53 21.927 -3.942 14.080 1.00 0.00 N ATOM 745 CA GLN A 53 22.896 -4.763 13.366 1.00 0.00 C ATOM 746 C GLN A 53 22.605 -4.771 11.869 1.00 0.00 C ATOM 747 O GLN A 53 23.360 -5.341 11.082 1.00 0.00 O ATOM 748 CB GLN A 53 22.882 -6.194 13.907 1.00 0.00 C ATOM 749 CG GLN A 53 23.273 -6.293 15.373 1.00 0.00 C ATOM 750 CD GLN A 53 23.926 -7.617 15.714 1.00 0.00 C ATOM 751 OE1 GLN A 53 24.685 -8.172 14.919 1.00 0.00 O ATOM 752 NE2 GLN A 53 23.634 -8.133 16.903 1.00 0.00 N ATOM 0 H GLN A 53 21.042 -4.410 14.278 1.00 0.00 H new ATOM 0 HA GLN A 53 23.885 -4.332 13.524 1.00 0.00 H new ATOM 0 HB2 GLN A 53 21.884 -6.613 13.776 1.00 0.00 H new ATOM 0 HB3 GLN A 53 23.564 -6.804 13.315 1.00 0.00 H new ATOM 0 HG2 GLN A 53 23.957 -5.481 15.618 1.00 0.00 H new ATOM 0 HG3 GLN A 53 22.386 -6.160 15.992 1.00 0.00 H new ATOM 0 HE21 GLN A 53 23.000 -7.640 17.531 1.00 0.00 H new ATOM 0 HE22 GLN A 53 24.044 -9.023 17.188 1.00 0.00 H new ATOM 761 N GLY A 54 21.504 -4.134 11.481 1.00 0.00 N ATOM 762 CA GLY A 54 21.132 -4.081 10.079 1.00 0.00 C ATOM 763 C GLY A 54 20.110 -5.136 9.710 1.00 0.00 C ATOM 764 O GLY A 54 20.008 -5.533 8.549 1.00 0.00 O ATOM 0 H GLY A 54 20.863 -3.654 12.113 1.00 0.00 H new ATOM 0 HA2 GLY A 54 20.730 -3.094 9.850 1.00 0.00 H new ATOM 0 HA3 GLY A 54 22.023 -4.212 9.465 1.00 0.00 H new ATOM 768 N ARG A 55 19.351 -5.594 10.700 1.00 0.00 N ATOM 769 CA ARG A 55 18.331 -6.612 10.473 1.00 0.00 C ATOM 770 C ARG A 55 16.951 -5.977 10.331 1.00 0.00 C ATOM 771 O ARG A 55 16.475 -5.294 11.237 1.00 0.00 O ATOM 772 CB ARG A 55 18.325 -7.621 11.624 1.00 0.00 C ATOM 773 CG ARG A 55 19.298 -8.771 11.430 1.00 0.00 C ATOM 774 CD ARG A 55 19.528 -9.531 12.728 1.00 0.00 C ATOM 775 NE ARG A 55 20.681 -10.423 12.643 1.00 0.00 N ATOM 776 CZ ARG A 55 20.660 -11.594 12.018 1.00 0.00 C ATOM 777 NH1 ARG A 55 19.550 -12.013 11.424 1.00 0.00 N ATOM 778 NH2 ARG A 55 21.751 -12.350 11.984 1.00 0.00 N ATOM 0 H ARG A 55 19.423 -5.277 11.667 1.00 0.00 H new ATOM 0 HA ARG A 55 18.570 -7.131 9.544 1.00 0.00 H new ATOM 0 HB2 ARG A 55 18.568 -7.103 12.552 1.00 0.00 H new ATOM 0 HB3 ARG A 55 17.318 -8.023 11.738 1.00 0.00 H new ATOM 0 HG2 ARG A 55 18.912 -9.452 10.672 1.00 0.00 H new ATOM 0 HG3 ARG A 55 20.248 -8.387 11.059 1.00 0.00 H new ATOM 0 HD2 ARG A 55 19.678 -8.821 13.542 1.00 0.00 H new ATOM 0 HD3 ARG A 55 18.638 -10.111 12.971 1.00 0.00 H new ATOM 0 HE ARG A 55 21.551 -10.130 13.088 1.00 0.00 H new ATOM 0 HH11 ARG A 55 18.710 -11.435 11.447 1.00 0.00 H new ATOM 0 HH12 ARG A 55 19.537 -12.913 10.945 1.00 0.00 H new ATOM 0 HH21 ARG A 55 22.607 -12.031 12.438 1.00 0.00 H new ATOM 0 HH22 ARG A 55 21.733 -13.250 11.503 1.00 0.00 H new ATOM 792 N SER A 56 16.315 -6.209 9.187 1.00 0.00 N ATOM 793 CA SER A 56 14.991 -5.657 8.924 1.00 0.00 C ATOM 794 C SER A 56 14.122 -5.706 10.177 1.00 0.00 C ATOM 795 O SER A 56 13.929 -6.767 10.772 1.00 0.00 O ATOM 796 CB SER A 56 14.312 -6.424 7.788 1.00 0.00 C ATOM 797 OG SER A 56 14.115 -7.783 8.137 1.00 0.00 O ATOM 0 H SER A 56 16.695 -6.775 8.428 1.00 0.00 H new ATOM 0 HA SER A 56 15.112 -4.615 8.628 1.00 0.00 H new ATOM 0 HB2 SER A 56 13.352 -5.962 7.556 1.00 0.00 H new ATOM 0 HB3 SER A 56 14.922 -6.361 6.887 1.00 0.00 H new ATOM 0 HG SER A 56 14.124 -7.875 9.113 1.00 0.00 H new ATOM 803 N THR A 57 13.600 -4.549 10.574 1.00 0.00 N ATOM 804 CA THR A 57 12.753 -4.459 11.755 1.00 0.00 C ATOM 805 C THR A 57 11.334 -4.931 11.454 1.00 0.00 C ATOM 806 O THR A 57 10.461 -4.895 12.319 1.00 0.00 O ATOM 807 CB THR A 57 12.698 -3.018 12.298 1.00 0.00 C ATOM 808 OG1 THR A 57 11.901 -2.200 11.435 1.00 0.00 O ATOM 809 CG2 THR A 57 14.096 -2.431 12.415 1.00 0.00 C ATOM 0 H THR A 57 13.750 -3.662 10.094 1.00 0.00 H new ATOM 0 HA THR A 57 13.195 -5.108 12.510 1.00 0.00 H new ATOM 0 HB THR A 57 12.248 -3.043 13.290 1.00 0.00 H new ATOM 0 HG1 THR A 57 11.869 -1.286 11.788 1.00 0.00 H new ATOM 0 HG21 THR A 57 14.032 -1.413 12.800 1.00 0.00 H new ATOM 0 HG22 THR A 57 14.691 -3.040 13.096 1.00 0.00 H new ATOM 0 HG23 THR A 57 14.569 -2.418 11.433 1.00 0.00 H new ATOM 817 N GLY A 58 11.113 -5.373 10.219 1.00 0.00 N ATOM 818 CA GLY A 58 9.799 -5.847 9.826 1.00 0.00 C ATOM 819 C GLY A 58 8.842 -4.712 9.521 1.00 0.00 C ATOM 820 O GLY A 58 7.650 -4.936 9.318 1.00 0.00 O ATOM 0 H GLY A 58 11.820 -5.411 9.485 1.00 0.00 H new ATOM 0 HA2 GLY A 58 9.894 -6.485 8.947 1.00 0.00 H new ATOM 0 HA3 GLY A 58 9.385 -6.463 10.624 1.00 0.00 H new ATOM 824 N GLU A 59 9.364 -3.490 9.493 1.00 0.00 N ATOM 825 CA GLU A 59 8.546 -2.316 9.214 1.00 0.00 C ATOM 826 C GLU A 59 8.974 -1.652 7.908 1.00 0.00 C ATOM 827 O GLU A 59 10.156 -1.632 7.568 1.00 0.00 O ATOM 828 CB GLU A 59 8.645 -1.313 10.365 1.00 0.00 C ATOM 829 CG GLU A 59 7.877 -1.733 11.607 1.00 0.00 C ATOM 830 CD GLU A 59 8.408 -1.082 12.870 1.00 0.00 C ATOM 831 OE1 GLU A 59 8.887 0.067 12.788 1.00 0.00 O ATOM 832 OE2 GLU A 59 8.343 -1.724 13.940 1.00 0.00 O ATOM 0 H GLU A 59 10.350 -3.287 9.660 1.00 0.00 H new ATOM 0 HA GLU A 59 7.511 -2.642 9.113 1.00 0.00 H new ATOM 0 HB2 GLU A 59 9.694 -1.175 10.626 1.00 0.00 H new ATOM 0 HB3 GLU A 59 8.271 -0.347 10.027 1.00 0.00 H new ATOM 0 HG2 GLU A 59 6.825 -1.474 11.484 1.00 0.00 H new ATOM 0 HG3 GLU A 59 7.928 -2.817 11.712 1.00 0.00 H new ATOM 839 N ALA A 60 8.003 -1.110 7.181 1.00 0.00 N ATOM 840 CA ALA A 60 8.279 -0.444 5.913 1.00 0.00 C ATOM 841 C ALA A 60 7.238 0.631 5.621 1.00 0.00 C ATOM 842 O ALA A 60 6.106 0.561 6.101 1.00 0.00 O ATOM 843 CB ALA A 60 8.322 -1.461 4.782 1.00 0.00 C ATOM 0 H ALA A 60 7.019 -1.119 7.448 1.00 0.00 H new ATOM 0 HA ALA A 60 9.252 0.040 5.989 1.00 0.00 H new ATOM 0 HB1 ALA A 60 8.529 -0.951 3.841 1.00 0.00 H new ATOM 0 HB2 ALA A 60 9.107 -2.191 4.979 1.00 0.00 H new ATOM 0 HB3 ALA A 60 7.361 -1.971 4.714 1.00 0.00 H new ATOM 849 N PHE A 61 7.628 1.626 4.831 1.00 0.00 N ATOM 850 CA PHE A 61 6.729 2.718 4.476 1.00 0.00 C ATOM 851 C PHE A 61 6.671 2.904 2.962 1.00 0.00 C ATOM 852 O PHE A 61 7.690 3.144 2.316 1.00 0.00 O ATOM 853 CB PHE A 61 7.181 4.017 5.144 1.00 0.00 C ATOM 854 CG PHE A 61 7.120 3.974 6.645 1.00 0.00 C ATOM 855 CD1 PHE A 61 5.957 4.318 7.314 1.00 0.00 C ATOM 856 CD2 PHE A 61 8.224 3.586 7.385 1.00 0.00 C ATOM 857 CE1 PHE A 61 5.897 4.279 8.693 1.00 0.00 C ATOM 858 CE2 PHE A 61 8.171 3.545 8.766 1.00 0.00 C ATOM 859 CZ PHE A 61 7.006 3.891 9.420 1.00 0.00 C ATOM 0 H PHE A 61 8.561 1.699 4.424 1.00 0.00 H new ATOM 0 HA PHE A 61 5.731 2.464 4.832 1.00 0.00 H new ATOM 0 HB2 PHE A 61 8.203 4.237 4.836 1.00 0.00 H new ATOM 0 HB3 PHE A 61 6.557 4.836 4.787 1.00 0.00 H new ATOM 0 HD1 PHE A 61 5.087 4.620 6.750 1.00 0.00 H new ATOM 0 HD2 PHE A 61 9.137 3.312 6.878 1.00 0.00 H new ATOM 0 HE1 PHE A 61 4.985 4.551 9.203 1.00 0.00 H new ATOM 0 HE2 PHE A 61 9.040 3.243 9.332 1.00 0.00 H new ATOM 0 HZ PHE A 61 6.961 3.859 10.499 1.00 0.00 H new ATOM 869 N VAL A 62 5.470 2.792 2.404 1.00 0.00 N ATOM 870 CA VAL A 62 5.277 2.949 0.967 1.00 0.00 C ATOM 871 C VAL A 62 4.423 4.172 0.657 1.00 0.00 C ATOM 872 O VAL A 62 3.447 4.452 1.353 1.00 0.00 O ATOM 873 CB VAL A 62 4.613 1.703 0.351 1.00 0.00 C ATOM 874 CG1 VAL A 62 4.578 1.810 -1.165 1.00 0.00 C ATOM 875 CG2 VAL A 62 5.340 0.440 0.788 1.00 0.00 C ATOM 0 H VAL A 62 4.616 2.593 2.925 1.00 0.00 H new ATOM 0 HA VAL A 62 6.266 3.080 0.527 1.00 0.00 H new ATOM 0 HB VAL A 62 3.586 1.646 0.711 1.00 0.00 H new ATOM 0 HG11 VAL A 62 4.105 0.921 -1.582 1.00 0.00 H new ATOM 0 HG12 VAL A 62 4.008 2.693 -1.454 1.00 0.00 H new ATOM 0 HG13 VAL A 62 5.595 1.893 -1.547 1.00 0.00 H new ATOM 0 HG21 VAL A 62 4.857 -0.430 0.343 1.00 0.00 H new ATOM 0 HG22 VAL A 62 6.378 0.486 0.460 1.00 0.00 H new ATOM 0 HG23 VAL A 62 5.306 0.358 1.874 1.00 0.00 H new ATOM 885 N GLN A 63 4.798 4.898 -0.392 1.00 0.00 N ATOM 886 CA GLN A 63 4.065 6.093 -0.794 1.00 0.00 C ATOM 887 C GLN A 63 3.416 5.900 -2.160 1.00 0.00 C ATOM 888 O GLN A 63 4.089 5.952 -3.190 1.00 0.00 O ATOM 889 CB GLN A 63 5.000 7.304 -0.825 1.00 0.00 C ATOM 890 CG GLN A 63 4.311 8.593 -1.242 1.00 0.00 C ATOM 891 CD GLN A 63 5.261 9.775 -1.283 1.00 0.00 C ATOM 892 OE1 GLN A 63 6.410 9.678 -0.852 1.00 0.00 O ATOM 893 NE2 GLN A 63 4.785 10.899 -1.803 1.00 0.00 N ATOM 0 H GLN A 63 5.604 4.680 -0.978 1.00 0.00 H new ATOM 0 HA GLN A 63 3.278 6.270 -0.061 1.00 0.00 H new ATOM 0 HB2 GLN A 63 5.439 7.439 0.164 1.00 0.00 H new ATOM 0 HB3 GLN A 63 5.821 7.101 -1.513 1.00 0.00 H new ATOM 0 HG2 GLN A 63 3.861 8.459 -2.226 1.00 0.00 H new ATOM 0 HG3 GLN A 63 3.499 8.808 -0.547 1.00 0.00 H new ATOM 0 HE21 GLN A 63 3.826 10.935 -2.149 1.00 0.00 H new ATOM 0 HE22 GLN A 63 5.378 11.727 -1.857 1.00 0.00 H new ATOM 902 N PHE A 64 2.107 5.678 -2.162 1.00 0.00 N ATOM 903 CA PHE A 64 1.367 5.475 -3.403 1.00 0.00 C ATOM 904 C PHE A 64 1.216 6.788 -4.166 1.00 0.00 C ATOM 905 O PHE A 64 1.308 7.869 -3.586 1.00 0.00 O ATOM 906 CB PHE A 64 -0.012 4.882 -3.109 1.00 0.00 C ATOM 907 CG PHE A 64 0.034 3.444 -2.678 1.00 0.00 C ATOM 908 CD1 PHE A 64 0.345 2.444 -3.586 1.00 0.00 C ATOM 909 CD2 PHE A 64 -0.234 3.091 -1.366 1.00 0.00 C ATOM 910 CE1 PHE A 64 0.386 1.120 -3.193 1.00 0.00 C ATOM 911 CE2 PHE A 64 -0.193 1.768 -0.966 1.00 0.00 C ATOM 912 CZ PHE A 64 0.118 0.782 -1.881 1.00 0.00 C ATOM 0 H PHE A 64 1.535 5.634 -1.318 1.00 0.00 H new ATOM 0 HA PHE A 64 1.930 4.777 -4.022 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -0.494 5.472 -2.329 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -0.633 4.966 -4.001 1.00 0.00 H new ATOM 0 HD1 PHE A 64 0.558 2.703 -4.613 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -0.478 3.858 -0.646 1.00 0.00 H new ATOM 0 HE1 PHE A 64 0.627 0.350 -3.911 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.404 1.506 0.060 1.00 0.00 H new ATOM 0 HZ PHE A 64 0.152 -0.252 -1.571 1.00 0.00 H new ATOM 922 N ALA A 65 0.985 6.684 -5.472 1.00 0.00 N ATOM 923 CA ALA A 65 0.821 7.861 -6.314 1.00 0.00 C ATOM 924 C ALA A 65 -0.170 8.843 -5.698 1.00 0.00 C ATOM 925 O ALA A 65 -0.039 10.056 -5.860 1.00 0.00 O ATOM 926 CB ALA A 65 0.365 7.453 -7.707 1.00 0.00 C ATOM 0 H ALA A 65 0.908 5.796 -5.968 1.00 0.00 H new ATOM 0 HA ALA A 65 1.787 8.360 -6.391 1.00 0.00 H new ATOM 0 HB1 ALA A 65 0.246 8.342 -8.326 1.00 0.00 H new ATOM 0 HB2 ALA A 65 1.110 6.795 -8.156 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -0.588 6.929 -7.639 1.00 0.00 H new ATOM 932 N SER A 66 -1.162 8.311 -4.992 1.00 0.00 N ATOM 933 CA SER A 66 -2.179 9.140 -4.355 1.00 0.00 C ATOM 934 C SER A 66 -3.012 8.321 -3.374 1.00 0.00 C ATOM 935 O SER A 66 -2.926 7.094 -3.345 1.00 0.00 O ATOM 936 CB SER A 66 -3.087 9.771 -5.411 1.00 0.00 C ATOM 937 OG SER A 66 -3.655 8.782 -6.252 1.00 0.00 O ATOM 0 H SER A 66 -1.284 7.309 -4.846 1.00 0.00 H new ATOM 0 HA SER A 66 -1.673 9.931 -3.802 1.00 0.00 H new ATOM 0 HB2 SER A 66 -3.880 10.336 -4.922 1.00 0.00 H new ATOM 0 HB3 SER A 66 -2.515 10.478 -6.011 1.00 0.00 H new ATOM 0 HG SER A 66 -3.960 9.197 -7.086 1.00 0.00 H new ATOM 943 N GLN A 67 -3.818 9.011 -2.572 1.00 0.00 N ATOM 944 CA GLN A 67 -4.666 8.347 -1.589 1.00 0.00 C ATOM 945 C GLN A 67 -5.602 7.349 -2.263 1.00 0.00 C ATOM 946 O GLN A 67 -5.763 6.223 -1.795 1.00 0.00 O ATOM 947 CB GLN A 67 -5.480 9.380 -0.808 1.00 0.00 C ATOM 948 CG GLN A 67 -5.827 8.940 0.605 1.00 0.00 C ATOM 949 CD GLN A 67 -7.311 8.693 0.792 1.00 0.00 C ATOM 950 OE1 GLN A 67 -8.138 9.554 0.490 1.00 0.00 O ATOM 951 NE2 GLN A 67 -7.657 7.512 1.292 1.00 0.00 N ATOM 0 H GLN A 67 -3.901 10.028 -2.584 1.00 0.00 H new ATOM 0 HA GLN A 67 -4.022 7.803 -0.898 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -4.918 10.313 -0.761 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -6.402 9.590 -1.351 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -5.278 8.029 0.843 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -5.498 9.703 1.310 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -6.938 6.828 1.528 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -8.641 7.289 1.440 1.00 0.00 H new ATOM 960 N GLU A 68 -6.215 7.771 -3.364 1.00 0.00 N ATOM 961 CA GLU A 68 -7.136 6.913 -4.101 1.00 0.00 C ATOM 962 C GLU A 68 -6.517 5.540 -4.352 1.00 0.00 C ATOM 963 O GLU A 68 -7.222 4.533 -4.420 1.00 0.00 O ATOM 964 CB GLU A 68 -7.519 7.563 -5.432 1.00 0.00 C ATOM 965 CG GLU A 68 -6.348 8.201 -6.157 1.00 0.00 C ATOM 966 CD GLU A 68 -6.673 8.551 -7.597 1.00 0.00 C ATOM 967 OE1 GLU A 68 -7.261 9.627 -7.829 1.00 0.00 O ATOM 968 OE2 GLU A 68 -6.338 7.747 -8.492 1.00 0.00 O ATOM 0 H GLU A 68 -6.091 8.701 -3.765 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.034 6.783 -3.497 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -7.969 6.809 -6.079 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -8.280 8.322 -5.250 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -6.046 9.104 -5.627 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -5.498 7.520 -6.136 1.00 0.00 H new ATOM 975 N ILE A 69 -5.196 5.510 -4.490 1.00 0.00 N ATOM 976 CA ILE A 69 -4.482 4.262 -4.734 1.00 0.00 C ATOM 977 C ILE A 69 -4.047 3.614 -3.424 1.00 0.00 C ATOM 978 O ILE A 69 -3.786 2.412 -3.371 1.00 0.00 O ATOM 979 CB ILE A 69 -3.243 4.486 -5.620 1.00 0.00 C ATOM 980 CG1 ILE A 69 -3.659 5.026 -6.990 1.00 0.00 C ATOM 981 CG2 ILE A 69 -2.459 3.192 -5.771 1.00 0.00 C ATOM 982 CD1 ILE A 69 -2.494 5.487 -7.838 1.00 0.00 C ATOM 0 H ILE A 69 -4.598 6.335 -4.437 1.00 0.00 H new ATOM 0 HA ILE A 69 -5.173 3.598 -5.253 1.00 0.00 H new ATOM 0 HB ILE A 69 -2.600 5.224 -5.140 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -4.204 4.250 -7.527 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -4.347 5.859 -6.849 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -1.586 3.367 -6.400 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -2.135 2.846 -4.789 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -3.093 2.434 -6.232 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -2.864 5.857 -8.794 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -1.962 6.286 -7.321 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -1.816 4.651 -8.010 1.00 0.00 H new ATOM 994 N ALA A 70 -3.972 4.417 -2.369 1.00 0.00 N ATOM 995 CA ALA A 70 -3.572 3.921 -1.058 1.00 0.00 C ATOM 996 C ALA A 70 -4.652 3.029 -0.455 1.00 0.00 C ATOM 997 O ALA A 70 -4.362 1.949 0.057 1.00 0.00 O ATOM 998 CB ALA A 70 -3.262 5.084 -0.125 1.00 0.00 C ATOM 0 H ALA A 70 -4.183 5.415 -2.396 1.00 0.00 H new ATOM 0 HA ALA A 70 -2.671 3.321 -1.184 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -2.965 4.699 0.850 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -2.450 5.679 -0.543 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -4.149 5.708 -0.014 1.00 0.00 H new ATOM 1004 N GLU A 71 -5.897 3.491 -0.519 1.00 0.00 N ATOM 1005 CA GLU A 71 -7.019 2.734 0.022 1.00 0.00 C ATOM 1006 C GLU A 71 -7.115 1.359 -0.632 1.00 0.00 C ATOM 1007 O GLU A 71 -7.371 0.357 0.037 1.00 0.00 O ATOM 1008 CB GLU A 71 -8.327 3.501 -0.185 1.00 0.00 C ATOM 1009 CG GLU A 71 -8.543 4.618 0.823 1.00 0.00 C ATOM 1010 CD GLU A 71 -9.980 4.702 1.301 1.00 0.00 C ATOM 1011 OE1 GLU A 71 -10.530 3.660 1.715 1.00 0.00 O ATOM 1012 OE2 GLU A 71 -10.554 5.811 1.262 1.00 0.00 O ATOM 0 H GLU A 71 -6.153 4.384 -0.939 1.00 0.00 H new ATOM 0 HA GLU A 71 -6.850 2.598 1.090 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -8.336 3.923 -1.190 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -9.162 2.802 -0.125 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -7.888 4.461 1.680 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -8.257 5.569 0.373 1.00 0.00 H new ATOM 1019 N LYS A 72 -6.908 1.318 -1.944 1.00 0.00 N ATOM 1020 CA LYS A 72 -6.969 0.068 -2.691 1.00 0.00 C ATOM 1021 C LYS A 72 -5.982 -0.951 -2.130 1.00 0.00 C ATOM 1022 O LYS A 72 -6.260 -2.149 -2.103 1.00 0.00 O ATOM 1023 CB LYS A 72 -6.673 0.319 -4.171 1.00 0.00 C ATOM 1024 CG LYS A 72 -7.564 1.377 -4.799 1.00 0.00 C ATOM 1025 CD LYS A 72 -7.762 1.129 -6.285 1.00 0.00 C ATOM 1026 CE LYS A 72 -6.605 1.684 -7.101 1.00 0.00 C ATOM 1027 NZ LYS A 72 -7.065 2.673 -8.115 1.00 0.00 N ATOM 0 H LYS A 72 -6.696 2.138 -2.512 1.00 0.00 H new ATOM 0 HA LYS A 72 -7.977 -0.336 -2.592 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -5.632 0.623 -4.278 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -6.791 -0.615 -4.720 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -8.532 1.383 -4.298 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -7.122 2.362 -4.649 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -7.857 0.058 -6.467 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -8.694 1.591 -6.611 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -5.884 2.157 -6.434 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -6.088 0.865 -7.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -6.247 3.028 -8.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -7.734 2.216 -8.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -7.536 3.467 -7.637 1.00 0.00 H new ATOM 1041 N ALA A 73 -4.830 -0.464 -1.680 1.00 0.00 N ATOM 1042 CA ALA A 73 -3.803 -1.332 -1.116 1.00 0.00 C ATOM 1043 C ALA A 73 -4.111 -1.673 0.339 1.00 0.00 C ATOM 1044 O ALA A 73 -3.667 -2.700 0.854 1.00 0.00 O ATOM 1045 CB ALA A 73 -2.436 -0.673 -1.227 1.00 0.00 C ATOM 0 H ALA A 73 -4.585 0.526 -1.695 1.00 0.00 H new ATOM 0 HA ALA A 73 -3.794 -2.261 -1.686 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -1.679 -1.332 -0.802 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -2.207 -0.485 -2.276 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -2.442 0.271 -0.683 1.00 0.00 H new ATOM 1051 N LEU A 74 -4.873 -0.805 0.996 1.00 0.00 N ATOM 1052 CA LEU A 74 -5.239 -1.014 2.393 1.00 0.00 C ATOM 1053 C LEU A 74 -6.008 -2.320 2.564 1.00 0.00 C ATOM 1054 O LEU A 74 -5.799 -3.053 3.531 1.00 0.00 O ATOM 1055 CB LEU A 74 -6.083 0.158 2.899 1.00 0.00 C ATOM 1056 CG LEU A 74 -5.341 1.212 3.721 1.00 0.00 C ATOM 1057 CD1 LEU A 74 -6.274 2.356 4.088 1.00 0.00 C ATOM 1058 CD2 LEU A 74 -4.742 0.588 4.973 1.00 0.00 C ATOM 0 H LEU A 74 -5.249 0.049 0.584 1.00 0.00 H new ATOM 0 HA LEU A 74 -4.322 -1.074 2.979 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -6.538 0.650 2.039 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -6.896 -0.241 3.505 1.00 0.00 H new ATOM 0 HG LEU A 74 -4.529 1.612 3.115 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -5.729 3.097 4.673 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -6.655 2.821 3.179 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -7.107 1.971 4.676 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -4.218 1.353 5.546 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -5.538 0.160 5.583 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -4.041 -0.197 4.689 1.00 0.00 H new ATOM 1070 N LYS A 75 -6.895 -2.607 1.618 1.00 0.00 N ATOM 1071 CA LYS A 75 -7.693 -3.827 1.662 1.00 0.00 C ATOM 1072 C LYS A 75 -6.799 -5.063 1.659 1.00 0.00 C ATOM 1073 O LYS A 75 -7.242 -6.164 1.988 1.00 0.00 O ATOM 1074 CB LYS A 75 -8.652 -3.876 0.471 1.00 0.00 C ATOM 1075 CG LYS A 75 -9.573 -2.670 0.380 1.00 0.00 C ATOM 1076 CD LYS A 75 -10.927 -2.955 1.007 1.00 0.00 C ATOM 1077 CE LYS A 75 -12.045 -2.229 0.273 1.00 0.00 C ATOM 1078 NZ LYS A 75 -12.592 -1.099 1.074 1.00 0.00 N ATOM 0 H LYS A 75 -7.080 -2.011 0.811 1.00 0.00 H new ATOM 0 HA LYS A 75 -8.270 -3.820 2.586 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.072 -3.950 -0.449 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -9.257 -4.780 0.540 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -9.111 -1.819 0.881 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -9.706 -2.391 -0.665 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -11.117 -4.028 0.992 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -10.917 -2.647 2.053 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -11.670 -1.852 -0.678 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -12.845 -2.932 0.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -13.351 -0.630 0.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -12.973 -1.462 1.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -11.834 -0.415 1.272 1.00 0.00 H new ATOM 1092 N LYS A 76 -5.537 -4.873 1.286 1.00 0.00 N ATOM 1093 CA LYS A 76 -4.579 -5.971 1.243 1.00 0.00 C ATOM 1094 C LYS A 76 -3.911 -6.164 2.600 1.00 0.00 C ATOM 1095 O LYS A 76 -2.750 -6.565 2.681 1.00 0.00 O ATOM 1096 CB LYS A 76 -3.517 -5.706 0.174 1.00 0.00 C ATOM 1097 CG LYS A 76 -4.083 -5.151 -1.122 1.00 0.00 C ATOM 1098 CD LYS A 76 -2.999 -4.519 -1.978 1.00 0.00 C ATOM 1099 CE LYS A 76 -2.025 -5.562 -2.505 1.00 0.00 C ATOM 1100 NZ LYS A 76 -2.158 -5.753 -3.976 1.00 0.00 N ATOM 0 H LYS A 76 -5.155 -3.969 1.009 1.00 0.00 H new ATOM 0 HA LYS A 76 -5.121 -6.883 0.991 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -2.783 -5.004 0.570 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -2.988 -6.635 -0.039 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -4.568 -5.951 -1.680 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -4.849 -4.409 -0.897 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -3.456 -3.991 -2.815 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -2.457 -3.777 -1.391 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -1.005 -5.258 -2.269 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -2.200 -6.511 -1.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -1.285 -6.175 -4.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -2.961 -6.384 -4.173 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -2.321 -4.833 -4.432 1.00 0.00 H new ATOM 1114 N HIS A 77 -4.654 -5.879 3.666 1.00 0.00 N ATOM 1115 CA HIS A 77 -4.133 -6.023 5.021 1.00 0.00 C ATOM 1116 C HIS A 77 -4.052 -7.494 5.418 1.00 0.00 C ATOM 1117 O HIS A 77 -4.829 -8.321 4.939 1.00 0.00 O ATOM 1118 CB HIS A 77 -5.015 -5.263 6.013 1.00 0.00 C ATOM 1119 CG HIS A 77 -4.809 -5.677 7.437 1.00 0.00 C ATOM 1120 ND1 HIS A 77 -3.962 -5.011 8.299 1.00 0.00 N ATOM 1121 CD2 HIS A 77 -5.346 -6.694 8.151 1.00 0.00 C ATOM 1122 CE1 HIS A 77 -3.987 -5.603 9.480 1.00 0.00 C ATOM 1123 NE2 HIS A 77 -4.820 -6.626 9.417 1.00 0.00 N ATOM 0 H HIS A 77 -5.617 -5.547 3.617 1.00 0.00 H new ATOM 0 HA HIS A 77 -3.128 -5.602 5.044 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -4.814 -4.196 5.921 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -6.061 -5.415 5.747 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -6.056 -7.424 7.791 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -3.422 -5.301 10.350 1.00 0.00 H new ATOM 0 HE2 HIS A 77 -5.037 -7.262 10.184 1.00 0.00 H new ATOM 1131 N LYS A 78 -3.108 -7.814 6.295 1.00 0.00 N ATOM 1132 CA LYS A 78 -2.924 -9.185 6.757 1.00 0.00 C ATOM 1133 C LYS A 78 -2.481 -10.090 5.613 1.00 0.00 C ATOM 1134 O LYS A 78 -2.375 -11.306 5.777 1.00 0.00 O ATOM 1135 CB LYS A 78 -4.223 -9.717 7.368 1.00 0.00 C ATOM 1136 CG LYS A 78 -4.171 -9.861 8.879 1.00 0.00 C ATOM 1137 CD LYS A 78 -3.082 -10.830 9.310 1.00 0.00 C ATOM 1138 CE LYS A 78 -3.247 -11.243 10.764 1.00 0.00 C ATOM 1139 NZ LYS A 78 -2.225 -12.245 11.175 1.00 0.00 N ATOM 0 H LYS A 78 -2.457 -7.142 6.701 1.00 0.00 H new ATOM 0 HA LYS A 78 -2.144 -9.184 7.519 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -5.040 -9.046 7.103 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -4.451 -10.687 6.927 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -3.992 -8.886 9.332 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -5.136 -10.211 9.246 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -3.108 -11.715 8.674 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -2.105 -10.367 9.171 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -3.170 -10.363 11.403 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -4.244 -11.659 10.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -2.641 -12.903 11.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -1.904 -12.776 10.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -1.415 -11.757 11.607 1.00 0.00 H new ATOM 1153 N GLU A 79 -2.220 -9.490 4.456 1.00 0.00 N ATOM 1154 CA GLU A 79 -1.786 -10.243 3.286 1.00 0.00 C ATOM 1155 C GLU A 79 -0.368 -10.774 3.476 1.00 0.00 C ATOM 1156 O GLU A 79 0.590 -10.004 3.551 1.00 0.00 O ATOM 1157 CB GLU A 79 -1.851 -9.366 2.034 1.00 0.00 C ATOM 1158 CG GLU A 79 -3.262 -9.150 1.515 1.00 0.00 C ATOM 1159 CD GLU A 79 -3.572 -9.999 0.298 1.00 0.00 C ATOM 1160 OE1 GLU A 79 -3.883 -11.197 0.474 1.00 0.00 O ATOM 1161 OE2 GLU A 79 -3.503 -9.469 -0.831 1.00 0.00 O ATOM 0 H GLU A 79 -2.302 -8.485 4.304 1.00 0.00 H new ATOM 0 HA GLU A 79 -2.459 -11.091 3.161 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -1.402 -8.398 2.255 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -1.250 -9.824 1.248 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -3.975 -9.381 2.306 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -3.395 -8.098 1.263 1.00 0.00 H new ATOM 1168 N ARG A 80 -0.242 -12.095 3.552 1.00 0.00 N ATOM 1169 CA ARG A 80 1.058 -12.730 3.734 1.00 0.00 C ATOM 1170 C ARG A 80 1.811 -12.815 2.411 1.00 0.00 C ATOM 1171 O ARG A 80 1.214 -13.038 1.358 1.00 0.00 O ATOM 1172 CB ARG A 80 0.887 -14.130 4.326 1.00 0.00 C ATOM 1173 CG ARG A 80 0.302 -15.137 3.350 1.00 0.00 C ATOM 1174 CD ARG A 80 1.377 -16.054 2.786 1.00 0.00 C ATOM 1175 NE ARG A 80 0.820 -17.066 1.892 1.00 0.00 N ATOM 1176 CZ ARG A 80 0.576 -16.853 0.603 1.00 0.00 C ATOM 1177 NH1 ARG A 80 0.841 -15.673 0.061 1.00 0.00 N ATOM 1178 NH2 ARG A 80 0.069 -17.823 -0.146 1.00 0.00 N ATOM 0 H ARG A 80 -1.024 -12.746 3.490 1.00 0.00 H new ATOM 0 HA ARG A 80 1.639 -12.119 4.425 1.00 0.00 H new ATOM 0 HB2 ARG A 80 1.856 -14.491 4.670 1.00 0.00 H new ATOM 0 HB3 ARG A 80 0.241 -14.068 5.202 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -0.459 -15.733 3.853 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -0.193 -14.610 2.534 1.00 0.00 H new ATOM 0 HD2 ARG A 80 2.114 -15.459 2.246 1.00 0.00 H new ATOM 0 HD3 ARG A 80 1.902 -16.544 3.606 1.00 0.00 H new ATOM 0 HE ARG A 80 0.607 -17.986 2.278 1.00 0.00 H new ATOM 0 HH11 ARG A 80 1.233 -14.925 0.633 1.00 0.00 H new ATOM 0 HH12 ARG A 80 0.653 -15.512 -0.929 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -0.134 -18.733 0.267 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -0.118 -17.659 -1.135 1.00 0.00 H new ATOM 1192 N ILE A 81 3.126 -12.634 2.473 1.00 0.00 N ATOM 1193 CA ILE A 81 3.962 -12.692 1.279 1.00 0.00 C ATOM 1194 C ILE A 81 4.926 -13.872 1.338 1.00 0.00 C ATOM 1195 O ILE A 81 6.048 -13.745 1.826 1.00 0.00 O ATOM 1196 CB ILE A 81 4.769 -11.393 1.095 1.00 0.00 C ATOM 1197 CG1 ILE A 81 3.826 -10.205 0.894 1.00 0.00 C ATOM 1198 CG2 ILE A 81 5.723 -11.525 -0.083 1.00 0.00 C ATOM 1199 CD1 ILE A 81 4.467 -8.867 1.188 1.00 0.00 C ATOM 0 H ILE A 81 3.636 -12.446 3.336 1.00 0.00 H new ATOM 0 HA ILE A 81 3.291 -12.818 0.430 1.00 0.00 H new ATOM 0 HB ILE A 81 5.357 -11.217 1.996 1.00 0.00 H new ATOM 0 HG12 ILE A 81 3.466 -10.208 -0.135 1.00 0.00 H new ATOM 0 HG13 ILE A 81 2.955 -10.330 1.537 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.286 -10.599 -0.201 1.00 0.00 H new ATOM 0 HG22 ILE A 81 6.413 -12.349 0.098 1.00 0.00 H new ATOM 0 HG23 ILE A 81 5.154 -11.721 -0.992 1.00 0.00 H new ATOM 0 HD11 ILE A 81 3.740 -8.071 1.024 1.00 0.00 H new ATOM 0 HD12 ILE A 81 4.802 -8.844 2.225 1.00 0.00 H new ATOM 0 HD13 ILE A 81 5.321 -8.720 0.527 1.00 0.00 H new ATOM 1211 N GLY A 82 4.479 -15.019 0.836 1.00 0.00 N ATOM 1212 CA GLY A 82 5.316 -16.206 0.840 1.00 0.00 C ATOM 1213 C GLY A 82 5.029 -17.112 2.020 1.00 0.00 C ATOM 1214 O GLY A 82 4.953 -18.333 1.869 1.00 0.00 O ATOM 0 H GLY A 82 3.554 -15.148 0.427 1.00 0.00 H new ATOM 0 HA2 GLY A 82 5.161 -16.760 -0.086 1.00 0.00 H new ATOM 0 HA3 GLY A 82 6.364 -15.908 0.861 1.00 0.00 H new ATOM 1218 N HIS A 83 4.871 -16.518 3.197 1.00 0.00 N ATOM 1219 CA HIS A 83 4.592 -17.281 4.409 1.00 0.00 C ATOM 1220 C HIS A 83 4.724 -16.401 5.648 1.00 0.00 C ATOM 1221 O HIS A 83 5.285 -16.820 6.661 1.00 0.00 O ATOM 1222 CB HIS A 83 5.541 -18.476 4.514 1.00 0.00 C ATOM 1223 CG HIS A 83 6.940 -18.170 4.077 1.00 0.00 C ATOM 1224 ND1 HIS A 83 7.635 -17.057 4.501 1.00 0.00 N ATOM 1225 CD2 HIS A 83 7.775 -18.840 3.248 1.00 0.00 C ATOM 1226 CE1 HIS A 83 8.836 -17.055 3.951 1.00 0.00 C ATOM 1227 NE2 HIS A 83 8.947 -18.126 3.187 1.00 0.00 N ATOM 0 H HIS A 83 4.931 -15.510 3.339 1.00 0.00 H new ATOM 0 HA HIS A 83 3.566 -17.645 4.352 1.00 0.00 H new ATOM 0 HB2 HIS A 83 5.560 -18.825 5.546 1.00 0.00 H new ATOM 0 HB3 HIS A 83 5.151 -19.294 3.908 1.00 0.00 H new ATOM 0 HD2 HIS A 83 7.560 -19.764 2.731 1.00 0.00 H new ATOM 0 HE1 HIS A 83 9.598 -16.304 4.101 1.00 0.00 H new ATOM 0 HE2 HIS A 83 9.769 -18.382 2.640 1.00 0.00 H new ATOM 1235 N ARG A 84 4.204 -15.182 5.560 1.00 0.00 N ATOM 1236 CA ARG A 84 4.266 -14.243 6.674 1.00 0.00 C ATOM 1237 C ARG A 84 3.243 -13.124 6.499 1.00 0.00 C ATOM 1238 O ARG A 84 3.455 -12.192 5.722 1.00 0.00 O ATOM 1239 CB ARG A 84 5.671 -13.650 6.792 1.00 0.00 C ATOM 1240 CG ARG A 84 6.475 -14.216 7.952 1.00 0.00 C ATOM 1241 CD ARG A 84 6.293 -13.386 9.213 1.00 0.00 C ATOM 1242 NE ARG A 84 7.337 -13.654 10.199 1.00 0.00 N ATOM 1243 CZ ARG A 84 7.202 -13.410 11.497 1.00 0.00 C ATOM 1244 NH1 ARG A 84 6.072 -12.896 11.964 1.00 0.00 N ATOM 1245 NH2 ARG A 84 8.197 -13.681 12.332 1.00 0.00 N ATOM 0 H ARG A 84 3.735 -14.821 4.729 1.00 0.00 H new ATOM 0 HA ARG A 84 4.031 -14.787 7.589 1.00 0.00 H new ATOM 0 HB2 ARG A 84 6.212 -13.831 5.863 1.00 0.00 H new ATOM 0 HB3 ARG A 84 5.592 -12.569 6.909 1.00 0.00 H new ATOM 0 HG2 ARG A 84 6.166 -15.243 8.144 1.00 0.00 H new ATOM 0 HG3 ARG A 84 7.531 -14.246 7.684 1.00 0.00 H new ATOM 0 HD2 ARG A 84 6.301 -12.327 8.955 1.00 0.00 H new ATOM 0 HD3 ARG A 84 5.318 -13.600 9.650 1.00 0.00 H new ATOM 0 HE ARG A 84 8.218 -14.050 9.872 1.00 0.00 H new ATOM 0 HH11 ARG A 84 5.304 -12.687 11.325 1.00 0.00 H new ATOM 0 HH12 ARG A 84 5.971 -12.709 12.962 1.00 0.00 H new ATOM 0 HH21 ARG A 84 9.067 -14.077 11.977 1.00 0.00 H new ATOM 0 HH22 ARG A 84 8.092 -13.493 13.329 1.00 0.00 H new ATOM 1259 N TYR A 85 2.136 -13.222 7.225 1.00 0.00 N ATOM 1260 CA TYR A 85 1.080 -12.220 7.148 1.00 0.00 C ATOM 1261 C TYR A 85 1.659 -10.810 7.224 1.00 0.00 C ATOM 1262 O TYR A 85 2.556 -10.538 8.023 1.00 0.00 O ATOM 1263 CB TYR A 85 0.067 -12.428 8.274 1.00 0.00 C ATOM 1264 CG TYR A 85 -0.703 -13.725 8.165 1.00 0.00 C ATOM 1265 CD1 TYR A 85 -1.478 -14.004 7.046 1.00 0.00 C ATOM 1266 CD2 TYR A 85 -0.651 -14.674 9.180 1.00 0.00 C ATOM 1267 CE1 TYR A 85 -2.183 -15.187 6.943 1.00 0.00 C ATOM 1268 CE2 TYR A 85 -1.352 -15.861 9.083 1.00 0.00 C ATOM 1269 CZ TYR A 85 -2.117 -16.112 7.963 1.00 0.00 C ATOM 1270 OH TYR A 85 -2.816 -17.293 7.863 1.00 0.00 O ATOM 0 H TYR A 85 1.946 -13.986 7.874 1.00 0.00 H new ATOM 0 HA TYR A 85 0.576 -12.335 6.189 1.00 0.00 H new ATOM 0 HB2 TYR A 85 0.590 -12.405 9.230 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -0.637 -11.596 8.276 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -1.530 -13.283 6.243 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -0.053 -14.480 10.058 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -2.783 -15.387 6.068 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -1.301 -16.588 9.880 1.00 0.00 H new ATOM 0 HH TYR A 85 -2.661 -17.834 8.665 1.00 0.00 H new ATOM 1280 N ILE A 86 1.140 -9.918 6.387 1.00 0.00 N ATOM 1281 CA ILE A 86 1.604 -8.537 6.361 1.00 0.00 C ATOM 1282 C ILE A 86 0.514 -7.582 6.835 1.00 0.00 C ATOM 1283 O ILE A 86 -0.594 -7.574 6.299 1.00 0.00 O ATOM 1284 CB ILE A 86 2.055 -8.122 4.948 1.00 0.00 C ATOM 1285 CG1 ILE A 86 2.939 -9.207 4.331 1.00 0.00 C ATOM 1286 CG2 ILE A 86 2.795 -6.793 4.997 1.00 0.00 C ATOM 1287 CD1 ILE A 86 4.401 -9.079 4.699 1.00 0.00 C ATOM 0 H ILE A 86 0.399 -10.127 5.718 1.00 0.00 H new ATOM 0 HA ILE A 86 2.456 -8.477 7.038 1.00 0.00 H new ATOM 0 HB ILE A 86 1.171 -8.001 4.322 1.00 0.00 H new ATOM 0 HG12 ILE A 86 2.577 -10.184 4.650 1.00 0.00 H new ATOM 0 HG13 ILE A 86 2.841 -9.170 3.246 1.00 0.00 H new ATOM 0 HG21 ILE A 86 3.107 -6.513 3.991 1.00 0.00 H new ATOM 0 HG22 ILE A 86 2.136 -6.024 5.399 1.00 0.00 H new ATOM 0 HG23 ILE A 86 3.673 -6.889 5.636 1.00 0.00 H new ATOM 0 HD11 ILE A 86 4.967 -9.882 4.226 1.00 0.00 H new ATOM 0 HD12 ILE A 86 4.780 -8.117 4.355 1.00 0.00 H new ATOM 0 HD13 ILE A 86 4.511 -9.147 5.781 1.00 0.00 H new ATOM 1299 N GLU A 87 0.837 -6.777 7.842 1.00 0.00 N ATOM 1300 CA GLU A 87 -0.115 -5.817 8.388 1.00 0.00 C ATOM 1301 C GLU A 87 0.094 -4.434 7.774 1.00 0.00 C ATOM 1302 O GLU A 87 1.158 -3.832 7.924 1.00 0.00 O ATOM 1303 CB GLU A 87 0.022 -5.737 9.909 1.00 0.00 C ATOM 1304 CG GLU A 87 -0.400 -7.010 10.626 1.00 0.00 C ATOM 1305 CD GLU A 87 0.327 -7.207 11.941 1.00 0.00 C ATOM 1306 OE1 GLU A 87 0.464 -6.222 12.698 1.00 0.00 O ATOM 1307 OE2 GLU A 87 0.761 -8.346 12.215 1.00 0.00 O ATOM 0 H GLU A 87 1.750 -6.770 8.296 1.00 0.00 H new ATOM 0 HA GLU A 87 -1.120 -6.159 8.139 1.00 0.00 H new ATOM 0 HB2 GLU A 87 1.059 -5.515 10.161 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -0.580 -4.906 10.277 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -1.474 -6.980 10.810 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -0.211 -7.867 9.979 1.00 0.00 H new ATOM 1314 N ILE A 88 -0.928 -3.939 7.086 1.00 0.00 N ATOM 1315 CA ILE A 88 -0.857 -2.629 6.450 1.00 0.00 C ATOM 1316 C ILE A 88 -1.689 -1.603 7.212 1.00 0.00 C ATOM 1317 O ILE A 88 -2.842 -1.857 7.558 1.00 0.00 O ATOM 1318 CB ILE A 88 -1.343 -2.684 4.990 1.00 0.00 C ATOM 1319 CG1 ILE A 88 -0.474 -3.646 4.176 1.00 0.00 C ATOM 1320 CG2 ILE A 88 -1.323 -1.294 4.372 1.00 0.00 C ATOM 1321 CD1 ILE A 88 -1.263 -4.499 3.207 1.00 0.00 C ATOM 0 H ILE A 88 -1.815 -4.425 6.954 1.00 0.00 H new ATOM 0 HA ILE A 88 0.191 -2.328 6.464 1.00 0.00 H new ATOM 0 HB ILE A 88 -2.369 -3.051 4.978 1.00 0.00 H new ATOM 0 HG12 ILE A 88 0.268 -3.072 3.621 1.00 0.00 H new ATOM 0 HG13 ILE A 88 0.072 -4.297 4.859 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -1.669 -1.350 3.340 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -1.979 -0.634 4.940 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -0.307 -0.901 4.393 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -0.584 -5.156 2.664 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -1.987 -5.100 3.757 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -1.788 -3.856 2.500 1.00 0.00 H new ATOM 1333 N PHE A 89 -1.096 -0.442 7.470 1.00 0.00 N ATOM 1334 CA PHE A 89 -1.782 0.624 8.190 1.00 0.00 C ATOM 1335 C PHE A 89 -1.454 1.987 7.587 1.00 0.00 C ATOM 1336 O PHE A 89 -0.295 2.404 7.557 1.00 0.00 O ATOM 1337 CB PHE A 89 -1.393 0.602 9.670 1.00 0.00 C ATOM 1338 CG PHE A 89 -1.750 -0.681 10.363 1.00 0.00 C ATOM 1339 CD1 PHE A 89 -3.074 -1.060 10.510 1.00 0.00 C ATOM 1340 CD2 PHE A 89 -0.760 -1.508 10.870 1.00 0.00 C ATOM 1341 CE1 PHE A 89 -3.407 -2.241 11.148 1.00 0.00 C ATOM 1342 CE2 PHE A 89 -1.086 -2.691 11.509 1.00 0.00 C ATOM 1343 CZ PHE A 89 -2.411 -3.057 11.648 1.00 0.00 C ATOM 0 H PHE A 89 -0.141 -0.216 7.191 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.855 0.455 8.101 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.319 0.767 9.758 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.885 1.430 10.179 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.856 -0.425 10.121 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.277 -1.226 10.765 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -4.444 -2.525 11.255 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -0.306 -3.328 11.899 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.668 -3.980 12.147 1.00 0.00 H new ATOM 1353 N LYS A 90 -2.482 2.678 7.106 1.00 0.00 N ATOM 1354 CA LYS A 90 -2.306 3.994 6.503 1.00 0.00 C ATOM 1355 C LYS A 90 -1.310 4.829 7.302 1.00 0.00 C ATOM 1356 O LYS A 90 -1.322 4.817 8.533 1.00 0.00 O ATOM 1357 CB LYS A 90 -3.648 4.724 6.421 1.00 0.00 C ATOM 1358 CG LYS A 90 -4.061 5.082 5.004 1.00 0.00 C ATOM 1359 CD LYS A 90 -3.359 6.339 4.520 1.00 0.00 C ATOM 1360 CE LYS A 90 -3.983 6.869 3.239 1.00 0.00 C ATOM 1361 NZ LYS A 90 -3.598 8.283 2.976 1.00 0.00 N ATOM 0 H LYS A 90 -3.447 2.348 7.122 1.00 0.00 H new ATOM 0 HA LYS A 90 -1.913 3.855 5.496 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -4.420 4.098 6.868 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -3.593 5.636 7.016 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -3.827 4.253 4.336 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -5.140 5.229 4.965 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -3.408 7.105 5.294 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -2.304 6.125 4.350 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -3.673 6.246 2.400 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -5.068 6.795 3.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -3.499 8.431 1.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -4.333 8.918 3.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -2.692 8.489 3.444 1.00 0.00 H new ATOM 1375 N SER A 91 -0.450 5.553 6.593 1.00 0.00 N ATOM 1376 CA SER A 91 0.554 6.392 7.236 1.00 0.00 C ATOM 1377 C SER A 91 0.781 7.674 6.442 1.00 0.00 C ATOM 1378 O SER A 91 0.130 7.910 5.424 1.00 0.00 O ATOM 1379 CB SER A 91 1.872 5.628 7.379 1.00 0.00 C ATOM 1380 OG SER A 91 2.820 6.378 8.120 1.00 0.00 O ATOM 0 H SER A 91 -0.428 5.575 5.573 1.00 0.00 H new ATOM 0 HA SER A 91 0.187 6.659 8.227 1.00 0.00 H new ATOM 0 HB2 SER A 91 1.691 4.674 7.875 1.00 0.00 H new ATOM 0 HB3 SER A 91 2.274 5.403 6.391 1.00 0.00 H new ATOM 0 HG SER A 91 3.652 5.867 8.198 1.00 0.00 H new ATOM 1386 N SER A 92 1.709 8.500 6.915 1.00 0.00 N ATOM 1387 CA SER A 92 2.020 9.761 6.252 1.00 0.00 C ATOM 1388 C SER A 92 3.525 10.013 6.242 1.00 0.00 C ATOM 1389 O SER A 92 4.249 9.542 7.118 1.00 0.00 O ATOM 1390 CB SER A 92 1.301 10.918 6.947 1.00 0.00 C ATOM 1391 OG SER A 92 -0.014 11.077 6.446 1.00 0.00 O ATOM 0 H SER A 92 2.259 8.318 7.755 1.00 0.00 H new ATOM 0 HA SER A 92 1.674 9.696 5.220 1.00 0.00 H new ATOM 0 HB2 SER A 92 1.264 10.735 8.021 1.00 0.00 H new ATOM 0 HB3 SER A 92 1.863 11.840 6.800 1.00 0.00 H new ATOM 0 HG SER A 92 -0.452 11.822 6.908 1.00 0.00 H new ATOM 1397 N ARG A 93 3.987 10.761 5.245 1.00 0.00 N ATOM 1398 CA ARG A 93 5.405 11.076 5.120 1.00 0.00 C ATOM 1399 C ARG A 93 5.972 11.568 6.449 1.00 0.00 C ATOM 1400 O ARG A 93 7.152 11.377 6.741 1.00 0.00 O ATOM 1401 CB ARG A 93 5.619 12.137 4.038 1.00 0.00 C ATOM 1402 CG ARG A 93 7.068 12.575 3.895 1.00 0.00 C ATOM 1403 CD ARG A 93 7.716 11.962 2.663 1.00 0.00 C ATOM 1404 NE ARG A 93 9.083 12.438 2.470 1.00 0.00 N ATOM 1405 CZ ARG A 93 9.751 12.311 1.328 1.00 0.00 C ATOM 1406 NH1 ARG A 93 9.181 11.726 0.284 1.00 0.00 N ATOM 1407 NH2 ARG A 93 10.992 12.770 1.231 1.00 0.00 N ATOM 0 H ARG A 93 3.400 11.160 4.512 1.00 0.00 H new ATOM 0 HA ARG A 93 5.931 10.165 4.836 1.00 0.00 H new ATOM 0 HB2 ARG A 93 5.270 11.745 3.082 1.00 0.00 H new ATOM 0 HB3 ARG A 93 5.006 13.008 4.268 1.00 0.00 H new ATOM 0 HG2 ARG A 93 7.116 13.662 3.830 1.00 0.00 H new ATOM 0 HG3 ARG A 93 7.627 12.284 4.784 1.00 0.00 H new ATOM 0 HD2 ARG A 93 7.720 10.876 2.758 1.00 0.00 H new ATOM 0 HD3 ARG A 93 7.121 12.203 1.782 1.00 0.00 H new ATOM 0 HE ARG A 93 9.551 12.893 3.254 1.00 0.00 H new ATOM 0 HH11 ARG A 93 8.227 11.372 0.356 1.00 0.00 H new ATOM 0 HH12 ARG A 93 9.696 11.630 -0.591 1.00 0.00 H new ATOM 0 HH21 ARG A 93 11.433 13.220 2.033 1.00 0.00 H new ATOM 0 HH22 ARG A 93 11.505 12.673 0.355 1.00 0.00 H new ATOM 1421 N ALA A 94 5.122 12.202 7.251 1.00 0.00 N ATOM 1422 CA ALA A 94 5.537 12.718 8.548 1.00 0.00 C ATOM 1423 C ALA A 94 5.778 11.585 9.540 1.00 0.00 C ATOM 1424 O ALA A 94 6.643 11.683 10.409 1.00 0.00 O ATOM 1425 CB ALA A 94 4.493 13.685 9.091 1.00 0.00 C ATOM 0 H ALA A 94 4.142 12.370 7.024 1.00 0.00 H new ATOM 0 HA ALA A 94 6.477 13.253 8.413 1.00 0.00 H new ATOM 0 HB1 ALA A 94 4.817 14.063 10.061 1.00 0.00 H new ATOM 0 HB2 ALA A 94 4.374 14.518 8.398 1.00 0.00 H new ATOM 0 HB3 ALA A 94 3.540 13.167 9.203 1.00 0.00 H new ATOM 1431 N GLU A 95 5.005 10.512 9.403 1.00 0.00 N ATOM 1432 CA GLU A 95 5.135 9.361 10.289 1.00 0.00 C ATOM 1433 C GLU A 95 6.429 8.602 10.010 1.00 0.00 C ATOM 1434 O GLU A 95 7.116 8.164 10.933 1.00 0.00 O ATOM 1435 CB GLU A 95 3.936 8.425 10.123 1.00 0.00 C ATOM 1436 CG GLU A 95 3.102 8.274 11.385 1.00 0.00 C ATOM 1437 CD GLU A 95 3.426 7.007 12.150 1.00 0.00 C ATOM 1438 OE1 GLU A 95 3.591 5.950 11.504 1.00 0.00 O ATOM 1439 OE2 GLU A 95 3.513 7.070 13.395 1.00 0.00 O ATOM 0 H GLU A 95 4.284 10.416 8.688 1.00 0.00 H new ATOM 0 HA GLU A 95 5.163 9.726 11.316 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.301 8.801 9.321 1.00 0.00 H new ATOM 0 HB3 GLU A 95 4.293 7.443 9.814 1.00 0.00 H new ATOM 0 HG2 GLU A 95 3.268 9.136 12.031 1.00 0.00 H new ATOM 0 HG3 GLU A 95 2.045 8.273 11.119 1.00 0.00 H new ATOM 1446 N VAL A 96 6.755 8.451 8.730 1.00 0.00 N ATOM 1447 CA VAL A 96 7.966 7.745 8.329 1.00 0.00 C ATOM 1448 C VAL A 96 9.175 8.675 8.348 1.00 0.00 C ATOM 1449 O VAL A 96 9.249 9.631 7.576 1.00 0.00 O ATOM 1450 CB VAL A 96 7.822 7.139 6.920 1.00 0.00 C ATOM 1451 CG1 VAL A 96 7.428 8.211 5.915 1.00 0.00 C ATOM 1452 CG2 VAL A 96 9.112 6.452 6.501 1.00 0.00 C ATOM 0 H VAL A 96 6.198 8.808 7.954 1.00 0.00 H new ATOM 0 HA VAL A 96 8.117 6.941 9.049 1.00 0.00 H new ATOM 0 HB VAL A 96 7.030 6.390 6.945 1.00 0.00 H new ATOM 0 HG11 VAL A 96 7.331 7.764 4.926 1.00 0.00 H new ATOM 0 HG12 VAL A 96 6.476 8.653 6.209 1.00 0.00 H new ATOM 0 HG13 VAL A 96 8.195 8.985 5.890 1.00 0.00 H new ATOM 0 HG21 VAL A 96 8.992 6.030 5.503 1.00 0.00 H new ATOM 0 HG22 VAL A 96 9.925 7.178 6.492 1.00 0.00 H new ATOM 0 HG23 VAL A 96 9.345 5.655 7.207 1.00 0.00 H new ATOM 1462 N ARG A 97 10.121 8.386 9.236 1.00 0.00 N ATOM 1463 CA ARG A 97 11.327 9.196 9.357 1.00 0.00 C ATOM 1464 C ARG A 97 11.761 9.732 7.995 1.00 0.00 C ATOM 1465 O ARG A 97 11.883 8.978 7.030 1.00 0.00 O ATOM 1466 CB ARG A 97 12.459 8.375 9.978 1.00 0.00 C ATOM 1467 CG ARG A 97 12.091 7.743 11.311 1.00 0.00 C ATOM 1468 CD ARG A 97 11.531 6.342 11.126 1.00 0.00 C ATOM 1469 NE ARG A 97 12.428 5.319 11.659 1.00 0.00 N ATOM 1470 CZ ARG A 97 12.774 5.239 12.939 1.00 0.00 C ATOM 1471 NH1 ARG A 97 12.299 6.116 13.814 1.00 0.00 N ATOM 1472 NH2 ARG A 97 13.595 4.280 13.347 1.00 0.00 N ATOM 0 H ARG A 97 10.075 7.598 9.882 1.00 0.00 H new ATOM 0 HA ARG A 97 11.102 10.042 10.007 1.00 0.00 H new ATOM 0 HB2 ARG A 97 12.752 7.589 9.281 1.00 0.00 H new ATOM 0 HB3 ARG A 97 13.328 9.017 10.117 1.00 0.00 H new ATOM 0 HG2 ARG A 97 12.972 7.702 11.951 1.00 0.00 H new ATOM 0 HG3 ARG A 97 11.355 8.366 11.820 1.00 0.00 H new ATOM 0 HD2 ARG A 97 10.563 6.270 11.622 1.00 0.00 H new ATOM 0 HD3 ARG A 97 11.360 6.157 10.066 1.00 0.00 H new ATOM 0 HE ARG A 97 12.809 4.628 11.013 1.00 0.00 H new ATOM 0 HH11 ARG A 97 11.667 6.854 13.504 1.00 0.00 H new ATOM 0 HH12 ARG A 97 12.566 6.052 14.796 1.00 0.00 H new ATOM 0 HH21 ARG A 97 13.961 3.603 12.678 1.00 0.00 H new ATOM 0 HH22 ARG A 97 13.860 4.220 14.330 1.00 0.00 H new ATOM 1486 N THR A 98 11.994 11.039 7.926 1.00 0.00 N ATOM 1487 CA THR A 98 12.413 11.676 6.684 1.00 0.00 C ATOM 1488 C THR A 98 13.297 12.886 6.958 1.00 0.00 C ATOM 1489 O THR A 98 13.239 13.885 6.240 1.00 0.00 O ATOM 1490 CB THR A 98 11.201 12.119 5.844 1.00 0.00 C ATOM 1491 OG1 THR A 98 11.643 12.849 4.694 1.00 0.00 O ATOM 1492 CG2 THR A 98 10.258 12.984 6.667 1.00 0.00 C ATOM 0 H THR A 98 11.900 11.677 8.716 1.00 0.00 H new ATOM 0 HA THR A 98 12.982 10.934 6.124 1.00 0.00 H new ATOM 0 HB THR A 98 10.664 11.226 5.524 1.00 0.00 H new ATOM 0 HG1 THR A 98 12.083 13.676 4.981 1.00 0.00 H new ATOM 0 HG21 THR A 98 9.410 13.284 6.052 1.00 0.00 H new ATOM 0 HG22 THR A 98 9.900 12.417 7.526 1.00 0.00 H new ATOM 0 HG23 THR A 98 10.787 13.872 7.013 1.00 0.00 H new ATOM 1500 N SER A 99 14.116 12.792 8.001 1.00 0.00 N ATOM 1501 CA SER A 99 15.011 13.882 8.372 1.00 0.00 C ATOM 1502 C SER A 99 16.449 13.563 7.974 1.00 0.00 C ATOM 1503 O SER A 99 17.059 14.279 7.182 1.00 0.00 O ATOM 1504 CB SER A 99 14.932 14.145 9.876 1.00 0.00 C ATOM 1505 OG SER A 99 15.425 15.435 10.194 1.00 0.00 O ATOM 0 H SER A 99 14.178 11.972 8.604 1.00 0.00 H new ATOM 0 HA SER A 99 14.695 14.778 7.837 1.00 0.00 H new ATOM 0 HB2 SER A 99 13.899 14.054 10.211 1.00 0.00 H new ATOM 0 HB3 SER A 99 15.508 13.390 10.411 1.00 0.00 H new ATOM 0 HG SER A 99 15.362 15.580 11.161 1.00 0.00 H new ATOM 1511 N GLY A 100 16.984 12.481 8.532 1.00 0.00 N ATOM 1512 CA GLY A 100 18.346 12.085 8.224 1.00 0.00 C ATOM 1513 C GLY A 100 19.373 13.009 8.847 1.00 0.00 C ATOM 1514 O GLY A 100 19.036 13.999 9.497 1.00 0.00 O ATOM 0 H GLY A 100 16.499 11.872 9.191 1.00 0.00 H new ATOM 0 HA2 GLY A 100 18.514 11.068 8.578 1.00 0.00 H new ATOM 0 HA3 GLY A 100 18.482 12.072 7.143 1.00 0.00 H new ATOM 1518 N PRO A 101 20.662 12.688 8.650 1.00 0.00 N ATOM 1519 CA PRO A 101 21.767 13.483 9.190 1.00 0.00 C ATOM 1520 C PRO A 101 21.898 14.838 8.501 1.00 0.00 C ATOM 1521 O PRO A 101 22.328 15.817 9.111 1.00 0.00 O ATOM 1522 CB PRO A 101 22.998 12.618 8.909 1.00 0.00 C ATOM 1523 CG PRO A 101 22.611 11.778 7.741 1.00 0.00 C ATOM 1524 CD PRO A 101 21.136 11.522 7.886 1.00 0.00 C ATOM 0 HA PRO A 101 21.624 13.714 10.246 1.00 0.00 H new ATOM 0 HB2 PRO A 101 23.870 13.232 8.684 1.00 0.00 H new ATOM 0 HB3 PRO A 101 23.255 12.003 9.771 1.00 0.00 H new ATOM 0 HG2 PRO A 101 22.828 12.290 6.803 1.00 0.00 H new ATOM 0 HG3 PRO A 101 23.170 10.843 7.731 1.00 0.00 H new ATOM 0 HD2 PRO A 101 20.643 11.449 6.916 1.00 0.00 H new ATOM 0 HD3 PRO A 101 20.940 10.589 8.414 1.00 0.00 H new ATOM 1532 N SER A 102 21.525 14.885 7.226 1.00 0.00 N ATOM 1533 CA SER A 102 21.604 16.119 6.453 1.00 0.00 C ATOM 1534 C SER A 102 22.995 16.736 6.555 1.00 0.00 C ATOM 1535 O SER A 102 23.859 16.232 7.273 1.00 0.00 O ATOM 1536 CB SER A 102 20.553 17.118 6.938 1.00 0.00 C ATOM 1537 OG SER A 102 19.452 17.173 6.048 1.00 0.00 O ATOM 0 H SER A 102 21.166 14.084 6.707 1.00 0.00 H new ATOM 0 HA SER A 102 21.409 15.877 5.408 1.00 0.00 H new ATOM 0 HB2 SER A 102 20.207 16.833 7.932 1.00 0.00 H new ATOM 0 HB3 SER A 102 21.002 18.107 7.028 1.00 0.00 H new ATOM 0 HG SER A 102 18.794 17.818 6.382 1.00 0.00 H new ATOM 1543 N SER A 103 23.205 17.832 5.832 1.00 0.00 N ATOM 1544 CA SER A 103 24.492 18.517 5.838 1.00 0.00 C ATOM 1545 C SER A 103 24.717 19.239 7.163 1.00 0.00 C ATOM 1546 O SER A 103 24.066 20.241 7.455 1.00 0.00 O ATOM 1547 CB SER A 103 24.567 19.516 4.681 1.00 0.00 C ATOM 1548 OG SER A 103 25.345 19.002 3.614 1.00 0.00 O ATOM 0 H SER A 103 22.500 18.264 5.235 1.00 0.00 H new ATOM 0 HA SER A 103 25.275 17.769 5.714 1.00 0.00 H new ATOM 0 HB2 SER A 103 23.562 19.743 4.326 1.00 0.00 H new ATOM 0 HB3 SER A 103 25.000 20.453 5.032 1.00 0.00 H new ATOM 0 HG SER A 103 25.376 19.658 2.886 1.00 0.00 H new ATOM 1554 N GLY A 104 25.645 18.721 7.962 1.00 0.00 N ATOM 1555 CA GLY A 104 25.941 19.327 9.247 1.00 0.00 C ATOM 1556 C GLY A 104 27.288 20.020 9.264 1.00 0.00 C ATOM 1557 O GLY A 104 28.124 19.747 10.126 1.00 0.00 O ATOM 0 H GLY A 104 26.197 17.892 7.742 1.00 0.00 H new ATOM 0 HA2 GLY A 104 25.162 20.048 9.493 1.00 0.00 H new ATOM 0 HA3 GLY A 104 25.921 18.559 10.021 1.00 0.00 H new TER 1561 GLY A 104