USER MOD reduce.3.24.130724 H: found=0, std=0, add=1041, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1038 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 46 THR OG1 : rot 98:sc= 0.108 USER MOD Set 1.2: A 63 MET CE :methyl 177:sc= -1.24 (180deg=-1.33) USER MOD Set 2.1: A 35 SER OG : rot 160:sc= -0.102 USER MOD Set 2.2: A 36 ASN : amide:sc= 0 X(o=-2.7,f=-2.7) USER MOD Set 2.3: A 72 ASN : amide:sc= -2.64 K(o=-2.7,f=-7.3) USER MOD Set 3.1: A 26 SER OG : rot -112:sc= 0.258 USER MOD Set 3.2: A 27 THR OG1 : rot 180:sc= 0.00331 USER MOD Set 4.1: A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -175:sc= 0 (180deg=-0.0215) USER MOD Single : A 3 MET CE :methyl 146:sc= -5.04 (180deg=-5.9!) USER MOD Single : A 4 THR OG1 : rot 84:sc= 0.256 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.0326 USER MOD Single : A 30 GLN : amide:sc= -0.0422 K(o=-0.042,f=-1.7!) USER MOD Single : A 37 HIS :FLIP no HD1:sc= -0.0288 F(o=-0.62,f=-0.029) USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.18 USER MOD Single : A 49 MET CE :methyl 164:sc= 0 (180deg=-0.209) USER MOD Single : A 53 GLN : amide:sc= -0.236 K(o=-0.24,f=-1.1!) USER MOD Single : A 71 ASN : amide:sc= -0.0796 K(o=-0.08,f=-1.8!) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= -0.156 K(o=-0.16,f=-0.97) USER MOD Single : A 86 THR OG1 : rot 4:sc= 0.372 USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.057) USER MOD Single : A 95 THR OG1 : rot 72:sc= 0.374 USER MOD Single : A 102 ASN : amide:sc= 0 K(o=0,f=-3.6!) USER MOD Single : A 105 LYS NZ :NH3+ -152:sc= -0.101 (180deg=-0.682) USER MOD Single : A 111 GLN : amide:sc= -0.179 X(o=-0.18,f=0) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 ASN : amide:sc= -0.0144 X(o=-0.014,f=0) USER MOD Single : A 124 THR OG1 : rot 92:sc= 1.26 USER MOD Single : A 129 SER OG : rot 180:sc=-0.00285 USER MOD Single : A 130 ASN : amide:sc=-0.00845 K(o=-0.0085,f=-2.4) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.801 0.035 0.377 1.00 52.00 N ATOM 2 CA MET A 1 3.017 0.437 -0.320 1.00 71.23 C ATOM 3 C MET A 1 3.274 1.930 -0.148 1.00 4.33 C ATOM 4 O MET A 1 4.396 2.348 0.140 1.00 64.23 O ATOM 5 CB MET A 1 2.915 0.094 -1.808 1.00 34.43 C ATOM 6 CG MET A 1 3.815 -1.056 -2.229 1.00 73.44 C ATOM 7 SD MET A 1 2.917 -2.610 -2.412 1.00 5.30 S ATOM 8 CE MET A 1 2.311 -2.455 -4.090 1.00 65.44 C ATOM 0 H1 MET A 1 1.692 -0.998 0.317 1.00 52.00 H new ATOM 0 H2 MET A 1 1.863 0.320 1.375 1.00 52.00 H new ATOM 0 H3 MET A 1 0.980 0.496 -0.064 1.00 52.00 H new ATOM 0 HA MET A 1 3.853 -0.110 0.116 1.00 71.23 H new ATOM 0 HB2 MET A 1 1.881 -0.159 -2.044 1.00 34.43 H new ATOM 0 HB3 MET A 1 3.169 0.977 -2.394 1.00 34.43 H new ATOM 0 HG2 MET A 1 4.299 -0.807 -3.174 1.00 73.44 H new ATOM 0 HG3 MET A 1 4.606 -1.183 -1.490 1.00 73.44 H new ATOM 0 HE1 MET A 1 1.734 -3.342 -4.352 1.00 65.44 H new ATOM 0 HE2 MET A 1 1.676 -1.573 -4.167 1.00 65.44 H new ATOM 0 HE3 MET A 1 3.154 -2.356 -4.774 1.00 65.44 H new ATOM 18 N VAL A 2 2.228 2.731 -0.325 1.00 44.21 N ATOM 19 CA VAL A 2 2.342 4.178 -0.188 1.00 55.30 C ATOM 20 C VAL A 2 1.480 4.691 0.961 1.00 63.51 C ATOM 21 O VAL A 2 0.547 4.018 1.398 1.00 22.32 O ATOM 22 CB VAL A 2 1.929 4.899 -1.485 1.00 71.13 C ATOM 23 CG1 VAL A 2 2.817 4.466 -2.642 1.00 53.22 C ATOM 24 CG2 VAL A 2 0.464 4.634 -1.799 1.00 20.04 C ATOM 0 H VAL A 2 1.292 2.402 -0.564 1.00 44.21 H new ATOM 0 HA VAL A 2 3.390 4.394 0.022 1.00 55.30 H new ATOM 0 HB VAL A 2 2.058 5.972 -1.341 1.00 71.13 H new ATOM 0 HG11 VAL A 2 2.511 4.985 -3.550 1.00 53.22 H new ATOM 0 HG12 VAL A 2 3.855 4.712 -2.416 1.00 53.22 H new ATOM 0 HG13 VAL A 2 2.723 3.390 -2.790 1.00 53.22 H new ATOM 0 HG21 VAL A 2 0.190 5.151 -2.718 1.00 20.04 H new ATOM 0 HG22 VAL A 2 0.307 3.563 -1.924 1.00 20.04 H new ATOM 0 HG23 VAL A 2 -0.155 4.998 -0.979 1.00 20.04 H new ATOM 34 N MET A 3 1.800 5.886 1.445 1.00 13.22 N ATOM 35 CA MET A 3 1.053 6.490 2.543 1.00 24.10 C ATOM 36 C MET A 3 0.004 7.464 2.016 1.00 20.33 C ATOM 37 O MET A 3 -0.056 7.739 0.818 1.00 55.54 O ATOM 38 CB MET A 3 2.005 7.214 3.497 1.00 11.22 C ATOM 39 CG MET A 3 2.431 8.587 3.004 1.00 44.30 C ATOM 40 SD MET A 3 4.075 9.053 3.580 1.00 65.50 S ATOM 41 CE MET A 3 4.924 9.294 2.021 1.00 5.05 C ATOM 0 H MET A 3 2.571 6.455 1.095 1.00 13.22 H new ATOM 0 HA MET A 3 0.543 5.693 3.085 1.00 24.10 H new ATOM 0 HB2 MET A 3 1.522 7.320 4.468 1.00 11.22 H new ATOM 0 HB3 MET A 3 2.893 6.599 3.647 1.00 11.22 H new ATOM 0 HG2 MET A 3 2.415 8.598 1.914 1.00 44.30 H new ATOM 0 HG3 MET A 3 1.708 9.330 3.341 1.00 44.30 H new ATOM 0 HE1 MET A 3 5.653 10.098 2.124 1.00 5.05 H new ATOM 0 HE2 MET A 3 5.436 8.374 1.739 1.00 5.05 H new ATOM 0 HE3 MET A 3 4.200 9.557 1.250 1.00 5.05 H new ATOM 51 N THR A 4 -0.822 7.982 2.920 1.00 53.13 N ATOM 52 CA THR A 4 -1.870 8.924 2.546 1.00 60.32 C ATOM 53 C THR A 4 -1.677 10.266 3.242 1.00 33.25 C ATOM 54 O THR A 4 -2.017 10.422 4.415 1.00 0.24 O ATOM 55 CB THR A 4 -3.267 8.375 2.890 1.00 14.15 C ATOM 56 OG1 THR A 4 -3.367 7.003 2.493 1.00 1.10 O ATOM 57 CG2 THR A 4 -4.353 9.188 2.201 1.00 20.02 C ATOM 0 H THR A 4 -0.785 7.765 3.916 1.00 53.13 H new ATOM 0 HA THR A 4 -1.799 9.065 1.467 1.00 60.32 H new ATOM 0 HB THR A 4 -3.407 8.451 3.968 1.00 14.15 H new ATOM 0 HG1 THR A 4 -2.990 6.431 3.194 1.00 1.10 H new ATOM 0 HG21 THR A 4 -5.331 8.781 2.459 1.00 20.02 H new ATOM 0 HG22 THR A 4 -4.294 10.226 2.529 1.00 20.02 H new ATOM 0 HG23 THR A 4 -4.214 9.140 1.121 1.00 20.02 H new ATOM 65 N VAL A 5 -1.131 11.233 2.513 1.00 45.12 N ATOM 66 CA VAL A 5 -0.894 12.563 3.061 1.00 54.44 C ATOM 67 C VAL A 5 -2.059 13.498 2.755 1.00 41.53 C ATOM 68 O VAL A 5 -2.492 13.613 1.608 1.00 61.52 O ATOM 69 CB VAL A 5 0.403 13.178 2.503 1.00 62.11 C ATOM 70 CG1 VAL A 5 0.624 14.570 3.074 1.00 13.14 C ATOM 71 CG2 VAL A 5 1.591 12.276 2.802 1.00 71.41 C ATOM 0 H VAL A 5 -0.844 11.120 1.541 1.00 45.12 H new ATOM 0 HA VAL A 5 -0.797 12.448 4.141 1.00 54.44 H new ATOM 0 HB VAL A 5 0.306 13.267 1.421 1.00 62.11 H new ATOM 0 HG11 VAL A 5 1.545 14.988 2.668 1.00 13.14 H new ATOM 0 HG12 VAL A 5 -0.215 15.211 2.804 1.00 13.14 H new ATOM 0 HG13 VAL A 5 0.701 14.510 4.160 1.00 13.14 H new ATOM 0 HG21 VAL A 5 2.499 12.726 2.401 1.00 71.41 H new ATOM 0 HG22 VAL A 5 1.693 12.154 3.880 1.00 71.41 H new ATOM 0 HG23 VAL A 5 1.434 11.302 2.339 1.00 71.41 H new ATOM 81 N ARG A 6 -2.562 14.166 3.788 1.00 43.21 N ATOM 82 CA ARG A 6 -3.677 15.092 3.630 1.00 72.52 C ATOM 83 C ARG A 6 -3.411 16.396 4.375 1.00 41.44 C ATOM 84 O ARG A 6 -2.949 16.389 5.516 1.00 55.11 O ATOM 85 CB ARG A 6 -4.971 14.455 4.140 1.00 14.43 C ATOM 86 CG ARG A 6 -5.072 14.413 5.656 1.00 33.53 C ATOM 87 CD ARG A 6 -5.715 13.120 6.136 1.00 44.15 C ATOM 88 NE ARG A 6 -6.644 13.347 7.239 1.00 50.21 N ATOM 89 CZ ARG A 6 -7.426 12.401 7.748 1.00 43.42 C ATOM 90 NH1 ARG A 6 -7.390 11.171 7.255 1.00 24.14 N ATOM 91 NH2 ARG A 6 -8.245 12.686 8.752 1.00 73.51 N ATOM 0 H ARG A 6 -2.215 14.083 4.744 1.00 43.21 H new ATOM 0 HA ARG A 6 -3.783 15.316 2.569 1.00 72.52 H new ATOM 0 HB2 ARG A 6 -5.821 15.010 3.743 1.00 14.43 H new ATOM 0 HB3 ARG A 6 -5.044 13.439 3.751 1.00 14.43 H new ATOM 0 HG2 ARG A 6 -4.077 14.509 6.091 1.00 33.53 H new ATOM 0 HG3 ARG A 6 -5.657 15.263 6.007 1.00 33.53 H new ATOM 0 HD2 ARG A 6 -6.244 12.649 5.308 1.00 44.15 H new ATOM 0 HD3 ARG A 6 -4.938 12.425 6.454 1.00 44.15 H new ATOM 0 HE ARG A 6 -6.696 14.283 7.641 1.00 50.21 H new ATOM 0 HH11 ARG A 6 -6.761 10.949 6.483 1.00 24.14 H new ATOM 0 HH12 ARG A 6 -7.991 10.446 7.647 1.00 24.14 H new ATOM 0 HH21 ARG A 6 -8.275 13.632 9.133 1.00 73.51 H new ATOM 0 HH22 ARG A 6 -8.845 11.960 9.142 1.00 73.51 H new ATOM 105 N VAL A 7 -3.704 17.516 3.720 1.00 34.24 N ATOM 106 CA VAL A 7 -3.497 18.828 4.320 1.00 15.52 C ATOM 107 C VAL A 7 -4.798 19.384 4.889 1.00 32.25 C ATOM 108 O VAL A 7 -5.864 19.229 4.293 1.00 34.02 O ATOM 109 CB VAL A 7 -2.929 19.830 3.297 1.00 22.32 C ATOM 110 CG1 VAL A 7 -2.693 21.184 3.949 1.00 75.30 C ATOM 111 CG2 VAL A 7 -1.644 19.293 2.685 1.00 61.03 C ATOM 0 H VAL A 7 -4.085 17.540 2.774 1.00 34.24 H new ATOM 0 HA VAL A 7 -2.777 18.696 5.128 1.00 15.52 H new ATOM 0 HB VAL A 7 -3.659 19.961 2.498 1.00 22.32 H new ATOM 0 HG11 VAL A 7 -2.292 21.878 3.211 1.00 75.30 H new ATOM 0 HG12 VAL A 7 -3.636 21.571 4.336 1.00 75.30 H new ATOM 0 HG13 VAL A 7 -1.982 21.074 4.768 1.00 75.30 H new ATOM 0 HG21 VAL A 7 -1.256 20.013 1.964 1.00 61.03 H new ATOM 0 HG22 VAL A 7 -0.906 19.132 3.471 1.00 61.03 H new ATOM 0 HG23 VAL A 7 -1.848 18.349 2.180 1.00 61.03 H new ATOM 121 N ILE A 8 -4.703 20.031 6.046 1.00 43.32 N ATOM 122 CA ILE A 8 -5.872 20.611 6.695 1.00 42.42 C ATOM 123 C ILE A 8 -5.532 21.948 7.347 1.00 75.54 C ATOM 124 O ILE A 8 -4.426 22.142 7.848 1.00 23.43 O ATOM 125 CB ILE A 8 -6.451 19.664 7.763 1.00 42.45 C ATOM 126 CG1 ILE A 8 -6.762 18.298 7.149 1.00 65.31 C ATOM 127 CG2 ILE A 8 -7.701 20.269 8.384 1.00 20.53 C ATOM 128 CD1 ILE A 8 -7.152 17.252 8.170 1.00 72.25 C ATOM 0 H ILE A 8 -3.828 20.167 6.553 1.00 43.32 H new ATOM 0 HA ILE A 8 -6.619 20.768 5.917 1.00 42.42 H new ATOM 0 HB ILE A 8 -5.708 19.527 8.549 1.00 42.45 H new ATOM 0 HG12 ILE A 8 -7.571 18.409 6.427 1.00 65.31 H new ATOM 0 HG13 ILE A 8 -5.889 17.949 6.598 1.00 65.31 H new ATOM 0 HG21 ILE A 8 -8.099 19.589 9.137 1.00 20.53 H new ATOM 0 HG22 ILE A 8 -7.451 21.221 8.852 1.00 20.53 H new ATOM 0 HG23 ILE A 8 -8.450 20.431 7.609 1.00 20.53 H new ATOM 0 HD11 ILE A 8 -7.358 16.309 7.664 1.00 72.25 H new ATOM 0 HD12 ILE A 8 -6.335 17.113 8.878 1.00 72.25 H new ATOM 0 HD13 ILE A 8 -8.044 17.580 8.704 1.00 72.25 H new ATOM 140 N ALA A 9 -6.493 22.865 7.337 1.00 55.42 N ATOM 141 CA ALA A 9 -6.298 24.182 7.930 1.00 11.34 C ATOM 142 C ALA A 9 -7.309 24.438 9.043 1.00 2.23 C ATOM 143 O ALA A 9 -8.347 23.782 9.135 1.00 3.30 O ATOM 144 CB ALA A 9 -6.400 25.262 6.864 1.00 40.43 C ATOM 0 H ALA A 9 -7.415 22.720 6.925 1.00 55.42 H new ATOM 0 HA ALA A 9 -5.300 24.212 8.367 1.00 11.34 H new ATOM 0 HB1 ALA A 9 -6.252 26.240 7.322 1.00 40.43 H new ATOM 0 HB2 ALA A 9 -5.635 25.097 6.105 1.00 40.43 H new ATOM 0 HB3 ALA A 9 -7.386 25.224 6.400 1.00 40.43 H new ATOM 150 N PRO A 10 -7.001 25.414 9.911 1.00 64.33 N ATOM 151 CA PRO A 10 -7.870 25.778 11.034 1.00 43.25 C ATOM 152 C PRO A 10 -9.155 26.458 10.575 1.00 52.14 C ATOM 153 O PRO A 10 -10.059 26.703 11.374 1.00 5.33 O ATOM 154 CB PRO A 10 -7.011 26.751 11.846 1.00 61.14 C ATOM 155 CG PRO A 10 -6.056 27.328 10.858 1.00 10.15 C ATOM 156 CD PRO A 10 -5.780 26.236 9.862 1.00 53.42 C ATOM 0 HA PRO A 10 -8.196 24.904 11.597 1.00 43.25 H new ATOM 0 HB2 PRO A 10 -7.621 27.528 12.307 1.00 61.14 H new ATOM 0 HB3 PRO A 10 -6.486 26.238 12.652 1.00 61.14 H new ATOM 0 HG2 PRO A 10 -6.482 28.204 10.369 1.00 10.15 H new ATOM 0 HG3 PRO A 10 -5.137 27.652 11.347 1.00 10.15 H new ATOM 0 HD2 PRO A 10 -5.605 26.637 8.864 1.00 53.42 H new ATOM 0 HD3 PRO A 10 -4.896 25.659 10.133 1.00 53.42 H new ATOM 164 N ASP A 11 -9.231 26.760 9.283 1.00 22.31 N ATOM 165 CA ASP A 11 -10.407 27.410 8.717 1.00 11.25 C ATOM 166 C ASP A 11 -11.230 26.424 7.894 1.00 11.23 C ATOM 167 O ASP A 11 -12.417 26.643 7.648 1.00 24.42 O ATOM 168 CB ASP A 11 -9.991 28.597 7.848 1.00 41.35 C ATOM 169 CG ASP A 11 -10.787 29.850 8.158 1.00 71.43 C ATOM 170 OD1 ASP A 11 -11.983 29.896 7.802 1.00 74.14 O ATOM 171 OD2 ASP A 11 -10.214 30.783 8.757 1.00 12.12 O ATOM 0 H ASP A 11 -8.492 26.565 8.608 1.00 22.31 H new ATOM 0 HA ASP A 11 -11.024 27.771 9.540 1.00 11.25 H new ATOM 0 HB2 ASP A 11 -8.930 28.798 7.997 1.00 41.35 H new ATOM 0 HB3 ASP A 11 -10.122 28.338 6.797 1.00 41.35 H new ATOM 176 N LYS A 12 -10.592 25.339 7.470 1.00 73.41 N ATOM 177 CA LYS A 12 -11.264 24.318 6.674 1.00 30.03 C ATOM 178 C LYS A 12 -10.290 23.216 6.268 1.00 13.34 C ATOM 179 O LYS A 12 -9.163 23.156 6.761 1.00 12.32 O ATOM 180 CB LYS A 12 -11.890 24.945 5.427 1.00 74.14 C ATOM 181 CG LYS A 12 -13.360 24.604 5.247 1.00 44.11 C ATOM 182 CD LYS A 12 -13.689 24.304 3.794 1.00 3.02 C ATOM 183 CE LYS A 12 -14.986 23.521 3.667 1.00 32.40 C ATOM 184 NZ LYS A 12 -14.762 22.053 3.785 1.00 10.22 N ATOM 0 H LYS A 12 -9.610 25.143 7.664 1.00 73.41 H new ATOM 0 HA LYS A 12 -12.051 23.876 7.285 1.00 30.03 H new ATOM 0 HB2 LYS A 12 -11.781 26.028 5.481 1.00 74.14 H new ATOM 0 HB3 LYS A 12 -11.338 24.613 4.548 1.00 74.14 H new ATOM 0 HG2 LYS A 12 -13.613 23.741 5.864 1.00 44.11 H new ATOM 0 HG3 LYS A 12 -13.973 25.435 5.596 1.00 44.11 H new ATOM 0 HD2 LYS A 12 -13.771 25.238 3.238 1.00 3.02 H new ATOM 0 HD3 LYS A 12 -12.874 23.736 3.345 1.00 3.02 H new ATOM 0 HE2 LYS A 12 -15.683 23.845 4.440 1.00 32.40 H new ATOM 0 HE3 LYS A 12 -15.451 23.741 2.706 1.00 32.40 H new ATOM 0 HZ1 LYS A 12 -15.670 21.555 3.693 1.00 10.22 H new ATOM 0 HZ2 LYS A 12 -14.117 21.739 3.032 1.00 10.22 H new ATOM 0 HZ3 LYS A 12 -14.342 21.839 4.712 1.00 10.22 H new ATOM 198 N THR A 13 -10.731 22.346 5.365 1.00 33.14 N ATOM 199 CA THR A 13 -9.899 21.247 4.893 1.00 61.20 C ATOM 200 C THR A 13 -9.329 21.543 3.510 1.00 15.34 C ATOM 201 O THR A 13 -9.897 22.326 2.749 1.00 52.41 O ATOM 202 CB THR A 13 -10.690 19.926 4.837 1.00 13.44 C ATOM 203 OG1 THR A 13 -11.929 20.126 4.148 1.00 51.44 O ATOM 204 CG2 THR A 13 -10.963 19.400 6.238 1.00 33.23 C ATOM 0 H THR A 13 -11.660 22.382 4.946 1.00 33.14 H new ATOM 0 HA THR A 13 -9.081 21.142 5.606 1.00 61.20 H new ATOM 0 HB THR A 13 -10.090 19.191 4.300 1.00 13.44 H new ATOM 0 HG1 THR A 13 -12.425 19.281 4.115 1.00 51.44 H new ATOM 0 HG21 THR A 13 -11.523 18.467 6.174 1.00 33.23 H new ATOM 0 HG22 THR A 13 -10.018 19.222 6.750 1.00 33.23 H new ATOM 0 HG23 THR A 13 -11.545 20.134 6.795 1.00 33.23 H new ATOM 212 N VAL A 14 -8.204 20.912 3.191 1.00 31.11 N ATOM 213 CA VAL A 14 -7.558 21.107 1.898 1.00 34.15 C ATOM 214 C VAL A 14 -7.810 19.921 0.974 1.00 21.12 C ATOM 215 O VAL A 14 -8.543 20.031 -0.008 1.00 54.42 O ATOM 216 CB VAL A 14 -6.039 21.309 2.055 1.00 55.04 C ATOM 217 CG1 VAL A 14 -5.420 21.746 0.736 1.00 55.23 C ATOM 218 CG2 VAL A 14 -5.747 22.321 3.152 1.00 52.43 C ATOM 0 H VAL A 14 -7.721 20.261 3.810 1.00 31.11 H new ATOM 0 HA VAL A 14 -7.993 22.005 1.458 1.00 34.15 H new ATOM 0 HB VAL A 14 -5.591 20.358 2.342 1.00 55.04 H new ATOM 0 HG11 VAL A 14 -4.347 21.884 0.866 1.00 55.23 H new ATOM 0 HG12 VAL A 14 -5.599 20.982 -0.021 1.00 55.23 H new ATOM 0 HG13 VAL A 14 -5.870 22.686 0.416 1.00 55.23 H new ATOM 0 HG21 VAL A 14 -4.669 22.451 3.249 1.00 52.43 H new ATOM 0 HG22 VAL A 14 -6.207 23.276 2.898 1.00 52.43 H new ATOM 0 HG23 VAL A 14 -6.156 21.962 4.097 1.00 52.43 H new ATOM 228 N TRP A 15 -7.197 18.787 1.296 1.00 52.43 N ATOM 229 CA TRP A 15 -7.355 17.579 0.494 1.00 51.32 C ATOM 230 C TRP A 15 -6.584 16.415 1.106 1.00 44.25 C ATOM 231 O TRP A 15 -5.867 16.584 2.092 1.00 30.34 O ATOM 232 CB TRP A 15 -6.878 17.827 -0.938 1.00 51.12 C ATOM 233 CG TRP A 15 -7.668 17.074 -1.966 1.00 2.31 C ATOM 234 CD1 TRP A 15 -7.173 16.269 -2.952 1.00 1.32 C ATOM 235 CD2 TRP A 15 -9.092 17.059 -2.110 1.00 32.54 C ATOM 236 NE1 TRP A 15 -8.204 15.754 -3.700 1.00 21.02 N ATOM 237 CE2 TRP A 15 -9.391 16.222 -3.203 1.00 14.21 C ATOM 238 CE3 TRP A 15 -10.144 17.668 -1.420 1.00 71.41 C ATOM 239 CZ2 TRP A 15 -10.698 15.983 -3.621 1.00 23.41 C ATOM 240 CZ3 TRP A 15 -11.440 17.429 -1.836 1.00 40.03 C ATOM 241 CH2 TRP A 15 -11.708 16.592 -2.928 1.00 0.04 C ATOM 0 H TRP A 15 -6.587 18.679 2.106 1.00 52.43 H new ATOM 0 HA TRP A 15 -8.414 17.320 0.477 1.00 51.32 H new ATOM 0 HB2 TRP A 15 -6.938 18.894 -1.154 1.00 51.12 H new ATOM 0 HB3 TRP A 15 -5.828 17.544 -1.018 1.00 51.12 H new ATOM 0 HD1 TRP A 15 -6.125 16.067 -3.119 1.00 1.32 H new ATOM 0 HE1 TRP A 15 -8.102 15.125 -4.496 1.00 21.02 H new ATOM 0 HE3 TRP A 15 -9.948 18.314 -0.577 1.00 71.41 H new ATOM 0 HZ2 TRP A 15 -10.907 15.339 -4.463 1.00 23.41 H new ATOM 0 HZ3 TRP A 15 -12.260 17.895 -1.311 1.00 40.03 H new ATOM 0 HH2 TRP A 15 -12.732 16.425 -3.228 1.00 0.04 H new ATOM 252 N ASP A 16 -6.734 15.235 0.514 1.00 14.31 N ATOM 253 CA ASP A 16 -6.050 14.043 1.001 1.00 51.02 C ATOM 254 C ASP A 16 -5.618 13.152 -0.160 1.00 53.40 C ATOM 255 O ASP A 16 -6.372 12.287 -0.604 1.00 65.44 O ATOM 256 CB ASP A 16 -6.958 13.260 1.951 1.00 62.05 C ATOM 257 CG ASP A 16 -8.295 12.919 1.323 1.00 13.15 C ATOM 258 OD1 ASP A 16 -9.108 13.845 1.118 1.00 43.25 O ATOM 259 OD2 ASP A 16 -8.529 11.726 1.038 1.00 54.32 O ATOM 0 H ASP A 16 -7.323 15.079 -0.304 1.00 14.31 H new ATOM 0 HA ASP A 16 -5.159 14.361 1.543 1.00 51.02 H new ATOM 0 HB2 ASP A 16 -6.457 12.341 2.253 1.00 62.05 H new ATOM 0 HB3 ASP A 16 -7.123 13.845 2.856 1.00 62.05 H new ATOM 264 N ALA A 17 -4.401 13.372 -0.647 1.00 55.11 N ATOM 265 CA ALA A 17 -3.869 12.589 -1.755 1.00 53.13 C ATOM 266 C ALA A 17 -2.788 11.625 -1.277 1.00 54.45 C ATOM 267 O ALA A 17 -2.177 11.812 -0.225 1.00 55.30 O ATOM 268 CB ALA A 17 -3.319 13.509 -2.835 1.00 71.12 C ATOM 0 H ALA A 17 -3.765 14.086 -0.291 1.00 55.11 H new ATOM 0 HA ALA A 17 -4.684 12.000 -2.176 1.00 53.13 H new ATOM 0 HB1 ALA A 17 -2.925 12.911 -3.657 1.00 71.12 H new ATOM 0 HB2 ALA A 17 -4.117 14.153 -3.205 1.00 71.12 H new ATOM 0 HB3 ALA A 17 -2.521 14.123 -2.418 1.00 71.12 H new ATOM 274 N PRO A 18 -2.546 10.569 -2.067 1.00 65.30 N ATOM 275 CA PRO A 18 -1.537 9.555 -1.744 1.00 75.53 C ATOM 276 C PRO A 18 -0.116 10.093 -1.861 1.00 65.33 C ATOM 277 O PRO A 18 0.095 11.230 -2.282 1.00 61.32 O ATOM 278 CB PRO A 18 -1.784 8.464 -2.790 1.00 32.13 C ATOM 279 CG PRO A 18 -2.416 9.175 -3.936 1.00 71.55 C ATOM 280 CD PRO A 18 -3.236 10.283 -3.336 1.00 22.11 C ATOM 0 HA PRO A 18 -1.624 9.206 -0.715 1.00 75.53 H new ATOM 0 HB2 PRO A 18 -0.852 7.983 -3.088 1.00 32.13 H new ATOM 0 HB3 PRO A 18 -2.436 7.682 -2.401 1.00 32.13 H new ATOM 0 HG2 PRO A 18 -1.660 9.572 -4.613 1.00 71.55 H new ATOM 0 HG3 PRO A 18 -3.041 8.498 -4.518 1.00 71.55 H new ATOM 0 HD2 PRO A 18 -3.264 11.159 -3.984 1.00 22.11 H new ATOM 0 HD3 PRO A 18 -4.269 9.975 -3.171 1.00 22.11 H new ATOM 288 N ALA A 19 0.857 9.268 -1.487 1.00 0.15 N ATOM 289 CA ALA A 19 2.259 9.661 -1.552 1.00 62.11 C ATOM 290 C ALA A 19 3.171 8.512 -1.137 1.00 23.34 C ATOM 291 O ALA A 19 2.880 7.790 -0.184 1.00 13.05 O ATOM 292 CB ALA A 19 2.508 10.879 -0.674 1.00 72.52 C ATOM 0 H ALA A 19 0.700 8.323 -1.136 1.00 0.15 H new ATOM 0 HA ALA A 19 2.490 9.919 -2.585 1.00 62.11 H new ATOM 0 HB1 ALA A 19 3.559 11.161 -0.733 1.00 72.52 H new ATOM 0 HB2 ALA A 19 1.890 11.708 -1.018 1.00 72.52 H new ATOM 0 HB3 ALA A 19 2.253 10.641 0.359 1.00 72.52 H new ATOM 298 N GLU A 20 4.275 8.348 -1.858 1.00 65.35 N ATOM 299 CA GLU A 20 5.229 7.284 -1.564 1.00 52.33 C ATOM 300 C GLU A 20 6.272 7.753 -0.554 1.00 42.13 C ATOM 301 O GLU A 20 6.759 6.969 0.260 1.00 75.23 O ATOM 302 CB GLU A 20 5.919 6.818 -2.848 1.00 12.11 C ATOM 303 CG GLU A 20 6.984 5.760 -2.616 1.00 45.03 C ATOM 304 CD GLU A 20 6.413 4.467 -2.066 1.00 44.45 C ATOM 305 OE1 GLU A 20 6.128 4.415 -0.852 1.00 12.13 O ATOM 306 OE2 GLU A 20 6.252 3.509 -2.850 1.00 23.40 O ATOM 0 H GLU A 20 4.532 8.938 -2.650 1.00 65.35 H new ATOM 0 HA GLU A 20 4.680 6.448 -1.132 1.00 52.33 H new ATOM 0 HB2 GLU A 20 5.168 6.422 -3.531 1.00 12.11 H new ATOM 0 HB3 GLU A 20 6.374 7.678 -3.339 1.00 12.11 H new ATOM 0 HG2 GLU A 20 7.498 5.555 -3.555 1.00 45.03 H new ATOM 0 HG3 GLU A 20 7.730 6.147 -1.922 1.00 45.03 H new ATOM 313 N GLU A 21 6.611 9.037 -0.615 1.00 10.11 N ATOM 314 CA GLU A 21 7.598 9.610 0.293 1.00 34.13 C ATOM 315 C GLU A 21 7.470 11.130 0.347 1.00 63.43 C ATOM 316 O GLU A 21 7.393 11.794 -0.687 1.00 4.23 O ATOM 317 CB GLU A 21 9.012 9.221 -0.143 1.00 34.40 C ATOM 318 CG GLU A 21 10.068 9.474 0.920 1.00 72.24 C ATOM 319 CD GLU A 21 11.460 9.082 0.464 1.00 72.24 C ATOM 320 OE1 GLU A 21 11.765 7.871 0.461 1.00 51.02 O ATOM 321 OE2 GLU A 21 12.244 9.987 0.109 1.00 21.12 O ATOM 0 H GLU A 21 6.217 9.700 -1.283 1.00 10.11 H new ATOM 0 HA GLU A 21 7.411 9.211 1.290 1.00 34.13 H new ATOM 0 HB2 GLU A 21 9.023 8.164 -0.410 1.00 34.40 H new ATOM 0 HB3 GLU A 21 9.272 9.779 -1.042 1.00 34.40 H new ATOM 0 HG2 GLU A 21 10.062 10.530 1.189 1.00 72.24 H new ATOM 0 HG3 GLU A 21 9.814 8.914 1.820 1.00 72.24 H new ATOM 328 N VAL A 22 7.448 11.673 1.559 1.00 1.55 N ATOM 329 CA VAL A 22 7.331 13.114 1.749 1.00 14.32 C ATOM 330 C VAL A 22 8.531 13.668 2.508 1.00 44.43 C ATOM 331 O VAL A 22 8.806 13.263 3.638 1.00 75.14 O ATOM 332 CB VAL A 22 6.043 13.477 2.513 1.00 60.31 C ATOM 333 CG1 VAL A 22 4.829 13.344 1.606 1.00 31.43 C ATOM 334 CG2 VAL A 22 5.894 12.603 3.749 1.00 13.24 C ATOM 0 H VAL A 22 7.510 11.137 2.425 1.00 1.55 H new ATOM 0 HA VAL A 22 7.295 13.562 0.756 1.00 14.32 H new ATOM 0 HB VAL A 22 6.113 14.516 2.836 1.00 60.31 H new ATOM 0 HG11 VAL A 22 3.929 13.604 2.163 1.00 31.43 H new ATOM 0 HG12 VAL A 22 4.936 14.016 0.754 1.00 31.43 H new ATOM 0 HG13 VAL A 22 4.751 12.317 1.250 1.00 31.43 H new ATOM 0 HG21 VAL A 22 4.979 12.872 4.277 1.00 13.24 H new ATOM 0 HG22 VAL A 22 5.846 11.556 3.450 1.00 13.24 H new ATOM 0 HG23 VAL A 22 6.750 12.754 4.406 1.00 13.24 H new ATOM 344 N ILE A 23 9.244 14.598 1.879 1.00 34.53 N ATOM 345 CA ILE A 23 10.414 15.209 2.496 1.00 65.31 C ATOM 346 C ILE A 23 10.193 16.697 2.741 1.00 53.41 C ATOM 347 O ILE A 23 9.703 17.415 1.868 1.00 43.41 O ATOM 348 CB ILE A 23 11.671 15.025 1.624 1.00 75.02 C ATOM 349 CG1 ILE A 23 11.375 15.422 0.176 1.00 62.21 C ATOM 350 CG2 ILE A 23 12.159 13.586 1.695 1.00 20.13 C ATOM 351 CD1 ILE A 23 12.480 16.231 -0.466 1.00 64.33 C ATOM 0 H ILE A 23 9.031 14.944 0.943 1.00 34.53 H new ATOM 0 HA ILE A 23 10.566 14.705 3.450 1.00 65.31 H new ATOM 0 HB ILE A 23 12.459 15.674 2.006 1.00 75.02 H new ATOM 0 HG12 ILE A 23 11.207 14.520 -0.413 1.00 62.21 H new ATOM 0 HG13 ILE A 23 10.450 15.998 0.147 1.00 62.21 H new ATOM 0 HG21 ILE A 23 13.047 13.472 1.074 1.00 20.13 H new ATOM 0 HG22 ILE A 23 12.403 13.335 2.727 1.00 20.13 H new ATOM 0 HG23 ILE A 23 11.376 12.918 1.335 1.00 20.13 H new ATOM 0 HD11 ILE A 23 12.202 16.477 -1.491 1.00 64.33 H new ATOM 0 HD12 ILE A 23 12.633 17.150 0.099 1.00 64.33 H new ATOM 0 HD13 ILE A 23 13.402 15.649 -0.470 1.00 64.33 H new ATOM 363 N LEU A 24 10.557 17.156 3.933 1.00 24.32 N ATOM 364 CA LEU A 24 10.400 18.561 4.294 1.00 65.44 C ATOM 365 C LEU A 24 11.289 18.921 5.480 1.00 61.02 C ATOM 366 O LEU A 24 11.741 18.058 6.233 1.00 11.42 O ATOM 367 CB LEU A 24 8.938 18.862 4.627 1.00 22.41 C ATOM 368 CG LEU A 24 8.142 17.715 5.251 1.00 62.31 C ATOM 369 CD1 LEU A 24 7.128 18.250 6.250 1.00 41.13 C ATOM 370 CD2 LEU A 24 7.449 16.897 4.171 1.00 42.14 C ATOM 0 H LEU A 24 10.963 16.575 4.667 1.00 24.32 H new ATOM 0 HA LEU A 24 10.703 19.166 3.440 1.00 65.44 H new ATOM 0 HB2 LEU A 24 8.909 19.711 5.310 1.00 22.41 H new ATOM 0 HB3 LEU A 24 8.434 19.172 3.711 1.00 22.41 H new ATOM 0 HG LEU A 24 8.836 17.064 5.783 1.00 62.31 H new ATOM 0 HD11 LEU A 24 6.571 17.419 6.684 1.00 41.13 H new ATOM 0 HD12 LEU A 24 7.647 18.791 7.041 1.00 41.13 H new ATOM 0 HD13 LEU A 24 6.438 18.924 5.742 1.00 41.13 H new ATOM 0 HD21 LEU A 24 6.887 16.085 4.633 1.00 42.14 H new ATOM 0 HD22 LEU A 24 6.767 17.537 3.611 1.00 42.14 H new ATOM 0 HD23 LEU A 24 8.195 16.482 3.494 1.00 42.14 H new ATOM 382 N PRO A 25 11.545 20.226 5.653 1.00 40.23 N ATOM 383 CA PRO A 25 12.379 20.731 6.747 1.00 0.15 C ATOM 384 C PRO A 25 11.704 20.583 8.107 1.00 54.35 C ATOM 385 O PRO A 25 10.577 21.039 8.303 1.00 21.13 O ATOM 386 CB PRO A 25 12.563 22.210 6.400 1.00 41.51 C ATOM 387 CG PRO A 25 11.377 22.554 5.567 1.00 50.33 C ATOM 388 CD PRO A 25 11.040 21.310 4.793 1.00 35.32 C ATOM 0 HA PRO A 25 13.315 20.180 6.833 1.00 0.15 H new ATOM 0 HB2 PRO A 25 12.607 22.825 7.299 1.00 41.51 H new ATOM 0 HB3 PRO A 25 13.492 22.376 5.854 1.00 41.51 H new ATOM 0 HG2 PRO A 25 10.539 22.865 6.191 1.00 50.33 H new ATOM 0 HG3 PRO A 25 11.599 23.383 4.895 1.00 50.33 H new ATOM 0 HD2 PRO A 25 9.967 21.221 4.623 1.00 35.32 H new ATOM 0 HD3 PRO A 25 11.520 21.303 3.814 1.00 35.32 H new ATOM 396 N SER A 26 12.399 19.944 9.042 1.00 61.15 N ATOM 397 CA SER A 26 11.865 19.733 10.382 1.00 54.22 C ATOM 398 C SER A 26 12.828 20.262 11.440 1.00 31.12 C ATOM 399 O SER A 26 13.812 20.931 11.123 1.00 11.11 O ATOM 400 CB SER A 26 11.595 18.246 10.618 1.00 23.14 C ATOM 401 OG SER A 26 10.804 18.049 11.778 1.00 64.03 O ATOM 0 H SER A 26 13.334 19.563 8.896 1.00 61.15 H new ATOM 0 HA SER A 26 10.927 20.282 10.463 1.00 54.22 H new ATOM 0 HB2 SER A 26 11.087 17.823 9.751 1.00 23.14 H new ATOM 0 HB3 SER A 26 12.540 17.714 10.724 1.00 23.14 H new ATOM 0 HG SER A 26 11.340 17.606 12.468 1.00 64.03 H new ATOM 407 N THR A 27 12.537 19.957 12.701 1.00 24.21 N ATOM 408 CA THR A 27 13.376 20.401 13.808 1.00 55.15 C ATOM 409 C THR A 27 14.844 20.091 13.544 1.00 65.14 C ATOM 410 O THR A 27 15.684 20.991 13.508 1.00 11.42 O ATOM 411 CB THR A 27 12.953 19.740 15.133 1.00 21.01 C ATOM 412 OG1 THR A 27 12.695 18.347 14.925 1.00 23.24 O ATOM 413 CG2 THR A 27 11.712 20.411 15.701 1.00 12.32 C ATOM 0 H THR A 27 11.727 19.404 12.981 1.00 24.21 H new ATOM 0 HA THR A 27 13.245 21.480 13.891 1.00 55.15 H new ATOM 0 HB THR A 27 13.768 19.856 15.847 1.00 21.01 H new ATOM 0 HG1 THR A 27 12.428 17.934 15.773 1.00 23.24 H new ATOM 0 HG21 THR A 27 11.433 19.927 16.637 1.00 12.32 H new ATOM 0 HG22 THR A 27 11.920 21.465 15.886 1.00 12.32 H new ATOM 0 HG23 THR A 27 10.892 20.323 14.988 1.00 12.32 H new ATOM 421 N THR A 28 15.150 18.810 13.358 1.00 42.41 N ATOM 422 CA THR A 28 16.518 18.381 13.097 1.00 4.35 C ATOM 423 C THR A 28 17.025 18.935 11.771 1.00 62.03 C ATOM 424 O THR A 28 18.225 18.919 11.498 1.00 53.31 O ATOM 425 CB THR A 28 16.631 16.845 13.076 1.00 10.22 C ATOM 426 OG1 THR A 28 15.458 16.276 12.485 1.00 54.14 O ATOM 427 CG2 THR A 28 16.813 16.296 14.483 1.00 13.43 C ATOM 0 H THR A 28 14.468 18.052 13.383 1.00 42.41 H new ATOM 0 HA THR A 28 17.132 18.772 13.909 1.00 4.35 H new ATOM 0 HB THR A 28 17.504 16.575 12.482 1.00 10.22 H new ATOM 0 HG1 THR A 28 15.538 15.299 12.474 1.00 54.14 H new ATOM 0 HG21 THR A 28 16.890 15.210 14.442 1.00 13.43 H new ATOM 0 HG22 THR A 28 17.723 16.708 14.920 1.00 13.43 H new ATOM 0 HG23 THR A 28 15.957 16.576 15.096 1.00 13.43 H new ATOM 435 N GLY A 29 16.103 19.425 10.948 1.00 13.20 N ATOM 436 CA GLY A 29 16.476 19.978 9.659 1.00 24.22 C ATOM 437 C GLY A 29 15.928 19.169 8.501 1.00 53.25 C ATOM 438 O GLY A 29 15.396 19.729 7.542 1.00 2.11 O ATOM 0 H GLY A 29 15.104 19.449 11.151 1.00 13.20 H new ATOM 0 HA2 GLY A 29 16.111 21.003 9.587 1.00 24.22 H new ATOM 0 HA3 GLY A 29 17.563 20.021 9.586 1.00 24.22 H new ATOM 442 N GLN A 30 16.058 17.849 8.588 1.00 50.42 N ATOM 443 CA GLN A 30 15.573 16.963 7.536 1.00 13.24 C ATOM 444 C GLN A 30 14.551 15.974 8.087 1.00 53.00 C ATOM 445 O GLN A 30 14.748 15.391 9.154 1.00 72.32 O ATOM 446 CB GLN A 30 16.740 16.207 6.899 1.00 55.24 C ATOM 447 CG GLN A 30 17.098 16.704 5.507 1.00 21.52 C ATOM 448 CD GLN A 30 18.514 16.340 5.105 1.00 51.31 C ATOM 449 OE1 GLN A 30 19.253 15.728 5.876 1.00 1.24 O ATOM 450 NE2 GLN A 30 18.900 16.716 3.891 1.00 13.42 N ATOM 0 H GLN A 30 16.495 17.370 9.375 1.00 50.42 H new ATOM 0 HA GLN A 30 15.087 17.574 6.775 1.00 13.24 H new ATOM 0 HB2 GLN A 30 17.615 16.295 7.544 1.00 55.24 H new ATOM 0 HB3 GLN A 30 16.490 15.148 6.845 1.00 55.24 H new ATOM 0 HG2 GLN A 30 16.399 16.283 4.784 1.00 21.52 H new ATOM 0 HG3 GLN A 30 16.981 17.787 5.470 1.00 21.52 H new ATOM 0 HE21 GLN A 30 18.254 17.222 3.284 1.00 13.42 H new ATOM 0 HE22 GLN A 30 19.842 16.499 3.565 1.00 13.42 H new ATOM 459 N LEU A 31 13.459 15.790 7.353 1.00 34.25 N ATOM 460 CA LEU A 31 12.404 14.871 7.768 1.00 23.14 C ATOM 461 C LEU A 31 11.893 14.057 6.583 1.00 5.55 C ATOM 462 O LEU A 31 11.781 14.567 5.470 1.00 41.54 O ATOM 463 CB LEU A 31 11.249 15.644 8.407 1.00 70.21 C ATOM 464 CG LEU A 31 9.926 14.889 8.535 1.00 75.44 C ATOM 465 CD1 LEU A 31 10.108 13.628 9.366 1.00 43.14 C ATOM 466 CD2 LEU A 31 8.858 15.783 9.147 1.00 11.41 C ATOM 0 H LEU A 31 13.281 16.265 6.468 1.00 34.25 H new ATOM 0 HA LEU A 31 12.823 14.184 8.503 1.00 23.14 H new ATOM 0 HB2 LEU A 31 11.559 15.965 9.402 1.00 70.21 H new ATOM 0 HB3 LEU A 31 11.074 16.546 7.821 1.00 70.21 H new ATOM 0 HG LEU A 31 9.599 14.598 7.537 1.00 75.44 H new ATOM 0 HD11 LEU A 31 9.155 13.104 9.446 1.00 43.14 H new ATOM 0 HD12 LEU A 31 10.840 12.979 8.886 1.00 43.14 H new ATOM 0 HD13 LEU A 31 10.459 13.896 10.362 1.00 43.14 H new ATOM 0 HD21 LEU A 31 7.923 15.229 9.230 1.00 11.41 H new ATOM 0 HD22 LEU A 31 9.178 16.106 10.138 1.00 11.41 H new ATOM 0 HD23 LEU A 31 8.707 16.656 8.512 1.00 11.41 H new ATOM 478 N GLY A 32 11.583 12.789 6.833 1.00 62.33 N ATOM 479 CA GLY A 32 11.086 11.926 5.777 1.00 32.44 C ATOM 480 C GLY A 32 10.109 10.886 6.290 1.00 11.45 C ATOM 481 O GLY A 32 10.471 10.030 7.098 1.00 70.12 O ATOM 0 H GLY A 32 11.667 12.344 7.747 1.00 62.33 H new ATOM 0 HA2 GLY A 32 10.598 12.534 5.015 1.00 32.44 H new ATOM 0 HA3 GLY A 32 11.926 11.425 5.296 1.00 32.44 H new ATOM 485 N ILE A 33 8.867 10.962 5.823 1.00 25.11 N ATOM 486 CA ILE A 33 7.836 10.021 6.241 1.00 71.44 C ATOM 487 C ILE A 33 7.407 9.126 5.083 1.00 72.04 C ATOM 488 O ILE A 33 7.345 9.566 3.934 1.00 73.13 O ATOM 489 CB ILE A 33 6.599 10.751 6.796 1.00 31.21 C ATOM 490 CG1 ILE A 33 6.990 11.630 7.986 1.00 61.13 C ATOM 491 CG2 ILE A 33 5.529 9.748 7.201 1.00 22.40 C ATOM 492 CD1 ILE A 33 6.463 13.045 7.891 1.00 64.34 C ATOM 0 H ILE A 33 8.551 11.665 5.155 1.00 25.11 H new ATOM 0 HA ILE A 33 8.270 9.407 7.030 1.00 71.44 H new ATOM 0 HB ILE A 33 6.192 11.391 6.013 1.00 31.21 H new ATOM 0 HG12 ILE A 33 6.618 11.173 8.903 1.00 61.13 H new ATOM 0 HG13 ILE A 33 8.077 11.660 8.064 1.00 61.13 H new ATOM 0 HG21 ILE A 33 4.661 10.280 7.591 1.00 22.40 H new ATOM 0 HG22 ILE A 33 5.234 9.160 6.332 1.00 22.40 H new ATOM 0 HG23 ILE A 33 5.924 9.085 7.970 1.00 22.40 H new ATOM 0 HD11 ILE A 33 6.779 13.610 8.768 1.00 64.34 H new ATOM 0 HD12 ILE A 33 6.856 13.520 6.992 1.00 64.34 H new ATOM 0 HD13 ILE A 33 5.374 13.025 7.844 1.00 64.34 H new ATOM 504 N LEU A 34 7.110 7.869 5.392 1.00 32.22 N ATOM 505 CA LEU A 34 6.684 6.911 4.378 1.00 51.15 C ATOM 506 C LEU A 34 5.499 6.086 4.870 1.00 1.44 C ATOM 507 O LEU A 34 5.032 6.263 5.996 1.00 65.33 O ATOM 508 CB LEU A 34 7.843 5.986 4.003 1.00 40.14 C ATOM 509 CG LEU A 34 9.224 6.638 3.924 1.00 11.24 C ATOM 510 CD1 LEU A 34 10.008 6.382 5.202 1.00 64.32 C ATOM 511 CD2 LEU A 34 9.989 6.123 2.714 1.00 41.40 C ATOM 0 H LEU A 34 7.156 7.489 6.337 1.00 32.22 H new ATOM 0 HA LEU A 34 6.372 7.469 3.495 1.00 51.15 H new ATOM 0 HB2 LEU A 34 7.886 5.177 4.732 1.00 40.14 H new ATOM 0 HB3 LEU A 34 7.622 5.533 3.037 1.00 40.14 H new ATOM 0 HG LEU A 34 9.091 7.714 3.813 1.00 11.24 H new ATOM 0 HD11 LEU A 34 10.988 6.853 5.128 1.00 64.32 H new ATOM 0 HD12 LEU A 34 9.467 6.801 6.051 1.00 64.32 H new ATOM 0 HD13 LEU A 34 10.131 5.308 5.344 1.00 64.32 H new ATOM 0 HD21 LEU A 34 10.969 6.598 2.674 1.00 41.40 H new ATOM 0 HD22 LEU A 34 10.112 5.043 2.794 1.00 41.40 H new ATOM 0 HD23 LEU A 34 9.434 6.359 1.806 1.00 41.40 H new ATOM 523 N SER A 35 5.019 5.184 4.021 1.00 54.01 N ATOM 524 CA SER A 35 3.887 4.333 4.369 1.00 21.43 C ATOM 525 C SER A 35 4.270 3.342 5.464 1.00 31.43 C ATOM 526 O SER A 35 3.531 3.150 6.429 1.00 70.00 O ATOM 527 CB SER A 35 3.390 3.579 3.134 1.00 32.35 C ATOM 528 OG SER A 35 3.762 2.212 3.187 1.00 42.41 O ATOM 0 H SER A 35 5.396 5.023 3.087 1.00 54.01 H new ATOM 0 HA SER A 35 3.086 4.970 4.743 1.00 21.43 H new ATOM 0 HB2 SER A 35 2.305 3.662 3.066 1.00 32.35 H new ATOM 0 HB3 SER A 35 3.802 4.037 2.234 1.00 32.35 H new ATOM 0 HG SER A 35 3.187 1.693 2.587 1.00 42.41 H new ATOM 534 N ASN A 36 5.431 2.714 5.306 1.00 10.34 N ATOM 535 CA ASN A 36 5.913 1.742 6.281 1.00 41.03 C ATOM 536 C ASN A 36 6.153 2.402 7.635 1.00 43.20 C ATOM 537 O ASN A 36 6.247 1.726 8.660 1.00 75.22 O ATOM 538 CB ASN A 36 7.204 1.088 5.784 1.00 72.14 C ATOM 539 CG ASN A 36 6.946 -0.211 5.045 1.00 23.30 C ATOM 540 OD1 ASN A 36 7.294 -1.290 5.525 1.00 62.53 O ATOM 541 ND2 ASN A 36 6.334 -0.113 3.871 1.00 51.22 N ATOM 0 H ASN A 36 6.055 2.861 4.513 1.00 10.34 H new ATOM 0 HA ASN A 36 5.148 0.975 6.401 1.00 41.03 H new ATOM 0 HB2 ASN A 36 7.728 1.780 5.125 1.00 72.14 H new ATOM 0 HB3 ASN A 36 7.861 0.896 6.632 1.00 72.14 H new ATOM 0 HD21 ASN A 36 6.134 -0.953 3.328 1.00 51.22 H new ATOM 0 HD22 ASN A 36 6.063 0.802 3.512 1.00 51.22 H new ATOM 548 N HIS A 37 6.252 3.728 7.632 1.00 71.12 N ATOM 549 CA HIS A 37 6.480 4.480 8.860 1.00 11.43 C ATOM 550 C HIS A 37 5.487 4.068 9.942 1.00 34.14 C ATOM 551 O HIS A 37 4.429 3.512 9.648 1.00 12.21 O ATOM 552 CB HIS A 37 6.366 5.981 8.592 1.00 11.45 C ATOM 553 CG HIS A 37 7.199 6.819 9.513 1.00 0.11 C ATOM 554 ND1 HIS A 37 6.869 7.490 10.641 1.00 62.14 N flip ATOM 555 CD2 HIS A 37 8.545 7.043 9.316 1.00 1.33 C flip ATOM 556 CE1 HIS A 37 8.010 8.100 11.101 1.00 13.14 C flip ATOM 557 NE2 HIS A 37 9.008 7.814 10.283 1.00 44.12 N flip ATOM 0 H HIS A 37 6.178 4.303 6.793 1.00 71.12 H new ATOM 0 HA HIS A 37 7.487 4.256 9.212 1.00 11.43 H new ATOM 0 HB2 HIS A 37 6.664 6.182 7.563 1.00 11.45 H new ATOM 0 HB3 HIS A 37 5.322 6.280 8.686 1.00 11.45 H new ATOM 0 HD2 HIS A 37 9.130 6.649 8.498 1.00 1.33 H new ATOM 0 HE1 HIS A 37 8.080 8.714 11.987 1.00 13.14 H new ATOM 0 HE2 HIS A 37 9.971 8.134 10.382 1.00 44.12 H new ATOM 565 N ALA A 38 5.835 4.343 11.195 1.00 43.20 N ATOM 566 CA ALA A 38 4.974 4.002 12.320 1.00 30.13 C ATOM 567 C ALA A 38 4.138 5.201 12.755 1.00 31.31 C ATOM 568 O ALA A 38 4.411 6.344 12.389 1.00 51.11 O ATOM 569 CB ALA A 38 5.807 3.486 13.485 1.00 55.32 C ATOM 0 H ALA A 38 6.708 4.801 11.456 1.00 43.20 H new ATOM 0 HA ALA A 38 4.292 3.215 11.998 1.00 30.13 H new ATOM 0 HB1 ALA A 38 5.151 3.235 14.318 1.00 55.32 H new ATOM 0 HB2 ALA A 38 6.355 2.597 13.174 1.00 55.32 H new ATOM 0 HB3 ALA A 38 6.512 4.256 13.797 1.00 55.32 H new ATOM 575 N PRO A 39 3.094 4.936 13.555 1.00 52.45 N ATOM 576 CA PRO A 39 2.196 5.981 14.056 1.00 5.32 C ATOM 577 C PRO A 39 2.875 6.887 15.078 1.00 22.34 C ATOM 578 O PRO A 39 3.043 6.513 16.240 1.00 71.51 O ATOM 579 CB PRO A 39 1.062 5.190 14.713 1.00 64.14 C ATOM 580 CG PRO A 39 1.678 3.885 15.086 1.00 55.41 C ATOM 581 CD PRO A 39 2.709 3.597 14.031 1.00 43.03 C ATOM 0 HA PRO A 39 1.863 6.648 13.261 1.00 5.32 H new ATOM 0 HB2 PRO A 39 0.673 5.709 15.589 1.00 64.14 H new ATOM 0 HB3 PRO A 39 0.226 5.052 14.027 1.00 64.14 H new ATOM 0 HG2 PRO A 39 2.135 3.938 16.074 1.00 55.41 H new ATOM 0 HG3 PRO A 39 0.927 3.096 15.124 1.00 55.41 H new ATOM 0 HD2 PRO A 39 3.562 3.055 14.440 1.00 43.03 H new ATOM 0 HD3 PRO A 39 2.300 2.987 13.226 1.00 43.03 H new ATOM 589 N LEU A 40 3.264 8.079 14.640 1.00 74.11 N ATOM 590 CA LEU A 40 3.924 9.039 15.518 1.00 62.15 C ATOM 591 C LEU A 40 3.641 10.470 15.071 1.00 63.44 C ATOM 592 O LEU A 40 3.416 10.729 13.888 1.00 61.03 O ATOM 593 CB LEU A 40 5.433 8.788 15.537 1.00 30.42 C ATOM 594 CG LEU A 40 6.242 9.633 16.522 1.00 54.45 C ATOM 595 CD1 LEU A 40 7.101 8.745 17.408 1.00 14.32 C ATOM 596 CD2 LEU A 40 7.105 10.640 15.776 1.00 50.24 C ATOM 0 H LEU A 40 3.134 8.404 13.682 1.00 74.11 H new ATOM 0 HA LEU A 40 3.527 8.907 16.524 1.00 62.15 H new ATOM 0 HB2 LEU A 40 5.603 7.736 15.767 1.00 30.42 H new ATOM 0 HB3 LEU A 40 5.823 8.963 14.534 1.00 30.42 H new ATOM 0 HG LEU A 40 5.546 10.181 17.158 1.00 54.45 H new ATOM 0 HD11 LEU A 40 7.669 9.364 18.102 1.00 14.32 H new ATOM 0 HD12 LEU A 40 6.462 8.064 17.969 1.00 14.32 H new ATOM 0 HD13 LEU A 40 7.789 8.169 16.789 1.00 14.32 H new ATOM 0 HD21 LEU A 40 7.674 11.233 16.492 1.00 50.24 H new ATOM 0 HD22 LEU A 40 7.792 10.111 15.115 1.00 50.24 H new ATOM 0 HD23 LEU A 40 6.468 11.298 15.185 1.00 50.24 H new ATOM 608 N LEU A 41 3.656 11.395 16.023 1.00 4.33 N ATOM 609 CA LEU A 41 3.404 12.801 15.728 1.00 52.41 C ATOM 610 C LEU A 41 4.685 13.621 15.844 1.00 60.14 C ATOM 611 O LEU A 41 5.575 13.296 16.631 1.00 74.31 O ATOM 612 CB LEU A 41 2.341 13.359 16.676 1.00 12.01 C ATOM 613 CG LEU A 41 2.707 13.375 18.160 1.00 23.15 C ATOM 614 CD1 LEU A 41 3.132 14.770 18.590 1.00 4.35 C ATOM 615 CD2 LEU A 41 1.538 12.888 19.004 1.00 51.12 C ATOM 0 H LEU A 41 3.840 11.197 17.007 1.00 4.33 H new ATOM 0 HA LEU A 41 3.041 12.871 14.703 1.00 52.41 H new ATOM 0 HB2 LEU A 41 2.108 14.379 16.369 1.00 12.01 H new ATOM 0 HB3 LEU A 41 1.430 12.773 16.553 1.00 12.01 H new ATOM 0 HG LEU A 41 3.547 12.698 18.314 1.00 23.15 H new ATOM 0 HD11 LEU A 41 3.389 14.762 19.649 1.00 4.35 H new ATOM 0 HD12 LEU A 41 4.000 15.081 18.009 1.00 4.35 H new ATOM 0 HD13 LEU A 41 2.312 15.468 18.421 1.00 4.35 H new ATOM 0 HD21 LEU A 41 1.817 12.906 20.057 1.00 51.12 H new ATOM 0 HD22 LEU A 41 0.678 13.539 18.845 1.00 51.12 H new ATOM 0 HD23 LEU A 41 1.280 11.869 18.715 1.00 51.12 H new ATOM 627 N THR A 42 4.772 14.688 15.055 1.00 24.22 N ATOM 628 CA THR A 42 5.944 15.555 15.070 1.00 73.15 C ATOM 629 C THR A 42 5.555 17.008 14.825 1.00 51.33 C ATOM 630 O THR A 42 4.413 17.305 14.474 1.00 62.53 O ATOM 631 CB THR A 42 6.974 15.125 14.008 1.00 11.10 C ATOM 632 OG1 THR A 42 8.184 15.874 14.169 1.00 61.54 O ATOM 633 CG2 THR A 42 6.425 15.335 12.605 1.00 74.50 C ATOM 0 H THR A 42 4.045 14.972 14.398 1.00 24.22 H new ATOM 0 HA THR A 42 6.393 15.463 16.059 1.00 73.15 H new ATOM 0 HB THR A 42 7.182 14.064 14.144 1.00 11.10 H new ATOM 0 HG1 THR A 42 8.835 15.594 13.492 1.00 61.54 H new ATOM 0 HG21 THR A 42 7.170 15.024 11.872 1.00 74.50 H new ATOM 0 HG22 THR A 42 5.520 14.742 12.476 1.00 74.50 H new ATOM 0 HG23 THR A 42 6.191 16.390 12.460 1.00 74.50 H new ATOM 641 N ALA A 43 6.512 17.912 15.012 1.00 73.55 N ATOM 642 CA ALA A 43 6.269 19.334 14.808 1.00 4.40 C ATOM 643 C ALA A 43 7.114 19.877 13.660 1.00 24.53 C ATOM 644 O ALA A 43 8.288 19.530 13.523 1.00 45.43 O ATOM 645 CB ALA A 43 6.555 20.107 16.087 1.00 25.33 C ATOM 0 H ALA A 43 7.462 17.684 15.304 1.00 73.55 H new ATOM 0 HA ALA A 43 5.219 19.463 14.545 1.00 4.40 H new ATOM 0 HB1 ALA A 43 6.369 21.168 15.920 1.00 25.33 H new ATOM 0 HB2 ALA A 43 5.905 19.746 16.884 1.00 25.33 H new ATOM 0 HB3 ALA A 43 7.596 19.962 16.375 1.00 25.33 H new ATOM 651 N LEU A 44 6.511 20.727 12.838 1.00 14.40 N ATOM 652 CA LEU A 44 7.208 21.317 11.701 1.00 51.54 C ATOM 653 C LEU A 44 7.012 22.830 11.667 1.00 61.23 C ATOM 654 O LEU A 44 5.994 23.343 12.130 1.00 43.54 O ATOM 655 CB LEU A 44 6.709 20.698 10.394 1.00 20.20 C ATOM 656 CG LEU A 44 6.399 19.201 10.436 1.00 24.04 C ATOM 657 CD1 LEU A 44 5.670 18.771 9.173 1.00 63.20 C ATOM 658 CD2 LEU A 44 7.679 18.397 10.616 1.00 34.43 C ATOM 0 H LEU A 44 5.540 21.024 12.937 1.00 14.40 H new ATOM 0 HA LEU A 44 8.272 21.109 11.812 1.00 51.54 H new ATOM 0 HB2 LEU A 44 5.807 21.227 10.086 1.00 20.20 H new ATOM 0 HB3 LEU A 44 7.460 20.872 9.623 1.00 20.20 H new ATOM 0 HG LEU A 44 5.749 19.007 11.289 1.00 24.04 H new ATOM 0 HD11 LEU A 44 5.458 17.703 9.221 1.00 63.20 H new ATOM 0 HD12 LEU A 44 4.734 19.323 9.087 1.00 63.20 H new ATOM 0 HD13 LEU A 44 6.295 18.978 8.304 1.00 63.20 H new ATOM 0 HD21 LEU A 44 7.440 17.334 10.644 1.00 34.43 H new ATOM 0 HD22 LEU A 44 8.354 18.596 9.783 1.00 34.43 H new ATOM 0 HD23 LEU A 44 8.161 18.685 11.550 1.00 34.43 H new ATOM 670 N GLU A 45 7.993 23.536 11.114 1.00 41.23 N ATOM 671 CA GLU A 45 7.927 24.990 11.018 1.00 30.24 C ATOM 672 C GLU A 45 7.567 25.426 9.601 1.00 4.31 C ATOM 673 O GLU A 45 7.426 24.598 8.701 1.00 55.34 O ATOM 674 CB GLU A 45 9.263 25.612 11.432 1.00 75.50 C ATOM 675 CG GLU A 45 9.158 26.533 12.636 1.00 42.05 C ATOM 676 CD GLU A 45 10.501 27.101 13.054 1.00 73.42 C ATOM 677 OE1 GLU A 45 11.401 26.306 13.396 1.00 60.15 O ATOM 678 OE2 GLU A 45 10.650 28.341 13.039 1.00 64.51 O ATOM 0 H GLU A 45 8.842 23.125 10.726 1.00 41.23 H new ATOM 0 HA GLU A 45 7.147 25.338 11.695 1.00 30.24 H new ATOM 0 HB2 GLU A 45 9.972 24.815 11.656 1.00 75.50 H new ATOM 0 HB3 GLU A 45 9.669 26.173 10.590 1.00 75.50 H new ATOM 0 HG2 GLU A 45 8.477 27.352 12.404 1.00 42.05 H new ATOM 0 HG3 GLU A 45 8.723 25.985 13.472 1.00 42.05 H new ATOM 685 N THR A 46 7.421 26.734 9.410 1.00 34.21 N ATOM 686 CA THR A 46 7.076 27.282 8.104 1.00 31.53 C ATOM 687 C THR A 46 8.066 26.826 7.038 1.00 34.42 C ATOM 688 O THR A 46 9.275 26.811 7.265 1.00 14.31 O ATOM 689 CB THR A 46 7.042 28.821 8.132 1.00 10.30 C ATOM 690 OG1 THR A 46 6.729 29.328 6.830 1.00 71.01 O ATOM 691 CG2 THR A 46 8.378 29.384 8.593 1.00 62.21 C ATOM 0 H THR A 46 7.536 27.433 10.144 1.00 34.21 H new ATOM 0 HA THR A 46 6.082 26.909 7.857 1.00 31.53 H new ATOM 0 HB THR A 46 6.272 29.132 8.838 1.00 10.30 H new ATOM 0 HG1 THR A 46 5.773 29.537 6.781 1.00 71.01 H new ATOM 0 HG21 THR A 46 8.329 30.473 8.605 1.00 62.21 H new ATOM 0 HG22 THR A 46 8.600 29.020 9.596 1.00 62.21 H new ATOM 0 HG23 THR A 46 9.164 29.063 7.909 1.00 62.21 H new ATOM 699 N GLY A 47 7.544 26.454 5.873 1.00 31.41 N ATOM 700 CA GLY A 47 8.396 26.003 4.789 1.00 65.43 C ATOM 701 C GLY A 47 7.610 25.374 3.656 1.00 71.22 C ATOM 702 O GLY A 47 6.388 25.509 3.589 1.00 41.25 O ATOM 0 H GLY A 47 6.546 26.457 5.661 1.00 31.41 H new ATOM 0 HA2 GLY A 47 8.968 26.848 4.405 1.00 65.43 H new ATOM 0 HA3 GLY A 47 9.115 25.280 5.173 1.00 65.43 H new ATOM 706 N VAL A 48 8.311 24.685 2.761 1.00 24.23 N ATOM 707 CA VAL A 48 7.671 24.033 1.625 1.00 42.20 C ATOM 708 C VAL A 48 7.801 22.517 1.717 1.00 75.15 C ATOM 709 O VAL A 48 8.794 21.998 2.224 1.00 4.21 O ATOM 710 CB VAL A 48 8.276 24.509 0.291 1.00 41.41 C ATOM 711 CG1 VAL A 48 9.721 24.052 0.166 1.00 23.42 C ATOM 712 CG2 VAL A 48 7.446 24.006 -0.880 1.00 32.20 C ATOM 0 H VAL A 48 9.323 24.564 2.801 1.00 24.23 H new ATOM 0 HA VAL A 48 6.616 24.307 1.656 1.00 42.20 H new ATOM 0 HB VAL A 48 8.262 25.599 0.275 1.00 41.41 H new ATOM 0 HG11 VAL A 48 10.131 24.398 -0.783 1.00 23.42 H new ATOM 0 HG12 VAL A 48 10.306 24.467 0.987 1.00 23.42 H new ATOM 0 HG13 VAL A 48 9.763 22.963 0.204 1.00 23.42 H new ATOM 0 HG21 VAL A 48 7.888 24.352 -1.814 1.00 32.20 H new ATOM 0 HG22 VAL A 48 7.425 22.916 -0.870 1.00 32.20 H new ATOM 0 HG23 VAL A 48 6.429 24.389 -0.796 1.00 32.20 H new ATOM 722 N MET A 49 6.789 21.811 1.221 1.00 1.31 N ATOM 723 CA MET A 49 6.791 20.353 1.246 1.00 53.24 C ATOM 724 C MET A 49 6.881 19.786 -0.168 1.00 23.15 C ATOM 725 O MET A 49 6.212 20.265 -1.083 1.00 34.13 O ATOM 726 CB MET A 49 5.529 19.832 1.937 1.00 44.00 C ATOM 727 CG MET A 49 5.338 18.330 1.801 1.00 41.24 C ATOM 728 SD MET A 49 4.032 17.697 2.869 1.00 34.55 S ATOM 729 CE MET A 49 2.574 18.205 1.961 1.00 42.12 C ATOM 0 H MET A 49 5.958 22.225 0.798 1.00 1.31 H new ATOM 0 HA MET A 49 7.666 20.025 1.807 1.00 53.24 H new ATOM 0 HB2 MET A 49 5.571 20.090 2.995 1.00 44.00 H new ATOM 0 HB3 MET A 49 4.660 20.340 1.519 1.00 44.00 H new ATOM 0 HG2 MET A 49 5.102 18.090 0.764 1.00 41.24 H new ATOM 0 HG3 MET A 49 6.274 17.825 2.040 1.00 41.24 H new ATOM 0 HE1 MET A 49 1.707 17.655 2.328 1.00 42.12 H new ATOM 0 HE2 MET A 49 2.412 19.274 2.101 1.00 42.12 H new ATOM 0 HE3 MET A 49 2.714 17.995 0.901 1.00 42.12 H new ATOM 739 N ARG A 50 7.714 18.764 -0.338 1.00 35.22 N ATOM 740 CA ARG A 50 7.892 18.133 -1.640 1.00 23.11 C ATOM 741 C ARG A 50 7.465 16.669 -1.598 1.00 22.42 C ATOM 742 O ARG A 50 8.068 15.855 -0.898 1.00 11.15 O ATOM 743 CB ARG A 50 9.352 18.237 -2.085 1.00 24.24 C ATOM 744 CG ARG A 50 9.585 19.269 -3.176 1.00 73.21 C ATOM 745 CD ARG A 50 11.040 19.296 -3.616 1.00 40.31 C ATOM 746 NE ARG A 50 11.519 20.658 -3.837 1.00 64.11 N ATOM 747 CZ ARG A 50 12.766 20.950 -4.192 1.00 32.31 C ATOM 748 NH1 ARG A 50 13.653 19.980 -4.365 1.00 45.34 N ATOM 749 NH2 ARG A 50 13.126 22.214 -4.374 1.00 63.45 N ATOM 0 H ARG A 50 8.276 18.356 0.409 1.00 35.22 H new ATOM 0 HA ARG A 50 7.262 18.657 -2.359 1.00 23.11 H new ATOM 0 HB2 ARG A 50 9.969 18.488 -1.222 1.00 24.24 H new ATOM 0 HB3 ARG A 50 9.684 17.262 -2.442 1.00 24.24 H new ATOM 0 HG2 ARG A 50 8.949 19.045 -4.032 1.00 73.21 H new ATOM 0 HG3 ARG A 50 9.295 20.255 -2.813 1.00 73.21 H new ATOM 0 HD2 ARG A 50 11.657 18.813 -2.858 1.00 40.31 H new ATOM 0 HD3 ARG A 50 11.152 18.719 -4.534 1.00 40.31 H new ATOM 0 HE ARG A 50 10.861 21.427 -3.712 1.00 64.11 H new ATOM 0 HH11 ARG A 50 13.379 19.007 -4.226 1.00 45.34 H new ATOM 0 HH12 ARG A 50 14.610 20.206 -4.637 1.00 45.34 H new ATOM 0 HH21 ARG A 50 12.446 22.962 -4.241 1.00 63.45 H new ATOM 0 HH22 ARG A 50 14.083 22.437 -4.646 1.00 63.45 H new ATOM 763 N VAL A 51 6.421 16.340 -2.352 1.00 10.21 N ATOM 764 CA VAL A 51 5.913 14.974 -2.401 1.00 42.34 C ATOM 765 C VAL A 51 6.543 14.195 -3.551 1.00 11.33 C ATOM 766 O VAL A 51 6.747 14.732 -4.640 1.00 3.25 O ATOM 767 CB VAL A 51 4.381 14.950 -2.558 1.00 41.42 C ATOM 768 CG1 VAL A 51 3.852 13.531 -2.418 1.00 50.32 C ATOM 769 CG2 VAL A 51 3.728 15.875 -1.542 1.00 34.42 C ATOM 0 H VAL A 51 5.910 17.001 -2.937 1.00 10.21 H new ATOM 0 HA VAL A 51 6.181 14.502 -1.456 1.00 42.34 H new ATOM 0 HB VAL A 51 4.129 15.308 -3.556 1.00 41.42 H new ATOM 0 HG11 VAL A 51 2.768 13.534 -2.532 1.00 50.32 H new ATOM 0 HG12 VAL A 51 4.296 12.900 -3.188 1.00 50.32 H new ATOM 0 HG13 VAL A 51 4.112 13.141 -1.434 1.00 50.32 H new ATOM 0 HG21 VAL A 51 2.646 15.846 -1.667 1.00 34.42 H new ATOM 0 HG22 VAL A 51 3.986 15.549 -0.534 1.00 34.42 H new ATOM 0 HG23 VAL A 51 4.084 16.894 -1.696 1.00 34.42 H new ATOM 779 N ARG A 52 6.848 12.926 -3.301 1.00 11.11 N ATOM 780 CA ARG A 52 7.455 12.073 -4.315 1.00 22.52 C ATOM 781 C ARG A 52 6.709 10.746 -4.426 1.00 64.15 C ATOM 782 O ARG A 52 6.720 9.938 -3.498 1.00 71.25 O ATOM 783 CB ARG A 52 8.926 11.816 -3.982 1.00 2.41 C ATOM 784 CG ARG A 52 9.770 13.080 -3.942 1.00 25.31 C ATOM 785 CD ARG A 52 10.577 13.252 -5.220 1.00 32.53 C ATOM 786 NE ARG A 52 11.911 12.669 -5.107 1.00 62.24 N ATOM 787 CZ ARG A 52 12.925 13.267 -4.492 1.00 41.33 C ATOM 788 NH1 ARG A 52 12.757 14.459 -3.937 1.00 2.33 N ATOM 789 NH2 ARG A 52 14.110 12.673 -4.432 1.00 31.04 N ATOM 0 H ARG A 52 6.685 12.466 -2.405 1.00 11.11 H new ATOM 0 HA ARG A 52 7.391 12.588 -5.273 1.00 22.52 H new ATOM 0 HB2 ARG A 52 8.989 11.316 -3.016 1.00 2.41 H new ATOM 0 HB3 ARG A 52 9.344 11.133 -4.722 1.00 2.41 H new ATOM 0 HG2 ARG A 52 9.124 13.946 -3.799 1.00 25.31 H new ATOM 0 HG3 ARG A 52 10.445 13.041 -3.087 1.00 25.31 H new ATOM 0 HD2 ARG A 52 10.046 12.785 -6.050 1.00 32.53 H new ATOM 0 HD3 ARG A 52 10.664 14.313 -5.454 1.00 32.53 H new ATOM 0 HE ARG A 52 12.073 11.752 -5.523 1.00 62.24 H new ATOM 0 HH11 ARG A 52 11.848 14.919 -3.982 1.00 2.33 H new ATOM 0 HH12 ARG A 52 13.537 14.916 -3.465 1.00 2.33 H new ATOM 0 HH21 ARG A 52 14.243 11.756 -4.859 1.00 31.04 H new ATOM 0 HH22 ARG A 52 14.888 13.133 -3.959 1.00 31.04 H new ATOM 803 N GLN A 53 6.063 10.530 -5.568 1.00 4.41 N ATOM 804 CA GLN A 53 5.312 9.303 -5.800 1.00 33.35 C ATOM 805 C GLN A 53 6.217 8.206 -6.349 1.00 62.54 C ATOM 806 O GLN A 53 6.576 7.268 -5.636 1.00 44.34 O ATOM 807 CB GLN A 53 4.158 9.562 -6.769 1.00 74.35 C ATOM 808 CG GLN A 53 2.789 9.537 -6.108 1.00 23.14 C ATOM 809 CD GLN A 53 1.898 10.674 -6.567 1.00 71.42 C ATOM 810 OE1 GLN A 53 2.374 11.769 -6.868 1.00 62.54 O ATOM 811 NE2 GLN A 53 0.596 10.419 -6.624 1.00 12.51 N ATOM 0 H GLN A 53 6.045 11.189 -6.346 1.00 4.41 H new ATOM 0 HA GLN A 53 4.907 8.969 -4.845 1.00 33.35 H new ATOM 0 HB2 GLN A 53 4.305 10.532 -7.244 1.00 74.35 H new ATOM 0 HB3 GLN A 53 4.184 8.812 -7.560 1.00 74.35 H new ATOM 0 HG2 GLN A 53 2.301 8.587 -6.327 1.00 23.14 H new ATOM 0 HG3 GLN A 53 2.911 9.590 -5.026 1.00 23.14 H new ATOM 0 HE21 GLN A 53 0.245 9.497 -6.365 1.00 12.51 H new ATOM 0 HE22 GLN A 53 -0.053 11.145 -6.927 1.00 12.51 H new ATOM 820 N ASP A 54 6.582 8.328 -7.621 1.00 0.53 N ATOM 821 CA ASP A 54 7.446 7.347 -8.266 1.00 45.44 C ATOM 822 C ASP A 54 7.727 7.740 -9.714 1.00 24.44 C ATOM 823 O ASP A 54 7.821 6.883 -10.592 1.00 74.55 O ATOM 824 CB ASP A 54 6.805 5.960 -8.216 1.00 62.34 C ATOM 825 CG ASP A 54 7.811 4.868 -7.908 1.00 12.01 C ATOM 826 OD1 ASP A 54 8.404 4.900 -6.809 1.00 13.20 O ATOM 827 OD2 ASP A 54 8.004 3.981 -8.765 1.00 24.11 O ATOM 0 H ASP A 54 6.293 9.097 -8.225 1.00 0.53 H new ATOM 0 HA ASP A 54 8.392 7.321 -7.725 1.00 45.44 H new ATOM 0 HB2 ASP A 54 6.021 5.952 -7.458 1.00 62.34 H new ATOM 0 HB3 ASP A 54 6.326 5.750 -9.172 1.00 62.34 H new ATOM 832 N ARG A 55 7.860 9.040 -9.954 1.00 21.02 N ATOM 833 CA ARG A 55 8.128 9.546 -11.295 1.00 31.23 C ATOM 834 C ARG A 55 8.281 11.064 -11.283 1.00 32.04 C ATOM 835 O ARG A 55 9.239 11.605 -11.834 1.00 31.34 O ATOM 836 CB ARG A 55 7.002 9.144 -12.249 1.00 32.41 C ATOM 837 CG ARG A 55 7.488 8.421 -13.495 1.00 1.42 C ATOM 838 CD ARG A 55 6.879 7.033 -13.607 1.00 74.23 C ATOM 839 NE ARG A 55 5.626 7.044 -14.357 1.00 55.24 N ATOM 840 CZ ARG A 55 5.065 5.954 -14.869 1.00 21.33 C ATOM 841 NH1 ARG A 55 5.643 4.771 -14.711 1.00 3.00 N ATOM 842 NH2 ARG A 55 3.924 6.045 -15.539 1.00 34.00 N ATOM 0 H ARG A 55 7.787 9.762 -9.237 1.00 21.02 H new ATOM 0 HA ARG A 55 9.063 9.107 -11.642 1.00 31.23 H new ATOM 0 HB2 ARG A 55 6.299 8.502 -11.718 1.00 32.41 H new ATOM 0 HB3 ARG A 55 6.454 10.038 -12.548 1.00 32.41 H new ATOM 0 HG2 ARG A 55 7.231 9.005 -14.379 1.00 1.42 H new ATOM 0 HG3 ARG A 55 8.575 8.342 -13.470 1.00 1.42 H new ATOM 0 HD2 ARG A 55 7.588 6.364 -14.095 1.00 74.23 H new ATOM 0 HD3 ARG A 55 6.700 6.634 -12.609 1.00 74.23 H new ATOM 0 HE ARG A 55 5.155 7.938 -14.495 1.00 55.24 H new ATOM 0 HH11 ARG A 55 6.520 4.697 -14.196 1.00 3.00 H new ATOM 0 HH12 ARG A 55 5.211 3.935 -15.105 1.00 3.00 H new ATOM 0 HH21 ARG A 55 3.476 6.953 -15.662 1.00 34.00 H new ATOM 0 HH22 ARG A 55 3.495 5.207 -15.931 1.00 34.00 H new ATOM 856 N GLU A 56 7.329 11.745 -10.651 1.00 24.51 N ATOM 857 CA GLU A 56 7.359 13.200 -10.569 1.00 14.11 C ATOM 858 C GLU A 56 7.267 13.665 -9.118 1.00 41.24 C ATOM 859 O GLU A 56 7.266 12.852 -8.194 1.00 2.41 O ATOM 860 CB GLU A 56 6.211 13.802 -11.382 1.00 51.03 C ATOM 861 CG GLU A 56 6.185 13.342 -12.830 1.00 53.44 C ATOM 862 CD GLU A 56 7.257 14.005 -13.672 1.00 45.34 C ATOM 863 OE1 GLU A 56 7.381 15.246 -13.605 1.00 4.33 O ATOM 864 OE2 GLU A 56 7.973 13.284 -14.399 1.00 15.13 O ATOM 0 H GLU A 56 6.529 11.312 -10.189 1.00 24.51 H new ATOM 0 HA GLU A 56 8.307 13.542 -10.983 1.00 14.11 H new ATOM 0 HB2 GLU A 56 5.265 13.539 -10.909 1.00 51.03 H new ATOM 0 HB3 GLU A 56 6.289 14.889 -11.356 1.00 51.03 H new ATOM 0 HG2 GLU A 56 6.317 12.261 -12.866 1.00 53.44 H new ATOM 0 HG3 GLU A 56 5.206 13.558 -13.258 1.00 53.44 H new ATOM 871 N TRP A 57 7.191 14.977 -8.928 1.00 41.31 N ATOM 872 CA TRP A 57 7.100 15.551 -7.590 1.00 50.44 C ATOM 873 C TRP A 57 6.205 16.786 -7.587 1.00 72.45 C ATOM 874 O TRP A 57 6.054 17.457 -8.608 1.00 54.21 O ATOM 875 CB TRP A 57 8.493 15.915 -7.073 1.00 53.12 C ATOM 876 CG TRP A 57 9.165 16.985 -7.879 1.00 13.51 C ATOM 877 CD1 TRP A 57 8.946 18.331 -7.798 1.00 3.10 C ATOM 878 CD2 TRP A 57 10.163 16.799 -8.889 1.00 34.15 C ATOM 879 NE1 TRP A 57 9.748 18.992 -8.697 1.00 3.54 N ATOM 880 CE2 TRP A 57 10.505 18.075 -9.377 1.00 55.20 C ATOM 881 CE3 TRP A 57 10.802 15.679 -9.426 1.00 20.41 C ATOM 882 CZ2 TRP A 57 11.456 18.259 -10.377 1.00 31.21 C ATOM 883 CZ3 TRP A 57 11.746 15.863 -10.418 1.00 73.54 C ATOM 884 CH2 TRP A 57 12.066 17.144 -10.885 1.00 41.41 C ATOM 0 H TRP A 57 7.191 15.663 -9.683 1.00 41.31 H new ATOM 0 HA TRP A 57 6.659 14.804 -6.930 1.00 50.44 H new ATOM 0 HB2 TRP A 57 8.413 16.246 -6.038 1.00 53.12 H new ATOM 0 HB3 TRP A 57 9.118 15.022 -7.075 1.00 53.12 H new ATOM 0 HD1 TRP A 57 8.246 18.806 -7.126 1.00 3.10 H new ATOM 0 HE1 TRP A 57 9.775 20.002 -8.836 1.00 3.54 H new ATOM 0 HE3 TRP A 57 10.563 14.687 -9.072 1.00 20.41 H new ATOM 0 HZ2 TRP A 57 11.703 19.246 -10.739 1.00 31.21 H new ATOM 0 HZ3 TRP A 57 12.246 15.004 -10.841 1.00 73.54 H new ATOM 0 HH2 TRP A 57 12.809 17.254 -11.661 1.00 41.41 H new ATOM 895 N VAL A 58 5.613 17.080 -6.434 1.00 70.41 N ATOM 896 CA VAL A 58 4.733 18.235 -6.299 1.00 24.54 C ATOM 897 C VAL A 58 5.183 19.137 -5.155 1.00 65.12 C ATOM 898 O VAL A 58 5.724 18.666 -4.155 1.00 71.20 O ATOM 899 CB VAL A 58 3.275 17.804 -6.055 1.00 31.35 C ATOM 900 CG1 VAL A 58 2.355 19.015 -6.044 1.00 71.02 C ATOM 901 CG2 VAL A 58 2.834 16.798 -7.107 1.00 32.31 C ATOM 0 H VAL A 58 5.727 16.534 -5.580 1.00 70.41 H new ATOM 0 HA VAL A 58 4.789 18.787 -7.237 1.00 24.54 H new ATOM 0 HB VAL A 58 3.215 17.324 -5.078 1.00 31.35 H new ATOM 0 HG11 VAL A 58 1.329 18.691 -5.870 1.00 71.02 H new ATOM 0 HG12 VAL A 58 2.660 19.696 -5.250 1.00 71.02 H new ATOM 0 HG13 VAL A 58 2.416 19.527 -7.004 1.00 71.02 H new ATOM 0 HG21 VAL A 58 1.801 16.504 -6.919 1.00 32.31 H new ATOM 0 HG22 VAL A 58 2.909 17.250 -8.096 1.00 32.31 H new ATOM 0 HG23 VAL A 58 3.476 15.918 -7.061 1.00 32.31 H new ATOM 911 N ALA A 59 4.956 20.437 -5.310 1.00 42.12 N ATOM 912 CA ALA A 59 5.336 21.406 -4.290 1.00 31.04 C ATOM 913 C ALA A 59 4.110 22.112 -3.719 1.00 62.45 C ATOM 914 O ALA A 59 3.208 22.504 -4.460 1.00 42.31 O ATOM 915 CB ALA A 59 6.313 22.422 -4.863 1.00 73.44 C ATOM 0 H ALA A 59 4.511 20.843 -6.133 1.00 42.12 H new ATOM 0 HA ALA A 59 5.824 20.868 -3.478 1.00 31.04 H new ATOM 0 HB1 ALA A 59 6.588 23.139 -4.089 1.00 73.44 H new ATOM 0 HB2 ALA A 59 7.207 21.908 -5.215 1.00 73.44 H new ATOM 0 HB3 ALA A 59 5.845 22.948 -5.695 1.00 73.44 H new ATOM 921 N ILE A 60 4.084 22.269 -2.400 1.00 72.54 N ATOM 922 CA ILE A 60 2.968 22.927 -1.732 1.00 44.31 C ATOM 923 C ILE A 60 3.450 23.758 -0.547 1.00 63.33 C ATOM 924 O ILE A 60 3.988 23.222 0.422 1.00 74.05 O ATOM 925 CB ILE A 60 1.925 21.907 -1.239 1.00 65.01 C ATOM 926 CG1 ILE A 60 1.393 21.082 -2.412 1.00 61.33 C ATOM 927 CG2 ILE A 60 0.786 22.618 -0.524 1.00 61.31 C ATOM 928 CD1 ILE A 60 0.373 20.041 -2.006 1.00 4.04 C ATOM 0 H ILE A 60 4.823 21.950 -1.773 1.00 72.54 H new ATOM 0 HA ILE A 60 2.502 23.583 -2.468 1.00 44.31 H new ATOM 0 HB ILE A 60 2.405 21.231 -0.532 1.00 65.01 H new ATOM 0 HG12 ILE A 60 0.943 21.753 -3.143 1.00 61.33 H new ATOM 0 HG13 ILE A 60 2.229 20.587 -2.906 1.00 61.33 H new ATOM 0 HG21 ILE A 60 0.057 21.884 -0.181 1.00 61.31 H new ATOM 0 HG22 ILE A 60 1.179 23.166 0.332 1.00 61.31 H new ATOM 0 HG23 ILE A 60 0.304 23.315 -1.210 1.00 61.31 H new ATOM 0 HD11 ILE A 60 0.040 19.494 -2.888 1.00 4.04 H new ATOM 0 HD12 ILE A 60 0.824 19.346 -1.298 1.00 4.04 H new ATOM 0 HD13 ILE A 60 -0.481 20.531 -1.539 1.00 4.04 H new ATOM 940 N ALA A 61 3.253 25.069 -0.632 1.00 14.25 N ATOM 941 CA ALA A 61 3.663 25.974 0.435 1.00 23.32 C ATOM 942 C ALA A 61 2.868 25.716 1.710 1.00 31.44 C ATOM 943 O ALA A 61 1.662 25.959 1.762 1.00 55.21 O ATOM 944 CB ALA A 61 3.500 27.420 -0.007 1.00 50.24 C ATOM 0 H ALA A 61 2.812 25.529 -1.429 1.00 14.25 H new ATOM 0 HA ALA A 61 4.715 25.788 0.650 1.00 23.32 H new ATOM 0 HB1 ALA A 61 3.810 28.084 0.800 1.00 50.24 H new ATOM 0 HB2 ALA A 61 4.118 27.604 -0.886 1.00 50.24 H new ATOM 0 HB3 ALA A 61 2.455 27.610 -0.252 1.00 50.24 H new ATOM 950 N LEU A 62 3.550 25.221 2.737 1.00 31.14 N ATOM 951 CA LEU A 62 2.906 24.929 4.014 1.00 64.14 C ATOM 952 C LEU A 62 3.603 25.663 5.155 1.00 31.31 C ATOM 953 O LEU A 62 4.706 25.297 5.559 1.00 4.21 O ATOM 954 CB LEU A 62 2.916 23.422 4.279 1.00 3.53 C ATOM 955 CG LEU A 62 1.929 22.920 5.333 1.00 1.35 C ATOM 956 CD1 LEU A 62 1.107 21.763 4.787 1.00 42.30 C ATOM 957 CD2 LEU A 62 2.666 22.503 6.598 1.00 15.31 C ATOM 0 H LEU A 62 4.548 25.013 2.711 1.00 31.14 H new ATOM 0 HA LEU A 62 1.874 25.275 3.961 1.00 64.14 H new ATOM 0 HB2 LEU A 62 2.708 22.907 3.341 1.00 3.53 H new ATOM 0 HB3 LEU A 62 3.922 23.134 4.585 1.00 3.53 H new ATOM 0 HG LEU A 62 1.250 23.735 5.584 1.00 1.35 H new ATOM 0 HD11 LEU A 62 0.410 21.419 5.551 1.00 42.30 H new ATOM 0 HD12 LEU A 62 0.550 22.094 3.911 1.00 42.30 H new ATOM 0 HD13 LEU A 62 1.771 20.945 4.507 1.00 42.30 H new ATOM 0 HD21 LEU A 62 1.948 22.148 7.337 1.00 15.31 H new ATOM 0 HD22 LEU A 62 3.369 21.704 6.363 1.00 15.31 H new ATOM 0 HD23 LEU A 62 3.209 23.358 7.001 1.00 15.31 H new ATOM 969 N MET A 63 2.949 26.698 5.672 1.00 45.10 N ATOM 970 CA MET A 63 3.505 27.481 6.770 1.00 50.02 C ATOM 971 C MET A 63 3.614 26.639 8.037 1.00 2.11 C ATOM 972 O MET A 63 3.441 25.422 8.002 1.00 63.42 O ATOM 973 CB MET A 63 2.638 28.713 7.035 1.00 1.43 C ATOM 974 CG MET A 63 2.376 29.551 5.794 1.00 34.40 C ATOM 975 SD MET A 63 3.858 30.379 5.189 1.00 41.50 S ATOM 976 CE MET A 63 4.049 31.670 6.416 1.00 24.13 C ATOM 0 H MET A 63 2.035 27.014 5.349 1.00 45.10 H new ATOM 0 HA MET A 63 4.506 27.805 6.483 1.00 50.02 H new ATOM 0 HB2 MET A 63 1.684 28.392 7.455 1.00 1.43 H new ATOM 0 HB3 MET A 63 3.124 29.334 7.787 1.00 1.43 H new ATOM 0 HG2 MET A 63 1.975 28.912 5.007 1.00 34.40 H new ATOM 0 HG3 MET A 63 1.614 30.297 6.019 1.00 34.40 H new ATOM 0 HE1 MET A 63 4.956 32.237 6.209 1.00 24.13 H new ATOM 0 HE2 MET A 63 3.188 32.337 6.379 1.00 24.13 H new ATOM 0 HE3 MET A 63 4.119 31.222 7.407 1.00 24.13 H new ATOM 986 N GLY A 64 3.903 27.297 9.156 1.00 33.43 N ATOM 987 CA GLY A 64 4.030 26.592 10.419 1.00 44.14 C ATOM 988 C GLY A 64 2.833 25.712 10.715 1.00 73.52 C ATOM 989 O GLY A 64 1.689 26.123 10.524 1.00 31.44 O ATOM 0 H GLY A 64 4.051 28.305 9.211 1.00 33.43 H new ATOM 0 HA2 GLY A 64 4.931 25.980 10.400 1.00 44.14 H new ATOM 0 HA3 GLY A 64 4.153 27.316 11.225 1.00 44.14 H new ATOM 993 N GLY A 65 3.096 24.494 11.181 1.00 14.42 N ATOM 994 CA GLY A 65 2.020 23.572 11.495 1.00 61.11 C ATOM 995 C GLY A 65 2.520 22.298 12.147 1.00 44.12 C ATOM 996 O GLY A 65 3.688 22.203 12.525 1.00 1.13 O ATOM 0 H GLY A 65 4.034 24.130 11.346 1.00 14.42 H new ATOM 0 HA2 GLY A 65 1.308 24.062 12.160 1.00 61.11 H new ATOM 0 HA3 GLY A 65 1.482 23.322 10.581 1.00 61.11 H new ATOM 1000 N PHE A 66 1.635 21.316 12.280 1.00 11.31 N ATOM 1001 CA PHE A 66 1.992 20.043 12.894 1.00 64.54 C ATOM 1002 C PHE A 66 1.671 18.880 11.959 1.00 22.32 C ATOM 1003 O PHE A 66 0.662 18.895 11.256 1.00 54.42 O ATOM 1004 CB PHE A 66 1.251 19.865 14.220 1.00 11.32 C ATOM 1005 CG PHE A 66 1.638 20.875 15.263 1.00 72.13 C ATOM 1006 CD1 PHE A 66 2.752 20.673 16.061 1.00 0.34 C ATOM 1007 CD2 PHE A 66 0.888 22.026 15.444 1.00 72.32 C ATOM 1008 CE1 PHE A 66 3.110 21.600 17.022 1.00 53.41 C ATOM 1009 CE2 PHE A 66 1.241 22.957 16.403 1.00 72.34 C ATOM 1010 CZ PHE A 66 2.354 22.744 17.192 1.00 50.11 C ATOM 0 H PHE A 66 0.665 21.378 11.971 1.00 11.31 H new ATOM 0 HA PHE A 66 3.065 20.049 13.084 1.00 64.54 H new ATOM 0 HB2 PHE A 66 0.178 19.934 14.040 1.00 11.32 H new ATOM 0 HB3 PHE A 66 1.446 18.864 14.605 1.00 11.32 H new ATOM 0 HD1 PHE A 66 3.347 19.781 15.931 1.00 0.34 H new ATOM 0 HD2 PHE A 66 0.017 22.198 14.829 1.00 72.32 H new ATOM 0 HE1 PHE A 66 3.980 21.430 17.639 1.00 53.41 H new ATOM 0 HE2 PHE A 66 0.647 23.849 16.535 1.00 72.34 H new ATOM 0 HZ PHE A 66 2.633 23.470 17.941 1.00 50.11 H new ATOM 1020 N ALA A 67 2.538 17.873 11.958 1.00 65.32 N ATOM 1021 CA ALA A 67 2.347 16.701 11.112 1.00 44.11 C ATOM 1022 C ALA A 67 2.299 15.425 11.945 1.00 75.33 C ATOM 1023 O ALA A 67 3.086 15.249 12.874 1.00 15.32 O ATOM 1024 CB ALA A 67 3.456 16.614 10.073 1.00 32.22 C ATOM 0 H ALA A 67 3.380 17.845 12.534 1.00 65.32 H new ATOM 0 HA ALA A 67 1.391 16.805 10.599 1.00 44.11 H new ATOM 0 HB1 ALA A 67 3.301 15.734 9.448 1.00 32.22 H new ATOM 0 HB2 ALA A 67 3.442 17.508 9.450 1.00 32.22 H new ATOM 0 HB3 ALA A 67 4.420 16.537 10.576 1.00 32.22 H new ATOM 1030 N GLU A 68 1.369 14.537 11.605 1.00 12.22 N ATOM 1031 CA GLU A 68 1.217 13.278 12.324 1.00 64.50 C ATOM 1032 C GLU A 68 0.898 12.137 11.362 1.00 53.12 C ATOM 1033 O GLU A 68 -0.159 12.121 10.730 1.00 20.52 O ATOM 1034 CB GLU A 68 0.114 13.395 13.377 1.00 11.24 C ATOM 1035 CG GLU A 68 0.246 14.623 14.263 1.00 51.25 C ATOM 1036 CD GLU A 68 -0.454 15.837 13.684 1.00 54.41 C ATOM 1037 OE1 GLU A 68 -1.609 15.697 13.230 1.00 61.34 O ATOM 1038 OE2 GLU A 68 0.153 16.929 13.686 1.00 70.31 O ATOM 0 H GLU A 68 0.711 14.667 10.837 1.00 12.22 H new ATOM 0 HA GLU A 68 2.162 13.058 12.822 1.00 64.50 H new ATOM 0 HB2 GLU A 68 -0.854 13.421 12.876 1.00 11.24 H new ATOM 0 HB3 GLU A 68 0.125 12.503 14.003 1.00 11.24 H new ATOM 0 HG2 GLU A 68 -0.169 14.403 15.247 1.00 51.25 H new ATOM 0 HG3 GLU A 68 1.302 14.851 14.407 1.00 51.25 H new ATOM 1045 N VAL A 69 1.819 11.185 11.255 1.00 31.21 N ATOM 1046 CA VAL A 69 1.636 10.040 10.371 1.00 62.11 C ATOM 1047 C VAL A 69 1.325 8.776 11.165 1.00 4.32 C ATOM 1048 O VAL A 69 1.826 8.590 12.274 1.00 55.11 O ATOM 1049 CB VAL A 69 2.886 9.794 9.505 1.00 40.41 C ATOM 1050 CG1 VAL A 69 3.972 9.107 10.318 1.00 45.11 C ATOM 1051 CG2 VAL A 69 2.529 8.973 8.275 1.00 13.23 C ATOM 0 H VAL A 69 2.700 11.184 11.770 1.00 31.21 H new ATOM 0 HA VAL A 69 0.793 10.274 9.721 1.00 62.11 H new ATOM 0 HB VAL A 69 3.271 10.758 9.171 1.00 40.41 H new ATOM 0 HG11 VAL A 69 4.847 8.941 9.690 1.00 45.11 H new ATOM 0 HG12 VAL A 69 4.247 9.737 11.164 1.00 45.11 H new ATOM 0 HG13 VAL A 69 3.602 8.149 10.684 1.00 45.11 H new ATOM 0 HG21 VAL A 69 3.424 8.809 7.675 1.00 13.23 H new ATOM 0 HG22 VAL A 69 2.119 8.012 8.585 1.00 13.23 H new ATOM 0 HG23 VAL A 69 1.788 9.509 7.682 1.00 13.23 H new ATOM 1061 N GLU A 70 0.497 7.911 10.589 1.00 33.24 N ATOM 1062 CA GLU A 70 0.119 6.664 11.245 1.00 41.12 C ATOM 1063 C GLU A 70 -0.688 5.777 10.302 1.00 72.52 C ATOM 1064 O GLU A 70 -1.728 6.185 9.786 1.00 22.13 O ATOM 1065 CB GLU A 70 -0.691 6.952 12.510 1.00 12.33 C ATOM 1066 CG GLU A 70 -1.848 7.912 12.287 1.00 72.41 C ATOM 1067 CD GLU A 70 -1.614 9.267 12.926 1.00 73.30 C ATOM 1068 OE1 GLU A 70 -1.151 9.305 14.085 1.00 72.30 O ATOM 1069 OE2 GLU A 70 -1.894 10.289 12.266 1.00 14.41 O ATOM 0 H GLU A 70 0.075 8.050 9.671 1.00 33.24 H new ATOM 0 HA GLU A 70 1.032 6.137 11.520 1.00 41.12 H new ATOM 0 HB2 GLU A 70 -1.080 6.013 12.904 1.00 12.33 H new ATOM 0 HB3 GLU A 70 -0.028 7.366 13.270 1.00 12.33 H new ATOM 0 HG2 GLU A 70 -2.006 8.042 11.216 1.00 72.41 H new ATOM 0 HG3 GLU A 70 -2.761 7.476 12.693 1.00 72.41 H new ATOM 1076 N ASN A 71 -0.200 4.560 10.081 1.00 35.02 N ATOM 1077 CA ASN A 71 -0.875 3.614 9.200 1.00 53.34 C ATOM 1078 C ASN A 71 -1.217 4.265 7.863 1.00 43.33 C ATOM 1079 O ASN A 71 -2.368 4.250 7.430 1.00 51.52 O ATOM 1080 CB ASN A 71 -2.149 3.087 9.863 1.00 72.33 C ATOM 1081 CG ASN A 71 -2.496 1.681 9.411 1.00 15.24 C ATOM 1082 OD1 ASN A 71 -1.836 1.116 8.540 1.00 44.12 O ATOM 1083 ND2 ASN A 71 -3.538 1.110 10.004 1.00 14.02 N ATOM 0 H ASN A 71 0.660 4.206 10.500 1.00 35.02 H new ATOM 0 HA ASN A 71 -0.197 2.780 9.016 1.00 53.34 H new ATOM 0 HB2 ASN A 71 -2.023 3.097 10.946 1.00 72.33 H new ATOM 0 HB3 ASN A 71 -2.979 3.755 9.632 1.00 72.33 H new ATOM 0 HD21 ASN A 71 -3.820 0.165 9.742 1.00 14.02 H new ATOM 0 HD22 ASN A 71 -4.057 1.616 10.722 1.00 14.02 H new ATOM 1090 N ASN A 72 -0.207 4.836 7.214 1.00 62.35 N ATOM 1091 CA ASN A 72 -0.400 5.492 5.926 1.00 43.24 C ATOM 1092 C ASN A 72 -1.420 6.621 6.038 1.00 61.03 C ATOM 1093 O ASN A 72 -2.202 6.857 5.118 1.00 72.23 O ATOM 1094 CB ASN A 72 -0.858 4.478 4.876 1.00 32.41 C ATOM 1095 CG ASN A 72 0.200 3.433 4.581 1.00 23.50 C ATOM 1096 OD1 ASN A 72 1.265 3.420 5.198 1.00 4.23 O ATOM 1097 ND2 ASN A 72 -0.089 2.549 3.633 1.00 41.02 N ATOM 0 H ASN A 72 0.753 4.858 7.559 1.00 62.35 H new ATOM 0 HA ASN A 72 0.555 5.918 5.617 1.00 43.24 H new ATOM 0 HB2 ASN A 72 -1.765 3.984 5.223 1.00 32.41 H new ATOM 0 HB3 ASN A 72 -1.113 5.003 3.955 1.00 32.41 H new ATOM 0 HD21 ASN A 72 0.584 1.822 3.391 1.00 41.02 H new ATOM 0 HD22 ASN A 72 -0.984 2.597 3.147 1.00 41.02 H new ATOM 1104 N GLU A 73 -1.404 7.315 7.171 1.00 12.24 N ATOM 1105 CA GLU A 73 -2.328 8.419 7.403 1.00 13.02 C ATOM 1106 C GLU A 73 -1.599 9.627 7.984 1.00 25.34 C ATOM 1107 O GLU A 73 -1.355 9.698 9.189 1.00 43.30 O ATOM 1108 CB GLU A 73 -3.450 7.984 8.348 1.00 14.13 C ATOM 1109 CG GLU A 73 -4.788 8.640 8.048 1.00 63.44 C ATOM 1110 CD GLU A 73 -5.924 7.638 7.968 1.00 45.10 C ATOM 1111 OE1 GLU A 73 -5.843 6.716 7.129 1.00 0.22 O ATOM 1112 OE2 GLU A 73 -6.892 7.776 8.743 1.00 14.14 O ATOM 0 H GLU A 73 -0.762 7.133 7.942 1.00 12.24 H new ATOM 0 HA GLU A 73 -2.760 8.704 6.444 1.00 13.02 H new ATOM 0 HB2 GLU A 73 -3.564 6.902 8.289 1.00 14.13 H new ATOM 0 HB3 GLU A 73 -3.162 8.218 9.373 1.00 14.13 H new ATOM 0 HG2 GLU A 73 -5.010 9.374 8.822 1.00 63.44 H new ATOM 0 HG3 GLU A 73 -4.719 9.182 7.105 1.00 63.44 H new ATOM 1119 N VAL A 74 -1.252 10.574 7.119 1.00 43.02 N ATOM 1120 CA VAL A 74 -0.550 11.779 7.545 1.00 53.22 C ATOM 1121 C VAL A 74 -1.512 12.953 7.688 1.00 52.34 C ATOM 1122 O VAL A 74 -2.361 13.184 6.826 1.00 34.10 O ATOM 1123 CB VAL A 74 0.564 12.160 6.552 1.00 0.52 C ATOM 1124 CG1 VAL A 74 1.703 12.866 7.273 1.00 54.33 C ATOM 1125 CG2 VAL A 74 1.069 10.927 5.820 1.00 63.25 C ATOM 0 H VAL A 74 -1.446 10.530 6.118 1.00 43.02 H new ATOM 0 HA VAL A 74 -0.103 11.559 8.514 1.00 53.22 H new ATOM 0 HB VAL A 74 0.150 12.848 5.815 1.00 0.52 H new ATOM 0 HG11 VAL A 74 2.481 13.128 6.556 1.00 54.33 H new ATOM 0 HG12 VAL A 74 1.327 13.772 7.747 1.00 54.33 H new ATOM 0 HG13 VAL A 74 2.118 12.204 8.033 1.00 54.33 H new ATOM 0 HG21 VAL A 74 1.856 11.215 5.122 1.00 63.25 H new ATOM 0 HG22 VAL A 74 1.467 10.213 6.541 1.00 63.25 H new ATOM 0 HG23 VAL A 74 0.247 10.468 5.271 1.00 63.25 H new ATOM 1135 N THR A 75 -1.374 13.695 8.782 1.00 4.13 N ATOM 1136 CA THR A 75 -2.230 14.846 9.039 1.00 33.33 C ATOM 1137 C THR A 75 -1.404 16.106 9.269 1.00 30.12 C ATOM 1138 O THR A 75 -0.816 16.288 10.336 1.00 63.54 O ATOM 1139 CB THR A 75 -3.136 14.609 10.262 1.00 15.43 C ATOM 1140 OG1 THR A 75 -3.620 13.262 10.261 1.00 60.44 O ATOM 1141 CG2 THR A 75 -4.312 15.575 10.260 1.00 42.24 C ATOM 0 H THR A 75 -0.677 13.519 9.505 1.00 4.13 H new ATOM 0 HA THR A 75 -2.853 14.981 8.155 1.00 33.33 H new ATOM 0 HB THR A 75 -2.545 14.781 11.162 1.00 15.43 H new ATOM 0 HG1 THR A 75 -4.194 13.120 11.043 1.00 60.44 H new ATOM 0 HG21 THR A 75 -4.938 15.388 11.133 1.00 42.24 H new ATOM 0 HG22 THR A 75 -3.941 16.600 10.291 1.00 42.24 H new ATOM 0 HG23 THR A 75 -4.901 15.430 9.354 1.00 42.24 H new ATOM 1149 N ILE A 76 -1.365 16.974 8.264 1.00 65.53 N ATOM 1150 CA ILE A 76 -0.611 18.218 8.358 1.00 33.11 C ATOM 1151 C ILE A 76 -1.532 19.397 8.654 1.00 72.21 C ATOM 1152 O ILE A 76 -2.114 19.988 7.743 1.00 4.43 O ATOM 1153 CB ILE A 76 0.169 18.503 7.062 1.00 42.35 C ATOM 1154 CG1 ILE A 76 0.979 17.273 6.646 1.00 14.03 C ATOM 1155 CG2 ILE A 76 1.082 19.707 7.247 1.00 74.45 C ATOM 1156 CD1 ILE A 76 1.688 17.436 5.320 1.00 21.23 C ATOM 0 H ILE A 76 -1.847 16.839 7.375 1.00 65.53 H new ATOM 0 HA ILE A 76 0.097 18.097 9.178 1.00 33.11 H new ATOM 0 HB ILE A 76 -0.544 18.730 6.269 1.00 42.35 H new ATOM 0 HG12 ILE A 76 1.716 17.055 7.419 1.00 14.03 H new ATOM 0 HG13 ILE A 76 0.313 16.412 6.589 1.00 14.03 H new ATOM 0 HG21 ILE A 76 1.627 19.896 6.322 1.00 74.45 H new ATOM 0 HG22 ILE A 76 0.483 20.582 7.501 1.00 74.45 H new ATOM 0 HG23 ILE A 76 1.790 19.506 8.051 1.00 74.45 H new ATOM 0 HD11 ILE A 76 2.242 16.526 5.089 1.00 21.23 H new ATOM 0 HD12 ILE A 76 0.954 17.623 4.536 1.00 21.23 H new ATOM 0 HD13 ILE A 76 2.379 18.277 5.378 1.00 21.23 H new ATOM 1168 N LEU A 77 -1.659 19.735 9.932 1.00 34.33 N ATOM 1169 CA LEU A 77 -2.508 20.845 10.349 1.00 14.33 C ATOM 1170 C LEU A 77 -1.740 22.163 10.310 1.00 74.43 C ATOM 1171 O LEU A 77 -1.177 22.595 11.315 1.00 43.20 O ATOM 1172 CB LEU A 77 -3.048 20.599 11.759 1.00 34.21 C ATOM 1173 CG LEU A 77 -4.205 21.496 12.201 1.00 33.41 C ATOM 1174 CD1 LEU A 77 -5.535 20.782 12.014 1.00 12.13 C ATOM 1175 CD2 LEU A 77 -4.026 21.922 13.651 1.00 42.23 C ATOM 0 H LEU A 77 -1.185 19.256 10.698 1.00 34.33 H new ATOM 0 HA LEU A 77 -3.344 20.911 9.653 1.00 14.33 H new ATOM 0 HB2 LEU A 77 -3.374 19.561 11.826 1.00 34.21 H new ATOM 0 HB3 LEU A 77 -2.228 20.722 12.467 1.00 34.21 H new ATOM 0 HG LEU A 77 -4.205 22.390 11.578 1.00 33.41 H new ATOM 0 HD11 LEU A 77 -6.347 21.435 12.334 1.00 12.13 H new ATOM 0 HD12 LEU A 77 -5.667 20.528 10.962 1.00 12.13 H new ATOM 0 HD13 LEU A 77 -5.546 19.871 12.612 1.00 12.13 H new ATOM 0 HD21 LEU A 77 -4.858 22.560 13.948 1.00 42.23 H new ATOM 0 HD22 LEU A 77 -4.000 21.039 14.289 1.00 42.23 H new ATOM 0 HD23 LEU A 77 -3.091 22.473 13.756 1.00 42.23 H new ATOM 1187 N VAL A 78 -1.724 22.797 9.142 1.00 51.32 N ATOM 1188 CA VAL A 78 -1.028 24.067 8.972 1.00 54.34 C ATOM 1189 C VAL A 78 -1.985 25.244 9.133 1.00 63.42 C ATOM 1190 O VAL A 78 -3.157 25.157 8.771 1.00 52.54 O ATOM 1191 CB VAL A 78 -0.351 24.156 7.591 1.00 74.30 C ATOM 1192 CG1 VAL A 78 -1.384 24.038 6.481 1.00 75.41 C ATOM 1193 CG2 VAL A 78 0.433 25.453 7.465 1.00 50.02 C ATOM 0 H VAL A 78 -2.185 22.452 8.300 1.00 51.32 H new ATOM 0 HA VAL A 78 -0.263 24.115 9.747 1.00 54.34 H new ATOM 0 HB VAL A 78 0.348 23.325 7.494 1.00 74.30 H new ATOM 0 HG11 VAL A 78 -0.887 24.103 5.513 1.00 75.41 H new ATOM 0 HG12 VAL A 78 -1.897 23.080 6.562 1.00 75.41 H new ATOM 0 HG13 VAL A 78 -2.109 24.847 6.572 1.00 75.41 H new ATOM 0 HG21 VAL A 78 0.905 25.499 6.483 1.00 50.02 H new ATOM 0 HG22 VAL A 78 -0.243 26.300 7.583 1.00 50.02 H new ATOM 0 HG23 VAL A 78 1.200 25.491 8.238 1.00 50.02 H new ATOM 1203 N ASN A 79 -1.475 26.343 9.679 1.00 41.03 N ATOM 1204 CA ASN A 79 -2.284 27.538 9.888 1.00 11.22 C ATOM 1205 C ASN A 79 -2.168 28.489 8.700 1.00 33.44 C ATOM 1206 O ASN A 79 -2.037 29.700 8.872 1.00 71.25 O ATOM 1207 CB ASN A 79 -1.854 28.252 11.171 1.00 4.30 C ATOM 1208 CG ASN A 79 -1.619 27.289 12.318 1.00 33.24 C ATOM 1209 OD1 ASN A 79 -2.178 26.192 12.347 1.00 54.41 O ATOM 1210 ND2 ASN A 79 -0.789 27.695 13.272 1.00 52.21 N ATOM 0 H ASN A 79 -0.506 26.431 9.985 1.00 41.03 H new ATOM 0 HA ASN A 79 -3.325 27.229 9.983 1.00 11.22 H new ATOM 0 HB2 ASN A 79 -0.941 28.816 10.981 1.00 4.30 H new ATOM 0 HB3 ASN A 79 -2.620 28.973 11.457 1.00 4.30 H new ATOM 0 HD21 ASN A 79 -0.593 27.090 14.069 1.00 52.21 H new ATOM 0 HD22 ASN A 79 -0.348 28.612 13.208 1.00 52.21 H new ATOM 1217 N GLY A 80 -2.218 27.930 7.495 1.00 74.31 N ATOM 1218 CA GLY A 80 -2.118 28.741 6.296 1.00 13.51 C ATOM 1219 C GLY A 80 -1.174 28.147 5.271 1.00 64.04 C ATOM 1220 O GLY A 80 -0.002 27.908 5.561 1.00 20.23 O ATOM 0 H GLY A 80 -2.326 26.930 7.328 1.00 74.31 H new ATOM 0 HA2 GLY A 80 -3.108 28.852 5.853 1.00 13.51 H new ATOM 0 HA3 GLY A 80 -1.775 29.740 6.565 1.00 13.51 H new ATOM 1224 N ALA A 81 -1.684 27.906 4.067 1.00 11.44 N ATOM 1225 CA ALA A 81 -0.878 27.336 2.995 1.00 4.44 C ATOM 1226 C ALA A 81 -1.337 27.845 1.633 1.00 5.31 C ATOM 1227 O ALA A 81 -2.346 28.542 1.529 1.00 65.21 O ATOM 1228 CB ALA A 81 -0.937 25.817 3.041 1.00 74.32 C ATOM 0 H ALA A 81 -2.652 28.097 3.810 1.00 11.44 H new ATOM 0 HA ALA A 81 0.155 27.653 3.142 1.00 4.44 H new ATOM 0 HB1 ALA A 81 -0.330 25.405 2.235 1.00 74.32 H new ATOM 0 HB2 ALA A 81 -0.553 25.467 3.999 1.00 74.32 H new ATOM 0 HB3 ALA A 81 -1.970 25.489 2.922 1.00 74.32 H new ATOM 1234 N GLU A 82 -0.588 27.493 0.592 1.00 14.11 N ATOM 1235 CA GLU A 82 -0.919 27.917 -0.763 1.00 72.45 C ATOM 1236 C GLU A 82 -0.288 26.984 -1.794 1.00 15.22 C ATOM 1237 O GLU A 82 0.901 26.676 -1.721 1.00 61.52 O ATOM 1238 CB GLU A 82 -0.447 29.352 -1.002 1.00 54.44 C ATOM 1239 CG GLU A 82 -1.165 30.046 -2.148 1.00 40.11 C ATOM 1240 CD GLU A 82 -2.575 30.468 -1.783 1.00 41.41 C ATOM 1241 OE1 GLU A 82 -3.475 29.603 -1.793 1.00 12.25 O ATOM 1242 OE2 GLU A 82 -2.777 31.665 -1.488 1.00 34.14 O ATOM 0 H GLU A 82 0.250 26.916 0.661 1.00 14.11 H new ATOM 0 HA GLU A 82 -2.002 27.875 -0.875 1.00 72.45 H new ATOM 0 HB2 GLU A 82 -0.593 29.930 -0.090 1.00 54.44 H new ATOM 0 HB3 GLU A 82 0.624 29.344 -1.207 1.00 54.44 H new ATOM 0 HG2 GLU A 82 -0.594 30.924 -2.451 1.00 40.11 H new ATOM 0 HG3 GLU A 82 -1.201 29.377 -3.008 1.00 40.11 H new ATOM 1249 N ARG A 83 -1.095 26.539 -2.752 1.00 23.00 N ATOM 1250 CA ARG A 83 -0.617 25.641 -3.796 1.00 61.41 C ATOM 1251 C ARG A 83 -0.176 26.425 -5.029 1.00 13.15 C ATOM 1252 O ARG A 83 -0.892 27.304 -5.506 1.00 53.03 O ATOM 1253 CB ARG A 83 -1.710 24.641 -4.178 1.00 54.45 C ATOM 1254 CG ARG A 83 -1.471 23.241 -3.639 1.00 34.24 C ATOM 1255 CD ARG A 83 -1.437 22.211 -4.757 1.00 44.11 C ATOM 1256 NE ARG A 83 -2.743 21.596 -4.976 1.00 11.22 N ATOM 1257 CZ ARG A 83 -3.033 20.842 -6.030 1.00 71.10 C ATOM 1258 NH1 ARG A 83 -2.114 20.610 -6.957 1.00 4.33 N ATOM 1259 NH2 ARG A 83 -4.245 20.317 -6.159 1.00 30.04 N ATOM 0 H ARG A 83 -2.082 26.786 -2.826 1.00 23.00 H new ATOM 0 HA ARG A 83 0.243 25.097 -3.406 1.00 61.41 H new ATOM 0 HB2 ARG A 83 -2.669 25.005 -3.808 1.00 54.45 H new ATOM 0 HB3 ARG A 83 -1.785 24.595 -5.264 1.00 54.45 H new ATOM 0 HG2 ARG A 83 -0.529 23.217 -3.092 1.00 34.24 H new ATOM 0 HG3 ARG A 83 -2.258 22.984 -2.930 1.00 34.24 H new ATOM 0 HD2 ARG A 83 -1.102 22.687 -5.678 1.00 44.11 H new ATOM 0 HD3 ARG A 83 -0.708 21.437 -4.515 1.00 44.11 H new ATOM 0 HE ARG A 83 -3.473 21.754 -4.281 1.00 11.22 H new ATOM 0 HH11 ARG A 83 -1.181 21.011 -6.862 1.00 4.33 H new ATOM 0 HH12 ARG A 83 -2.340 20.030 -7.765 1.00 4.33 H new ATOM 0 HH21 ARG A 83 -4.955 20.492 -5.448 1.00 30.04 H new ATOM 0 HH22 ARG A 83 -4.466 19.738 -6.969 1.00 30.04 H new ATOM 1273 N GLY A 84 1.008 26.101 -5.538 1.00 62.31 N ATOM 1274 CA GLY A 84 1.524 26.784 -6.710 1.00 3.55 C ATOM 1275 C GLY A 84 0.608 26.651 -7.910 1.00 32.15 C ATOM 1276 O GLY A 84 0.691 27.437 -8.853 1.00 41.03 O ATOM 0 H GLY A 84 1.620 25.378 -5.160 1.00 62.31 H new ATOM 0 HA2 GLY A 84 1.664 27.840 -6.479 1.00 3.55 H new ATOM 0 HA3 GLY A 84 2.505 26.380 -6.959 1.00 3.55 H new ATOM 1280 N ASP A 85 -0.268 25.652 -7.875 1.00 3.41 N ATOM 1281 CA ASP A 85 -1.203 25.418 -8.968 1.00 75.25 C ATOM 1282 C ASP A 85 -2.455 26.275 -8.806 1.00 30.31 C ATOM 1283 O ASP A 85 -3.127 26.604 -9.784 1.00 33.30 O ATOM 1284 CB ASP A 85 -1.588 23.939 -9.031 1.00 24.42 C ATOM 1285 CG ASP A 85 -2.135 23.539 -10.387 1.00 13.41 C ATOM 1286 OD1 ASP A 85 -2.291 24.429 -11.250 1.00 2.02 O ATOM 1287 OD2 ASP A 85 -2.408 22.337 -10.586 1.00 4.22 O ATOM 0 H ASP A 85 -0.349 24.992 -7.102 1.00 3.41 H new ATOM 0 HA ASP A 85 -0.711 25.698 -9.899 1.00 75.25 H new ATOM 0 HB2 ASP A 85 -0.714 23.329 -8.801 1.00 24.42 H new ATOM 0 HB3 ASP A 85 -2.334 23.728 -8.265 1.00 24.42 H new ATOM 1292 N THR A 86 -2.764 26.633 -7.563 1.00 63.14 N ATOM 1293 CA THR A 86 -3.935 27.449 -7.272 1.00 53.30 C ATOM 1294 C THR A 86 -3.566 28.925 -7.171 1.00 70.13 C ATOM 1295 O THR A 86 -4.183 29.678 -6.418 1.00 3.54 O ATOM 1296 CB THR A 86 -4.614 27.011 -5.960 1.00 65.24 C ATOM 1297 OG1 THR A 86 -3.645 26.938 -4.908 1.00 43.15 O ATOM 1298 CG2 THR A 86 -5.291 25.659 -6.127 1.00 50.11 C ATOM 0 H THR A 86 -2.219 26.370 -6.742 1.00 63.14 H new ATOM 0 HA THR A 86 -4.632 27.307 -8.098 1.00 53.30 H new ATOM 0 HB THR A 86 -5.373 27.751 -5.704 1.00 65.24 H new ATOM 0 HG1 THR A 86 -2.775 27.239 -5.243 1.00 43.15 H new ATOM 0 HG21 THR A 86 -5.763 25.370 -5.188 1.00 50.11 H new ATOM 0 HG22 THR A 86 -6.048 25.725 -6.909 1.00 50.11 H new ATOM 0 HG23 THR A 86 -4.548 24.912 -6.404 1.00 50.11 H new ATOM 1306 N ILE A 87 -2.558 29.331 -7.935 1.00 44.02 N ATOM 1307 CA ILE A 87 -2.108 30.718 -7.932 1.00 72.45 C ATOM 1308 C ILE A 87 -2.810 31.525 -9.019 1.00 13.22 C ATOM 1309 O ILE A 87 -2.906 31.090 -10.167 1.00 5.05 O ATOM 1310 CB ILE A 87 -0.585 30.816 -8.139 1.00 11.22 C ATOM 1311 CG1 ILE A 87 -0.199 30.272 -9.516 1.00 3.13 C ATOM 1312 CG2 ILE A 87 0.148 30.061 -7.040 1.00 41.31 C ATOM 1313 CD1 ILE A 87 -0.008 31.350 -10.560 1.00 10.15 C ATOM 0 H ILE A 87 -2.037 28.720 -8.564 1.00 44.02 H new ATOM 0 HA ILE A 87 -2.361 31.130 -6.955 1.00 72.45 H new ATOM 0 HB ILE A 87 -0.293 31.865 -8.089 1.00 11.22 H new ATOM 0 HG12 ILE A 87 0.723 29.698 -9.425 1.00 3.13 H new ATOM 0 HG13 ILE A 87 -0.972 29.582 -9.855 1.00 3.13 H new ATOM 0 HG21 ILE A 87 1.223 30.139 -7.200 1.00 41.31 H new ATOM 0 HG22 ILE A 87 -0.107 30.490 -6.071 1.00 41.31 H new ATOM 0 HG23 ILE A 87 -0.146 29.012 -7.061 1.00 41.31 H new ATOM 0 HD11 ILE A 87 0.264 30.892 -11.511 1.00 10.15 H new ATOM 0 HD12 ILE A 87 -0.936 31.909 -10.679 1.00 10.15 H new ATOM 0 HD13 ILE A 87 0.786 32.027 -10.243 1.00 10.15 H new ATOM 1325 N ASP A 88 -3.299 32.704 -8.649 1.00 61.13 N ATOM 1326 CA ASP A 88 -3.990 33.575 -9.593 1.00 32.12 C ATOM 1327 C ASP A 88 -3.416 34.987 -9.550 1.00 2.54 C ATOM 1328 O ASP A 88 -2.758 35.387 -8.589 1.00 14.55 O ATOM 1329 CB ASP A 88 -5.488 33.610 -9.284 1.00 42.32 C ATOM 1330 CG ASP A 88 -6.279 32.643 -10.143 1.00 1.21 C ATOM 1331 OD1 ASP A 88 -5.717 31.597 -10.529 1.00 33.14 O ATOM 1332 OD2 ASP A 88 -7.459 32.933 -10.430 1.00 54.20 O ATOM 0 H ASP A 88 -3.230 33.078 -7.703 1.00 61.13 H new ATOM 0 HA ASP A 88 -3.843 33.173 -10.595 1.00 32.12 H new ATOM 0 HB2 ASP A 88 -5.645 33.369 -8.233 1.00 42.32 H new ATOM 0 HB3 ASP A 88 -5.865 34.621 -9.439 1.00 42.32 H new ATOM 1337 N PRO A 89 -3.668 35.762 -10.615 1.00 64.14 N ATOM 1338 CA PRO A 89 -3.184 37.142 -10.723 1.00 71.43 C ATOM 1339 C PRO A 89 -3.890 38.081 -9.751 1.00 63.12 C ATOM 1340 O PRO A 89 -3.414 39.184 -9.485 1.00 50.35 O ATOM 1341 CB PRO A 89 -3.515 37.521 -12.169 1.00 2.21 C ATOM 1342 CG PRO A 89 -4.657 36.640 -12.540 1.00 14.30 C ATOM 1343 CD PRO A 89 -4.444 35.351 -11.797 1.00 34.42 C ATOM 0 HA PRO A 89 -2.125 37.224 -10.478 1.00 71.43 H new ATOM 0 HB2 PRO A 89 -3.785 38.574 -12.250 1.00 2.21 H new ATOM 0 HB3 PRO A 89 -2.661 37.359 -12.826 1.00 2.21 H new ATOM 0 HG2 PRO A 89 -5.608 37.097 -12.265 1.00 14.30 H new ATOM 0 HG3 PRO A 89 -4.685 36.470 -13.616 1.00 14.30 H new ATOM 0 HD2 PRO A 89 -5.390 34.889 -11.516 1.00 34.42 H new ATOM 0 HD3 PRO A 89 -3.901 34.624 -12.401 1.00 34.42 H new ATOM 1351 N GLN A 90 -5.025 37.635 -9.224 1.00 14.31 N ATOM 1352 CA GLN A 90 -5.796 38.438 -8.281 1.00 61.41 C ATOM 1353 C GLN A 90 -5.124 38.464 -6.912 1.00 45.25 C ATOM 1354 O GLN A 90 -5.252 39.435 -6.167 1.00 23.30 O ATOM 1355 CB GLN A 90 -7.218 37.888 -8.154 1.00 25.55 C ATOM 1356 CG GLN A 90 -8.297 38.926 -8.411 1.00 51.20 C ATOM 1357 CD GLN A 90 -9.436 38.388 -9.255 1.00 65.20 C ATOM 1358 OE1 GLN A 90 -10.315 37.684 -8.756 1.00 44.44 O ATOM 1359 NE2 GLN A 90 -9.426 38.716 -10.542 1.00 2.34 N ATOM 0 H GLN A 90 -5.431 36.723 -9.433 1.00 14.31 H new ATOM 0 HA GLN A 90 -5.841 39.458 -8.663 1.00 61.41 H new ATOM 0 HB2 GLN A 90 -7.344 37.064 -8.856 1.00 25.55 H new ATOM 0 HB3 GLN A 90 -7.352 37.477 -7.153 1.00 25.55 H new ATOM 0 HG2 GLN A 90 -8.691 39.278 -7.458 1.00 51.20 H new ATOM 0 HG3 GLN A 90 -7.855 39.788 -8.911 1.00 51.20 H new ATOM 0 HE21 GLN A 90 -8.678 39.302 -10.913 1.00 2.34 H new ATOM 0 HE22 GLN A 90 -10.166 38.382 -11.159 1.00 2.34 H new ATOM 1368 N GLU A 91 -4.407 37.392 -6.589 1.00 74.23 N ATOM 1369 CA GLU A 91 -3.716 37.293 -5.309 1.00 52.02 C ATOM 1370 C GLU A 91 -2.805 38.497 -5.089 1.00 25.22 C ATOM 1371 O GLU A 91 -2.782 39.081 -4.006 1.00 45.31 O ATOM 1372 CB GLU A 91 -2.898 36.001 -5.244 1.00 54.43 C ATOM 1373 CG GLU A 91 -2.621 35.527 -3.828 1.00 10.13 C ATOM 1374 CD GLU A 91 -3.355 34.245 -3.488 1.00 35.25 C ATOM 1375 OE1 GLU A 91 -2.987 33.186 -4.037 1.00 22.33 O ATOM 1376 OE2 GLU A 91 -4.299 34.301 -2.671 1.00 52.14 O ATOM 0 H GLU A 91 -4.290 36.581 -7.196 1.00 74.23 H new ATOM 0 HA GLU A 91 -4.467 37.278 -4.519 1.00 52.02 H new ATOM 0 HB2 GLU A 91 -3.430 35.217 -5.783 1.00 54.43 H new ATOM 0 HB3 GLU A 91 -1.950 36.155 -5.759 1.00 54.43 H new ATOM 0 HG2 GLU A 91 -1.549 35.371 -3.704 1.00 10.13 H new ATOM 0 HG3 GLU A 91 -2.913 36.306 -3.124 1.00 10.13 H new ATOM 1383 N ALA A 92 -2.054 38.861 -6.124 1.00 34.33 N ATOM 1384 CA ALA A 92 -1.142 39.995 -6.045 1.00 31.24 C ATOM 1385 C ALA A 92 -1.874 41.258 -5.604 1.00 42.34 C ATOM 1386 O ALA A 92 -1.372 42.020 -4.778 1.00 75.00 O ATOM 1387 CB ALA A 92 -0.460 40.218 -7.386 1.00 61.01 C ATOM 0 H ALA A 92 -2.060 38.387 -7.027 1.00 34.33 H new ATOM 0 HA ALA A 92 -0.382 39.768 -5.297 1.00 31.24 H new ATOM 0 HB1 ALA A 92 0.218 41.068 -7.312 1.00 61.01 H new ATOM 0 HB2 ALA A 92 0.104 39.326 -7.660 1.00 61.01 H new ATOM 0 HB3 ALA A 92 -1.213 40.420 -8.148 1.00 61.01 H new ATOM 1393 N GLN A 93 -3.061 41.474 -6.162 1.00 63.04 N ATOM 1394 CA GLN A 93 -3.860 42.647 -5.827 1.00 61.45 C ATOM 1395 C GLN A 93 -4.421 42.537 -4.414 1.00 14.13 C ATOM 1396 O GLN A 93 -4.537 43.535 -3.703 1.00 45.22 O ATOM 1397 CB GLN A 93 -5.002 42.815 -6.831 1.00 11.01 C ATOM 1398 CG GLN A 93 -4.658 43.728 -7.996 1.00 53.44 C ATOM 1399 CD GLN A 93 -5.888 44.220 -8.735 1.00 5.43 C ATOM 1400 OE1 GLN A 93 -6.866 43.489 -8.892 1.00 3.12 O ATOM 1401 NE2 GLN A 93 -5.844 45.466 -9.193 1.00 13.13 N ATOM 0 H GLN A 93 -3.490 40.853 -6.848 1.00 63.04 H new ATOM 0 HA GLN A 93 -3.213 43.523 -5.874 1.00 61.45 H new ATOM 0 HB2 GLN A 93 -5.281 41.835 -7.218 1.00 11.01 H new ATOM 0 HB3 GLN A 93 -5.874 43.214 -6.313 1.00 11.01 H new ATOM 0 HG2 GLN A 93 -4.094 44.584 -7.627 1.00 53.44 H new ATOM 0 HG3 GLN A 93 -4.010 43.195 -8.692 1.00 53.44 H new ATOM 0 HE21 GLN A 93 -5.012 46.037 -9.040 1.00 13.13 H new ATOM 0 HE22 GLN A 93 -6.642 45.852 -9.698 1.00 13.13 H new ATOM 1410 N GLN A 94 -4.769 41.318 -4.013 1.00 52.42 N ATOM 1411 CA GLN A 94 -5.320 41.080 -2.684 1.00 63.33 C ATOM 1412 C GLN A 94 -4.274 41.345 -1.606 1.00 70.42 C ATOM 1413 O GLN A 94 -4.531 42.063 -0.640 1.00 3.53 O ATOM 1414 CB GLN A 94 -5.832 39.643 -2.572 1.00 74.21 C ATOM 1415 CG GLN A 94 -7.308 39.495 -2.908 1.00 3.33 C ATOM 1416 CD GLN A 94 -7.638 38.142 -3.505 1.00 22.42 C ATOM 1417 OE1 GLN A 94 -7.133 37.112 -3.055 1.00 52.24 O ATOM 1418 NE2 GLN A 94 -8.490 38.135 -4.524 1.00 5.54 N ATOM 0 H GLN A 94 -4.679 40.481 -4.589 1.00 52.42 H new ATOM 0 HA GLN A 94 -6.152 41.768 -2.534 1.00 63.33 H new ATOM 0 HB2 GLN A 94 -5.251 39.006 -3.238 1.00 74.21 H new ATOM 0 HB3 GLN A 94 -5.661 39.283 -1.557 1.00 74.21 H new ATOM 0 HG2 GLN A 94 -7.899 39.643 -2.004 1.00 3.33 H new ATOM 0 HG3 GLN A 94 -7.597 40.278 -3.609 1.00 3.33 H new ATOM 0 HE21 GLN A 94 -8.885 39.012 -4.865 1.00 5.54 H new ATOM 0 HE22 GLN A 94 -8.750 37.253 -4.966 1.00 5.54 H new ATOM 1427 N THR A 95 -3.093 40.759 -1.778 1.00 21.15 N ATOM 1428 CA THR A 95 -2.009 40.930 -0.819 1.00 4.21 C ATOM 1429 C THR A 95 -1.638 42.401 -0.665 1.00 63.22 C ATOM 1430 O THR A 95 -1.373 42.873 0.441 1.00 32.44 O ATOM 1431 CB THR A 95 -0.756 40.138 -1.240 1.00 34.15 C ATOM 1432 OG1 THR A 95 -1.133 38.838 -1.706 1.00 72.33 O ATOM 1433 CG2 THR A 95 0.215 40.003 -0.076 1.00 74.13 C ATOM 0 H THR A 95 -2.863 40.162 -2.572 1.00 21.15 H new ATOM 0 HA THR A 95 -2.369 40.547 0.136 1.00 4.21 H new ATOM 0 HB THR A 95 -0.261 40.683 -2.044 1.00 34.15 H new ATOM 0 HG1 THR A 95 -1.566 38.917 -2.582 1.00 72.33 H new ATOM 0 HG21 THR A 95 1.092 39.440 -0.397 1.00 74.13 H new ATOM 0 HG22 THR A 95 0.522 40.994 0.258 1.00 74.13 H new ATOM 0 HG23 THR A 95 -0.272 39.478 0.745 1.00 74.13 H new ATOM 1441 N LEU A 96 -1.621 43.121 -1.781 1.00 45.31 N ATOM 1442 CA LEU A 96 -1.283 44.540 -1.770 1.00 45.43 C ATOM 1443 C LEU A 96 -2.391 45.359 -1.117 1.00 54.45 C ATOM 1444 O LEU A 96 -2.127 46.364 -0.457 1.00 72.44 O ATOM 1445 CB LEU A 96 -1.038 45.037 -3.196 1.00 41.42 C ATOM 1446 CG LEU A 96 -0.355 46.399 -3.324 1.00 41.44 C ATOM 1447 CD1 LEU A 96 1.108 46.303 -2.922 1.00 25.33 C ATOM 1448 CD2 LEU A 96 -0.485 46.930 -4.745 1.00 32.13 C ATOM 0 H LEU A 96 -1.837 42.746 -2.705 1.00 45.31 H new ATOM 0 HA LEU A 96 -0.371 44.666 -1.186 1.00 45.43 H new ATOM 0 HB2 LEU A 96 -0.430 44.298 -3.718 1.00 41.42 H new ATOM 0 HB3 LEU A 96 -1.997 45.084 -3.713 1.00 41.42 H new ATOM 0 HG LEU A 96 -0.851 47.097 -2.649 1.00 41.44 H new ATOM 0 HD11 LEU A 96 1.577 47.282 -3.020 1.00 25.33 H new ATOM 0 HD12 LEU A 96 1.180 45.968 -1.887 1.00 25.33 H new ATOM 0 HD13 LEU A 96 1.617 45.590 -3.570 1.00 25.33 H new ATOM 0 HD21 LEU A 96 0.007 47.900 -4.817 1.00 32.13 H new ATOM 0 HD22 LEU A 96 -0.015 46.232 -5.438 1.00 32.13 H new ATOM 0 HD23 LEU A 96 -1.540 47.038 -4.998 1.00 32.13 H new ATOM 1460 N GLU A 97 -3.633 44.921 -1.305 1.00 45.53 N ATOM 1461 CA GLU A 97 -4.781 45.614 -0.733 1.00 10.01 C ATOM 1462 C GLU A 97 -4.679 45.671 0.789 1.00 40.34 C ATOM 1463 O GLU A 97 -4.874 46.725 1.395 1.00 43.32 O ATOM 1464 CB GLU A 97 -6.081 44.918 -1.142 1.00 65.50 C ATOM 1465 CG GLU A 97 -7.198 45.880 -1.509 1.00 24.02 C ATOM 1466 CD GLU A 97 -8.128 46.164 -0.346 1.00 34.20 C ATOM 1467 OE1 GLU A 97 -8.419 45.226 0.425 1.00 23.41 O ATOM 1468 OE2 GLU A 97 -8.566 47.325 -0.207 1.00 54.23 O ATOM 0 H GLU A 97 -3.869 44.091 -1.848 1.00 45.53 H new ATOM 0 HA GLU A 97 -4.786 46.634 -1.118 1.00 10.01 H new ATOM 0 HB2 GLU A 97 -5.882 44.265 -1.992 1.00 65.50 H new ATOM 0 HB3 GLU A 97 -6.416 44.282 -0.323 1.00 65.50 H new ATOM 0 HG2 GLU A 97 -6.765 46.817 -1.860 1.00 24.02 H new ATOM 0 HG3 GLU A 97 -7.773 45.464 -2.336 1.00 24.02 H new ATOM 1475 N ILE A 98 -4.373 44.531 1.398 1.00 12.14 N ATOM 1476 CA ILE A 98 -4.245 44.451 2.848 1.00 1.42 C ATOM 1477 C ILE A 98 -3.076 45.296 3.344 1.00 52.31 C ATOM 1478 O ILE A 98 -3.203 46.038 4.317 1.00 4.44 O ATOM 1479 CB ILE A 98 -4.048 42.998 3.317 1.00 62.43 C ATOM 1480 CG1 ILE A 98 -5.222 42.128 2.861 1.00 3.32 C ATOM 1481 CG2 ILE A 98 -3.898 42.944 4.830 1.00 51.42 C ATOM 1482 CD1 ILE A 98 -4.983 40.646 3.046 1.00 52.05 C ATOM 0 H ILE A 98 -4.209 43.650 0.910 1.00 12.14 H new ATOM 0 HA ILE A 98 -5.174 44.837 3.268 1.00 1.42 H new ATOM 0 HB ILE A 98 -3.135 42.608 2.868 1.00 62.43 H new ATOM 0 HG12 ILE A 98 -6.114 42.416 3.417 1.00 3.32 H new ATOM 0 HG13 ILE A 98 -5.424 42.327 1.808 1.00 3.32 H new ATOM 0 HG21 ILE A 98 -3.760 41.910 5.145 1.00 51.42 H new ATOM 0 HG22 ILE A 98 -3.032 43.534 5.131 1.00 51.42 H new ATOM 0 HG23 ILE A 98 -4.794 43.349 5.299 1.00 51.42 H new ATOM 0 HD11 ILE A 98 -5.856 40.091 2.702 1.00 52.05 H new ATOM 0 HD12 ILE A 98 -4.110 40.343 2.468 1.00 52.05 H new ATOM 0 HD13 ILE A 98 -4.811 40.434 4.101 1.00 52.05 H new ATOM 1494 N ALA A 99 -1.939 45.179 2.666 1.00 11.21 N ATOM 1495 CA ALA A 99 -0.749 45.935 3.035 1.00 44.01 C ATOM 1496 C ALA A 99 -0.994 47.436 2.922 1.00 72.21 C ATOM 1497 O ALA A 99 -0.421 48.225 3.672 1.00 53.42 O ATOM 1498 CB ALA A 99 0.429 45.524 2.163 1.00 33.23 C ATOM 0 H ALA A 99 -1.817 44.568 1.858 1.00 11.21 H new ATOM 0 HA ALA A 99 -0.514 45.709 4.075 1.00 44.01 H new ATOM 0 HB1 ALA A 99 1.311 46.097 2.450 1.00 33.23 H new ATOM 0 HB2 ALA A 99 0.627 44.461 2.297 1.00 33.23 H new ATOM 0 HB3 ALA A 99 0.193 45.720 1.117 1.00 33.23 H new ATOM 1504 N GLU A 100 -1.849 47.822 1.979 1.00 23.44 N ATOM 1505 CA GLU A 100 -2.168 49.229 1.768 1.00 21.33 C ATOM 1506 C GLU A 100 -2.954 49.791 2.949 1.00 1.41 C ATOM 1507 O GLU A 100 -2.631 50.858 3.471 1.00 32.14 O ATOM 1508 CB GLU A 100 -2.970 49.405 0.477 1.00 31.53 C ATOM 1509 CG GLU A 100 -3.257 50.856 0.132 1.00 44.24 C ATOM 1510 CD GLU A 100 -3.352 51.092 -1.363 1.00 72.13 C ATOM 1511 OE1 GLU A 100 -4.316 50.594 -1.981 1.00 74.23 O ATOM 1512 OE2 GLU A 100 -2.463 51.774 -1.915 1.00 74.30 O ATOM 0 H GLU A 100 -2.332 47.181 1.350 1.00 23.44 H new ATOM 0 HA GLU A 100 -1.231 49.779 1.682 1.00 21.33 H new ATOM 0 HB2 GLU A 100 -2.423 48.946 -0.346 1.00 31.53 H new ATOM 0 HB3 GLU A 100 -3.914 48.869 0.570 1.00 31.53 H new ATOM 0 HG2 GLU A 100 -4.191 51.160 0.604 1.00 44.24 H new ATOM 0 HG3 GLU A 100 -2.470 51.487 0.546 1.00 44.24 H new ATOM 1519 N ALA A 101 -3.988 49.066 3.364 1.00 44.23 N ATOM 1520 CA ALA A 101 -4.819 49.491 4.483 1.00 51.22 C ATOM 1521 C ALA A 101 -3.976 49.741 5.729 1.00 54.00 C ATOM 1522 O ALA A 101 -4.133 50.759 6.402 1.00 72.03 O ATOM 1523 CB ALA A 101 -5.892 48.451 4.769 1.00 63.45 C ATOM 0 H ALA A 101 -4.270 48.181 2.942 1.00 44.23 H new ATOM 0 HA ALA A 101 -5.302 50.429 4.209 1.00 51.22 H new ATOM 0 HB1 ALA A 101 -6.505 48.782 5.607 1.00 63.45 H new ATOM 0 HB2 ALA A 101 -6.520 48.325 3.887 1.00 63.45 H new ATOM 0 HB3 ALA A 101 -5.420 47.500 5.018 1.00 63.45 H new ATOM 1529 N ASN A 102 -3.083 48.805 6.031 1.00 62.30 N ATOM 1530 CA ASN A 102 -2.216 48.923 7.198 1.00 50.32 C ATOM 1531 C ASN A 102 -1.289 50.128 7.067 1.00 54.22 C ATOM 1532 O ASN A 102 -1.105 50.890 8.017 1.00 24.54 O ATOM 1533 CB ASN A 102 -1.390 47.648 7.377 1.00 33.24 C ATOM 1534 CG ASN A 102 -2.018 46.687 8.369 1.00 0.51 C ATOM 1535 OD1 ASN A 102 -2.276 47.045 9.518 1.00 11.44 O ATOM 1536 ND2 ASN A 102 -2.266 45.460 7.928 1.00 73.13 N ATOM 0 H ASN A 102 -2.940 47.956 5.484 1.00 62.30 H new ATOM 0 HA ASN A 102 -2.847 49.065 8.075 1.00 50.32 H new ATOM 0 HB2 ASN A 102 -1.280 47.151 6.413 1.00 33.24 H new ATOM 0 HB3 ASN A 102 -0.388 47.912 7.715 1.00 33.24 H new ATOM 0 HD21 ASN A 102 -2.687 44.770 8.550 1.00 73.13 H new ATOM 0 HD22 ASN A 102 -2.035 45.207 6.967 1.00 73.13 H new ATOM 1543 N LEU A 103 -0.709 50.296 5.883 1.00 35.45 N ATOM 1544 CA LEU A 103 0.198 51.409 5.627 1.00 60.53 C ATOM 1545 C LEU A 103 -0.534 52.743 5.729 1.00 71.22 C ATOM 1546 O LEU A 103 0.069 53.771 6.035 1.00 43.30 O ATOM 1547 CB LEU A 103 0.832 51.266 4.242 1.00 40.31 C ATOM 1548 CG LEU A 103 2.355 51.130 4.212 1.00 73.43 C ATOM 1549 CD1 LEU A 103 2.822 50.668 2.840 1.00 1.10 C ATOM 1550 CD2 LEU A 103 3.016 52.448 4.587 1.00 61.31 C ATOM 0 H LEU A 103 -0.851 49.676 5.086 1.00 35.45 H new ATOM 0 HA LEU A 103 0.983 51.388 6.383 1.00 60.53 H new ATOM 0 HB2 LEU A 103 0.400 50.392 3.755 1.00 40.31 H new ATOM 0 HB3 LEU A 103 0.553 52.134 3.645 1.00 40.31 H new ATOM 0 HG LEU A 103 2.648 50.379 4.945 1.00 73.43 H new ATOM 0 HD11 LEU A 103 3.908 50.577 2.837 1.00 1.10 H new ATOM 0 HD12 LEU A 103 2.376 49.700 2.611 1.00 1.10 H new ATOM 0 HD13 LEU A 103 2.517 51.396 2.088 1.00 1.10 H new ATOM 0 HD21 LEU A 103 4.100 52.332 4.560 1.00 61.31 H new ATOM 0 HD22 LEU A 103 2.716 53.220 3.878 1.00 61.31 H new ATOM 0 HD23 LEU A 103 2.707 52.737 5.591 1.00 61.31 H new ATOM 1562 N ARG A 104 -1.838 52.718 5.472 1.00 21.42 N ATOM 1563 CA ARG A 104 -2.653 53.925 5.536 1.00 24.12 C ATOM 1564 C ARG A 104 -2.467 54.636 6.874 1.00 60.24 C ATOM 1565 O ARG A 104 -1.889 55.721 6.937 1.00 14.34 O ATOM 1566 CB ARG A 104 -4.129 53.581 5.330 1.00 41.22 C ATOM 1567 CG ARG A 104 -5.017 54.800 5.137 1.00 22.34 C ATOM 1568 CD ARG A 104 -5.674 54.799 3.766 1.00 34.22 C ATOM 1569 NE ARG A 104 -6.926 54.046 3.760 1.00 64.43 N ATOM 1570 CZ ARG A 104 -7.490 53.567 2.656 1.00 4.03 C ATOM 1571 NH1 ARG A 104 -6.916 53.762 1.477 1.00 54.02 N ATOM 1572 NH2 ARG A 104 -8.629 52.891 2.732 1.00 50.23 N ATOM 0 H ARG A 104 -2.352 51.875 5.218 1.00 21.42 H new ATOM 0 HA ARG A 104 -2.329 54.595 4.740 1.00 24.12 H new ATOM 0 HB2 ARG A 104 -4.224 52.931 4.460 1.00 41.22 H new ATOM 0 HB3 ARG A 104 -4.485 53.015 6.191 1.00 41.22 H new ATOM 0 HG2 ARG A 104 -5.785 54.818 5.910 1.00 22.34 H new ATOM 0 HG3 ARG A 104 -4.424 55.706 5.257 1.00 22.34 H new ATOM 0 HD2 ARG A 104 -5.867 55.826 3.456 1.00 34.22 H new ATOM 0 HD3 ARG A 104 -4.989 54.369 3.036 1.00 34.22 H new ATOM 0 HE ARG A 104 -7.393 53.879 4.652 1.00 64.43 H new ATOM 0 HH11 ARG A 104 -6.040 54.281 1.416 1.00 54.02 H new ATOM 0 HH12 ARG A 104 -7.351 53.393 0.631 1.00 54.02 H new ATOM 0 HH21 ARG A 104 -9.072 52.739 3.638 1.00 50.23 H new ATOM 0 HH22 ARG A 104 -9.062 52.524 1.884 1.00 50.23 H new ATOM 1586 N LYS A 105 -2.961 54.017 7.940 1.00 31.33 N ATOM 1587 CA LYS A 105 -2.850 54.588 9.277 1.00 0.21 C ATOM 1588 C LYS A 105 -2.018 53.689 10.186 1.00 70.01 C ATOM 1589 O LYS A 105 -1.221 54.171 10.990 1.00 20.33 O ATOM 1590 CB LYS A 105 -4.240 54.797 9.882 1.00 31.32 C ATOM 1591 CG LYS A 105 -4.253 55.756 11.060 1.00 72.31 C ATOM 1592 CD LYS A 105 -5.669 56.036 11.535 1.00 51.10 C ATOM 1593 CE LYS A 105 -6.197 57.347 10.972 1.00 63.34 C ATOM 1594 NZ LYS A 105 -5.406 58.514 11.450 1.00 51.40 N ATOM 0 H LYS A 105 -3.443 53.119 7.904 1.00 31.33 H new ATOM 0 HA LYS A 105 -2.349 55.552 9.192 1.00 0.21 H new ATOM 0 HB2 LYS A 105 -4.910 55.174 9.110 1.00 31.32 H new ATOM 0 HB3 LYS A 105 -4.635 53.834 10.204 1.00 31.32 H new ATOM 0 HG2 LYS A 105 -3.670 55.335 11.879 1.00 72.31 H new ATOM 0 HG3 LYS A 105 -3.772 56.692 10.774 1.00 72.31 H new ATOM 0 HD2 LYS A 105 -6.324 55.219 11.232 1.00 51.10 H new ATOM 0 HD3 LYS A 105 -5.688 56.073 12.624 1.00 51.10 H new ATOM 0 HE2 LYS A 105 -6.170 57.312 9.883 1.00 63.34 H new ATOM 0 HE3 LYS A 105 -7.240 57.472 11.261 1.00 63.34 H new ATOM 0 HZ1 LYS A 105 -6.011 59.360 11.467 1.00 51.40 H new ATOM 0 HZ2 LYS A 105 -5.051 58.323 12.409 1.00 51.40 H new ATOM 0 HZ3 LYS A 105 -4.603 58.675 10.809 1.00 51.40 H new ATOM 1608 N ALA A 106 -2.208 52.381 10.051 1.00 72.41 N ATOM 1609 CA ALA A 106 -1.473 51.415 10.857 1.00 23.44 C ATOM 1610 C ALA A 106 0.020 51.463 10.547 1.00 15.31 C ATOM 1611 O ALA A 106 0.457 52.218 9.679 1.00 4.05 O ATOM 1612 CB ALA A 106 -2.016 50.012 10.627 1.00 51.20 C ATOM 0 H ALA A 106 -2.865 51.966 9.391 1.00 72.41 H new ATOM 0 HA ALA A 106 -1.609 51.678 11.906 1.00 23.44 H new ATOM 0 HB1 ALA A 106 -1.457 49.301 11.236 1.00 51.20 H new ATOM 0 HB2 ALA A 106 -3.069 49.979 10.906 1.00 51.20 H new ATOM 0 HB3 ALA A 106 -1.911 49.749 9.574 1.00 51.20 H new ATOM 1618 N GLU A 107 0.795 50.654 11.262 1.00 11.23 N ATOM 1619 CA GLU A 107 2.239 50.608 11.063 1.00 34.50 C ATOM 1620 C GLU A 107 2.877 49.545 11.953 1.00 14.03 C ATOM 1621 O GLU A 107 3.256 49.819 13.091 1.00 45.21 O ATOM 1622 CB GLU A 107 2.861 51.975 11.356 1.00 74.53 C ATOM 1623 CG GLU A 107 3.391 52.679 10.119 1.00 42.34 C ATOM 1624 CD GLU A 107 4.794 52.236 9.751 1.00 30.01 C ATOM 1625 OE1 GLU A 107 5.015 51.014 9.617 1.00 12.43 O ATOM 1626 OE2 GLU A 107 5.671 53.112 9.597 1.00 30.22 O ATOM 0 H GLU A 107 0.448 50.022 11.984 1.00 11.23 H new ATOM 0 HA GLU A 107 2.428 50.347 10.022 1.00 34.50 H new ATOM 0 HB2 GLU A 107 2.115 52.610 11.833 1.00 74.53 H new ATOM 0 HB3 GLU A 107 3.676 51.849 12.069 1.00 74.53 H new ATOM 0 HG2 GLU A 107 2.722 52.486 9.281 1.00 42.34 H new ATOM 0 HG3 GLU A 107 3.387 53.756 10.289 1.00 42.34 H new ATOM 1633 N GLY A 108 2.990 48.330 11.426 1.00 23.30 N ATOM 1634 CA GLY A 108 3.582 47.244 12.186 1.00 74.22 C ATOM 1635 C GLY A 108 3.914 46.045 11.320 1.00 24.33 C ATOM 1636 O GLY A 108 3.086 45.591 10.531 1.00 1.23 O ATOM 0 H GLY A 108 2.682 48.078 10.487 1.00 23.30 H new ATOM 0 HA2 GLY A 108 4.490 47.599 12.674 1.00 74.22 H new ATOM 0 HA3 GLY A 108 2.894 46.939 12.975 1.00 74.22 H new ATOM 1640 N ALA A 109 5.131 45.531 11.467 1.00 62.43 N ATOM 1641 CA ALA A 109 5.571 44.377 10.692 1.00 24.13 C ATOM 1642 C ALA A 109 4.731 43.146 11.015 1.00 52.23 C ATOM 1643 O ALA A 109 4.333 42.402 10.118 1.00 25.11 O ATOM 1644 CB ALA A 109 7.044 44.096 10.954 1.00 13.20 C ATOM 0 H ALA A 109 5.829 45.895 12.115 1.00 62.43 H new ATOM 0 HA ALA A 109 5.438 44.608 9.635 1.00 24.13 H new ATOM 0 HB1 ALA A 109 7.359 43.232 10.369 1.00 13.20 H new ATOM 0 HB2 ALA A 109 7.637 44.964 10.667 1.00 13.20 H new ATOM 0 HB3 ALA A 109 7.192 43.890 12.014 1.00 13.20 H new ATOM 1650 N ARG A 110 4.464 42.938 12.300 1.00 70.41 N ATOM 1651 CA ARG A 110 3.672 41.796 12.740 1.00 20.52 C ATOM 1652 C ARG A 110 2.316 41.773 12.042 1.00 73.34 C ATOM 1653 O ARG A 110 1.815 40.711 11.673 1.00 62.41 O ATOM 1654 CB ARG A 110 3.476 41.838 14.257 1.00 51.22 C ATOM 1655 CG ARG A 110 4.740 41.531 15.043 1.00 33.23 C ATOM 1656 CD ARG A 110 5.154 40.076 14.885 1.00 2.31 C ATOM 1657 NE ARG A 110 6.131 39.899 13.814 1.00 73.22 N ATOM 1658 CZ ARG A 110 6.911 38.830 13.701 1.00 44.15 C ATOM 1659 NH1 ARG A 110 6.830 37.849 14.588 1.00 20.51 N ATOM 1660 NH2 ARG A 110 7.776 38.741 12.697 1.00 14.45 N ATOM 0 H ARG A 110 4.784 43.545 13.054 1.00 70.41 H new ATOM 0 HA ARG A 110 4.213 40.887 12.475 1.00 20.52 H new ATOM 0 HB2 ARG A 110 3.113 42.826 14.541 1.00 51.22 H new ATOM 0 HB3 ARG A 110 2.703 41.122 14.535 1.00 51.22 H new ATOM 0 HG2 ARG A 110 5.548 42.179 14.703 1.00 33.23 H new ATOM 0 HG3 ARG A 110 4.577 41.752 16.098 1.00 33.23 H new ATOM 0 HD2 ARG A 110 5.575 39.715 15.823 1.00 2.31 H new ATOM 0 HD3 ARG A 110 4.273 39.469 14.676 1.00 2.31 H new ATOM 0 HE ARG A 110 6.219 40.636 13.115 1.00 73.22 H new ATOM 0 HH11 ARG A 110 6.167 37.913 15.361 1.00 20.51 H new ATOM 0 HH12 ARG A 110 7.431 37.029 14.498 1.00 20.51 H new ATOM 0 HH21 ARG A 110 7.842 39.494 12.012 1.00 14.45 H new ATOM 0 HH22 ARG A 110 8.375 37.920 12.611 1.00 14.45 H new ATOM 1674 N GLN A 111 1.727 42.951 11.864 1.00 3.22 N ATOM 1675 CA GLN A 111 0.429 43.065 11.211 1.00 14.51 C ATOM 1676 C GLN A 111 0.472 42.473 9.806 1.00 34.15 C ATOM 1677 O GLN A 111 -0.454 41.779 9.385 1.00 22.20 O ATOM 1678 CB GLN A 111 -0.006 44.531 11.146 1.00 31.43 C ATOM 1679 CG GLN A 111 -1.169 44.861 12.067 1.00 14.43 C ATOM 1680 CD GLN A 111 -0.829 45.946 13.070 1.00 15.22 C ATOM 1681 OE1 GLN A 111 -0.644 45.675 14.257 1.00 62.42 O ATOM 1682 NE2 GLN A 111 -0.746 47.184 12.598 1.00 41.41 N ATOM 0 H GLN A 111 2.128 43.840 12.163 1.00 3.22 H new ATOM 0 HA GLN A 111 -0.296 42.503 11.800 1.00 14.51 H new ATOM 0 HB2 GLN A 111 0.842 45.165 11.404 1.00 31.43 H new ATOM 0 HB3 GLN A 111 -0.285 44.774 10.121 1.00 31.43 H new ATOM 0 HG2 GLN A 111 -2.023 45.179 11.468 1.00 14.43 H new ATOM 0 HG3 GLN A 111 -1.472 43.960 12.601 1.00 14.43 H new ATOM 0 HE21 GLN A 111 -0.907 47.364 11.607 1.00 41.41 H new ATOM 0 HE22 GLN A 111 -0.521 47.955 13.226 1.00 41.41 H new ATOM 1691 N LYS A 112 1.552 42.751 9.085 1.00 1.41 N ATOM 1692 CA LYS A 112 1.718 42.246 7.728 1.00 75.25 C ATOM 1693 C LYS A 112 1.828 40.725 7.723 1.00 21.52 C ATOM 1694 O LYS A 112 1.143 40.045 6.958 1.00 43.54 O ATOM 1695 CB LYS A 112 2.961 42.860 7.081 1.00 40.05 C ATOM 1696 CG LYS A 112 2.644 43.916 6.035 1.00 24.34 C ATOM 1697 CD LYS A 112 2.088 45.179 6.670 1.00 42.41 C ATOM 1698 CE LYS A 112 2.284 46.388 5.768 1.00 53.41 C ATOM 1699 NZ LYS A 112 3.267 47.352 6.337 1.00 72.53 N ATOM 0 H LYS A 112 2.327 43.324 9.419 1.00 1.41 H new ATOM 0 HA LYS A 112 0.838 42.531 7.151 1.00 75.25 H new ATOM 0 HB2 LYS A 112 3.582 43.305 7.858 1.00 40.05 H new ATOM 0 HB3 LYS A 112 3.549 42.067 6.618 1.00 40.05 H new ATOM 0 HG2 LYS A 112 3.547 44.157 5.474 1.00 24.34 H new ATOM 0 HG3 LYS A 112 1.922 43.518 5.322 1.00 24.34 H new ATOM 0 HD2 LYS A 112 1.026 45.046 6.877 1.00 42.41 H new ATOM 0 HD3 LYS A 112 2.580 45.354 7.627 1.00 42.41 H new ATOM 0 HE2 LYS A 112 2.626 46.058 4.787 1.00 53.41 H new ATOM 0 HE3 LYS A 112 1.328 46.889 5.620 1.00 53.41 H new ATOM 0 HZ1 LYS A 112 3.372 48.161 5.693 1.00 72.53 H new ATOM 0 HZ2 LYS A 112 2.929 47.687 7.262 1.00 72.53 H new ATOM 0 HZ3 LYS A 112 4.187 46.881 6.454 1.00 72.53 H new ATOM 1713 N ILE A 113 2.693 40.196 8.583 1.00 54.30 N ATOM 1714 CA ILE A 113 2.890 38.755 8.679 1.00 13.31 C ATOM 1715 C ILE A 113 1.574 38.038 8.959 1.00 34.23 C ATOM 1716 O ILE A 113 1.197 37.111 8.243 1.00 15.01 O ATOM 1717 CB ILE A 113 3.901 38.398 9.784 1.00 45.00 C ATOM 1718 CG1 ILE A 113 5.227 39.124 9.546 1.00 0.42 C ATOM 1719 CG2 ILE A 113 4.118 36.893 9.837 1.00 0.13 C ATOM 1720 CD1 ILE A 113 5.858 38.808 8.208 1.00 21.45 C ATOM 0 H ILE A 113 3.268 40.744 9.223 1.00 54.30 H new ATOM 0 HA ILE A 113 3.283 38.425 7.717 1.00 13.31 H new ATOM 0 HB ILE A 113 3.498 38.722 10.743 1.00 45.00 H new ATOM 0 HG12 ILE A 113 5.061 40.199 9.615 1.00 0.42 H new ATOM 0 HG13 ILE A 113 5.925 38.858 10.340 1.00 0.42 H new ATOM 0 HG21 ILE A 113 4.835 36.656 10.623 1.00 0.13 H new ATOM 0 HG22 ILE A 113 3.171 36.396 10.048 1.00 0.13 H new ATOM 0 HG23 ILE A 113 4.503 36.547 8.878 1.00 0.13 H new ATOM 0 HD11 ILE A 113 6.794 39.357 8.108 1.00 21.45 H new ATOM 0 HD12 ILE A 113 6.056 37.738 8.143 1.00 21.45 H new ATOM 0 HD13 ILE A 113 5.179 39.100 7.407 1.00 21.45 H new ATOM 1732 N GLU A 114 0.879 38.475 10.005 1.00 74.30 N ATOM 1733 CA GLU A 114 -0.396 37.874 10.379 1.00 55.13 C ATOM 1734 C GLU A 114 -1.370 37.890 9.204 1.00 74.10 C ATOM 1735 O GLU A 114 -2.047 36.899 8.931 1.00 22.35 O ATOM 1736 CB GLU A 114 -1.005 38.616 11.570 1.00 14.22 C ATOM 1737 CG GLU A 114 -0.161 38.539 12.831 1.00 12.12 C ATOM 1738 CD GLU A 114 -0.522 37.352 13.703 1.00 62.10 C ATOM 1739 OE1 GLU A 114 -0.410 36.206 13.221 1.00 72.50 O ATOM 1740 OE2 GLU A 114 -0.915 37.570 14.868 1.00 15.10 O ATOM 0 H GLU A 114 1.177 39.242 10.608 1.00 74.30 H new ATOM 0 HA GLU A 114 -0.211 36.838 10.662 1.00 55.13 H new ATOM 0 HB2 GLU A 114 -1.147 39.663 11.301 1.00 14.22 H new ATOM 0 HB3 GLU A 114 -1.992 38.204 11.778 1.00 14.22 H new ATOM 0 HG2 GLU A 114 0.892 38.476 12.556 1.00 12.12 H new ATOM 0 HG3 GLU A 114 -0.286 39.458 13.404 1.00 12.12 H new ATOM 1747 N ALA A 115 -1.436 39.023 8.512 1.00 23.04 N ATOM 1748 CA ALA A 115 -2.325 39.168 7.367 1.00 41.44 C ATOM 1749 C ALA A 115 -1.906 38.246 6.226 1.00 14.34 C ATOM 1750 O ALA A 115 -2.747 37.741 5.484 1.00 51.42 O ATOM 1751 CB ALA A 115 -2.348 40.615 6.897 1.00 43.34 C ATOM 0 H ALA A 115 -0.884 39.854 8.725 1.00 23.04 H new ATOM 0 HA ALA A 115 -3.329 38.883 7.680 1.00 41.44 H new ATOM 0 HB1 ALA A 115 -3.016 40.709 6.041 1.00 43.34 H new ATOM 0 HB2 ALA A 115 -2.702 41.255 7.706 1.00 43.34 H new ATOM 0 HB3 ALA A 115 -1.342 40.920 6.607 1.00 43.34 H new ATOM 1757 N ASN A 116 -0.601 38.032 6.094 1.00 74.15 N ATOM 1758 CA ASN A 116 -0.072 37.171 5.042 1.00 5.13 C ATOM 1759 C ASN A 116 -0.641 35.760 5.156 1.00 42.21 C ATOM 1760 O ASN A 116 -1.236 35.241 4.211 1.00 62.14 O ATOM 1761 CB ASN A 116 1.456 37.124 5.115 1.00 41.15 C ATOM 1762 CG ASN A 116 2.109 37.491 3.796 1.00 72.54 C ATOM 1763 OD1 ASN A 116 2.910 38.422 3.725 1.00 44.23 O ATOM 1764 ND2 ASN A 116 1.767 36.757 2.743 1.00 62.13 N ATOM 0 H ASN A 116 0.109 38.442 6.701 1.00 74.15 H new ATOM 0 HA ASN A 116 -0.372 37.587 4.080 1.00 5.13 H new ATOM 0 HB2 ASN A 116 1.801 37.807 5.891 1.00 41.15 H new ATOM 0 HB3 ASN A 116 1.773 36.123 5.408 1.00 41.15 H new ATOM 0 HD21 ASN A 116 2.173 36.956 1.829 1.00 62.13 H new ATOM 0 HD22 ASN A 116 1.098 35.994 2.849 1.00 62.13 H new ATOM 1771 N LEU A 117 -0.455 35.145 6.319 1.00 41.25 N ATOM 1772 CA LEU A 117 -0.950 33.794 6.557 1.00 33.01 C ATOM 1773 C LEU A 117 -2.471 33.743 6.443 1.00 4.43 C ATOM 1774 O LEU A 117 -3.036 32.750 5.988 1.00 31.34 O ATOM 1775 CB LEU A 117 -0.515 33.307 7.940 1.00 25.40 C ATOM 1776 CG LEU A 117 0.945 33.566 8.314 1.00 63.12 C ATOM 1777 CD1 LEU A 117 1.032 34.504 9.507 1.00 1.24 C ATOM 1778 CD2 LEU A 117 1.661 32.256 8.610 1.00 72.12 C ATOM 0 H LEU A 117 0.035 35.560 7.111 1.00 41.25 H new ATOM 0 HA LEU A 117 -0.525 33.139 5.797 1.00 33.01 H new ATOM 0 HB2 LEU A 117 -1.150 33.783 8.687 1.00 25.40 H new ATOM 0 HB3 LEU A 117 -0.700 32.234 8.000 1.00 25.40 H new ATOM 0 HG LEU A 117 1.438 34.042 7.466 1.00 63.12 H new ATOM 0 HD11 LEU A 117 2.078 34.677 9.759 1.00 1.24 H new ATOM 0 HD12 LEU A 117 0.557 35.453 9.259 1.00 1.24 H new ATOM 0 HD13 LEU A 117 0.523 34.056 10.360 1.00 1.24 H new ATOM 0 HD21 LEU A 117 2.699 32.460 8.874 1.00 72.12 H new ATOM 0 HD22 LEU A 117 1.168 31.751 9.441 1.00 72.12 H new ATOM 0 HD23 LEU A 117 1.630 31.617 7.727 1.00 72.12 H new ATOM 1790 N ALA A 118 -3.126 34.823 6.858 1.00 70.31 N ATOM 1791 CA ALA A 118 -4.580 34.903 6.799 1.00 72.05 C ATOM 1792 C ALA A 118 -5.071 34.910 5.355 1.00 51.22 C ATOM 1793 O ALA A 118 -6.162 34.423 5.057 1.00 74.22 O ATOM 1794 CB ALA A 118 -5.071 36.143 7.531 1.00 4.10 C ATOM 0 H ALA A 118 -2.673 35.654 7.238 1.00 70.31 H new ATOM 0 HA ALA A 118 -4.988 34.019 7.290 1.00 72.05 H new ATOM 0 HB1 ALA A 118 -6.159 36.190 7.479 1.00 4.10 H new ATOM 0 HB2 ALA A 118 -4.760 36.097 8.575 1.00 4.10 H new ATOM 0 HB3 ALA A 118 -4.647 37.032 7.065 1.00 4.10 H new ATOM 1800 N LEU A 119 -4.260 35.466 4.462 1.00 42.31 N ATOM 1801 CA LEU A 119 -4.612 35.538 3.048 1.00 31.40 C ATOM 1802 C LEU A 119 -4.521 34.163 2.394 1.00 32.41 C ATOM 1803 O LEU A 119 -5.491 33.675 1.814 1.00 74.10 O ATOM 1804 CB LEU A 119 -3.693 36.522 2.322 1.00 31.13 C ATOM 1805 CG LEU A 119 -4.083 36.870 0.885 1.00 33.24 C ATOM 1806 CD1 LEU A 119 -5.492 37.440 0.838 1.00 14.01 C ATOM 1807 CD2 LEU A 119 -3.088 37.852 0.285 1.00 10.35 C ATOM 0 H LEU A 119 -3.354 35.874 4.692 1.00 42.31 H new ATOM 0 HA LEU A 119 -5.641 35.889 2.973 1.00 31.40 H new ATOM 0 HB2 LEU A 119 -3.653 37.445 2.900 1.00 31.13 H new ATOM 0 HB3 LEU A 119 -2.685 36.108 2.313 1.00 31.13 H new ATOM 0 HG LEU A 119 -4.063 35.956 0.292 1.00 33.24 H new ATOM 0 HD11 LEU A 119 -5.752 37.682 -0.192 1.00 14.01 H new ATOM 0 HD12 LEU A 119 -6.195 36.704 1.227 1.00 14.01 H new ATOM 0 HD13 LEU A 119 -5.539 38.344 1.446 1.00 14.01 H new ATOM 0 HD21 LEU A 119 -3.382 38.088 -0.738 1.00 10.35 H new ATOM 0 HD22 LEU A 119 -3.075 38.766 0.879 1.00 10.35 H new ATOM 0 HD23 LEU A 119 -2.093 37.407 0.283 1.00 10.35 H new ATOM 1819 N ARG A 120 -3.350 33.542 2.494 1.00 73.11 N ATOM 1820 CA ARG A 120 -3.133 32.222 1.913 1.00 12.40 C ATOM 1821 C ARG A 120 -4.132 31.212 2.470 1.00 52.23 C ATOM 1822 O ARG A 120 -4.594 30.323 1.755 1.00 73.21 O ATOM 1823 CB ARG A 120 -1.705 31.749 2.189 1.00 31.24 C ATOM 1824 CG ARG A 120 -1.278 31.915 3.639 1.00 60.04 C ATOM 1825 CD ARG A 120 -0.001 31.145 3.935 1.00 64.13 C ATOM 1826 NE ARG A 120 1.091 32.029 4.336 1.00 33.51 N ATOM 1827 CZ ARG A 120 1.841 32.708 3.475 1.00 33.25 C ATOM 1828 NH1 ARG A 120 1.618 32.605 2.172 1.00 1.45 N ATOM 1829 NH2 ARG A 120 2.815 33.492 3.918 1.00 65.11 N ATOM 0 H ARG A 120 -2.537 33.931 2.972 1.00 73.11 H new ATOM 0 HA ARG A 120 -3.282 32.297 0.836 1.00 12.40 H new ATOM 0 HB2 ARG A 120 -1.619 30.698 1.912 1.00 31.24 H new ATOM 0 HB3 ARG A 120 -1.018 32.304 1.551 1.00 31.24 H new ATOM 0 HG2 ARG A 120 -1.125 32.972 3.856 1.00 60.04 H new ATOM 0 HG3 ARG A 120 -2.075 31.567 4.296 1.00 60.04 H new ATOM 0 HD2 ARG A 120 -0.190 30.420 4.727 1.00 64.13 H new ATOM 0 HD3 ARG A 120 0.295 30.581 3.051 1.00 64.13 H new ATOM 0 HE ARG A 120 1.288 32.130 5.332 1.00 33.51 H new ATOM 0 HH11 ARG A 120 0.869 32.003 1.829 1.00 1.45 H new ATOM 0 HH12 ARG A 120 2.195 33.127 1.513 1.00 1.45 H new ATOM 0 HH21 ARG A 120 2.988 33.574 4.920 1.00 65.11 H new ATOM 0 HH22 ARG A 120 3.391 34.013 3.257 1.00 65.11 H new ATOM 1843 N ARG A 121 -4.460 31.356 3.750 1.00 72.14 N ATOM 1844 CA ARG A 121 -5.403 30.455 4.402 1.00 4.25 C ATOM 1845 C ARG A 121 -6.824 30.703 3.907 1.00 53.51 C ATOM 1846 O ARG A 121 -7.527 29.772 3.515 1.00 0.30 O ATOM 1847 CB ARG A 121 -5.342 30.633 5.921 1.00 71.33 C ATOM 1848 CG ARG A 121 -5.794 29.406 6.696 1.00 64.42 C ATOM 1849 CD ARG A 121 -5.643 29.607 8.195 1.00 5.24 C ATOM 1850 NE ARG A 121 -6.783 30.316 8.770 1.00 31.51 N ATOM 1851 CZ ARG A 121 -6.771 30.872 9.976 1.00 3.41 C ATOM 1852 NH1 ARG A 121 -5.682 30.804 10.730 1.00 34.13 N ATOM 1853 NH2 ARG A 121 -7.848 31.500 10.430 1.00 73.05 N ATOM 0 H ARG A 121 -4.087 32.087 4.356 1.00 72.14 H new ATOM 0 HA ARG A 121 -5.123 29.432 4.150 1.00 4.25 H new ATOM 0 HB2 ARG A 121 -4.320 30.878 6.209 1.00 71.33 H new ATOM 0 HB3 ARG A 121 -5.965 31.481 6.204 1.00 71.33 H new ATOM 0 HG2 ARG A 121 -6.836 29.189 6.460 1.00 64.42 H new ATOM 0 HG3 ARG A 121 -5.209 28.541 6.383 1.00 64.42 H new ATOM 0 HD2 ARG A 121 -5.536 28.638 8.682 1.00 5.24 H new ATOM 0 HD3 ARG A 121 -4.729 30.167 8.395 1.00 5.24 H new ATOM 0 HE ARG A 121 -7.636 30.388 8.215 1.00 31.51 H new ATOM 0 HH11 ARG A 121 -4.851 30.324 10.384 1.00 34.13 H new ATOM 0 HH12 ARG A 121 -5.675 31.232 11.656 1.00 34.13 H new ATOM 0 HH21 ARG A 121 -8.687 31.556 9.853 1.00 73.05 H new ATOM 0 HH22 ARG A 121 -7.837 31.926 11.357 1.00 73.05 H new ATOM 1867 N ALA A 122 -7.241 31.965 3.928 1.00 42.31 N ATOM 1868 CA ALA A 122 -8.577 32.336 3.480 1.00 53.14 C ATOM 1869 C ALA A 122 -8.864 31.779 2.089 1.00 12.23 C ATOM 1870 O ALA A 122 -9.891 31.137 1.867 1.00 1.13 O ATOM 1871 CB ALA A 122 -8.736 33.849 3.487 1.00 4.40 C ATOM 0 H ALA A 122 -6.672 32.748 4.251 1.00 42.31 H new ATOM 0 HA ALA A 122 -9.298 31.903 4.173 1.00 53.14 H new ATOM 0 HB1 ALA A 122 -9.739 34.111 3.150 1.00 4.40 H new ATOM 0 HB2 ALA A 122 -8.583 34.226 4.498 1.00 4.40 H new ATOM 0 HB3 ALA A 122 -8.000 34.295 2.818 1.00 4.40 H new ATOM 1877 N ARG A 123 -7.951 32.030 1.157 1.00 73.34 N ATOM 1878 CA ARG A 123 -8.108 31.555 -0.213 1.00 22.42 C ATOM 1879 C ARG A 123 -8.243 30.035 -0.249 1.00 42.21 C ATOM 1880 O ARG A 123 -9.104 29.493 -0.943 1.00 0.31 O ATOM 1881 CB ARG A 123 -6.916 31.992 -1.066 1.00 60.04 C ATOM 1882 CG ARG A 123 -7.304 32.465 -2.458 1.00 12.45 C ATOM 1883 CD ARG A 123 -7.400 31.304 -3.435 1.00 1.23 C ATOM 1884 NE ARG A 123 -7.244 31.740 -4.820 1.00 2.12 N ATOM 1885 CZ ARG A 123 -8.180 32.399 -5.493 1.00 13.32 C ATOM 1886 NH1 ARG A 123 -9.334 32.697 -4.911 1.00 3.32 N ATOM 1887 NH2 ARG A 123 -7.964 32.762 -6.751 1.00 2.14 N ATOM 0 H ARG A 123 -7.095 32.559 1.325 1.00 73.34 H new ATOM 0 HA ARG A 123 -9.019 31.993 -0.621 1.00 22.42 H new ATOM 0 HB2 ARG A 123 -6.388 32.795 -0.553 1.00 60.04 H new ATOM 0 HB3 ARG A 123 -6.219 31.159 -1.156 1.00 60.04 H new ATOM 0 HG2 ARG A 123 -8.261 32.984 -2.413 1.00 12.45 H new ATOM 0 HG3 ARG A 123 -6.568 33.184 -2.817 1.00 12.45 H new ATOM 0 HD2 ARG A 123 -6.633 30.567 -3.198 1.00 1.23 H new ATOM 0 HD3 ARG A 123 -8.364 30.810 -3.317 1.00 1.23 H new ATOM 0 HE ARG A 123 -6.368 31.527 -5.297 1.00 2.12 H new ATOM 0 HH11 ARG A 123 -9.504 32.420 -3.944 1.00 3.32 H new ATOM 0 HH12 ARG A 123 -10.051 33.203 -5.430 1.00 3.32 H new ATOM 0 HH21 ARG A 123 -7.078 32.535 -7.202 1.00 2.14 H new ATOM 0 HH22 ARG A 123 -8.684 33.268 -7.267 1.00 2.14 H new ATOM 1901 N THR A 124 -7.385 29.352 0.503 1.00 73.22 N ATOM 1902 CA THR A 124 -7.407 27.896 0.556 1.00 71.54 C ATOM 1903 C THR A 124 -8.791 27.380 0.934 1.00 23.24 C ATOM 1904 O THR A 124 -9.241 26.352 0.427 1.00 2.32 O ATOM 1905 CB THR A 124 -6.376 27.354 1.564 1.00 12.41 C ATOM 1906 OG1 THR A 124 -5.058 27.768 1.187 1.00 71.54 O ATOM 1907 CG2 THR A 124 -6.436 25.836 1.637 1.00 1.10 C ATOM 0 H THR A 124 -6.666 29.784 1.084 1.00 73.22 H new ATOM 0 HA THR A 124 -7.150 27.540 -0.442 1.00 71.54 H new ATOM 0 HB THR A 124 -6.615 27.758 2.548 1.00 12.41 H new ATOM 0 HG1 THR A 124 -4.841 28.614 1.631 1.00 71.54 H new ATOM 0 HG21 THR A 124 -5.699 25.477 2.355 1.00 1.10 H new ATOM 0 HG22 THR A 124 -7.432 25.526 1.953 1.00 1.10 H new ATOM 0 HG23 THR A 124 -6.220 25.416 0.655 1.00 1.10 H new ATOM 1915 N ARG A 125 -9.461 28.100 1.828 1.00 31.52 N ATOM 1916 CA ARG A 125 -10.794 27.714 2.275 1.00 31.31 C ATOM 1917 C ARG A 125 -11.812 27.873 1.150 1.00 52.03 C ATOM 1918 O ARG A 125 -12.664 27.009 0.942 1.00 13.12 O ATOM 1919 CB ARG A 125 -11.215 28.556 3.481 1.00 43.02 C ATOM 1920 CG ARG A 125 -12.623 28.259 3.970 1.00 62.11 C ATOM 1921 CD ARG A 125 -13.630 29.245 3.400 1.00 73.05 C ATOM 1922 NE ARG A 125 -15.006 28.850 3.688 1.00 14.00 N ATOM 1923 CZ ARG A 125 -15.599 29.053 4.859 1.00 0.14 C ATOM 1924 NH1 ARG A 125 -14.939 29.644 5.846 1.00 34.22 N ATOM 1925 NH2 ARG A 125 -16.854 28.665 5.045 1.00 13.33 N ATOM 0 H ARG A 125 -9.103 28.953 2.257 1.00 31.52 H new ATOM 0 HA ARG A 125 -10.762 26.664 2.567 1.00 31.31 H new ATOM 0 HB2 ARG A 125 -10.513 28.384 4.296 1.00 43.02 H new ATOM 0 HB3 ARG A 125 -11.146 29.612 3.218 1.00 43.02 H new ATOM 0 HG2 ARG A 125 -12.903 27.245 3.683 1.00 62.11 H new ATOM 0 HG3 ARG A 125 -12.648 28.301 5.059 1.00 62.11 H new ATOM 0 HD2 ARG A 125 -13.443 30.235 3.815 1.00 73.05 H new ATOM 0 HD3 ARG A 125 -13.493 29.321 2.321 1.00 73.05 H new ATOM 0 HE ARG A 125 -15.541 28.393 2.949 1.00 14.00 H new ATOM 0 HH11 ARG A 125 -13.974 29.944 5.707 1.00 34.22 H new ATOM 0 HH12 ARG A 125 -15.396 29.799 6.744 1.00 34.22 H new ATOM 0 HH21 ARG A 125 -17.365 28.210 4.288 1.00 13.33 H new ATOM 0 HH22 ARG A 125 -17.308 28.822 5.945 1.00 13.33 H new ATOM 1939 N VAL A 126 -11.718 28.984 0.426 1.00 4.10 N ATOM 1940 CA VAL A 126 -12.629 29.257 -0.679 1.00 34.15 C ATOM 1941 C VAL A 126 -12.592 28.136 -1.711 1.00 55.13 C ATOM 1942 O VAL A 126 -13.627 27.570 -2.064 1.00 44.32 O ATOM 1943 CB VAL A 126 -12.289 30.590 -1.371 1.00 61.22 C ATOM 1944 CG1 VAL A 126 -13.310 30.906 -2.453 1.00 74.20 C ATOM 1945 CG2 VAL A 126 -12.215 31.716 -0.351 1.00 44.03 C ATOM 0 H VAL A 126 -11.019 29.710 0.585 1.00 4.10 H new ATOM 0 HA VAL A 126 -13.631 29.323 -0.255 1.00 34.15 H new ATOM 0 HB VAL A 126 -11.312 30.495 -1.844 1.00 61.22 H new ATOM 0 HG11 VAL A 126 -13.053 31.851 -2.931 1.00 74.20 H new ATOM 0 HG12 VAL A 126 -13.308 30.111 -3.198 1.00 74.20 H new ATOM 0 HG13 VAL A 126 -14.301 30.983 -2.007 1.00 74.20 H new ATOM 0 HG21 VAL A 126 -11.974 32.651 -0.858 1.00 44.03 H new ATOM 0 HG22 VAL A 126 -13.176 31.814 0.153 1.00 44.03 H new ATOM 0 HG23 VAL A 126 -11.442 31.491 0.383 1.00 44.03 H new ATOM 1955 N GLU A 127 -11.394 27.820 -2.192 1.00 3.55 N ATOM 1956 CA GLU A 127 -11.223 26.767 -3.185 1.00 23.43 C ATOM 1957 C GLU A 127 -11.705 25.424 -2.642 1.00 54.44 C ATOM 1958 O GLU A 127 -12.262 24.610 -3.378 1.00 34.02 O ATOM 1959 CB GLU A 127 -9.754 26.662 -3.602 1.00 54.13 C ATOM 1960 CG GLU A 127 -9.550 25.973 -4.941 1.00 21.32 C ATOM 1961 CD GLU A 127 -9.692 26.923 -6.114 1.00 73.41 C ATOM 1962 OE1 GLU A 127 -10.838 27.311 -6.427 1.00 24.32 O ATOM 1963 OE2 GLU A 127 -8.660 27.278 -6.720 1.00 24.44 O ATOM 0 H GLU A 127 -10.528 28.278 -1.910 1.00 3.55 H new ATOM 0 HA GLU A 127 -11.824 27.025 -4.057 1.00 23.43 H new ATOM 0 HB2 GLU A 127 -9.326 27.663 -3.649 1.00 54.13 H new ATOM 0 HB3 GLU A 127 -9.205 26.116 -2.835 1.00 54.13 H new ATOM 0 HG2 GLU A 127 -8.559 25.519 -4.964 1.00 21.32 H new ATOM 0 HG3 GLU A 127 -10.274 25.165 -5.043 1.00 21.32 H new ATOM 1970 N ALA A 128 -11.486 25.202 -1.351 1.00 35.44 N ATOM 1971 CA ALA A 128 -11.900 23.960 -0.709 1.00 23.22 C ATOM 1972 C ALA A 128 -13.417 23.806 -0.736 1.00 3.43 C ATOM 1973 O ALA A 128 -13.939 22.793 -1.199 1.00 75.11 O ATOM 1974 CB ALA A 128 -11.388 23.910 0.723 1.00 24.10 C ATOM 0 H ALA A 128 -11.024 25.865 -0.729 1.00 35.44 H new ATOM 0 HA ALA A 128 -11.467 23.130 -1.268 1.00 23.22 H new ATOM 0 HB1 ALA A 128 -11.704 22.977 1.190 1.00 24.10 H new ATOM 0 HB2 ALA A 128 -10.299 23.964 0.722 1.00 24.10 H new ATOM 0 HB3 ALA A 128 -11.793 24.752 1.284 1.00 24.10 H new ATOM 1980 N SER A 129 -14.118 24.818 -0.235 1.00 52.54 N ATOM 1981 CA SER A 129 -15.576 24.794 -0.198 1.00 63.31 C ATOM 1982 C SER A 129 -16.153 24.656 -1.604 1.00 1.33 C ATOM 1983 O SER A 129 -17.085 23.886 -1.831 1.00 64.12 O ATOM 1984 CB SER A 129 -16.112 26.065 0.464 1.00 62.44 C ATOM 1985 OG SER A 129 -16.652 25.784 1.743 1.00 2.44 O ATOM 0 H SER A 129 -13.700 25.665 0.151 1.00 52.54 H new ATOM 0 HA SER A 129 -15.886 23.930 0.389 1.00 63.31 H new ATOM 0 HB2 SER A 129 -15.309 26.797 0.557 1.00 62.44 H new ATOM 0 HB3 SER A 129 -16.879 26.512 -0.168 1.00 62.44 H new ATOM 0 HG SER A 129 -16.986 26.612 2.146 1.00 2.44 H new ATOM 1991 N ASN A 130 -15.591 25.410 -2.543 1.00 53.14 N ATOM 1992 CA ASN A 130 -16.050 25.374 -3.927 1.00 63.14 C ATOM 1993 C ASN A 130 -15.051 24.634 -4.812 1.00 20.20 C ATOM 1994 O ASN A 130 -14.697 25.102 -5.895 1.00 23.14 O ATOM 1995 CB ASN A 130 -16.260 26.795 -4.454 1.00 64.14 C ATOM 1996 CG ASN A 130 -17.372 27.524 -3.725 1.00 61.52 C ATOM 1997 OD1 ASN A 130 -18.008 26.970 -2.828 1.00 60.13 O ATOM 1998 ND2 ASN A 130 -17.612 28.772 -4.108 1.00 45.25 N ATOM 0 H ASN A 130 -14.818 26.053 -2.371 1.00 53.14 H new ATOM 0 HA ASN A 130 -16.999 24.839 -3.955 1.00 63.14 H new ATOM 0 HB2 ASN A 130 -15.332 27.358 -4.352 1.00 64.14 H new ATOM 0 HB3 ASN A 130 -16.493 26.754 -5.518 1.00 64.14 H new ATOM 0 HD21 ASN A 130 -18.349 29.312 -3.654 1.00 45.25 H new ATOM 0 HD22 ASN A 130 -17.060 29.191 -4.856 1.00 45.25 H new ATOM 2005 N THR A 131 -14.600 23.474 -4.344 1.00 1.00 N ATOM 2006 CA THR A 131 -13.642 22.669 -5.091 1.00 70.11 C ATOM 2007 C THR A 131 -14.171 22.334 -6.481 1.00 41.20 C ATOM 2008 O THR A 131 -13.411 22.280 -7.448 1.00 65.30 O ATOM 2009 CB THR A 131 -13.311 21.359 -4.351 1.00 40.10 C ATOM 2010 OG1 THR A 131 -12.362 20.597 -5.105 1.00 71.31 O ATOM 2011 CG2 THR A 131 -14.568 20.533 -4.125 1.00 30.22 C ATOM 0 H THR A 131 -14.883 23.071 -3.451 1.00 1.00 H new ATOM 0 HA THR A 131 -12.734 23.265 -5.184 1.00 70.11 H new ATOM 0 HB THR A 131 -12.883 21.613 -3.381 1.00 40.10 H new ATOM 0 HG1 THR A 131 -12.156 19.767 -4.627 1.00 71.31 H new ATOM 0 HG21 THR A 131 -14.309 19.613 -3.601 1.00 30.22 H new ATOM 0 HG22 THR A 131 -15.276 21.105 -3.526 1.00 30.22 H new ATOM 0 HG23 THR A 131 -15.020 20.288 -5.086 1.00 30.22 H new ATOM 2019 N ILE A 132 -15.478 22.111 -6.574 1.00 5.41 N ATOM 2020 CA ILE A 132 -16.107 21.784 -7.847 1.00 35.11 C ATOM 2021 C ILE A 132 -17.611 21.590 -7.682 1.00 51.35 C ATOM 2022 O ILE A 132 -18.060 20.604 -7.098 1.00 52.33 O ATOM 2023 CB ILE A 132 -15.502 20.509 -8.463 1.00 44.24 C ATOM 2024 CG1 ILE A 132 -16.288 20.095 -9.709 1.00 1.41 C ATOM 2025 CG2 ILE A 132 -15.486 19.382 -7.441 1.00 51.34 C ATOM 2026 CD1 ILE A 132 -15.552 19.108 -10.587 1.00 75.53 C ATOM 0 H ILE A 132 -16.121 22.151 -5.783 1.00 5.41 H new ATOM 0 HA ILE A 132 -15.921 22.624 -8.516 1.00 35.11 H new ATOM 0 HB ILE A 132 -14.474 20.719 -8.758 1.00 44.24 H new ATOM 0 HG12 ILE A 132 -17.238 19.657 -9.401 1.00 1.41 H new ATOM 0 HG13 ILE A 132 -16.522 20.985 -10.293 1.00 1.41 H new ATOM 0 HG21 ILE A 132 -15.055 18.488 -7.892 1.00 51.34 H new ATOM 0 HG22 ILE A 132 -14.886 19.679 -6.581 1.00 51.34 H new ATOM 0 HG23 ILE A 132 -16.505 19.170 -7.117 1.00 51.34 H new ATOM 0 HD11 ILE A 132 -16.168 18.859 -11.451 1.00 75.53 H new ATOM 0 HD12 ILE A 132 -14.615 19.550 -10.925 1.00 75.53 H new ATOM 0 HD13 ILE A 132 -15.342 18.202 -10.019 1.00 75.53 H new ATOM 2038 N SER A 133 -18.385 22.538 -8.203 1.00 64.54 N ATOM 2039 CA SER A 133 -19.839 22.473 -8.113 1.00 25.32 C ATOM 2040 C SER A 133 -20.462 22.315 -9.496 1.00 75.11 C ATOM 2041 O SER A 133 -20.036 22.954 -10.458 1.00 15.21 O ATOM 2042 CB SER A 133 -20.385 23.731 -7.435 1.00 31.52 C ATOM 2043 OG SER A 133 -20.931 23.428 -6.163 1.00 34.22 O ATOM 0 H SER A 133 -18.029 23.360 -8.692 1.00 64.54 H new ATOM 0 HA SER A 133 -20.103 21.602 -7.513 1.00 25.32 H new ATOM 0 HB2 SER A 133 -19.587 24.465 -7.326 1.00 31.52 H new ATOM 0 HB3 SER A 133 -21.151 24.184 -8.065 1.00 31.52 H new ATOM 0 HG SER A 133 -21.272 24.249 -5.749 1.00 34.22 H new ATOM 2049 N SER A 134 -21.475 21.458 -9.588 1.00 2.54 N ATOM 2050 CA SER A 134 -22.156 21.213 -10.853 1.00 71.42 C ATOM 2051 C SER A 134 -23.397 20.350 -10.644 1.00 23.44 C ATOM 2052 O SER A 134 -24.290 20.706 -9.877 1.00 73.14 O ATOM 2053 CB SER A 134 -21.209 20.532 -11.843 1.00 24.21 C ATOM 2054 OG SER A 134 -21.930 19.884 -12.876 1.00 71.22 O ATOM 0 H SER A 134 -21.841 20.922 -8.801 1.00 2.54 H new ATOM 0 HA SER A 134 -22.468 22.174 -11.261 1.00 71.42 H new ATOM 0 HB2 SER A 134 -20.536 21.272 -12.275 1.00 24.21 H new ATOM 0 HB3 SER A 134 -20.589 19.806 -11.317 1.00 24.21 H new ATOM 0 HG SER A 134 -21.302 19.458 -13.496 1.00 71.22 H new TER 2060 SER A 134