USER MOD reduce.3.24.130724 H: found=0, std=0, add=1030, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1030 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: B 23 SER OG : rot 119:sc= 0.0113 USER MOD Set 1.2: B 74 LYS NZ :NH3+ -168:sc= 0.197 (180deg=0.129) USER MOD Set 2.1: B 20 THR OG1 : rot 67:sc= -3.05! USER MOD Set 2.2: B 68 SER OG : rot 64:sc= -2.37! USER MOD Set 3.1: B 21 GLN :FLIP amide:sc= -2.37! C(o=-5.1!,f=-3.3!) USER MOD Set 3.2: B 24 SER OG : rot 1:sc= -0.926! USER MOD Set 4.1: B 12 TYR OH : rot -173:sc= 0.232 USER MOD Set 4.2: B 67 SER OG : rot -132:sc= -0.522! USER MOD Set 5.1: A 20 THR OG1 : rot 56:sc= -2.64! USER MOD Set 5.2: A 68 SER OG : rot -91:sc= -2.41! USER MOD Set 6.1: A 23 SER OG : rot 116:sc= 0.0753 USER MOD Set 6.2: A 74 LYS NZ :NH3+ -168:sc= 0.19 (180deg=0.127) USER MOD Set 7.1: A 21 GLN :FLIP amide:sc= -2.15! C(o=-5.1!,f=-3!) USER MOD Set 7.2: A 24 SER OG : rot 1:sc= -0.804! USER MOD Set 8.1: A 12 TYR OH : rot -54:sc= 0.472 USER MOD Set 8.2: A 67 SER OG : rot -134:sc= -0.784! USER MOD Single : A 1 ASP N :NH3+ 174:sc= -0.282 (180deg=-0.366) USER MOD Single : A 2 GLN :FLIP amide:sc= -5.55! C(o=-6.4!,f=-5.5!) USER MOD Single : A 4 SER OG : rot 180:sc= -0.144 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 ASN :FLIP amide:sc= -11.3! C(o=-18!,f=-11!) USER MOD Single : A 27 ASN :FLIP amide:sc= -0.817 F(o=-7.5!,f=-0.82) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -170:sc= -0.853 USER MOD Single : A 40 SER OG : rot -61:sc= 1.21 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 64 THR OG1 : rot -47:sc= 0.14 USER MOD Single : A 66 THR OG1 : rot 135:sc= -4.11! USER MOD Single : A 70 THR OG1 : rot -153:sc= 1.81 USER MOD Single : B 1 ASP N :NH3+ 175:sc= -0.34 (180deg=-0.365) USER MOD Single : B 2 GLN :FLIP amide:sc= -5.81! C(o=-6.3!,f=-5.8!) USER MOD Single : B 4 SER OG : rot 180:sc= -0.109 USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 13 ASN :FLIP amide:sc= -11.2! C(o=-18!,f=-11!) USER MOD Single : B 27 ASN :FLIP amide:sc= -0.666 F(o=-7.6!,f=-0.67) USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 36 SER OG : rot 180:sc= 0 USER MOD Single : B 38 SER OG : rot -170:sc= -0.881 USER MOD Single : B 40 SER OG : rot -53:sc= 1.16 USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 64 THR OG1 : rot -48:sc= 0.13 USER MOD Single : B 66 THR OG1 : rot 127:sc= -4.15! USER MOD Single : B 70 THR OG1 : rot -151:sc= 1.78 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 1 -7.916 15.212 -2.835 1.00 0.00 N ATOM 2 CA ASP A 1 -8.151 14.497 -1.555 1.00 0.00 C ATOM 3 C ASP A 1 -8.985 13.242 -1.778 1.00 0.00 C ATOM 4 O ASP A 1 -9.755 12.831 -0.908 1.00 0.00 O ATOM 5 CB ASP A 1 -8.851 15.420 -0.554 1.00 0.00 C ATOM 6 CG ASP A 1 -8.072 16.696 -0.301 1.00 0.00 C ATOM 7 OD1 ASP A 1 -7.149 16.671 0.539 1.00 0.00 O ATOM 8 OD2 ASP A 1 -8.385 17.720 -0.945 1.00 0.00 O ATOM 0 H1 ASP A 1 -7.434 16.114 -2.645 1.00 0.00 H new ATOM 0 H2 ASP A 1 -7.322 14.626 -3.456 1.00 0.00 H new ATOM 0 H3 ASP A 1 -8.827 15.397 -3.301 1.00 0.00 H new ATOM 0 HA ASP A 1 -7.184 14.199 -1.150 1.00 0.00 H new ATOM 0 HB2 ASP A 1 -9.843 15.672 -0.929 1.00 0.00 H new ATOM 0 HB3 ASP A 1 -8.991 14.890 0.388 1.00 0.00 H new ATOM 15 N GLN A 2 -8.821 12.636 -2.953 1.00 0.00 N ATOM 16 CA GLN A 2 -9.552 11.422 -3.304 1.00 0.00 C ATOM 17 C GLN A 2 -11.061 11.620 -3.141 1.00 0.00 C ATOM 18 O GLN A 2 -11.638 11.219 -2.131 1.00 0.00 O ATOM 19 CB GLN A 2 -9.080 10.251 -2.440 1.00 0.00 C ATOM 20 CG GLN A 2 -7.676 9.764 -2.777 1.00 0.00 C ATOM 21 CD GLN A 2 -6.590 10.752 -2.391 1.00 0.00 C ATOM 22 OE1 GLN A 2 -6.816 11.499 -1.317 1.00 0.00 O flip ATOM 23 NE2 GLN A 2 -5.554 10.837 -3.049 1.00 0.00 N flip ATOM 0 H GLN A 2 -8.186 12.968 -3.679 1.00 0.00 H new ATOM 0 HA GLN A 2 -9.349 11.197 -4.351 1.00 0.00 H new ATOM 0 HB2 GLN A 2 -9.109 10.550 -1.392 1.00 0.00 H new ATOM 0 HB3 GLN A 2 -9.779 9.422 -2.554 1.00 0.00 H new ATOM 0 HG2 GLN A 2 -7.495 8.818 -2.267 1.00 0.00 H new ATOM 0 HG3 GLN A 2 -7.614 9.566 -3.847 1.00 0.00 H new ATOM 0 HE21 GLN A 2 -5.420 10.244 -3.868 1.00 0.00 H new ATOM 0 HE22 GLN A 2 -4.829 11.500 -2.775 1.00 0.00 H new ATOM 32 N PRO A 3 -11.720 12.240 -4.138 1.00 0.00 N ATOM 33 CA PRO A 3 -13.163 12.491 -4.094 1.00 0.00 C ATOM 34 C PRO A 3 -13.991 11.245 -4.397 1.00 0.00 C ATOM 35 O PRO A 3 -15.149 11.146 -3.990 1.00 0.00 O ATOM 36 CB PRO A 3 -13.363 13.543 -5.183 1.00 0.00 C ATOM 37 CG PRO A 3 -12.284 13.267 -6.173 1.00 0.00 C ATOM 38 CD PRO A 3 -11.110 12.751 -5.384 1.00 0.00 C ATOM 0 HA PRO A 3 -13.491 12.805 -3.103 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -14.350 13.460 -5.638 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -13.282 14.552 -4.779 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -12.610 12.533 -6.910 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -12.018 14.171 -6.720 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -10.581 11.965 -5.922 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -10.386 13.540 -5.181 1.00 0.00 H new ATOM 46 N SER A 4 -13.394 10.294 -5.111 1.00 0.00 N ATOM 47 CA SER A 4 -14.084 9.056 -5.464 1.00 0.00 C ATOM 48 C SER A 4 -13.153 7.874 -5.266 1.00 0.00 C ATOM 49 O SER A 4 -12.013 8.056 -4.863 1.00 0.00 O ATOM 50 CB SER A 4 -14.555 9.107 -6.916 1.00 0.00 C ATOM 51 OG SER A 4 -15.370 7.991 -7.229 1.00 0.00 O ATOM 0 H SER A 4 -12.436 10.356 -5.456 1.00 0.00 H new ATOM 0 HA SER A 4 -14.954 8.942 -4.817 1.00 0.00 H new ATOM 0 HB2 SER A 4 -15.112 10.028 -7.088 1.00 0.00 H new ATOM 0 HB3 SER A 4 -13.691 9.128 -7.581 1.00 0.00 H new ATOM 0 HG SER A 4 -15.659 8.049 -8.164 1.00 0.00 H new ATOM 57 N VAL A 5 -13.630 6.665 -5.534 1.00 0.00 N ATOM 58 CA VAL A 5 -12.789 5.486 -5.378 1.00 0.00 C ATOM 59 C VAL A 5 -11.839 5.339 -6.569 1.00 0.00 C ATOM 60 O VAL A 5 -10.625 5.249 -6.394 1.00 0.00 O ATOM 61 CB VAL A 5 -13.614 4.186 -5.181 1.00 0.00 C ATOM 62 CG1 VAL A 5 -15.088 4.500 -4.953 1.00 0.00 C ATOM 63 CG2 VAL A 5 -13.426 3.217 -6.347 1.00 0.00 C ATOM 0 H VAL A 5 -14.579 6.476 -5.855 1.00 0.00 H new ATOM 0 HA VAL A 5 -12.205 5.635 -4.470 1.00 0.00 H new ATOM 0 HB VAL A 5 -13.236 3.691 -4.286 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -15.641 3.571 -4.818 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -15.195 5.118 -4.062 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -15.484 5.036 -5.816 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -14.019 2.319 -6.173 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -13.751 3.693 -7.272 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -12.373 2.946 -6.429 1.00 0.00 H new ATOM 73 N GLY A 6 -12.397 5.326 -7.781 1.00 0.00 N ATOM 74 CA GLY A 6 -11.578 5.185 -8.971 1.00 0.00 C ATOM 75 C GLY A 6 -10.661 6.375 -9.167 1.00 0.00 C ATOM 76 O GLY A 6 -9.485 6.216 -9.502 1.00 0.00 O ATOM 0 H GLY A 6 -13.398 5.410 -7.956 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -10.982 4.275 -8.896 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -12.221 5.074 -9.844 1.00 0.00 H new ATOM 80 N ASP A 7 -11.202 7.570 -8.956 1.00 0.00 N ATOM 81 CA ASP A 7 -10.423 8.794 -9.090 1.00 0.00 C ATOM 82 C ASP A 7 -9.349 8.840 -8.020 1.00 0.00 C ATOM 83 O ASP A 7 -8.240 9.318 -8.257 1.00 0.00 O ATOM 84 CB ASP A 7 -11.326 10.017 -8.959 1.00 0.00 C ATOM 85 CG ASP A 7 -12.384 10.080 -10.044 1.00 0.00 C ATOM 86 OD1 ASP A 7 -13.432 9.419 -9.889 1.00 0.00 O ATOM 87 OD2 ASP A 7 -12.162 10.788 -11.049 1.00 0.00 O ATOM 0 H ASP A 7 -12.176 7.716 -8.692 1.00 0.00 H new ATOM 0 HA ASP A 7 -9.956 8.803 -10.075 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -11.812 10.002 -7.983 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -10.717 10.920 -8.998 1.00 0.00 H new ATOM 92 N ALA A 8 -9.694 8.341 -6.838 1.00 0.00 N ATOM 93 CA ALA A 8 -8.760 8.312 -5.728 1.00 0.00 C ATOM 94 C ALA A 8 -7.473 7.638 -6.151 1.00 0.00 C ATOM 95 O ALA A 8 -6.378 8.141 -5.902 1.00 0.00 O ATOM 96 CB ALA A 8 -9.353 7.569 -4.550 1.00 0.00 C ATOM 0 H ALA A 8 -10.613 7.952 -6.628 1.00 0.00 H new ATOM 0 HA ALA A 8 -8.553 9.340 -5.429 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -8.637 7.559 -3.728 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -10.267 8.068 -4.228 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -9.583 6.545 -4.844 1.00 0.00 H new ATOM 102 N PHE A 9 -7.621 6.486 -6.796 1.00 0.00 N ATOM 103 CA PHE A 9 -6.487 5.726 -7.267 1.00 0.00 C ATOM 104 C PHE A 9 -5.595 6.575 -8.158 1.00 0.00 C ATOM 105 O PHE A 9 -4.427 6.726 -7.872 1.00 0.00 O ATOM 106 CB PHE A 9 -6.953 4.483 -7.998 1.00 0.00 C ATOM 107 CG PHE A 9 -7.125 3.323 -7.079 1.00 0.00 C ATOM 108 CD1 PHE A 9 -6.066 2.480 -6.798 1.00 0.00 C ATOM 109 CD2 PHE A 9 -8.343 3.091 -6.475 1.00 0.00 C ATOM 110 CE1 PHE A 9 -6.222 1.426 -5.927 1.00 0.00 C ATOM 111 CE2 PHE A 9 -8.506 2.035 -5.609 1.00 0.00 C ATOM 112 CZ PHE A 9 -7.446 1.204 -5.332 1.00 0.00 C ATOM 0 H PHE A 9 -8.526 6.062 -7.002 1.00 0.00 H new ATOM 0 HA PHE A 9 -5.898 5.418 -6.403 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -7.898 4.691 -8.499 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -6.231 4.227 -8.773 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -5.108 2.650 -7.266 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -9.177 3.745 -6.684 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -5.388 0.775 -5.710 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -9.466 1.859 -5.147 1.00 0.00 H new ATOM 0 HZ PHE A 9 -7.572 0.377 -4.648 1.00 0.00 H new ATOM 122 N ASP A 10 -6.158 7.201 -9.190 1.00 0.00 N ATOM 123 CA ASP A 10 -5.346 8.010 -10.107 1.00 0.00 C ATOM 124 C ASP A 10 -4.359 8.869 -9.319 1.00 0.00 C ATOM 125 O ASP A 10 -3.190 9.015 -9.694 1.00 0.00 O ATOM 126 CB ASP A 10 -6.242 8.897 -10.973 1.00 0.00 C ATOM 127 CG ASP A 10 -5.455 9.685 -12.001 1.00 0.00 C ATOM 128 OD1 ASP A 10 -5.207 9.144 -13.100 1.00 0.00 O ATOM 129 OD2 ASP A 10 -5.086 10.841 -11.709 1.00 0.00 O ATOM 0 H ASP A 10 -7.153 7.168 -9.413 1.00 0.00 H new ATOM 0 HA ASP A 10 -4.787 7.339 -10.759 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -6.980 8.277 -11.482 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -6.792 9.587 -10.334 1.00 0.00 H new ATOM 134 N LYS A 11 -4.839 9.399 -8.205 1.00 0.00 N ATOM 135 CA LYS A 11 -4.022 10.221 -7.323 1.00 0.00 C ATOM 136 C LYS A 11 -2.988 9.350 -6.632 1.00 0.00 C ATOM 137 O LYS A 11 -1.784 9.582 -6.737 1.00 0.00 O ATOM 138 CB LYS A 11 -4.892 10.909 -6.281 1.00 0.00 C ATOM 139 CG LYS A 11 -4.213 12.069 -5.617 1.00 0.00 C ATOM 140 CD LYS A 11 -4.820 13.309 -6.158 1.00 0.00 C ATOM 141 CE LYS A 11 -3.910 14.516 -6.004 1.00 0.00 C ATOM 142 NZ LYS A 11 -4.540 15.759 -6.528 1.00 0.00 N ATOM 0 H LYS A 11 -5.800 9.273 -7.887 1.00 0.00 H new ATOM 0 HA LYS A 11 -3.520 10.984 -7.917 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -5.810 11.257 -6.756 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -5.181 10.182 -5.522 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -4.340 12.020 -4.536 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -3.141 12.050 -5.813 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -5.053 13.166 -7.213 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -5.763 13.501 -5.647 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -3.662 14.651 -4.951 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -2.974 14.334 -6.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -3.886 16.558 -6.404 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -4.754 15.640 -7.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -5.421 15.948 -6.008 1.00 0.00 H new ATOM 156 N TYR A 12 -3.486 8.346 -5.915 1.00 0.00 N ATOM 157 CA TYR A 12 -2.639 7.395 -5.213 1.00 0.00 C ATOM 158 C TYR A 12 -1.566 6.882 -6.125 1.00 0.00 C ATOM 159 O TYR A 12 -0.388 6.972 -5.850 1.00 0.00 O ATOM 160 CB TYR A 12 -3.441 6.177 -4.784 1.00 0.00 C ATOM 161 CG TYR A 12 -2.717 5.340 -3.755 1.00 0.00 C ATOM 162 CD1 TYR A 12 -1.935 5.930 -2.764 1.00 0.00 C ATOM 163 CD2 TYR A 12 -2.803 3.960 -3.786 1.00 0.00 C ATOM 164 CE1 TYR A 12 -1.264 5.160 -1.834 1.00 0.00 C ATOM 165 CE2 TYR A 12 -2.136 3.187 -2.859 1.00 0.00 C ATOM 166 CZ TYR A 12 -1.367 3.789 -1.886 1.00 0.00 C ATOM 167 OH TYR A 12 -0.702 3.015 -0.963 1.00 0.00 O ATOM 0 H TYR A 12 -4.485 8.172 -5.806 1.00 0.00 H new ATOM 0 HA TYR A 12 -2.220 7.916 -4.352 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -4.398 6.502 -4.375 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -3.659 5.564 -5.658 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -1.852 7.006 -2.722 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -3.401 3.481 -4.547 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -0.662 5.631 -1.071 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -2.216 2.111 -2.895 1.00 0.00 H new ATOM 0 HH TYR A 12 0.248 3.257 -0.957 1.00 0.00 H new ATOM 177 N ASN A 13 -2.041 6.389 -7.238 1.00 0.00 N ATOM 178 CA ASN A 13 -1.243 5.783 -8.275 1.00 0.00 C ATOM 179 C ASN A 13 0.075 6.503 -8.467 1.00 0.00 C ATOM 180 O ASN A 13 1.142 5.904 -8.338 1.00 0.00 O ATOM 181 CB ASN A 13 -2.069 5.850 -9.551 1.00 0.00 C ATOM 182 CG ASN A 13 -3.288 4.935 -9.537 1.00 0.00 C ATOM 183 OD1 ASN A 13 -3.698 4.490 -8.352 1.00 0.00 O flip ATOM 184 ND2 ASN A 13 -3.851 4.622 -10.588 1.00 0.00 N flip ATOM 0 H ASN A 13 -3.037 6.398 -7.458 1.00 0.00 H new ATOM 0 HA ASN A 13 -0.996 4.756 -8.006 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -2.398 6.877 -9.708 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.436 5.585 -10.398 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -3.507 4.983 -11.478 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -4.660 4.002 -10.568 1.00 0.00 H new ATOM 191 N GLU A 14 0.009 7.779 -8.765 1.00 0.00 N ATOM 192 CA GLU A 14 1.221 8.556 -8.951 1.00 0.00 C ATOM 193 C GLU A 14 2.010 8.613 -7.634 1.00 0.00 C ATOM 194 O GLU A 14 3.241 8.528 -7.611 1.00 0.00 O ATOM 195 CB GLU A 14 0.845 9.965 -9.426 1.00 0.00 C ATOM 196 CG GLU A 14 0.515 10.926 -8.297 1.00 0.00 C ATOM 197 CD GLU A 14 1.710 11.749 -7.855 1.00 0.00 C ATOM 198 OE1 GLU A 14 2.006 12.766 -8.516 1.00 0.00 O ATOM 199 OE2 GLU A 14 2.350 11.376 -6.849 1.00 0.00 O ATOM 0 H GLU A 14 -0.859 8.301 -8.884 1.00 0.00 H new ATOM 0 HA GLU A 14 1.853 8.087 -9.705 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.670 10.374 -10.009 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -0.013 9.896 -10.094 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -0.283 11.596 -8.618 1.00 0.00 H new ATOM 0 HG3 GLU A 14 0.134 10.362 -7.446 1.00 0.00 H new ATOM 206 N ALA A 15 1.262 8.679 -6.541 1.00 0.00 N ATOM 207 CA ALA A 15 1.809 8.802 -5.196 1.00 0.00 C ATOM 208 C ALA A 15 2.432 7.524 -4.641 1.00 0.00 C ATOM 209 O ALA A 15 3.424 7.586 -3.917 1.00 0.00 O ATOM 210 CB ALA A 15 0.694 9.239 -4.265 1.00 0.00 C ATOM 0 H ALA A 15 0.243 8.648 -6.564 1.00 0.00 H new ATOM 0 HA ALA A 15 2.617 9.531 -5.259 1.00 0.00 H new ATOM 0 HB1 ALA A 15 1.083 9.337 -3.252 1.00 0.00 H new ATOM 0 HB2 ALA A 15 0.299 10.199 -4.596 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -0.103 8.495 -4.277 1.00 0.00 H new ATOM 216 N VAL A 16 1.860 6.373 -4.965 1.00 0.00 N ATOM 217 CA VAL A 16 2.352 5.131 -4.416 1.00 0.00 C ATOM 218 C VAL A 16 3.453 4.560 -5.237 1.00 0.00 C ATOM 219 O VAL A 16 4.458 4.084 -4.710 1.00 0.00 O ATOM 220 CB VAL A 16 1.236 4.091 -4.219 1.00 0.00 C ATOM 221 CG1 VAL A 16 0.221 4.175 -5.336 1.00 0.00 C ATOM 222 CG2 VAL A 16 1.815 2.686 -4.102 1.00 0.00 C ATOM 0 H VAL A 16 1.065 6.280 -5.598 1.00 0.00 H new ATOM 0 HA VAL A 16 2.751 5.376 -3.432 1.00 0.00 H new ATOM 0 HB VAL A 16 0.723 4.316 -3.284 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -0.559 3.430 -5.176 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -0.224 5.170 -5.349 1.00 0.00 H new ATOM 0 HG13 VAL A 16 0.713 3.985 -6.290 1.00 0.00 H new ATOM 0 HG21 VAL A 16 1.006 1.969 -3.963 1.00 0.00 H new ATOM 0 HG22 VAL A 16 2.364 2.442 -5.011 1.00 0.00 H new ATOM 0 HG23 VAL A 16 2.490 2.641 -3.247 1.00 0.00 H new ATOM 232 N ARG A 17 3.265 4.600 -6.523 1.00 0.00 N ATOM 233 CA ARG A 17 4.249 4.071 -7.404 1.00 0.00 C ATOM 234 C ARG A 17 5.582 4.700 -7.160 1.00 0.00 C ATOM 235 O ARG A 17 6.621 4.037 -7.202 1.00 0.00 O ATOM 236 CB ARG A 17 3.777 4.189 -8.841 1.00 0.00 C ATOM 237 CG ARG A 17 2.549 3.347 -9.123 1.00 0.00 C ATOM 238 CD ARG A 17 2.404 2.178 -8.154 1.00 0.00 C ATOM 239 NE ARG A 17 1.121 2.148 -7.527 1.00 0.00 N ATOM 240 CZ ARG A 17 0.817 1.282 -6.610 1.00 0.00 C ATOM 241 NH1 ARG A 17 1.571 0.221 -6.409 1.00 0.00 N ATOM 242 NH2 ARG A 17 -0.265 1.445 -5.922 1.00 0.00 N ATOM 0 H ARG A 17 2.441 4.993 -6.978 1.00 0.00 H new ATOM 0 HA ARG A 17 4.384 3.008 -7.203 1.00 0.00 H new ATOM 0 HB2 ARG A 17 3.555 5.233 -9.062 1.00 0.00 H new ATOM 0 HB3 ARG A 17 4.582 3.886 -9.510 1.00 0.00 H new ATOM 0 HG2 ARG A 17 1.661 3.976 -9.064 1.00 0.00 H new ATOM 0 HG3 ARG A 17 2.601 2.965 -10.142 1.00 0.00 H new ATOM 0 HD2 ARG A 17 2.566 1.243 -8.690 1.00 0.00 H new ATOM 0 HD3 ARG A 17 3.178 2.245 -7.389 1.00 0.00 H new ATOM 0 HE ARG A 17 0.419 2.832 -7.810 1.00 0.00 H new ATOM 0 HH11 ARG A 17 2.405 0.073 -6.977 1.00 0.00 H new ATOM 0 HH12 ARG A 17 1.321 -0.452 -5.685 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -0.868 2.247 -6.103 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -0.515 0.771 -5.198 1.00 0.00 H new ATOM 256 N VAL A 18 5.566 5.957 -6.842 1.00 0.00 N ATOM 257 CA VAL A 18 6.797 6.616 -6.574 1.00 0.00 C ATOM 258 C VAL A 18 7.310 6.223 -5.196 1.00 0.00 C ATOM 259 O VAL A 18 8.462 5.862 -5.054 1.00 0.00 O ATOM 260 CB VAL A 18 6.628 8.139 -6.664 1.00 0.00 C ATOM 261 CG1 VAL A 18 6.071 8.509 -8.029 1.00 0.00 C ATOM 262 CG2 VAL A 18 5.718 8.643 -5.550 1.00 0.00 C ATOM 0 H VAL A 18 4.729 6.535 -6.764 1.00 0.00 H new ATOM 0 HA VAL A 18 7.525 6.308 -7.324 1.00 0.00 H new ATOM 0 HB VAL A 18 7.601 8.615 -6.540 1.00 0.00 H new ATOM 0 HG11 VAL A 18 5.951 9.591 -8.092 1.00 0.00 H new ATOM 0 HG12 VAL A 18 6.759 8.174 -8.806 1.00 0.00 H new ATOM 0 HG13 VAL A 18 5.103 8.028 -8.170 1.00 0.00 H new ATOM 0 HG21 VAL A 18 5.610 9.725 -5.630 1.00 0.00 H new ATOM 0 HG22 VAL A 18 4.739 8.173 -5.639 1.00 0.00 H new ATOM 0 HG23 VAL A 18 6.154 8.392 -4.583 1.00 0.00 H new ATOM 272 N PHE A 19 6.414 6.160 -4.215 1.00 0.00 N ATOM 273 CA PHE A 19 6.815 5.896 -2.838 1.00 0.00 C ATOM 274 C PHE A 19 7.396 4.495 -2.616 1.00 0.00 C ATOM 275 O PHE A 19 8.432 4.340 -1.944 1.00 0.00 O ATOM 276 CB PHE A 19 5.642 6.253 -1.875 1.00 0.00 C ATOM 277 CG PHE A 19 4.630 5.180 -1.498 1.00 0.00 C ATOM 278 CD1 PHE A 19 4.995 3.889 -1.170 1.00 0.00 C ATOM 279 CD2 PHE A 19 3.287 5.504 -1.451 1.00 0.00 C ATOM 280 CE1 PHE A 19 4.049 2.945 -0.825 1.00 0.00 C ATOM 281 CE2 PHE A 19 2.334 4.565 -1.107 1.00 0.00 C ATOM 282 CZ PHE A 19 2.717 3.282 -0.800 1.00 0.00 C ATOM 0 H PHE A 19 5.411 6.288 -4.347 1.00 0.00 H new ATOM 0 HA PHE A 19 7.655 6.549 -2.602 1.00 0.00 H new ATOM 0 HB2 PHE A 19 6.081 6.628 -0.950 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.091 7.079 -2.324 1.00 0.00 H new ATOM 0 HD1 PHE A 19 6.039 3.613 -1.184 1.00 0.00 H new ATOM 0 HD2 PHE A 19 2.977 6.511 -1.688 1.00 0.00 H new ATOM 0 HE1 PHE A 19 4.356 1.940 -0.574 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.290 4.839 -1.079 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.975 2.542 -0.540 1.00 0.00 H new ATOM 292 N THR A 20 6.801 3.473 -3.211 1.00 0.00 N ATOM 293 CA THR A 20 7.286 2.130 -2.959 1.00 0.00 C ATOM 294 C THR A 20 8.559 1.834 -3.728 1.00 0.00 C ATOM 295 O THR A 20 9.551 1.418 -3.128 1.00 0.00 O ATOM 296 CB THR A 20 6.227 1.067 -3.243 1.00 0.00 C ATOM 297 OG1 THR A 20 5.295 1.014 -2.175 1.00 0.00 O ATOM 298 CG2 THR A 20 6.859 -0.289 -3.446 1.00 0.00 C ATOM 0 H THR A 20 6.009 3.543 -3.850 1.00 0.00 H new ATOM 0 HA THR A 20 7.517 2.087 -1.895 1.00 0.00 H new ATOM 0 HB THR A 20 5.708 1.340 -4.161 1.00 0.00 H new ATOM 0 HG1 THR A 20 4.908 1.903 -2.034 1.00 0.00 H new ATOM 0 HG21 THR A 20 6.082 -1.026 -3.646 1.00 0.00 H new ATOM 0 HG22 THR A 20 7.546 -0.247 -4.291 1.00 0.00 H new ATOM 0 HG23 THR A 20 7.406 -0.574 -2.547 1.00 0.00 H new ATOM 306 N GLN A 21 8.559 2.037 -5.042 1.00 0.00 N ATOM 307 CA GLN A 21 9.774 1.774 -5.784 1.00 0.00 C ATOM 308 C GLN A 21 10.839 2.762 -5.352 1.00 0.00 C ATOM 309 O GLN A 21 12.009 2.594 -5.665 1.00 0.00 O ATOM 310 CB GLN A 21 9.554 1.795 -7.295 1.00 0.00 C ATOM 311 CG GLN A 21 9.132 0.438 -7.866 1.00 0.00 C ATOM 312 CD GLN A 21 9.815 -0.733 -7.204 1.00 0.00 C ATOM 313 OE1 GLN A 21 9.202 -1.222 -6.129 1.00 0.00 O flip ATOM 314 NE2 GLN A 21 10.871 -1.189 -7.640 1.00 0.00 N flip ATOM 0 H GLN A 21 7.765 2.368 -5.591 1.00 0.00 H new ATOM 0 HA GLN A 21 10.109 0.762 -5.555 1.00 0.00 H new ATOM 0 HB2 GLN A 21 8.790 2.535 -7.533 1.00 0.00 H new ATOM 0 HB3 GLN A 21 10.473 2.117 -7.784 1.00 0.00 H new ATOM 0 HG2 GLN A 21 8.053 0.327 -7.758 1.00 0.00 H new ATOM 0 HG3 GLN A 21 9.349 0.419 -8.934 1.00 0.00 H new ATOM 0 HE21 GLN A 21 11.301 -0.778 -8.469 1.00 0.00 H new ATOM 0 HE22 GLN A 21 11.317 -1.979 -7.173 1.00 0.00 H new ATOM 323 N LEU A 22 10.433 3.807 -4.628 1.00 0.00 N ATOM 324 CA LEU A 22 11.405 4.751 -4.112 1.00 0.00 C ATOM 325 C LEU A 22 12.365 3.971 -3.248 1.00 0.00 C ATOM 326 O LEU A 22 13.580 4.148 -3.325 1.00 0.00 O ATOM 327 CB LEU A 22 10.757 5.865 -3.271 1.00 0.00 C ATOM 328 CG LEU A 22 10.440 7.194 -3.988 1.00 0.00 C ATOM 329 CD1 LEU A 22 11.101 8.347 -3.262 1.00 0.00 C ATOM 330 CD2 LEU A 22 10.857 7.183 -5.459 1.00 0.00 C ATOM 0 H LEU A 22 9.461 4.012 -4.394 1.00 0.00 H new ATOM 0 HA LEU A 22 11.904 5.238 -4.949 1.00 0.00 H new ATOM 0 HB2 LEU A 22 9.828 5.476 -2.853 1.00 0.00 H new ATOM 0 HB3 LEU A 22 11.418 6.083 -2.432 1.00 0.00 H new ATOM 0 HG LEU A 22 9.358 7.321 -3.967 1.00 0.00 H new ATOM 0 HD11 LEU A 22 10.871 9.280 -3.776 1.00 0.00 H new ATOM 0 HD12 LEU A 22 10.728 8.395 -2.239 1.00 0.00 H new ATOM 0 HD13 LEU A 22 12.181 8.197 -3.248 1.00 0.00 H new ATOM 0 HD21 LEU A 22 10.611 8.142 -5.914 1.00 0.00 H new ATOM 0 HD22 LEU A 22 11.931 7.012 -5.531 1.00 0.00 H new ATOM 0 HD23 LEU A 22 10.327 6.387 -5.982 1.00 0.00 H new ATOM 342 N SER A 23 11.801 3.087 -2.427 1.00 0.00 N ATOM 343 CA SER A 23 12.619 2.248 -1.558 1.00 0.00 C ATOM 344 C SER A 23 13.366 1.166 -2.354 1.00 0.00 C ATOM 345 O SER A 23 14.573 0.991 -2.184 1.00 0.00 O ATOM 346 CB SER A 23 11.769 1.615 -0.451 1.00 0.00 C ATOM 347 OG SER A 23 11.488 2.556 0.569 1.00 0.00 O ATOM 0 H SER A 23 10.796 2.935 -2.346 1.00 0.00 H new ATOM 0 HA SER A 23 13.366 2.891 -1.093 1.00 0.00 H new ATOM 0 HB2 SER A 23 10.836 1.240 -0.872 1.00 0.00 H new ATOM 0 HB3 SER A 23 12.295 0.759 -0.027 1.00 0.00 H new ATOM 0 HG SER A 23 10.522 2.716 0.610 1.00 0.00 H new ATOM 353 N SER A 24 12.656 0.441 -3.221 1.00 0.00 N ATOM 354 CA SER A 24 13.285 -0.617 -4.017 1.00 0.00 C ATOM 355 C SER A 24 14.306 -0.063 -4.992 1.00 0.00 C ATOM 356 O SER A 24 15.479 -0.433 -4.947 1.00 0.00 O ATOM 357 CB SER A 24 12.241 -1.413 -4.788 1.00 0.00 C ATOM 358 OG SER A 24 12.842 -2.186 -5.811 1.00 0.00 O ATOM 0 H SER A 24 11.658 0.564 -3.389 1.00 0.00 H new ATOM 0 HA SER A 24 13.798 -1.272 -3.313 1.00 0.00 H new ATOM 0 HB2 SER A 24 11.700 -2.067 -4.104 1.00 0.00 H new ATOM 0 HB3 SER A 24 11.510 -0.733 -5.224 1.00 0.00 H new ATOM 0 HG SER A 24 13.813 -2.056 -5.792 1.00 0.00 H new ATOM 364 N ALA A 25 13.849 0.808 -5.883 1.00 0.00 N ATOM 365 CA ALA A 25 14.724 1.417 -6.867 1.00 0.00 C ATOM 366 C ALA A 25 15.964 1.943 -6.170 1.00 0.00 C ATOM 367 O ALA A 25 17.061 1.927 -6.722 1.00 0.00 O ATOM 368 CB ALA A 25 13.998 2.542 -7.606 1.00 0.00 C ATOM 0 H ALA A 25 12.875 1.106 -5.941 1.00 0.00 H new ATOM 0 HA ALA A 25 15.017 0.670 -7.605 1.00 0.00 H new ATOM 0 HB1 ALA A 25 14.669 2.988 -8.340 1.00 0.00 H new ATOM 0 HB2 ALA A 25 13.122 2.138 -8.113 1.00 0.00 H new ATOM 0 HB3 ALA A 25 13.685 3.303 -6.892 1.00 0.00 H new ATOM 374 N ALA A 26 15.773 2.372 -4.928 1.00 0.00 N ATOM 375 CA ALA A 26 16.861 2.905 -4.123 1.00 0.00 C ATOM 376 C ALA A 26 17.948 1.867 -3.866 1.00 0.00 C ATOM 377 O ALA A 26 19.133 2.198 -3.905 1.00 0.00 O ATOM 378 CB ALA A 26 16.336 3.454 -2.803 1.00 0.00 C ATOM 0 H ALA A 26 14.869 2.360 -4.456 1.00 0.00 H new ATOM 0 HA ALA A 26 17.311 3.718 -4.693 1.00 0.00 H new ATOM 0 HB1 ALA A 26 17.166 3.848 -2.217 1.00 0.00 H new ATOM 0 HB2 ALA A 26 15.620 4.252 -3.000 1.00 0.00 H new ATOM 0 HB3 ALA A 26 15.845 2.656 -2.246 1.00 0.00 H new ATOM 384 N ASN A 27 17.566 0.613 -3.605 1.00 0.00 N ATOM 385 CA ASN A 27 18.577 -0.410 -3.336 1.00 0.00 C ATOM 386 C ASN A 27 18.087 -1.857 -3.478 1.00 0.00 C ATOM 387 O ASN A 27 18.837 -2.706 -3.959 1.00 0.00 O ATOM 388 CB ASN A 27 19.156 -0.208 -1.933 1.00 0.00 C ATOM 389 CG ASN A 27 18.123 0.252 -0.915 1.00 0.00 C ATOM 390 OD1 ASN A 27 16.850 -0.024 -1.177 1.00 0.00 O flip ATOM 391 ND2 ASN A 27 18.469 0.862 0.096 1.00 0.00 N flip ATOM 0 H ASN A 27 16.599 0.290 -3.575 1.00 0.00 H new ATOM 0 HA ASN A 27 19.337 -0.275 -4.105 1.00 0.00 H new ATOM 0 HB2 ASN A 27 19.599 -1.144 -1.593 1.00 0.00 H new ATOM 0 HB3 ASN A 27 19.960 0.527 -1.982 1.00 0.00 H new ATOM 0 HD21 ASN A 27 19.457 1.055 0.262 1.00 0.00 H new ATOM 0 HD22 ASN A 27 17.768 1.175 0.768 1.00 0.00 H new ATOM 398 N CYS A 28 16.849 -2.154 -3.079 1.00 0.00 N ATOM 399 CA CYS A 28 16.361 -3.534 -3.140 1.00 0.00 C ATOM 400 C CYS A 28 14.885 -3.641 -2.774 1.00 0.00 C ATOM 401 O CYS A 28 14.313 -2.724 -2.215 1.00 0.00 O ATOM 402 CB CYS A 28 17.191 -4.390 -2.176 1.00 0.00 C ATOM 403 SG CYS A 28 16.281 -5.722 -1.335 1.00 0.00 S ATOM 0 H CYS A 28 16.179 -1.475 -2.718 1.00 0.00 H new ATOM 0 HA CYS A 28 16.467 -3.887 -4.166 1.00 0.00 H new ATOM 0 HB2 CYS A 28 18.019 -4.832 -2.730 1.00 0.00 H new ATOM 0 HB3 CYS A 28 17.627 -3.737 -1.420 1.00 0.00 H new ATOM 408 N ASP A 29 14.281 -4.778 -3.103 1.00 0.00 N ATOM 409 CA ASP A 29 12.877 -5.040 -2.786 1.00 0.00 C ATOM 410 C ASP A 29 12.769 -6.152 -1.761 1.00 0.00 C ATOM 411 O ASP A 29 13.661 -6.993 -1.661 1.00 0.00 O ATOM 412 CB ASP A 29 12.135 -5.494 -4.034 1.00 0.00 C ATOM 413 CG ASP A 29 10.653 -5.256 -3.968 1.00 0.00 C ATOM 414 OD1 ASP A 29 9.971 -5.988 -3.228 1.00 0.00 O ATOM 415 OD2 ASP A 29 10.171 -4.356 -4.679 1.00 0.00 O ATOM 0 H ASP A 29 14.746 -5.542 -3.594 1.00 0.00 H new ATOM 0 HA ASP A 29 12.444 -4.119 -2.396 1.00 0.00 H new ATOM 0 HB2 ASP A 29 12.541 -4.971 -4.900 1.00 0.00 H new ATOM 0 HB3 ASP A 29 12.318 -6.557 -4.190 1.00 0.00 H new ATOM 420 N TRP A 30 11.680 -6.173 -1.001 1.00 0.00 N ATOM 421 CA TRP A 30 11.502 -7.250 -0.041 1.00 0.00 C ATOM 422 C TRP A 30 11.072 -8.493 -0.810 1.00 0.00 C ATOM 423 O TRP A 30 11.552 -9.593 -0.545 1.00 0.00 O ATOM 424 CB TRP A 30 10.501 -6.908 1.088 1.00 0.00 C ATOM 425 CG TRP A 30 9.170 -6.420 0.650 1.00 0.00 C ATOM 426 CD1 TRP A 30 8.222 -7.050 -0.103 1.00 0.00 C ATOM 427 CD2 TRP A 30 8.635 -5.163 1.008 1.00 0.00 C ATOM 428 NE1 TRP A 30 7.143 -6.215 -0.272 1.00 0.00 N ATOM 429 CE2 TRP A 30 7.385 -5.048 0.408 1.00 0.00 C ATOM 430 CE3 TRP A 30 9.123 -4.111 1.773 1.00 0.00 C ATOM 431 CZ2 TRP A 30 6.614 -3.909 0.550 1.00 0.00 C ATOM 432 CZ3 TRP A 30 8.361 -2.986 1.920 1.00 0.00 C ATOM 433 CH2 TRP A 30 7.120 -2.886 1.309 1.00 0.00 C ATOM 0 H TRP A 30 10.931 -5.481 -1.029 1.00 0.00 H new ATOM 0 HA TRP A 30 12.449 -7.422 0.470 1.00 0.00 H new ATOM 0 HB2 TRP A 30 10.356 -7.798 1.700 1.00 0.00 H new ATOM 0 HB3 TRP A 30 10.951 -6.150 1.729 1.00 0.00 H new ATOM 0 HD1 TRP A 30 8.306 -8.049 -0.504 1.00 0.00 H new ATOM 0 HE1 TRP A 30 6.304 -6.427 -0.812 1.00 0.00 H new ATOM 0 HE3 TRP A 30 10.092 -4.181 2.245 1.00 0.00 H new ATOM 0 HZ2 TRP A 30 5.646 -3.828 0.079 1.00 0.00 H new ATOM 0 HZ3 TRP A 30 8.729 -2.166 2.519 1.00 0.00 H new ATOM 0 HH2 TRP A 30 6.540 -1.983 1.434 1.00 0.00 H new ATOM 444 N ALA A 31 10.222 -8.261 -1.824 1.00 0.00 N ATOM 445 CA ALA A 31 9.681 -9.306 -2.704 1.00 0.00 C ATOM 446 C ALA A 31 8.857 -10.361 -1.954 1.00 0.00 C ATOM 447 O ALA A 31 7.769 -10.742 -2.386 1.00 0.00 O ATOM 448 CB ALA A 31 10.821 -9.955 -3.469 1.00 0.00 C ATOM 0 H ALA A 31 9.887 -7.326 -2.058 1.00 0.00 H new ATOM 0 HA ALA A 31 8.990 -8.827 -3.397 1.00 0.00 H new ATOM 0 HB1 ALA A 31 10.425 -10.731 -4.123 1.00 0.00 H new ATOM 0 HB2 ALA A 31 11.333 -9.202 -4.068 1.00 0.00 H new ATOM 0 HB3 ALA A 31 11.525 -10.399 -2.765 1.00 0.00 H new ATOM 454 N ALA A 32 9.376 -10.836 -0.842 1.00 0.00 N ATOM 455 CA ALA A 32 8.696 -11.849 -0.048 1.00 0.00 C ATOM 456 C ALA A 32 7.420 -11.307 0.587 1.00 0.00 C ATOM 457 O ALA A 32 6.388 -11.983 0.608 1.00 0.00 O ATOM 458 CB ALA A 32 9.629 -12.389 1.025 1.00 0.00 C ATOM 0 H ALA A 32 10.274 -10.537 -0.461 1.00 0.00 H new ATOM 0 HA ALA A 32 8.412 -12.660 -0.719 1.00 0.00 H new ATOM 0 HB1 ALA A 32 9.109 -13.146 1.612 1.00 0.00 H new ATOM 0 HB2 ALA A 32 10.506 -12.834 0.554 1.00 0.00 H new ATOM 0 HB3 ALA A 32 9.942 -11.575 1.678 1.00 0.00 H new ATOM 464 N CYS A 33 7.484 -10.080 1.097 1.00 0.00 N ATOM 465 CA CYS A 33 6.330 -9.478 1.750 1.00 0.00 C ATOM 466 C CYS A 33 5.199 -9.199 0.782 1.00 0.00 C ATOM 467 O CYS A 33 4.054 -9.508 1.067 1.00 0.00 O ATOM 468 CB CYS A 33 6.704 -8.194 2.473 1.00 0.00 C ATOM 469 SG CYS A 33 6.108 -8.142 4.201 1.00 0.00 S ATOM 0 H CYS A 33 8.315 -9.489 1.070 1.00 0.00 H new ATOM 0 HA CYS A 33 5.983 -10.211 2.479 1.00 0.00 H new ATOM 0 HB2 CYS A 33 7.788 -8.083 2.466 1.00 0.00 H new ATOM 0 HB3 CYS A 33 6.293 -7.344 1.928 1.00 0.00 H new ATOM 474 N LEU A 34 5.495 -8.606 -0.357 1.00 0.00 N ATOM 475 CA LEU A 34 4.434 -8.315 -1.301 1.00 0.00 C ATOM 476 C LEU A 34 3.628 -9.571 -1.583 1.00 0.00 C ATOM 477 O LEU A 34 2.401 -9.532 -1.624 1.00 0.00 O ATOM 478 CB LEU A 34 4.977 -7.681 -2.573 1.00 0.00 C ATOM 479 CG LEU A 34 6.362 -8.158 -2.981 1.00 0.00 C ATOM 480 CD1 LEU A 34 6.250 -9.227 -4.054 1.00 0.00 C ATOM 481 CD2 LEU A 34 7.203 -6.988 -3.457 1.00 0.00 C ATOM 0 H LEU A 34 6.431 -8.323 -0.646 1.00 0.00 H new ATOM 0 HA LEU A 34 3.763 -7.580 -0.856 1.00 0.00 H new ATOM 0 HB2 LEU A 34 4.283 -7.884 -3.389 1.00 0.00 H new ATOM 0 HB3 LEU A 34 5.005 -6.599 -2.440 1.00 0.00 H new ATOM 0 HG LEU A 34 6.858 -8.597 -2.115 1.00 0.00 H new ATOM 0 HD11 LEU A 34 7.247 -9.562 -4.339 1.00 0.00 H new ATOM 0 HD12 LEU A 34 5.680 -10.072 -3.668 1.00 0.00 H new ATOM 0 HD13 LEU A 34 5.742 -8.815 -4.926 1.00 0.00 H new ATOM 0 HD21 LEU A 34 8.192 -7.344 -3.746 1.00 0.00 H new ATOM 0 HD22 LEU A 34 6.721 -6.519 -4.315 1.00 0.00 H new ATOM 0 HD23 LEU A 34 7.301 -6.259 -2.653 1.00 0.00 H new ATOM 493 N SER A 35 4.310 -10.695 -1.748 1.00 0.00 N ATOM 494 CA SER A 35 3.616 -11.954 -1.965 1.00 0.00 C ATOM 495 C SER A 35 2.607 -12.162 -0.841 1.00 0.00 C ATOM 496 O SER A 35 1.517 -12.690 -1.047 1.00 0.00 O ATOM 497 CB SER A 35 4.612 -13.109 -1.982 1.00 0.00 C ATOM 498 OG SER A 35 3.963 -14.342 -2.241 1.00 0.00 O ATOM 0 H SER A 35 5.328 -10.761 -1.736 1.00 0.00 H new ATOM 0 HA SER A 35 3.102 -11.924 -2.926 1.00 0.00 H new ATOM 0 HB2 SER A 35 5.370 -12.927 -2.743 1.00 0.00 H new ATOM 0 HB3 SER A 35 5.129 -13.161 -1.024 1.00 0.00 H new ATOM 0 HG SER A 35 4.625 -15.065 -2.248 1.00 0.00 H new ATOM 504 N SER A 36 3.007 -11.727 0.350 1.00 0.00 N ATOM 505 CA SER A 36 2.185 -11.829 1.563 1.00 0.00 C ATOM 506 C SER A 36 0.768 -11.258 1.369 1.00 0.00 C ATOM 507 O SER A 36 -0.215 -11.899 1.742 1.00 0.00 O ATOM 508 CB SER A 36 2.884 -11.115 2.726 1.00 0.00 C ATOM 509 OG SER A 36 2.547 -11.704 3.969 1.00 0.00 O ATOM 0 H SER A 36 3.915 -11.290 0.507 1.00 0.00 H new ATOM 0 HA SER A 36 2.073 -12.889 1.789 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.964 -11.155 2.583 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.602 -10.062 2.732 1.00 0.00 H new ATOM 0 HG SER A 36 3.008 -11.229 4.692 1.00 0.00 H new ATOM 515 N LEU A 37 0.655 -10.053 0.801 1.00 0.00 N ATOM 516 CA LEU A 37 -0.674 -9.455 0.577 1.00 0.00 C ATOM 517 C LEU A 37 -1.431 -10.339 -0.378 1.00 0.00 C ATOM 518 O LEU A 37 -2.565 -10.740 -0.126 1.00 0.00 O ATOM 519 CB LEU A 37 -0.605 -8.037 -0.004 1.00 0.00 C ATOM 520 CG LEU A 37 -1.873 -7.574 -0.723 1.00 0.00 C ATOM 521 CD1 LEU A 37 -3.007 -7.378 0.261 1.00 0.00 C ATOM 522 CD2 LEU A 37 -1.621 -6.311 -1.505 1.00 0.00 C ATOM 0 H LEU A 37 1.442 -9.482 0.494 1.00 0.00 H new ATOM 0 HA LEU A 37 -1.172 -9.378 1.544 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -0.388 -7.339 0.804 1.00 0.00 H new ATOM 0 HB3 LEU A 37 0.230 -7.986 -0.702 1.00 0.00 H new ATOM 0 HG LEU A 37 -2.163 -8.354 -1.428 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -3.899 -7.049 -0.272 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.215 -8.320 0.769 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -2.725 -6.624 0.996 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.539 -6.004 -2.006 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.297 -5.522 -0.827 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -0.845 -6.492 -2.249 1.00 0.00 H new ATOM 534 N SER A 38 -0.774 -10.628 -1.489 1.00 0.00 N ATOM 535 CA SER A 38 -1.330 -11.488 -2.509 1.00 0.00 C ATOM 536 C SER A 38 -1.459 -12.915 -1.973 1.00 0.00 C ATOM 537 O SER A 38 -1.905 -13.823 -2.675 1.00 0.00 O ATOM 538 CB SER A 38 -0.432 -11.446 -3.748 1.00 0.00 C ATOM 539 OG SER A 38 0.040 -12.737 -4.088 1.00 0.00 O ATOM 0 H SER A 38 0.157 -10.272 -1.705 1.00 0.00 H new ATOM 0 HA SER A 38 -2.325 -11.140 -2.786 1.00 0.00 H new ATOM 0 HB2 SER A 38 -0.987 -11.027 -4.587 1.00 0.00 H new ATOM 0 HB3 SER A 38 0.414 -10.784 -3.564 1.00 0.00 H new ATOM 0 HG SER A 38 0.731 -12.661 -4.779 1.00 0.00 H new ATOM 545 N ALA A 39 -1.065 -13.088 -0.713 1.00 0.00 N ATOM 546 CA ALA A 39 -1.124 -14.382 -0.043 1.00 0.00 C ATOM 547 C ALA A 39 -2.302 -14.433 0.925 1.00 0.00 C ATOM 548 O ALA A 39 -2.648 -15.501 1.428 1.00 0.00 O ATOM 549 CB ALA A 39 0.181 -14.662 0.689 1.00 0.00 C ATOM 0 H ALA A 39 -0.697 -12.336 -0.130 1.00 0.00 H new ATOM 0 HA ALA A 39 -1.269 -15.154 -0.799 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.120 -15.631 1.184 1.00 0.00 H new ATOM 0 HB2 ALA A 39 1.004 -14.670 -0.025 1.00 0.00 H new ATOM 0 HB3 ALA A 39 0.354 -13.885 1.434 1.00 0.00 H new ATOM 555 N SER A 40 -2.882 -13.253 1.188 1.00 0.00 N ATOM 556 CA SER A 40 -4.054 -13.093 2.065 1.00 0.00 C ATOM 557 C SER A 40 -3.686 -12.798 3.513 1.00 0.00 C ATOM 558 O SER A 40 -2.891 -13.505 4.131 1.00 0.00 O ATOM 559 CB SER A 40 -4.975 -14.318 2.013 1.00 0.00 C ATOM 560 OG SER A 40 -4.598 -15.284 2.980 1.00 0.00 O ATOM 0 H SER A 40 -2.548 -12.373 0.794 1.00 0.00 H new ATOM 0 HA SER A 40 -4.585 -12.225 1.674 1.00 0.00 H new ATOM 0 HB2 SER A 40 -6.006 -14.009 2.186 1.00 0.00 H new ATOM 0 HB3 SER A 40 -4.938 -14.762 1.018 1.00 0.00 H new ATOM 0 HG SER A 40 -3.682 -15.585 2.802 1.00 0.00 H new ATOM 566 N SER A 41 -4.286 -11.729 4.037 1.00 0.00 N ATOM 567 CA SER A 41 -4.094 -11.326 5.423 1.00 0.00 C ATOM 568 C SER A 41 -5.455 -11.198 6.081 1.00 0.00 C ATOM 569 O SER A 41 -6.398 -10.694 5.477 1.00 0.00 O ATOM 570 CB SER A 41 -3.359 -9.990 5.538 1.00 0.00 C ATOM 571 OG SER A 41 -2.552 -9.951 6.704 1.00 0.00 O ATOM 0 H SER A 41 -4.916 -11.123 3.512 1.00 0.00 H new ATOM 0 HA SER A 41 -3.484 -12.084 5.916 1.00 0.00 H new ATOM 0 HB2 SER A 41 -2.737 -9.836 4.656 1.00 0.00 H new ATOM 0 HB3 SER A 41 -4.082 -9.175 5.565 1.00 0.00 H new ATOM 0 HG SER A 41 -2.091 -9.088 6.754 1.00 0.00 H new ATOM 577 N ALA A 42 -5.545 -11.643 7.319 1.00 0.00 N ATOM 578 CA ALA A 42 -6.799 -11.584 8.067 1.00 0.00 C ATOM 579 C ALA A 42 -7.294 -10.151 8.190 1.00 0.00 C ATOM 580 O ALA A 42 -8.418 -9.901 8.632 1.00 0.00 O ATOM 581 CB ALA A 42 -6.612 -12.194 9.445 1.00 0.00 C ATOM 0 H ALA A 42 -4.766 -12.052 7.835 1.00 0.00 H new ATOM 0 HA ALA A 42 -7.550 -12.156 7.522 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -7.552 -12.145 9.995 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -6.304 -13.235 9.343 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -5.845 -11.640 9.987 1.00 0.00 H new ATOM 587 N ALA A 43 -6.450 -9.216 7.785 1.00 0.00 N ATOM 588 CA ALA A 43 -6.764 -7.803 7.877 1.00 0.00 C ATOM 589 C ALA A 43 -7.523 -7.281 6.671 1.00 0.00 C ATOM 590 O ALA A 43 -8.646 -6.815 6.811 1.00 0.00 O ATOM 591 CB ALA A 43 -5.480 -7.012 8.080 1.00 0.00 C ATOM 0 H ALA A 43 -5.533 -9.415 7.385 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.426 -7.673 8.733 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.714 -5.950 8.149 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -4.994 -7.337 9.000 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.811 -7.182 7.236 1.00 0.00 H new ATOM 597 N CYS A 44 -6.918 -7.363 5.496 1.00 0.00 N ATOM 598 CA CYS A 44 -7.543 -6.863 4.276 1.00 0.00 C ATOM 599 C CYS A 44 -9.032 -7.192 4.209 1.00 0.00 C ATOM 600 O CYS A 44 -9.824 -6.422 3.663 1.00 0.00 O ATOM 601 CB CYS A 44 -6.809 -7.392 3.050 1.00 0.00 C ATOM 602 SG CYS A 44 -5.676 -8.780 3.392 1.00 0.00 S ATOM 0 H CYS A 44 -5.993 -7.771 5.359 1.00 0.00 H new ATOM 0 HA CYS A 44 -7.464 -5.776 4.291 1.00 0.00 H new ATOM 0 HB2 CYS A 44 -7.544 -7.712 2.311 1.00 0.00 H new ATOM 0 HB3 CYS A 44 -6.241 -6.577 2.602 1.00 0.00 H new ATOM 607 N ILE A 45 -9.410 -8.329 4.761 1.00 0.00 N ATOM 608 CA ILE A 45 -10.805 -8.733 4.766 1.00 0.00 C ATOM 609 C ILE A 45 -11.554 -8.090 5.931 1.00 0.00 C ATOM 610 O ILE A 45 -12.643 -7.492 5.767 1.00 0.00 O ATOM 611 CB ILE A 45 -10.962 -10.263 4.809 1.00 0.00 C ATOM 612 CG1 ILE A 45 -9.676 -10.947 4.340 1.00 0.00 C ATOM 613 CG2 ILE A 45 -12.132 -10.692 3.935 1.00 0.00 C ATOM 614 CD1 ILE A 45 -9.005 -11.773 5.415 1.00 0.00 C ATOM 0 H ILE A 45 -8.774 -8.988 5.210 1.00 0.00 H new ATOM 0 HA ILE A 45 -11.242 -8.383 3.831 1.00 0.00 H new ATOM 0 HB ILE A 45 -11.159 -10.564 5.838 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -9.905 -11.589 3.489 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -8.978 -10.188 3.988 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -12.235 -11.776 3.972 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -13.048 -10.228 4.300 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -11.952 -10.379 2.906 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -8.100 -12.228 5.012 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -8.745 -11.132 6.257 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -9.686 -12.555 5.751 1.00 0.00 H new ATOM 626 N ALA A 46 -10.948 -8.168 7.113 1.00 0.00 N ATOM 627 CA ALA A 46 -11.568 -7.565 8.289 1.00 0.00 C ATOM 628 C ALA A 46 -11.747 -6.096 7.971 1.00 0.00 C ATOM 629 O ALA A 46 -12.580 -5.369 8.531 1.00 0.00 O ATOM 630 CB ALA A 46 -10.709 -7.770 9.528 1.00 0.00 C ATOM 0 H ALA A 46 -10.054 -8.629 7.281 1.00 0.00 H new ATOM 0 HA ALA A 46 -12.528 -8.031 8.511 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -11.196 -7.310 10.388 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -10.582 -8.837 9.710 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -9.733 -7.309 9.374 1.00 0.00 H new ATOM 636 N ALA A 47 -10.947 -5.702 7.006 1.00 0.00 N ATOM 637 CA ALA A 47 -10.920 -4.368 6.493 1.00 0.00 C ATOM 638 C ALA A 47 -12.191 -4.082 5.727 1.00 0.00 C ATOM 639 O ALA A 47 -12.816 -3.040 5.914 1.00 0.00 O ATOM 640 CB ALA A 47 -9.726 -4.227 5.582 1.00 0.00 C ATOM 0 H ALA A 47 -10.281 -6.326 6.549 1.00 0.00 H new ATOM 0 HA ALA A 47 -10.845 -3.657 7.315 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -9.691 -3.214 5.182 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -8.814 -4.427 6.144 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -9.809 -4.939 4.761 1.00 0.00 H new ATOM 646 N VAL A 48 -12.587 -5.040 4.889 1.00 0.00 N ATOM 647 CA VAL A 48 -13.782 -4.895 4.070 1.00 0.00 C ATOM 648 C VAL A 48 -14.876 -4.237 4.862 1.00 0.00 C ATOM 649 O VAL A 48 -15.623 -3.401 4.352 1.00 0.00 O ATOM 650 CB VAL A 48 -14.304 -6.266 3.583 1.00 0.00 C ATOM 651 CG1 VAL A 48 -15.560 -6.111 2.745 1.00 0.00 C ATOM 652 CG2 VAL A 48 -13.241 -7.010 2.805 1.00 0.00 C ATOM 0 H VAL A 48 -12.095 -5.924 4.762 1.00 0.00 H new ATOM 0 HA VAL A 48 -13.509 -4.285 3.209 1.00 0.00 H new ATOM 0 HB VAL A 48 -14.555 -6.852 4.468 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -15.902 -7.093 2.418 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -16.339 -5.635 3.341 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -15.342 -5.494 1.874 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -13.637 -7.971 2.475 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -12.947 -6.421 1.936 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -12.372 -7.175 3.442 1.00 0.00 H new ATOM 662 N GLY A 49 -14.963 -4.621 6.109 1.00 0.00 N ATOM 663 CA GLY A 49 -15.994 -4.058 6.964 1.00 0.00 C ATOM 664 C GLY A 49 -15.640 -2.766 7.694 1.00 0.00 C ATOM 665 O GLY A 49 -16.538 -2.008 8.051 1.00 0.00 O ATOM 0 H GLY A 49 -14.351 -5.305 6.554 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -16.880 -3.875 6.356 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -16.267 -4.807 7.708 1.00 0.00 H new ATOM 669 N GLU A 50 -14.361 -2.475 7.894 1.00 0.00 N ATOM 670 CA GLU A 50 -13.992 -1.309 8.708 1.00 0.00 C ATOM 671 C GLU A 50 -13.594 0.013 7.999 1.00 0.00 C ATOM 672 O GLU A 50 -12.775 0.739 8.546 1.00 0.00 O ATOM 673 CB GLU A 50 -12.962 -1.683 9.758 1.00 0.00 C ATOM 674 CG GLU A 50 -12.957 -0.706 10.915 1.00 0.00 C ATOM 675 CD GLU A 50 -13.793 -1.180 12.088 1.00 0.00 C ATOM 676 OE1 GLU A 50 -13.286 -1.994 12.888 1.00 0.00 O ATOM 677 OE2 GLU A 50 -14.954 -0.736 12.207 1.00 0.00 O ATOM 0 H GLU A 50 -13.577 -3.009 7.519 1.00 0.00 H new ATOM 0 HA GLU A 50 -14.950 -1.045 9.155 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -13.170 -2.686 10.130 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -11.972 -1.711 9.302 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -11.931 -0.548 11.247 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -13.333 0.258 10.572 1.00 0.00 H new ATOM 684 N LEU A 51 -14.016 0.266 6.755 1.00 0.00 N ATOM 685 CA LEU A 51 -13.750 1.577 6.096 1.00 0.00 C ATOM 686 C LEU A 51 -12.694 1.488 5.040 1.00 0.00 C ATOM 687 O LEU A 51 -11.485 1.364 5.324 1.00 0.00 O ATOM 688 CB LEU A 51 -13.411 2.703 7.061 1.00 0.00 C ATOM 689 CG LEU A 51 -13.568 4.108 6.477 1.00 0.00 C ATOM 690 CD1 LEU A 51 -15.033 4.442 6.218 1.00 0.00 C ATOM 691 CD2 LEU A 51 -12.921 5.148 7.379 1.00 0.00 C ATOM 0 H LEU A 51 -14.535 -0.399 6.181 1.00 0.00 H new ATOM 0 HA LEU A 51 -14.701 1.828 5.626 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -14.049 2.615 7.940 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -12.383 2.577 7.400 1.00 0.00 H new ATOM 0 HG LEU A 51 -13.052 4.127 5.517 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -15.109 5.447 5.803 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -15.450 3.725 5.511 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -15.588 4.393 7.155 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -13.047 6.138 6.941 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -13.394 5.123 8.361 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -11.858 4.929 7.482 1.00 0.00 H new ATOM 703 N GLY A 52 -13.204 1.582 3.815 1.00 0.00 N ATOM 704 CA GLY A 52 -12.423 1.468 2.620 1.00 0.00 C ATOM 705 C GLY A 52 -11.517 0.311 2.729 1.00 0.00 C ATOM 706 O GLY A 52 -10.576 0.156 1.955 1.00 0.00 O ATOM 0 H GLY A 52 -14.196 1.743 3.638 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -13.077 1.350 1.756 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -11.847 2.380 2.462 1.00 0.00 H new ATOM 710 N LEU A 53 -11.853 -0.499 3.717 1.00 0.00 N ATOM 711 CA LEU A 53 -11.138 -1.681 4.066 1.00 0.00 C ATOM 712 C LEU A 53 -10.137 -1.322 5.144 1.00 0.00 C ATOM 713 O LEU A 53 -8.939 -1.531 4.967 1.00 0.00 O ATOM 714 CB LEU A 53 -10.455 -2.339 2.861 1.00 0.00 C ATOM 715 CG LEU A 53 -11.353 -2.687 1.655 1.00 0.00 C ATOM 716 CD1 LEU A 53 -11.117 -4.123 1.206 1.00 0.00 C ATOM 717 CD2 LEU A 53 -12.830 -2.459 1.969 1.00 0.00 C ATOM 0 H LEU A 53 -12.665 -0.332 4.312 1.00 0.00 H new ATOM 0 HA LEU A 53 -11.843 -2.424 4.438 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -9.664 -1.674 2.514 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -9.974 -3.256 3.202 1.00 0.00 H new ATOM 0 HG LEU A 53 -11.081 -2.017 0.839 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -11.760 -4.348 0.355 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -10.074 -4.247 0.916 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -11.349 -4.803 2.026 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -13.431 -2.715 1.096 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -13.125 -3.088 2.809 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -12.990 -1.412 2.226 1.00 0.00 H new ATOM 729 N ASP A 54 -10.645 -0.769 6.271 1.00 0.00 N ATOM 730 CA ASP A 54 -9.784 -0.371 7.382 1.00 0.00 C ATOM 731 C ASP A 54 -8.360 -0.318 6.922 1.00 0.00 C ATOM 732 O ASP A 54 -7.703 -1.348 6.854 1.00 0.00 O ATOM 733 CB ASP A 54 -9.869 -1.367 8.523 1.00 0.00 C ATOM 734 CG ASP A 54 -9.803 -0.701 9.884 1.00 0.00 C ATOM 735 OD1 ASP A 54 -10.280 0.447 10.008 1.00 0.00 O ATOM 736 OD2 ASP A 54 -9.276 -1.327 10.827 1.00 0.00 O ATOM 0 H ASP A 54 -11.638 -0.594 6.423 1.00 0.00 H new ATOM 0 HA ASP A 54 -10.118 0.607 7.727 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -10.800 -1.928 8.442 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -9.055 -2.086 8.434 1.00 0.00 H new ATOM 741 N VAL A 55 -7.883 0.856 6.580 1.00 0.00 N ATOM 742 CA VAL A 55 -6.507 0.957 6.112 1.00 0.00 C ATOM 743 C VAL A 55 -5.544 0.153 6.978 1.00 0.00 C ATOM 744 O VAL A 55 -4.674 -0.520 6.422 1.00 0.00 O ATOM 745 CB VAL A 55 -5.985 2.399 5.963 1.00 0.00 C ATOM 746 CG1 VAL A 55 -5.356 2.908 7.254 1.00 0.00 C ATOM 747 CG2 VAL A 55 -5.001 2.440 4.799 1.00 0.00 C ATOM 0 H VAL A 55 -8.402 1.733 6.612 1.00 0.00 H new ATOM 0 HA VAL A 55 -6.540 0.528 5.110 1.00 0.00 H new ATOM 0 HB VAL A 55 -6.821 3.067 5.753 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -5.000 3.928 7.108 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -6.099 2.894 8.051 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -4.518 2.267 7.528 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -4.621 3.455 4.679 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.171 1.763 5.000 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -5.507 2.132 3.884 1.00 0.00 H new ATOM 757 N PRO A 56 -5.686 0.165 8.338 1.00 0.00 N ATOM 758 CA PRO A 56 -4.785 -0.591 9.205 1.00 0.00 C ATOM 759 C PRO A 56 -4.895 -2.066 8.901 1.00 0.00 C ATOM 760 O PRO A 56 -4.056 -2.870 9.308 1.00 0.00 O ATOM 761 CB PRO A 56 -5.277 -0.288 10.627 1.00 0.00 C ATOM 762 CG PRO A 56 -6.115 0.936 10.492 1.00 0.00 C ATOM 763 CD PRO A 56 -6.735 0.844 9.131 1.00 0.00 C ATOM 0 HA PRO A 56 -3.738 -0.319 9.068 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -5.855 -1.120 11.030 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -4.441 -0.121 11.307 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -6.878 0.978 11.269 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -5.511 1.838 10.589 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -7.663 0.273 9.147 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -6.973 1.828 8.728 1.00 0.00 H new ATOM 771 N LEU A 57 -5.991 -2.423 8.246 1.00 0.00 N ATOM 772 CA LEU A 57 -6.221 -3.788 7.844 1.00 0.00 C ATOM 773 C LEU A 57 -5.825 -4.049 6.385 1.00 0.00 C ATOM 774 O LEU A 57 -4.864 -4.758 6.126 1.00 0.00 O ATOM 775 CB LEU A 57 -7.672 -4.187 8.075 1.00 0.00 C ATOM 776 CG LEU A 57 -8.164 -4.098 9.525 1.00 0.00 C ATOM 777 CD1 LEU A 57 -9.609 -4.554 9.622 1.00 0.00 C ATOM 778 CD2 LEU A 57 -7.286 -4.930 10.447 1.00 0.00 C ATOM 0 H LEU A 57 -6.734 -1.776 7.984 1.00 0.00 H new ATOM 0 HA LEU A 57 -5.578 -4.407 8.469 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -8.307 -3.553 7.456 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -7.808 -5.211 7.727 1.00 0.00 H new ATOM 0 HG LEU A 57 -8.102 -3.057 9.842 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -9.944 -4.485 10.657 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -10.234 -3.918 8.995 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -9.688 -5.587 9.283 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -7.655 -4.851 11.470 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -7.312 -5.973 10.131 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -6.261 -4.563 10.402 1.00 0.00 H new ATOM 790 N ASP A 58 -6.576 -3.460 5.436 1.00 0.00 N ATOM 791 CA ASP A 58 -6.352 -3.687 3.999 1.00 0.00 C ATOM 792 C ASP A 58 -5.090 -3.092 3.419 1.00 0.00 C ATOM 793 O ASP A 58 -4.252 -3.829 2.919 1.00 0.00 O ATOM 794 CB ASP A 58 -7.520 -3.158 3.199 1.00 0.00 C ATOM 795 CG ASP A 58 -7.279 -3.218 1.704 1.00 0.00 C ATOM 796 OD1 ASP A 58 -6.375 -3.964 1.279 1.00 0.00 O ATOM 797 OD2 ASP A 58 -7.993 -2.515 0.960 1.00 0.00 O ATOM 0 H ASP A 58 -7.345 -2.822 5.641 1.00 0.00 H new ATOM 0 HA ASP A 58 -6.244 -4.769 3.923 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -8.413 -3.734 3.443 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -7.717 -2.126 3.490 1.00 0.00 H new ATOM 802 N LEU A 59 -4.952 -1.780 3.437 1.00 0.00 N ATOM 803 CA LEU A 59 -3.776 -1.189 2.841 1.00 0.00 C ATOM 804 C LEU A 59 -2.603 -1.479 3.699 1.00 0.00 C ATOM 805 O LEU A 59 -1.478 -1.216 3.332 1.00 0.00 O ATOM 806 CB LEU A 59 -3.927 0.282 2.536 1.00 0.00 C ATOM 807 CG LEU A 59 -4.190 0.567 1.058 1.00 0.00 C ATOM 808 CD1 LEU A 59 -2.902 0.595 0.266 1.00 0.00 C ATOM 809 CD2 LEU A 59 -5.150 -0.459 0.452 1.00 0.00 C ATOM 0 H LEU A 59 -5.618 -1.123 3.844 1.00 0.00 H new ATOM 0 HA LEU A 59 -3.624 -1.647 1.863 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -4.747 0.687 3.129 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -3.022 0.805 2.845 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.655 1.551 1.002 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.123 0.800 -0.781 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -2.250 1.376 0.659 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -2.403 -0.370 0.349 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -5.315 -0.226 -0.600 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -4.719 -1.456 0.540 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -6.101 -0.426 0.984 1.00 0.00 H new ATOM 821 N ALA A 60 -2.911 -1.930 4.889 1.00 0.00 N ATOM 822 CA ALA A 60 -1.905 -2.338 5.824 1.00 0.00 C ATOM 823 C ALA A 60 -1.590 -3.791 5.526 1.00 0.00 C ATOM 824 O ALA A 60 -0.494 -4.265 5.775 1.00 0.00 O ATOM 825 CB ALA A 60 -2.392 -2.150 7.235 1.00 0.00 C ATOM 0 H ALA A 60 -3.867 -2.023 5.232 1.00 0.00 H new ATOM 0 HA ALA A 60 -1.003 -1.733 5.726 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -1.616 -2.465 7.933 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -2.626 -1.099 7.402 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.288 -2.750 7.394 1.00 0.00 H new ATOM 831 N CYS A 61 -2.602 -4.490 5.002 1.00 0.00 N ATOM 832 CA CYS A 61 -2.455 -5.872 4.563 1.00 0.00 C ATOM 833 C CYS A 61 -1.634 -5.809 3.287 1.00 0.00 C ATOM 834 O CYS A 61 -0.760 -6.635 3.002 1.00 0.00 O ATOM 835 CB CYS A 61 -3.833 -6.499 4.282 1.00 0.00 C ATOM 836 SG CYS A 61 -3.805 -7.971 3.209 1.00 0.00 S ATOM 0 H CYS A 61 -3.540 -4.111 4.873 1.00 0.00 H new ATOM 0 HA CYS A 61 -1.975 -6.487 5.324 1.00 0.00 H new ATOM 0 HB2 CYS A 61 -4.293 -6.770 5.232 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -4.472 -5.745 3.822 1.00 0.00 H new ATOM 841 N ALA A 62 -1.911 -4.747 2.552 1.00 0.00 N ATOM 842 CA ALA A 62 -1.250 -4.467 1.306 1.00 0.00 C ATOM 843 C ALA A 62 0.111 -3.830 1.566 1.00 0.00 C ATOM 844 O ALA A 62 1.107 -4.193 0.934 1.00 0.00 O ATOM 845 CB ALA A 62 -2.136 -3.576 0.455 1.00 0.00 C ATOM 0 H ALA A 62 -2.610 -4.052 2.813 1.00 0.00 H new ATOM 0 HA ALA A 62 -1.077 -5.395 0.761 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -1.637 -3.362 -0.490 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -3.081 -4.083 0.260 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -2.327 -2.642 0.983 1.00 0.00 H new ATOM 851 N ALA A 63 0.141 -2.882 2.511 1.00 0.00 N ATOM 852 CA ALA A 63 1.377 -2.210 2.895 1.00 0.00 C ATOM 853 C ALA A 63 2.281 -3.218 3.540 1.00 0.00 C ATOM 854 O ALA A 63 3.499 -3.169 3.402 1.00 0.00 O ATOM 855 CB ALA A 63 1.119 -1.069 3.865 1.00 0.00 C ATOM 0 H ALA A 63 -0.683 -2.566 3.022 1.00 0.00 H new ATOM 0 HA ALA A 63 1.837 -1.786 2.002 1.00 0.00 H new ATOM 0 HB1 ALA A 63 2.064 -0.594 4.127 1.00 0.00 H new ATOM 0 HB2 ALA A 63 0.461 -0.336 3.398 1.00 0.00 H new ATOM 0 HB3 ALA A 63 0.646 -1.458 4.767 1.00 0.00 H new ATOM 861 N THR A 64 1.662 -4.151 4.245 1.00 0.00 N ATOM 862 CA THR A 64 2.422 -5.208 4.884 1.00 0.00 C ATOM 863 C THR A 64 2.869 -6.176 3.808 1.00 0.00 C ATOM 864 O THR A 64 3.321 -7.283 4.096 1.00 0.00 O ATOM 865 CB THR A 64 1.658 -5.971 6.007 1.00 0.00 C ATOM 866 OG1 THR A 64 2.597 -6.652 6.847 1.00 0.00 O ATOM 867 CG2 THR A 64 0.661 -6.988 5.455 1.00 0.00 C ATOM 0 H THR A 64 0.653 -4.197 4.387 1.00 0.00 H new ATOM 0 HA THR A 64 3.266 -4.739 5.389 1.00 0.00 H new ATOM 0 HB THR A 64 1.095 -5.228 6.572 1.00 0.00 H new ATOM 0 HG1 THR A 64 3.242 -7.137 6.291 1.00 0.00 H new ATOM 0 HG21 THR A 64 0.158 -7.490 6.282 1.00 0.00 H new ATOM 0 HG22 THR A 64 -0.077 -6.476 4.838 1.00 0.00 H new ATOM 0 HG23 THR A 64 1.190 -7.725 4.851 1.00 0.00 H new ATOM 875 N ALA A 65 2.738 -5.737 2.547 1.00 0.00 N ATOM 876 CA ALA A 65 3.110 -6.576 1.432 1.00 0.00 C ATOM 877 C ALA A 65 3.293 -5.829 0.095 1.00 0.00 C ATOM 878 O ALA A 65 4.326 -5.221 -0.131 1.00 0.00 O ATOM 879 CB ALA A 65 2.090 -7.666 1.294 1.00 0.00 C ATOM 0 H ALA A 65 2.381 -4.817 2.291 1.00 0.00 H new ATOM 0 HA ALA A 65 4.096 -6.983 1.657 1.00 0.00 H new ATOM 0 HB1 ALA A 65 2.356 -8.309 0.455 1.00 0.00 H new ATOM 0 HB2 ALA A 65 2.062 -8.256 2.210 1.00 0.00 H new ATOM 0 HB3 ALA A 65 1.109 -7.226 1.116 1.00 0.00 H new ATOM 885 N THR A 66 2.298 -5.892 -0.803 1.00 0.00 N ATOM 886 CA THR A 66 2.438 -5.283 -2.140 1.00 0.00 C ATOM 887 C THR A 66 2.216 -3.781 -2.166 1.00 0.00 C ATOM 888 O THR A 66 3.031 -3.068 -2.747 1.00 0.00 O ATOM 889 CB THR A 66 1.509 -5.913 -3.194 1.00 0.00 C ATOM 890 OG1 THR A 66 0.223 -5.305 -3.129 1.00 0.00 O ATOM 891 CG2 THR A 66 1.378 -7.409 -2.999 1.00 0.00 C ATOM 0 H THR A 66 1.402 -6.349 -0.635 1.00 0.00 H new ATOM 0 HA THR A 66 3.478 -5.489 -2.392 1.00 0.00 H new ATOM 0 HB THR A 66 1.950 -5.740 -4.175 1.00 0.00 H new ATOM 0 HG1 THR A 66 -0.087 -5.098 -4.035 1.00 0.00 H new ATOM 0 HG21 THR A 66 0.715 -7.819 -3.761 1.00 0.00 H new ATOM 0 HG22 THR A 66 2.360 -7.874 -3.084 1.00 0.00 H new ATOM 0 HG23 THR A 66 0.965 -7.612 -2.011 1.00 0.00 H new ATOM 899 N SER A 67 1.128 -3.277 -1.571 1.00 0.00 N ATOM 900 CA SER A 67 0.916 -1.822 -1.588 1.00 0.00 C ATOM 901 C SER A 67 2.237 -1.227 -1.203 1.00 0.00 C ATOM 902 O SER A 67 2.612 -0.123 -1.600 1.00 0.00 O ATOM 903 CB SER A 67 -0.192 -1.360 -0.655 1.00 0.00 C ATOM 904 OG SER A 67 -0.310 0.049 -0.692 1.00 0.00 O ATOM 0 H SER A 67 0.411 -3.823 -1.093 1.00 0.00 H new ATOM 0 HA SER A 67 0.584 -1.499 -2.575 1.00 0.00 H new ATOM 0 HB2 SER A 67 -1.137 -1.819 -0.947 1.00 0.00 H new ATOM 0 HB3 SER A 67 0.020 -1.687 0.363 1.00 0.00 H new ATOM 0 HG SER A 67 -0.374 0.396 0.222 1.00 0.00 H new ATOM 910 N SER A 68 2.913 -2.015 -0.386 1.00 0.00 N ATOM 911 CA SER A 68 4.253 -1.790 0.012 1.00 0.00 C ATOM 912 C SER A 68 4.474 -0.731 1.049 1.00 0.00 C ATOM 913 O SER A 68 4.351 0.465 0.804 1.00 0.00 O ATOM 914 CB SER A 68 5.120 -1.529 -1.199 1.00 0.00 C ATOM 915 OG SER A 68 6.400 -1.068 -0.809 1.00 0.00 O ATOM 0 H SER A 68 2.509 -2.857 0.024 1.00 0.00 H new ATOM 0 HA SER A 68 4.542 -2.714 0.512 1.00 0.00 H new ATOM 0 HB2 SER A 68 5.220 -2.443 -1.784 1.00 0.00 H new ATOM 0 HB3 SER A 68 4.642 -0.790 -1.842 1.00 0.00 H new ATOM 0 HG SER A 68 6.397 -0.089 -0.771 1.00 0.00 H new ATOM 921 N ALA A 69 4.821 -1.233 2.210 1.00 0.00 N ATOM 922 CA ALA A 69 5.183 -0.423 3.355 1.00 0.00 C ATOM 923 C ALA A 69 5.228 -1.292 4.597 1.00 0.00 C ATOM 924 O ALA A 69 4.725 -0.925 5.659 1.00 0.00 O ATOM 925 CB ALA A 69 4.237 0.751 3.541 1.00 0.00 C ATOM 0 H ALA A 69 4.861 -2.236 2.392 1.00 0.00 H new ATOM 0 HA ALA A 69 6.172 -0.001 3.178 1.00 0.00 H new ATOM 0 HB1 ALA A 69 4.545 1.332 4.410 1.00 0.00 H new ATOM 0 HB2 ALA A 69 4.264 1.384 2.654 1.00 0.00 H new ATOM 0 HB3 ALA A 69 3.223 0.381 3.692 1.00 0.00 H new ATOM 931 N THR A 70 5.846 -2.453 4.438 1.00 0.00 N ATOM 932 CA THR A 70 5.971 -3.418 5.518 1.00 0.00 C ATOM 933 C THR A 70 7.322 -3.294 6.195 1.00 0.00 C ATOM 934 O THR A 70 8.329 -3.789 5.691 1.00 0.00 O ATOM 935 CB THR A 70 5.795 -4.863 5.010 1.00 0.00 C ATOM 936 OG1 THR A 70 6.703 -5.738 5.690 1.00 0.00 O ATOM 937 CG2 THR A 70 6.023 -4.947 3.508 1.00 0.00 C ATOM 0 H THR A 70 6.273 -2.751 3.561 1.00 0.00 H new ATOM 0 HA THR A 70 5.180 -3.199 6.235 1.00 0.00 H new ATOM 0 HB THR A 70 4.771 -5.172 5.219 1.00 0.00 H new ATOM 0 HG1 THR A 70 6.907 -6.507 5.118 1.00 0.00 H new ATOM 0 HG21 THR A 70 5.892 -5.977 3.177 1.00 0.00 H new ATOM 0 HG22 THR A 70 5.305 -4.307 2.995 1.00 0.00 H new ATOM 0 HG23 THR A 70 7.035 -4.617 3.275 1.00 0.00 H new ATOM 945 N GLU A 71 7.339 -2.633 7.341 1.00 0.00 N ATOM 946 CA GLU A 71 8.570 -2.447 8.086 1.00 0.00 C ATOM 947 C GLU A 71 9.062 -3.765 8.654 1.00 0.00 C ATOM 948 O GLU A 71 10.112 -3.825 9.294 1.00 0.00 O ATOM 949 CB GLU A 71 8.381 -1.416 9.194 1.00 0.00 C ATOM 950 CG GLU A 71 7.446 -1.831 10.309 1.00 0.00 C ATOM 951 CD GLU A 71 5.990 -1.834 9.888 1.00 0.00 C ATOM 952 OE1 GLU A 71 5.348 -0.765 9.964 1.00 0.00 O ATOM 953 OE2 GLU A 71 5.492 -2.904 9.481 1.00 0.00 O ATOM 0 H GLU A 71 6.514 -2.217 7.774 1.00 0.00 H new ATOM 0 HA GLU A 71 9.328 -2.071 7.399 1.00 0.00 H new ATOM 0 HB2 GLU A 71 9.356 -1.187 9.625 1.00 0.00 H new ATOM 0 HB3 GLU A 71 8.005 -0.494 8.750 1.00 0.00 H new ATOM 0 HG2 GLU A 71 7.721 -2.827 10.655 1.00 0.00 H new ATOM 0 HG3 GLU A 71 7.573 -1.154 11.154 1.00 0.00 H new ATOM 960 N ALA A 72 8.299 -4.824 8.415 1.00 0.00 N ATOM 961 CA ALA A 72 8.663 -6.137 8.906 1.00 0.00 C ATOM 962 C ALA A 72 9.492 -6.912 7.882 1.00 0.00 C ATOM 963 O ALA A 72 10.315 -7.751 8.252 1.00 0.00 O ATOM 964 CB ALA A 72 7.421 -6.926 9.293 1.00 0.00 C ATOM 0 H ALA A 72 7.428 -4.795 7.885 1.00 0.00 H new ATOM 0 HA ALA A 72 9.281 -5.997 9.793 1.00 0.00 H new ATOM 0 HB1 ALA A 72 7.714 -7.910 9.660 1.00 0.00 H new ATOM 0 HB2 ALA A 72 6.881 -6.393 10.076 1.00 0.00 H new ATOM 0 HB3 ALA A 72 6.777 -7.041 8.421 1.00 0.00 H new ATOM 970 N CYS A 73 9.278 -6.634 6.595 1.00 0.00 N ATOM 971 CA CYS A 73 10.023 -7.320 5.540 1.00 0.00 C ATOM 972 C CYS A 73 10.835 -6.343 4.732 1.00 0.00 C ATOM 973 O CYS A 73 11.562 -6.740 3.822 1.00 0.00 O ATOM 974 CB CYS A 73 9.090 -8.021 4.555 1.00 0.00 C ATOM 975 SG CYS A 73 7.659 -8.850 5.301 1.00 0.00 S ATOM 0 H CYS A 73 8.603 -5.946 6.261 1.00 0.00 H new ATOM 0 HA CYS A 73 10.662 -8.044 6.046 1.00 0.00 H new ATOM 0 HB2 CYS A 73 8.729 -7.286 3.835 1.00 0.00 H new ATOM 0 HB3 CYS A 73 9.666 -8.758 3.996 1.00 0.00 H new ATOM 980 N LYS A 74 10.723 -5.072 5.057 1.00 0.00 N ATOM 981 CA LYS A 74 11.395 -4.072 4.270 1.00 0.00 C ATOM 982 C LYS A 74 12.902 -4.121 4.323 1.00 0.00 C ATOM 983 O LYS A 74 13.529 -5.154 4.090 1.00 0.00 O ATOM 984 CB LYS A 74 10.914 -2.660 4.574 1.00 0.00 C ATOM 985 CG LYS A 74 11.192 -1.720 3.409 1.00 0.00 C ATOM 986 CD LYS A 74 12.274 -0.691 3.713 1.00 0.00 C ATOM 987 CE LYS A 74 12.628 0.162 2.508 1.00 0.00 C ATOM 988 NZ LYS A 74 13.399 1.377 2.893 1.00 0.00 N ATOM 0 H LYS A 74 10.183 -4.716 5.846 1.00 0.00 H new ATOM 0 HA LYS A 74 11.113 -4.333 3.250 1.00 0.00 H new ATOM 0 HB2 LYS A 74 9.845 -2.675 4.785 1.00 0.00 H new ATOM 0 HB3 LYS A 74 11.411 -2.289 5.470 1.00 0.00 H new ATOM 0 HG2 LYS A 74 11.491 -2.307 2.541 1.00 0.00 H new ATOM 0 HG3 LYS A 74 10.271 -1.201 3.141 1.00 0.00 H new ATOM 0 HD2 LYS A 74 11.937 -0.045 4.524 1.00 0.00 H new ATOM 0 HD3 LYS A 74 13.169 -1.204 4.065 1.00 0.00 H new ATOM 0 HE2 LYS A 74 13.212 -0.430 1.803 1.00 0.00 H new ATOM 0 HE3 LYS A 74 11.714 0.460 1.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 13.445 2.029 2.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 12.928 1.848 3.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 14.363 1.103 3.172 1.00 0.00 H new ATOM 1002 N GLY A 75 13.463 -2.977 4.634 1.00 0.00 N ATOM 1003 CA GLY A 75 14.874 -2.808 4.595 1.00 0.00 C ATOM 1004 C GLY A 75 15.260 -2.845 3.141 1.00 0.00 C ATOM 1005 O GLY A 75 16.414 -3.094 2.789 1.00 0.00 O ATOM 0 H GLY A 75 12.945 -2.146 4.919 1.00 0.00 H new ATOM 0 HA2 GLY A 75 15.166 -1.862 5.051 1.00 0.00 H new ATOM 0 HA3 GLY A 75 15.377 -3.599 5.152 1.00 0.00 H new ATOM 1009 N CYS A 76 14.248 -2.581 2.282 1.00 0.00 N ATOM 1010 CA CYS A 76 14.436 -2.639 0.852 1.00 0.00 C ATOM 1011 C CYS A 76 13.352 -1.917 0.024 1.00 0.00 C ATOM 1012 O CYS A 76 13.651 -0.961 -0.687 1.00 0.00 O ATOM 1013 CB CYS A 76 14.421 -4.107 0.427 1.00 0.00 C ATOM 1014 SG CYS A 76 16.020 -4.971 0.538 1.00 0.00 S ATOM 0 H CYS A 76 13.304 -2.329 2.574 1.00 0.00 H new ATOM 0 HA CYS A 76 15.380 -2.132 0.655 1.00 0.00 H new ATOM 0 HB2 CYS A 76 13.697 -4.639 1.044 1.00 0.00 H new ATOM 0 HB3 CYS A 76 14.067 -4.166 -0.602 1.00 0.00 H new ATOM 1019 N LEU A 77 12.091 -2.357 0.147 1.00 0.00 N ATOM 1020 CA LEU A 77 11.010 -1.870 -0.739 1.00 0.00 C ATOM 1021 C LEU A 77 10.012 -0.814 -0.213 1.00 0.00 C ATOM 1022 O LEU A 77 9.306 -0.237 -1.034 1.00 0.00 O ATOM 1023 CB LEU A 77 10.202 -3.088 -1.179 1.00 0.00 C ATOM 1024 CG LEU A 77 8.980 -2.780 -2.051 1.00 0.00 C ATOM 1025 CD1 LEU A 77 9.410 -2.075 -3.316 1.00 0.00 C ATOM 1026 CD2 LEU A 77 8.198 -4.039 -2.381 1.00 0.00 C ATOM 0 H LEU A 77 11.791 -3.041 0.841 1.00 0.00 H new ATOM 0 HA LEU A 77 11.546 -1.335 -1.523 1.00 0.00 H new ATOM 0 HB2 LEU A 77 10.860 -3.761 -1.728 1.00 0.00 H new ATOM 0 HB3 LEU A 77 9.868 -3.623 -0.290 1.00 0.00 H new ATOM 0 HG LEU A 77 8.319 -2.123 -1.485 1.00 0.00 H new ATOM 0 HD11 LEU A 77 8.534 -1.861 -3.929 1.00 0.00 H new ATOM 0 HD12 LEU A 77 9.911 -1.141 -3.060 1.00 0.00 H new ATOM 0 HD13 LEU A 77 10.095 -2.714 -3.873 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.339 -3.782 -3.000 1.00 0.00 H new ATOM 0 HD22 LEU A 77 8.840 -4.735 -2.922 1.00 0.00 H new ATOM 0 HD23 LEU A 77 7.853 -4.506 -1.458 1.00 0.00 H new ATOM 1038 N TRP A 78 9.939 -0.539 1.089 1.00 0.00 N ATOM 1039 CA TRP A 78 8.936 0.429 1.616 1.00 0.00 C ATOM 1040 C TRP A 78 8.289 1.277 0.521 1.00 0.00 C ATOM 1041 O TRP A 78 7.067 1.134 0.311 1.00 0.00 O ATOM 1042 CB TRP A 78 9.512 1.362 2.693 1.00 0.00 C ATOM 1043 CG TRP A 78 9.374 0.825 4.078 1.00 0.00 C ATOM 1044 CD1 TRP A 78 8.513 -0.141 4.499 1.00 0.00 C ATOM 1045 CD2 TRP A 78 10.129 1.213 5.220 1.00 0.00 C ATOM 1046 NE1 TRP A 78 8.718 -0.409 5.823 1.00 0.00 N ATOM 1047 CE2 TRP A 78 9.702 0.417 6.289 1.00 0.00 C ATOM 1048 CE3 TRP A 78 11.138 2.147 5.437 1.00 0.00 C ATOM 1049 CZ2 TRP A 78 10.250 0.524 7.550 1.00 0.00 C ATOM 1050 CZ3 TRP A 78 11.680 2.259 6.706 1.00 0.00 C ATOM 1051 CH2 TRP A 78 11.231 1.440 7.750 1.00 0.00 C ATOM 1052 OXT TRP A 78 9.003 2.076 -0.117 1.00 0.00 O ATOM 0 H TRP A 78 10.542 -0.955 1.798 1.00 0.00 H new ATOM 0 HA TRP A 78 8.169 -0.200 2.069 1.00 0.00 H new ATOM 0 HB2 TRP A 78 10.567 1.539 2.483 1.00 0.00 H new ATOM 0 HB3 TRP A 78 9.009 2.327 2.634 1.00 0.00 H new ATOM 0 HD1 TRP A 78 7.775 -0.625 3.877 1.00 0.00 H new ATOM 0 HE1 TRP A 78 8.220 -1.109 6.372 1.00 0.00 H new ATOM 0 HE3 TRP A 78 11.491 2.773 4.631 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 9.907 -0.105 8.358 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 12.457 2.985 6.893 1.00 0.00 H new ATOM 0 HH2 TRP A 78 11.673 1.539 8.730 1.00 0.00 H new TER 1063 TRP A 78 ATOM 1064 N ASP B 1 1.231 15.205 -0.820 1.00 0.00 N ATOM 1065 CA ASP B 1 1.463 14.491 -2.102 1.00 0.00 C ATOM 1066 C ASP B 1 2.297 13.233 -1.881 1.00 0.00 C ATOM 1067 O ASP B 1 3.065 12.822 -2.751 1.00 0.00 O ATOM 1068 CB ASP B 1 2.166 15.414 -3.101 1.00 0.00 C ATOM 1069 CG ASP B 1 1.387 16.692 -3.351 1.00 0.00 C ATOM 1070 OD1 ASP B 1 0.465 16.669 -4.192 1.00 0.00 O ATOM 1071 OD2 ASP B 1 1.702 17.714 -2.706 1.00 0.00 O ATOM 0 H1 ASP B 1 0.735 16.100 -1.006 1.00 0.00 H new ATOM 0 H2 ASP B 1 0.652 14.612 -0.192 1.00 0.00 H new ATOM 0 H3 ASP B 1 2.144 15.404 -0.363 1.00 0.00 H new ATOM 0 HA ASP B 1 0.495 14.196 -2.507 1.00 0.00 H new ATOM 0 HB2 ASP B 1 3.158 15.664 -2.725 1.00 0.00 H new ATOM 0 HB3 ASP B 1 2.306 14.886 -4.044 1.00 0.00 H new ATOM 1078 N GLN B 2 2.132 12.625 -0.707 1.00 0.00 N ATOM 1079 CA GLN B 2 2.861 11.410 -0.358 1.00 0.00 C ATOM 1080 C GLN B 2 4.369 11.605 -0.520 1.00 0.00 C ATOM 1081 O GLN B 2 4.947 11.207 -1.531 1.00 0.00 O ATOM 1082 CB GLN B 2 2.386 10.240 -1.224 1.00 0.00 C ATOM 1083 CG GLN B 2 0.982 9.755 -0.889 1.00 0.00 C ATOM 1084 CD GLN B 2 -0.103 10.746 -1.273 1.00 0.00 C ATOM 1085 OE1 GLN B 2 0.124 11.495 -2.345 1.00 0.00 O flip ATOM 1086 NE2 GLN B 2 -1.139 10.830 -0.615 1.00 0.00 N flip ATOM 0 H GLN B 2 1.497 12.957 0.019 1.00 0.00 H new ATOM 0 HA GLN B 2 2.658 11.185 0.689 1.00 0.00 H new ATOM 0 HB2 GLN B 2 2.416 10.540 -2.271 1.00 0.00 H new ATOM 0 HB3 GLN B 2 3.083 9.410 -1.110 1.00 0.00 H new ATOM 0 HG2 GLN B 2 0.799 8.810 -1.401 1.00 0.00 H new ATOM 0 HG3 GLN B 2 0.920 9.555 0.181 1.00 0.00 H new ATOM 0 HE21 GLN B 2 -1.273 10.235 0.203 1.00 0.00 H new ATOM 0 HE22 GLN B 2 -1.864 11.494 -0.887 1.00 0.00 H new ATOM 1095 N PRO B 3 5.029 12.224 0.478 1.00 0.00 N ATOM 1096 CA PRO B 3 6.473 12.473 0.434 1.00 0.00 C ATOM 1097 C PRO B 3 7.300 11.225 0.734 1.00 0.00 C ATOM 1098 O PRO B 3 8.458 11.127 0.326 1.00 0.00 O ATOM 1099 CB PRO B 3 6.674 13.522 1.525 1.00 0.00 C ATOM 1100 CG PRO B 3 5.596 13.246 2.514 1.00 0.00 C ATOM 1101 CD PRO B 3 4.420 12.732 1.724 1.00 0.00 C ATOM 0 HA PRO B 3 6.801 12.789 -0.556 1.00 0.00 H new ATOM 0 HB2 PRO B 3 7.661 13.437 1.980 1.00 0.00 H new ATOM 0 HB3 PRO B 3 6.594 14.532 1.123 1.00 0.00 H new ATOM 0 HG2 PRO B 3 5.922 12.510 3.249 1.00 0.00 H new ATOM 0 HG3 PRO B 3 5.331 14.150 3.063 1.00 0.00 H new ATOM 0 HD2 PRO B 3 3.891 11.945 2.261 1.00 0.00 H new ATOM 0 HD3 PRO B 3 3.697 13.522 1.523 1.00 0.00 H new ATOM 1109 N SER B 4 6.702 10.274 1.447 1.00 0.00 N ATOM 1110 CA SER B 4 7.388 9.034 1.797 1.00 0.00 C ATOM 1111 C SER B 4 6.456 7.853 1.596 1.00 0.00 C ATOM 1112 O SER B 4 5.317 8.037 1.193 1.00 0.00 O ATOM 1113 CB SER B 4 7.859 9.080 3.250 1.00 0.00 C ATOM 1114 OG SER B 4 8.673 7.962 3.560 1.00 0.00 O ATOM 0 H SER B 4 5.745 10.338 1.793 1.00 0.00 H new ATOM 0 HA SER B 4 8.257 8.920 1.149 1.00 0.00 H new ATOM 0 HB2 SER B 4 8.417 10.000 3.425 1.00 0.00 H new ATOM 0 HB3 SER B 4 6.995 9.100 3.915 1.00 0.00 H new ATOM 0 HG SER B 4 8.962 8.017 4.495 1.00 0.00 H new ATOM 1120 N VAL B 5 6.932 6.643 1.862 1.00 0.00 N ATOM 1121 CA VAL B 5 6.088 5.466 1.705 1.00 0.00 C ATOM 1122 C VAL B 5 5.139 5.319 2.896 1.00 0.00 C ATOM 1123 O VAL B 5 3.924 5.230 2.720 1.00 0.00 O ATOM 1124 CB VAL B 5 6.913 4.166 1.505 1.00 0.00 C ATOM 1125 CG1 VAL B 5 8.386 4.478 1.277 1.00 0.00 C ATOM 1126 CG2 VAL B 5 6.723 3.194 2.670 1.00 0.00 C ATOM 0 H VAL B 5 7.882 6.452 2.182 1.00 0.00 H new ATOM 0 HA VAL B 5 5.501 5.616 0.799 1.00 0.00 H new ATOM 0 HB VAL B 5 6.536 3.674 0.608 1.00 0.00 H new ATOM 0 HG11 VAL B 5 8.938 3.548 1.140 1.00 0.00 H new ATOM 0 HG12 VAL B 5 8.493 5.098 0.387 1.00 0.00 H new ATOM 0 HG13 VAL B 5 8.783 5.012 2.141 1.00 0.00 H new ATOM 0 HG21 VAL B 5 7.315 2.296 2.495 1.00 0.00 H new ATOM 0 HG22 VAL B 5 7.048 3.668 3.596 1.00 0.00 H new ATOM 0 HG23 VAL B 5 5.670 2.924 2.751 1.00 0.00 H new ATOM 1136 N GLY B 6 5.697 5.302 4.107 1.00 0.00 N ATOM 1137 CA GLY B 6 4.878 5.161 5.297 1.00 0.00 C ATOM 1138 C GLY B 6 3.963 6.350 5.496 1.00 0.00 C ATOM 1139 O GLY B 6 2.787 6.194 5.831 1.00 0.00 O ATOM 0 H GLY B 6 6.699 5.383 4.282 1.00 0.00 H new ATOM 0 HA2 GLY B 6 4.281 4.252 5.221 1.00 0.00 H new ATOM 0 HA3 GLY B 6 5.522 5.048 6.169 1.00 0.00 H new ATOM 1143 N ASP B 7 4.505 7.545 5.286 1.00 0.00 N ATOM 1144 CA ASP B 7 3.728 8.769 5.422 1.00 0.00 C ATOM 1145 C ASP B 7 2.654 8.819 4.354 1.00 0.00 C ATOM 1146 O ASP B 7 1.546 9.300 4.591 1.00 0.00 O ATOM 1147 CB ASP B 7 4.633 9.993 5.293 1.00 0.00 C ATOM 1148 CG ASP B 7 5.691 10.051 6.379 1.00 0.00 C ATOM 1149 OD1 ASP B 7 6.738 9.390 6.225 1.00 0.00 O ATOM 1150 OD2 ASP B 7 5.469 10.757 7.386 1.00 0.00 O ATOM 0 H ASP B 7 5.479 7.691 5.021 1.00 0.00 H new ATOM 0 HA ASP B 7 3.262 8.776 6.407 1.00 0.00 H new ATOM 0 HB2 ASP B 7 5.119 9.980 4.317 1.00 0.00 H new ATOM 0 HB3 ASP B 7 4.025 10.897 5.334 1.00 0.00 H new ATOM 1155 N ALA B 8 2.998 8.323 3.170 1.00 0.00 N ATOM 1156 CA ALA B 8 2.065 8.297 2.060 1.00 0.00 C ATOM 1157 C ALA B 8 0.776 7.624 2.483 1.00 0.00 C ATOM 1158 O ALA B 8 -0.318 8.129 2.234 1.00 0.00 O ATOM 1159 CB ALA B 8 2.656 7.555 0.881 1.00 0.00 C ATOM 0 H ALA B 8 3.917 7.935 2.959 1.00 0.00 H new ATOM 0 HA ALA B 8 1.860 9.325 1.762 1.00 0.00 H new ATOM 0 HB1 ALA B 8 1.940 7.547 0.060 1.00 0.00 H new ATOM 0 HB2 ALA B 8 3.571 8.052 0.560 1.00 0.00 H new ATOM 0 HB3 ALA B 8 2.884 6.530 1.173 1.00 0.00 H new ATOM 1165 N PHE B 9 0.922 6.470 3.125 1.00 0.00 N ATOM 1166 CA PHE B 9 -0.213 5.711 3.594 1.00 0.00 C ATOM 1167 C PHE B 9 -1.104 6.561 4.487 1.00 0.00 C ATOM 1168 O PHE B 9 -2.271 6.713 4.202 1.00 0.00 O ATOM 1169 CB PHE B 9 0.251 4.467 4.324 1.00 0.00 C ATOM 1170 CG PHE B 9 0.422 3.308 3.401 1.00 0.00 C ATOM 1171 CD1 PHE B 9 -0.639 2.468 3.121 1.00 0.00 C ATOM 1172 CD2 PHE B 9 1.639 3.074 2.797 1.00 0.00 C ATOM 1173 CE1 PHE B 9 -0.484 1.414 2.248 1.00 0.00 C ATOM 1174 CE2 PHE B 9 1.799 2.021 1.929 1.00 0.00 C ATOM 1175 CZ PHE B 9 0.739 1.192 1.651 1.00 0.00 C ATOM 0 H PHE B 9 1.826 6.044 3.330 1.00 0.00 H new ATOM 0 HA PHE B 9 -0.802 5.405 2.729 1.00 0.00 H new ATOM 0 HB2 PHE B 9 1.196 4.673 4.826 1.00 0.00 H new ATOM 0 HB3 PHE B 9 -0.472 4.210 5.098 1.00 0.00 H new ATOM 0 HD1 PHE B 9 -1.597 2.639 3.590 1.00 0.00 H new ATOM 0 HD2 PHE B 9 2.475 3.725 3.008 1.00 0.00 H new ATOM 0 HE1 PHE B 9 -1.318 0.763 2.032 1.00 0.00 H new ATOM 0 HE2 PHE B 9 2.758 1.845 1.465 1.00 0.00 H new ATOM 0 HZ PHE B 9 0.864 0.367 0.965 1.00 0.00 H new ATOM 1185 N ASP B 10 -0.540 7.182 5.521 1.00 0.00 N ATOM 1186 CA ASP B 10 -1.351 7.991 6.439 1.00 0.00 C ATOM 1187 C ASP B 10 -2.336 8.855 5.653 1.00 0.00 C ATOM 1188 O ASP B 10 -3.505 9.001 6.027 1.00 0.00 O ATOM 1189 CB ASP B 10 -0.452 8.876 7.307 1.00 0.00 C ATOM 1190 CG ASP B 10 -1.238 9.663 8.336 1.00 0.00 C ATOM 1191 OD1 ASP B 10 -1.488 9.122 9.433 1.00 0.00 O ATOM 1192 OD2 ASP B 10 -1.606 10.821 8.046 1.00 0.00 O ATOM 0 H ASP B 10 0.454 7.145 5.745 1.00 0.00 H new ATOM 0 HA ASP B 10 -1.912 7.319 7.089 1.00 0.00 H new ATOM 0 HB2 ASP B 10 0.285 8.254 7.815 1.00 0.00 H new ATOM 0 HB3 ASP B 10 0.099 9.566 6.669 1.00 0.00 H new ATOM 1197 N LYS B 11 -1.856 9.384 4.539 1.00 0.00 N ATOM 1198 CA LYS B 11 -2.671 10.211 3.659 1.00 0.00 C ATOM 1199 C LYS B 11 -3.706 9.342 2.966 1.00 0.00 C ATOM 1200 O LYS B 11 -4.910 9.575 3.071 1.00 0.00 O ATOM 1201 CB LYS B 11 -1.801 10.899 2.618 1.00 0.00 C ATOM 1202 CG LYS B 11 -2.477 12.061 1.956 1.00 0.00 C ATOM 1203 CD LYS B 11 -1.868 13.299 2.500 1.00 0.00 C ATOM 1204 CE LYS B 11 -2.777 14.508 2.347 1.00 0.00 C ATOM 1205 NZ LYS B 11 -2.144 15.749 2.873 1.00 0.00 N ATOM 0 H LYS B 11 -0.896 9.254 4.219 1.00 0.00 H new ATOM 0 HA LYS B 11 -3.171 10.975 4.255 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -0.882 11.244 3.093 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -1.514 10.173 1.857 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -2.349 12.014 0.875 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -3.549 12.043 2.151 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -1.636 13.153 3.555 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -0.924 13.491 1.990 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -3.025 14.645 1.294 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -3.714 14.327 2.874 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -2.796 16.550 2.750 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -1.931 15.628 3.884 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -1.263 15.937 2.353 1.00 0.00 H new ATOM 1219 N TYR B 12 -3.210 8.339 2.248 1.00 0.00 N ATOM 1220 CA TYR B 12 -4.058 7.391 1.544 1.00 0.00 C ATOM 1221 C TYR B 12 -5.132 6.876 2.455 1.00 0.00 C ATOM 1222 O TYR B 12 -6.311 6.971 2.179 1.00 0.00 O ATOM 1223 CB TYR B 12 -3.257 6.172 1.112 1.00 0.00 C ATOM 1224 CG TYR B 12 -3.984 5.338 0.084 1.00 0.00 C ATOM 1225 CD1 TYR B 12 -4.764 5.930 -0.907 1.00 0.00 C ATOM 1226 CD2 TYR B 12 -3.899 3.958 0.111 1.00 0.00 C ATOM 1227 CE1 TYR B 12 -5.436 5.164 -1.839 1.00 0.00 C ATOM 1228 CE2 TYR B 12 -4.568 3.187 -0.817 1.00 0.00 C ATOM 1229 CZ TYR B 12 -5.336 3.791 -1.788 1.00 0.00 C ATOM 1230 OH TYR B 12 -6.003 3.021 -2.713 1.00 0.00 O ATOM 0 H TYR B 12 -2.211 8.163 2.140 1.00 0.00 H new ATOM 0 HA TYR B 12 -4.477 7.915 0.685 1.00 0.00 H new ATOM 0 HB2 TYR B 12 -2.301 6.496 0.702 1.00 0.00 H new ATOM 0 HB3 TYR B 12 -3.038 5.557 1.985 1.00 0.00 H new ATOM 0 HD1 TYR B 12 -4.844 7.006 -0.947 1.00 0.00 H new ATOM 0 HD2 TYR B 12 -3.300 3.477 0.870 1.00 0.00 H new ATOM 0 HE1 TYR B 12 -6.036 5.638 -2.602 1.00 0.00 H new ATOM 0 HE2 TYR B 12 -4.490 2.110 -0.782 1.00 0.00 H new ATOM 0 HH TYR B 12 -5.913 2.074 -2.477 1.00 0.00 H new ATOM 1240 N ASN B 13 -4.659 6.381 3.567 1.00 0.00 N ATOM 1241 CA ASN B 13 -5.457 5.775 4.603 1.00 0.00 C ATOM 1242 C ASN B 13 -6.773 6.496 4.797 1.00 0.00 C ATOM 1243 O ASN B 13 -7.841 5.897 4.666 1.00 0.00 O ATOM 1244 CB ASN B 13 -4.629 5.837 5.880 1.00 0.00 C ATOM 1245 CG ASN B 13 -3.412 4.920 5.864 1.00 0.00 C ATOM 1246 OD1 ASN B 13 -3.003 4.478 4.677 1.00 0.00 O flip ATOM 1247 ND2 ASN B 13 -2.850 4.605 6.912 1.00 0.00 N flip ATOM 0 H ASN B 13 -3.663 6.389 3.787 1.00 0.00 H new ATOM 0 HA ASN B 13 -5.706 4.749 4.332 1.00 0.00 H new ATOM 0 HB2 ASN B 13 -4.298 6.863 6.039 1.00 0.00 H new ATOM 0 HB3 ASN B 13 -5.262 5.572 6.727 1.00 0.00 H new ATOM 0 HD21 ASN B 13 -3.193 4.964 7.803 1.00 0.00 H new ATOM 0 HD22 ASN B 13 -2.041 3.984 6.890 1.00 0.00 H new ATOM 1254 N GLU B 14 -6.706 7.771 5.097 1.00 0.00 N ATOM 1255 CA GLU B 14 -7.916 8.550 5.284 1.00 0.00 C ATOM 1256 C GLU B 14 -8.705 8.611 3.967 1.00 0.00 C ATOM 1257 O GLU B 14 -9.936 8.528 3.944 1.00 0.00 O ATOM 1258 CB GLU B 14 -7.539 9.957 5.761 1.00 0.00 C ATOM 1259 CG GLU B 14 -7.206 10.920 4.635 1.00 0.00 C ATOM 1260 CD GLU B 14 -8.400 11.745 4.194 1.00 0.00 C ATOM 1261 OE1 GLU B 14 -8.695 12.762 4.856 1.00 0.00 O ATOM 1262 OE2 GLU B 14 -9.040 11.376 3.187 1.00 0.00 O ATOM 0 H GLU B 14 -5.837 8.291 5.217 1.00 0.00 H new ATOM 0 HA GLU B 14 -8.548 8.080 6.037 1.00 0.00 H new ATOM 0 HB2 GLU B 14 -8.365 10.366 6.343 1.00 0.00 H new ATOM 0 HB3 GLU B 14 -6.682 9.886 6.430 1.00 0.00 H new ATOM 0 HG2 GLU B 14 -6.408 11.588 4.959 1.00 0.00 H new ATOM 0 HG3 GLU B 14 -6.824 10.357 3.783 1.00 0.00 H new ATOM 1269 N ALA B 15 -7.958 8.677 2.874 1.00 0.00 N ATOM 1270 CA ALA B 15 -8.505 8.804 1.529 1.00 0.00 C ATOM 1271 C ALA B 15 -9.128 7.528 0.974 1.00 0.00 C ATOM 1272 O ALA B 15 -10.121 7.591 0.248 1.00 0.00 O ATOM 1273 CB ALA B 15 -7.388 9.241 0.599 1.00 0.00 C ATOM 0 H ALA B 15 -6.939 8.643 2.896 1.00 0.00 H new ATOM 0 HA ALA B 15 -9.312 9.534 1.591 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -7.777 9.342 -0.414 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -6.991 10.200 0.933 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -6.593 8.495 0.610 1.00 0.00 H new ATOM 1279 N VAL B 16 -8.559 6.375 1.294 1.00 0.00 N ATOM 1280 CA VAL B 16 -9.053 5.135 0.742 1.00 0.00 C ATOM 1281 C VAL B 16 -10.155 4.564 1.563 1.00 0.00 C ATOM 1282 O VAL B 16 -11.160 4.092 1.035 1.00 0.00 O ATOM 1283 CB VAL B 16 -7.938 4.093 0.544 1.00 0.00 C ATOM 1284 CG1 VAL B 16 -6.923 4.173 1.662 1.00 0.00 C ATOM 1285 CG2 VAL B 16 -8.520 2.690 0.425 1.00 0.00 C ATOM 0 H VAL B 16 -7.764 6.278 1.926 1.00 0.00 H new ATOM 0 HA VAL B 16 -9.451 5.382 -0.242 1.00 0.00 H new ATOM 0 HB VAL B 16 -7.423 4.319 -0.390 1.00 0.00 H new ATOM 0 HG11 VAL B 16 -6.145 3.427 1.501 1.00 0.00 H new ATOM 0 HG12 VAL B 16 -6.476 5.167 1.677 1.00 0.00 H new ATOM 0 HG13 VAL B 16 -7.416 3.983 2.615 1.00 0.00 H new ATOM 0 HG21 VAL B 16 -7.712 1.972 0.286 1.00 0.00 H new ATOM 0 HG22 VAL B 16 -9.070 2.446 1.334 1.00 0.00 H new ATOM 0 HG23 VAL B 16 -9.195 2.647 -0.430 1.00 0.00 H new ATOM 1295 N ARG B 17 -9.966 4.602 2.848 1.00 0.00 N ATOM 1296 CA ARG B 17 -10.951 4.073 3.729 1.00 0.00 C ATOM 1297 C ARG B 17 -12.282 4.704 3.486 1.00 0.00 C ATOM 1298 O ARG B 17 -13.322 4.040 3.526 1.00 0.00 O ATOM 1299 CB ARG B 17 -10.480 4.187 5.167 1.00 0.00 C ATOM 1300 CG ARG B 17 -9.254 3.343 5.448 1.00 0.00 C ATOM 1301 CD ARG B 17 -9.110 2.175 4.476 1.00 0.00 C ATOM 1302 NE ARG B 17 -7.826 2.144 3.849 1.00 0.00 N ATOM 1303 CZ ARG B 17 -7.523 1.280 2.930 1.00 0.00 C ATOM 1304 NH1 ARG B 17 -8.279 0.219 2.728 1.00 0.00 N ATOM 1305 NH2 ARG B 17 -6.442 1.443 2.242 1.00 0.00 N ATOM 0 H ARG B 17 -9.141 4.993 3.304 1.00 0.00 H new ATOM 0 HA ARG B 17 -11.086 3.011 3.526 1.00 0.00 H new ATOM 0 HB2 ARG B 17 -10.257 5.230 5.391 1.00 0.00 H new ATOM 0 HB3 ARG B 17 -11.286 3.883 5.835 1.00 0.00 H new ATOM 0 HG2 ARG B 17 -8.365 3.970 5.391 1.00 0.00 H new ATOM 0 HG3 ARG B 17 -9.308 2.959 6.467 1.00 0.00 H new ATOM 0 HD2 ARG B 17 -9.273 1.239 5.010 1.00 0.00 H new ATOM 0 HD3 ARG B 17 -9.883 2.245 3.711 1.00 0.00 H new ATOM 0 HE ARG B 17 -7.123 2.826 4.134 1.00 0.00 H new ATOM 0 HH11 ARG B 17 -9.112 0.071 3.297 1.00 0.00 H new ATOM 0 HH12 ARG B 17 -8.031 -0.453 2.002 1.00 0.00 H new ATOM 0 HH21 ARG B 17 -5.838 2.244 2.424 1.00 0.00 H new ATOM 0 HH22 ARG B 17 -6.193 0.771 1.517 1.00 0.00 H new ATOM 1319 N VAL B 18 -12.264 5.961 3.171 1.00 0.00 N ATOM 1320 CA VAL B 18 -13.494 6.622 2.904 1.00 0.00 C ATOM 1321 C VAL B 18 -14.010 6.232 1.526 1.00 0.00 C ATOM 1322 O VAL B 18 -15.162 5.873 1.384 1.00 0.00 O ATOM 1323 CB VAL B 18 -13.324 8.144 2.996 1.00 0.00 C ATOM 1324 CG1 VAL B 18 -12.766 8.511 4.362 1.00 0.00 C ATOM 1325 CG2 VAL B 18 -12.413 8.649 1.883 1.00 0.00 C ATOM 0 H VAL B 18 -11.426 6.538 3.094 1.00 0.00 H new ATOM 0 HA VAL B 18 -14.221 6.313 3.655 1.00 0.00 H new ATOM 0 HB VAL B 18 -14.296 8.621 2.873 1.00 0.00 H new ATOM 0 HG11 VAL B 18 -12.645 9.592 4.427 1.00 0.00 H new ATOM 0 HG12 VAL B 18 -13.454 8.175 5.138 1.00 0.00 H new ATOM 0 HG13 VAL B 18 -11.798 8.029 4.501 1.00 0.00 H new ATOM 0 HG21 VAL B 18 -12.304 9.730 1.964 1.00 0.00 H new ATOM 0 HG22 VAL B 18 -11.434 8.178 1.972 1.00 0.00 H new ATOM 0 HG23 VAL B 18 -12.848 8.400 0.915 1.00 0.00 H new ATOM 1335 N PHE B 19 -13.114 6.170 0.545 1.00 0.00 N ATOM 1336 CA PHE B 19 -13.515 5.909 -0.833 1.00 0.00 C ATOM 1337 C PHE B 19 -14.098 4.509 -1.058 1.00 0.00 C ATOM 1338 O PHE B 19 -15.135 4.357 -1.730 1.00 0.00 O ATOM 1339 CB PHE B 19 -12.341 6.265 -1.795 1.00 0.00 C ATOM 1340 CG PHE B 19 -11.331 5.192 -2.174 1.00 0.00 C ATOM 1341 CD1 PHE B 19 -11.697 3.903 -2.504 1.00 0.00 C ATOM 1342 CD2 PHE B 19 -9.988 5.515 -2.221 1.00 0.00 C ATOM 1343 CE1 PHE B 19 -10.753 2.957 -2.851 1.00 0.00 C ATOM 1344 CE2 PHE B 19 -9.035 4.575 -2.567 1.00 0.00 C ATOM 1345 CZ PHE B 19 -9.420 3.292 -2.875 1.00 0.00 C ATOM 0 H PHE B 19 -12.111 6.296 0.678 1.00 0.00 H new ATOM 0 HA PHE B 19 -14.354 6.564 -1.067 1.00 0.00 H new ATOM 0 HB2 PHE B 19 -12.779 6.642 -2.719 1.00 0.00 H new ATOM 0 HB3 PHE B 19 -11.788 7.089 -1.345 1.00 0.00 H new ATOM 0 HD1 PHE B 19 -12.742 3.629 -2.491 1.00 0.00 H new ATOM 0 HD2 PHE B 19 -9.677 6.521 -1.983 1.00 0.00 H new ATOM 0 HE1 PHE B 19 -11.062 1.953 -3.104 1.00 0.00 H new ATOM 0 HE2 PHE B 19 -7.991 4.848 -2.595 1.00 0.00 H new ATOM 0 HZ PHE B 19 -8.679 2.551 -3.135 1.00 0.00 H new ATOM 1355 N THR B 20 -13.504 3.484 -0.465 1.00 0.00 N ATOM 1356 CA THR B 20 -13.991 2.144 -0.718 1.00 0.00 C ATOM 1357 C THR B 20 -15.263 1.848 0.048 1.00 0.00 C ATOM 1358 O THR B 20 -16.255 1.432 -0.551 1.00 0.00 O ATOM 1359 CB THR B 20 -12.934 1.079 -0.436 1.00 0.00 C ATOM 1360 OG1 THR B 20 -12.003 1.026 -1.506 1.00 0.00 O ATOM 1361 CG2 THR B 20 -13.568 -0.277 -0.237 1.00 0.00 C ATOM 0 H THR B 20 -12.711 3.552 0.173 1.00 0.00 H new ATOM 0 HA THR B 20 -14.223 2.104 -1.782 1.00 0.00 H new ATOM 0 HB THR B 20 -12.414 1.350 0.483 1.00 0.00 H new ATOM 0 HG1 THR B 20 -11.486 1.858 -1.531 1.00 0.00 H new ATOM 0 HG21 THR B 20 -12.792 -1.016 -0.038 1.00 0.00 H new ATOM 0 HG22 THR B 20 -14.256 -0.237 0.608 1.00 0.00 H new ATOM 0 HG23 THR B 20 -14.115 -0.559 -1.137 1.00 0.00 H new ATOM 1369 N GLN B 21 -15.265 2.049 1.364 1.00 0.00 N ATOM 1370 CA GLN B 21 -16.479 1.786 2.105 1.00 0.00 C ATOM 1371 C GLN B 21 -17.544 2.776 1.676 1.00 0.00 C ATOM 1372 O GLN B 21 -18.713 2.610 1.989 1.00 0.00 O ATOM 1373 CB GLN B 21 -16.259 1.803 3.617 1.00 0.00 C ATOM 1374 CG GLN B 21 -15.839 0.446 4.186 1.00 0.00 C ATOM 1375 CD GLN B 21 -16.523 -0.723 3.520 1.00 0.00 C ATOM 1376 OE1 GLN B 21 -15.912 -1.212 2.445 1.00 0.00 O flip ATOM 1377 NE2 GLN B 21 -17.580 -1.179 3.956 1.00 0.00 N flip ATOM 0 H GLN B 21 -14.472 2.379 1.914 1.00 0.00 H new ATOM 0 HA GLN B 21 -16.815 0.775 1.873 1.00 0.00 H new ATOM 0 HB2 GLN B 21 -15.494 2.542 3.857 1.00 0.00 H new ATOM 0 HB3 GLN B 21 -17.178 2.125 4.107 1.00 0.00 H new ATOM 0 HG2 GLN B 21 -14.760 0.334 4.080 1.00 0.00 H new ATOM 0 HG3 GLN B 21 -16.058 0.425 5.254 1.00 0.00 H new ATOM 0 HE21 GLN B 21 -18.009 -0.768 4.785 1.00 0.00 H new ATOM 0 HE22 GLN B 21 -18.027 -1.968 3.488 1.00 0.00 H new ATOM 1386 N LEU B 22 -17.136 3.821 0.953 1.00 0.00 N ATOM 1387 CA LEU B 22 -18.107 4.769 0.439 1.00 0.00 C ATOM 1388 C LEU B 22 -19.069 3.991 -0.426 1.00 0.00 C ATOM 1389 O LEU B 22 -20.282 4.170 -0.350 1.00 0.00 O ATOM 1390 CB LEU B 22 -17.458 5.883 -0.400 1.00 0.00 C ATOM 1391 CG LEU B 22 -17.138 7.211 0.319 1.00 0.00 C ATOM 1392 CD1 LEU B 22 -17.798 8.366 -0.405 1.00 0.00 C ATOM 1393 CD2 LEU B 22 -17.555 7.197 1.790 1.00 0.00 C ATOM 0 H LEU B 22 -16.164 4.024 0.718 1.00 0.00 H new ATOM 0 HA LEU B 22 -18.605 5.256 1.277 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -16.530 5.494 -0.819 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -18.119 6.103 -1.238 1.00 0.00 H new ATOM 0 HG LEU B 22 -16.056 7.337 0.297 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -17.566 9.298 0.110 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -17.426 8.414 -1.428 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -18.878 8.218 -0.418 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -17.307 8.155 2.248 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -18.629 7.028 1.862 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -17.026 6.399 2.311 1.00 0.00 H new ATOM 1405 N SER B 23 -18.506 3.107 -1.249 1.00 0.00 N ATOM 1406 CA SER B 23 -19.325 2.273 -2.120 1.00 0.00 C ATOM 1407 C SER B 23 -20.072 1.191 -1.327 1.00 0.00 C ATOM 1408 O SER B 23 -21.280 1.017 -1.497 1.00 0.00 O ATOM 1409 CB SER B 23 -18.475 1.639 -3.227 1.00 0.00 C ATOM 1410 OG SER B 23 -18.191 2.582 -4.247 1.00 0.00 O ATOM 0 H SER B 23 -17.501 2.953 -1.329 1.00 0.00 H new ATOM 0 HA SER B 23 -20.070 2.919 -2.584 1.00 0.00 H new ATOM 0 HB2 SER B 23 -17.544 1.261 -2.805 1.00 0.00 H new ATOM 0 HB3 SER B 23 -19.002 0.785 -3.652 1.00 0.00 H new ATOM 0 HG SER B 23 -17.221 2.704 -4.319 1.00 0.00 H new ATOM 1416 N SER B 24 -19.365 0.461 -0.461 1.00 0.00 N ATOM 1417 CA SER B 24 -19.993 -0.597 0.334 1.00 0.00 C ATOM 1418 C SER B 24 -21.014 -0.043 1.309 1.00 0.00 C ATOM 1419 O SER B 24 -22.187 -0.410 1.263 1.00 0.00 O ATOM 1420 CB SER B 24 -18.951 -1.394 1.102 1.00 0.00 C ATOM 1421 OG SER B 24 -19.553 -2.169 2.125 1.00 0.00 O ATOM 0 H SER B 24 -18.366 0.581 -0.293 1.00 0.00 H new ATOM 0 HA SER B 24 -20.506 -1.252 -0.370 1.00 0.00 H new ATOM 0 HB2 SER B 24 -18.411 -2.047 0.417 1.00 0.00 H new ATOM 0 HB3 SER B 24 -18.219 -0.715 1.539 1.00 0.00 H new ATOM 0 HG SER B 24 -20.524 -2.037 2.107 1.00 0.00 H new ATOM 1427 N ALA B 25 -20.555 0.826 2.202 1.00 0.00 N ATOM 1428 CA ALA B 25 -21.429 1.436 3.188 1.00 0.00 C ATOM 1429 C ALA B 25 -22.669 1.964 2.493 1.00 0.00 C ATOM 1430 O ALA B 25 -23.767 1.946 3.044 1.00 0.00 O ATOM 1431 CB ALA B 25 -20.702 2.557 3.928 1.00 0.00 C ATOM 0 H ALA B 25 -19.581 1.122 2.261 1.00 0.00 H new ATOM 0 HA ALA B 25 -21.723 0.689 3.925 1.00 0.00 H new ATOM 0 HB1 ALA B 25 -21.373 3.002 4.663 1.00 0.00 H new ATOM 0 HB2 ALA B 25 -19.827 2.151 4.435 1.00 0.00 H new ATOM 0 HB3 ALA B 25 -20.387 3.319 3.215 1.00 0.00 H new ATOM 1437 N ALA B 26 -22.477 2.394 1.251 1.00 0.00 N ATOM 1438 CA ALA B 26 -23.565 2.932 0.447 1.00 0.00 C ATOM 1439 C ALA B 26 -24.653 1.895 0.188 1.00 0.00 C ATOM 1440 O ALA B 26 -25.839 2.225 0.228 1.00 0.00 O ATOM 1441 CB ALA B 26 -23.040 3.481 -0.873 1.00 0.00 C ATOM 0 H ALA B 26 -21.573 2.380 0.778 1.00 0.00 H new ATOM 0 HA ALA B 26 -24.012 3.745 1.019 1.00 0.00 H new ATOM 0 HB1 ALA B 26 -23.870 3.878 -1.458 1.00 0.00 H new ATOM 0 HB2 ALA B 26 -22.322 4.277 -0.676 1.00 0.00 H new ATOM 0 HB3 ALA B 26 -22.552 2.682 -1.431 1.00 0.00 H new ATOM 1447 N ASN B 27 -24.272 0.641 -0.075 1.00 0.00 N ATOM 1448 CA ASN B 27 -25.286 -0.379 -0.346 1.00 0.00 C ATOM 1449 C ASN B 27 -24.798 -1.828 -0.207 1.00 0.00 C ATOM 1450 O ASN B 27 -25.551 -2.678 0.273 1.00 0.00 O ATOM 1451 CB ASN B 27 -25.865 -0.176 -1.749 1.00 0.00 C ATOM 1452 CG ASN B 27 -24.831 0.284 -2.766 1.00 0.00 C ATOM 1453 OD1 ASN B 27 -23.557 0.006 -2.504 1.00 0.00 O flip ATOM 1454 ND2 ASN B 27 -25.177 0.896 -3.778 1.00 0.00 N flip ATOM 0 H ASN B 27 -23.305 0.317 -0.106 1.00 0.00 H new ATOM 0 HA ASN B 27 -26.046 -0.242 0.423 1.00 0.00 H new ATOM 0 HB2 ASN B 27 -26.309 -1.111 -2.090 1.00 0.00 H new ATOM 0 HB3 ASN B 27 -26.668 0.559 -1.700 1.00 0.00 H new ATOM 0 HD21 ASN B 27 -26.164 1.090 -3.944 1.00 0.00 H new ATOM 0 HD22 ASN B 27 -24.476 1.208 -4.450 1.00 0.00 H new ATOM 1461 N CYS B 28 -23.560 -2.126 -0.606 1.00 0.00 N ATOM 1462 CA CYS B 28 -23.074 -3.507 -0.547 1.00 0.00 C ATOM 1463 C CYS B 28 -21.599 -3.617 -0.915 1.00 0.00 C ATOM 1464 O CYS B 28 -21.025 -2.699 -1.472 1.00 0.00 O ATOM 1465 CB CYS B 28 -23.906 -4.360 -1.513 1.00 0.00 C ATOM 1466 SG CYS B 28 -22.999 -5.691 -2.356 1.00 0.00 S ATOM 0 H CYS B 28 -22.889 -1.448 -0.966 1.00 0.00 H new ATOM 0 HA CYS B 28 -23.179 -3.861 0.479 1.00 0.00 H new ATOM 0 HB2 CYS B 28 -24.735 -4.802 -0.959 1.00 0.00 H new ATOM 0 HB3 CYS B 28 -24.340 -3.705 -2.268 1.00 0.00 H new ATOM 1471 N ASP B 29 -20.997 -4.754 -0.587 1.00 0.00 N ATOM 1472 CA ASP B 29 -19.593 -5.018 -0.905 1.00 0.00 C ATOM 1473 C ASP B 29 -19.487 -6.128 -1.932 1.00 0.00 C ATOM 1474 O ASP B 29 -20.380 -6.968 -2.033 1.00 0.00 O ATOM 1475 CB ASP B 29 -18.852 -5.476 0.341 1.00 0.00 C ATOM 1476 CG ASP B 29 -17.371 -5.241 0.277 1.00 0.00 C ATOM 1477 OD1 ASP B 29 -16.689 -5.971 -0.464 1.00 0.00 O ATOM 1478 OD2 ASP B 29 -16.887 -4.342 0.991 1.00 0.00 O ATOM 0 H ASP B 29 -21.463 -5.517 -0.096 1.00 0.00 H new ATOM 0 HA ASP B 29 -19.159 -4.097 -1.293 1.00 0.00 H new ATOM 0 HB2 ASP B 29 -19.258 -4.954 1.208 1.00 0.00 H new ATOM 0 HB3 ASP B 29 -19.037 -6.539 0.494 1.00 0.00 H new ATOM 1483 N TRP B 30 -18.398 -6.149 -2.692 1.00 0.00 N ATOM 1484 CA TRP B 30 -18.222 -7.226 -3.654 1.00 0.00 C ATOM 1485 C TRP B 30 -17.792 -8.471 -2.888 1.00 0.00 C ATOM 1486 O TRP B 30 -18.275 -9.569 -3.153 1.00 0.00 O ATOM 1487 CB TRP B 30 -17.220 -6.882 -4.781 1.00 0.00 C ATOM 1488 CG TRP B 30 -15.888 -6.398 -4.344 1.00 0.00 C ATOM 1489 CD1 TRP B 30 -14.941 -7.030 -3.592 1.00 0.00 C ATOM 1490 CD2 TRP B 30 -15.351 -5.141 -4.698 1.00 0.00 C ATOM 1491 NE1 TRP B 30 -13.860 -6.197 -3.421 1.00 0.00 N ATOM 1492 CE2 TRP B 30 -14.101 -5.028 -4.098 1.00 0.00 C ATOM 1493 CE3 TRP B 30 -15.837 -4.086 -5.461 1.00 0.00 C ATOM 1494 CZ2 TRP B 30 -13.329 -3.891 -4.238 1.00 0.00 C ATOM 1495 CZ3 TRP B 30 -15.073 -2.962 -5.607 1.00 0.00 C ATOM 1496 CH2 TRP B 30 -13.832 -2.866 -4.997 1.00 0.00 C ATOM 0 H TRP B 30 -17.648 -5.458 -2.664 1.00 0.00 H new ATOM 0 HA TRP B 30 -19.170 -7.397 -4.164 1.00 0.00 H new ATOM 0 HB2 TRP B 30 -17.077 -7.770 -5.396 1.00 0.00 H new ATOM 0 HB3 TRP B 30 -17.669 -6.121 -5.419 1.00 0.00 H new ATOM 0 HD1 TRP B 30 -15.027 -8.030 -3.193 1.00 0.00 H new ATOM 0 HE1 TRP B 30 -13.021 -6.412 -2.882 1.00 0.00 H new ATOM 0 HE3 TRP B 30 -16.806 -4.153 -5.933 1.00 0.00 H new ATOM 0 HZ2 TRP B 30 -12.361 -3.812 -3.765 1.00 0.00 H new ATOM 0 HZ3 TRP B 30 -15.440 -2.140 -6.204 1.00 0.00 H new ATOM 0 HH2 TRP B 30 -13.249 -1.965 -5.122 1.00 0.00 H new ATOM 1507 N ALA B 31 -16.943 -8.240 -1.873 1.00 0.00 N ATOM 1508 CA ALA B 31 -16.403 -9.286 -0.994 1.00 0.00 C ATOM 1509 C ALA B 31 -15.579 -10.341 -1.747 1.00 0.00 C ATOM 1510 O ALA B 31 -14.494 -10.725 -1.316 1.00 0.00 O ATOM 1511 CB ALA B 31 -17.542 -9.936 -0.231 1.00 0.00 C ATOM 0 H ALA B 31 -16.608 -7.306 -1.638 1.00 0.00 H new ATOM 0 HA ALA B 31 -15.713 -8.808 -0.299 1.00 0.00 H new ATOM 0 HB1 ALA B 31 -17.145 -10.713 0.423 1.00 0.00 H new ATOM 0 HB2 ALA B 31 -18.054 -9.184 0.369 1.00 0.00 H new ATOM 0 HB3 ALA B 31 -18.246 -10.379 -0.936 1.00 0.00 H new ATOM 1517 N ALA B 32 -16.101 -10.814 -2.861 1.00 0.00 N ATOM 1518 CA ALA B 32 -15.421 -11.827 -3.655 1.00 0.00 C ATOM 1519 C ALA B 32 -14.144 -11.285 -4.291 1.00 0.00 C ATOM 1520 O ALA B 32 -13.114 -11.964 -4.314 1.00 0.00 O ATOM 1521 CB ALA B 32 -16.356 -12.365 -4.728 1.00 0.00 C ATOM 0 H ALA B 32 -16.998 -10.513 -3.241 1.00 0.00 H new ATOM 0 HA ALA B 32 -15.136 -12.638 -2.985 1.00 0.00 H new ATOM 0 HB1 ALA B 32 -15.837 -13.122 -5.316 1.00 0.00 H new ATOM 0 HB2 ALA B 32 -17.233 -12.809 -4.257 1.00 0.00 H new ATOM 0 HB3 ALA B 32 -16.668 -11.550 -5.381 1.00 0.00 H new ATOM 1527 N CYS B 33 -14.208 -10.059 -4.798 1.00 0.00 N ATOM 1528 CA CYS B 33 -13.053 -9.458 -5.451 1.00 0.00 C ATOM 1529 C CYS B 33 -11.921 -9.182 -4.480 1.00 0.00 C ATOM 1530 O CYS B 33 -10.777 -9.493 -4.766 1.00 0.00 O ATOM 1531 CB CYS B 33 -13.425 -8.172 -6.170 1.00 0.00 C ATOM 1532 SG CYS B 33 -12.829 -8.118 -7.897 1.00 0.00 S ATOM 0 H CYS B 33 -15.039 -9.468 -4.770 1.00 0.00 H new ATOM 0 HA CYS B 33 -12.707 -10.189 -6.182 1.00 0.00 H new ATOM 0 HB2 CYS B 33 -14.509 -8.059 -6.162 1.00 0.00 H new ATOM 0 HB3 CYS B 33 -13.012 -7.324 -5.623 1.00 0.00 H new ATOM 1537 N LEU B 34 -12.216 -8.590 -3.341 1.00 0.00 N ATOM 1538 CA LEU B 34 -11.156 -8.303 -2.396 1.00 0.00 C ATOM 1539 C LEU B 34 -10.350 -9.562 -2.116 1.00 0.00 C ATOM 1540 O LEU B 34 -9.123 -9.524 -2.074 1.00 0.00 O ATOM 1541 CB LEU B 34 -11.697 -7.671 -1.124 1.00 0.00 C ATOM 1542 CG LEU B 34 -13.082 -8.145 -0.716 1.00 0.00 C ATOM 1543 CD1 LEU B 34 -12.972 -9.217 0.355 1.00 0.00 C ATOM 1544 CD2 LEU B 34 -13.921 -6.976 -0.238 1.00 0.00 C ATOM 0 H LEU B 34 -13.152 -8.305 -3.052 1.00 0.00 H new ATOM 0 HA LEU B 34 -10.484 -7.568 -2.840 1.00 0.00 H new ATOM 0 HB2 LEU B 34 -11.003 -7.877 -0.309 1.00 0.00 H new ATOM 0 HB3 LEU B 34 -11.723 -6.589 -1.255 1.00 0.00 H new ATOM 0 HG LEU B 34 -13.579 -8.580 -1.583 1.00 0.00 H new ATOM 0 HD11 LEU B 34 -13.970 -9.550 0.640 1.00 0.00 H new ATOM 0 HD12 LEU B 34 -12.405 -10.063 -0.034 1.00 0.00 H new ATOM 0 HD13 LEU B 34 -12.462 -8.809 1.228 1.00 0.00 H new ATOM 0 HD21 LEU B 34 -14.910 -7.332 0.051 1.00 0.00 H new ATOM 0 HD22 LEU B 34 -13.439 -6.509 0.621 1.00 0.00 H new ATOM 0 HD23 LEU B 34 -14.018 -6.246 -1.041 1.00 0.00 H new ATOM 1556 N SER B 35 -11.034 -10.683 -1.953 1.00 0.00 N ATOM 1557 CA SER B 35 -10.341 -11.944 -1.737 1.00 0.00 C ATOM 1558 C SER B 35 -9.333 -12.153 -2.863 1.00 0.00 C ATOM 1559 O SER B 35 -8.244 -12.683 -2.658 1.00 0.00 O ATOM 1560 CB SER B 35 -11.340 -13.098 -1.724 1.00 0.00 C ATOM 1561 OG SER B 35 -10.692 -14.333 -1.467 1.00 0.00 O ATOM 0 H SER B 35 -12.052 -10.747 -1.966 1.00 0.00 H new ATOM 0 HA SER B 35 -9.827 -11.915 -0.776 1.00 0.00 H new ATOM 0 HB2 SER B 35 -12.099 -12.917 -0.963 1.00 0.00 H new ATOM 0 HB3 SER B 35 -11.856 -13.147 -2.683 1.00 0.00 H new ATOM 0 HG SER B 35 -11.354 -15.055 -1.463 1.00 0.00 H new ATOM 1567 N SER B 36 -9.734 -11.714 -4.054 1.00 0.00 N ATOM 1568 CA SER B 36 -8.911 -11.815 -5.266 1.00 0.00 C ATOM 1569 C SER B 36 -7.494 -11.247 -5.070 1.00 0.00 C ATOM 1570 O SER B 36 -6.512 -11.889 -5.444 1.00 0.00 O ATOM 1571 CB SER B 36 -9.609 -11.097 -6.428 1.00 0.00 C ATOM 1572 OG SER B 36 -9.271 -11.685 -7.673 1.00 0.00 O ATOM 0 H SER B 36 -10.642 -11.276 -4.210 1.00 0.00 H new ATOM 0 HA SER B 36 -8.800 -12.875 -5.494 1.00 0.00 H new ATOM 0 HB2 SER B 36 -10.689 -11.136 -6.286 1.00 0.00 H new ATOM 0 HB3 SER B 36 -9.325 -10.045 -6.431 1.00 0.00 H new ATOM 0 HG SER B 36 -9.731 -11.209 -8.395 1.00 0.00 H new ATOM 1578 N LEU B 37 -7.378 -10.043 -4.501 1.00 0.00 N ATOM 1579 CA LEU B 37 -6.048 -9.448 -4.276 1.00 0.00 C ATOM 1580 C LEU B 37 -5.293 -10.333 -3.323 1.00 0.00 C ATOM 1581 O LEU B 37 -4.160 -10.736 -3.576 1.00 0.00 O ATOM 1582 CB LEU B 37 -6.115 -8.029 -3.692 1.00 0.00 C ATOM 1583 CG LEU B 37 -4.848 -7.571 -2.973 1.00 0.00 C ATOM 1584 CD1 LEU B 37 -3.712 -7.374 -3.957 1.00 0.00 C ATOM 1585 CD2 LEU B 37 -5.096 -6.307 -2.188 1.00 0.00 C ATOM 0 H LEU B 37 -8.164 -9.470 -4.193 1.00 0.00 H new ATOM 0 HA LEU B 37 -5.550 -9.371 -5.243 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -6.331 -7.329 -4.499 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -6.951 -7.978 -2.994 1.00 0.00 H new ATOM 0 HG LEU B 37 -4.561 -8.354 -2.271 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -2.820 -7.048 -3.422 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -3.505 -8.315 -4.467 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -3.993 -6.618 -4.690 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -4.177 -6.004 -1.686 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -5.418 -5.516 -2.865 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -5.873 -6.487 -1.445 1.00 0.00 H new ATOM 1597 N SER B 38 -5.950 -10.624 -2.214 1.00 0.00 N ATOM 1598 CA SER B 38 -5.396 -11.486 -1.194 1.00 0.00 C ATOM 1599 C SER B 38 -5.268 -12.912 -1.732 1.00 0.00 C ATOM 1600 O SER B 38 -4.823 -13.822 -1.033 1.00 0.00 O ATOM 1601 CB SER B 38 -6.293 -11.446 0.045 1.00 0.00 C ATOM 1602 OG SER B 38 -6.766 -12.738 0.383 1.00 0.00 O ATOM 0 H SER B 38 -6.881 -10.268 -1.999 1.00 0.00 H new ATOM 0 HA SER B 38 -4.401 -11.138 -0.916 1.00 0.00 H new ATOM 0 HB2 SER B 38 -5.737 -11.029 0.885 1.00 0.00 H new ATOM 0 HB3 SER B 38 -7.139 -10.783 -0.138 1.00 0.00 H new ATOM 0 HG SER B 38 -7.456 -12.663 1.075 1.00 0.00 H new ATOM 1608 N ALA B 39 -5.663 -13.082 -2.992 1.00 0.00 N ATOM 1609 CA ALA B 39 -5.606 -14.376 -3.665 1.00 0.00 C ATOM 1610 C ALA B 39 -4.428 -14.427 -4.634 1.00 0.00 C ATOM 1611 O ALA B 39 -4.083 -15.496 -5.138 1.00 0.00 O ATOM 1612 CB ALA B 39 -6.912 -14.651 -4.398 1.00 0.00 C ATOM 0 H ALA B 39 -6.030 -12.328 -3.573 1.00 0.00 H new ATOM 0 HA ALA B 39 -5.462 -15.150 -2.911 1.00 0.00 H new ATOM 0 HB1 ALA B 39 -6.854 -15.620 -4.895 1.00 0.00 H new ATOM 0 HB2 ALA B 39 -7.735 -14.659 -3.684 1.00 0.00 H new ATOM 0 HB3 ALA B 39 -7.083 -13.872 -5.141 1.00 0.00 H new ATOM 1618 N SER B 40 -3.847 -13.247 -4.894 1.00 0.00 N ATOM 1619 CA SER B 40 -2.674 -13.087 -5.771 1.00 0.00 C ATOM 1620 C SER B 40 -3.041 -12.788 -7.219 1.00 0.00 C ATOM 1621 O SER B 40 -3.838 -13.493 -7.838 1.00 0.00 O ATOM 1622 CB SER B 40 -1.754 -14.315 -5.722 1.00 0.00 C ATOM 1623 OG SER B 40 -2.132 -15.278 -6.690 1.00 0.00 O ATOM 0 H SER B 40 -4.180 -12.368 -4.499 1.00 0.00 H new ATOM 0 HA SER B 40 -2.142 -12.221 -5.378 1.00 0.00 H new ATOM 0 HB2 SER B 40 -0.723 -14.007 -5.895 1.00 0.00 H new ATOM 0 HB3 SER B 40 -1.791 -14.761 -4.728 1.00 0.00 H new ATOM 0 HG SER B 40 -3.085 -15.483 -6.592 1.00 0.00 H new ATOM 1629 N SER B 41 -2.441 -11.719 -7.742 1.00 0.00 N ATOM 1630 CA SER B 41 -2.631 -11.314 -9.127 1.00 0.00 C ATOM 1631 C SER B 41 -1.271 -11.186 -9.785 1.00 0.00 C ATOM 1632 O SER B 41 -0.326 -10.686 -9.180 1.00 0.00 O ATOM 1633 CB SER B 41 -3.364 -9.976 -9.240 1.00 0.00 C ATOM 1634 OG SER B 41 -4.171 -9.935 -10.405 1.00 0.00 O ATOM 0 H SER B 41 -1.812 -11.113 -7.216 1.00 0.00 H new ATOM 0 HA SER B 41 -3.241 -12.071 -9.620 1.00 0.00 H new ATOM 0 HB2 SER B 41 -3.985 -9.822 -8.358 1.00 0.00 H new ATOM 0 HB3 SER B 41 -2.640 -9.162 -9.266 1.00 0.00 H new ATOM 0 HG SER B 41 -4.631 -9.071 -10.454 1.00 0.00 H new ATOM 1640 N ALA B 42 -1.180 -11.629 -11.022 1.00 0.00 N ATOM 1641 CA ALA B 42 0.073 -11.572 -11.770 1.00 0.00 C ATOM 1642 C ALA B 42 0.571 -10.139 -11.892 1.00 0.00 C ATOM 1643 O ALA B 42 1.694 -9.890 -12.333 1.00 0.00 O ATOM 1644 CB ALA B 42 -0.115 -12.178 -13.149 1.00 0.00 C ATOM 0 H ALA B 42 -1.960 -12.036 -11.539 1.00 0.00 H new ATOM 0 HA ALA B 42 0.821 -12.147 -11.225 1.00 0.00 H new ATOM 0 HB1 ALA B 42 0.825 -12.131 -13.699 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -0.425 -13.218 -13.050 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -0.880 -11.621 -13.690 1.00 0.00 H new ATOM 1650 N ALA B 43 -0.273 -9.204 -11.483 1.00 0.00 N ATOM 1651 CA ALA B 43 0.045 -7.791 -11.573 1.00 0.00 C ATOM 1652 C ALA B 43 0.804 -7.271 -10.366 1.00 0.00 C ATOM 1653 O ALA B 43 1.928 -6.807 -10.506 1.00 0.00 O ATOM 1654 CB ALA B 43 -1.239 -6.998 -11.774 1.00 0.00 C ATOM 0 H ALA B 43 -1.190 -9.403 -11.083 1.00 0.00 H new ATOM 0 HA ALA B 43 0.708 -7.661 -12.428 1.00 0.00 H new ATOM 0 HB1 ALA B 43 -1.004 -5.936 -11.842 1.00 0.00 H new ATOM 0 HB2 ALA B 43 -1.726 -7.321 -12.694 1.00 0.00 H new ATOM 0 HB3 ALA B 43 -1.908 -7.168 -10.930 1.00 0.00 H new ATOM 1660 N CYS B 44 0.199 -7.355 -9.191 1.00 0.00 N ATOM 1661 CA CYS B 44 0.825 -6.859 -7.971 1.00 0.00 C ATOM 1662 C CYS B 44 2.313 -7.190 -7.904 1.00 0.00 C ATOM 1663 O CYS B 44 3.106 -6.422 -7.358 1.00 0.00 O ATOM 1664 CB CYS B 44 0.090 -7.388 -6.746 1.00 0.00 C ATOM 1665 SG CYS B 44 -1.045 -8.773 -7.091 1.00 0.00 S ATOM 0 H CYS B 44 -0.726 -7.762 -9.055 1.00 0.00 H new ATOM 0 HA CYS B 44 0.749 -5.772 -7.985 1.00 0.00 H new ATOM 0 HB2 CYS B 44 0.824 -7.711 -6.008 1.00 0.00 H new ATOM 0 HB3 CYS B 44 -0.477 -6.573 -6.297 1.00 0.00 H new ATOM 1670 N ILE B 45 2.689 -8.326 -8.458 1.00 0.00 N ATOM 1671 CA ILE B 45 4.084 -8.733 -8.464 1.00 0.00 C ATOM 1672 C ILE B 45 4.833 -8.089 -9.629 1.00 0.00 C ATOM 1673 O ILE B 45 5.924 -7.493 -9.464 1.00 0.00 O ATOM 1674 CB ILE B 45 4.237 -10.263 -8.509 1.00 0.00 C ATOM 1675 CG1 ILE B 45 2.951 -10.945 -8.042 1.00 0.00 C ATOM 1676 CG2 ILE B 45 5.407 -10.694 -7.637 1.00 0.00 C ATOM 1677 CD1 ILE B 45 2.278 -11.769 -9.119 1.00 0.00 C ATOM 0 H ILE B 45 2.052 -8.983 -8.909 1.00 0.00 H new ATOM 0 HA ILE B 45 4.523 -8.385 -7.529 1.00 0.00 H new ATOM 0 HB ILE B 45 4.432 -10.564 -9.538 1.00 0.00 H new ATOM 0 HG12 ILE B 45 3.179 -11.589 -7.192 1.00 0.00 H new ATOM 0 HG13 ILE B 45 2.254 -10.185 -7.688 1.00 0.00 H new ATOM 0 HG21 ILE B 45 5.508 -11.779 -7.674 1.00 0.00 H new ATOM 0 HG22 ILE B 45 6.323 -10.231 -8.003 1.00 0.00 H new ATOM 0 HG23 ILE B 45 5.228 -10.382 -6.608 1.00 0.00 H new ATOM 0 HD11 ILE B 45 1.372 -12.223 -8.717 1.00 0.00 H new ATOM 0 HD12 ILE B 45 2.019 -11.126 -9.960 1.00 0.00 H new ATOM 0 HD13 ILE B 45 2.958 -12.552 -9.456 1.00 0.00 H new ATOM 1689 N ALA B 46 4.228 -8.163 -10.810 1.00 0.00 N ATOM 1690 CA ALA B 46 4.849 -7.560 -11.985 1.00 0.00 C ATOM 1691 C ALA B 46 5.030 -6.091 -11.665 1.00 0.00 C ATOM 1692 O ALA B 46 5.865 -5.364 -12.223 1.00 0.00 O ATOM 1693 CB ALA B 46 3.990 -7.760 -13.223 1.00 0.00 C ATOM 0 H ALA B 46 3.332 -8.621 -10.978 1.00 0.00 H new ATOM 0 HA ALA B 46 5.808 -8.028 -12.207 1.00 0.00 H new ATOM 0 HB1 ALA B 46 4.478 -7.300 -14.083 1.00 0.00 H new ATOM 0 HB2 ALA B 46 3.860 -8.826 -13.407 1.00 0.00 H new ATOM 0 HB3 ALA B 46 3.015 -7.297 -13.068 1.00 0.00 H new ATOM 1699 N ALA B 47 4.230 -5.698 -10.699 1.00 0.00 N ATOM 1700 CA ALA B 47 4.206 -4.364 -10.185 1.00 0.00 C ATOM 1701 C ALA B 47 5.477 -4.083 -9.417 1.00 0.00 C ATOM 1702 O ALA B 47 6.103 -3.041 -9.602 1.00 0.00 O ATOM 1703 CB ALA B 47 3.011 -4.223 -9.273 1.00 0.00 C ATOM 0 H ALA B 47 3.564 -6.321 -10.243 1.00 0.00 H new ATOM 0 HA ALA B 47 4.134 -3.651 -11.006 1.00 0.00 H new ATOM 0 HB1 ALA B 47 2.977 -3.210 -8.872 1.00 0.00 H new ATOM 0 HB2 ALA B 47 2.099 -4.421 -9.836 1.00 0.00 H new ATOM 0 HB3 ALA B 47 3.093 -4.936 -8.453 1.00 0.00 H new ATOM 1709 N VAL B 48 5.870 -5.043 -8.581 1.00 0.00 N ATOM 1710 CA VAL B 48 7.066 -4.900 -7.761 1.00 0.00 C ATOM 1711 C VAL B 48 8.161 -4.241 -8.552 1.00 0.00 C ATOM 1712 O VAL B 48 8.908 -3.407 -8.041 1.00 0.00 O ATOM 1713 CB VAL B 48 7.586 -6.272 -7.277 1.00 0.00 C ATOM 1714 CG1 VAL B 48 8.842 -6.121 -6.439 1.00 0.00 C ATOM 1715 CG2 VAL B 48 6.522 -7.016 -6.499 1.00 0.00 C ATOM 0 H VAL B 48 5.376 -5.927 -8.456 1.00 0.00 H new ATOM 0 HA VAL B 48 6.794 -4.291 -6.899 1.00 0.00 H new ATOM 0 HB VAL B 48 7.835 -6.856 -8.163 1.00 0.00 H new ATOM 0 HG11 VAL B 48 9.183 -7.104 -6.114 1.00 0.00 H new ATOM 0 HG12 VAL B 48 9.621 -5.645 -7.034 1.00 0.00 H new ATOM 0 HG13 VAL B 48 8.625 -5.505 -5.566 1.00 0.00 H new ATOM 0 HG21 VAL B 48 6.917 -7.978 -6.171 1.00 0.00 H new ATOM 0 HG22 VAL B 48 6.230 -6.428 -5.629 1.00 0.00 H new ATOM 0 HG23 VAL B 48 5.652 -7.179 -7.136 1.00 0.00 H new ATOM 1725 N GLY B 49 8.248 -4.623 -9.801 1.00 0.00 N ATOM 1726 CA GLY B 49 9.279 -4.061 -10.654 1.00 0.00 C ATOM 1727 C GLY B 49 8.927 -2.767 -11.382 1.00 0.00 C ATOM 1728 O GLY B 49 9.827 -2.011 -11.738 1.00 0.00 O ATOM 0 H GLY B 49 7.635 -5.305 -10.248 1.00 0.00 H new ATOM 0 HA2 GLY B 49 10.165 -3.880 -10.045 1.00 0.00 H new ATOM 0 HA3 GLY B 49 9.551 -4.809 -11.399 1.00 0.00 H new ATOM 1732 N GLU B 50 7.649 -2.473 -11.581 1.00 0.00 N ATOM 1733 CA GLU B 50 7.282 -1.305 -12.393 1.00 0.00 C ATOM 1734 C GLU B 50 6.884 0.015 -11.681 1.00 0.00 C ATOM 1735 O GLU B 50 6.068 0.743 -12.228 1.00 0.00 O ATOM 1736 CB GLU B 50 6.250 -1.676 -13.444 1.00 0.00 C ATOM 1737 CG GLU B 50 6.247 -0.697 -14.600 1.00 0.00 C ATOM 1738 CD GLU B 50 7.082 -1.169 -15.774 1.00 0.00 C ATOM 1739 OE1 GLU B 50 6.574 -1.982 -16.574 1.00 0.00 O ATOM 1740 OE2 GLU B 50 8.245 -0.728 -15.892 1.00 0.00 O ATOM 0 H GLU B 50 6.864 -3.006 -11.206 1.00 0.00 H new ATOM 0 HA GLU B 50 8.241 -1.041 -12.840 1.00 0.00 H new ATOM 0 HB2 GLU B 50 6.456 -2.679 -13.818 1.00 0.00 H new ATOM 0 HB3 GLU B 50 5.260 -1.703 -12.988 1.00 0.00 H new ATOM 0 HG2 GLU B 50 5.221 -0.537 -14.931 1.00 0.00 H new ATOM 0 HG3 GLU B 50 6.625 0.266 -14.255 1.00 0.00 H new ATOM 1747 N LEU B 51 7.307 0.266 -10.437 1.00 0.00 N ATOM 1748 CA LEU B 51 7.044 1.577 -9.775 1.00 0.00 C ATOM 1749 C LEU B 51 5.987 1.486 -8.719 1.00 0.00 C ATOM 1750 O LEU B 51 4.777 1.366 -9.002 1.00 0.00 O ATOM 1751 CB LEU B 51 6.706 2.705 -10.738 1.00 0.00 C ATOM 1752 CG LEU B 51 6.865 4.108 -10.152 1.00 0.00 C ATOM 1753 CD1 LEU B 51 8.331 4.440 -9.893 1.00 0.00 C ATOM 1754 CD2 LEU B 51 6.220 5.150 -11.053 1.00 0.00 C ATOM 0 H LEU B 51 7.826 -0.400 -9.865 1.00 0.00 H new ATOM 0 HA LEU B 51 7.995 1.827 -9.305 1.00 0.00 H new ATOM 0 HB2 LEU B 51 7.344 2.618 -11.618 1.00 0.00 H new ATOM 0 HB3 LEU B 51 5.677 2.581 -11.076 1.00 0.00 H new ATOM 0 HG LEU B 51 6.349 4.126 -9.192 1.00 0.00 H new ATOM 0 HD11 LEU B 51 8.409 5.444 -9.477 1.00 0.00 H new ATOM 0 HD12 LEU B 51 8.748 3.721 -9.187 1.00 0.00 H new ATOM 0 HD13 LEU B 51 8.886 4.392 -10.830 1.00 0.00 H new ATOM 0 HD21 LEU B 51 6.347 6.139 -10.614 1.00 0.00 H new ATOM 0 HD22 LEU B 51 6.693 5.125 -12.035 1.00 0.00 H new ATOM 0 HD23 LEU B 51 5.157 4.933 -11.157 1.00 0.00 H new ATOM 1766 N GLY B 52 6.498 1.578 -7.493 1.00 0.00 N ATOM 1767 CA GLY B 52 5.717 1.462 -6.299 1.00 0.00 C ATOM 1768 C GLY B 52 4.809 0.306 -6.411 1.00 0.00 C ATOM 1769 O GLY B 52 3.868 0.150 -5.636 1.00 0.00 O ATOM 0 H GLY B 52 7.490 1.739 -7.316 1.00 0.00 H new ATOM 0 HA2 GLY B 52 6.371 1.341 -5.435 1.00 0.00 H new ATOM 0 HA3 GLY B 52 5.142 2.374 -6.138 1.00 0.00 H new ATOM 1773 N LEU B 53 5.144 -0.502 -7.401 1.00 0.00 N ATOM 1774 CA LEU B 53 4.427 -1.681 -7.752 1.00 0.00 C ATOM 1775 C LEU B 53 3.427 -1.320 -8.830 1.00 0.00 C ATOM 1776 O LEU B 53 2.229 -1.529 -8.653 1.00 0.00 O ATOM 1777 CB LEU B 53 3.743 -2.341 -6.548 1.00 0.00 C ATOM 1778 CG LEU B 53 4.641 -2.694 -5.343 1.00 0.00 C ATOM 1779 CD1 LEU B 53 4.403 -4.130 -4.895 1.00 0.00 C ATOM 1780 CD2 LEU B 53 6.118 -2.465 -5.655 1.00 0.00 C ATOM 0 H LEU B 53 5.956 -0.335 -7.995 1.00 0.00 H new ATOM 0 HA LEU B 53 5.131 -2.424 -8.125 1.00 0.00 H new ATOM 0 HB2 LEU B 53 2.953 -1.676 -6.199 1.00 0.00 H new ATOM 0 HB3 LEU B 53 3.260 -3.256 -6.891 1.00 0.00 H new ATOM 0 HG LEU B 53 4.370 -2.026 -4.525 1.00 0.00 H new ATOM 0 HD11 LEU B 53 5.046 -4.357 -4.045 1.00 0.00 H new ATOM 0 HD12 LEU B 53 3.360 -4.252 -4.604 1.00 0.00 H new ATOM 0 HD13 LEU B 53 4.632 -4.810 -5.715 1.00 0.00 H new ATOM 0 HD21 LEU B 53 6.719 -2.724 -4.783 1.00 0.00 H new ATOM 0 HD22 LEU B 53 6.413 -3.090 -6.498 1.00 0.00 H new ATOM 0 HD23 LEU B 53 6.278 -1.417 -5.907 1.00 0.00 H new ATOM 1792 N ASP B 54 3.935 -0.765 -9.955 1.00 0.00 N ATOM 1793 CA ASP B 54 3.076 -0.363 -11.065 1.00 0.00 C ATOM 1794 C ASP B 54 1.651 -0.310 -10.605 1.00 0.00 C ATOM 1795 O ASP B 54 0.991 -1.338 -10.539 1.00 0.00 O ATOM 1796 CB ASP B 54 3.158 -1.357 -12.208 1.00 0.00 C ATOM 1797 CG ASP B 54 3.093 -0.688 -13.568 1.00 0.00 C ATOM 1798 OD1 ASP B 54 3.571 0.460 -13.689 1.00 0.00 O ATOM 1799 OD2 ASP B 54 2.565 -1.312 -14.512 1.00 0.00 O ATOM 0 H ASP B 54 4.929 -0.591 -10.106 1.00 0.00 H new ATOM 0 HA ASP B 54 3.413 0.615 -11.408 1.00 0.00 H new ATOM 0 HB2 ASP B 54 4.087 -1.921 -12.128 1.00 0.00 H new ATOM 0 HB3 ASP B 54 2.342 -2.074 -12.120 1.00 0.00 H new ATOM 1804 N VAL B 55 1.176 0.864 -10.261 1.00 0.00 N ATOM 1805 CA VAL B 55 -0.201 0.967 -9.793 1.00 0.00 C ATOM 1806 C VAL B 55 -1.164 0.165 -10.660 1.00 0.00 C ATOM 1807 O VAL B 55 -2.034 -0.510 -10.106 1.00 0.00 O ATOM 1808 CB VAL B 55 -0.720 2.410 -9.642 1.00 0.00 C ATOM 1809 CG1 VAL B 55 -1.349 2.922 -10.932 1.00 0.00 C ATOM 1810 CG2 VAL B 55 -1.704 2.451 -8.477 1.00 0.00 C ATOM 0 H VAL B 55 1.697 1.740 -10.291 1.00 0.00 H new ATOM 0 HA VAL B 55 -0.170 0.538 -8.792 1.00 0.00 H new ATOM 0 HB VAL B 55 0.117 3.076 -9.432 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -1.703 3.942 -10.784 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -0.606 2.907 -11.730 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -2.189 2.283 -11.206 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -2.082 3.466 -8.355 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -2.536 1.776 -8.679 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -1.199 2.140 -7.563 1.00 0.00 H new ATOM 1820 N PRO B 56 -1.022 0.179 -12.021 1.00 0.00 N ATOM 1821 CA PRO B 56 -1.925 -0.573 -12.889 1.00 0.00 C ATOM 1822 C PRO B 56 -1.815 -2.051 -12.588 1.00 0.00 C ATOM 1823 O PRO B 56 -2.656 -2.852 -12.995 1.00 0.00 O ATOM 1824 CB PRO B 56 -1.432 -0.268 -14.310 1.00 0.00 C ATOM 1825 CG PRO B 56 -0.593 0.954 -14.173 1.00 0.00 C ATOM 1826 CD PRO B 56 0.027 0.858 -12.812 1.00 0.00 C ATOM 0 HA PRO B 56 -2.971 -0.300 -12.752 1.00 0.00 H new ATOM 0 HB2 PRO B 56 -0.855 -1.100 -14.714 1.00 0.00 H new ATOM 0 HB3 PRO B 56 -2.267 -0.099 -14.990 1.00 0.00 H new ATOM 0 HG2 PRO B 56 0.170 0.996 -14.950 1.00 0.00 H new ATOM 0 HG3 PRO B 56 -1.196 1.857 -14.268 1.00 0.00 H new ATOM 0 HD2 PRO B 56 0.954 0.286 -12.830 1.00 0.00 H new ATOM 0 HD3 PRO B 56 0.267 1.841 -12.407 1.00 0.00 H new ATOM 1834 N LEU B 57 -0.720 -2.408 -11.933 1.00 0.00 N ATOM 1835 CA LEU B 57 -0.494 -3.774 -11.533 1.00 0.00 C ATOM 1836 C LEU B 57 -0.890 -4.037 -10.074 1.00 0.00 C ATOM 1837 O LEU B 57 -1.851 -4.747 -9.818 1.00 0.00 O ATOM 1838 CB LEU B 57 0.957 -4.176 -11.765 1.00 0.00 C ATOM 1839 CG LEU B 57 1.449 -4.084 -13.214 1.00 0.00 C ATOM 1840 CD1 LEU B 57 2.893 -4.542 -13.314 1.00 0.00 C ATOM 1841 CD2 LEU B 57 0.570 -4.914 -14.139 1.00 0.00 C ATOM 0 H LEU B 57 0.024 -1.762 -11.670 1.00 0.00 H new ATOM 0 HA LEU B 57 -1.140 -4.390 -12.159 1.00 0.00 H new ATOM 0 HB2 LEU B 57 1.593 -3.545 -11.144 1.00 0.00 H new ATOM 0 HB3 LEU B 57 1.090 -5.201 -11.420 1.00 0.00 H new ATOM 0 HG LEU B 57 1.388 -3.041 -13.526 1.00 0.00 H new ATOM 0 HD11 LEU B 57 3.227 -4.470 -14.349 1.00 0.00 H new ATOM 0 HD12 LEU B 57 3.520 -3.909 -12.686 1.00 0.00 H new ATOM 0 HD13 LEU B 57 2.971 -5.576 -12.978 1.00 0.00 H new ATOM 0 HD21 LEU B 57 0.939 -4.833 -15.161 1.00 0.00 H new ATOM 0 HD22 LEU B 57 0.596 -5.958 -13.826 1.00 0.00 H new ATOM 0 HD23 LEU B 57 -0.455 -4.547 -14.093 1.00 0.00 H new ATOM 1853 N ASP B 58 -0.138 -3.452 -9.126 1.00 0.00 N ATOM 1854 CA ASP B 58 -0.363 -3.681 -7.688 1.00 0.00 C ATOM 1855 C ASP B 58 -1.623 -3.085 -7.108 1.00 0.00 C ATOM 1856 O ASP B 58 -2.462 -3.820 -6.608 1.00 0.00 O ATOM 1857 CB ASP B 58 0.806 -3.156 -6.887 1.00 0.00 C ATOM 1858 CG ASP B 58 0.566 -3.218 -5.393 1.00 0.00 C ATOM 1859 OD1 ASP B 58 -0.340 -3.962 -4.968 1.00 0.00 O ATOM 1860 OD2 ASP B 58 1.281 -2.517 -4.648 1.00 0.00 O ATOM 0 H ASP B 58 0.633 -2.816 -9.330 1.00 0.00 H new ATOM 0 HA ASP B 58 -0.473 -4.763 -7.614 1.00 0.00 H new ATOM 0 HB2 ASP B 58 1.697 -3.733 -7.132 1.00 0.00 H new ATOM 0 HB3 ASP B 58 1.005 -2.124 -7.176 1.00 0.00 H new ATOM 1865 N LEU B 59 -1.759 -1.772 -7.124 1.00 0.00 N ATOM 1866 CA LEU B 59 -2.934 -1.181 -6.526 1.00 0.00 C ATOM 1867 C LEU B 59 -4.107 -1.469 -7.384 1.00 0.00 C ATOM 1868 O LEU B 59 -5.232 -1.206 -7.016 1.00 0.00 O ATOM 1869 CB LEU B 59 -2.781 0.290 -6.217 1.00 0.00 C ATOM 1870 CG LEU B 59 -2.517 0.572 -4.739 1.00 0.00 C ATOM 1871 CD1 LEU B 59 -3.806 0.600 -3.948 1.00 0.00 C ATOM 1872 CD2 LEU B 59 -1.559 -0.457 -4.136 1.00 0.00 C ATOM 0 H LEU B 59 -1.093 -1.115 -7.531 1.00 0.00 H new ATOM 0 HA LEU B 59 -3.086 -1.640 -5.549 1.00 0.00 H new ATOM 0 HB2 LEU B 59 -1.961 0.695 -6.809 1.00 0.00 H new ATOM 0 HB3 LEU B 59 -3.686 0.815 -6.524 1.00 0.00 H new ATOM 0 HG LEU B 59 -2.050 1.555 -4.680 1.00 0.00 H new ATOM 0 HD11 LEU B 59 -3.585 0.803 -2.900 1.00 0.00 H new ATOM 0 HD12 LEU B 59 -4.456 1.382 -4.340 1.00 0.00 H new ATOM 0 HD13 LEU B 59 -4.306 -0.365 -4.033 1.00 0.00 H new ATOM 0 HD21 LEU B 59 -1.393 -0.227 -3.084 1.00 0.00 H new ATOM 0 HD22 LEU B 59 -1.992 -1.453 -4.225 1.00 0.00 H new ATOM 0 HD23 LEU B 59 -0.609 -0.425 -4.669 1.00 0.00 H new ATOM 1884 N ALA B 60 -3.800 -1.919 -8.575 1.00 0.00 N ATOM 1885 CA ALA B 60 -4.807 -2.323 -9.511 1.00 0.00 C ATOM 1886 C ALA B 60 -5.124 -3.775 -9.216 1.00 0.00 C ATOM 1887 O ALA B 60 -6.221 -4.248 -9.467 1.00 0.00 O ATOM 1888 CB ALA B 60 -4.322 -2.132 -10.921 1.00 0.00 C ATOM 0 H ALA B 60 -2.844 -2.014 -8.918 1.00 0.00 H new ATOM 0 HA ALA B 60 -5.708 -1.717 -9.412 1.00 0.00 H new ATOM 0 HB1 ALA B 60 -5.099 -2.444 -11.619 1.00 0.00 H new ATOM 0 HB2 ALA B 60 -4.087 -1.080 -11.086 1.00 0.00 H new ATOM 0 HB3 ALA B 60 -3.427 -2.733 -11.083 1.00 0.00 H new ATOM 1894 N CYS B 61 -4.114 -4.476 -8.692 1.00 0.00 N ATOM 1895 CA CYS B 61 -4.263 -5.860 -8.257 1.00 0.00 C ATOM 1896 C CYS B 61 -5.083 -5.797 -6.980 1.00 0.00 C ATOM 1897 O CYS B 61 -5.958 -6.623 -6.697 1.00 0.00 O ATOM 1898 CB CYS B 61 -2.886 -6.489 -7.977 1.00 0.00 C ATOM 1899 SG CYS B 61 -2.915 -7.963 -6.905 1.00 0.00 S ATOM 0 H CYS B 61 -3.176 -4.098 -8.560 1.00 0.00 H new ATOM 0 HA CYS B 61 -4.744 -6.473 -9.020 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -2.427 -6.759 -8.928 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -2.246 -5.736 -7.516 1.00 0.00 H new ATOM 1904 N ALA B 62 -4.804 -4.737 -6.244 1.00 0.00 N ATOM 1905 CA ALA B 62 -5.465 -4.459 -4.996 1.00 0.00 C ATOM 1906 C ALA B 62 -6.825 -3.819 -5.255 1.00 0.00 C ATOM 1907 O ALA B 62 -7.820 -4.182 -4.624 1.00 0.00 O ATOM 1908 CB ALA B 62 -4.578 -3.570 -4.144 1.00 0.00 C ATOM 0 H ALA B 62 -4.104 -4.042 -6.504 1.00 0.00 H new ATOM 0 HA ALA B 62 -5.639 -5.388 -4.452 1.00 0.00 H new ATOM 0 HB1 ALA B 62 -5.077 -3.358 -3.198 1.00 0.00 H new ATOM 0 HB2 ALA B 62 -3.633 -4.077 -3.950 1.00 0.00 H new ATOM 0 HB3 ALA B 62 -4.387 -2.635 -4.671 1.00 0.00 H new ATOM 1914 N ALA B 63 -6.854 -2.870 -6.199 1.00 0.00 N ATOM 1915 CA ALA B 63 -8.089 -2.194 -6.582 1.00 0.00 C ATOM 1916 C ALA B 63 -8.994 -3.200 -7.228 1.00 0.00 C ATOM 1917 O ALA B 63 -10.213 -3.149 -7.089 1.00 0.00 O ATOM 1918 CB ALA B 63 -7.829 -1.053 -7.549 1.00 0.00 C ATOM 0 H ALA B 63 -6.030 -2.555 -6.711 1.00 0.00 H new ATOM 0 HA ALA B 63 -8.548 -1.770 -5.689 1.00 0.00 H new ATOM 0 HB1 ALA B 63 -8.773 -0.575 -7.810 1.00 0.00 H new ATOM 0 HB2 ALA B 63 -7.170 -0.322 -7.081 1.00 0.00 H new ATOM 0 HB3 ALA B 63 -7.357 -1.441 -8.452 1.00 0.00 H new ATOM 1924 N THR B 64 -8.376 -4.133 -7.935 1.00 0.00 N ATOM 1925 CA THR B 64 -9.138 -5.188 -8.576 1.00 0.00 C ATOM 1926 C THR B 64 -9.586 -6.156 -7.502 1.00 0.00 C ATOM 1927 O THR B 64 -10.040 -7.264 -7.791 1.00 0.00 O ATOM 1928 CB THR B 64 -8.375 -5.949 -9.700 1.00 0.00 C ATOM 1929 OG1 THR B 64 -9.316 -6.629 -10.541 1.00 0.00 O ATOM 1930 CG2 THR B 64 -7.379 -6.970 -9.150 1.00 0.00 C ATOM 0 H THR B 64 -7.367 -4.181 -8.077 1.00 0.00 H new ATOM 0 HA THR B 64 -9.982 -4.717 -9.080 1.00 0.00 H new ATOM 0 HB THR B 64 -7.812 -5.205 -10.263 1.00 0.00 H new ATOM 0 HG1 THR B 64 -9.951 -7.127 -9.985 1.00 0.00 H new ATOM 0 HG21 THR B 64 -6.876 -7.470 -9.978 1.00 0.00 H new ATOM 0 HG22 THR B 64 -6.640 -6.461 -8.531 1.00 0.00 H new ATOM 0 HG23 THR B 64 -7.909 -7.708 -8.548 1.00 0.00 H new ATOM 1938 N ALA B 65 -9.455 -5.720 -6.240 1.00 0.00 N ATOM 1939 CA ALA B 65 -9.829 -6.560 -5.125 1.00 0.00 C ATOM 1940 C ALA B 65 -10.010 -5.815 -3.787 1.00 0.00 C ATOM 1941 O ALA B 65 -11.042 -5.207 -3.560 1.00 0.00 O ATOM 1942 CB ALA B 65 -8.808 -7.652 -4.991 1.00 0.00 C ATOM 0 H ALA B 65 -9.096 -4.801 -5.982 1.00 0.00 H new ATOM 0 HA ALA B 65 -10.816 -6.965 -5.348 1.00 0.00 H new ATOM 0 HB1 ALA B 65 -9.073 -8.297 -4.154 1.00 0.00 H new ATOM 0 HB2 ALA B 65 -8.782 -8.240 -5.908 1.00 0.00 H new ATOM 0 HB3 ALA B 65 -7.826 -7.213 -4.814 1.00 0.00 H new ATOM 1948 N THR B 66 -9.015 -5.882 -2.889 1.00 0.00 N ATOM 1949 CA THR B 66 -9.154 -5.274 -1.551 1.00 0.00 C ATOM 1950 C THR B 66 -8.930 -3.773 -1.523 1.00 0.00 C ATOM 1951 O THR B 66 -9.744 -3.059 -0.943 1.00 0.00 O ATOM 1952 CB THR B 66 -8.226 -5.909 -0.499 1.00 0.00 C ATOM 1953 OG1 THR B 66 -6.939 -5.304 -0.561 1.00 0.00 O ATOM 1954 CG2 THR B 66 -8.097 -7.405 -0.697 1.00 0.00 C ATOM 0 H THR B 66 -8.120 -6.341 -3.057 1.00 0.00 H new ATOM 0 HA THR B 66 -10.195 -5.477 -1.299 1.00 0.00 H new ATOM 0 HB THR B 66 -8.668 -5.737 0.482 1.00 0.00 H new ATOM 0 HG1 THR B 66 -6.685 -4.983 0.329 1.00 0.00 H new ATOM 0 HG21 THR B 66 -7.434 -7.817 0.064 1.00 0.00 H new ATOM 0 HG22 THR B 66 -9.080 -7.869 -0.613 1.00 0.00 H new ATOM 0 HG23 THR B 66 -7.684 -7.607 -1.685 1.00 0.00 H new ATOM 1962 N SER B 67 -7.840 -3.270 -2.117 1.00 0.00 N ATOM 1963 CA SER B 67 -7.626 -1.816 -2.099 1.00 0.00 C ATOM 1964 C SER B 67 -8.946 -1.216 -2.483 1.00 0.00 C ATOM 1965 O SER B 67 -9.319 -0.112 -2.083 1.00 0.00 O ATOM 1966 CB SER B 67 -6.517 -1.354 -3.030 1.00 0.00 C ATOM 1967 OG SER B 67 -6.397 0.055 -2.990 1.00 0.00 O ATOM 0 H SER B 67 -7.123 -3.816 -2.595 1.00 0.00 H new ATOM 0 HA SER B 67 -7.294 -1.496 -1.111 1.00 0.00 H new ATOM 0 HB2 SER B 67 -5.573 -1.815 -2.739 1.00 0.00 H new ATOM 0 HB3 SER B 67 -6.729 -1.679 -4.049 1.00 0.00 H new ATOM 0 HG SER B 67 -6.364 0.407 -3.904 1.00 0.00 H new ATOM 1973 N SER B 68 -9.624 -2.003 -3.300 1.00 0.00 N ATOM 1974 CA SER B 68 -10.963 -1.776 -3.697 1.00 0.00 C ATOM 1975 C SER B 68 -11.182 -0.714 -4.733 1.00 0.00 C ATOM 1976 O SER B 68 -11.058 0.481 -4.485 1.00 0.00 O ATOM 1977 CB SER B 68 -11.831 -1.516 -2.486 1.00 0.00 C ATOM 1978 OG SER B 68 -13.110 -1.051 -2.874 1.00 0.00 O ATOM 0 H SER B 68 -9.222 -2.846 -3.710 1.00 0.00 H new ATOM 0 HA SER B 68 -11.254 -2.699 -4.198 1.00 0.00 H new ATOM 0 HB2 SER B 68 -11.933 -2.431 -1.903 1.00 0.00 H new ATOM 0 HB3 SER B 68 -11.352 -0.780 -1.841 1.00 0.00 H new ATOM 0 HG SER B 68 -13.572 -1.750 -3.382 1.00 0.00 H new ATOM 1984 N ALA B 69 -11.532 -1.212 -5.894 1.00 0.00 N ATOM 1985 CA ALA B 69 -11.893 -0.400 -7.038 1.00 0.00 C ATOM 1986 C ALA B 69 -11.939 -1.267 -8.282 1.00 0.00 C ATOM 1987 O ALA B 69 -11.436 -0.898 -9.343 1.00 0.00 O ATOM 1988 CB ALA B 69 -10.944 0.772 -7.221 1.00 0.00 C ATOM 0 H ALA B 69 -11.576 -2.214 -6.077 1.00 0.00 H new ATOM 0 HA ALA B 69 -12.882 0.023 -6.861 1.00 0.00 H new ATOM 0 HB1 ALA B 69 -11.250 1.356 -8.089 1.00 0.00 H new ATOM 0 HB2 ALA B 69 -10.969 1.403 -6.333 1.00 0.00 H new ATOM 0 HB3 ALA B 69 -9.931 0.400 -7.373 1.00 0.00 H new ATOM 1994 N THR B 70 -12.558 -2.428 -8.125 1.00 0.00 N ATOM 1995 CA THR B 70 -12.685 -3.391 -9.206 1.00 0.00 C ATOM 1996 C THR B 70 -14.036 -3.264 -9.883 1.00 0.00 C ATOM 1997 O THR B 70 -15.044 -3.758 -9.380 1.00 0.00 O ATOM 1998 CB THR B 70 -12.512 -4.837 -8.701 1.00 0.00 C ATOM 1999 OG1 THR B 70 -13.421 -5.709 -9.382 1.00 0.00 O ATOM 2000 CG2 THR B 70 -12.739 -4.923 -7.200 1.00 0.00 C ATOM 0 H THR B 70 -12.984 -2.727 -7.248 1.00 0.00 H new ATOM 0 HA THR B 70 -11.893 -3.171 -9.922 1.00 0.00 H new ATOM 0 HB THR B 70 -11.489 -5.148 -8.911 1.00 0.00 H new ATOM 0 HG1 THR B 70 -13.651 -6.462 -8.799 1.00 0.00 H new ATOM 0 HG21 THR B 70 -12.611 -5.954 -6.871 1.00 0.00 H new ATOM 0 HG22 THR B 70 -12.019 -4.286 -6.686 1.00 0.00 H new ATOM 0 HG23 THR B 70 -13.750 -4.591 -6.965 1.00 0.00 H new ATOM 2008 N GLU B 71 -14.051 -2.601 -11.028 1.00 0.00 N ATOM 2009 CA GLU B 71 -15.282 -2.413 -11.772 1.00 0.00 C ATOM 2010 C GLU B 71 -15.776 -3.729 -12.342 1.00 0.00 C ATOM 2011 O GLU B 71 -16.826 -3.785 -12.983 1.00 0.00 O ATOM 2012 CB GLU B 71 -15.091 -1.380 -12.879 1.00 0.00 C ATOM 2013 CG GLU B 71 -14.158 -1.794 -13.994 1.00 0.00 C ATOM 2014 CD GLU B 71 -12.702 -1.800 -13.573 1.00 0.00 C ATOM 2015 OE1 GLU B 71 -12.059 -0.731 -13.648 1.00 0.00 O ATOM 2016 OE2 GLU B 71 -12.205 -2.871 -13.169 1.00 0.00 O ATOM 0 H GLU B 71 -13.226 -2.186 -11.460 1.00 0.00 H new ATOM 0 HA GLU B 71 -16.040 -2.038 -11.084 1.00 0.00 H new ATOM 0 HB2 GLU B 71 -16.065 -1.149 -13.310 1.00 0.00 H new ATOM 0 HB3 GLU B 71 -14.713 -0.460 -12.434 1.00 0.00 H new ATOM 0 HG2 GLU B 71 -14.435 -2.789 -14.342 1.00 0.00 H new ATOM 0 HG3 GLU B 71 -14.284 -1.115 -14.837 1.00 0.00 H new ATOM 2023 N ALA B 72 -15.014 -4.787 -12.106 1.00 0.00 N ATOM 2024 CA ALA B 72 -15.380 -6.100 -12.598 1.00 0.00 C ATOM 2025 C ALA B 72 -16.211 -6.875 -11.577 1.00 0.00 C ATOM 2026 O ALA B 72 -17.035 -7.710 -11.949 1.00 0.00 O ATOM 2027 CB ALA B 72 -14.139 -6.890 -12.987 1.00 0.00 C ATOM 0 H ALA B 72 -14.142 -4.759 -11.578 1.00 0.00 H new ATOM 0 HA ALA B 72 -15.998 -5.958 -13.485 1.00 0.00 H new ATOM 0 HB1 ALA B 72 -14.434 -7.873 -13.354 1.00 0.00 H new ATOM 0 HB2 ALA B 72 -13.599 -6.357 -13.770 1.00 0.00 H new ATOM 0 HB3 ALA B 72 -13.494 -7.006 -12.116 1.00 0.00 H new ATOM 2033 N CYS B 73 -15.996 -6.600 -10.289 1.00 0.00 N ATOM 2034 CA CYS B 73 -16.742 -7.288 -9.235 1.00 0.00 C ATOM 2035 C CYS B 73 -17.553 -6.311 -8.425 1.00 0.00 C ATOM 2036 O CYS B 73 -18.280 -6.708 -7.515 1.00 0.00 O ATOM 2037 CB CYS B 73 -15.811 -7.991 -8.252 1.00 0.00 C ATOM 2038 SG CYS B 73 -14.381 -8.822 -8.998 1.00 0.00 S ATOM 0 H CYS B 73 -15.320 -5.914 -9.954 1.00 0.00 H new ATOM 0 HA CYS B 73 -17.381 -8.011 -9.742 1.00 0.00 H new ATOM 0 HB2 CYS B 73 -15.449 -7.257 -7.532 1.00 0.00 H new ATOM 0 HB3 CYS B 73 -16.388 -8.728 -7.694 1.00 0.00 H new ATOM 2043 N LYS B 74 -17.438 -5.039 -8.747 1.00 0.00 N ATOM 2044 CA LYS B 74 -18.108 -4.039 -7.958 1.00 0.00 C ATOM 2045 C LYS B 74 -19.616 -4.087 -8.011 1.00 0.00 C ATOM 2046 O LYS B 74 -20.245 -5.118 -7.780 1.00 0.00 O ATOM 2047 CB LYS B 74 -17.627 -2.628 -8.260 1.00 0.00 C ATOM 2048 CG LYS B 74 -17.903 -1.689 -7.094 1.00 0.00 C ATOM 2049 CD LYS B 74 -18.984 -0.659 -7.395 1.00 0.00 C ATOM 2050 CE LYS B 74 -19.336 0.193 -6.189 1.00 0.00 C ATOM 2051 NZ LYS B 74 -20.105 1.409 -6.572 1.00 0.00 N ATOM 0 H LYS B 74 -16.897 -4.683 -9.535 1.00 0.00 H new ATOM 0 HA LYS B 74 -17.825 -4.301 -6.939 1.00 0.00 H new ATOM 0 HB2 LYS B 74 -16.558 -2.643 -8.472 1.00 0.00 H new ATOM 0 HB3 LYS B 74 -18.125 -2.256 -9.155 1.00 0.00 H new ATOM 0 HG2 LYS B 74 -18.202 -2.276 -6.226 1.00 0.00 H new ATOM 0 HG3 LYS B 74 -16.982 -1.172 -6.827 1.00 0.00 H new ATOM 0 HD2 LYS B 74 -18.648 -0.012 -8.205 1.00 0.00 H new ATOM 0 HD3 LYS B 74 -19.880 -1.171 -7.746 1.00 0.00 H new ATOM 0 HE2 LYS B 74 -19.921 -0.399 -5.485 1.00 0.00 H new ATOM 0 HE3 LYS B 74 -18.422 0.489 -5.675 1.00 0.00 H new ATOM 0 HZ1 LYS B 74 -20.150 2.061 -5.763 1.00 0.00 H new ATOM 0 HZ2 LYS B 74 -19.634 1.881 -7.370 1.00 0.00 H new ATOM 0 HZ3 LYS B 74 -21.069 1.136 -6.851 1.00 0.00 H new ATOM 2065 N GLY B 75 -20.176 -2.940 -8.322 1.00 0.00 N ATOM 2066 CA GLY B 75 -21.587 -2.770 -8.282 1.00 0.00 C ATOM 2067 C GLY B 75 -21.973 -2.809 -6.827 1.00 0.00 C ATOM 2068 O GLY B 75 -23.125 -3.058 -6.475 1.00 0.00 O ATOM 0 H GLY B 75 -19.657 -2.109 -8.607 1.00 0.00 H new ATOM 0 HA2 GLY B 75 -21.878 -1.823 -8.737 1.00 0.00 H new ATOM 0 HA3 GLY B 75 -22.090 -3.560 -8.840 1.00 0.00 H new ATOM 2072 N CYS B 76 -20.962 -2.548 -5.968 1.00 0.00 N ATOM 2073 CA CYS B 76 -21.149 -2.608 -4.538 1.00 0.00 C ATOM 2074 C CYS B 76 -20.064 -1.889 -3.709 1.00 0.00 C ATOM 2075 O CYS B 76 -20.362 -0.934 -2.997 1.00 0.00 O ATOM 2076 CB CYS B 76 -21.138 -4.077 -4.115 1.00 0.00 C ATOM 2077 SG CYS B 76 -22.738 -4.939 -4.228 1.00 0.00 S ATOM 0 H CYS B 76 -20.018 -2.296 -6.259 1.00 0.00 H new ATOM 0 HA CYS B 76 -22.092 -2.099 -4.339 1.00 0.00 H new ATOM 0 HB2 CYS B 76 -20.414 -4.609 -4.732 1.00 0.00 H new ATOM 0 HB3 CYS B 76 -20.785 -4.138 -3.086 1.00 0.00 H new ATOM 2082 N LEU B 77 -18.804 -2.331 -3.832 1.00 0.00 N ATOM 2083 CA LEU B 77 -17.721 -1.848 -2.946 1.00 0.00 C ATOM 2084 C LEU B 77 -16.722 -0.792 -3.470 1.00 0.00 C ATOM 2085 O LEU B 77 -16.013 -0.217 -2.647 1.00 0.00 O ATOM 2086 CB LEU B 77 -16.915 -3.068 -2.509 1.00 0.00 C ATOM 2087 CG LEU B 77 -15.693 -2.762 -1.635 1.00 0.00 C ATOM 2088 CD1 LEU B 77 -16.120 -2.059 -0.369 1.00 0.00 C ATOM 2089 CD2 LEU B 77 -14.912 -4.023 -1.308 1.00 0.00 C ATOM 0 H LEU B 77 -18.506 -3.015 -4.527 1.00 0.00 H new ATOM 0 HA LEU B 77 -18.256 -1.314 -2.160 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -17.574 -3.742 -1.962 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -16.581 -3.601 -3.399 1.00 0.00 H new ATOM 0 HG LEU B 77 -15.033 -2.104 -2.200 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -15.243 -1.847 0.243 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -16.620 -1.124 -0.623 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -16.806 -2.697 0.188 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -14.053 -3.768 -0.687 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -15.555 -4.720 -0.770 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -14.567 -4.487 -2.232 1.00 0.00 H new ATOM 2101 N TRP B 78 -16.648 -0.514 -4.772 1.00 0.00 N ATOM 2102 CA TRP B 78 -15.643 0.454 -5.296 1.00 0.00 C ATOM 2103 C TRP B 78 -14.996 1.300 -4.201 1.00 0.00 C ATOM 2104 O TRP B 78 -13.774 1.154 -3.990 1.00 0.00 O ATOM 2105 CB TRP B 78 -16.218 1.388 -6.373 1.00 0.00 C ATOM 2106 CG TRP B 78 -16.081 0.854 -7.759 1.00 0.00 C ATOM 2107 CD1 TRP B 78 -15.222 -0.113 -8.182 1.00 0.00 C ATOM 2108 CD2 TRP B 78 -16.837 1.245 -8.900 1.00 0.00 C ATOM 2109 NE1 TRP B 78 -15.427 -0.377 -9.507 1.00 0.00 N ATOM 2110 CE2 TRP B 78 -16.411 0.452 -9.970 1.00 0.00 C ATOM 2111 CE3 TRP B 78 -17.844 2.181 -9.116 1.00 0.00 C ATOM 2112 CZ2 TRP B 78 -16.958 0.561 -11.232 1.00 0.00 C ATOM 2113 CZ3 TRP B 78 -18.385 2.297 -10.383 1.00 0.00 C ATOM 2114 CH2 TRP B 78 -17.937 1.479 -11.429 1.00 0.00 C ATOM 2115 OXT TRP B 78 -15.709 2.097 -3.562 1.00 0.00 O ATOM 0 H TRP B 78 -17.252 -0.928 -5.482 1.00 0.00 H new ATOM 0 HA TRP B 78 -14.876 -0.175 -5.748 1.00 0.00 H new ATOM 0 HB2 TRP B 78 -17.273 1.565 -6.163 1.00 0.00 H new ATOM 0 HB3 TRP B 78 -15.714 2.353 -6.312 1.00 0.00 H new ATOM 0 HD1 TRP B 78 -14.485 -0.601 -7.561 1.00 0.00 H new ATOM 0 HE1 TRP B 78 -14.929 -1.076 -10.059 1.00 0.00 H new ATOM 0 HE3 TRP B 78 -18.196 2.805 -8.308 1.00 0.00 H new ATOM 0 HZ2 TRP B 78 -16.616 -0.067 -12.041 1.00 0.00 H new ATOM 0 HZ3 TRP B 78 -19.161 3.025 -10.568 1.00 0.00 H new ATOM 0 HH2 TRP B 78 -18.379 1.581 -12.409 1.00 0.00 H new TER 2126 TRP B 78