USER MOD reduce.3.24.130724 H: found=0, std=0, add=1006, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 1000 hydrogens (45 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 72 HIS : no HE2:sc= -7.98! C(o=-8.7!,f=-11!) USER MOD Set 1.2: A 73 MET CE :methyl 168:sc= -0.684 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -175:sc= 0.217 (180deg=0.067) USER MOD Single : A 2 SER OG : rot 61:sc= 0.352 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 141:sc= -0.291 (180deg=-1.69!) USER MOD Single : A 38 HIS : no HD1:sc= -0.427 X(o=-0.43,f=-0.33) USER MOD Single : A 39 THR OG1 : rot -124:sc= 1.21 USER MOD Single : A 49 ASN : amide:sc= -0.23 K(o=-0.23,f=-2.1!) USER MOD Single : A 54 GLN : amide:sc= -3.67! C(o=-3.7!,f=-4.7!) USER MOD Single : A 60 TYR OH : rot 150:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= -0.0207 X(o=-0.021,f=-0.16) USER MOD Single : A 75 ASN : amide:sc= 1.08 K(o=1.1,f=-0.2) USER MOD Single : A 92 HIS : no HD1:sc= -5.57! C(o=-5.6!,f=-17!) USER MOD Single : A 99 GLN : amide:sc= -4.89! C(o=-4.9!,f=-9.9!) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 61:sc= 0.839 USER MOD Single : A 111 ASN : amide:sc= -0.802 X(o=-0.8,f=-0.34) USER MOD Single : A 113 ASN : amide:sc= -2.64! C(o=-2.6!,f=-6!) USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.606 USER MOD Single : A 123 THR OG1 : rot -71:sc= 0.455 USER MOD Single : A 125 TYR OH : rot 117:sc= 1.58 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 78.314 22.212 -23.580 1.00 1.00 N ATOM 2 CA MET A 1 78.861 20.871 -23.936 1.00 1.00 C ATOM 3 C MET A 1 77.762 19.824 -23.764 1.00 1.00 C ATOM 4 O MET A 1 76.702 20.103 -23.199 1.00 1.00 O ATOM 5 CB MET A 1 80.093 20.531 -23.042 1.00 1.00 C ATOM 6 CG MET A 1 80.320 21.623 -21.985 1.00 1.00 C ATOM 7 SD MET A 1 78.843 21.788 -20.947 1.00 1.00 S ATOM 8 CE MET A 1 79.220 23.423 -20.268 1.00 1.00 C ATOM 0 H1 MET A 1 79.029 22.942 -23.775 1.00 1.00 H new ATOM 0 H2 MET A 1 77.463 22.401 -24.147 1.00 1.00 H new ATOM 0 H3 MET A 1 78.068 22.230 -22.570 1.00 1.00 H new ATOM 0 HA MET A 1 79.194 20.876 -24.974 1.00 1.00 H new ATOM 0 HB2 MET A 1 79.937 19.570 -22.551 1.00 1.00 H new ATOM 0 HB3 MET A 1 80.982 20.431 -23.664 1.00 1.00 H new ATOM 0 HG2 MET A 1 81.183 21.372 -21.368 1.00 1.00 H new ATOM 0 HG3 MET A 1 80.542 22.573 -22.472 1.00 1.00 H new ATOM 0 HE1 MET A 1 78.424 23.727 -19.588 1.00 1.00 H new ATOM 0 HE2 MET A 1 80.165 23.383 -19.726 1.00 1.00 H new ATOM 0 HE3 MET A 1 79.298 24.145 -21.081 1.00 1.00 H new ATOM 18 N SER A 2 78.025 18.621 -24.262 1.00 1.00 N ATOM 19 CA SER A 2 77.068 17.528 -24.174 1.00 1.00 C ATOM 20 C SER A 2 77.128 16.866 -22.802 1.00 1.00 C ATOM 21 O SER A 2 76.456 15.864 -22.572 1.00 1.00 O ATOM 22 CB SER A 2 77.358 16.487 -25.258 1.00 1.00 C ATOM 23 OG SER A 2 78.680 15.990 -25.093 1.00 1.00 O ATOM 0 H SER A 2 78.897 18.379 -24.732 1.00 1.00 H new ATOM 0 HA SER A 2 76.069 17.938 -24.322 1.00 1.00 H new ATOM 0 HB2 SER A 2 76.640 15.670 -25.194 1.00 1.00 H new ATOM 0 HB3 SER A 2 77.246 16.934 -26.246 1.00 1.00 H new ATOM 0 HG SER A 2 78.760 15.557 -24.217 1.00 1.00 H new ATOM 29 N ASP A 3 77.924 17.451 -21.896 1.00 1.00 N ATOM 30 CA ASP A 3 78.071 16.945 -20.522 1.00 1.00 C ATOM 31 C ASP A 3 79.428 17.353 -19.941 1.00 1.00 C ATOM 32 O ASP A 3 80.470 17.107 -20.549 1.00 1.00 O ATOM 33 CB ASP A 3 77.941 15.414 -20.459 1.00 1.00 C ATOM 34 CG ASP A 3 78.691 14.776 -21.623 1.00 1.00 C ATOM 35 OD1 ASP A 3 79.374 15.501 -22.327 1.00 1.00 O ATOM 36 OD2 ASP A 3 78.574 13.574 -21.792 1.00 1.00 O ATOM 0 H ASP A 3 78.481 18.283 -22.092 1.00 1.00 H new ATOM 0 HA ASP A 3 77.267 17.387 -19.934 1.00 1.00 H new ATOM 0 HB2 ASP A 3 78.340 15.046 -19.514 1.00 1.00 H new ATOM 0 HB3 ASP A 3 76.890 15.129 -20.494 1.00 1.00 H new ATOM 41 N PHE A 4 79.411 17.965 -18.760 1.00 1.00 N ATOM 42 CA PHE A 4 80.657 18.383 -18.111 1.00 1.00 C ATOM 43 C PHE A 4 80.481 18.454 -16.598 1.00 1.00 C ATOM 44 O PHE A 4 79.388 18.729 -16.103 1.00 1.00 O ATOM 45 CB PHE A 4 81.096 19.747 -18.642 1.00 1.00 C ATOM 46 CG PHE A 4 82.447 20.094 -18.066 1.00 1.00 C ATOM 47 CD1 PHE A 4 83.608 19.557 -18.638 1.00 1.00 C ATOM 48 CD2 PHE A 4 82.543 20.952 -16.964 1.00 1.00 C ATOM 49 CE1 PHE A 4 84.863 19.877 -18.108 1.00 1.00 C ATOM 50 CE2 PHE A 4 83.797 21.271 -16.433 1.00 1.00 C ATOM 51 CZ PHE A 4 84.957 20.734 -17.004 1.00 1.00 C ATOM 0 H PHE A 4 78.563 18.182 -18.236 1.00 1.00 H new ATOM 0 HA PHE A 4 81.424 17.643 -18.339 1.00 1.00 H new ATOM 0 HB2 PHE A 4 81.146 19.728 -19.731 1.00 1.00 H new ATOM 0 HB3 PHE A 4 80.365 20.509 -18.370 1.00 1.00 H new ATOM 0 HD1 PHE A 4 83.534 18.896 -19.489 1.00 1.00 H new ATOM 0 HD2 PHE A 4 81.649 21.368 -16.524 1.00 1.00 H new ATOM 0 HE1 PHE A 4 85.758 19.464 -18.550 1.00 1.00 H new ATOM 0 HE2 PHE A 4 83.870 21.932 -15.582 1.00 1.00 H new ATOM 0 HZ PHE A 4 85.925 20.981 -16.593 1.00 1.00 H new ATOM 61 N ASP A 5 81.566 18.201 -15.863 1.00 1.00 N ATOM 62 CA ASP A 5 81.531 18.242 -14.405 1.00 1.00 C ATOM 63 C ASP A 5 82.927 18.586 -13.867 1.00 1.00 C ATOM 64 O ASP A 5 83.937 18.228 -14.473 1.00 1.00 O ATOM 65 CB ASP A 5 81.066 16.887 -13.860 1.00 1.00 C ATOM 66 CG ASP A 5 79.616 16.635 -14.272 1.00 1.00 C ATOM 67 OD1 ASP A 5 78.791 17.499 -14.021 1.00 1.00 O ATOM 68 OD2 ASP A 5 79.353 15.585 -14.835 1.00 1.00 O ATOM 0 H ASP A 5 82.478 17.966 -16.256 1.00 1.00 H new ATOM 0 HA ASP A 5 80.829 19.009 -14.078 1.00 1.00 H new ATOM 0 HB2 ASP A 5 81.706 16.092 -14.242 1.00 1.00 H new ATOM 0 HB3 ASP A 5 81.153 16.872 -12.774 1.00 1.00 H new ATOM 73 N THR A 6 82.976 19.286 -12.731 1.00 1.00 N ATOM 74 CA THR A 6 84.258 19.689 -12.117 1.00 1.00 C ATOM 75 C THR A 6 84.715 18.658 -11.068 1.00 1.00 C ATOM 76 O THR A 6 84.076 17.677 -10.874 1.00 1.00 O ATOM 77 CB THR A 6 84.106 21.085 -11.488 1.00 1.00 C ATOM 78 OG1 THR A 6 83.028 21.756 -12.119 1.00 1.00 O ATOM 79 CG2 THR A 6 85.389 21.899 -11.680 1.00 1.00 C ATOM 0 H THR A 6 82.150 19.588 -12.214 1.00 1.00 H new ATOM 0 HA THR A 6 85.026 19.729 -12.890 1.00 1.00 H new ATOM 0 HB THR A 6 83.914 20.979 -10.420 1.00 1.00 H new ATOM 0 HG1 THR A 6 82.921 22.647 -11.724 1.00 1.00 H new ATOM 0 HG21 THR A 6 85.266 22.884 -11.230 1.00 1.00 H new ATOM 0 HG22 THR A 6 86.222 21.383 -11.202 1.00 1.00 H new ATOM 0 HG23 THR A 6 85.594 22.010 -12.745 1.00 1.00 H new ATOM 87 N GLU A 7 85.825 18.914 -10.402 1.00 1.00 N ATOM 88 CA GLU A 7 86.354 17.981 -9.388 1.00 1.00 C ATOM 89 C GLU A 7 85.349 17.771 -8.266 1.00 1.00 C ATOM 90 O GLU A 7 84.942 16.658 -7.974 1.00 1.00 O ATOM 91 CB GLU A 7 87.684 18.527 -8.807 1.00 1.00 C ATOM 92 CG GLU A 7 88.127 17.723 -7.564 1.00 1.00 C ATOM 93 CD GLU A 7 89.546 18.127 -7.132 1.00 1.00 C ATOM 94 OE1 GLU A 7 90.083 19.058 -7.710 1.00 1.00 O ATOM 95 OE2 GLU A 7 90.069 17.501 -6.223 1.00 1.00 O ATOM 0 H GLU A 7 86.387 19.755 -10.534 1.00 1.00 H new ATOM 0 HA GLU A 7 86.537 17.021 -9.871 1.00 1.00 H new ATOM 0 HB2 GLU A 7 88.462 18.480 -9.569 1.00 1.00 H new ATOM 0 HB3 GLU A 7 87.562 19.577 -8.539 1.00 1.00 H new ATOM 0 HG2 GLU A 7 87.429 17.897 -6.745 1.00 1.00 H new ATOM 0 HG3 GLU A 7 88.099 16.656 -7.786 1.00 1.00 H new ATOM 102 N ARG A 8 84.930 18.847 -7.661 1.00 1.00 N ATOM 103 CA ARG A 8 83.964 18.714 -6.579 1.00 1.00 C ATOM 104 C ARG A 8 82.774 17.902 -7.111 1.00 1.00 C ATOM 105 O ARG A 8 82.454 16.845 -6.598 1.00 1.00 O ATOM 106 CB ARG A 8 83.518 20.106 -6.092 1.00 1.00 C ATOM 107 CG ARG A 8 83.607 21.125 -7.257 1.00 1.00 C ATOM 108 CD ARG A 8 82.457 22.126 -7.198 1.00 1.00 C ATOM 109 NE ARG A 8 82.446 22.899 -8.425 1.00 1.00 N ATOM 110 CZ ARG A 8 81.417 23.658 -8.747 1.00 1.00 C ATOM 111 NH1 ARG A 8 80.375 23.719 -7.964 1.00 1.00 N ATOM 112 NH2 ARG A 8 81.453 24.331 -9.859 1.00 1.00 N ATOM 0 H ARG A 8 85.222 19.799 -7.879 1.00 1.00 H new ATOM 0 HA ARG A 8 84.407 18.200 -5.726 1.00 1.00 H new ATOM 0 HB2 ARG A 8 82.496 20.059 -5.715 1.00 1.00 H new ATOM 0 HB3 ARG A 8 84.148 20.431 -5.264 1.00 1.00 H new ATOM 0 HG2 ARG A 8 84.558 21.655 -7.209 1.00 1.00 H new ATOM 0 HG3 ARG A 8 83.585 20.596 -8.210 1.00 1.00 H new ATOM 0 HD2 ARG A 8 81.508 21.604 -7.073 1.00 1.00 H new ATOM 0 HD3 ARG A 8 82.574 22.785 -6.338 1.00 1.00 H new ATOM 0 HE ARG A 8 83.250 22.855 -9.051 1.00 1.00 H new ATOM 0 HH11 ARG A 8 80.354 23.178 -7.099 1.00 1.00 H new ATOM 0 HH12 ARG A 8 79.581 24.307 -8.217 1.00 1.00 H new ATOM 0 HH21 ARG A 8 82.269 24.267 -10.468 1.00 1.00 H new ATOM 0 HH22 ARG A 8 80.665 24.923 -10.123 1.00 1.00 H new ATOM 126 N VAL A 9 82.169 18.435 -8.152 1.00 1.00 N ATOM 127 CA VAL A 9 81.008 17.777 -8.787 1.00 1.00 C ATOM 128 C VAL A 9 81.421 16.421 -9.436 1.00 1.00 C ATOM 129 O VAL A 9 80.782 15.421 -9.201 1.00 1.00 O ATOM 130 CB VAL A 9 80.311 18.736 -9.780 1.00 1.00 C ATOM 131 CG1 VAL A 9 79.167 19.497 -9.068 1.00 1.00 C ATOM 132 CG2 VAL A 9 81.330 19.759 -10.278 1.00 1.00 C ATOM 0 H VAL A 9 82.447 19.315 -8.586 1.00 1.00 H new ATOM 0 HA VAL A 9 80.274 17.538 -8.018 1.00 1.00 H new ATOM 0 HB VAL A 9 79.906 18.157 -10.610 1.00 1.00 H new ATOM 0 HG11 VAL A 9 78.682 20.170 -9.775 1.00 1.00 H new ATOM 0 HG12 VAL A 9 78.437 18.783 -8.687 1.00 1.00 H new ATOM 0 HG13 VAL A 9 79.575 20.075 -8.239 1.00 1.00 H new ATOM 0 HG21 VAL A 9 80.848 20.440 -10.979 1.00 1.00 H new ATOM 0 HG22 VAL A 9 81.721 20.325 -9.432 1.00 1.00 H new ATOM 0 HG23 VAL A 9 82.149 19.243 -10.778 1.00 1.00 H new ATOM 142 N SER A 10 82.486 16.407 -10.229 1.00 1.00 N ATOM 143 CA SER A 10 82.944 15.136 -10.863 1.00 1.00 C ATOM 144 C SER A 10 83.313 14.141 -9.743 1.00 1.00 C ATOM 145 O SER A 10 82.848 13.026 -9.692 1.00 1.00 O ATOM 146 CB SER A 10 84.175 15.317 -11.766 1.00 1.00 C ATOM 147 OG SER A 10 84.474 14.077 -12.402 1.00 1.00 O ATOM 0 H SER A 10 83.048 17.227 -10.456 1.00 1.00 H new ATOM 0 HA SER A 10 82.129 14.775 -11.490 1.00 1.00 H new ATOM 0 HB2 SER A 10 83.983 16.086 -12.514 1.00 1.00 H new ATOM 0 HB3 SER A 10 85.028 15.652 -11.176 1.00 1.00 H new ATOM 0 HG SER A 10 85.257 14.187 -12.981 1.00 1.00 H new ATOM 153 N ARG A 11 84.240 14.552 -8.906 1.00 1.00 N ATOM 154 CA ARG A 11 84.742 13.700 -7.813 1.00 1.00 C ATOM 155 C ARG A 11 83.584 13.372 -6.856 1.00 1.00 C ATOM 156 O ARG A 11 83.421 12.229 -6.449 1.00 1.00 O ATOM 157 CB ARG A 11 85.905 14.414 -7.074 1.00 1.00 C ATOM 158 CG ARG A 11 86.878 13.420 -6.387 1.00 1.00 C ATOM 159 CD ARG A 11 87.745 12.687 -7.420 1.00 1.00 C ATOM 160 NE ARG A 11 88.955 12.157 -6.787 1.00 1.00 N ATOM 161 CZ ARG A 11 89.601 11.121 -7.310 1.00 1.00 C ATOM 162 NH1 ARG A 11 89.150 10.560 -8.397 1.00 1.00 N ATOM 163 NH2 ARG A 11 90.683 10.669 -6.744 1.00 1.00 N ATOM 0 H ARG A 11 84.673 15.474 -8.950 1.00 1.00 H new ATOM 0 HA ARG A 11 85.132 12.766 -8.217 1.00 1.00 H new ATOM 0 HB2 ARG A 11 86.460 15.027 -7.785 1.00 1.00 H new ATOM 0 HB3 ARG A 11 85.493 15.090 -6.324 1.00 1.00 H new ATOM 0 HG2 ARG A 11 87.518 13.958 -5.688 1.00 1.00 H new ATOM 0 HG3 ARG A 11 86.310 12.694 -5.805 1.00 1.00 H new ATOM 0 HD2 ARG A 11 87.176 11.873 -7.870 1.00 1.00 H new ATOM 0 HD3 ARG A 11 88.017 13.369 -8.225 1.00 1.00 H new ATOM 0 HE ARG A 11 89.306 12.590 -5.933 1.00 1.00 H new ATOM 0 HH11 ARG A 11 88.304 10.917 -8.842 1.00 1.00 H new ATOM 0 HH12 ARG A 11 89.643 9.764 -8.802 1.00 1.00 H new ATOM 0 HH21 ARG A 11 91.038 11.111 -5.896 1.00 1.00 H new ATOM 0 HH22 ARG A 11 91.176 9.873 -7.149 1.00 1.00 H new ATOM 177 N ALA A 12 82.744 14.372 -6.585 1.00 1.00 N ATOM 178 CA ALA A 12 81.561 14.110 -5.743 1.00 1.00 C ATOM 179 C ALA A 12 80.614 13.211 -6.509 1.00 1.00 C ATOM 180 O ALA A 12 80.217 12.153 -6.035 1.00 1.00 O ATOM 181 CB ALA A 12 80.771 15.360 -5.349 1.00 1.00 C ATOM 0 H ALA A 12 82.846 15.332 -6.916 1.00 1.00 H new ATOM 0 HA ALA A 12 81.942 13.661 -4.826 1.00 1.00 H new ATOM 0 HB1 ALA A 12 79.920 15.073 -4.732 1.00 1.00 H new ATOM 0 HB2 ALA A 12 81.416 16.036 -4.787 1.00 1.00 H new ATOM 0 HB3 ALA A 12 80.414 15.863 -6.248 1.00 1.00 H new ATOM 187 N VAL A 13 80.236 13.645 -7.701 1.00 1.00 N ATOM 188 CA VAL A 13 79.307 12.828 -8.469 1.00 1.00 C ATOM 189 C VAL A 13 79.973 11.492 -8.791 1.00 1.00 C ATOM 190 O VAL A 13 79.451 10.455 -8.467 1.00 1.00 O ATOM 191 CB VAL A 13 78.769 13.498 -9.782 1.00 1.00 C ATOM 192 CG1 VAL A 13 78.263 14.952 -9.532 1.00 1.00 C ATOM 193 CG2 VAL A 13 79.848 13.464 -10.885 1.00 1.00 C ATOM 0 H VAL A 13 80.539 14.514 -8.142 1.00 1.00 H new ATOM 0 HA VAL A 13 78.426 12.692 -7.842 1.00 1.00 H new ATOM 0 HB VAL A 13 77.910 12.919 -10.120 1.00 1.00 H new ATOM 0 HG11 VAL A 13 77.900 15.377 -10.468 1.00 1.00 H new ATOM 0 HG12 VAL A 13 77.453 14.935 -8.803 1.00 1.00 H new ATOM 0 HG13 VAL A 13 79.082 15.562 -9.150 1.00 1.00 H new ATOM 0 HG21 VAL A 13 79.459 13.933 -11.789 1.00 1.00 H new ATOM 0 HG22 VAL A 13 80.731 14.006 -10.547 1.00 1.00 H new ATOM 0 HG23 VAL A 13 80.117 12.430 -11.099 1.00 1.00 H new ATOM 203 N ALA A 14 81.145 11.489 -9.365 1.00 1.00 N ATOM 204 CA ALA A 14 81.756 10.210 -9.652 1.00 1.00 C ATOM 205 C ALA A 14 81.977 9.425 -8.366 1.00 1.00 C ATOM 206 O ALA A 14 81.383 8.380 -8.183 1.00 1.00 O ATOM 207 CB ALA A 14 83.098 10.407 -10.357 1.00 1.00 C ATOM 0 H ALA A 14 81.680 12.314 -9.635 1.00 1.00 H new ATOM 0 HA ALA A 14 81.083 9.652 -10.304 1.00 1.00 H new ATOM 0 HB1 ALA A 14 83.545 9.435 -10.566 1.00 1.00 H new ATOM 0 HB2 ALA A 14 82.942 10.944 -11.293 1.00 1.00 H new ATOM 0 HB3 ALA A 14 83.765 10.983 -9.715 1.00 1.00 H new ATOM 213 N ALA A 15 82.829 9.950 -7.497 1.00 1.00 N ATOM 214 CA ALA A 15 83.133 9.224 -6.245 1.00 1.00 C ATOM 215 C ALA A 15 81.856 8.932 -5.443 1.00 1.00 C ATOM 216 O ALA A 15 81.577 7.788 -5.113 1.00 1.00 O ATOM 217 CB ALA A 15 84.136 9.978 -5.357 1.00 1.00 C ATOM 0 H ALA A 15 83.312 10.840 -7.615 1.00 1.00 H new ATOM 0 HA ALA A 15 83.591 8.282 -6.546 1.00 1.00 H new ATOM 0 HB1 ALA A 15 84.325 9.402 -4.451 1.00 1.00 H new ATOM 0 HB2 ALA A 15 85.071 10.116 -5.900 1.00 1.00 H new ATOM 0 HB3 ALA A 15 83.725 10.951 -5.089 1.00 1.00 H new ATOM 223 N ALA A 16 81.106 9.966 -5.119 1.00 1.00 N ATOM 224 CA ALA A 16 79.891 9.745 -4.326 1.00 1.00 C ATOM 225 C ALA A 16 78.867 8.921 -5.134 1.00 1.00 C ATOM 226 O ALA A 16 78.396 7.873 -4.692 1.00 1.00 O ATOM 227 CB ALA A 16 79.303 11.097 -3.859 1.00 1.00 C ATOM 0 H ALA A 16 81.296 10.935 -5.375 1.00 1.00 H new ATOM 0 HA ALA A 16 80.144 9.171 -3.435 1.00 1.00 H new ATOM 0 HB1 ALA A 16 78.402 10.919 -3.272 1.00 1.00 H new ATOM 0 HB2 ALA A 16 80.037 11.621 -3.247 1.00 1.00 H new ATOM 0 HB3 ALA A 16 79.055 11.706 -4.729 1.00 1.00 H new ATOM 233 N LEU A 17 78.523 9.433 -6.299 1.00 1.00 N ATOM 234 CA LEU A 17 77.513 8.723 -7.124 1.00 1.00 C ATOM 235 C LEU A 17 78.018 7.304 -7.413 1.00 1.00 C ATOM 236 O LEU A 17 77.320 6.330 -7.128 1.00 1.00 O ATOM 237 CB LEU A 17 77.200 9.451 -8.450 1.00 1.00 C ATOM 238 CG LEU A 17 75.846 9.016 -9.041 1.00 1.00 C ATOM 239 CD1 LEU A 17 75.442 10.027 -10.124 1.00 1.00 C ATOM 240 CD2 LEU A 17 75.960 7.615 -9.673 1.00 1.00 C ATOM 0 H LEU A 17 78.895 10.295 -6.699 1.00 1.00 H new ATOM 0 HA LEU A 17 76.582 8.695 -6.557 1.00 1.00 H new ATOM 0 HB2 LEU A 17 77.192 10.528 -8.279 1.00 1.00 H new ATOM 0 HB3 LEU A 17 77.992 9.248 -9.171 1.00 1.00 H new ATOM 0 HG LEU A 17 75.098 8.982 -8.248 1.00 1.00 H new ATOM 0 HD11 LEU A 17 74.484 9.735 -10.555 1.00 1.00 H new ATOM 0 HD12 LEU A 17 75.354 11.019 -9.681 1.00 1.00 H new ATOM 0 HD13 LEU A 17 76.201 10.045 -10.906 1.00 1.00 H new ATOM 0 HD21 LEU A 17 74.995 7.322 -10.086 1.00 1.00 H new ATOM 0 HD22 LEU A 17 76.704 7.634 -10.469 1.00 1.00 H new ATOM 0 HD23 LEU A 17 76.262 6.896 -8.912 1.00 1.00 H new ATOM 252 N VAL A 18 79.226 7.177 -7.982 1.00 1.00 N ATOM 253 CA VAL A 18 79.742 5.826 -8.278 1.00 1.00 C ATOM 254 C VAL A 18 80.136 5.097 -6.987 1.00 1.00 C ATOM 255 O VAL A 18 79.652 3.992 -6.725 1.00 1.00 O ATOM 256 CB VAL A 18 80.897 5.815 -9.340 1.00 1.00 C ATOM 257 CG1 VAL A 18 80.636 6.888 -10.436 1.00 1.00 C ATOM 258 CG2 VAL A 18 82.321 6.001 -8.715 1.00 1.00 C ATOM 0 H VAL A 18 79.841 7.950 -8.237 1.00 1.00 H new ATOM 0 HA VAL A 18 78.924 5.275 -8.742 1.00 1.00 H new ATOM 0 HB VAL A 18 80.890 4.823 -9.792 1.00 1.00 H new ATOM 0 HG11 VAL A 18 81.446 6.868 -11.165 1.00 1.00 H new ATOM 0 HG12 VAL A 18 79.692 6.674 -10.937 1.00 1.00 H new ATOM 0 HG13 VAL A 18 80.587 7.875 -9.975 1.00 1.00 H new ATOM 0 HG21 VAL A 18 83.071 5.983 -9.506 1.00 1.00 H new ATOM 0 HG22 VAL A 18 82.367 6.957 -8.193 1.00 1.00 H new ATOM 0 HG23 VAL A 18 82.518 5.193 -8.011 1.00 1.00 H new ATOM 268 N GLY A 19 81.046 5.682 -6.209 1.00 1.00 N ATOM 269 CA GLY A 19 81.526 5.042 -5.007 1.00 1.00 C ATOM 270 C GLY A 19 80.406 4.716 -4.053 1.00 1.00 C ATOM 271 O GLY A 19 79.229 4.883 -4.376 1.00 1.00 O ATOM 0 H GLY A 19 81.459 6.596 -6.397 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.055 4.126 -5.271 1.00 1.00 H new ATOM 0 HA3 GLY A 19 82.245 5.694 -4.512 1.00 1.00 H new ATOM 275 N PRO A 20 80.756 4.222 -2.895 1.00 1.00 N ATOM 276 CA PRO A 20 79.778 3.823 -1.872 1.00 1.00 C ATOM 277 C PRO A 20 79.251 5.003 -1.049 1.00 1.00 C ATOM 278 O PRO A 20 78.172 4.896 -0.504 1.00 1.00 O ATOM 279 CB PRO A 20 80.542 2.809 -0.982 1.00 1.00 C ATOM 280 CG PRO A 20 81.974 2.819 -1.452 1.00 1.00 C ATOM 281 CD PRO A 20 82.122 4.005 -2.406 1.00 1.00 C ATOM 0 HA PRO A 20 78.884 3.397 -2.328 1.00 1.00 H new ATOM 0 HB2 PRO A 20 80.477 3.090 0.069 1.00 1.00 H new ATOM 0 HB3 PRO A 20 80.111 1.812 -1.073 1.00 1.00 H new ATOM 0 HG2 PRO A 20 82.657 2.916 -0.608 1.00 1.00 H new ATOM 0 HG3 PRO A 20 82.221 1.885 -1.956 1.00 1.00 H new ATOM 0 HD2 PRO A 20 82.510 4.886 -1.895 1.00 1.00 H new ATOM 0 HD3 PRO A 20 82.810 3.781 -3.222 1.00 1.00 H new ATOM 289 N GLY A 21 80.027 6.093 -0.898 1.00 1.00 N ATOM 290 CA GLY A 21 79.560 7.197 -0.041 1.00 1.00 C ATOM 291 C GLY A 21 78.278 7.845 -0.570 1.00 1.00 C ATOM 292 O GLY A 21 77.257 7.861 0.111 1.00 1.00 O ATOM 0 H GLY A 21 80.938 6.231 -1.336 1.00 1.00 H new ATOM 0 HA2 GLY A 21 79.385 6.821 0.967 1.00 1.00 H new ATOM 0 HA3 GLY A 21 80.342 7.953 0.032 1.00 1.00 H new ATOM 296 N GLY A 22 78.332 8.409 -1.769 1.00 1.00 N ATOM 297 CA GLY A 22 77.133 9.087 -2.289 1.00 1.00 C ATOM 298 C GLY A 22 76.013 8.089 -2.191 1.00 1.00 C ATOM 299 O GLY A 22 74.955 8.359 -1.619 1.00 1.00 O ATOM 0 H GLY A 22 79.147 8.418 -2.382 1.00 1.00 H new ATOM 0 HA2 GLY A 22 76.909 9.982 -1.709 1.00 1.00 H new ATOM 0 HA3 GLY A 22 77.282 9.405 -3.321 1.00 1.00 H new ATOM 303 N VAL A 23 76.266 6.922 -2.732 1.00 1.00 N ATOM 304 CA VAL A 23 75.260 5.868 -2.665 1.00 1.00 C ATOM 305 C VAL A 23 74.976 5.511 -1.196 1.00 1.00 C ATOM 306 O VAL A 23 73.858 5.120 -0.871 1.00 1.00 O ATOM 307 CB VAL A 23 75.634 4.607 -3.455 1.00 1.00 C ATOM 308 CG1 VAL A 23 74.448 3.628 -3.404 1.00 1.00 C ATOM 309 CG2 VAL A 23 75.908 4.963 -4.919 1.00 1.00 C ATOM 0 H VAL A 23 77.131 6.673 -3.212 1.00 1.00 H new ATOM 0 HA VAL A 23 74.362 6.265 -3.138 1.00 1.00 H new ATOM 0 HB VAL A 23 76.527 4.160 -3.019 1.00 1.00 H new ATOM 0 HG11 VAL A 23 74.697 2.725 -3.961 1.00 1.00 H new ATOM 0 HG12 VAL A 23 74.236 3.367 -2.367 1.00 1.00 H new ATOM 0 HG13 VAL A 23 73.570 4.097 -3.847 1.00 1.00 H new ATOM 0 HG21 VAL A 23 76.172 4.060 -5.470 1.00 1.00 H new ATOM 0 HG22 VAL A 23 75.015 5.408 -5.359 1.00 1.00 H new ATOM 0 HG23 VAL A 23 76.732 5.675 -4.972 1.00 1.00 H new ATOM 319 N ALA A 24 75.992 5.631 -0.310 1.00 1.00 N ATOM 320 CA ALA A 24 75.742 5.283 1.099 1.00 1.00 C ATOM 321 C ALA A 24 74.594 6.133 1.644 1.00 1.00 C ATOM 322 O ALA A 24 73.571 5.594 2.049 1.00 1.00 O ATOM 323 CB ALA A 24 76.964 5.524 1.999 1.00 1.00 C ATOM 0 H ALA A 24 76.937 5.947 -0.530 1.00 1.00 H new ATOM 0 HA ALA A 24 75.502 4.220 1.115 1.00 1.00 H new ATOM 0 HB1 ALA A 24 76.720 5.250 3.025 1.00 1.00 H new ATOM 0 HB2 ALA A 24 77.799 4.916 1.650 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.242 6.577 1.961 1.00 1.00 H new ATOM 329 N LEU A 25 74.754 7.462 1.688 1.00 1.00 N ATOM 330 CA LEU A 25 73.693 8.307 2.239 1.00 1.00 C ATOM 331 C LEU A 25 72.394 8.184 1.443 1.00 1.00 C ATOM 332 O LEU A 25 71.310 8.102 2.021 1.00 1.00 O ATOM 333 CB LEU A 25 74.176 9.787 2.328 1.00 1.00 C ATOM 334 CG LEU A 25 73.835 10.599 1.048 1.00 1.00 C ATOM 335 CD1 LEU A 25 72.383 11.153 1.101 1.00 1.00 C ATOM 336 CD2 LEU A 25 74.829 11.766 0.896 1.00 1.00 C ATOM 0 H LEU A 25 75.581 7.961 1.360 1.00 1.00 H new ATOM 0 HA LEU A 25 73.471 7.957 3.247 1.00 1.00 H new ATOM 0 HB2 LEU A 25 73.715 10.265 3.192 1.00 1.00 H new ATOM 0 HB3 LEU A 25 75.254 9.806 2.490 1.00 1.00 H new ATOM 0 HG LEU A 25 73.913 9.931 0.190 1.00 1.00 H new ATOM 0 HD11 LEU A 25 72.175 11.716 0.191 1.00 1.00 H new ATOM 0 HD12 LEU A 25 71.680 10.324 1.183 1.00 1.00 H new ATOM 0 HD13 LEU A 25 72.275 11.808 1.966 1.00 1.00 H new ATOM 0 HD21 LEU A 25 74.588 12.334 -0.002 1.00 1.00 H new ATOM 0 HD22 LEU A 25 74.761 12.418 1.767 1.00 1.00 H new ATOM 0 HD23 LEU A 25 75.842 11.373 0.816 1.00 1.00 H new ATOM 348 N VAL A 26 72.495 8.211 0.130 1.00 1.00 N ATOM 349 CA VAL A 26 71.295 8.146 -0.678 1.00 1.00 C ATOM 350 C VAL A 26 70.528 6.866 -0.381 1.00 1.00 C ATOM 351 O VAL A 26 69.353 6.910 -0.015 1.00 1.00 O ATOM 352 CB VAL A 26 71.703 8.199 -2.150 1.00 1.00 C ATOM 353 CG1 VAL A 26 70.541 7.767 -3.046 1.00 1.00 C ATOM 354 CG2 VAL A 26 72.127 9.629 -2.506 1.00 1.00 C ATOM 0 H VAL A 26 73.370 8.276 -0.389 1.00 1.00 H new ATOM 0 HA VAL A 26 70.642 8.987 -0.446 1.00 1.00 H new ATOM 0 HB VAL A 26 72.536 7.515 -2.311 1.00 1.00 H new ATOM 0 HG11 VAL A 26 70.851 7.811 -4.090 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.249 6.747 -2.797 1.00 1.00 H new ATOM 0 HG13 VAL A 26 69.694 8.435 -2.890 1.00 1.00 H new ATOM 0 HG21 VAL A 26 72.419 9.671 -3.555 1.00 1.00 H new ATOM 0 HG22 VAL A 26 71.293 10.309 -2.334 1.00 1.00 H new ATOM 0 HG23 VAL A 26 72.971 9.924 -1.882 1.00 1.00 H new ATOM 364 N VAL A 27 71.171 5.730 -0.574 1.00 1.00 N ATOM 365 CA VAL A 27 70.501 4.461 -0.357 1.00 1.00 C ATOM 366 C VAL A 27 70.086 4.305 1.104 1.00 1.00 C ATOM 367 O VAL A 27 69.031 3.749 1.404 1.00 1.00 O ATOM 368 CB VAL A 27 71.422 3.305 -0.810 1.00 1.00 C ATOM 369 CG1 VAL A 27 72.395 2.911 0.307 1.00 1.00 C ATOM 370 CG2 VAL A 27 70.574 2.090 -1.202 1.00 1.00 C ATOM 0 H VAL A 27 72.143 5.659 -0.876 1.00 1.00 H new ATOM 0 HA VAL A 27 69.589 4.433 -0.954 1.00 1.00 H new ATOM 0 HB VAL A 27 71.999 3.644 -1.670 1.00 1.00 H new ATOM 0 HG11 VAL A 27 73.032 2.096 -0.036 1.00 1.00 H new ATOM 0 HG12 VAL A 27 73.014 3.769 0.570 1.00 1.00 H new ATOM 0 HG13 VAL A 27 71.832 2.588 1.183 1.00 1.00 H new ATOM 0 HG21 VAL A 27 71.227 1.278 -1.521 1.00 1.00 H new ATOM 0 HG22 VAL A 27 69.984 1.766 -0.345 1.00 1.00 H new ATOM 0 HG23 VAL A 27 69.907 2.361 -2.020 1.00 1.00 H new ATOM 380 N LYS A 28 70.920 4.794 2.007 1.00 1.00 N ATOM 381 CA LYS A 28 70.615 4.676 3.423 1.00 1.00 C ATOM 382 C LYS A 28 69.376 5.496 3.737 1.00 1.00 C ATOM 383 O LYS A 28 68.390 4.998 4.281 1.00 1.00 O ATOM 384 CB LYS A 28 71.822 5.219 4.205 1.00 1.00 C ATOM 385 CG LYS A 28 71.605 5.140 5.723 1.00 1.00 C ATOM 386 CD LYS A 28 71.814 3.685 6.230 1.00 1.00 C ATOM 387 CE LYS A 28 73.056 3.610 7.127 1.00 1.00 C ATOM 388 NZ LYS A 28 72.956 4.638 8.201 1.00 1.00 N ATOM 0 H LYS A 28 71.797 5.268 1.791 1.00 1.00 H new ATOM 0 HA LYS A 28 70.424 3.639 3.699 1.00 1.00 H new ATOM 0 HB2 LYS A 28 72.713 4.652 3.936 1.00 1.00 H new ATOM 0 HB3 LYS A 28 72.004 6.255 3.918 1.00 1.00 H new ATOM 0 HG2 LYS A 28 72.298 5.811 6.230 1.00 1.00 H new ATOM 0 HG3 LYS A 28 70.598 5.476 5.970 1.00 1.00 H new ATOM 0 HD2 LYS A 28 70.935 3.356 6.785 1.00 1.00 H new ATOM 0 HD3 LYS A 28 71.927 3.009 5.382 1.00 1.00 H new ATOM 0 HE2 LYS A 28 73.141 2.616 7.567 1.00 1.00 H new ATOM 0 HE3 LYS A 28 73.956 3.774 6.535 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 73.318 4.244 9.093 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 73.519 5.472 7.937 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 71.961 4.916 8.324 1.00 1.00 H new ATOM 402 N VAL A 29 69.471 6.769 3.432 1.00 1.00 N ATOM 403 CA VAL A 29 68.375 7.677 3.735 1.00 1.00 C ATOM 404 C VAL A 29 67.142 7.288 2.950 1.00 1.00 C ATOM 405 O VAL A 29 66.050 7.204 3.510 1.00 1.00 O ATOM 406 CB VAL A 29 68.744 9.141 3.458 1.00 1.00 C ATOM 407 CG1 VAL A 29 67.494 10.022 3.616 1.00 1.00 C ATOM 408 CG2 VAL A 29 69.796 9.595 4.469 1.00 1.00 C ATOM 0 H VAL A 29 70.279 7.200 2.982 1.00 1.00 H new ATOM 0 HA VAL A 29 68.165 7.592 4.801 1.00 1.00 H new ATOM 0 HB VAL A 29 69.135 9.231 2.445 1.00 1.00 H new ATOM 0 HG11 VAL A 29 67.755 11.062 3.420 1.00 1.00 H new ATOM 0 HG12 VAL A 29 66.730 9.700 2.909 1.00 1.00 H new ATOM 0 HG13 VAL A 29 67.110 9.930 4.632 1.00 1.00 H new ATOM 0 HG21 VAL A 29 70.061 10.634 4.276 1.00 1.00 H new ATOM 0 HG22 VAL A 29 69.394 9.504 5.478 1.00 1.00 H new ATOM 0 HG23 VAL A 29 70.684 8.970 4.375 1.00 1.00 H new ATOM 418 N CYS A 30 67.304 7.054 1.659 1.00 1.00 N ATOM 419 CA CYS A 30 66.158 6.691 0.855 1.00 1.00 C ATOM 420 C CYS A 30 65.609 5.335 1.294 1.00 1.00 C ATOM 421 O CYS A 30 64.446 5.231 1.673 1.00 1.00 O ATOM 422 CB CYS A 30 66.577 6.619 -0.609 1.00 1.00 C ATOM 423 SG CYS A 30 65.161 6.161 -1.630 1.00 1.00 S ATOM 0 H CYS A 30 68.192 7.107 1.160 1.00 1.00 H new ATOM 0 HA CYS A 30 65.380 7.443 0.984 1.00 1.00 H new ATOM 0 HB2 CYS A 30 66.972 7.582 -0.931 1.00 1.00 H new ATOM 0 HB3 CYS A 30 67.377 5.889 -0.732 1.00 1.00 H new ATOM 428 N ALA A 31 66.416 4.284 1.196 1.00 1.00 N ATOM 429 CA ALA A 31 65.945 2.949 1.532 1.00 1.00 C ATOM 430 C ALA A 31 65.482 2.879 2.973 1.00 1.00 C ATOM 431 O ALA A 31 64.424 2.326 3.261 1.00 1.00 O ATOM 432 CB ALA A 31 67.060 1.923 1.282 1.00 1.00 C ATOM 0 H ALA A 31 67.388 4.331 0.890 1.00 1.00 H new ATOM 0 HA ALA A 31 65.093 2.716 0.894 1.00 1.00 H new ATOM 0 HB1 ALA A 31 66.700 0.926 1.536 1.00 1.00 H new ATOM 0 HB2 ALA A 31 67.349 1.948 0.231 1.00 1.00 H new ATOM 0 HB3 ALA A 31 67.923 2.166 1.901 1.00 1.00 H new ATOM 438 N GLY A 32 66.297 3.398 3.878 1.00 1.00 N ATOM 439 CA GLY A 32 65.957 3.341 5.285 1.00 1.00 C ATOM 440 C GLY A 32 66.131 1.916 5.772 1.00 1.00 C ATOM 441 O GLY A 32 65.161 1.258 6.127 1.00 1.00 O ATOM 0 H GLY A 32 67.184 3.856 3.666 1.00 1.00 H new ATOM 0 HA2 GLY A 32 66.596 4.015 5.855 1.00 1.00 H new ATOM 0 HA3 GLY A 32 64.929 3.670 5.439 1.00 1.00 H new ATOM 445 N LEU A 33 67.389 1.474 5.731 1.00 1.00 N ATOM 446 CA LEU A 33 67.815 0.118 6.118 1.00 1.00 C ATOM 447 C LEU A 33 67.627 -0.878 4.953 1.00 1.00 C ATOM 448 O LEU A 33 66.544 -0.951 4.368 1.00 1.00 O ATOM 449 CB LEU A 33 67.072 -0.424 7.366 1.00 1.00 C ATOM 450 CG LEU A 33 67.632 0.235 8.643 1.00 1.00 C ATOM 451 CD1 LEU A 33 66.609 0.098 9.774 1.00 1.00 C ATOM 452 CD2 LEU A 33 68.967 -0.428 9.068 1.00 1.00 C ATOM 0 H LEU A 33 68.164 2.060 5.420 1.00 1.00 H new ATOM 0 HA LEU A 33 68.872 0.206 6.370 1.00 1.00 H new ATOM 0 HB2 LEU A 33 66.005 -0.221 7.280 1.00 1.00 H new ATOM 0 HB3 LEU A 33 67.186 -1.506 7.426 1.00 1.00 H new ATOM 0 HG LEU A 33 67.822 1.288 8.437 1.00 1.00 H new ATOM 0 HD11 LEU A 33 67.002 0.563 10.678 1.00 1.00 H new ATOM 0 HD12 LEU A 33 65.680 0.591 9.486 1.00 1.00 H new ATOM 0 HD13 LEU A 33 66.415 -0.958 9.964 1.00 1.00 H new ATOM 0 HD21 LEU A 33 69.342 0.054 9.971 1.00 1.00 H new ATOM 0 HD22 LEU A 33 68.801 -1.487 9.265 1.00 1.00 H new ATOM 0 HD23 LEU A 33 69.699 -0.318 8.268 1.00 1.00 H new ATOM 464 N PRO A 34 68.640 -1.658 4.616 1.00 1.00 N ATOM 465 CA PRO A 34 68.553 -2.669 3.518 1.00 1.00 C ATOM 466 C PRO A 34 67.688 -3.878 3.897 1.00 1.00 C ATOM 467 O PRO A 34 67.462 -4.761 3.069 1.00 1.00 O ATOM 468 CB PRO A 34 70.016 -3.078 3.263 1.00 1.00 C ATOM 469 CG PRO A 34 70.717 -2.841 4.561 1.00 1.00 C ATOM 470 CD PRO A 34 69.991 -1.669 5.233 1.00 1.00 C ATOM 0 HA PRO A 34 68.070 -2.259 2.631 1.00 1.00 H new ATOM 0 HB2 PRO A 34 70.087 -4.123 2.962 1.00 1.00 H new ATOM 0 HB3 PRO A 34 70.458 -2.485 2.462 1.00 1.00 H new ATOM 0 HG2 PRO A 34 70.684 -3.731 5.189 1.00 1.00 H new ATOM 0 HG3 PRO A 34 71.769 -2.605 4.398 1.00 1.00 H new ATOM 0 HD2 PRO A 34 69.932 -1.807 6.313 1.00 1.00 H new ATOM 0 HD3 PRO A 34 70.513 -0.728 5.060 1.00 1.00 H new ATOM 478 N GLY A 35 67.225 -3.938 5.149 1.00 1.00 N ATOM 479 CA GLY A 35 66.425 -5.098 5.540 1.00 1.00 C ATOM 480 C GLY A 35 65.150 -5.184 4.720 1.00 1.00 C ATOM 481 O GLY A 35 64.960 -6.146 3.973 1.00 1.00 O ATOM 0 H GLY A 35 67.379 -3.237 5.874 1.00 1.00 H new ATOM 0 HA2 GLY A 35 67.009 -6.008 5.406 1.00 1.00 H new ATOM 0 HA3 GLY A 35 66.176 -5.032 6.599 1.00 1.00 H new ATOM 485 N VAL A 36 64.280 -4.186 4.821 1.00 1.00 N ATOM 486 CA VAL A 36 63.048 -4.198 4.038 1.00 1.00 C ATOM 487 C VAL A 36 63.354 -3.567 2.695 1.00 1.00 C ATOM 488 O VAL A 36 64.432 -3.782 2.175 1.00 1.00 O ATOM 489 CB VAL A 36 61.925 -3.433 4.779 1.00 1.00 C ATOM 490 CG1 VAL A 36 62.217 -1.909 4.784 1.00 1.00 C ATOM 491 CG2 VAL A 36 60.541 -3.733 4.112 1.00 1.00 C ATOM 0 H VAL A 36 64.399 -3.373 5.425 1.00 1.00 H new ATOM 0 HA VAL A 36 62.692 -5.218 3.895 1.00 1.00 H new ATOM 0 HB VAL A 36 61.891 -3.773 5.814 1.00 1.00 H new ATOM 0 HG11 VAL A 36 61.417 -1.387 5.309 1.00 1.00 H new ATOM 0 HG12 VAL A 36 63.165 -1.722 5.289 1.00 1.00 H new ATOM 0 HG13 VAL A 36 62.274 -1.546 3.758 1.00 1.00 H new ATOM 0 HG21 VAL A 36 59.757 -3.190 4.640 1.00 1.00 H new ATOM 0 HG22 VAL A 36 60.563 -3.415 3.070 1.00 1.00 H new ATOM 0 HG23 VAL A 36 60.338 -4.803 4.161 1.00 1.00 H new ATOM 501 N ILE A 37 62.406 -2.805 2.162 1.00 1.00 N ATOM 502 CA ILE A 37 62.549 -2.119 0.866 1.00 1.00 C ATOM 503 C ILE A 37 62.528 -3.119 -0.305 1.00 1.00 C ATOM 504 O ILE A 37 63.543 -3.438 -0.913 1.00 1.00 O ATOM 505 CB ILE A 37 63.816 -1.175 0.853 1.00 1.00 C ATOM 506 CG1 ILE A 37 63.503 0.081 0.010 1.00 1.00 C ATOM 507 CG2 ILE A 37 65.107 -1.835 0.279 1.00 1.00 C ATOM 508 CD1 ILE A 37 63.025 -0.340 -1.388 1.00 1.00 C ATOM 0 H ILE A 37 61.507 -2.639 2.614 1.00 1.00 H new ATOM 0 HA ILE A 37 61.684 -1.471 0.727 1.00 1.00 H new ATOM 0 HB ILE A 37 64.020 -0.936 1.897 1.00 1.00 H new ATOM 0 HG12 ILE A 37 62.736 0.679 0.502 1.00 1.00 H new ATOM 0 HG13 ILE A 37 64.392 0.707 -0.072 1.00 1.00 H new ATOM 0 HG21 ILE A 37 65.926 -1.117 0.308 1.00 1.00 H new ATOM 0 HG22 ILE A 37 65.367 -2.707 0.879 1.00 1.00 H new ATOM 0 HG23 ILE A 37 64.931 -2.143 -0.752 1.00 1.00 H new ATOM 0 HD11 ILE A 37 62.805 0.548 -1.980 1.00 1.00 H new ATOM 0 HD12 ILE A 37 63.806 -0.920 -1.880 1.00 1.00 H new ATOM 0 HD13 ILE A 37 62.125 -0.947 -1.297 1.00 1.00 H new ATOM 520 N HIS A 38 61.341 -3.610 -0.649 1.00 1.00 N ATOM 521 CA HIS A 38 61.204 -4.555 -1.756 1.00 1.00 C ATOM 522 C HIS A 38 59.954 -4.215 -2.551 1.00 1.00 C ATOM 523 O HIS A 38 58.889 -3.997 -1.975 1.00 1.00 O ATOM 524 CB HIS A 38 61.104 -5.976 -1.199 1.00 1.00 C ATOM 525 CG HIS A 38 62.401 -6.320 -0.528 1.00 1.00 C ATOM 526 ND1 HIS A 38 63.486 -6.810 -1.233 1.00 1.00 N ATOM 527 CD2 HIS A 38 62.819 -6.206 0.775 1.00 1.00 C ATOM 528 CE1 HIS A 38 64.498 -6.967 -0.364 1.00 1.00 C ATOM 529 NE2 HIS A 38 64.145 -6.614 0.875 1.00 1.00 N ATOM 0 H HIS A 38 60.466 -3.373 -0.182 1.00 1.00 H new ATOM 0 HA HIS A 38 62.073 -4.491 -2.411 1.00 1.00 H new ATOM 0 HB2 HIS A 38 60.280 -6.047 -0.489 1.00 1.00 H new ATOM 0 HB3 HIS A 38 60.894 -6.683 -2.002 1.00 1.00 H new ATOM 0 HD2 HIS A 38 62.212 -5.854 1.596 1.00 1.00 H new ATOM 0 HE1 HIS A 38 65.477 -7.334 -0.634 1.00 1.00 H new ATOM 0 HE2 HIS A 38 64.724 -6.638 1.715 1.00 1.00 H new ATOM 537 N THR A 39 60.093 -4.178 -3.878 1.00 1.00 N ATOM 538 CA THR A 39 58.965 -3.867 -4.764 1.00 1.00 C ATOM 539 C THR A 39 58.529 -5.140 -5.515 1.00 1.00 C ATOM 540 O THR A 39 59.357 -5.762 -6.177 1.00 1.00 O ATOM 541 CB THR A 39 59.387 -2.804 -5.791 1.00 1.00 C ATOM 542 OG1 THR A 39 58.550 -2.898 -6.935 1.00 1.00 O ATOM 543 CG2 THR A 39 60.836 -3.043 -6.204 1.00 1.00 C ATOM 0 H THR A 39 60.972 -4.359 -4.363 1.00 1.00 H new ATOM 0 HA THR A 39 58.137 -3.490 -4.163 1.00 1.00 H new ATOM 0 HB THR A 39 59.294 -1.812 -5.349 1.00 1.00 H new ATOM 0 HG1 THR A 39 59.102 -3.032 -7.734 1.00 1.00 H new ATOM 0 HG21 THR A 39 61.136 -2.289 -6.932 1.00 1.00 H new ATOM 0 HG22 THR A 39 61.480 -2.977 -5.327 1.00 1.00 H new ATOM 0 HG23 THR A 39 60.929 -4.034 -6.648 1.00 1.00 H new ATOM 551 N PRO A 40 57.274 -5.552 -5.450 1.00 1.00 N ATOM 552 CA PRO A 40 56.809 -6.785 -6.166 1.00 1.00 C ATOM 553 C PRO A 40 57.213 -6.832 -7.647 1.00 1.00 C ATOM 554 O PRO A 40 57.308 -7.913 -8.230 1.00 1.00 O ATOM 555 CB PRO A 40 55.271 -6.730 -6.054 1.00 1.00 C ATOM 556 CG PRO A 40 54.979 -5.876 -4.860 1.00 1.00 C ATOM 557 CD PRO A 40 56.167 -4.915 -4.697 1.00 1.00 C ATOM 0 HA PRO A 40 57.263 -7.671 -5.722 1.00 1.00 H new ATOM 0 HB2 PRO A 40 54.828 -6.306 -6.955 1.00 1.00 H new ATOM 0 HB3 PRO A 40 54.852 -7.729 -5.932 1.00 1.00 H new ATOM 0 HG2 PRO A 40 54.051 -5.322 -4.999 1.00 1.00 H new ATOM 0 HG3 PRO A 40 54.853 -6.490 -3.968 1.00 1.00 H new ATOM 0 HD2 PRO A 40 55.935 -3.927 -5.095 1.00 1.00 H new ATOM 0 HD3 PRO A 40 56.428 -4.782 -3.647 1.00 1.00 H new ATOM 565 N ALA A 41 57.474 -5.668 -8.243 1.00 1.00 N ATOM 566 CA ALA A 41 57.900 -5.593 -9.647 1.00 1.00 C ATOM 567 C ALA A 41 59.200 -4.806 -9.791 1.00 1.00 C ATOM 568 O ALA A 41 59.321 -3.716 -9.234 1.00 1.00 O ATOM 569 CB ALA A 41 56.807 -4.938 -10.489 1.00 1.00 C ATOM 0 H ALA A 41 57.399 -4.763 -7.778 1.00 1.00 H new ATOM 0 HA ALA A 41 58.075 -6.609 -10.000 1.00 1.00 H new ATOM 0 HB1 ALA A 41 57.131 -4.886 -11.529 1.00 1.00 H new ATOM 0 HB2 ALA A 41 55.893 -5.529 -10.422 1.00 1.00 H new ATOM 0 HB3 ALA A 41 56.616 -3.931 -10.118 1.00 1.00 H new ATOM 575 N ARG A 42 60.152 -5.303 -10.572 1.00 1.00 N ATOM 576 CA ARG A 42 61.385 -4.558 -10.789 1.00 1.00 C ATOM 577 C ARG A 42 62.131 -5.133 -11.986 1.00 1.00 C ATOM 578 O ARG A 42 61.819 -6.228 -12.452 1.00 1.00 O ATOM 579 CB ARG A 42 62.273 -4.562 -9.533 1.00 1.00 C ATOM 580 CG ARG A 42 63.514 -3.661 -9.764 1.00 1.00 C ATOM 581 CD ARG A 42 64.095 -3.155 -8.427 1.00 1.00 C ATOM 582 NE ARG A 42 65.009 -4.143 -7.839 1.00 1.00 N ATOM 583 CZ ARG A 42 64.711 -4.820 -6.725 1.00 1.00 C ATOM 584 NH1 ARG A 42 63.532 -4.712 -6.175 1.00 1.00 N ATOM 585 NH2 ARG A 42 65.603 -5.611 -6.186 1.00 1.00 N ATOM 0 H ARG A 42 60.097 -6.199 -11.056 1.00 1.00 H new ATOM 0 HA ARG A 42 61.128 -3.520 -10.998 1.00 1.00 H new ATOM 0 HB2 ARG A 42 61.706 -4.202 -8.674 1.00 1.00 H new ATOM 0 HB3 ARG A 42 62.589 -5.580 -9.303 1.00 1.00 H new ATOM 0 HG2 ARG A 42 64.277 -4.220 -10.306 1.00 1.00 H new ATOM 0 HG3 ARG A 42 63.238 -2.811 -10.388 1.00 1.00 H new ATOM 0 HD2 ARG A 42 64.625 -2.216 -8.589 1.00 1.00 H new ATOM 0 HD3 ARG A 42 63.283 -2.946 -7.730 1.00 1.00 H new ATOM 0 HE ARG A 42 65.903 -4.319 -8.297 1.00 1.00 H new ATOM 0 HH11 ARG A 42 62.827 -4.106 -6.595 1.00 1.00 H new ATOM 0 HH12 ARG A 42 63.316 -5.233 -5.325 1.00 1.00 H new ATOM 0 HH21 ARG A 42 66.523 -5.710 -6.616 1.00 1.00 H new ATOM 0 HH22 ARG A 42 65.379 -6.129 -5.336 1.00 1.00 H new ATOM 599 N ARG A 43 63.090 -4.368 -12.490 1.00 1.00 N ATOM 600 CA ARG A 43 63.872 -4.789 -13.660 1.00 1.00 C ATOM 601 C ARG A 43 64.637 -6.097 -13.361 1.00 1.00 C ATOM 602 O ARG A 43 65.650 -6.391 -13.992 1.00 1.00 O ATOM 603 CB ARG A 43 64.848 -3.656 -14.066 1.00 1.00 C ATOM 604 CG ARG A 43 65.345 -3.847 -15.519 1.00 1.00 C ATOM 605 CD ARG A 43 64.348 -3.243 -16.524 1.00 1.00 C ATOM 606 NE ARG A 43 64.467 -3.924 -17.816 1.00 1.00 N ATOM 607 CZ ARG A 43 65.204 -3.437 -18.817 1.00 1.00 C ATOM 608 NH1 ARG A 43 65.839 -2.305 -18.688 1.00 1.00 N ATOM 609 NH2 ARG A 43 65.290 -4.101 -19.938 1.00 1.00 N ATOM 0 H ARG A 43 63.349 -3.456 -12.114 1.00 1.00 H new ATOM 0 HA ARG A 43 63.195 -4.984 -14.492 1.00 1.00 H new ATOM 0 HB2 ARG A 43 64.350 -2.691 -13.972 1.00 1.00 H new ATOM 0 HB3 ARG A 43 65.699 -3.643 -13.385 1.00 1.00 H new ATOM 0 HG2 ARG A 43 66.320 -3.375 -15.639 1.00 1.00 H new ATOM 0 HG3 ARG A 43 65.478 -4.909 -15.726 1.00 1.00 H new ATOM 0 HD2 ARG A 43 63.331 -3.341 -16.144 1.00 1.00 H new ATOM 0 HD3 ARG A 43 64.542 -2.177 -16.646 1.00 1.00 H new ATOM 0 HE ARG A 43 63.968 -4.803 -17.956 1.00 1.00 H new ATOM 0 HH11 ARG A 43 65.776 -1.781 -17.815 1.00 1.00 H new ATOM 0 HH12 ARG A 43 66.399 -1.943 -19.460 1.00 1.00 H new ATOM 0 HH21 ARG A 43 64.796 -4.987 -20.045 1.00 1.00 H new ATOM 0 HH22 ARG A 43 65.852 -3.734 -20.706 1.00 1.00 H new ATOM 623 N GLY A 44 64.129 -6.884 -12.403 1.00 1.00 N ATOM 624 CA GLY A 44 64.731 -8.162 -12.011 1.00 1.00 C ATOM 625 C GLY A 44 66.092 -7.939 -11.366 1.00 1.00 C ATOM 626 O GLY A 44 66.505 -8.674 -10.470 1.00 1.00 O ATOM 0 H GLY A 44 63.287 -6.650 -11.878 1.00 1.00 H new ATOM 0 HA2 GLY A 44 64.073 -8.681 -11.314 1.00 1.00 H new ATOM 0 HA3 GLY A 44 64.838 -8.803 -12.886 1.00 1.00 H new ATOM 630 N PHE A 45 66.766 -6.900 -11.829 1.00 1.00 N ATOM 631 CA PHE A 45 68.067 -6.536 -11.313 1.00 1.00 C ATOM 632 C PHE A 45 68.439 -5.153 -11.869 1.00 1.00 C ATOM 633 O PHE A 45 67.741 -4.668 -12.741 1.00 1.00 O ATOM 634 CB PHE A 45 69.104 -7.622 -11.677 1.00 1.00 C ATOM 635 CG PHE A 45 70.517 -7.243 -11.234 1.00 1.00 C ATOM 636 CD1 PHE A 45 70.753 -6.619 -9.998 1.00 1.00 C ATOM 637 CD2 PHE A 45 71.605 -7.526 -12.077 1.00 1.00 C ATOM 638 CE1 PHE A 45 72.052 -6.281 -9.617 1.00 1.00 C ATOM 639 CE2 PHE A 45 72.903 -7.187 -11.686 1.00 1.00 C ATOM 640 CZ PHE A 45 73.124 -6.564 -10.461 1.00 1.00 C ATOM 0 H PHE A 45 66.425 -6.289 -12.571 1.00 1.00 H new ATOM 0 HA PHE A 45 68.051 -6.474 -10.225 1.00 1.00 H new ATOM 0 HB2 PHE A 45 68.819 -8.565 -11.210 1.00 1.00 H new ATOM 0 HB3 PHE A 45 69.094 -7.784 -12.755 1.00 1.00 H new ATOM 0 HD1 PHE A 45 69.925 -6.400 -9.340 1.00 1.00 H new ATOM 0 HD2 PHE A 45 71.438 -8.007 -13.030 1.00 1.00 H new ATOM 0 HE1 PHE A 45 72.227 -5.799 -8.666 1.00 1.00 H new ATOM 0 HE2 PHE A 45 73.737 -7.409 -12.336 1.00 1.00 H new ATOM 0 HZ PHE A 45 74.128 -6.299 -10.164 1.00 1.00 H new ATOM 650 N PHE A 46 69.534 -4.579 -11.337 1.00 1.00 N ATOM 651 CA PHE A 46 70.114 -3.241 -11.677 1.00 1.00 C ATOM 652 C PHE A 46 70.114 -2.431 -10.382 1.00 1.00 C ATOM 653 O PHE A 46 69.046 -2.034 -9.938 1.00 1.00 O ATOM 654 CB PHE A 46 69.349 -2.428 -12.789 1.00 1.00 C ATOM 655 CG PHE A 46 70.114 -2.412 -14.095 1.00 1.00 C ATOM 656 CD1 PHE A 46 69.966 -3.454 -15.014 1.00 1.00 C ATOM 657 CD2 PHE A 46 70.950 -1.328 -14.394 1.00 1.00 C ATOM 658 CE1 PHE A 46 70.655 -3.415 -16.230 1.00 1.00 C ATOM 659 CE2 PHE A 46 71.642 -1.291 -15.607 1.00 1.00 C ATOM 660 CZ PHE A 46 71.494 -2.333 -16.526 1.00 1.00 C ATOM 0 H PHE A 46 70.078 -5.053 -10.616 1.00 1.00 H new ATOM 0 HA PHE A 46 71.105 -3.414 -12.096 1.00 1.00 H new ATOM 0 HB2 PHE A 46 68.364 -2.868 -12.949 1.00 1.00 H new ATOM 0 HB3 PHE A 46 69.190 -1.405 -12.448 1.00 1.00 H new ATOM 0 HD1 PHE A 46 69.320 -4.289 -14.785 1.00 1.00 H new ATOM 0 HD2 PHE A 46 71.060 -0.520 -13.686 1.00 1.00 H new ATOM 0 HE1 PHE A 46 70.540 -4.219 -16.941 1.00 1.00 H new ATOM 0 HE2 PHE A 46 72.291 -0.458 -15.834 1.00 1.00 H new ATOM 0 HZ PHE A 46 72.027 -2.304 -17.465 1.00 1.00 H new ATOM 670 N ARG A 47 71.307 -2.232 -9.781 1.00 1.00 N ATOM 671 CA ARG A 47 71.501 -1.501 -8.510 1.00 1.00 C ATOM 672 C ARG A 47 71.734 -2.492 -7.372 1.00 1.00 C ATOM 673 O ARG A 47 71.264 -3.627 -7.403 1.00 1.00 O ATOM 674 CB ARG A 47 70.358 -0.535 -8.111 1.00 1.00 C ATOM 675 CG ARG A 47 70.363 0.749 -8.997 1.00 1.00 C ATOM 676 CD ARG A 47 69.253 0.712 -10.056 1.00 1.00 C ATOM 677 NE ARG A 47 67.983 0.249 -9.497 1.00 1.00 N ATOM 678 CZ ARG A 47 66.958 -0.067 -10.291 1.00 1.00 C ATOM 679 NH1 ARG A 47 67.080 0.052 -11.583 1.00 1.00 N ATOM 680 NH2 ARG A 47 65.829 -0.495 -9.786 1.00 1.00 N ATOM 0 H ARG A 47 72.180 -2.582 -10.174 1.00 1.00 H new ATOM 0 HA ARG A 47 72.372 -0.869 -8.685 1.00 1.00 H new ATOM 0 HB2 ARG A 47 69.399 -1.043 -8.210 1.00 1.00 H new ATOM 0 HB3 ARG A 47 70.465 -0.256 -7.063 1.00 1.00 H new ATOM 0 HG2 ARG A 47 70.234 1.628 -8.365 1.00 1.00 H new ATOM 0 HG3 ARG A 47 71.331 0.849 -9.488 1.00 1.00 H new ATOM 0 HD2 ARG A 47 69.122 1.708 -10.480 1.00 1.00 H new ATOM 0 HD3 ARG A 47 69.552 0.055 -10.873 1.00 1.00 H new ATOM 0 HE ARG A 47 67.879 0.166 -8.486 1.00 1.00 H new ATOM 0 HH11 ARG A 47 67.957 0.386 -11.984 1.00 1.00 H new ATOM 0 HH12 ARG A 47 66.299 -0.189 -12.193 1.00 1.00 H new ATOM 0 HH21 ARG A 47 65.726 -0.590 -8.776 1.00 1.00 H new ATOM 0 HH22 ARG A 47 65.052 -0.734 -10.403 1.00 1.00 H new ATOM 694 N CYS A 48 72.504 -2.043 -6.385 1.00 1.00 N ATOM 695 CA CYS A 48 72.858 -2.855 -5.223 1.00 1.00 C ATOM 696 C CYS A 48 73.706 -4.060 -5.651 1.00 1.00 C ATOM 697 O CYS A 48 73.234 -5.197 -5.663 1.00 1.00 O ATOM 698 CB CYS A 48 71.600 -3.323 -4.421 1.00 1.00 C ATOM 699 SG CYS A 48 70.086 -2.521 -5.002 1.00 1.00 S ATOM 0 H CYS A 48 72.901 -1.104 -6.368 1.00 1.00 H new ATOM 0 HA CYS A 48 73.446 -2.226 -4.555 1.00 1.00 H new ATOM 0 HB2 CYS A 48 71.495 -4.404 -4.511 1.00 1.00 H new ATOM 0 HB3 CYS A 48 71.743 -3.104 -3.363 1.00 1.00 H new ATOM 704 N ASN A 49 74.957 -3.814 -6.029 1.00 1.00 N ATOM 705 CA ASN A 49 75.831 -4.902 -6.469 1.00 1.00 C ATOM 706 C ASN A 49 77.257 -4.696 -5.950 1.00 1.00 C ATOM 707 O ASN A 49 77.625 -3.593 -5.545 1.00 1.00 O ATOM 708 CB ASN A 49 75.829 -4.981 -8.020 1.00 1.00 C ATOM 709 CG ASN A 49 75.051 -3.809 -8.629 1.00 1.00 C ATOM 710 OD1 ASN A 49 73.864 -3.938 -8.931 1.00 1.00 O ATOM 711 ND2 ASN A 49 75.657 -2.667 -8.828 1.00 1.00 N ATOM 0 H ASN A 49 75.385 -2.888 -6.041 1.00 1.00 H new ATOM 0 HA ASN A 49 75.454 -5.840 -6.062 1.00 1.00 H new ATOM 0 HB2 ASN A 49 76.854 -4.972 -8.389 1.00 1.00 H new ATOM 0 HB3 ASN A 49 75.383 -5.923 -8.339 1.00 1.00 H new ATOM 0 HD21 ASN A 49 75.146 -1.883 -9.234 1.00 1.00 H new ATOM 0 HD22 ASN A 49 76.640 -2.561 -8.578 1.00 1.00 H new ATOM 718 N PRO A 50 78.057 -5.740 -5.980 1.00 1.00 N ATOM 719 CA PRO A 50 79.486 -5.689 -5.533 1.00 1.00 C ATOM 720 C PRO A 50 80.335 -4.797 -6.444 1.00 1.00 C ATOM 721 O PRO A 50 81.434 -5.169 -6.865 1.00 1.00 O ATOM 722 CB PRO A 50 79.936 -7.162 -5.586 1.00 1.00 C ATOM 723 CG PRO A 50 79.014 -7.819 -6.562 1.00 1.00 C ATOM 724 CD PRO A 50 77.679 -7.096 -6.429 1.00 1.00 C ATOM 0 HA PRO A 50 79.601 -5.253 -4.541 1.00 1.00 H new ATOM 0 HB2 PRO A 50 80.974 -7.245 -5.908 1.00 1.00 H new ATOM 0 HB3 PRO A 50 79.868 -7.630 -4.604 1.00 1.00 H new ATOM 0 HG2 PRO A 50 79.401 -7.741 -7.578 1.00 1.00 H new ATOM 0 HG3 PRO A 50 78.906 -8.881 -6.343 1.00 1.00 H new ATOM 0 HD2 PRO A 50 77.143 -7.069 -7.377 1.00 1.00 H new ATOM 0 HD3 PRO A 50 77.027 -7.589 -5.708 1.00 1.00 H new ATOM 732 N GLU A 51 79.811 -3.618 -6.730 1.00 1.00 N ATOM 733 CA GLU A 51 80.497 -2.655 -7.574 1.00 1.00 C ATOM 734 C GLU A 51 80.823 -3.247 -8.943 1.00 1.00 C ATOM 735 O GLU A 51 81.566 -2.647 -9.723 1.00 1.00 O ATOM 736 CB GLU A 51 81.775 -2.174 -6.880 1.00 1.00 C ATOM 737 CG GLU A 51 81.489 -1.944 -5.378 1.00 1.00 C ATOM 738 CD GLU A 51 82.379 -0.835 -4.821 1.00 1.00 C ATOM 739 OE1 GLU A 51 83.340 -0.484 -5.482 1.00 1.00 O ATOM 740 OE2 GLU A 51 82.085 -0.358 -3.737 1.00 1.00 O ATOM 0 H GLU A 51 78.904 -3.302 -6.386 1.00 1.00 H new ATOM 0 HA GLU A 51 79.833 -1.805 -7.732 1.00 1.00 H new ATOM 0 HB2 GLU A 51 82.568 -2.912 -7.002 1.00 1.00 H new ATOM 0 HB3 GLU A 51 82.126 -1.250 -7.340 1.00 1.00 H new ATOM 0 HG2 GLU A 51 80.441 -1.680 -5.239 1.00 1.00 H new ATOM 0 HG3 GLU A 51 81.661 -2.867 -4.825 1.00 1.00 H new ATOM 747 N ARG A 52 80.233 -4.402 -9.252 1.00 1.00 N ATOM 748 CA ARG A 52 80.444 -5.024 -10.555 1.00 1.00 C ATOM 749 C ARG A 52 79.433 -4.414 -11.517 1.00 1.00 C ATOM 750 O ARG A 52 78.346 -4.024 -11.092 1.00 1.00 O ATOM 751 CB ARG A 52 80.279 -6.568 -10.457 1.00 1.00 C ATOM 752 CG ARG A 52 78.835 -7.029 -10.756 1.00 1.00 C ATOM 753 CD ARG A 52 78.756 -8.550 -10.620 1.00 1.00 C ATOM 754 NE ARG A 52 77.414 -9.014 -10.959 1.00 1.00 N ATOM 755 CZ ARG A 52 77.018 -9.096 -12.228 1.00 1.00 C ATOM 756 NH1 ARG A 52 77.847 -8.786 -13.189 1.00 1.00 N ATOM 757 NH2 ARG A 52 75.807 -9.496 -12.517 1.00 1.00 N ATOM 0 H ARG A 52 79.614 -4.918 -8.627 1.00 1.00 H new ATOM 0 HA ARG A 52 81.457 -4.841 -10.914 1.00 1.00 H new ATOM 0 HB2 ARG A 52 80.963 -7.048 -11.157 1.00 1.00 H new ATOM 0 HB3 ARG A 52 80.563 -6.898 -9.458 1.00 1.00 H new ATOM 0 HG2 ARG A 52 78.138 -6.553 -10.066 1.00 1.00 H new ATOM 0 HG3 ARG A 52 78.544 -6.726 -11.762 1.00 1.00 H new ATOM 0 HD2 ARG A 52 79.489 -9.020 -11.276 1.00 1.00 H new ATOM 0 HD3 ARG A 52 79.005 -8.845 -9.601 1.00 1.00 H new ATOM 0 HE ARG A 52 76.770 -9.279 -10.213 1.00 1.00 H new ATOM 0 HH11 ARG A 52 78.795 -8.482 -12.967 1.00 1.00 H new ATOM 0 HH12 ARG A 52 77.546 -8.848 -14.162 1.00 1.00 H new ATOM 0 HH21 ARG A 52 75.161 -9.747 -11.769 1.00 1.00 H new ATOM 0 HH22 ARG A 52 75.509 -9.557 -13.491 1.00 1.00 H new ATOM 771 N ILE A 53 79.786 -4.274 -12.786 1.00 1.00 N ATOM 772 CA ILE A 53 78.896 -3.659 -13.760 1.00 1.00 C ATOM 773 C ILE A 53 77.485 -4.240 -13.730 1.00 1.00 C ATOM 774 O ILE A 53 77.279 -5.451 -13.626 1.00 1.00 O ATOM 775 CB ILE A 53 79.525 -3.872 -15.135 1.00 1.00 C ATOM 776 CG1 ILE A 53 78.744 -3.112 -16.221 1.00 1.00 C ATOM 777 CG2 ILE A 53 79.539 -5.366 -15.448 1.00 1.00 C ATOM 778 CD1 ILE A 53 78.957 -1.598 -16.068 1.00 1.00 C ATOM 0 H ILE A 53 80.683 -4.578 -13.166 1.00 1.00 H new ATOM 0 HA ILE A 53 78.785 -2.601 -13.522 1.00 1.00 H new ATOM 0 HB ILE A 53 80.544 -3.486 -15.123 1.00 1.00 H new ATOM 0 HG12 ILE A 53 79.073 -3.435 -17.209 1.00 1.00 H new ATOM 0 HG13 ILE A 53 77.682 -3.346 -16.147 1.00 1.00 H new ATOM 0 HG21 ILE A 53 79.987 -5.528 -16.429 1.00 1.00 H new ATOM 0 HG22 ILE A 53 80.122 -5.891 -14.691 1.00 1.00 H new ATOM 0 HG23 ILE A 53 78.518 -5.747 -15.448 1.00 1.00 H new ATOM 0 HD11 ILE A 53 78.399 -1.072 -16.843 1.00 1.00 H new ATOM 0 HD12 ILE A 53 78.605 -1.278 -15.087 1.00 1.00 H new ATOM 0 HD13 ILE A 53 80.018 -1.368 -16.166 1.00 1.00 H new ATOM 790 N GLN A 54 76.522 -3.331 -13.841 1.00 1.00 N ATOM 791 CA GLN A 54 75.116 -3.717 -13.839 1.00 1.00 C ATOM 792 C GLN A 54 74.755 -4.317 -15.204 1.00 1.00 C ATOM 793 O GLN A 54 74.128 -3.668 -16.041 1.00 1.00 O ATOM 794 CB GLN A 54 74.242 -2.480 -13.542 1.00 1.00 C ATOM 795 CG GLN A 54 74.892 -1.219 -14.143 1.00 1.00 C ATOM 796 CD GLN A 54 75.922 -0.627 -13.181 1.00 1.00 C ATOM 797 OE1 GLN A 54 77.013 -0.247 -13.603 1.00 1.00 O ATOM 798 NE2 GLN A 54 75.648 -0.526 -11.906 1.00 1.00 N ATOM 0 H GLN A 54 76.688 -2.329 -13.933 1.00 1.00 H new ATOM 0 HA GLN A 54 74.936 -4.464 -13.066 1.00 1.00 H new ATOM 0 HB2 GLN A 54 73.245 -2.620 -13.960 1.00 1.00 H new ATOM 0 HB3 GLN A 54 74.122 -2.359 -12.465 1.00 1.00 H new ATOM 0 HG2 GLN A 54 75.373 -1.468 -15.089 1.00 1.00 H new ATOM 0 HG3 GLN A 54 74.124 -0.477 -14.361 1.00 1.00 H new ATOM 0 HE21 GLN A 54 74.744 -0.840 -11.552 1.00 1.00 H new ATOM 0 HE22 GLN A 54 76.338 -0.133 -11.266 1.00 1.00 H new ATOM 807 N ILE A 55 75.126 -5.593 -15.384 1.00 1.00 N ATOM 808 CA ILE A 55 74.828 -6.347 -16.615 1.00 1.00 C ATOM 809 C ILE A 55 74.607 -7.835 -16.287 1.00 1.00 C ATOM 810 O ILE A 55 75.085 -8.326 -15.265 1.00 1.00 O ATOM 811 CB ILE A 55 75.965 -6.146 -17.666 1.00 1.00 C ATOM 812 CG1 ILE A 55 75.598 -4.993 -18.616 1.00 1.00 C ATOM 813 CG2 ILE A 55 76.206 -7.413 -18.505 1.00 1.00 C ATOM 814 CD1 ILE A 55 76.816 -4.577 -19.453 1.00 1.00 C ATOM 0 H ILE A 55 75.639 -6.131 -14.685 1.00 1.00 H new ATOM 0 HA ILE A 55 73.906 -5.965 -17.054 1.00 1.00 H new ATOM 0 HB ILE A 55 76.877 -5.918 -17.115 1.00 1.00 H new ATOM 0 HG12 ILE A 55 74.785 -5.301 -19.274 1.00 1.00 H new ATOM 0 HG13 ILE A 55 75.237 -4.141 -18.040 1.00 1.00 H new ATOM 0 HG21 ILE A 55 77.005 -7.228 -19.223 1.00 1.00 H new ATOM 0 HG22 ILE A 55 76.491 -8.235 -17.849 1.00 1.00 H new ATOM 0 HG23 ILE A 55 75.292 -7.675 -19.039 1.00 1.00 H new ATOM 0 HD11 ILE A 55 76.538 -3.760 -20.119 1.00 1.00 H new ATOM 0 HD12 ILE A 55 77.617 -4.248 -18.791 1.00 1.00 H new ATOM 0 HD13 ILE A 55 77.159 -5.426 -20.044 1.00 1.00 H new ATOM 826 N GLY A 56 73.889 -8.553 -17.159 1.00 1.00 N ATOM 827 CA GLY A 56 73.624 -9.976 -16.946 1.00 1.00 C ATOM 828 C GLY A 56 72.168 -10.198 -16.582 1.00 1.00 C ATOM 829 O GLY A 56 71.741 -11.331 -16.345 1.00 1.00 O ATOM 0 H GLY A 56 73.484 -8.172 -18.014 1.00 1.00 H new ATOM 0 HA2 GLY A 56 73.869 -10.536 -17.848 1.00 1.00 H new ATOM 0 HA3 GLY A 56 74.266 -10.356 -16.151 1.00 1.00 H new ATOM 833 N ASP A 57 71.410 -9.110 -16.515 1.00 1.00 N ATOM 834 CA ASP A 57 70.001 -9.198 -16.149 1.00 1.00 C ATOM 835 C ASP A 57 69.117 -9.625 -17.327 1.00 1.00 C ATOM 836 O ASP A 57 68.763 -8.822 -18.193 1.00 1.00 O ATOM 837 CB ASP A 57 69.531 -7.840 -15.628 1.00 1.00 C ATOM 838 CG ASP A 57 69.541 -6.810 -16.751 1.00 1.00 C ATOM 839 OD1 ASP A 57 70.239 -7.034 -17.728 1.00 1.00 O ATOM 840 OD2 ASP A 57 68.860 -5.811 -16.612 1.00 1.00 O ATOM 0 H ASP A 57 71.743 -8.165 -16.707 1.00 1.00 H new ATOM 0 HA ASP A 57 69.907 -9.961 -15.377 1.00 1.00 H new ATOM 0 HB2 ASP A 57 68.526 -7.929 -15.216 1.00 1.00 H new ATOM 0 HB3 ASP A 57 70.180 -7.510 -14.817 1.00 1.00 H new ATOM 845 N TRP A 58 68.745 -10.895 -17.316 1.00 1.00 N ATOM 846 CA TRP A 58 67.874 -11.493 -18.327 1.00 1.00 C ATOM 847 C TRP A 58 66.432 -11.092 -18.007 1.00 1.00 C ATOM 848 O TRP A 58 66.226 -10.421 -17.001 1.00 1.00 O ATOM 849 CB TRP A 58 68.092 -13.004 -18.333 1.00 1.00 C ATOM 850 CG TRP A 58 69.285 -13.321 -19.185 1.00 1.00 C ATOM 851 CD1 TRP A 58 70.363 -12.514 -19.326 1.00 1.00 C ATOM 852 CD2 TRP A 58 69.544 -14.495 -20.009 1.00 1.00 C ATOM 853 NE1 TRP A 58 71.264 -13.114 -20.184 1.00 1.00 N ATOM 854 CE2 TRP A 58 70.808 -14.340 -20.631 1.00 1.00 C ATOM 855 CE3 TRP A 58 68.815 -15.666 -20.273 1.00 1.00 C ATOM 856 CZ2 TRP A 58 71.327 -15.312 -21.487 1.00 1.00 C ATOM 857 CZ3 TRP A 58 69.335 -16.647 -21.133 1.00 1.00 C ATOM 858 CH2 TRP A 58 70.588 -16.470 -21.739 1.00 1.00 C ATOM 0 H TRP A 58 69.042 -11.553 -16.595 1.00 1.00 H new ATOM 0 HA TRP A 58 68.102 -11.136 -19.331 1.00 1.00 H new ATOM 0 HB2 TRP A 58 68.248 -13.366 -17.317 1.00 1.00 H new ATOM 0 HB3 TRP A 58 67.208 -13.511 -18.720 1.00 1.00 H new ATOM 0 HD1 TRP A 58 70.497 -11.556 -18.845 1.00 1.00 H new ATOM 0 HE1 TRP A 58 72.157 -12.702 -20.455 1.00 1.00 H new ATOM 0 HE3 TRP A 58 67.849 -15.813 -19.812 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 72.292 -15.170 -21.951 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 68.766 -17.544 -21.329 1.00 1.00 H new ATOM 0 HH2 TRP A 58 70.981 -17.229 -22.400 1.00 1.00 H new ATOM 869 N ARG A 59 65.400 -11.486 -18.785 1.00 1.00 N ATOM 870 CA ARG A 59 64.027 -11.118 -18.443 1.00 1.00 C ATOM 871 C ARG A 59 63.281 -12.282 -17.751 1.00 1.00 C ATOM 872 O ARG A 59 62.603 -12.098 -16.759 1.00 1.00 O ATOM 873 CB ARG A 59 63.293 -10.755 -19.738 1.00 1.00 C ATOM 874 CG ARG A 59 63.943 -9.511 -20.418 1.00 1.00 C ATOM 875 CD ARG A 59 64.709 -9.904 -21.701 1.00 1.00 C ATOM 876 NE ARG A 59 63.896 -10.774 -22.545 1.00 1.00 N ATOM 877 CZ ARG A 59 64.456 -11.569 -23.455 1.00 1.00 C ATOM 878 NH1 ARG A 59 65.748 -11.539 -23.644 1.00 1.00 N ATOM 879 NH2 ARG A 59 63.715 -12.376 -24.165 1.00 1.00 N ATOM 0 H ARG A 59 65.496 -12.045 -19.632 1.00 1.00 H new ATOM 0 HA ARG A 59 64.052 -10.276 -17.751 1.00 1.00 H new ATOM 0 HB2 ARG A 59 63.316 -11.602 -20.423 1.00 1.00 H new ATOM 0 HB3 ARG A 59 62.245 -10.549 -19.521 1.00 1.00 H new ATOM 0 HG2 ARG A 59 63.170 -8.783 -20.663 1.00 1.00 H new ATOM 0 HG3 ARG A 59 64.625 -9.028 -19.719 1.00 1.00 H new ATOM 0 HD2 ARG A 59 64.984 -9.006 -22.255 1.00 1.00 H new ATOM 0 HD3 ARG A 59 65.636 -10.411 -21.435 1.00 1.00 H new ATOM 0 HE ARG A 59 62.882 -10.773 -22.436 1.00 1.00 H new ATOM 0 HH11 ARG A 59 66.329 -10.906 -23.094 1.00 1.00 H new ATOM 0 HH12 ARG A 59 66.176 -12.148 -24.341 1.00 1.00 H new ATOM 0 HH21 ARG A 59 62.705 -12.398 -24.023 1.00 1.00 H new ATOM 0 HH22 ARG A 59 64.146 -12.984 -24.861 1.00 1.00 H new ATOM 893 N TYR A 60 63.372 -13.463 -18.372 1.00 1.00 N ATOM 894 CA TYR A 60 62.707 -14.716 -17.924 1.00 1.00 C ATOM 895 C TYR A 60 63.529 -15.504 -16.883 1.00 1.00 C ATOM 896 O TYR A 60 63.056 -16.481 -16.268 1.00 1.00 O ATOM 897 CB TYR A 60 62.420 -15.617 -19.147 1.00 1.00 C ATOM 898 CG TYR A 60 63.627 -16.480 -19.481 1.00 1.00 C ATOM 899 CD1 TYR A 60 63.813 -17.702 -18.817 1.00 1.00 C ATOM 900 CD2 TYR A 60 64.549 -16.066 -20.450 1.00 1.00 C ATOM 901 CE1 TYR A 60 64.918 -18.505 -19.121 1.00 1.00 C ATOM 902 CE2 TYR A 60 65.656 -16.873 -20.755 1.00 1.00 C ATOM 903 CZ TYR A 60 65.838 -18.091 -20.089 1.00 1.00 C ATOM 904 OH TYR A 60 66.929 -18.886 -20.388 1.00 1.00 O ATOM 0 H TYR A 60 63.921 -13.589 -19.222 1.00 1.00 H new ATOM 0 HA TYR A 60 61.778 -14.422 -17.436 1.00 1.00 H new ATOM 0 HB2 TYR A 60 61.559 -16.253 -18.941 1.00 1.00 H new ATOM 0 HB3 TYR A 60 62.161 -14.999 -20.006 1.00 1.00 H new ATOM 0 HD1 TYR A 60 63.102 -18.023 -18.070 1.00 1.00 H new ATOM 0 HD2 TYR A 60 64.408 -15.126 -20.963 1.00 1.00 H new ATOM 0 HE1 TYR A 60 65.060 -19.445 -18.608 1.00 1.00 H new ATOM 0 HE2 TYR A 60 66.367 -16.555 -21.503 1.00 1.00 H new ATOM 0 HH TYR A 60 67.185 -18.752 -21.324 1.00 1.00 H new ATOM 914 N GLU A 61 64.754 -15.094 -16.678 1.00 1.00 N ATOM 915 CA GLU A 61 65.619 -15.775 -15.740 1.00 1.00 C ATOM 916 C GLU A 61 65.231 -15.437 -14.313 1.00 1.00 C ATOM 917 O GLU A 61 65.702 -16.047 -13.375 1.00 1.00 O ATOM 918 CB GLU A 61 67.055 -15.343 -16.013 1.00 1.00 C ATOM 919 CG GLU A 61 68.047 -16.311 -15.368 1.00 1.00 C ATOM 920 CD GLU A 61 69.474 -15.833 -15.627 1.00 1.00 C ATOM 921 OE1 GLU A 61 69.733 -14.658 -15.419 1.00 1.00 O ATOM 922 OE2 GLU A 61 70.286 -16.647 -16.037 1.00 1.00 O ATOM 0 H GLU A 61 65.178 -14.293 -17.146 1.00 1.00 H new ATOM 0 HA GLU A 61 65.522 -16.853 -15.865 1.00 1.00 H new ATOM 0 HB2 GLU A 61 67.228 -15.301 -17.088 1.00 1.00 H new ATOM 0 HB3 GLU A 61 67.217 -14.337 -15.625 1.00 1.00 H new ATOM 0 HG2 GLU A 61 67.863 -16.374 -14.295 1.00 1.00 H new ATOM 0 HG3 GLU A 61 67.909 -17.313 -15.775 1.00 1.00 H new ATOM 929 N VAL A 62 64.421 -14.413 -14.154 1.00 1.00 N ATOM 930 CA VAL A 62 64.051 -13.934 -12.810 1.00 1.00 C ATOM 931 C VAL A 62 63.723 -15.111 -11.922 1.00 1.00 C ATOM 932 O VAL A 62 64.225 -15.208 -10.817 1.00 1.00 O ATOM 933 CB VAL A 62 62.817 -12.974 -12.856 1.00 1.00 C ATOM 934 CG1 VAL A 62 63.064 -11.715 -12.015 1.00 1.00 C ATOM 935 CG2 VAL A 62 62.557 -12.548 -14.284 1.00 1.00 C ATOM 0 H VAL A 62 64.001 -13.890 -14.922 1.00 1.00 H new ATOM 0 HA VAL A 62 64.902 -13.381 -12.412 1.00 1.00 H new ATOM 0 HB VAL A 62 61.960 -13.512 -12.452 1.00 1.00 H new ATOM 0 HG11 VAL A 62 62.190 -11.066 -12.066 1.00 1.00 H new ATOM 0 HG12 VAL A 62 63.245 -12.000 -10.979 1.00 1.00 H new ATOM 0 HG13 VAL A 62 63.933 -11.183 -12.402 1.00 1.00 H new ATOM 0 HG21 VAL A 62 61.697 -11.879 -14.313 1.00 1.00 H new ATOM 0 HG22 VAL A 62 63.433 -12.030 -14.674 1.00 1.00 H new ATOM 0 HG23 VAL A 62 62.354 -13.428 -14.895 1.00 1.00 H new ATOM 945 N ALA A 63 62.874 -15.997 -12.384 1.00 1.00 N ATOM 946 CA ALA A 63 62.514 -17.133 -11.602 1.00 1.00 C ATOM 947 C ALA A 63 63.721 -18.027 -11.469 1.00 1.00 C ATOM 948 O ALA A 63 64.078 -18.446 -10.364 1.00 1.00 O ATOM 949 CB ALA A 63 61.381 -17.886 -12.306 1.00 1.00 C ATOM 0 H ALA A 63 62.425 -15.945 -13.298 1.00 1.00 H new ATOM 0 HA ALA A 63 62.177 -16.824 -10.613 1.00 1.00 H new ATOM 0 HB1 ALA A 63 61.100 -18.757 -11.714 1.00 1.00 H new ATOM 0 HB2 ALA A 63 60.519 -17.228 -12.415 1.00 1.00 H new ATOM 0 HB3 ALA A 63 61.717 -18.210 -13.291 1.00 1.00 H new ATOM 955 N HIS A 64 64.381 -18.270 -12.608 1.00 1.00 N ATOM 956 CA HIS A 64 65.572 -19.120 -12.592 1.00 1.00 C ATOM 957 C HIS A 64 66.599 -18.567 -11.576 1.00 1.00 C ATOM 958 O HIS A 64 66.965 -19.236 -10.605 1.00 1.00 O ATOM 959 CB HIS A 64 66.154 -19.178 -14.027 1.00 1.00 C ATOM 960 CG HIS A 64 66.527 -20.585 -14.418 1.00 1.00 C ATOM 961 ND1 HIS A 64 67.182 -21.444 -13.557 1.00 1.00 N ATOM 962 CD2 HIS A 64 66.339 -21.289 -15.584 1.00 1.00 C ATOM 963 CE1 HIS A 64 67.362 -22.609 -14.206 1.00 1.00 C ATOM 964 NE2 HIS A 64 66.867 -22.568 -15.446 1.00 1.00 N ATOM 0 H HIS A 64 64.120 -17.903 -13.523 1.00 1.00 H new ATOM 0 HA HIS A 64 65.319 -20.132 -12.277 1.00 1.00 H new ATOM 0 HB2 HIS A 64 65.422 -18.785 -14.733 1.00 1.00 H new ATOM 0 HB3 HIS A 64 67.033 -18.537 -14.090 1.00 1.00 H new ATOM 0 HD2 HIS A 64 65.855 -20.907 -16.471 1.00 1.00 H new ATOM 0 HE1 HIS A 64 67.848 -23.473 -13.776 1.00 1.00 H new ATOM 0 HE2 HIS A 64 66.875 -23.314 -16.142 1.00 1.00 H new ATOM 972 N ASP A 65 67.033 -17.333 -11.778 1.00 1.00 N ATOM 973 CA ASP A 65 67.978 -16.706 -10.857 1.00 1.00 C ATOM 974 C ASP A 65 67.292 -16.481 -9.503 1.00 1.00 C ATOM 975 O ASP A 65 67.769 -16.931 -8.447 1.00 1.00 O ATOM 976 CB ASP A 65 68.465 -15.377 -11.451 1.00 1.00 C ATOM 977 CG ASP A 65 69.403 -14.676 -10.478 1.00 1.00 C ATOM 978 OD1 ASP A 65 70.539 -15.109 -10.368 1.00 1.00 O ATOM 979 OD2 ASP A 65 68.975 -13.714 -9.862 1.00 1.00 O ATOM 0 H ASP A 65 66.751 -16.747 -12.564 1.00 1.00 H new ATOM 0 HA ASP A 65 68.841 -17.354 -10.707 1.00 1.00 H new ATOM 0 HB2 ASP A 65 68.979 -15.559 -12.395 1.00 1.00 H new ATOM 0 HB3 ASP A 65 67.612 -14.735 -11.671 1.00 1.00 H new ATOM 984 N GLY A 66 66.141 -15.818 -9.526 1.00 1.00 N ATOM 985 CA GLY A 66 65.362 -15.565 -8.317 1.00 1.00 C ATOM 986 C GLY A 66 64.879 -16.863 -7.683 1.00 1.00 C ATOM 987 O GLY A 66 63.864 -16.887 -6.989 1.00 1.00 O ATOM 0 H GLY A 66 65.723 -15.442 -10.377 1.00 1.00 H new ATOM 0 HA2 GLY A 66 65.970 -15.013 -7.600 1.00 1.00 H new ATOM 0 HA3 GLY A 66 64.505 -14.936 -8.560 1.00 1.00 H new ATOM 991 N ARG A 67 65.666 -17.904 -7.847 1.00 1.00 N ATOM 992 CA ARG A 67 65.410 -19.178 -7.221 1.00 1.00 C ATOM 993 C ARG A 67 65.800 -19.071 -5.761 1.00 1.00 C ATOM 994 O ARG A 67 65.699 -20.058 -5.031 1.00 1.00 O ATOM 995 CB ARG A 67 66.236 -20.316 -7.827 1.00 1.00 C ATOM 996 CG ARG A 67 65.560 -20.883 -9.077 1.00 1.00 C ATOM 997 CD ARG A 67 64.475 -21.895 -8.696 1.00 1.00 C ATOM 998 NE ARG A 67 63.439 -21.884 -9.714 1.00 1.00 N ATOM 999 CZ ARG A 67 62.582 -22.882 -9.824 1.00 1.00 C ATOM 1000 NH1 ARG A 67 62.694 -23.916 -9.038 1.00 1.00 N ATOM 1001 NH2 ARG A 67 61.636 -22.830 -10.717 1.00 1.00 N ATOM 0 H ARG A 67 66.507 -17.887 -8.423 1.00 1.00 H new ATOM 0 HA ARG A 67 64.354 -19.406 -7.366 1.00 1.00 H new ATOM 0 HB2 ARG A 67 67.231 -19.951 -8.082 1.00 1.00 H new ATOM 0 HB3 ARG A 67 66.366 -21.108 -7.089 1.00 1.00 H new ATOM 0 HG2 ARG A 67 65.120 -20.072 -9.658 1.00 1.00 H new ATOM 0 HG3 ARG A 67 66.304 -21.363 -9.713 1.00 1.00 H new ATOM 0 HD2 ARG A 67 64.905 -22.893 -8.608 1.00 1.00 H new ATOM 0 HD3 ARG A 67 64.050 -21.644 -7.724 1.00 1.00 H new ATOM 0 HE ARG A 67 63.373 -21.093 -10.354 1.00 1.00 H new ATOM 0 HH11 ARG A 67 63.440 -23.950 -8.344 1.00 1.00 H new ATOM 0 HH12 ARG A 67 62.035 -24.691 -9.117 1.00 1.00 H new ATOM 0 HH21 ARG A 67 61.558 -22.019 -11.330 1.00 1.00 H new ATOM 0 HH22 ARG A 67 60.973 -23.600 -10.803 1.00 1.00 H new ATOM 1015 N LEU A 68 66.332 -17.899 -5.361 1.00 1.00 N ATOM 1016 CA LEU A 68 66.813 -17.734 -3.976 1.00 1.00 C ATOM 1017 C LEU A 68 65.900 -18.530 -3.044 1.00 1.00 C ATOM 1018 O LEU A 68 66.312 -19.017 -1.993 1.00 1.00 O ATOM 1019 CB LEU A 68 66.844 -16.254 -3.527 1.00 1.00 C ATOM 1020 CG LEU A 68 67.478 -16.146 -2.096 1.00 1.00 C ATOM 1021 CD1 LEU A 68 68.450 -14.961 -2.012 1.00 1.00 C ATOM 1022 CD2 LEU A 68 66.386 -15.942 -1.039 1.00 1.00 C ATOM 0 H LEU A 68 66.438 -17.077 -5.956 1.00 1.00 H new ATOM 0 HA LEU A 68 67.838 -18.102 -3.932 1.00 1.00 H new ATOM 0 HB2 LEU A 68 67.422 -15.661 -4.236 1.00 1.00 H new ATOM 0 HB3 LEU A 68 65.833 -15.846 -3.519 1.00 1.00 H new ATOM 0 HG LEU A 68 68.015 -17.076 -1.909 1.00 1.00 H new ATOM 0 HD11 LEU A 68 68.875 -14.909 -1.010 1.00 1.00 H new ATOM 0 HD12 LEU A 68 69.251 -15.095 -2.739 1.00 1.00 H new ATOM 0 HD13 LEU A 68 67.915 -14.036 -2.227 1.00 1.00 H new ATOM 0 HD21 LEU A 68 66.844 -15.869 -0.052 1.00 1.00 H new ATOM 0 HD22 LEU A 68 65.839 -15.024 -1.254 1.00 1.00 H new ATOM 0 HD23 LEU A 68 65.698 -16.787 -1.058 1.00 1.00 H new ATOM 1034 N LEU A 69 64.638 -18.641 -3.450 1.00 1.00 N ATOM 1035 CA LEU A 69 63.679 -19.395 -2.626 1.00 1.00 C ATOM 1036 C LEU A 69 64.001 -20.910 -2.643 1.00 1.00 C ATOM 1037 O LEU A 69 64.387 -21.467 -1.616 1.00 1.00 O ATOM 1038 CB LEU A 69 62.253 -19.195 -3.190 1.00 1.00 C ATOM 1039 CG LEU A 69 61.574 -17.988 -2.543 1.00 1.00 C ATOM 1040 CD1 LEU A 69 62.387 -16.725 -2.819 1.00 1.00 C ATOM 1041 CD2 LEU A 69 60.169 -17.834 -3.135 1.00 1.00 C ATOM 0 H LEU A 69 64.260 -18.239 -4.308 1.00 1.00 H new ATOM 0 HA LEU A 69 63.748 -19.027 -1.602 1.00 1.00 H new ATOM 0 HB2 LEU A 69 62.301 -19.054 -4.270 1.00 1.00 H new ATOM 0 HB3 LEU A 69 61.658 -20.091 -3.011 1.00 1.00 H new ATOM 0 HG LEU A 69 61.509 -18.138 -1.465 1.00 1.00 H new ATOM 0 HD11 LEU A 69 61.898 -15.869 -2.355 1.00 1.00 H new ATOM 0 HD12 LEU A 69 63.389 -16.839 -2.404 1.00 1.00 H new ATOM 0 HD13 LEU A 69 62.456 -16.565 -3.895 1.00 1.00 H new ATOM 0 HD21 LEU A 69 59.675 -16.975 -2.680 1.00 1.00 H new ATOM 0 HD22 LEU A 69 60.243 -17.682 -4.212 1.00 1.00 H new ATOM 0 HD23 LEU A 69 59.589 -18.735 -2.934 1.00 1.00 H new ATOM 1053 N ALA A 70 63.816 -21.586 -3.791 1.00 1.00 N ATOM 1054 CA ALA A 70 64.082 -23.035 -3.818 1.00 1.00 C ATOM 1055 C ALA A 70 65.586 -23.274 -3.881 1.00 1.00 C ATOM 1056 O ALA A 70 66.202 -23.614 -2.878 1.00 1.00 O ATOM 1057 CB ALA A 70 63.390 -23.659 -5.052 1.00 1.00 C ATOM 0 H ALA A 70 63.500 -21.178 -4.671 1.00 1.00 H new ATOM 0 HA ALA A 70 63.687 -23.500 -2.915 1.00 1.00 H new ATOM 0 HB1 ALA A 70 63.585 -24.731 -5.075 1.00 1.00 H new ATOM 0 HB2 ALA A 70 62.315 -23.487 -4.992 1.00 1.00 H new ATOM 0 HB3 ALA A 70 63.781 -23.200 -5.960 1.00 1.00 H new ATOM 1063 N ALA A 71 66.157 -23.085 -5.061 1.00 1.00 N ATOM 1064 CA ALA A 71 67.583 -23.256 -5.331 1.00 1.00 C ATOM 1065 C ALA A 71 68.461 -22.376 -4.435 1.00 1.00 C ATOM 1066 O ALA A 71 69.649 -22.214 -4.694 1.00 1.00 O ATOM 1067 CB ALA A 71 67.886 -23.086 -6.831 1.00 1.00 C ATOM 0 H ALA A 71 65.627 -22.800 -5.885 1.00 1.00 H new ATOM 0 HA ALA A 71 67.846 -24.281 -5.069 1.00 1.00 H new ATOM 0 HB1 ALA A 71 68.954 -23.218 -7.004 1.00 1.00 H new ATOM 0 HB2 ALA A 71 67.331 -23.831 -7.401 1.00 1.00 H new ATOM 0 HB3 ALA A 71 67.588 -22.088 -7.152 1.00 1.00 H new ATOM 1073 N HIS A 72 67.850 -21.767 -3.423 1.00 1.00 N ATOM 1074 CA HIS A 72 68.523 -20.844 -2.505 1.00 1.00 C ATOM 1075 C HIS A 72 70.044 -20.974 -2.472 1.00 1.00 C ATOM 1076 O HIS A 72 70.732 -19.955 -2.567 1.00 1.00 O ATOM 1077 CB HIS A 72 67.992 -21.144 -1.098 1.00 1.00 C ATOM 1078 CG HIS A 72 68.557 -22.474 -0.625 1.00 1.00 C ATOM 1079 ND1 HIS A 72 69.156 -22.634 0.616 1.00 1.00 N ATOM 1080 CD2 HIS A 72 68.653 -23.704 -1.239 1.00 1.00 C ATOM 1081 CE1 HIS A 72 69.580 -23.913 0.703 1.00 1.00 C ATOM 1082 NE2 HIS A 72 69.295 -24.606 -0.401 1.00 1.00 N ATOM 0 H HIS A 72 66.861 -21.900 -3.212 1.00 1.00 H new ATOM 0 HA HIS A 72 68.311 -19.833 -2.852 1.00 1.00 H new ATOM 0 HB2 HIS A 72 68.279 -20.348 -0.411 1.00 1.00 H new ATOM 0 HB3 HIS A 72 66.903 -21.180 -1.107 1.00 1.00 H new ATOM 0 HD1 HIS A 72 69.258 -21.916 1.333 1.00 1.00 H new ATOM 0 HD2 HIS A 72 68.283 -23.933 -2.227 1.00 1.00 H new ATOM 0 HE1 HIS A 72 70.088 -24.325 1.562 1.00 1.00 H new ATOM 1090 N MET A 73 70.588 -22.173 -2.349 1.00 1.00 N ATOM 1091 CA MET A 73 72.036 -22.302 -2.338 1.00 1.00 C ATOM 1092 C MET A 73 72.572 -22.117 -3.758 1.00 1.00 C ATOM 1093 O MET A 73 73.574 -21.427 -3.962 1.00 1.00 O ATOM 1094 CB MET A 73 72.478 -23.636 -1.710 1.00 1.00 C ATOM 1095 CG MET A 73 72.074 -24.833 -2.581 1.00 1.00 C ATOM 1096 SD MET A 73 72.781 -26.347 -1.886 1.00 1.00 S ATOM 1097 CE MET A 73 71.414 -26.763 -0.783 1.00 1.00 C ATOM 0 H MET A 73 70.069 -23.046 -2.258 1.00 1.00 H new ATOM 0 HA MET A 73 72.462 -21.520 -1.709 1.00 1.00 H new ATOM 0 HB2 MET A 73 73.559 -23.634 -1.573 1.00 1.00 H new ATOM 0 HB3 MET A 73 72.032 -23.738 -0.721 1.00 1.00 H new ATOM 0 HG2 MET A 73 70.988 -24.913 -2.627 1.00 1.00 H new ATOM 0 HG3 MET A 73 72.427 -24.689 -3.602 1.00 1.00 H new ATOM 0 HE1 MET A 73 71.545 -27.778 -0.409 1.00 1.00 H new ATOM 0 HE2 MET A 73 71.398 -26.067 0.055 1.00 1.00 H new ATOM 0 HE3 MET A 73 70.473 -26.696 -1.329 1.00 1.00 H new ATOM 1107 N VAL A 74 71.962 -22.805 -4.729 1.00 1.00 N ATOM 1108 CA VAL A 74 72.456 -22.777 -6.097 1.00 1.00 C ATOM 1109 C VAL A 74 72.838 -21.369 -6.507 1.00 1.00 C ATOM 1110 O VAL A 74 73.922 -21.207 -7.029 1.00 1.00 O ATOM 1111 CB VAL A 74 71.392 -23.318 -7.032 1.00 1.00 C ATOM 1112 CG1 VAL A 74 71.901 -23.301 -8.469 1.00 1.00 C ATOM 1113 CG2 VAL A 74 71.049 -24.754 -6.628 1.00 1.00 C ATOM 0 H VAL A 74 71.133 -23.382 -4.588 1.00 1.00 H new ATOM 0 HA VAL A 74 73.347 -23.402 -6.157 1.00 1.00 H new ATOM 0 HB VAL A 74 70.502 -22.693 -6.964 1.00 1.00 H new ATOM 0 HG11 VAL A 74 71.130 -23.691 -9.133 1.00 1.00 H new ATOM 0 HG12 VAL A 74 72.144 -22.278 -8.757 1.00 1.00 H new ATOM 0 HG13 VAL A 74 72.794 -23.921 -8.546 1.00 1.00 H new ATOM 0 HG21 VAL A 74 70.284 -25.147 -7.298 1.00 1.00 H new ATOM 0 HG22 VAL A 74 71.943 -25.374 -6.694 1.00 1.00 H new ATOM 0 HG23 VAL A 74 70.675 -24.765 -5.604 1.00 1.00 H new ATOM 1123 N ASN A 75 71.987 -20.353 -6.279 1.00 1.00 N ATOM 1124 CA ASN A 75 72.342 -18.961 -6.637 1.00 1.00 C ATOM 1125 C ASN A 75 73.842 -18.710 -6.359 1.00 1.00 C ATOM 1126 O ASN A 75 74.493 -17.825 -6.938 1.00 1.00 O ATOM 1127 CB ASN A 75 71.480 -18.001 -5.789 1.00 1.00 C ATOM 1128 CG ASN A 75 70.182 -17.653 -6.514 1.00 1.00 C ATOM 1129 OD1 ASN A 75 69.145 -18.277 -6.280 1.00 1.00 O ATOM 1130 ND2 ASN A 75 70.182 -16.682 -7.383 1.00 1.00 N ATOM 0 H ASN A 75 71.065 -20.461 -5.857 1.00 1.00 H new ATOM 0 HA ASN A 75 72.154 -18.791 -7.697 1.00 1.00 H new ATOM 0 HB2 ASN A 75 71.252 -18.462 -4.828 1.00 1.00 H new ATOM 0 HB3 ASN A 75 72.041 -17.090 -5.580 1.00 1.00 H new ATOM 0 HD21 ASN A 75 69.322 -16.436 -7.873 1.00 1.00 H new ATOM 0 HD22 ASN A 75 71.042 -16.168 -7.574 1.00 1.00 H new ATOM 1137 N GLY A 76 74.396 -19.566 -5.520 1.00 1.00 N ATOM 1138 CA GLY A 76 75.807 -19.502 -5.232 1.00 1.00 C ATOM 1139 C GLY A 76 76.563 -19.474 -6.560 1.00 1.00 C ATOM 1140 O GLY A 76 77.670 -18.985 -6.645 1.00 1.00 O ATOM 0 H GLY A 76 73.891 -20.306 -5.032 1.00 1.00 H new ATOM 0 HA2 GLY A 76 76.036 -18.612 -4.645 1.00 1.00 H new ATOM 0 HA3 GLY A 76 76.113 -20.363 -4.638 1.00 1.00 H new ATOM 1144 N ILE A 77 75.935 -19.997 -7.609 1.00 1.00 N ATOM 1145 CA ILE A 77 76.556 -20.014 -8.922 1.00 1.00 C ATOM 1146 C ILE A 77 77.184 -18.658 -9.246 1.00 1.00 C ATOM 1147 O ILE A 77 78.295 -18.617 -9.761 1.00 1.00 O ATOM 1148 CB ILE A 77 75.527 -20.370 -10.001 1.00 1.00 C ATOM 1149 CG1 ILE A 77 74.256 -19.546 -9.785 1.00 1.00 C ATOM 1150 CG2 ILE A 77 75.192 -21.860 -9.935 1.00 1.00 C ATOM 1151 CD1 ILE A 77 73.222 -19.878 -10.862 1.00 1.00 C ATOM 0 H ILE A 77 75.003 -20.411 -7.573 1.00 1.00 H new ATOM 0 HA ILE A 77 77.339 -20.772 -8.909 1.00 1.00 H new ATOM 0 HB ILE A 77 75.945 -20.145 -10.982 1.00 1.00 H new ATOM 0 HG12 ILE A 77 73.843 -19.753 -8.798 1.00 1.00 H new ATOM 0 HG13 ILE A 77 74.494 -18.483 -9.814 1.00 1.00 H new ATOM 0 HG21 ILE A 77 74.460 -22.103 -10.705 1.00 1.00 H new ATOM 0 HG22 ILE A 77 76.098 -22.444 -10.098 1.00 1.00 H new ATOM 0 HG23 ILE A 77 74.779 -22.097 -8.955 1.00 1.00 H new ATOM 0 HD11 ILE A 77 72.322 -19.285 -10.697 1.00 1.00 H new ATOM 0 HD12 ILE A 77 73.633 -19.648 -11.845 1.00 1.00 H new ATOM 0 HD13 ILE A 77 72.972 -20.938 -10.812 1.00 1.00 H new ATOM 1163 N VAL A 78 76.493 -17.547 -8.964 1.00 1.00 N ATOM 1164 CA VAL A 78 77.040 -16.230 -9.258 1.00 1.00 C ATOM 1165 C VAL A 78 78.393 -16.043 -8.600 1.00 1.00 C ATOM 1166 O VAL A 78 79.200 -15.226 -9.048 1.00 1.00 O ATOM 1167 CB VAL A 78 76.085 -15.164 -8.732 1.00 1.00 C ATOM 1168 CG1 VAL A 78 76.642 -13.776 -9.047 1.00 1.00 C ATOM 1169 CG2 VAL A 78 74.720 -15.341 -9.395 1.00 1.00 C ATOM 0 H VAL A 78 75.566 -17.539 -8.538 1.00 1.00 H new ATOM 0 HA VAL A 78 77.161 -16.140 -10.338 1.00 1.00 H new ATOM 0 HB VAL A 78 75.978 -15.266 -7.652 1.00 1.00 H new ATOM 0 HG11 VAL A 78 75.958 -13.015 -8.670 1.00 1.00 H new ATOM 0 HG12 VAL A 78 77.615 -13.657 -8.570 1.00 1.00 H new ATOM 0 HG13 VAL A 78 76.751 -13.664 -10.126 1.00 1.00 H new ATOM 0 HG21 VAL A 78 74.033 -14.581 -9.022 1.00 1.00 H new ATOM 0 HG22 VAL A 78 74.824 -15.238 -10.475 1.00 1.00 H new ATOM 0 HG23 VAL A 78 74.328 -16.331 -9.161 1.00 1.00 H new ATOM 1179 N ILE A 79 78.669 -16.818 -7.553 1.00 1.00 N ATOM 1180 CA ILE A 79 79.982 -16.701 -6.895 1.00 1.00 C ATOM 1181 C ILE A 79 80.996 -17.628 -7.576 1.00 1.00 C ATOM 1182 O ILE A 79 82.141 -17.251 -7.785 1.00 1.00 O ATOM 1183 CB ILE A 79 79.896 -16.975 -5.368 1.00 1.00 C ATOM 1184 CG1 ILE A 79 80.150 -18.469 -5.040 1.00 1.00 C ATOM 1185 CG2 ILE A 79 78.512 -16.537 -4.864 1.00 1.00 C ATOM 1186 CD1 ILE A 79 79.690 -18.790 -3.614 1.00 1.00 C ATOM 0 H ILE A 79 78.035 -17.508 -7.150 1.00 1.00 H new ATOM 0 HA ILE A 79 80.323 -15.672 -7.005 1.00 1.00 H new ATOM 0 HB ILE A 79 80.673 -16.402 -4.862 1.00 1.00 H new ATOM 0 HG12 ILE A 79 79.617 -19.100 -5.751 1.00 1.00 H new ATOM 0 HG13 ILE A 79 81.211 -18.696 -5.146 1.00 1.00 H new ATOM 0 HG21 ILE A 79 78.439 -16.724 -3.793 1.00 1.00 H new ATOM 0 HG22 ILE A 79 78.375 -15.473 -5.057 1.00 1.00 H new ATOM 0 HG23 ILE A 79 77.739 -17.103 -5.385 1.00 1.00 H new ATOM 0 HD11 ILE A 79 79.875 -19.843 -3.400 1.00 1.00 H new ATOM 0 HD12 ILE A 79 80.243 -18.173 -2.906 1.00 1.00 H new ATOM 0 HD13 ILE A 79 78.624 -18.583 -3.520 1.00 1.00 H new ATOM 1198 N ALA A 80 80.577 -18.845 -7.896 1.00 1.00 N ATOM 1199 CA ALA A 80 81.477 -19.816 -8.529 1.00 1.00 C ATOM 1200 C ALA A 80 81.651 -19.554 -10.033 1.00 1.00 C ATOM 1201 O ALA A 80 82.663 -19.945 -10.618 1.00 1.00 O ATOM 1202 CB ALA A 80 80.962 -21.235 -8.278 1.00 1.00 C ATOM 0 H ALA A 80 79.630 -19.187 -7.732 1.00 1.00 H new ATOM 0 HA ALA A 80 82.463 -19.704 -8.077 1.00 1.00 H new ATOM 0 HB1 ALA A 80 81.632 -21.954 -8.749 1.00 1.00 H new ATOM 0 HB2 ALA A 80 80.924 -21.424 -7.205 1.00 1.00 H new ATOM 0 HB3 ALA A 80 79.963 -21.339 -8.701 1.00 1.00 H new ATOM 1208 N GLU A 81 80.682 -18.868 -10.648 1.00 1.00 N ATOM 1209 CA GLU A 81 80.757 -18.539 -12.066 1.00 1.00 C ATOM 1210 C GLU A 81 81.421 -17.181 -12.318 1.00 1.00 C ATOM 1211 O GLU A 81 82.498 -17.136 -12.914 1.00 1.00 O ATOM 1212 CB GLU A 81 79.355 -18.499 -12.684 1.00 1.00 C ATOM 1213 CG GLU A 81 78.817 -19.916 -12.905 1.00 1.00 C ATOM 1214 CD GLU A 81 77.415 -19.834 -13.501 1.00 1.00 C ATOM 1215 OE1 GLU A 81 76.921 -18.731 -13.654 1.00 1.00 O ATOM 1216 OE2 GLU A 81 76.852 -20.879 -13.799 1.00 1.00 O ATOM 0 H GLU A 81 79.839 -18.532 -10.182 1.00 1.00 H new ATOM 0 HA GLU A 81 81.363 -19.319 -12.527 1.00 1.00 H new ATOM 0 HB2 GLU A 81 78.680 -17.947 -12.030 1.00 1.00 H new ATOM 0 HB3 GLU A 81 79.386 -17.965 -13.634 1.00 1.00 H new ATOM 0 HG2 GLU A 81 79.477 -20.468 -13.574 1.00 1.00 H new ATOM 0 HG3 GLU A 81 78.792 -20.460 -11.961 1.00 1.00 H new ATOM 1223 N ASP A 82 80.782 -16.057 -11.934 1.00 1.00 N ATOM 1224 CA ASP A 82 81.351 -14.743 -12.231 1.00 1.00 C ATOM 1225 C ASP A 82 82.545 -14.345 -11.363 1.00 1.00 C ATOM 1226 O ASP A 82 83.318 -13.497 -11.796 1.00 1.00 O ATOM 1227 CB ASP A 82 80.265 -13.680 -12.082 1.00 1.00 C ATOM 1228 CG ASP A 82 78.981 -14.170 -12.734 1.00 1.00 C ATOM 1229 OD1 ASP A 82 78.410 -15.123 -12.226 1.00 1.00 O ATOM 1230 OD2 ASP A 82 78.583 -13.585 -13.726 1.00 1.00 O ATOM 0 H ASP A 82 79.895 -16.039 -11.431 1.00 1.00 H new ATOM 0 HA ASP A 82 81.726 -14.811 -13.252 1.00 1.00 H new ATOM 0 HB2 ASP A 82 80.091 -13.468 -11.027 1.00 1.00 H new ATOM 0 HB3 ASP A 82 80.588 -12.748 -12.546 1.00 1.00 H new ATOM 1235 N ALA A 83 82.739 -14.930 -10.170 1.00 1.00 N ATOM 1236 CA ALA A 83 83.919 -14.549 -9.357 1.00 1.00 C ATOM 1237 C ALA A 83 85.157 -14.297 -10.246 1.00 1.00 C ATOM 1238 O ALA A 83 85.855 -13.307 -10.048 1.00 1.00 O ATOM 1239 CB ALA A 83 84.259 -15.637 -8.329 1.00 1.00 C ATOM 0 H ALA A 83 82.130 -15.636 -9.756 1.00 1.00 H new ATOM 0 HA ALA A 83 83.658 -13.628 -8.836 1.00 1.00 H new ATOM 0 HB1 ALA A 83 85.128 -15.330 -7.748 1.00 1.00 H new ATOM 0 HB2 ALA A 83 83.410 -15.785 -7.661 1.00 1.00 H new ATOM 0 HB3 ALA A 83 84.480 -16.570 -8.847 1.00 1.00 H new ATOM 1245 N LEU A 84 85.469 -15.243 -11.150 1.00 1.00 N ATOM 1246 CA LEU A 84 86.698 -15.156 -11.990 1.00 1.00 C ATOM 1247 C LEU A 84 87.121 -13.684 -12.185 1.00 1.00 C ATOM 1248 O LEU A 84 88.305 -13.350 -12.076 1.00 1.00 O ATOM 1249 CB LEU A 84 86.436 -15.879 -13.369 1.00 1.00 C ATOM 1250 CG LEU A 84 86.503 -14.926 -14.600 1.00 1.00 C ATOM 1251 CD1 LEU A 84 87.960 -14.708 -15.029 1.00 1.00 C ATOM 1252 CD2 LEU A 84 85.717 -15.523 -15.776 1.00 1.00 C ATOM 0 H LEU A 84 84.900 -16.072 -11.324 1.00 1.00 H new ATOM 0 HA LEU A 84 87.523 -15.660 -11.487 1.00 1.00 H new ATOM 0 HB2 LEU A 84 87.170 -16.675 -13.497 1.00 1.00 H new ATOM 0 HB3 LEU A 84 85.454 -16.352 -13.340 1.00 1.00 H new ATOM 0 HG LEU A 84 86.064 -13.970 -14.315 1.00 1.00 H new ATOM 0 HD11 LEU A 84 87.990 -14.040 -15.890 1.00 1.00 H new ATOM 0 HD12 LEU A 84 88.519 -14.264 -14.206 1.00 1.00 H new ATOM 0 HD13 LEU A 84 88.408 -15.665 -15.297 1.00 1.00 H new ATOM 0 HD21 LEU A 84 85.771 -14.848 -16.630 1.00 1.00 H new ATOM 0 HD22 LEU A 84 86.146 -16.487 -16.048 1.00 1.00 H new ATOM 0 HD23 LEU A 84 84.675 -15.658 -15.486 1.00 1.00 H new ATOM 1264 N ILE A 85 86.153 -12.803 -12.420 1.00 1.00 N ATOM 1265 CA ILE A 85 86.440 -11.375 -12.568 1.00 1.00 C ATOM 1266 C ILE A 85 86.153 -10.657 -11.246 1.00 1.00 C ATOM 1267 O ILE A 85 86.941 -9.829 -10.794 1.00 1.00 O ATOM 1268 CB ILE A 85 85.584 -10.773 -13.701 1.00 1.00 C ATOM 1269 CG1 ILE A 85 84.209 -11.443 -13.686 1.00 1.00 C ATOM 1270 CG2 ILE A 85 86.244 -10.987 -15.080 1.00 1.00 C ATOM 1271 CD1 ILE A 85 83.275 -10.734 -14.662 1.00 1.00 C ATOM 0 H ILE A 85 85.167 -13.048 -12.512 1.00 1.00 H new ATOM 0 HA ILE A 85 87.491 -11.245 -12.825 1.00 1.00 H new ATOM 0 HB ILE A 85 85.491 -9.700 -13.536 1.00 1.00 H new ATOM 0 HG12 ILE A 85 84.304 -12.494 -13.959 1.00 1.00 H new ATOM 0 HG13 ILE A 85 83.790 -11.411 -12.680 1.00 1.00 H new ATOM 0 HG21 ILE A 85 85.615 -10.551 -15.856 1.00 1.00 H new ATOM 0 HG22 ILE A 85 87.222 -10.507 -15.094 1.00 1.00 H new ATOM 0 HG23 ILE A 85 86.361 -12.055 -15.265 1.00 1.00 H new ATOM 0 HD11 ILE A 85 82.298 -11.216 -14.646 1.00 1.00 H new ATOM 0 HD12 ILE A 85 83.169 -9.689 -14.370 1.00 1.00 H new ATOM 0 HD13 ILE A 85 83.690 -10.789 -15.668 1.00 1.00 H new ATOM 1283 N ALA A 86 84.995 -10.960 -10.657 1.00 1.00 N ATOM 1284 CA ALA A 86 84.588 -10.307 -9.415 1.00 1.00 C ATOM 1285 C ALA A 86 85.724 -10.358 -8.398 1.00 1.00 C ATOM 1286 O ALA A 86 86.016 -9.362 -7.738 1.00 1.00 O ATOM 1287 CB ALA A 86 83.303 -10.954 -8.841 1.00 1.00 C ATOM 0 H ALA A 86 84.330 -11.645 -11.016 1.00 1.00 H new ATOM 0 HA ALA A 86 84.363 -9.263 -9.633 1.00 1.00 H new ATOM 0 HB1 ALA A 86 83.023 -10.449 -7.917 1.00 1.00 H new ATOM 0 HB2 ALA A 86 82.494 -10.861 -9.565 1.00 1.00 H new ATOM 0 HB3 ALA A 86 83.487 -12.009 -8.636 1.00 1.00 H new ATOM 1293 N GLU A 87 86.365 -11.515 -8.276 1.00 1.00 N ATOM 1294 CA GLU A 87 87.470 -11.676 -7.343 1.00 1.00 C ATOM 1295 C GLU A 87 88.530 -10.607 -7.580 1.00 1.00 C ATOM 1296 O GLU A 87 89.332 -10.303 -6.695 1.00 1.00 O ATOM 1297 CB GLU A 87 88.093 -13.062 -7.557 1.00 1.00 C ATOM 1298 CG GLU A 87 88.773 -13.109 -8.935 1.00 1.00 C ATOM 1299 CD GLU A 87 89.175 -14.538 -9.280 1.00 1.00 C ATOM 1300 OE1 GLU A 87 89.063 -15.390 -8.415 1.00 1.00 O ATOM 1301 OE2 GLU A 87 89.591 -14.757 -10.406 1.00 1.00 O ATOM 0 H GLU A 87 86.138 -12.353 -8.811 1.00 1.00 H new ATOM 0 HA GLU A 87 87.097 -11.577 -6.323 1.00 1.00 H new ATOM 0 HB2 GLU A 87 88.821 -13.271 -6.773 1.00 1.00 H new ATOM 0 HB3 GLU A 87 87.325 -13.832 -7.492 1.00 1.00 H new ATOM 0 HG2 GLU A 87 88.095 -12.721 -9.696 1.00 1.00 H new ATOM 0 HG3 GLU A 87 89.654 -12.466 -8.935 1.00 1.00 H new ATOM 1308 N ALA A 88 88.533 -10.042 -8.786 1.00 1.00 N ATOM 1309 CA ALA A 88 89.514 -9.010 -9.132 1.00 1.00 C ATOM 1310 C ALA A 88 89.049 -7.662 -8.615 1.00 1.00 C ATOM 1311 O ALA A 88 89.815 -6.705 -8.551 1.00 1.00 O ATOM 1312 CB ALA A 88 89.720 -8.958 -10.647 1.00 1.00 C ATOM 0 H ALA A 88 87.878 -10.276 -9.532 1.00 1.00 H new ATOM 0 HA ALA A 88 90.467 -9.257 -8.664 1.00 1.00 H new ATOM 0 HB1 ALA A 88 90.451 -8.187 -10.888 1.00 1.00 H new ATOM 0 HB2 ALA A 88 90.082 -9.924 -10.998 1.00 1.00 H new ATOM 0 HB3 ALA A 88 88.773 -8.726 -11.135 1.00 1.00 H new ATOM 1318 N VAL A 89 87.782 -7.616 -8.236 1.00 1.00 N ATOM 1319 CA VAL A 89 87.169 -6.414 -7.694 1.00 1.00 C ATOM 1320 C VAL A 89 87.270 -6.435 -6.177 1.00 1.00 C ATOM 1321 O VAL A 89 86.378 -5.947 -5.488 1.00 1.00 O ATOM 1322 CB VAL A 89 85.703 -6.313 -8.138 1.00 1.00 C ATOM 1323 CG1 VAL A 89 85.117 -4.932 -7.761 1.00 1.00 C ATOM 1324 CG2 VAL A 89 85.635 -6.503 -9.657 1.00 1.00 C ATOM 0 H VAL A 89 87.148 -8.413 -8.296 1.00 1.00 H new ATOM 0 HA VAL A 89 87.697 -5.539 -8.073 1.00 1.00 H new ATOM 0 HB VAL A 89 85.120 -7.084 -7.635 1.00 1.00 H new ATOM 0 HG11 VAL A 89 84.077 -4.878 -8.083 1.00 1.00 H new ATOM 0 HG12 VAL A 89 85.170 -4.797 -6.681 1.00 1.00 H new ATOM 0 HG13 VAL A 89 85.691 -4.147 -8.253 1.00 1.00 H new ATOM 0 HG21 VAL A 89 84.598 -6.434 -9.986 1.00 1.00 H new ATOM 0 HG22 VAL A 89 86.224 -5.728 -10.147 1.00 1.00 H new ATOM 0 HG23 VAL A 89 86.034 -7.483 -9.919 1.00 1.00 H new ATOM 1334 N GLY A 90 88.363 -6.983 -5.648 1.00 1.00 N ATOM 1335 CA GLY A 90 88.555 -7.030 -4.212 1.00 1.00 C ATOM 1336 C GLY A 90 88.933 -5.649 -3.648 1.00 1.00 C ATOM 1337 O GLY A 90 88.436 -5.267 -2.590 1.00 1.00 O ATOM 0 H GLY A 90 89.120 -7.396 -6.193 1.00 1.00 H new ATOM 0 HA2 GLY A 90 87.641 -7.382 -3.733 1.00 1.00 H new ATOM 0 HA3 GLY A 90 89.338 -7.749 -3.972 1.00 1.00 H new ATOM 1341 N PRO A 91 89.792 -4.891 -4.310 1.00 1.00 N ATOM 1342 CA PRO A 91 90.194 -3.547 -3.803 1.00 1.00 C ATOM 1343 C PRO A 91 89.001 -2.792 -3.245 1.00 1.00 C ATOM 1344 O PRO A 91 89.150 -1.861 -2.459 1.00 1.00 O ATOM 1345 CB PRO A 91 90.773 -2.861 -5.044 1.00 1.00 C ATOM 1346 CG PRO A 91 91.356 -3.981 -5.849 1.00 1.00 C ATOM 1347 CD PRO A 91 90.482 -5.219 -5.574 1.00 1.00 C ATOM 0 HA PRO A 91 90.907 -3.594 -2.980 1.00 1.00 H new ATOM 0 HB2 PRO A 91 90.001 -2.330 -5.602 1.00 1.00 H new ATOM 0 HB3 PRO A 91 91.533 -2.127 -4.775 1.00 1.00 H new ATOM 0 HG2 PRO A 91 91.357 -3.735 -6.911 1.00 1.00 H new ATOM 0 HG3 PRO A 91 92.391 -4.166 -5.563 1.00 1.00 H new ATOM 0 HD2 PRO A 91 89.773 -5.395 -6.383 1.00 1.00 H new ATOM 0 HD3 PRO A 91 91.086 -6.121 -5.477 1.00 1.00 H new ATOM 1355 N HIS A 92 87.815 -3.201 -3.665 1.00 1.00 N ATOM 1356 CA HIS A 92 86.623 -2.522 -3.195 1.00 1.00 C ATOM 1357 C HIS A 92 86.692 -2.531 -1.671 1.00 1.00 C ATOM 1358 O HIS A 92 86.345 -1.576 -1.040 1.00 1.00 O ATOM 1359 CB HIS A 92 85.344 -3.223 -3.679 1.00 1.00 C ATOM 1360 CG HIS A 92 85.154 -4.501 -2.912 1.00 1.00 C ATOM 1361 ND1 HIS A 92 85.999 -5.583 -3.067 1.00 1.00 N ATOM 1362 CD2 HIS A 92 84.254 -4.857 -1.940 1.00 1.00 C ATOM 1363 CE1 HIS A 92 85.601 -6.530 -2.201 1.00 1.00 C ATOM 1364 NE2 HIS A 92 84.540 -6.138 -1.490 1.00 1.00 N ATOM 0 H HIS A 92 87.655 -3.975 -4.310 1.00 1.00 H new ATOM 0 HA HIS A 92 86.585 -1.506 -3.588 1.00 1.00 H new ATOM 0 HB2 HIS A 92 84.483 -2.570 -3.538 1.00 1.00 H new ATOM 0 HB3 HIS A 92 85.413 -3.433 -4.746 1.00 1.00 H new ATOM 0 HD2 HIS A 92 83.447 -4.236 -1.580 1.00 1.00 H new ATOM 0 HE1 HIS A 92 86.081 -7.492 -2.093 1.00 1.00 H new ATOM 0 HE2 HIS A 92 84.046 -6.667 -0.771 1.00 1.00 H new ATOM 1372 N LEU A 93 87.157 -3.622 -1.094 1.00 1.00 N ATOM 1373 CA LEU A 93 87.246 -3.702 0.363 1.00 1.00 C ATOM 1374 C LEU A 93 87.872 -2.413 0.936 1.00 1.00 C ATOM 1375 O LEU A 93 87.237 -1.740 1.753 1.00 1.00 O ATOM 1376 CB LEU A 93 88.087 -4.927 0.769 1.00 1.00 C ATOM 1377 CG LEU A 93 89.508 -4.851 0.126 1.00 1.00 C ATOM 1378 CD1 LEU A 93 90.555 -4.305 1.135 1.00 1.00 C ATOM 1379 CD2 LEU A 93 89.965 -6.243 -0.360 1.00 1.00 C ATOM 0 H LEU A 93 87.475 -4.453 -1.593 1.00 1.00 H new ATOM 0 HA LEU A 93 86.241 -3.809 0.771 1.00 1.00 H new ATOM 0 HB2 LEU A 93 88.174 -4.972 1.855 1.00 1.00 H new ATOM 0 HB3 LEU A 93 87.586 -5.841 0.451 1.00 1.00 H new ATOM 0 HG LEU A 93 89.440 -4.170 -0.723 1.00 1.00 H new ATOM 0 HD11 LEU A 93 91.534 -4.264 0.657 1.00 1.00 H new ATOM 0 HD12 LEU A 93 90.265 -3.304 1.454 1.00 1.00 H new ATOM 0 HD13 LEU A 93 90.602 -4.963 2.003 1.00 1.00 H new ATOM 0 HD21 LEU A 93 90.957 -6.166 -0.804 1.00 1.00 H new ATOM 0 HD22 LEU A 93 89.998 -6.931 0.485 1.00 1.00 H new ATOM 0 HD23 LEU A 93 89.262 -6.617 -1.105 1.00 1.00 H new ATOM 1391 N ALA A 94 89.100 -2.066 0.534 1.00 1.00 N ATOM 1392 CA ALA A 94 89.731 -0.851 1.054 1.00 1.00 C ATOM 1393 C ALA A 94 88.874 0.359 0.711 1.00 1.00 C ATOM 1394 O ALA A 94 88.431 1.085 1.596 1.00 1.00 O ATOM 1395 CB ALA A 94 91.131 -0.678 0.458 1.00 1.00 C ATOM 0 H ALA A 94 89.663 -2.594 -0.132 1.00 1.00 H new ATOM 0 HA ALA A 94 89.820 -0.939 2.137 1.00 1.00 H new ATOM 0 HB1 ALA A 94 91.586 0.230 0.855 1.00 1.00 H new ATOM 0 HB2 ALA A 94 91.747 -1.538 0.721 1.00 1.00 H new ATOM 0 HB3 ALA A 94 91.058 -0.603 -0.627 1.00 1.00 H new ATOM 1401 N ARG A 95 88.608 0.548 -0.579 1.00 1.00 N ATOM 1402 CA ARG A 95 87.763 1.664 -0.992 1.00 1.00 C ATOM 1403 C ARG A 95 86.448 1.564 -0.221 1.00 1.00 C ATOM 1404 O ARG A 95 86.061 2.449 0.554 1.00 1.00 O ATOM 1405 CB ARG A 95 87.515 1.618 -2.522 1.00 1.00 C ATOM 1406 CG ARG A 95 88.518 2.522 -3.270 1.00 1.00 C ATOM 1407 CD ARG A 95 88.511 2.164 -4.763 1.00 1.00 C ATOM 1408 NE ARG A 95 87.159 1.766 -5.175 1.00 1.00 N ATOM 1409 CZ ARG A 95 86.841 0.496 -5.455 1.00 1.00 C ATOM 1410 NH1 ARG A 95 87.736 -0.452 -5.363 1.00 1.00 N ATOM 1411 NH2 ARG A 95 85.623 0.197 -5.819 1.00 1.00 N ATOM 0 H ARG A 95 88.954 -0.039 -1.338 1.00 1.00 H new ATOM 0 HA ARG A 95 88.251 2.614 -0.772 1.00 1.00 H new ATOM 0 HB2 ARG A 95 87.608 0.592 -2.879 1.00 1.00 H new ATOM 0 HB3 ARG A 95 86.497 1.940 -2.739 1.00 1.00 H new ATOM 0 HG2 ARG A 95 88.251 3.570 -3.135 1.00 1.00 H new ATOM 0 HG3 ARG A 95 89.519 2.392 -2.858 1.00 1.00 H new ATOM 0 HD2 ARG A 95 88.843 3.019 -5.352 1.00 1.00 H new ATOM 0 HD3 ARG A 95 89.213 1.352 -4.955 1.00 1.00 H new ATOM 0 HE ARG A 95 86.437 2.482 -5.251 1.00 1.00 H new ATOM 0 HH11 ARG A 95 88.689 -0.228 -5.075 1.00 1.00 H new ATOM 0 HH12 ARG A 95 87.482 -1.416 -5.579 1.00 1.00 H new ATOM 0 HH21 ARG A 95 84.917 0.930 -5.889 1.00 1.00 H new ATOM 0 HH22 ARG A 95 85.377 -0.770 -6.033 1.00 1.00 H new ATOM 1425 N ALA A 96 85.746 0.485 -0.354 1.00 1.00 N ATOM 1426 CA ALA A 96 84.509 0.337 0.355 1.00 1.00 C ATOM 1427 C ALA A 96 84.668 0.778 1.820 1.00 1.00 C ATOM 1428 O ALA A 96 83.699 0.755 2.557 1.00 1.00 O ATOM 1429 CB ALA A 96 84.016 -1.100 0.180 1.00 1.00 C ATOM 0 H ALA A 96 86.004 -0.306 -0.944 1.00 1.00 H new ATOM 0 HA ALA A 96 83.741 0.993 -0.055 1.00 1.00 H new ATOM 0 HB1 ALA A 96 83.075 -1.229 0.714 1.00 1.00 H new ATOM 0 HB2 ALA A 96 83.863 -1.306 -0.879 1.00 1.00 H new ATOM 0 HB3 ALA A 96 84.758 -1.791 0.581 1.00 1.00 H new ATOM 1435 N LEU A 97 85.940 0.955 2.264 1.00 1.00 N ATOM 1436 CA LEU A 97 86.309 1.167 3.681 1.00 1.00 C ATOM 1437 C LEU A 97 85.099 1.118 4.597 1.00 1.00 C ATOM 1438 O LEU A 97 85.099 0.303 5.494 1.00 1.00 O ATOM 1439 CB LEU A 97 86.867 2.617 3.715 1.00 1.00 C ATOM 1440 CG LEU A 97 87.723 2.911 4.952 1.00 1.00 C ATOM 1441 CD1 LEU A 97 86.911 2.666 6.225 1.00 1.00 C ATOM 1442 CD2 LEU A 97 88.993 2.039 4.947 1.00 1.00 C ATOM 0 H LEU A 97 86.745 0.954 1.637 1.00 1.00 H new ATOM 0 HA LEU A 97 87.005 0.399 4.018 1.00 1.00 H new ATOM 0 HB2 LEU A 97 87.464 2.790 2.820 1.00 1.00 H new ATOM 0 HB3 LEU A 97 86.034 3.320 3.683 1.00 1.00 H new ATOM 0 HG LEU A 97 88.025 3.958 4.927 1.00 1.00 H new ATOM 0 HD11 LEU A 97 87.529 2.878 7.097 1.00 1.00 H new ATOM 0 HD12 LEU A 97 86.038 3.319 6.231 1.00 1.00 H new ATOM 0 HD13 LEU A 97 86.586 1.626 6.255 1.00 1.00 H new ATOM 0 HD21 LEU A 97 89.590 2.260 5.832 1.00 1.00 H new ATOM 0 HD22 LEU A 97 88.711 0.986 4.953 1.00 1.00 H new ATOM 0 HD23 LEU A 97 89.578 2.253 4.052 1.00 1.00 H new ATOM 1454 N GLY A 98 84.057 1.874 4.411 1.00 1.00 N ATOM 1455 CA GLY A 98 82.900 1.689 5.270 1.00 1.00 C ATOM 1456 C GLY A 98 82.560 0.189 5.320 1.00 1.00 C ATOM 1457 O GLY A 98 81.950 -0.276 6.289 1.00 1.00 O ATOM 0 H GLY A 98 83.973 2.602 3.702 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.109 2.063 6.272 1.00 1.00 H new ATOM 0 HA3 GLY A 98 82.051 2.257 4.889 1.00 1.00 H new ATOM 1461 N GLN A 99 82.983 -0.597 4.289 1.00 1.00 N ATOM 1462 CA GLN A 99 82.691 -2.045 4.345 1.00 1.00 C ATOM 1463 C GLN A 99 83.540 -2.645 5.443 1.00 1.00 C ATOM 1464 O GLN A 99 83.195 -3.671 6.035 1.00 1.00 O ATOM 1465 CB GLN A 99 82.990 -2.767 3.018 1.00 1.00 C ATOM 1466 CG GLN A 99 81.716 -2.890 2.155 1.00 1.00 C ATOM 1467 CD GLN A 99 80.960 -1.565 2.101 1.00 1.00 C ATOM 1468 OE1 GLN A 99 81.527 -0.509 2.377 1.00 1.00 O ATOM 1469 NE2 GLN A 99 79.704 -1.561 1.739 1.00 1.00 N ATOM 0 H GLN A 99 83.492 -0.275 3.466 1.00 1.00 H new ATOM 0 HA GLN A 99 81.626 -2.172 4.539 1.00 1.00 H new ATOM 0 HB2 GLN A 99 83.755 -2.220 2.467 1.00 1.00 H new ATOM 0 HB3 GLN A 99 83.392 -3.759 3.222 1.00 1.00 H new ATOM 0 HG2 GLN A 99 81.985 -3.200 1.145 1.00 1.00 H new ATOM 0 HG3 GLN A 99 81.069 -3.665 2.565 1.00 1.00 H new ATOM 0 HE21 GLN A 99 79.236 -2.438 1.511 1.00 1.00 H new ATOM 0 HE22 GLN A 99 79.192 -0.681 1.685 1.00 1.00 H new ATOM 1478 N ILE A 100 84.633 -1.968 5.736 1.00 1.00 N ATOM 1479 CA ILE A 100 85.515 -2.418 6.809 1.00 1.00 C ATOM 1480 C ILE A 100 84.769 -2.317 8.130 1.00 1.00 C ATOM 1481 O ILE A 100 84.879 -3.205 8.976 1.00 1.00 O ATOM 1482 CB ILE A 100 86.836 -1.610 6.883 1.00 1.00 C ATOM 1483 CG1 ILE A 100 87.728 -1.923 5.652 1.00 1.00 C ATOM 1484 CG2 ILE A 100 87.586 -1.951 8.179 1.00 1.00 C ATOM 1485 CD1 ILE A 100 88.576 -3.189 5.882 1.00 1.00 C ATOM 0 H ILE A 100 84.933 -1.118 5.259 1.00 1.00 H new ATOM 0 HA ILE A 100 85.795 -3.451 6.600 1.00 1.00 H new ATOM 0 HB ILE A 100 86.598 -0.546 6.880 1.00 1.00 H new ATOM 0 HG12 ILE A 100 87.101 -2.058 4.771 1.00 1.00 H new ATOM 0 HG13 ILE A 100 88.383 -1.076 5.450 1.00 1.00 H new ATOM 0 HG21 ILE A 100 88.513 -1.380 8.224 1.00 1.00 H new ATOM 0 HG22 ILE A 100 86.963 -1.699 9.037 1.00 1.00 H new ATOM 0 HG23 ILE A 100 87.815 -3.016 8.197 1.00 1.00 H new ATOM 0 HD11 ILE A 100 89.189 -3.381 5.002 1.00 1.00 H new ATOM 0 HD12 ILE A 100 89.221 -3.043 6.749 1.00 1.00 H new ATOM 0 HD13 ILE A 100 87.918 -4.040 6.059 1.00 1.00 H new ATOM 1497 N VAL A 101 83.988 -1.241 8.317 1.00 1.00 N ATOM 1498 CA VAL A 101 83.253 -1.113 9.565 1.00 1.00 C ATOM 1499 C VAL A 101 82.354 -2.344 9.695 1.00 1.00 C ATOM 1500 O VAL A 101 82.436 -3.065 10.684 1.00 1.00 O ATOM 1501 CB VAL A 101 82.480 0.250 9.620 1.00 1.00 C ATOM 1502 CG1 VAL A 101 80.949 0.078 9.593 1.00 1.00 C ATOM 1503 CG2 VAL A 101 82.857 1.013 10.904 1.00 1.00 C ATOM 0 H VAL A 101 83.858 -0.483 7.647 1.00 1.00 H new ATOM 0 HA VAL A 101 83.923 -1.086 10.425 1.00 1.00 H new ATOM 0 HB VAL A 101 82.772 0.805 8.728 1.00 1.00 H new ATOM 0 HG11 VAL A 101 80.472 1.057 9.634 1.00 1.00 H new ATOM 0 HG12 VAL A 101 80.656 -0.431 8.674 1.00 1.00 H new ATOM 0 HG13 VAL A 101 80.634 -0.515 10.452 1.00 1.00 H new ATOM 0 HG21 VAL A 101 82.317 1.959 10.937 1.00 1.00 H new ATOM 0 HG22 VAL A 101 82.592 0.413 11.775 1.00 1.00 H new ATOM 0 HG23 VAL A 101 83.930 1.207 10.910 1.00 1.00 H new ATOM 1513 N CYS A 102 81.493 -2.566 8.708 1.00 1.00 N ATOM 1514 CA CYS A 102 80.567 -3.704 8.712 1.00 1.00 C ATOM 1515 C CYS A 102 81.261 -4.980 9.211 1.00 1.00 C ATOM 1516 O CYS A 102 80.605 -5.931 9.622 1.00 1.00 O ATOM 1517 CB CYS A 102 80.061 -3.901 7.260 1.00 1.00 C ATOM 1518 SG CYS A 102 78.338 -4.460 7.244 1.00 1.00 S ATOM 0 H CYS A 102 81.413 -1.969 7.885 1.00 1.00 H new ATOM 0 HA CYS A 102 79.735 -3.504 9.387 1.00 1.00 H new ATOM 0 HB2 CYS A 102 80.148 -2.964 6.710 1.00 1.00 H new ATOM 0 HB3 CYS A 102 80.689 -4.630 6.748 1.00 1.00 H new ATOM 1523 N ARG A 103 82.588 -4.973 9.205 1.00 1.00 N ATOM 1524 CA ARG A 103 83.370 -6.122 9.708 1.00 1.00 C ATOM 1525 C ARG A 103 83.742 -5.946 11.194 1.00 1.00 C ATOM 1526 O ARG A 103 83.759 -6.890 11.985 1.00 1.00 O ATOM 1527 CB ARG A 103 84.657 -6.285 8.886 1.00 1.00 C ATOM 1528 CG ARG A 103 85.314 -7.670 9.184 1.00 1.00 C ATOM 1529 CD ARG A 103 86.831 -7.548 9.448 1.00 1.00 C ATOM 1530 NE ARG A 103 87.581 -7.639 8.204 1.00 1.00 N ATOM 1531 CZ ARG A 103 88.907 -7.666 8.222 1.00 1.00 C ATOM 1532 NH1 ARG A 103 89.539 -7.490 9.350 1.00 1.00 N ATOM 1533 NH2 ARG A 103 89.580 -7.846 7.119 1.00 1.00 N ATOM 0 H ARG A 103 83.153 -4.196 8.862 1.00 1.00 H new ATOM 0 HA ARG A 103 82.747 -7.011 9.608 1.00 1.00 H new ATOM 0 HB2 ARG A 103 84.431 -6.202 7.823 1.00 1.00 H new ATOM 0 HB3 ARG A 103 85.355 -5.483 9.127 1.00 1.00 H new ATOM 0 HG2 ARG A 103 84.831 -8.121 10.051 1.00 1.00 H new ATOM 0 HG3 ARG A 103 85.146 -8.340 8.341 1.00 1.00 H new ATOM 0 HD2 ARG A 103 87.044 -6.598 9.938 1.00 1.00 H new ATOM 0 HD3 ARG A 103 87.151 -8.337 10.129 1.00 1.00 H new ATOM 0 HE ARG A 103 87.085 -7.682 7.314 1.00 1.00 H new ATOM 0 HH11 ARG A 103 89.013 -7.333 10.210 1.00 1.00 H new ATOM 0 HH12 ARG A 103 90.559 -7.509 9.372 1.00 1.00 H new ATOM 0 HH21 ARG A 103 89.087 -7.967 6.235 1.00 1.00 H new ATOM 0 HH22 ARG A 103 90.600 -7.866 7.141 1.00 1.00 H new ATOM 1547 N TYR A 104 83.985 -4.686 11.514 1.00 1.00 N ATOM 1548 CA TYR A 104 84.320 -4.171 12.848 1.00 1.00 C ATOM 1549 C TYR A 104 83.113 -3.416 13.432 1.00 1.00 C ATOM 1550 O TYR A 104 83.250 -2.650 14.383 1.00 1.00 O ATOM 1551 CB TYR A 104 85.624 -3.308 12.829 1.00 1.00 C ATOM 1552 CG TYR A 104 85.552 -2.224 13.886 1.00 1.00 C ATOM 1553 CD1 TYR A 104 85.887 -2.493 15.223 1.00 1.00 C ATOM 1554 CD2 TYR A 104 85.080 -0.963 13.524 1.00 1.00 C ATOM 1555 CE1 TYR A 104 85.747 -1.488 16.189 1.00 1.00 C ATOM 1556 CE2 TYR A 104 84.949 0.040 14.485 1.00 1.00 C ATOM 1557 CZ TYR A 104 85.279 -0.221 15.817 1.00 1.00 C ATOM 1558 OH TYR A 104 85.132 0.769 16.770 1.00 1.00 O ATOM 0 H TYR A 104 83.954 -3.945 10.814 1.00 1.00 H new ATOM 0 HA TYR A 104 84.537 -5.012 13.506 1.00 1.00 H new ATOM 0 HB2 TYR A 104 86.491 -3.943 13.008 1.00 1.00 H new ATOM 0 HB3 TYR A 104 85.756 -2.858 11.845 1.00 1.00 H new ATOM 0 HD1 TYR A 104 86.251 -3.470 15.505 1.00 1.00 H new ATOM 0 HD2 TYR A 104 84.815 -0.762 12.497 1.00 1.00 H new ATOM 0 HE1 TYR A 104 86.000 -1.690 17.219 1.00 1.00 H new ATOM 0 HE2 TYR A 104 84.592 1.018 14.199 1.00 1.00 H new ATOM 0 HH TYR A 104 84.799 1.586 16.344 1.00 1.00 H new ATOM 1568 N GLY A 105 81.910 -3.634 12.928 1.00 1.00 N ATOM 1569 CA GLY A 105 80.795 -2.913 13.519 1.00 1.00 C ATOM 1570 C GLY A 105 79.452 -3.472 13.119 1.00 1.00 C ATOM 1571 O GLY A 105 78.475 -3.192 13.800 1.00 1.00 O ATOM 0 H GLY A 105 81.686 -4.264 12.158 1.00 1.00 H new ATOM 0 HA2 GLY A 105 80.886 -2.942 14.605 1.00 1.00 H new ATOM 0 HA3 GLY A 105 80.849 -1.865 13.223 1.00 1.00 H new ATOM 1575 N ALA A 106 79.425 -4.247 12.024 1.00 1.00 N ATOM 1576 CA ALA A 106 78.194 -4.865 11.490 1.00 1.00 C ATOM 1577 C ALA A 106 77.023 -4.752 12.474 1.00 1.00 C ATOM 1578 O ALA A 106 76.541 -5.756 12.999 1.00 1.00 O ATOM 1579 CB ALA A 106 78.486 -6.353 11.146 1.00 1.00 C ATOM 0 H ALA A 106 80.259 -4.466 11.479 1.00 1.00 H new ATOM 0 HA ALA A 106 77.897 -4.329 10.589 1.00 1.00 H new ATOM 0 HB1 ALA A 106 77.583 -6.819 10.751 1.00 1.00 H new ATOM 0 HB2 ALA A 106 79.278 -6.405 10.399 1.00 1.00 H new ATOM 0 HB3 ALA A 106 78.802 -6.880 12.047 1.00 1.00 H new ATOM 1585 N THR A 107 76.567 -3.524 12.754 1.00 1.00 N ATOM 1586 CA THR A 107 75.474 -3.336 13.694 1.00 1.00 C ATOM 1587 C THR A 107 74.181 -3.168 12.931 1.00 1.00 C ATOM 1588 O THR A 107 73.105 -3.096 13.527 1.00 1.00 O ATOM 1589 CB THR A 107 75.736 -2.122 14.594 1.00 1.00 C ATOM 1590 OG1 THR A 107 76.924 -2.344 15.342 1.00 1.00 O ATOM 1591 CG2 THR A 107 74.565 -1.927 15.564 1.00 1.00 C ATOM 0 H THR A 107 76.936 -2.665 12.347 1.00 1.00 H new ATOM 0 HA THR A 107 75.398 -4.214 14.335 1.00 1.00 H new ATOM 0 HB THR A 107 75.843 -1.232 13.974 1.00 1.00 H new ATOM 0 HG1 THR A 107 77.681 -2.455 14.729 1.00 1.00 H new ATOM 0 HG21 THR A 107 74.759 -1.063 16.200 1.00 1.00 H new ATOM 0 HG22 THR A 107 73.648 -1.763 14.999 1.00 1.00 H new ATOM 0 HG23 THR A 107 74.455 -2.816 16.185 1.00 1.00 H new ATOM 1599 N VAL A 108 74.281 -3.128 11.595 1.00 1.00 N ATOM 1600 CA VAL A 108 73.094 -3.002 10.750 1.00 1.00 C ATOM 1601 C VAL A 108 72.432 -4.377 10.560 1.00 1.00 C ATOM 1602 O VAL A 108 71.239 -4.516 10.814 1.00 1.00 O ATOM 1603 CB VAL A 108 73.461 -2.377 9.396 1.00 1.00 C ATOM 1604 CG1 VAL A 108 72.303 -2.545 8.403 1.00 1.00 C ATOM 1605 CG2 VAL A 108 73.744 -0.883 9.594 1.00 1.00 C ATOM 0 H VAL A 108 75.162 -3.181 11.084 1.00 1.00 H new ATOM 0 HA VAL A 108 72.380 -2.342 11.242 1.00 1.00 H new ATOM 0 HB VAL A 108 74.344 -2.877 8.999 1.00 1.00 H new ATOM 0 HG11 VAL A 108 72.576 -2.098 7.447 1.00 1.00 H new ATOM 0 HG12 VAL A 108 72.096 -3.606 8.261 1.00 1.00 H new ATOM 0 HG13 VAL A 108 71.414 -2.051 8.794 1.00 1.00 H new ATOM 0 HG21 VAL A 108 74.005 -0.432 8.637 1.00 1.00 H new ATOM 0 HG22 VAL A 108 72.856 -0.394 9.995 1.00 1.00 H new ATOM 0 HG23 VAL A 108 74.572 -0.759 10.292 1.00 1.00 H new ATOM 1615 N ILE A 109 73.185 -5.395 10.098 1.00 1.00 N ATOM 1616 CA ILE A 109 72.625 -6.738 9.869 1.00 1.00 C ATOM 1617 C ILE A 109 71.773 -7.286 11.022 1.00 1.00 C ATOM 1618 O ILE A 109 70.800 -7.976 10.761 1.00 1.00 O ATOM 1619 CB ILE A 109 73.782 -7.757 9.497 1.00 1.00 C ATOM 1620 CG1 ILE A 109 74.175 -8.764 10.649 1.00 1.00 C ATOM 1621 CG2 ILE A 109 75.049 -6.972 9.110 1.00 1.00 C ATOM 1622 CD1 ILE A 109 74.736 -10.056 10.040 1.00 1.00 C ATOM 0 H ILE A 109 74.177 -5.312 9.878 1.00 1.00 H new ATOM 0 HA ILE A 109 71.935 -6.629 9.032 1.00 1.00 H new ATOM 0 HB ILE A 109 73.387 -8.352 8.674 1.00 1.00 H new ATOM 0 HG12 ILE A 109 74.916 -8.309 11.306 1.00 1.00 H new ATOM 0 HG13 ILE A 109 73.302 -8.989 11.262 1.00 1.00 H new ATOM 0 HG21 ILE A 109 75.846 -7.670 8.854 1.00 1.00 H new ATOM 0 HG22 ILE A 109 74.835 -6.335 8.252 1.00 1.00 H new ATOM 0 HG23 ILE A 109 75.365 -6.354 9.950 1.00 1.00 H new ATOM 0 HD11 ILE A 109 75.006 -10.747 10.838 1.00 1.00 H new ATOM 0 HD12 ILE A 109 73.981 -10.515 9.402 1.00 1.00 H new ATOM 0 HD13 ILE A 109 75.620 -9.824 9.447 1.00 1.00 H new ATOM 1634 N PRO A 110 72.130 -7.072 12.264 1.00 1.00 N ATOM 1635 CA PRO A 110 71.397 -7.680 13.411 1.00 1.00 C ATOM 1636 C PRO A 110 69.888 -7.528 13.288 1.00 1.00 C ATOM 1637 O PRO A 110 69.156 -8.471 13.578 1.00 1.00 O ATOM 1638 CB PRO A 110 71.961 -6.933 14.627 1.00 1.00 C ATOM 1639 CG PRO A 110 73.344 -6.569 14.214 1.00 1.00 C ATOM 1640 CD PRO A 110 73.226 -6.228 12.734 1.00 1.00 C ATOM 0 HA PRO A 110 71.541 -8.759 13.474 1.00 1.00 H new ATOM 0 HB2 PRO A 110 71.369 -6.049 14.863 1.00 1.00 H new ATOM 0 HB3 PRO A 110 71.962 -7.562 15.517 1.00 1.00 H new ATOM 0 HG2 PRO A 110 73.719 -5.721 14.787 1.00 1.00 H new ATOM 0 HG3 PRO A 110 74.037 -7.395 14.377 1.00 1.00 H new ATOM 0 HD2 PRO A 110 73.008 -5.171 12.584 1.00 1.00 H new ATOM 0 HD3 PRO A 110 74.152 -6.442 12.200 1.00 1.00 H new ATOM 1648 N ASN A 111 69.401 -6.371 12.859 1.00 1.00 N ATOM 1649 CA ASN A 111 67.961 -6.218 12.736 1.00 1.00 C ATOM 1650 C ASN A 111 67.410 -7.191 11.683 1.00 1.00 C ATOM 1651 O ASN A 111 66.684 -8.129 12.009 1.00 1.00 O ATOM 1652 CB ASN A 111 67.662 -4.754 12.338 1.00 1.00 C ATOM 1653 CG ASN A 111 66.309 -4.635 11.637 1.00 1.00 C ATOM 1654 OD1 ASN A 111 66.198 -3.952 10.618 1.00 1.00 O ATOM 1655 ND2 ASN A 111 65.282 -5.271 12.120 1.00 1.00 N ATOM 0 H ASN A 111 69.957 -5.556 12.600 1.00 1.00 H new ATOM 0 HA ASN A 111 67.476 -6.448 13.685 1.00 1.00 H new ATOM 0 HB2 ASN A 111 67.670 -4.124 13.228 1.00 1.00 H new ATOM 0 HB3 ASN A 111 68.449 -4.386 11.680 1.00 1.00 H new ATOM 0 HD21 ASN A 111 64.377 -5.206 11.654 1.00 1.00 H new ATOM 0 HD22 ASN A 111 65.382 -5.835 12.964 1.00 1.00 H new ATOM 1662 N ILE A 112 67.733 -6.941 10.424 1.00 1.00 N ATOM 1663 CA ILE A 112 67.226 -7.783 9.337 1.00 1.00 C ATOM 1664 C ILE A 112 67.717 -9.218 9.498 1.00 1.00 C ATOM 1665 O ILE A 112 66.984 -10.171 9.268 1.00 1.00 O ATOM 1666 CB ILE A 112 67.649 -7.203 7.941 1.00 1.00 C ATOM 1667 CG1 ILE A 112 68.743 -8.072 7.248 1.00 1.00 C ATOM 1668 CG2 ILE A 112 68.199 -5.781 8.136 1.00 1.00 C ATOM 1669 CD1 ILE A 112 69.125 -7.504 5.873 1.00 1.00 C ATOM 0 H ILE A 112 68.335 -6.174 10.126 1.00 1.00 H new ATOM 0 HA ILE A 112 66.137 -7.787 9.386 1.00 1.00 H new ATOM 0 HB ILE A 112 66.766 -7.201 7.302 1.00 1.00 H new ATOM 0 HG12 ILE A 112 69.628 -8.119 7.882 1.00 1.00 H new ATOM 0 HG13 ILE A 112 68.379 -9.093 7.133 1.00 1.00 H new ATOM 0 HG21 ILE A 112 68.495 -5.370 7.171 1.00 1.00 H new ATOM 0 HG22 ILE A 112 67.428 -5.150 8.578 1.00 1.00 H new ATOM 0 HG23 ILE A 112 69.064 -5.813 8.798 1.00 1.00 H new ATOM 0 HD11 ILE A 112 69.890 -8.134 5.419 1.00 1.00 H new ATOM 0 HD12 ILE A 112 68.244 -7.482 5.231 1.00 1.00 H new ATOM 0 HD13 ILE A 112 69.513 -6.492 5.992 1.00 1.00 H new ATOM 1681 N ASN A 113 68.984 -9.345 9.802 1.00 1.00 N ATOM 1682 CA ASN A 113 69.617 -10.659 9.875 1.00 1.00 C ATOM 1683 C ASN A 113 68.768 -11.639 10.640 1.00 1.00 C ATOM 1684 O ASN A 113 68.321 -12.634 10.080 1.00 1.00 O ATOM 1685 CB ASN A 113 70.975 -10.549 10.574 1.00 1.00 C ATOM 1686 CG ASN A 113 71.570 -11.926 10.833 1.00 1.00 C ATOM 1687 OD1 ASN A 113 71.340 -12.860 10.067 1.00 1.00 O ATOM 1688 ND2 ASN A 113 72.314 -12.102 11.887 1.00 1.00 N ATOM 0 H ASN A 113 69.606 -8.562 10.004 1.00 1.00 H new ATOM 0 HA ASN A 113 69.741 -11.017 8.853 1.00 1.00 H new ATOM 0 HB2 ASN A 113 71.658 -9.964 9.958 1.00 1.00 H new ATOM 0 HB3 ASN A 113 70.860 -10.016 11.518 1.00 1.00 H new ATOM 0 HD21 ASN A 113 72.712 -13.021 12.083 1.00 1.00 H new ATOM 0 HD22 ASN A 113 72.499 -11.321 12.517 1.00 1.00 H new ATOM 1695 N ALA A 114 68.509 -11.393 11.903 1.00 1.00 N ATOM 1696 CA ALA A 114 67.694 -12.317 12.635 1.00 1.00 C ATOM 1697 C ALA A 114 66.301 -12.410 12.022 1.00 1.00 C ATOM 1698 O ALA A 114 65.644 -13.448 12.143 1.00 1.00 O ATOM 1699 CB ALA A 114 67.587 -11.885 14.095 1.00 1.00 C ATOM 0 H ALA A 114 68.842 -10.584 12.428 1.00 1.00 H new ATOM 0 HA ALA A 114 68.164 -13.299 12.585 1.00 1.00 H new ATOM 0 HB1 ALA A 114 66.965 -12.595 14.640 1.00 1.00 H new ATOM 0 HB2 ALA A 114 68.582 -11.857 14.540 1.00 1.00 H new ATOM 0 HB3 ALA A 114 67.138 -10.893 14.149 1.00 1.00 H new ATOM 1705 N ALA A 115 65.861 -11.363 11.311 1.00 1.00 N ATOM 1706 CA ALA A 115 64.545 -11.411 10.668 1.00 1.00 C ATOM 1707 C ALA A 115 64.538 -12.139 9.316 1.00 1.00 C ATOM 1708 O ALA A 115 63.825 -13.140 9.162 1.00 1.00 O ATOM 1709 CB ALA A 115 64.011 -9.995 10.478 1.00 1.00 C ATOM 0 H ALA A 115 66.381 -10.497 11.170 1.00 1.00 H new ATOM 0 HA ALA A 115 63.904 -11.986 11.336 1.00 1.00 H new ATOM 0 HB1 ALA A 115 63.032 -10.036 10.000 1.00 1.00 H new ATOM 0 HB2 ALA A 115 63.920 -9.507 11.448 1.00 1.00 H new ATOM 0 HB3 ALA A 115 64.698 -9.428 9.850 1.00 1.00 H new ATOM 1715 N ILE A 116 65.286 -11.667 8.296 1.00 1.00 N ATOM 1716 CA ILE A 116 65.253 -12.323 6.999 1.00 1.00 C ATOM 1717 C ILE A 116 65.918 -13.675 7.044 1.00 1.00 C ATOM 1718 O ILE A 116 65.397 -14.660 6.540 1.00 1.00 O ATOM 1719 CB ILE A 116 66.000 -11.417 5.996 1.00 1.00 C ATOM 1720 CG1 ILE A 116 65.103 -10.225 5.636 1.00 1.00 C ATOM 1721 CG2 ILE A 116 66.379 -12.188 4.722 1.00 1.00 C ATOM 1722 CD1 ILE A 116 65.868 -9.193 4.782 1.00 1.00 C ATOM 0 H ILE A 116 65.901 -10.855 8.354 1.00 1.00 H new ATOM 0 HA ILE A 116 64.216 -12.477 6.701 1.00 1.00 H new ATOM 0 HB ILE A 116 66.922 -11.067 6.461 1.00 1.00 H new ATOM 0 HG12 ILE A 116 64.228 -10.576 5.090 1.00 1.00 H new ATOM 0 HG13 ILE A 116 64.740 -9.750 6.548 1.00 1.00 H new ATOM 0 HG21 ILE A 116 66.903 -11.522 4.036 1.00 1.00 H new ATOM 0 HG22 ILE A 116 67.027 -13.025 4.982 1.00 1.00 H new ATOM 0 HG23 ILE A 116 65.476 -12.565 4.242 1.00 1.00 H new ATOM 0 HD11 ILE A 116 65.208 -8.359 4.541 1.00 1.00 H new ATOM 0 HD12 ILE A 116 66.729 -8.825 5.340 1.00 1.00 H new ATOM 0 HD13 ILE A 116 66.208 -9.664 3.860 1.00 1.00 H new ATOM 1734 N GLU A 117 67.104 -13.702 7.604 1.00 1.00 N ATOM 1735 CA GLU A 117 67.883 -14.928 7.658 1.00 1.00 C ATOM 1736 C GLU A 117 66.977 -16.049 8.112 1.00 1.00 C ATOM 1737 O GLU A 117 66.742 -17.014 7.361 1.00 1.00 O ATOM 1738 CB GLU A 117 69.074 -14.734 8.613 1.00 1.00 C ATOM 1739 CG GLU A 117 70.186 -15.708 8.257 1.00 1.00 C ATOM 1740 CD GLU A 117 71.366 -15.575 9.211 1.00 1.00 C ATOM 1741 OE1 GLU A 117 72.197 -14.715 8.972 1.00 1.00 O ATOM 1742 OE2 GLU A 117 71.418 -16.329 10.168 1.00 1.00 O ATOM 0 H GLU A 117 67.555 -12.892 8.030 1.00 1.00 H new ATOM 0 HA GLU A 117 68.284 -15.181 6.677 1.00 1.00 H new ATOM 0 HB2 GLU A 117 69.441 -13.710 8.547 1.00 1.00 H new ATOM 0 HB3 GLU A 117 68.755 -14.893 9.643 1.00 1.00 H new ATOM 0 HG2 GLU A 117 69.803 -16.728 8.289 1.00 1.00 H new ATOM 0 HG3 GLU A 117 70.519 -15.525 7.235 1.00 1.00 H new ATOM 1749 N VAL A 118 66.452 -15.895 9.326 1.00 1.00 N ATOM 1750 CA VAL A 118 65.546 -16.880 9.857 1.00 1.00 C ATOM 1751 C VAL A 118 64.403 -17.094 8.875 1.00 1.00 C ATOM 1752 O VAL A 118 63.699 -18.102 8.964 1.00 1.00 O ATOM 1753 CB VAL A 118 64.988 -16.409 11.201 1.00 1.00 C ATOM 1754 CG1 VAL A 118 63.997 -17.444 11.746 1.00 1.00 C ATOM 1755 CG2 VAL A 118 66.139 -16.233 12.192 1.00 1.00 C ATOM 0 H VAL A 118 66.642 -15.106 9.944 1.00 1.00 H new ATOM 0 HA VAL A 118 66.082 -17.818 10.006 1.00 1.00 H new ATOM 0 HB VAL A 118 64.472 -15.459 11.064 1.00 1.00 H new ATOM 0 HG11 VAL A 118 63.604 -17.102 12.703 1.00 1.00 H new ATOM 0 HG12 VAL A 118 63.176 -17.569 11.040 1.00 1.00 H new ATOM 0 HG13 VAL A 118 64.506 -18.398 11.883 1.00 1.00 H new ATOM 0 HG21 VAL A 118 65.745 -15.897 13.151 1.00 1.00 H new ATOM 0 HG22 VAL A 118 66.654 -17.185 12.324 1.00 1.00 H new ATOM 0 HG23 VAL A 118 66.840 -15.492 11.808 1.00 1.00 H new ATOM 1765 N LEU A 119 64.219 -16.171 7.909 1.00 1.00 N ATOM 1766 CA LEU A 119 63.153 -16.355 6.919 1.00 1.00 C ATOM 1767 C LEU A 119 63.599 -17.336 5.827 1.00 1.00 C ATOM 1768 O LEU A 119 62.968 -18.384 5.672 1.00 1.00 O ATOM 1769 CB LEU A 119 62.752 -15.005 6.300 1.00 1.00 C ATOM 1770 CG LEU A 119 61.269 -15.016 5.874 1.00 1.00 C ATOM 1771 CD1 LEU A 119 60.994 -16.226 4.969 1.00 1.00 C ATOM 1772 CD2 LEU A 119 60.346 -15.071 7.118 1.00 1.00 C ATOM 0 H LEU A 119 64.775 -15.323 7.799 1.00 1.00 H new ATOM 0 HA LEU A 119 62.282 -16.773 7.424 1.00 1.00 H new ATOM 0 HB2 LEU A 119 62.922 -14.205 7.020 1.00 1.00 H new ATOM 0 HB3 LEU A 119 63.382 -14.795 5.435 1.00 1.00 H new ATOM 0 HG LEU A 119 61.059 -14.099 5.324 1.00 1.00 H new ATOM 0 HD11 LEU A 119 59.945 -16.227 4.672 1.00 1.00 H new ATOM 0 HD12 LEU A 119 61.623 -16.166 4.081 1.00 1.00 H new ATOM 0 HD13 LEU A 119 61.219 -17.144 5.511 1.00 1.00 H new ATOM 0 HD21 LEU A 119 59.304 -15.078 6.798 1.00 1.00 H new ATOM 0 HD22 LEU A 119 60.557 -15.976 7.688 1.00 1.00 H new ATOM 0 HD23 LEU A 119 60.527 -14.198 7.744 1.00 1.00 H new ATOM 1784 N GLY A 120 64.676 -17.037 5.050 1.00 1.00 N ATOM 1785 CA GLY A 120 65.062 -18.012 4.020 1.00 1.00 C ATOM 1786 C GLY A 120 65.573 -19.330 4.632 1.00 1.00 C ATOM 1787 O GLY A 120 64.834 -20.303 4.785 1.00 1.00 O ATOM 0 H GLY A 120 65.247 -16.194 5.113 1.00 1.00 H new ATOM 0 HA2 GLY A 120 64.206 -18.219 3.378 1.00 1.00 H new ATOM 0 HA3 GLY A 120 65.838 -17.582 3.387 1.00 1.00 H new ATOM 1791 N THR A 121 66.857 -19.337 4.945 1.00 1.00 N ATOM 1792 CA THR A 121 67.544 -20.510 5.513 1.00 1.00 C ATOM 1793 C THR A 121 68.859 -20.025 6.106 1.00 1.00 C ATOM 1794 O THR A 121 69.410 -20.607 7.041 1.00 1.00 O ATOM 1795 CB THR A 121 67.763 -21.586 4.415 1.00 1.00 C ATOM 1796 OG1 THR A 121 67.008 -21.218 3.272 1.00 1.00 O ATOM 1797 CG2 THR A 121 67.290 -22.968 4.898 1.00 1.00 C ATOM 0 H THR A 121 67.466 -18.529 4.816 1.00 1.00 H new ATOM 0 HA THR A 121 66.945 -20.979 6.294 1.00 1.00 H new ATOM 0 HB THR A 121 68.826 -21.645 4.182 1.00 1.00 H new ATOM 0 HG1 THR A 121 67.136 -21.886 2.567 1.00 1.00 H new ATOM 0 HG21 THR A 121 67.454 -23.704 4.111 1.00 1.00 H new ATOM 0 HG22 THR A 121 67.852 -23.255 5.786 1.00 1.00 H new ATOM 0 HG23 THR A 121 66.228 -22.925 5.139 1.00 1.00 H new ATOM 1805 N GLY A 122 69.340 -18.935 5.527 1.00 1.00 N ATOM 1806 CA GLY A 122 70.576 -18.267 5.909 1.00 1.00 C ATOM 1807 C GLY A 122 71.635 -18.268 4.804 1.00 1.00 C ATOM 1808 O GLY A 122 72.367 -17.285 4.707 1.00 1.00 O ATOM 0 H GLY A 122 68.864 -18.475 4.751 1.00 1.00 H new ATOM 0 HA2 GLY A 122 70.353 -17.237 6.187 1.00 1.00 H new ATOM 0 HA3 GLY A 122 70.985 -18.754 6.794 1.00 1.00 H new ATOM 1812 N THR A 123 71.770 -19.321 3.993 1.00 1.00 N ATOM 1813 CA THR A 123 72.811 -19.333 2.947 1.00 1.00 C ATOM 1814 C THR A 123 73.093 -17.937 2.373 1.00 1.00 C ATOM 1815 O THR A 123 72.475 -17.513 1.396 1.00 1.00 O ATOM 1816 CB THR A 123 72.369 -20.234 1.794 1.00 1.00 C ATOM 1817 OG1 THR A 123 73.126 -19.896 0.636 1.00 1.00 O ATOM 1818 CG2 THR A 123 70.873 -20.029 1.503 1.00 1.00 C ATOM 0 H THR A 123 71.190 -20.159 4.033 1.00 1.00 H new ATOM 0 HA THR A 123 73.722 -19.701 3.418 1.00 1.00 H new ATOM 0 HB THR A 123 72.534 -21.277 2.064 1.00 1.00 H new ATOM 0 HG1 THR A 123 72.842 -19.019 0.304 1.00 1.00 H new ATOM 0 HG21 THR A 123 70.570 -20.676 0.680 1.00 1.00 H new ATOM 0 HG22 THR A 123 70.292 -20.276 2.392 1.00 1.00 H new ATOM 0 HG23 THR A 123 70.694 -18.989 1.231 1.00 1.00 H new ATOM 1826 N ASP A 124 74.038 -17.226 2.994 1.00 1.00 N ATOM 1827 CA ASP A 124 74.419 -15.885 2.566 1.00 1.00 C ATOM 1828 C ASP A 124 75.900 -15.691 2.852 1.00 1.00 C ATOM 1829 O ASP A 124 76.413 -16.177 3.857 1.00 1.00 O ATOM 1830 CB ASP A 124 73.596 -14.829 3.324 1.00 1.00 C ATOM 1831 CG ASP A 124 73.885 -13.437 2.765 1.00 1.00 C ATOM 1832 OD1 ASP A 124 75.051 -13.087 2.681 1.00 1.00 O ATOM 1833 OD2 ASP A 124 72.938 -12.742 2.432 1.00 1.00 O ATOM 0 H ASP A 124 74.556 -17.566 3.804 1.00 1.00 H new ATOM 0 HA ASP A 124 74.225 -15.769 1.500 1.00 1.00 H new ATOM 0 HB2 ASP A 124 72.533 -15.052 3.234 1.00 1.00 H new ATOM 0 HB3 ASP A 124 73.839 -14.861 4.386 1.00 1.00 H new ATOM 1838 N TYR A 125 76.586 -14.976 1.974 1.00 1.00 N ATOM 1839 CA TYR A 125 78.010 -14.726 2.151 1.00 1.00 C ATOM 1840 C TYR A 125 78.382 -13.383 1.503 1.00 1.00 C ATOM 1841 O TYR A 125 77.812 -13.008 0.478 1.00 1.00 O ATOM 1842 CB TYR A 125 78.818 -15.896 1.525 1.00 1.00 C ATOM 1843 CG TYR A 125 79.486 -15.458 0.234 1.00 1.00 C ATOM 1844 CD1 TYR A 125 78.700 -15.138 -0.878 1.00 1.00 C ATOM 1845 CD2 TYR A 125 80.881 -15.336 0.165 1.00 1.00 C ATOM 1846 CE1 TYR A 125 79.306 -14.703 -2.061 1.00 1.00 C ATOM 1847 CE2 TYR A 125 81.486 -14.899 -1.018 1.00 1.00 C ATOM 1848 CZ TYR A 125 80.698 -14.582 -2.132 1.00 1.00 C ATOM 1849 OH TYR A 125 81.291 -14.148 -3.299 1.00 1.00 O ATOM 0 H TYR A 125 76.183 -14.560 1.135 1.00 1.00 H new ATOM 0 HA TYR A 125 78.252 -14.669 3.212 1.00 1.00 H new ATOM 0 HB2 TYR A 125 79.573 -16.242 2.231 1.00 1.00 H new ATOM 0 HB3 TYR A 125 78.155 -16.738 1.329 1.00 1.00 H new ATOM 0 HD1 TYR A 125 77.625 -15.227 -0.823 1.00 1.00 H new ATOM 0 HD2 TYR A 125 81.488 -15.579 1.025 1.00 1.00 H new ATOM 0 HE1 TYR A 125 78.699 -14.460 -2.921 1.00 1.00 H new ATOM 0 HE2 TYR A 125 82.561 -14.806 -1.073 1.00 1.00 H new ATOM 0 HH TYR A 125 81.751 -13.298 -3.136 1.00 1.00 H new ATOM 1859 N ARG A 126 79.377 -12.700 2.076 1.00 1.00 N ATOM 1860 CA ARG A 126 79.869 -11.430 1.519 1.00 1.00 C ATOM 1861 C ARG A 126 81.371 -11.316 1.755 1.00 1.00 C ATOM 1862 O ARG A 126 81.888 -11.820 2.751 1.00 1.00 O ATOM 1863 CB ARG A 126 79.176 -10.204 2.148 1.00 1.00 C ATOM 1864 CG ARG A 126 77.689 -10.117 1.749 1.00 1.00 C ATOM 1865 CD ARG A 126 77.520 -9.397 0.398 1.00 1.00 C ATOM 1866 NE ARG A 126 78.177 -10.127 -0.687 1.00 1.00 N ATOM 1867 CZ ARG A 126 77.557 -11.092 -1.368 1.00 1.00 C ATOM 1868 NH1 ARG A 126 76.333 -11.430 -1.065 1.00 1.00 N ATOM 1869 NH2 ARG A 126 78.179 -11.696 -2.346 1.00 1.00 N ATOM 0 H ARG A 126 79.859 -13.001 2.923 1.00 1.00 H new ATOM 0 HA ARG A 126 79.641 -11.437 0.453 1.00 1.00 H new ATOM 0 HB2 ARG A 126 79.258 -10.258 3.234 1.00 1.00 H new ATOM 0 HB3 ARG A 126 79.690 -9.296 1.834 1.00 1.00 H new ATOM 0 HG2 ARG A 126 77.267 -11.120 1.686 1.00 1.00 H new ATOM 0 HG3 ARG A 126 77.133 -9.585 2.521 1.00 1.00 H new ATOM 0 HD2 ARG A 126 76.459 -9.288 0.174 1.00 1.00 H new ATOM 0 HD3 ARG A 126 77.937 -8.392 0.466 1.00 1.00 H new ATOM 0 HE ARG A 126 79.139 -9.891 -0.930 1.00 1.00 H new ATOM 0 HH11 ARG A 126 75.846 -10.956 -0.304 1.00 1.00 H new ATOM 0 HH12 ARG A 126 75.863 -12.169 -1.589 1.00 1.00 H new ATOM 0 HH21 ARG A 126 79.134 -11.429 -2.585 1.00 1.00 H new ATOM 0 HH22 ARG A 126 77.710 -12.435 -2.870 1.00 1.00 H new ATOM 1883 N PHE A 127 82.073 -10.651 0.839 1.00 1.00 N ATOM 1884 CA PHE A 127 83.522 -10.480 0.960 1.00 1.00 C ATOM 1885 C PHE A 127 83.847 -9.042 1.361 1.00 1.00 C ATOM 1886 O PHE A 127 83.815 -8.185 0.496 1.00 1.00 O ATOM 1887 CB PHE A 127 84.193 -10.827 -0.382 1.00 1.00 C ATOM 1888 CG PHE A 127 83.252 -10.501 -1.521 1.00 1.00 C ATOM 1889 CD1 PHE A 127 82.320 -11.452 -1.952 1.00 1.00 C ATOM 1890 CD2 PHE A 127 83.314 -9.255 -2.148 1.00 1.00 C ATOM 1891 CE1 PHE A 127 81.453 -11.151 -3.008 1.00 1.00 C ATOM 1892 CE2 PHE A 127 82.451 -8.953 -3.205 1.00 1.00 C ATOM 1893 CZ PHE A 127 81.519 -9.904 -3.635 1.00 1.00 C ATOM 1894 OXT PHE A 127 84.126 -8.821 2.528 1.00 1.00 O ATOM 0 H PHE A 127 81.665 -10.223 0.008 1.00 1.00 H new ATOM 0 HA PHE A 127 83.903 -11.149 1.732 1.00 1.00 H new ATOM 0 HB2 PHE A 127 85.121 -10.266 -0.492 1.00 1.00 H new ATOM 0 HB3 PHE A 127 84.456 -11.885 -0.406 1.00 1.00 H new ATOM 0 HD1 PHE A 127 82.270 -12.417 -1.470 1.00 1.00 H new ATOM 0 HD2 PHE A 127 84.032 -8.521 -1.814 1.00 1.00 H new ATOM 0 HE1 PHE A 127 80.732 -11.884 -3.339 1.00 1.00 H new ATOM 0 HE2 PHE A 127 82.503 -7.989 -3.688 1.00 1.00 H new ATOM 0 HZ PHE A 127 80.851 -9.674 -4.452 1.00 1.00 H new TER 1904 PHE A 127 HETATM 1905 O1 MTN A 128 65.861 4.912 -9.046 1.00 1.00 O HETATM 1906 N1 MTN A 128 65.518 4.860 -7.829 1.00 1.00 N HETATM 1907 C1 MTN A 128 65.467 3.596 -7.047 1.00 1.00 C HETATM 1908 C2 MTN A 128 65.010 4.122 -5.735 1.00 1.00 C HETATM 1909 C3 MTN A 128 64.822 5.427 -5.720 1.00 1.00 C HETATM 1910 C4 MTN A 128 64.364 6.208 -4.534 1.00 1.00 C HETATM 1911 S1 MTN A 128 65.704 6.777 -3.471 1.00 1.00 S HETATM 1912 C5 MTN A 128 65.123 6.076 -7.051 1.00 1.00 C HETATM 1913 C6 MTN A 128 63.946 6.864 -7.617 1.00 1.00 C HETATM 1914 C7 MTN A 128 66.352 6.967 -6.898 1.00 1.00 C HETATM 1915 C8 MTN A 128 64.474 2.576 -7.602 1.00 1.00 C HETATM 1916 C9 MTN A 128 66.862 2.993 -6.930 1.00 1.00 C HETATM 0 H93 MTN A 128 67.251 2.781 -7.926 1.00 1.00 H new HETATM 0 H92 MTN A 128 67.522 3.698 -6.425 1.00 1.00 H new HETATM 0 H91 MTN A 128 66.812 2.068 -6.355 1.00 1.00 H new HETATM 0 H83 MTN A 128 63.471 3.004 -7.596 1.00 1.00 H new HETATM 0 H82 MTN A 128 64.752 2.316 -8.624 1.00 1.00 H new HETATM 0 H81 MTN A 128 64.489 1.679 -6.983 1.00 1.00 H new HETATM 0 H73 MTN A 128 67.133 6.422 -6.368 1.00 1.00 H new HETATM 0 H72 MTN A 128 66.717 7.256 -7.884 1.00 1.00 H new HETATM 0 H71 MTN A 128 66.086 7.860 -6.333 1.00 1.00 H new HETATM 0 H63 MTN A 128 64.188 7.208 -8.622 1.00 1.00 H new HETATM 0 H62 MTN A 128 63.064 6.224 -7.655 1.00 1.00 H new HETATM 0 H61 MTN A 128 63.743 7.724 -6.978 1.00 1.00 H new HETATM 0 H42 MTN A 128 63.795 7.072 -4.878 1.00 1.00 H new HETATM 0 H41 MTN A 128 63.684 5.592 -3.946 1.00 1.00 H new HETATM 0 H2 MTN A 128 64.845 3.487 -4.864 1.00 1.00 H new HETATM 1932 O1 MTN A 129 71.524 -9.553 -4.496 1.00 1.00 O HETATM 1933 N1 MTN A 129 70.872 -8.558 -4.934 1.00 1.00 N HETATM 1934 C1 MTN A 129 70.539 -8.395 -6.347 1.00 1.00 C HETATM 1935 C2 MTN A 129 69.804 -7.102 -6.283 1.00 1.00 C HETATM 1936 C3 MTN A 129 69.708 -6.604 -5.058 1.00 1.00 C HETATM 1937 C4 MTN A 129 68.975 -5.345 -4.696 1.00 1.00 C HETATM 1938 S1 MTN A 129 69.077 -4.017 -5.925 1.00 1.00 S HETATM 1939 C5 MTN A 129 70.397 -7.480 -4.034 1.00 1.00 C HETATM 1940 C6 MTN A 129 71.512 -6.795 -3.251 1.00 1.00 C HETATM 1941 C7 MTN A 129 69.362 -8.081 -3.088 1.00 1.00 C HETATM 1942 C8 MTN A 129 71.785 -8.345 -7.228 1.00 1.00 C HETATM 1943 C9 MTN A 129 69.606 -9.520 -6.771 1.00 1.00 C HETATM 0 H93 MTN A 129 70.100 -10.479 -6.619 1.00 1.00 H new HETATM 0 H92 MTN A 129 68.695 -9.482 -6.173 1.00 1.00 H new HETATM 0 H91 MTN A 129 69.353 -9.405 -7.825 1.00 1.00 H new HETATM 0 H83 MTN A 129 72.410 -7.504 -6.927 1.00 1.00 H new HETATM 0 H82 MTN A 129 72.347 -9.272 -7.117 1.00 1.00 H new HETATM 0 H81 MTN A 129 71.489 -8.223 -8.270 1.00 1.00 H new HETATM 0 H73 MTN A 129 68.530 -8.483 -3.667 1.00 1.00 H new HETATM 0 H72 MTN A 129 69.821 -8.882 -2.508 1.00 1.00 H new HETATM 0 H71 MTN A 129 68.994 -7.308 -2.413 1.00 1.00 H new HETATM 0 H63 MTN A 129 72.026 -7.530 -2.631 1.00 1.00 H new HETATM 0 H62 MTN A 129 72.222 -6.346 -3.946 1.00 1.00 H new HETATM 0 H61 MTN A 129 71.086 -6.019 -2.615 1.00 1.00 H new HETATM 0 H42 MTN A 129 67.925 -5.588 -4.533 1.00 1.00 H new HETATM 0 H41 MTN A 129 69.367 -4.974 -3.749 1.00 1.00 H new HETATM 0 H2 MTN A 129 69.384 -6.611 -7.161 1.00 1.00 H new HETATM 1959 O1 MTN A 130 83.064 -9.872 5.286 1.00 1.00 O HETATM 1960 N1 MTN A 130 81.929 -9.440 5.646 1.00 1.00 N HETATM 1961 C1 MTN A 130 81.032 -10.192 6.559 1.00 1.00 C HETATM 1962 C2 MTN A 130 79.888 -9.254 6.625 1.00 1.00 C HETATM 1963 C3 MTN A 130 80.060 -8.160 5.907 1.00 1.00 C HETATM 1964 C4 MTN A 130 79.067 -7.051 5.808 1.00 1.00 C HETATM 1965 S1 MTN A 130 78.463 -6.472 7.412 1.00 1.00 S HETATM 1966 C5 MTN A 130 81.397 -8.133 5.184 1.00 1.00 C HETATM 1967 C6 MTN A 130 81.290 -8.006 3.650 1.00 1.00 C HETATM 1968 C7 MTN A 130 82.288 -7.035 5.788 1.00 1.00 C HETATM 1969 C8 MTN A 130 80.614 -11.554 6.010 1.00 1.00 C HETATM 1970 C9 MTN A 130 81.681 -10.331 7.928 1.00 1.00 C HETATM 0 H93 MTN A 130 82.625 -10.868 7.830 1.00 1.00 H new HETATM 0 H92 MTN A 130 81.868 -9.341 8.344 1.00 1.00 H new HETATM 0 H91 MTN A 130 81.016 -10.884 8.591 1.00 1.00 H new HETATM 0 H83 MTN A 130 80.084 -11.419 5.067 1.00 1.00 H new HETATM 0 H82 MTN A 130 81.500 -12.167 5.843 1.00 1.00 H new HETATM 0 H81 MTN A 130 79.960 -12.050 6.727 1.00 1.00 H new HETATM 0 H73 MTN A 130 82.255 -7.097 6.876 1.00 1.00 H new HETATM 0 H72 MTN A 130 83.314 -7.171 5.447 1.00 1.00 H new HETATM 0 H71 MTN A 130 81.927 -6.057 5.470 1.00 1.00 H new HETATM 0 H63 MTN A 130 82.278 -8.126 3.205 1.00 1.00 H new HETATM 0 H62 MTN A 130 80.623 -8.778 3.267 1.00 1.00 H new HETATM 0 H61 MTN A 130 80.894 -7.024 3.393 1.00 1.00 H new HETATM 0 H42 MTN A 130 79.521 -6.214 5.277 1.00 1.00 H new HETATM 0 H41 MTN A 130 78.220 -7.386 5.210 1.00 1.00 H new HETATM 0 H2 MTN A 130 78.990 -9.449 7.211 1.00 1.00 H new