USER MOD reduce.3.24.130724 H: found=0, std=0, add=1402, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1400 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl -149:sc= 0 (180deg=-0.00373) USER MOD Single : A 1 MET N :NH3+ 168:sc= -1.13 (180deg=-1.48!) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= -0.333 USER MOD Single : A 5 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 6 LYS NZ :NH3+ -162:sc=-0.00747 (180deg=-0.306) USER MOD Single : A 7 HIS : no HD1:sc= -0.0668 X(o=-0.067,f=0) USER MOD Single : A 15 MET CE :methyl -148:sc= -4.28! (180deg=-7.51!) USER MOD Single : A 18 LYS NZ :NH3+ 164:sc= -0.229 (180deg=-0.891) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ -165:sc=-0.00314 (180deg=-0.21) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 TYR OH : rot 165:sc= 0 USER MOD Single : A 48 GLN :FLIP amide:sc= -0.219 F(o=-1.3,f=-0.22) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ -161:sc= -0.0473 (180deg=-0.444) USER MOD Single : A 64 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0665) USER MOD Single : A 66 THR OG1 : rot 101:sc= 0.74 USER MOD Single : A 67 CYS SG : rot -53:sc= 1.14 USER MOD Single : A 70 ASN :FLIP amide:sc= -2.28! C(o=-3.7!,f=-2.3!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= -0.619 K(o=-0.62,f=-4.8!) USER MOD Single : A 74 SER OG : rot 110:sc= -0.57 USER MOD Single : A 77 CYS SG : rot -18:sc= 0.129 USER MOD Single : A 80 CYS SG : rot -130:sc= -0.812 USER MOD Single : A 85 CYS SG : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -150:sc= 0 (180deg=-0.00296) USER MOD Single : B 1 MET N :NH3+ 170:sc= -1.2 (180deg=-1.43!) USER MOD Single : B 2 THR OG1 : rot 180:sc= 0 USER MOD Single : B 3 THR OG1 : rot 180:sc= 0 USER MOD Single : B 4 SER OG : rot 180:sc= -0.349 USER MOD Single : B 5 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : B 6 LYS NZ :NH3+ -162:sc= -0.0224 (180deg=-0.294) USER MOD Single : B 7 HIS : no HD1:sc= -0.0999 X(o=-0.1,f=0) USER MOD Single : B 15 MET CE :methyl -150:sc= -4.25! (180deg=-7.76!) USER MOD Single : B 18 LYS NZ :NH3+ 163:sc= -0.182 (180deg=-0.87) USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.212) USER MOD Single : B 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 TYR OH : rot 165:sc= 0 USER MOD Single : B 48 GLN :FLIP amide:sc= -0.186 F(o=-1.2,f=-0.19) USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 54 LYS NZ :NH3+ -160:sc= -0.0361 (180deg=-0.478) USER MOD Single : B 64 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0601) USER MOD Single : B 66 THR OG1 : rot 94:sc= 0.756 USER MOD Single : B 67 CYS SG : rot -51:sc= 1.09 USER MOD Single : B 70 ASN :FLIP amide:sc= -2.12! C(o=-3.5!,f=-2.1!) USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 73 GLN : amide:sc= -0.691 K(o=-0.69,f=-4.7!) USER MOD Single : B 74 SER OG : rot 120:sc= -0.576 USER MOD Single : B 77 CYS SG : rot -18:sc= 0.108 USER MOD Single : B 80 CYS SG : rot -130:sc= -0.808 USER MOD Single : B 85 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 119.621 -10.695 13.847 1.00 0.00 N ATOM 2 CA MET A 1 118.427 -11.568 13.656 1.00 0.00 C ATOM 3 C MET A 1 117.549 -11.003 12.537 1.00 0.00 C ATOM 4 O MET A 1 116.715 -11.692 11.986 1.00 0.00 O ATOM 5 CB MET A 1 117.622 -11.618 14.957 1.00 0.00 C ATOM 6 CG MET A 1 117.216 -10.199 15.361 1.00 0.00 C ATOM 7 SD MET A 1 116.555 -10.215 17.047 1.00 0.00 S ATOM 8 CE MET A 1 118.136 -10.047 17.914 1.00 0.00 C ATOM 0 H1 MET A 1 120.106 -10.958 14.729 1.00 0.00 H new ATOM 0 H2 MET A 1 120.272 -10.816 13.045 1.00 0.00 H new ATOM 0 H3 MET A 1 119.319 -9.701 13.901 1.00 0.00 H new ATOM 0 HA MET A 1 118.753 -12.573 13.387 1.00 0.00 H new ATOM 0 HB2 MET A 1 116.735 -12.238 14.825 1.00 0.00 H new ATOM 0 HB3 MET A 1 118.216 -12.077 15.747 1.00 0.00 H new ATOM 0 HG2 MET A 1 118.077 -9.533 15.303 1.00 0.00 H new ATOM 0 HG3 MET A 1 116.467 -9.813 14.669 1.00 0.00 H new ATOM 0 HE1 MET A 1 118.080 -10.558 18.875 1.00 0.00 H new ATOM 0 HE2 MET A 1 118.930 -10.490 17.313 1.00 0.00 H new ATOM 0 HE3 MET A 1 118.351 -8.991 18.077 1.00 0.00 H new ATOM 20 N THR A 2 117.722 -9.746 12.204 1.00 0.00 N ATOM 21 CA THR A 2 116.888 -9.123 11.126 1.00 0.00 C ATOM 22 C THR A 2 117.690 -9.017 9.826 1.00 0.00 C ATOM 23 O THR A 2 117.133 -8.883 8.755 1.00 0.00 O ATOM 24 CB THR A 2 116.476 -7.718 11.565 1.00 0.00 C ATOM 25 OG1 THR A 2 115.786 -7.793 12.804 1.00 0.00 O ATOM 26 CG2 THR A 2 115.565 -7.099 10.505 1.00 0.00 C ATOM 0 H THR A 2 118.406 -9.123 12.633 1.00 0.00 H new ATOM 0 HA THR A 2 116.009 -9.744 10.955 1.00 0.00 H new ATOM 0 HB THR A 2 117.364 -7.098 11.683 1.00 0.00 H new ATOM 0 HG1 THR A 2 115.523 -6.892 13.087 1.00 0.00 H new ATOM 0 HG21 THR A 2 115.271 -6.097 10.818 1.00 0.00 H new ATOM 0 HG22 THR A 2 116.098 -7.041 9.556 1.00 0.00 H new ATOM 0 HG23 THR A 2 114.675 -7.717 10.384 1.00 0.00 H new ATOM 34 N THR A 3 118.990 -9.065 9.907 1.00 0.00 N ATOM 35 CA THR A 3 119.814 -8.951 8.670 1.00 0.00 C ATOM 36 C THR A 3 119.688 -10.228 7.839 1.00 0.00 C ATOM 37 O THR A 3 119.414 -11.294 8.354 1.00 0.00 O ATOM 38 CB THR A 3 121.279 -8.738 9.053 1.00 0.00 C ATOM 39 OG1 THR A 3 121.742 -9.862 9.790 1.00 0.00 O ATOM 40 CG2 THR A 3 121.404 -7.477 9.908 1.00 0.00 C ATOM 0 H THR A 3 119.517 -9.178 10.773 1.00 0.00 H new ATOM 0 HA THR A 3 119.460 -8.104 8.082 1.00 0.00 H new ATOM 0 HB THR A 3 121.880 -8.623 8.151 1.00 0.00 H new ATOM 0 HG1 THR A 3 122.681 -9.728 10.035 1.00 0.00 H new ATOM 0 HG21 THR A 3 122.448 -7.325 10.181 1.00 0.00 H new ATOM 0 HG22 THR A 3 121.048 -6.617 9.341 1.00 0.00 H new ATOM 0 HG23 THR A 3 120.805 -7.589 10.812 1.00 0.00 H new ATOM 48 N SER A 4 119.901 -10.127 6.555 1.00 0.00 N ATOM 49 CA SER A 4 119.808 -11.334 5.687 1.00 0.00 C ATOM 50 C SER A 4 121.051 -12.196 5.907 1.00 0.00 C ATOM 51 O SER A 4 122.025 -11.769 6.496 1.00 0.00 O ATOM 52 CB SER A 4 119.731 -10.909 4.220 1.00 0.00 C ATOM 53 OG SER A 4 120.009 -12.030 3.390 1.00 0.00 O ATOM 0 H SER A 4 120.135 -9.261 6.070 1.00 0.00 H new ATOM 0 HA SER A 4 118.913 -11.903 5.939 1.00 0.00 H new ATOM 0 HB2 SER A 4 118.741 -10.513 3.996 1.00 0.00 H new ATOM 0 HB3 SER A 4 120.446 -10.110 4.023 1.00 0.00 H new ATOM 0 HG SER A 4 119.959 -11.761 2.449 1.00 0.00 H new ATOM 59 N GLN A 5 121.008 -13.416 5.453 1.00 0.00 N ATOM 60 CA GLN A 5 122.161 -14.341 5.640 1.00 0.00 C ATOM 61 C GLN A 5 123.405 -13.798 4.934 1.00 0.00 C ATOM 62 O GLN A 5 124.519 -14.143 5.275 1.00 0.00 O ATOM 63 CB GLN A 5 121.806 -15.707 5.054 1.00 0.00 C ATOM 64 CG GLN A 5 120.741 -16.377 5.923 1.00 0.00 C ATOM 65 CD GLN A 5 120.354 -17.719 5.303 1.00 0.00 C ATOM 66 OE1 GLN A 5 120.585 -17.950 4.133 1.00 0.00 O ATOM 67 NE2 GLN A 5 119.763 -18.619 6.040 1.00 0.00 N ATOM 0 H GLN A 5 120.214 -13.817 4.954 1.00 0.00 H new ATOM 0 HA GLN A 5 122.373 -14.431 6.705 1.00 0.00 H new ATOM 0 HB2 GLN A 5 121.438 -15.592 4.034 1.00 0.00 H new ATOM 0 HB3 GLN A 5 122.696 -16.334 5.003 1.00 0.00 H new ATOM 0 HG2 GLN A 5 121.121 -16.526 6.934 1.00 0.00 H new ATOM 0 HG3 GLN A 5 119.864 -15.734 6.004 1.00 0.00 H new ATOM 0 HE21 GLN A 5 119.569 -18.426 7.023 1.00 0.00 H new ATOM 0 HE22 GLN A 5 119.495 -19.515 5.634 1.00 0.00 H new ATOM 76 N LYS A 6 123.231 -12.963 3.945 1.00 0.00 N ATOM 77 CA LYS A 6 124.404 -12.411 3.211 1.00 0.00 C ATOM 78 C LYS A 6 125.291 -11.620 4.171 1.00 0.00 C ATOM 79 O LYS A 6 126.501 -11.632 4.063 1.00 0.00 O ATOM 80 CB LYS A 6 123.904 -11.479 2.107 1.00 0.00 C ATOM 81 CG LYS A 6 123.225 -12.306 1.016 1.00 0.00 C ATOM 82 CD LYS A 6 122.723 -11.378 -0.091 1.00 0.00 C ATOM 83 CE LYS A 6 122.045 -12.211 -1.178 1.00 0.00 C ATOM 84 NZ LYS A 6 123.073 -13.010 -1.902 1.00 0.00 N ATOM 0 H LYS A 6 122.323 -12.639 3.613 1.00 0.00 H new ATOM 0 HA LYS A 6 124.981 -13.229 2.780 1.00 0.00 H new ATOM 0 HB2 LYS A 6 123.203 -10.753 2.518 1.00 0.00 H new ATOM 0 HB3 LYS A 6 124.737 -10.915 1.687 1.00 0.00 H new ATOM 0 HG2 LYS A 6 123.927 -13.032 0.606 1.00 0.00 H new ATOM 0 HG3 LYS A 6 122.393 -12.870 1.437 1.00 0.00 H new ATOM 0 HD2 LYS A 6 122.021 -10.652 0.318 1.00 0.00 H new ATOM 0 HD3 LYS A 6 123.555 -10.814 -0.514 1.00 0.00 H new ATOM 0 HE2 LYS A 6 121.301 -12.872 -0.734 1.00 0.00 H new ATOM 0 HE3 LYS A 6 121.517 -11.560 -1.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 122.685 -13.332 -2.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 123.913 -12.421 -2.073 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 123.339 -13.835 -1.328 1.00 0.00 H new ATOM 98 N HIS A 7 124.706 -10.917 5.098 1.00 0.00 N ATOM 99 CA HIS A 7 125.527 -10.111 6.042 1.00 0.00 C ATOM 100 C HIS A 7 126.497 -11.016 6.812 1.00 0.00 C ATOM 101 O HIS A 7 127.680 -10.749 6.885 1.00 0.00 O ATOM 102 CB HIS A 7 124.592 -9.385 7.019 1.00 0.00 C ATOM 103 CG HIS A 7 125.385 -8.788 8.152 1.00 0.00 C ATOM 104 ND1 HIS A 7 125.975 -7.534 8.071 1.00 0.00 N ATOM 105 CD2 HIS A 7 125.695 -9.269 9.400 1.00 0.00 C ATOM 106 CE1 HIS A 7 126.603 -7.307 9.241 1.00 0.00 C ATOM 107 NE2 HIS A 7 126.461 -8.333 10.081 1.00 0.00 N ATOM 0 H HIS A 7 123.698 -10.865 5.243 1.00 0.00 H new ATOM 0 HA HIS A 7 126.113 -9.381 5.483 1.00 0.00 H new ATOM 0 HB2 HIS A 7 124.045 -8.601 6.496 1.00 0.00 H new ATOM 0 HB3 HIS A 7 123.852 -10.082 7.411 1.00 0.00 H new ATOM 0 HD2 HIS A 7 125.390 -10.228 9.792 1.00 0.00 H new ATOM 0 HE1 HIS A 7 127.153 -6.406 9.470 1.00 0.00 H new ATOM 0 HE2 HIS A 7 126.837 -8.413 11.026 1.00 0.00 H new ATOM 115 N ARG A 8 126.010 -12.087 7.386 1.00 0.00 N ATOM 116 CA ARG A 8 126.902 -13.006 8.147 1.00 0.00 C ATOM 117 C ARG A 8 127.834 -13.754 7.195 1.00 0.00 C ATOM 118 O ARG A 8 128.964 -14.054 7.526 1.00 0.00 O ATOM 119 CB ARG A 8 126.047 -14.011 8.925 1.00 0.00 C ATOM 120 CG ARG A 8 125.326 -13.293 10.067 1.00 0.00 C ATOM 121 CD ARG A 8 124.421 -14.281 10.803 1.00 0.00 C ATOM 122 NE ARG A 8 123.890 -13.640 12.040 1.00 0.00 N ATOM 123 CZ ARG A 8 122.865 -14.161 12.658 1.00 0.00 C ATOM 124 NH1 ARG A 8 122.296 -15.237 12.189 1.00 0.00 N ATOM 125 NH2 ARG A 8 122.410 -13.602 13.746 1.00 0.00 N ATOM 0 H ARG A 8 125.029 -12.363 7.359 1.00 0.00 H new ATOM 0 HA ARG A 8 127.507 -12.421 8.840 1.00 0.00 H new ATOM 0 HB2 ARG A 8 125.321 -14.479 8.260 1.00 0.00 H new ATOM 0 HB3 ARG A 8 126.675 -14.808 9.322 1.00 0.00 H new ATOM 0 HG2 ARG A 8 126.053 -12.866 10.758 1.00 0.00 H new ATOM 0 HG3 ARG A 8 124.735 -12.466 9.674 1.00 0.00 H new ATOM 0 HD2 ARG A 8 123.598 -14.588 10.157 1.00 0.00 H new ATOM 0 HD3 ARG A 8 124.979 -15.182 11.058 1.00 0.00 H new ATOM 0 HE ARG A 8 124.328 -12.794 12.404 1.00 0.00 H new ATOM 0 HH11 ARG A 8 122.652 -15.673 11.338 1.00 0.00 H new ATOM 0 HH12 ARG A 8 121.495 -15.643 12.673 1.00 0.00 H new ATOM 0 HH21 ARG A 8 122.855 -12.760 14.111 1.00 0.00 H new ATOM 0 HH22 ARG A 8 121.609 -14.007 14.231 1.00 0.00 H new ATOM 139 N ASP A 9 127.376 -14.051 6.016 1.00 0.00 N ATOM 140 CA ASP A 9 128.242 -14.772 5.044 1.00 0.00 C ATOM 141 C ASP A 9 129.328 -13.835 4.506 1.00 0.00 C ATOM 142 O ASP A 9 130.446 -14.242 4.261 1.00 0.00 O ATOM 143 CB ASP A 9 127.395 -15.307 3.888 1.00 0.00 C ATOM 144 CG ASP A 9 126.550 -16.489 4.374 1.00 0.00 C ATOM 145 OD1 ASP A 9 126.900 -17.066 5.390 1.00 0.00 O ATOM 146 OD2 ASP A 9 125.569 -16.798 3.720 1.00 0.00 O ATOM 0 H ASP A 9 126.439 -13.827 5.681 1.00 0.00 H new ATOM 0 HA ASP A 9 128.720 -15.609 5.553 1.00 0.00 H new ATOM 0 HB2 ASP A 9 126.748 -14.519 3.503 1.00 0.00 H new ATOM 0 HB3 ASP A 9 128.039 -15.621 3.067 1.00 0.00 H new ATOM 151 N PHE A 10 129.003 -12.586 4.303 1.00 0.00 N ATOM 152 CA PHE A 10 130.015 -11.633 3.760 1.00 0.00 C ATOM 153 C PHE A 10 131.132 -11.409 4.785 1.00 0.00 C ATOM 154 O PHE A 10 132.295 -11.349 4.443 1.00 0.00 O ATOM 155 CB PHE A 10 129.336 -10.294 3.458 1.00 0.00 C ATOM 156 CG PHE A 10 130.293 -9.390 2.717 1.00 0.00 C ATOM 157 CD1 PHE A 10 131.181 -8.572 3.427 1.00 0.00 C ATOM 158 CD2 PHE A 10 130.290 -9.368 1.316 1.00 0.00 C ATOM 159 CE1 PHE A 10 132.066 -7.733 2.737 1.00 0.00 C ATOM 160 CE2 PHE A 10 131.175 -8.529 0.625 1.00 0.00 C ATOM 161 CZ PHE A 10 132.062 -7.711 1.336 1.00 0.00 C ATOM 0 H PHE A 10 128.084 -12.185 4.489 1.00 0.00 H new ATOM 0 HA PHE A 10 130.443 -12.050 2.848 1.00 0.00 H new ATOM 0 HB2 PHE A 10 128.439 -10.457 2.860 1.00 0.00 H new ATOM 0 HB3 PHE A 10 129.018 -9.819 4.386 1.00 0.00 H new ATOM 0 HD1 PHE A 10 131.184 -8.588 4.507 1.00 0.00 H new ATOM 0 HD2 PHE A 10 129.605 -9.998 0.768 1.00 0.00 H new ATOM 0 HE1 PHE A 10 132.751 -7.103 3.285 1.00 0.00 H new ATOM 0 HE2 PHE A 10 131.173 -8.513 -0.455 1.00 0.00 H new ATOM 0 HZ PHE A 10 132.743 -7.063 0.804 1.00 0.00 H new ATOM 171 N VAL A 11 130.788 -11.277 6.037 1.00 0.00 N ATOM 172 CA VAL A 11 131.832 -11.047 7.078 1.00 0.00 C ATOM 173 C VAL A 11 132.438 -12.384 7.513 1.00 0.00 C ATOM 174 O VAL A 11 133.059 -12.480 8.553 1.00 0.00 O ATOM 175 CB VAL A 11 131.198 -10.357 8.286 1.00 0.00 C ATOM 176 CG1 VAL A 11 130.497 -9.074 7.831 1.00 0.00 C ATOM 177 CG2 VAL A 11 130.176 -11.295 8.925 1.00 0.00 C ATOM 0 H VAL A 11 129.830 -11.318 6.385 1.00 0.00 H new ATOM 0 HA VAL A 11 132.619 -10.416 6.665 1.00 0.00 H new ATOM 0 HB VAL A 11 131.972 -10.110 9.013 1.00 0.00 H new ATOM 0 HG11 VAL A 11 130.045 -8.582 8.692 1.00 0.00 H new ATOM 0 HG12 VAL A 11 131.225 -8.405 7.371 1.00 0.00 H new ATOM 0 HG13 VAL A 11 129.722 -9.321 7.105 1.00 0.00 H new ATOM 0 HG21 VAL A 11 129.722 -10.806 9.787 1.00 0.00 H new ATOM 0 HG22 VAL A 11 129.402 -11.540 8.197 1.00 0.00 H new ATOM 0 HG23 VAL A 11 130.673 -12.210 9.247 1.00 0.00 H new ATOM 187 N ALA A 12 132.246 -13.420 6.729 1.00 0.00 N ATOM 188 CA ALA A 12 132.794 -14.769 7.090 1.00 0.00 C ATOM 189 C ALA A 12 133.762 -15.255 6.006 1.00 0.00 C ATOM 190 O ALA A 12 134.406 -16.275 6.155 1.00 0.00 O ATOM 191 CB ALA A 12 131.636 -15.762 7.210 1.00 0.00 C ATOM 0 H ALA A 12 131.730 -13.389 5.850 1.00 0.00 H new ATOM 0 HA ALA A 12 133.328 -14.696 8.037 1.00 0.00 H new ATOM 0 HB1 ALA A 12 132.026 -16.746 7.472 1.00 0.00 H new ATOM 0 HB2 ALA A 12 130.947 -15.426 7.985 1.00 0.00 H new ATOM 0 HB3 ALA A 12 131.109 -15.823 6.258 1.00 0.00 H new ATOM 197 N GLU A 13 133.880 -14.539 4.917 1.00 0.00 N ATOM 198 CA GLU A 13 134.818 -14.977 3.835 1.00 0.00 C ATOM 199 C GLU A 13 135.303 -13.749 3.042 1.00 0.00 C ATOM 200 O GLU A 13 134.591 -12.771 2.932 1.00 0.00 O ATOM 201 CB GLU A 13 134.084 -15.940 2.898 1.00 0.00 C ATOM 202 CG GLU A 13 132.964 -15.196 2.170 1.00 0.00 C ATOM 203 CD GLU A 13 132.033 -16.207 1.497 1.00 0.00 C ATOM 204 OE1 GLU A 13 131.867 -17.286 2.043 1.00 0.00 O ATOM 205 OE2 GLU A 13 131.503 -15.887 0.446 1.00 0.00 O ATOM 0 H GLU A 13 133.372 -13.675 4.729 1.00 0.00 H new ATOM 0 HA GLU A 13 135.679 -15.479 4.275 1.00 0.00 H new ATOM 0 HB2 GLU A 13 134.782 -16.363 2.176 1.00 0.00 H new ATOM 0 HB3 GLU A 13 133.671 -16.773 3.467 1.00 0.00 H new ATOM 0 HG2 GLU A 13 132.403 -14.582 2.875 1.00 0.00 H new ATOM 0 HG3 GLU A 13 133.386 -14.522 1.425 1.00 0.00 H new ATOM 212 N PRO A 14 136.492 -13.791 2.473 1.00 0.00 N ATOM 213 CA PRO A 14 137.023 -12.651 1.672 1.00 0.00 C ATOM 214 C PRO A 14 135.957 -12.062 0.739 1.00 0.00 C ATOM 215 O PRO A 14 134.984 -12.711 0.409 1.00 0.00 O ATOM 216 CB PRO A 14 138.164 -13.277 0.857 1.00 0.00 C ATOM 217 CG PRO A 14 138.653 -14.428 1.684 1.00 0.00 C ATOM 218 CD PRO A 14 137.461 -14.909 2.531 1.00 0.00 C ATOM 0 HA PRO A 14 137.346 -11.823 2.304 1.00 0.00 H new ATOM 0 HB2 PRO A 14 137.812 -13.614 -0.118 1.00 0.00 H new ATOM 0 HB3 PRO A 14 138.961 -12.555 0.676 1.00 0.00 H new ATOM 0 HG2 PRO A 14 139.023 -15.231 1.047 1.00 0.00 H new ATOM 0 HG3 PRO A 14 139.481 -14.120 2.322 1.00 0.00 H new ATOM 0 HD2 PRO A 14 137.033 -15.827 2.129 1.00 0.00 H new ATOM 0 HD3 PRO A 14 137.762 -15.121 3.557 1.00 0.00 H new ATOM 226 N MET A 15 136.133 -10.841 0.304 1.00 0.00 N ATOM 227 CA MET A 15 135.128 -10.221 -0.611 1.00 0.00 C ATOM 228 C MET A 15 135.558 -10.442 -2.063 1.00 0.00 C ATOM 229 O MET A 15 134.745 -10.495 -2.964 1.00 0.00 O ATOM 230 CB MET A 15 135.033 -8.721 -0.326 1.00 0.00 C ATOM 231 CG MET A 15 136.436 -8.125 -0.205 1.00 0.00 C ATOM 232 SD MET A 15 136.337 -6.318 -0.310 1.00 0.00 S ATOM 233 CE MET A 15 135.957 -5.992 1.432 1.00 0.00 C ATOM 0 H MET A 15 136.928 -10.247 0.542 1.00 0.00 H new ATOM 0 HA MET A 15 134.154 -10.681 -0.447 1.00 0.00 H new ATOM 0 HB2 MET A 15 134.485 -8.224 -1.126 1.00 0.00 H new ATOM 0 HB3 MET A 15 134.476 -8.551 0.595 1.00 0.00 H new ATOM 0 HG2 MET A 15 136.888 -8.421 0.742 1.00 0.00 H new ATOM 0 HG3 MET A 15 137.076 -8.511 -0.998 1.00 0.00 H new ATOM 0 HE1 MET A 15 135.325 -5.107 1.507 1.00 0.00 H new ATOM 0 HE2 MET A 15 135.433 -6.849 1.857 1.00 0.00 H new ATOM 0 HE3 MET A 15 136.883 -5.824 1.981 1.00 0.00 H new ATOM 243 N GLY A 16 136.836 -10.581 -2.291 1.00 0.00 N ATOM 244 CA GLY A 16 137.331 -10.809 -3.678 1.00 0.00 C ATOM 245 C GLY A 16 136.829 -9.701 -4.604 1.00 0.00 C ATOM 246 O GLY A 16 136.882 -8.531 -4.276 1.00 0.00 O ATOM 0 H GLY A 16 137.560 -10.546 -1.574 1.00 0.00 H new ATOM 0 HA2 GLY A 16 138.421 -10.833 -3.684 1.00 0.00 H new ATOM 0 HA3 GLY A 16 136.989 -11.779 -4.040 1.00 0.00 H new ATOM 250 N GLU A 17 136.369 -10.063 -5.776 1.00 0.00 N ATOM 251 CA GLU A 17 135.890 -9.046 -6.766 1.00 0.00 C ATOM 252 C GLU A 17 134.363 -9.076 -6.874 1.00 0.00 C ATOM 253 O GLU A 17 133.807 -8.782 -7.913 1.00 0.00 O ATOM 254 CB GLU A 17 136.495 -9.366 -8.132 1.00 0.00 C ATOM 255 CG GLU A 17 137.997 -9.075 -8.101 1.00 0.00 C ATOM 256 CD GLU A 17 138.618 -9.452 -9.446 1.00 0.00 C ATOM 257 OE1 GLU A 17 137.902 -9.983 -10.279 1.00 0.00 O ATOM 258 OE2 GLU A 17 139.800 -9.206 -9.621 1.00 0.00 O ATOM 0 H GLU A 17 136.304 -11.030 -6.093 1.00 0.00 H new ATOM 0 HA GLU A 17 136.198 -8.054 -6.434 1.00 0.00 H new ATOM 0 HB2 GLU A 17 136.321 -10.412 -8.384 1.00 0.00 H new ATOM 0 HB3 GLU A 17 136.013 -8.768 -8.905 1.00 0.00 H new ATOM 0 HG2 GLU A 17 138.169 -8.019 -7.892 1.00 0.00 H new ATOM 0 HG3 GLU A 17 138.471 -9.640 -7.298 1.00 0.00 H new ATOM 265 N LYS A 18 133.677 -9.426 -5.821 1.00 0.00 N ATOM 266 CA LYS A 18 132.189 -9.466 -5.893 1.00 0.00 C ATOM 267 C LYS A 18 131.692 -8.053 -6.244 1.00 0.00 C ATOM 268 O LYS A 18 132.318 -7.074 -5.893 1.00 0.00 O ATOM 269 CB LYS A 18 131.632 -9.889 -4.525 1.00 0.00 C ATOM 270 CG LYS A 18 132.163 -11.286 -4.146 1.00 0.00 C ATOM 271 CD LYS A 18 131.266 -12.377 -4.746 1.00 0.00 C ATOM 272 CE LYS A 18 131.912 -13.746 -4.519 1.00 0.00 C ATOM 273 NZ LYS A 18 132.589 -13.762 -3.191 1.00 0.00 N ATOM 0 H LYS A 18 134.079 -9.684 -4.920 1.00 0.00 H new ATOM 0 HA LYS A 18 131.856 -10.178 -6.648 1.00 0.00 H new ATOM 0 HB2 LYS A 18 131.922 -9.163 -3.765 1.00 0.00 H new ATOM 0 HB3 LYS A 18 130.542 -9.901 -4.555 1.00 0.00 H new ATOM 0 HG2 LYS A 18 133.184 -11.405 -4.508 1.00 0.00 H new ATOM 0 HG3 LYS A 18 132.196 -11.388 -3.061 1.00 0.00 H new ATOM 0 HD2 LYS A 18 130.279 -12.347 -4.284 1.00 0.00 H new ATOM 0 HD3 LYS A 18 131.124 -12.201 -5.812 1.00 0.00 H new ATOM 0 HE2 LYS A 18 131.155 -14.529 -4.563 1.00 0.00 H new ATOM 0 HE3 LYS A 18 132.633 -13.955 -5.309 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 132.789 -14.745 -2.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 133.481 -13.230 -3.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 131.970 -13.322 -2.480 1.00 0.00 H new ATOM 287 N PRO A 19 130.591 -7.937 -6.952 1.00 0.00 N ATOM 288 CA PRO A 19 130.047 -6.607 -7.368 1.00 0.00 C ATOM 289 C PRO A 19 129.598 -5.753 -6.176 1.00 0.00 C ATOM 290 O PRO A 19 129.270 -6.254 -5.119 1.00 0.00 O ATOM 291 CB PRO A 19 128.863 -6.956 -8.290 1.00 0.00 C ATOM 292 CG PRO A 19 128.466 -8.347 -7.908 1.00 0.00 C ATOM 293 CD PRO A 19 129.743 -9.044 -7.435 1.00 0.00 C ATOM 0 HA PRO A 19 130.805 -6.000 -7.864 1.00 0.00 H new ATOM 0 HB2 PRO A 19 128.037 -6.259 -8.151 1.00 0.00 H new ATOM 0 HB3 PRO A 19 129.152 -6.903 -9.340 1.00 0.00 H new ATOM 0 HG2 PRO A 19 127.715 -8.334 -7.118 1.00 0.00 H new ATOM 0 HG3 PRO A 19 128.027 -8.873 -8.756 1.00 0.00 H new ATOM 0 HD2 PRO A 19 129.536 -9.764 -6.643 1.00 0.00 H new ATOM 0 HD3 PRO A 19 130.224 -9.591 -8.246 1.00 0.00 H new ATOM 301 N VAL A 20 129.603 -4.459 -6.350 1.00 0.00 N ATOM 302 CA VAL A 20 129.206 -3.541 -5.246 1.00 0.00 C ATOM 303 C VAL A 20 127.831 -3.922 -4.690 1.00 0.00 C ATOM 304 O VAL A 20 127.626 -3.971 -3.493 1.00 0.00 O ATOM 305 CB VAL A 20 129.165 -2.107 -5.780 1.00 0.00 C ATOM 306 CG1 VAL A 20 128.042 -1.968 -6.814 1.00 0.00 C ATOM 307 CG2 VAL A 20 128.916 -1.141 -4.619 1.00 0.00 C ATOM 0 H VAL A 20 129.868 -3.995 -7.219 1.00 0.00 H new ATOM 0 HA VAL A 20 129.936 -3.621 -4.440 1.00 0.00 H new ATOM 0 HB VAL A 20 130.117 -1.871 -6.255 1.00 0.00 H new ATOM 0 HG11 VAL A 20 128.018 -0.945 -7.190 1.00 0.00 H new ATOM 0 HG12 VAL A 20 128.222 -2.655 -7.641 1.00 0.00 H new ATOM 0 HG13 VAL A 20 127.086 -2.205 -6.347 1.00 0.00 H new ATOM 0 HG21 VAL A 20 128.886 -0.119 -4.996 1.00 0.00 H new ATOM 0 HG22 VAL A 20 127.965 -1.380 -4.144 1.00 0.00 H new ATOM 0 HG23 VAL A 20 129.720 -1.235 -3.889 1.00 0.00 H new ATOM 317 N GLY A 21 126.880 -4.176 -5.553 1.00 0.00 N ATOM 318 CA GLY A 21 125.511 -4.535 -5.083 1.00 0.00 C ATOM 319 C GLY A 21 125.566 -5.789 -4.210 1.00 0.00 C ATOM 320 O GLY A 21 124.567 -6.219 -3.671 1.00 0.00 O ATOM 0 H GLY A 21 126.995 -4.150 -6.566 1.00 0.00 H new ATOM 0 HA2 GLY A 21 125.084 -3.707 -4.517 1.00 0.00 H new ATOM 0 HA3 GLY A 21 124.858 -4.707 -5.939 1.00 0.00 H new ATOM 324 N SER A 22 126.720 -6.381 -4.056 1.00 0.00 N ATOM 325 CA SER A 22 126.818 -7.599 -3.205 1.00 0.00 C ATOM 326 C SER A 22 126.919 -7.171 -1.743 1.00 0.00 C ATOM 327 O SER A 22 126.628 -7.930 -0.840 1.00 0.00 O ATOM 328 CB SER A 22 128.065 -8.396 -3.593 1.00 0.00 C ATOM 329 OG SER A 22 128.076 -9.626 -2.881 1.00 0.00 O ATOM 0 H SER A 22 127.595 -6.074 -4.481 1.00 0.00 H new ATOM 0 HA SER A 22 125.936 -8.223 -3.348 1.00 0.00 H new ATOM 0 HB2 SER A 22 128.071 -8.584 -4.667 1.00 0.00 H new ATOM 0 HB3 SER A 22 128.963 -7.822 -3.365 1.00 0.00 H new ATOM 0 HG SER A 22 128.873 -10.140 -3.128 1.00 0.00 H new ATOM 335 N LEU A 23 127.324 -5.955 -1.506 1.00 0.00 N ATOM 336 CA LEU A 23 127.438 -5.470 -0.105 1.00 0.00 C ATOM 337 C LEU A 23 126.048 -5.420 0.525 1.00 0.00 C ATOM 338 O LEU A 23 125.080 -5.032 -0.099 1.00 0.00 O ATOM 339 CB LEU A 23 128.054 -4.070 -0.095 1.00 0.00 C ATOM 340 CG LEU A 23 129.489 -4.129 -0.636 1.00 0.00 C ATOM 341 CD1 LEU A 23 130.006 -2.700 -0.839 1.00 0.00 C ATOM 342 CD2 LEU A 23 130.407 -4.881 0.350 1.00 0.00 C ATOM 0 H LEU A 23 127.581 -5.277 -2.223 1.00 0.00 H new ATOM 0 HA LEU A 23 128.074 -6.147 0.465 1.00 0.00 H new ATOM 0 HB2 LEU A 23 127.454 -3.394 -0.704 1.00 0.00 H new ATOM 0 HB3 LEU A 23 128.054 -3.670 0.919 1.00 0.00 H new ATOM 0 HG LEU A 23 129.492 -4.663 -1.586 1.00 0.00 H new ATOM 0 HD11 LEU A 23 131.025 -2.733 -1.223 1.00 0.00 H new ATOM 0 HD12 LEU A 23 129.366 -2.179 -1.552 1.00 0.00 H new ATOM 0 HD13 LEU A 23 129.994 -2.170 0.113 1.00 0.00 H new ATOM 0 HD21 LEU A 23 131.421 -4.914 -0.049 1.00 0.00 H new ATOM 0 HD22 LEU A 23 130.411 -4.364 1.310 1.00 0.00 H new ATOM 0 HD23 LEU A 23 130.038 -5.898 0.487 1.00 0.00 H new ATOM 354 N ALA A 24 125.949 -5.805 1.758 1.00 0.00 N ATOM 355 CA ALA A 24 124.624 -5.776 2.431 1.00 0.00 C ATOM 356 C ALA A 24 124.132 -4.327 2.522 1.00 0.00 C ATOM 357 O ALA A 24 124.868 -3.426 2.874 1.00 0.00 O ATOM 358 CB ALA A 24 124.745 -6.369 3.835 1.00 0.00 C ATOM 0 H ALA A 24 126.724 -6.138 2.331 1.00 0.00 H new ATOM 0 HA ALA A 24 123.911 -6.366 1.855 1.00 0.00 H new ATOM 0 HB1 ALA A 24 123.772 -6.346 4.325 1.00 0.00 H new ATOM 0 HB2 ALA A 24 125.092 -7.400 3.766 1.00 0.00 H new ATOM 0 HB3 ALA A 24 125.458 -5.785 4.417 1.00 0.00 H new ATOM 364 N GLY A 25 122.885 -4.108 2.201 1.00 0.00 N ATOM 365 CA GLY A 25 122.313 -2.725 2.256 1.00 0.00 C ATOM 366 C GLY A 25 122.277 -2.116 0.850 1.00 0.00 C ATOM 367 O GLY A 25 121.539 -1.187 0.589 1.00 0.00 O ATOM 0 H GLY A 25 122.231 -4.831 1.901 1.00 0.00 H new ATOM 0 HA2 GLY A 25 121.307 -2.755 2.674 1.00 0.00 H new ATOM 0 HA3 GLY A 25 122.914 -2.100 2.917 1.00 0.00 H new ATOM 371 N ILE A 26 123.058 -2.635 -0.064 1.00 0.00 N ATOM 372 CA ILE A 26 123.058 -2.086 -1.460 1.00 0.00 C ATOM 373 C ILE A 26 122.165 -2.976 -2.324 1.00 0.00 C ATOM 374 O ILE A 26 122.432 -4.150 -2.490 1.00 0.00 O ATOM 375 CB ILE A 26 124.486 -2.104 -2.011 1.00 0.00 C ATOM 376 CG1 ILE A 26 125.431 -1.409 -1.020 1.00 0.00 C ATOM 377 CG2 ILE A 26 124.529 -1.380 -3.359 1.00 0.00 C ATOM 378 CD1 ILE A 26 124.913 -0.004 -0.678 1.00 0.00 C ATOM 0 H ILE A 26 123.696 -3.415 0.093 1.00 0.00 H new ATOM 0 HA ILE A 26 122.686 -1.061 -1.466 1.00 0.00 H new ATOM 0 HB ILE A 26 124.805 -3.137 -2.148 1.00 0.00 H new ATOM 0 HG12 ILE A 26 125.515 -2.004 -0.110 1.00 0.00 H new ATOM 0 HG13 ILE A 26 126.431 -1.340 -1.449 1.00 0.00 H new ATOM 0 HG21 ILE A 26 125.547 -1.395 -3.748 1.00 0.00 H new ATOM 0 HG22 ILE A 26 123.864 -1.881 -4.063 1.00 0.00 H new ATOM 0 HG23 ILE A 26 124.206 -0.347 -3.228 1.00 0.00 H new ATOM 0 HD11 ILE A 26 125.595 0.474 0.025 1.00 0.00 H new ATOM 0 HD12 ILE A 26 124.853 0.593 -1.588 1.00 0.00 H new ATOM 0 HD13 ILE A 26 123.923 -0.081 -0.228 1.00 0.00 H new ATOM 390 N GLY A 27 121.100 -2.448 -2.878 1.00 0.00 N ATOM 391 CA GLY A 27 120.199 -3.288 -3.725 1.00 0.00 C ATOM 392 C GLY A 27 120.608 -3.180 -5.199 1.00 0.00 C ATOM 393 O GLY A 27 121.504 -2.440 -5.556 1.00 0.00 O ATOM 0 H GLY A 27 120.817 -1.473 -2.780 1.00 0.00 H new ATOM 0 HA2 GLY A 27 120.248 -4.328 -3.401 1.00 0.00 H new ATOM 0 HA3 GLY A 27 119.165 -2.964 -3.602 1.00 0.00 H new ATOM 397 N GLU A 28 119.964 -3.933 -6.050 1.00 0.00 N ATOM 398 CA GLU A 28 120.318 -3.899 -7.501 1.00 0.00 C ATOM 399 C GLU A 28 120.175 -2.478 -8.061 1.00 0.00 C ATOM 400 O GLU A 28 120.988 -2.035 -8.848 1.00 0.00 O ATOM 401 CB GLU A 28 119.390 -4.842 -8.268 1.00 0.00 C ATOM 402 CG GLU A 28 119.732 -6.294 -7.928 1.00 0.00 C ATOM 403 CD GLU A 28 121.054 -6.676 -8.598 1.00 0.00 C ATOM 404 OE1 GLU A 28 121.013 -7.106 -9.740 1.00 0.00 O ATOM 405 OE2 GLU A 28 122.084 -6.521 -7.964 1.00 0.00 O ATOM 0 H GLU A 28 119.207 -4.571 -5.804 1.00 0.00 H new ATOM 0 HA GLU A 28 121.354 -4.216 -7.617 1.00 0.00 H new ATOM 0 HB2 GLU A 28 118.351 -4.634 -8.011 1.00 0.00 H new ATOM 0 HB3 GLU A 28 119.493 -4.676 -9.340 1.00 0.00 H new ATOM 0 HG2 GLU A 28 119.810 -6.417 -6.848 1.00 0.00 H new ATOM 0 HG3 GLU A 28 118.935 -6.956 -8.267 1.00 0.00 H new ATOM 412 N VAL A 29 119.160 -1.757 -7.672 1.00 0.00 N ATOM 413 CA VAL A 29 118.995 -0.369 -8.202 1.00 0.00 C ATOM 414 C VAL A 29 120.121 0.519 -7.673 1.00 0.00 C ATOM 415 O VAL A 29 120.693 1.311 -8.395 1.00 0.00 O ATOM 416 CB VAL A 29 117.635 0.188 -7.762 1.00 0.00 C ATOM 417 CG1 VAL A 29 117.555 1.684 -8.083 1.00 0.00 C ATOM 418 CG2 VAL A 29 116.524 -0.544 -8.518 1.00 0.00 C ATOM 0 H VAL A 29 118.442 -2.063 -7.016 1.00 0.00 H new ATOM 0 HA VAL A 29 119.039 -0.386 -9.291 1.00 0.00 H new ATOM 0 HB VAL A 29 117.518 0.042 -6.688 1.00 0.00 H new ATOM 0 HG11 VAL A 29 116.587 2.072 -7.768 1.00 0.00 H new ATOM 0 HG12 VAL A 29 118.348 2.213 -7.554 1.00 0.00 H new ATOM 0 HG13 VAL A 29 117.674 1.833 -9.156 1.00 0.00 H new ATOM 0 HG21 VAL A 29 115.555 -0.152 -8.209 1.00 0.00 H new ATOM 0 HG22 VAL A 29 116.652 -0.392 -9.590 1.00 0.00 H new ATOM 0 HG23 VAL A 29 116.573 -1.610 -8.294 1.00 0.00 H new ATOM 428 N LEU A 30 120.434 0.402 -6.415 1.00 0.00 N ATOM 429 CA LEU A 30 121.512 1.246 -5.830 1.00 0.00 C ATOM 430 C LEU A 30 122.856 0.866 -6.453 1.00 0.00 C ATOM 431 O LEU A 30 123.708 1.703 -6.671 1.00 0.00 O ATOM 432 CB LEU A 30 121.563 1.038 -4.313 1.00 0.00 C ATOM 433 CG LEU A 30 120.224 1.450 -3.680 1.00 0.00 C ATOM 434 CD1 LEU A 30 120.283 1.198 -2.170 1.00 0.00 C ATOM 435 CD2 LEU A 30 119.945 2.945 -3.940 1.00 0.00 C ATOM 0 H LEU A 30 119.988 -0.244 -5.763 1.00 0.00 H new ATOM 0 HA LEU A 30 121.305 2.295 -6.040 1.00 0.00 H new ATOM 0 HB2 LEU A 30 121.775 -0.007 -4.088 1.00 0.00 H new ATOM 0 HB3 LEU A 30 122.374 1.627 -3.884 1.00 0.00 H new ATOM 0 HG LEU A 30 119.423 0.860 -4.126 1.00 0.00 H new ATOM 0 HD11 LEU A 30 119.336 1.488 -1.715 1.00 0.00 H new ATOM 0 HD12 LEU A 30 120.465 0.139 -1.985 1.00 0.00 H new ATOM 0 HD13 LEU A 30 121.090 1.787 -1.734 1.00 0.00 H new ATOM 0 HD21 LEU A 30 118.994 3.222 -3.486 1.00 0.00 H new ATOM 0 HD22 LEU A 30 120.744 3.545 -3.504 1.00 0.00 H new ATOM 0 HD23 LEU A 30 119.900 3.125 -5.014 1.00 0.00 H new ATOM 447 N GLY A 31 123.051 -0.388 -6.737 1.00 0.00 N ATOM 448 CA GLY A 31 124.340 -0.817 -7.346 1.00 0.00 C ATOM 449 C GLY A 31 124.545 -0.099 -8.685 1.00 0.00 C ATOM 450 O GLY A 31 125.641 0.299 -9.022 1.00 0.00 O ATOM 0 H GLY A 31 122.376 -1.135 -6.575 1.00 0.00 H new ATOM 0 HA2 GLY A 31 125.165 -0.590 -6.671 1.00 0.00 H new ATOM 0 HA3 GLY A 31 124.340 -1.896 -7.498 1.00 0.00 H new ATOM 454 N LYS A 32 123.501 0.052 -9.458 1.00 0.00 N ATOM 455 CA LYS A 32 123.640 0.727 -10.783 1.00 0.00 C ATOM 456 C LYS A 32 124.022 2.201 -10.605 1.00 0.00 C ATOM 457 O LYS A 32 124.799 2.739 -11.370 1.00 0.00 O ATOM 458 CB LYS A 32 122.318 0.643 -11.547 1.00 0.00 C ATOM 459 CG LYS A 32 122.066 -0.805 -11.968 1.00 0.00 C ATOM 460 CD LYS A 32 120.744 -0.892 -12.733 1.00 0.00 C ATOM 461 CE LYS A 32 120.494 -2.341 -13.153 1.00 0.00 C ATOM 462 NZ LYS A 32 119.362 -2.391 -14.120 1.00 0.00 N ATOM 0 H LYS A 32 122.558 -0.263 -9.229 1.00 0.00 H new ATOM 0 HA LYS A 32 124.427 0.222 -11.343 1.00 0.00 H new ATOM 0 HB2 LYS A 32 121.500 0.999 -10.921 1.00 0.00 H new ATOM 0 HB3 LYS A 32 122.351 1.288 -12.425 1.00 0.00 H new ATOM 0 HG2 LYS A 32 122.885 -1.160 -12.594 1.00 0.00 H new ATOM 0 HG3 LYS A 32 122.033 -1.450 -11.090 1.00 0.00 H new ATOM 0 HD2 LYS A 32 119.925 -0.537 -12.107 1.00 0.00 H new ATOM 0 HD3 LYS A 32 120.777 -0.248 -13.612 1.00 0.00 H new ATOM 0 HE2 LYS A 32 121.392 -2.759 -13.607 1.00 0.00 H new ATOM 0 HE3 LYS A 32 120.266 -2.950 -12.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 119.192 -3.377 -14.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 118.505 -2.008 -13.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 119.597 -1.823 -14.959 1.00 0.00 H new ATOM 476 N LYS A 33 123.476 2.872 -9.627 1.00 0.00 N ATOM 477 CA LYS A 33 123.810 4.316 -9.450 1.00 0.00 C ATOM 478 C LYS A 33 125.277 4.462 -9.040 1.00 0.00 C ATOM 479 O LYS A 33 126.014 5.242 -9.610 1.00 0.00 O ATOM 480 CB LYS A 33 122.916 4.904 -8.357 1.00 0.00 C ATOM 481 CG LYS A 33 121.476 4.979 -8.867 1.00 0.00 C ATOM 482 CD LYS A 33 120.580 5.567 -7.776 1.00 0.00 C ATOM 483 CE LYS A 33 119.140 5.641 -8.286 1.00 0.00 C ATOM 484 NZ LYS A 33 119.031 6.717 -9.310 1.00 0.00 N ATOM 0 H LYS A 33 122.819 2.488 -8.948 1.00 0.00 H new ATOM 0 HA LYS A 33 123.647 4.846 -10.389 1.00 0.00 H new ATOM 0 HB2 LYS A 33 122.965 4.286 -7.460 1.00 0.00 H new ATOM 0 HB3 LYS A 33 123.268 5.898 -8.079 1.00 0.00 H new ATOM 0 HG2 LYS A 33 121.428 5.596 -9.764 1.00 0.00 H new ATOM 0 HG3 LYS A 33 121.125 3.985 -9.145 1.00 0.00 H new ATOM 0 HD2 LYS A 33 120.628 4.950 -6.879 1.00 0.00 H new ATOM 0 HD3 LYS A 33 120.931 6.561 -7.499 1.00 0.00 H new ATOM 0 HE2 LYS A 33 118.846 4.684 -8.716 1.00 0.00 H new ATOM 0 HE3 LYS A 33 118.460 5.841 -7.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 118.029 6.942 -9.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 119.527 7.567 -8.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 119.461 6.394 -10.200 1.00 0.00 H new ATOM 498 N LEU A 34 125.715 3.705 -8.075 1.00 0.00 N ATOM 499 CA LEU A 34 127.141 3.789 -7.653 1.00 0.00 C ATOM 500 C LEU A 34 128.020 3.412 -8.853 1.00 0.00 C ATOM 501 O LEU A 34 129.066 3.985 -9.084 1.00 0.00 O ATOM 502 CB LEU A 34 127.388 2.831 -6.479 1.00 0.00 C ATOM 503 CG LEU A 34 126.672 3.344 -5.214 1.00 0.00 C ATOM 504 CD1 LEU A 34 126.536 2.198 -4.209 1.00 0.00 C ATOM 505 CD2 LEU A 34 127.480 4.479 -4.558 1.00 0.00 C ATOM 0 H LEU A 34 125.148 3.032 -7.560 1.00 0.00 H new ATOM 0 HA LEU A 34 127.385 4.799 -7.325 1.00 0.00 H new ATOM 0 HB2 LEU A 34 127.027 1.834 -6.731 1.00 0.00 H new ATOM 0 HB3 LEU A 34 128.458 2.744 -6.290 1.00 0.00 H new ATOM 0 HG LEU A 34 125.690 3.720 -5.500 1.00 0.00 H new ATOM 0 HD11 LEU A 34 126.030 2.558 -3.313 1.00 0.00 H new ATOM 0 HD12 LEU A 34 125.955 1.390 -4.654 1.00 0.00 H new ATOM 0 HD13 LEU A 34 127.526 1.828 -3.943 1.00 0.00 H new ATOM 0 HD21 LEU A 34 126.959 4.828 -3.667 1.00 0.00 H new ATOM 0 HD22 LEU A 34 128.467 4.109 -4.280 1.00 0.00 H new ATOM 0 HD23 LEU A 34 127.587 5.304 -5.263 1.00 0.00 H new ATOM 517 N GLU A 35 127.584 2.448 -9.610 1.00 0.00 N ATOM 518 CA GLU A 35 128.380 2.022 -10.800 1.00 0.00 C ATOM 519 C GLU A 35 128.542 3.204 -11.760 1.00 0.00 C ATOM 520 O GLU A 35 129.602 3.431 -12.308 1.00 0.00 O ATOM 521 CB GLU A 35 127.662 0.867 -11.508 1.00 0.00 C ATOM 522 CG GLU A 35 128.465 0.424 -12.736 1.00 0.00 C ATOM 523 CD GLU A 35 127.758 -0.755 -13.407 1.00 0.00 C ATOM 524 OE1 GLU A 35 126.828 -1.277 -12.815 1.00 0.00 O ATOM 525 OE2 GLU A 35 128.154 -1.111 -14.505 1.00 0.00 O ATOM 0 H GLU A 35 126.715 1.936 -9.461 1.00 0.00 H new ATOM 0 HA GLU A 35 129.366 1.687 -10.478 1.00 0.00 H new ATOM 0 HB2 GLU A 35 127.540 0.029 -10.822 1.00 0.00 H new ATOM 0 HB3 GLU A 35 126.663 1.180 -11.810 1.00 0.00 H new ATOM 0 HG2 GLU A 35 128.562 1.252 -13.439 1.00 0.00 H new ATOM 0 HG3 GLU A 35 129.474 0.137 -12.440 1.00 0.00 H new ATOM 532 N GLU A 36 127.502 3.960 -11.959 1.00 0.00 N ATOM 533 CA GLU A 36 127.589 5.135 -12.872 1.00 0.00 C ATOM 534 C GLU A 36 128.513 6.180 -12.243 1.00 0.00 C ATOM 535 O GLU A 36 129.006 7.074 -12.900 1.00 0.00 O ATOM 536 CB GLU A 36 126.191 5.722 -13.079 1.00 0.00 C ATOM 537 CG GLU A 36 126.262 6.903 -14.049 1.00 0.00 C ATOM 538 CD GLU A 36 124.848 7.425 -14.315 1.00 0.00 C ATOM 539 OE1 GLU A 36 123.908 6.763 -13.908 1.00 0.00 O ATOM 540 OE2 GLU A 36 124.731 8.477 -14.922 1.00 0.00 O ATOM 0 H GLU A 36 126.589 3.816 -11.527 1.00 0.00 H new ATOM 0 HA GLU A 36 127.990 4.832 -13.839 1.00 0.00 H new ATOM 0 HB2 GLU A 36 125.520 4.958 -13.471 1.00 0.00 H new ATOM 0 HB3 GLU A 36 125.779 6.048 -12.124 1.00 0.00 H new ATOM 0 HG2 GLU A 36 126.882 7.696 -13.630 1.00 0.00 H new ATOM 0 HG3 GLU A 36 126.729 6.593 -14.984 1.00 0.00 H new ATOM 547 N ARG A 37 128.727 6.075 -10.962 1.00 0.00 N ATOM 548 CA ARG A 37 129.593 7.067 -10.258 1.00 0.00 C ATOM 549 C ARG A 37 131.056 6.596 -10.273 1.00 0.00 C ATOM 550 O ARG A 37 131.935 7.281 -9.786 1.00 0.00 O ATOM 551 CB ARG A 37 129.104 7.210 -8.811 1.00 0.00 C ATOM 552 CG ARG A 37 127.746 7.927 -8.767 1.00 0.00 C ATOM 553 CD ARG A 37 127.923 9.444 -8.900 1.00 0.00 C ATOM 554 NE ARG A 37 126.614 10.107 -8.643 1.00 0.00 N ATOM 555 CZ ARG A 37 126.565 11.387 -8.399 1.00 0.00 C ATOM 556 NH1 ARG A 37 127.664 12.089 -8.374 1.00 0.00 N ATOM 557 NH2 ARG A 37 125.415 11.964 -8.182 1.00 0.00 N ATOM 0 H ARG A 37 128.339 5.343 -10.368 1.00 0.00 H new ATOM 0 HA ARG A 37 129.535 8.030 -10.765 1.00 0.00 H new ATOM 0 HB2 ARG A 37 129.016 6.225 -8.352 1.00 0.00 H new ATOM 0 HB3 ARG A 37 129.836 7.769 -8.228 1.00 0.00 H new ATOM 0 HG2 ARG A 37 127.110 7.559 -9.572 1.00 0.00 H new ATOM 0 HG3 ARG A 37 127.239 7.697 -7.830 1.00 0.00 H new ATOM 0 HD2 ARG A 37 128.671 9.800 -8.192 1.00 0.00 H new ATOM 0 HD3 ARG A 37 128.283 9.695 -9.897 1.00 0.00 H new ATOM 0 HE ARG A 37 125.754 9.559 -8.658 1.00 0.00 H new ATOM 0 HH11 ARG A 37 128.562 11.637 -8.545 1.00 0.00 H new ATOM 0 HH12 ARG A 37 127.625 13.090 -8.183 1.00 0.00 H new ATOM 0 HH21 ARG A 37 124.556 11.414 -8.203 1.00 0.00 H new ATOM 0 HH22 ARG A 37 125.375 12.965 -7.991 1.00 0.00 H new ATOM 571 N GLY A 38 131.335 5.456 -10.866 1.00 0.00 N ATOM 572 CA GLY A 38 132.757 4.971 -10.956 1.00 0.00 C ATOM 573 C GLY A 38 133.043 3.845 -9.957 1.00 0.00 C ATOM 574 O GLY A 38 134.162 3.384 -9.853 1.00 0.00 O ATOM 0 H GLY A 38 130.642 4.840 -11.291 1.00 0.00 H new ATOM 0 HA2 GLY A 38 132.956 4.618 -11.968 1.00 0.00 H new ATOM 0 HA3 GLY A 38 133.436 5.803 -10.769 1.00 0.00 H new ATOM 578 N PHE A 39 132.058 3.387 -9.229 1.00 0.00 N ATOM 579 CA PHE A 39 132.296 2.275 -8.248 1.00 0.00 C ATOM 580 C PHE A 39 131.738 0.972 -8.829 1.00 0.00 C ATOM 581 O PHE A 39 130.687 0.506 -8.435 1.00 0.00 O ATOM 582 CB PHE A 39 131.565 2.596 -6.948 1.00 0.00 C ATOM 583 CG PHE A 39 132.107 3.877 -6.364 1.00 0.00 C ATOM 584 CD1 PHE A 39 131.528 5.094 -6.721 1.00 0.00 C ATOM 585 CD2 PHE A 39 133.180 3.847 -5.470 1.00 0.00 C ATOM 586 CE1 PHE A 39 132.022 6.291 -6.189 1.00 0.00 C ATOM 587 CE2 PHE A 39 133.677 5.042 -4.935 1.00 0.00 C ATOM 588 CZ PHE A 39 133.099 6.265 -5.296 1.00 0.00 C ATOM 0 H PHE A 39 131.099 3.731 -9.268 1.00 0.00 H new ATOM 0 HA PHE A 39 133.364 2.168 -8.056 1.00 0.00 H new ATOM 0 HB2 PHE A 39 130.496 2.694 -7.135 1.00 0.00 H new ATOM 0 HB3 PHE A 39 131.691 1.779 -6.237 1.00 0.00 H new ATOM 0 HD1 PHE A 39 130.696 5.113 -7.410 1.00 0.00 H new ATOM 0 HD2 PHE A 39 133.626 2.903 -5.192 1.00 0.00 H new ATOM 0 HE1 PHE A 39 131.573 7.233 -6.467 1.00 0.00 H new ATOM 0 HE2 PHE A 39 134.506 5.020 -4.244 1.00 0.00 H new ATOM 0 HZ PHE A 39 133.484 7.187 -4.886 1.00 0.00 H new ATOM 598 N ASP A 40 132.425 0.389 -9.777 1.00 0.00 N ATOM 599 CA ASP A 40 131.914 -0.874 -10.393 1.00 0.00 C ATOM 600 C ASP A 40 132.284 -2.085 -9.530 1.00 0.00 C ATOM 601 O ASP A 40 131.785 -3.173 -9.745 1.00 0.00 O ATOM 602 CB ASP A 40 132.510 -1.036 -11.794 1.00 0.00 C ATOM 603 CG ASP A 40 134.024 -1.227 -11.694 1.00 0.00 C ATOM 604 OD1 ASP A 40 134.582 -0.865 -10.672 1.00 0.00 O ATOM 605 OD2 ASP A 40 134.600 -1.730 -12.645 1.00 0.00 O ATOM 0 H ASP A 40 133.311 0.729 -10.150 1.00 0.00 H new ATOM 0 HA ASP A 40 130.828 -0.817 -10.460 1.00 0.00 H new ATOM 0 HB2 ASP A 40 132.058 -1.893 -12.294 1.00 0.00 H new ATOM 0 HB3 ASP A 40 132.284 -0.158 -12.399 1.00 0.00 H new ATOM 610 N LYS A 41 133.149 -1.917 -8.556 1.00 0.00 N ATOM 611 CA LYS A 41 133.544 -3.070 -7.678 1.00 0.00 C ATOM 612 C LYS A 41 133.422 -2.663 -6.208 1.00 0.00 C ATOM 613 O LYS A 41 133.532 -1.506 -5.857 1.00 0.00 O ATOM 614 CB LYS A 41 134.986 -3.492 -7.979 1.00 0.00 C ATOM 615 CG LYS A 41 135.115 -3.922 -9.450 1.00 0.00 C ATOM 616 CD LYS A 41 134.359 -5.239 -9.691 1.00 0.00 C ATOM 617 CE LYS A 41 134.875 -5.907 -10.969 1.00 0.00 C ATOM 618 NZ LYS A 41 134.195 -7.222 -11.153 1.00 0.00 N ATOM 0 H LYS A 41 133.600 -1.030 -8.330 1.00 0.00 H new ATOM 0 HA LYS A 41 132.880 -3.911 -7.877 1.00 0.00 H new ATOM 0 HB2 LYS A 41 135.666 -2.665 -7.773 1.00 0.00 H new ATOM 0 HB3 LYS A 41 135.277 -4.314 -7.325 1.00 0.00 H new ATOM 0 HG2 LYS A 41 134.717 -3.143 -10.100 1.00 0.00 H new ATOM 0 HG3 LYS A 41 136.167 -4.046 -9.708 1.00 0.00 H new ATOM 0 HD2 LYS A 41 134.494 -5.907 -8.841 1.00 0.00 H new ATOM 0 HD3 LYS A 41 133.290 -5.045 -9.777 1.00 0.00 H new ATOM 0 HE2 LYS A 41 134.687 -5.265 -11.829 1.00 0.00 H new ATOM 0 HE3 LYS A 41 135.954 -6.049 -10.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 134.545 -7.676 -12.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 134.396 -7.834 -10.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 133.168 -7.074 -11.230 1.00 0.00 H new ATOM 632 N ALA A 42 133.171 -3.617 -5.356 1.00 0.00 N ATOM 633 CA ALA A 42 133.010 -3.322 -3.902 1.00 0.00 C ATOM 634 C ALA A 42 134.310 -2.778 -3.295 1.00 0.00 C ATOM 635 O ALA A 42 134.283 -1.898 -2.458 1.00 0.00 O ATOM 636 CB ALA A 42 132.618 -4.609 -3.174 1.00 0.00 C ATOM 0 H ALA A 42 133.069 -4.600 -5.607 1.00 0.00 H new ATOM 0 HA ALA A 42 132.236 -2.563 -3.788 1.00 0.00 H new ATOM 0 HB1 ALA A 42 132.498 -4.403 -2.110 1.00 0.00 H new ATOM 0 HB2 ALA A 42 131.678 -4.984 -3.579 1.00 0.00 H new ATOM 0 HB3 ALA A 42 133.398 -5.358 -3.313 1.00 0.00 H new ATOM 642 N TYR A 43 135.440 -3.310 -3.670 1.00 0.00 N ATOM 643 CA TYR A 43 136.714 -2.833 -3.058 1.00 0.00 C ATOM 644 C TYR A 43 136.920 -1.332 -3.308 1.00 0.00 C ATOM 645 O TYR A 43 137.663 -0.684 -2.597 1.00 0.00 O ATOM 646 CB TYR A 43 137.910 -3.641 -3.581 1.00 0.00 C ATOM 647 CG TYR A 43 138.081 -3.466 -5.071 1.00 0.00 C ATOM 648 CD1 TYR A 43 138.659 -2.297 -5.576 1.00 0.00 C ATOM 649 CD2 TYR A 43 137.687 -4.486 -5.946 1.00 0.00 C ATOM 650 CE1 TYR A 43 138.841 -2.145 -6.955 1.00 0.00 C ATOM 651 CE2 TYR A 43 137.866 -4.333 -7.325 1.00 0.00 C ATOM 652 CZ TYR A 43 138.444 -3.162 -7.830 1.00 0.00 C ATOM 653 OH TYR A 43 138.623 -3.012 -9.189 1.00 0.00 O ATOM 0 H TYR A 43 135.538 -4.048 -4.367 1.00 0.00 H new ATOM 0 HA TYR A 43 136.644 -2.988 -1.981 1.00 0.00 H new ATOM 0 HB2 TYR A 43 138.818 -3.323 -3.069 1.00 0.00 H new ATOM 0 HB3 TYR A 43 137.767 -4.697 -3.351 1.00 0.00 H new ATOM 0 HD1 TYR A 43 138.965 -1.511 -4.901 1.00 0.00 H new ATOM 0 HD2 TYR A 43 137.245 -5.391 -5.556 1.00 0.00 H new ATOM 0 HE1 TYR A 43 139.288 -1.242 -7.344 1.00 0.00 H new ATOM 0 HE2 TYR A 43 137.558 -5.118 -8.000 1.00 0.00 H new ATOM 0 HH TYR A 43 138.524 -3.882 -9.630 1.00 0.00 H new ATOM 663 N VAL A 44 136.254 -0.753 -4.276 1.00 0.00 N ATOM 664 CA VAL A 44 136.419 0.719 -4.497 1.00 0.00 C ATOM 665 C VAL A 44 135.557 1.445 -3.458 1.00 0.00 C ATOM 666 O VAL A 44 135.894 2.505 -2.967 1.00 0.00 O ATOM 667 CB VAL A 44 135.961 1.106 -5.911 1.00 0.00 C ATOM 668 CG1 VAL A 44 136.226 2.599 -6.161 1.00 0.00 C ATOM 669 CG2 VAL A 44 136.736 0.284 -6.943 1.00 0.00 C ATOM 0 H VAL A 44 135.613 -1.225 -4.914 1.00 0.00 H new ATOM 0 HA VAL A 44 137.468 0.997 -4.394 1.00 0.00 H new ATOM 0 HB VAL A 44 134.893 0.907 -6.002 1.00 0.00 H new ATOM 0 HG11 VAL A 44 135.898 2.863 -7.166 1.00 0.00 H new ATOM 0 HG12 VAL A 44 135.676 3.193 -5.432 1.00 0.00 H new ATOM 0 HG13 VAL A 44 137.293 2.801 -6.063 1.00 0.00 H new ATOM 0 HG21 VAL A 44 136.410 0.559 -7.946 1.00 0.00 H new ATOM 0 HG22 VAL A 44 137.803 0.483 -6.840 1.00 0.00 H new ATOM 0 HG23 VAL A 44 136.548 -0.777 -6.779 1.00 0.00 H new ATOM 679 N VAL A 45 134.445 0.847 -3.119 1.00 0.00 N ATOM 680 CA VAL A 45 133.534 1.452 -2.108 1.00 0.00 C ATOM 681 C VAL A 45 134.130 1.195 -0.728 1.00 0.00 C ATOM 682 O VAL A 45 134.097 2.039 0.146 1.00 0.00 O ATOM 683 CB VAL A 45 132.149 0.804 -2.199 1.00 0.00 C ATOM 684 CG1 VAL A 45 131.228 1.414 -1.139 1.00 0.00 C ATOM 685 CG2 VAL A 45 131.562 1.046 -3.596 1.00 0.00 C ATOM 0 H VAL A 45 134.128 -0.043 -3.504 1.00 0.00 H new ATOM 0 HA VAL A 45 133.429 2.522 -2.287 1.00 0.00 H new ATOM 0 HB VAL A 45 132.237 -0.268 -2.025 1.00 0.00 H new ATOM 0 HG11 VAL A 45 130.243 0.953 -1.204 1.00 0.00 H new ATOM 0 HG12 VAL A 45 131.647 1.237 -0.148 1.00 0.00 H new ATOM 0 HG13 VAL A 45 131.138 2.487 -1.309 1.00 0.00 H new ATOM 0 HG21 VAL A 45 130.576 0.585 -3.661 1.00 0.00 H new ATOM 0 HG22 VAL A 45 131.474 2.118 -3.773 1.00 0.00 H new ATOM 0 HG23 VAL A 45 132.218 0.607 -4.347 1.00 0.00 H new ATOM 695 N LEU A 46 134.713 0.046 -0.542 1.00 0.00 N ATOM 696 CA LEU A 46 135.356 -0.263 0.761 1.00 0.00 C ATOM 697 C LEU A 46 136.446 0.786 0.983 1.00 0.00 C ATOM 698 O LEU A 46 136.666 1.259 2.079 1.00 0.00 O ATOM 699 CB LEU A 46 135.988 -1.660 0.699 1.00 0.00 C ATOM 700 CG LEU A 46 136.629 -2.033 2.053 1.00 0.00 C ATOM 701 CD1 LEU A 46 135.539 -2.400 3.075 1.00 0.00 C ATOM 702 CD2 LEU A 46 137.604 -3.214 1.860 1.00 0.00 C ATOM 0 H LEU A 46 134.772 -0.695 -1.240 1.00 0.00 H new ATOM 0 HA LEU A 46 134.629 -0.246 1.573 1.00 0.00 H new ATOM 0 HB2 LEU A 46 135.228 -2.396 0.436 1.00 0.00 H new ATOM 0 HB3 LEU A 46 136.744 -1.688 -0.086 1.00 0.00 H new ATOM 0 HG LEU A 46 137.183 -1.175 2.433 1.00 0.00 H new ATOM 0 HD11 LEU A 46 136.004 -2.661 4.025 1.00 0.00 H new ATOM 0 HD12 LEU A 46 134.873 -1.549 3.219 1.00 0.00 H new ATOM 0 HD13 LEU A 46 134.966 -3.251 2.706 1.00 0.00 H new ATOM 0 HD21 LEU A 46 138.054 -3.474 2.818 1.00 0.00 H new ATOM 0 HD22 LEU A 46 137.061 -4.074 1.469 1.00 0.00 H new ATOM 0 HD23 LEU A 46 138.386 -2.929 1.157 1.00 0.00 H new ATOM 714 N GLY A 47 137.127 1.148 -0.071 1.00 0.00 N ATOM 715 CA GLY A 47 138.209 2.161 0.042 1.00 0.00 C ATOM 716 C GLY A 47 137.623 3.465 0.581 1.00 0.00 C ATOM 717 O GLY A 47 138.221 4.127 1.407 1.00 0.00 O ATOM 0 H GLY A 47 136.977 0.781 -1.011 1.00 0.00 H new ATOM 0 HA2 GLY A 47 138.994 1.799 0.706 1.00 0.00 H new ATOM 0 HA3 GLY A 47 138.668 2.330 -0.932 1.00 0.00 H new ATOM 721 N GLN A 48 136.451 3.836 0.137 1.00 0.00 N ATOM 722 CA GLN A 48 135.827 5.089 0.647 1.00 0.00 C ATOM 723 C GLN A 48 135.644 4.956 2.161 1.00 0.00 C ATOM 724 O GLN A 48 135.914 5.869 2.915 1.00 0.00 O ATOM 725 CB GLN A 48 134.461 5.283 -0.025 1.00 0.00 C ATOM 726 CG GLN A 48 133.811 6.585 0.458 1.00 0.00 C ATOM 727 CD GLN A 48 134.642 7.780 -0.012 1.00 0.00 C ATOM 728 OE1 GLN A 48 135.283 7.711 -1.147 1.00 0.00 O flip ATOM 729 NE2 GLN A 48 134.708 8.790 0.661 1.00 0.00 N flip ATOM 0 H GLN A 48 135.901 3.326 -0.555 1.00 0.00 H new ATOM 0 HA GLN A 48 136.460 5.948 0.423 1.00 0.00 H new ATOM 0 HB2 GLN A 48 134.581 5.308 -1.108 1.00 0.00 H new ATOM 0 HB3 GLN A 48 133.812 4.438 0.204 1.00 0.00 H new ATOM 0 HG2 GLN A 48 132.795 6.661 0.071 1.00 0.00 H new ATOM 0 HG3 GLN A 48 133.738 6.585 1.546 1.00 0.00 H new ATOM 0 HE21 GLN A 48 134.208 8.845 1.548 1.00 0.00 H new ATOM 0 HE22 GLN A 48 135.264 9.582 0.339 1.00 0.00 H new ATOM 738 N PHE A 49 135.195 3.813 2.607 1.00 0.00 N ATOM 739 CA PHE A 49 135.000 3.594 4.068 1.00 0.00 C ATOM 740 C PHE A 49 136.351 3.770 4.773 1.00 0.00 C ATOM 741 O PHE A 49 136.443 4.350 5.838 1.00 0.00 O ATOM 742 CB PHE A 49 134.462 2.176 4.278 1.00 0.00 C ATOM 743 CG PHE A 49 134.238 1.911 5.748 1.00 0.00 C ATOM 744 CD1 PHE A 49 133.196 2.560 6.421 1.00 0.00 C ATOM 745 CD2 PHE A 49 135.057 1.005 6.434 1.00 0.00 C ATOM 746 CE1 PHE A 49 132.974 2.304 7.779 1.00 0.00 C ATOM 747 CE2 PHE A 49 134.836 0.752 7.791 1.00 0.00 C ATOM 748 CZ PHE A 49 133.794 1.400 8.465 1.00 0.00 C ATOM 0 H PHE A 49 134.954 3.017 2.017 1.00 0.00 H new ATOM 0 HA PHE A 49 134.289 4.310 4.481 1.00 0.00 H new ATOM 0 HB2 PHE A 49 133.527 2.050 3.733 1.00 0.00 H new ATOM 0 HB3 PHE A 49 135.167 1.449 3.874 1.00 0.00 H new ATOM 0 HD1 PHE A 49 132.564 3.258 5.892 1.00 0.00 H new ATOM 0 HD2 PHE A 49 135.859 0.502 5.915 1.00 0.00 H new ATOM 0 HE1 PHE A 49 132.170 2.804 8.298 1.00 0.00 H new ATOM 0 HE2 PHE A 49 135.470 0.056 8.320 1.00 0.00 H new ATOM 0 HZ PHE A 49 133.623 1.203 9.513 1.00 0.00 H new ATOM 758 N LEU A 50 137.393 3.283 4.171 1.00 0.00 N ATOM 759 CA LEU A 50 138.743 3.429 4.794 1.00 0.00 C ATOM 760 C LEU A 50 139.144 4.908 4.748 1.00 0.00 C ATOM 761 O LEU A 50 139.735 5.432 5.671 1.00 0.00 O ATOM 762 CB LEU A 50 139.774 2.593 4.025 1.00 0.00 C ATOM 763 CG LEU A 50 139.396 1.104 4.066 1.00 0.00 C ATOM 764 CD1 LEU A 50 140.432 0.304 3.270 1.00 0.00 C ATOM 765 CD2 LEU A 50 139.365 0.601 5.521 1.00 0.00 C ATOM 0 H LEU A 50 137.375 2.791 3.278 1.00 0.00 H new ATOM 0 HA LEU A 50 138.710 3.079 5.826 1.00 0.00 H new ATOM 0 HB2 LEU A 50 139.828 2.932 2.991 1.00 0.00 H new ATOM 0 HB3 LEU A 50 140.764 2.735 4.459 1.00 0.00 H new ATOM 0 HG LEU A 50 138.406 0.972 3.629 1.00 0.00 H new ATOM 0 HD11 LEU A 50 140.171 -0.754 3.294 1.00 0.00 H new ATOM 0 HD12 LEU A 50 140.445 0.651 2.237 1.00 0.00 H new ATOM 0 HD13 LEU A 50 141.418 0.445 3.712 1.00 0.00 H new ATOM 0 HD21 LEU A 50 139.096 -0.455 5.535 1.00 0.00 H new ATOM 0 HD22 LEU A 50 140.349 0.731 5.972 1.00 0.00 H new ATOM 0 HD23 LEU A 50 138.628 1.171 6.087 1.00 0.00 H new ATOM 777 N VAL A 51 138.836 5.576 3.673 1.00 0.00 N ATOM 778 CA VAL A 51 139.200 7.019 3.542 1.00 0.00 C ATOM 779 C VAL A 51 138.423 7.861 4.565 1.00 0.00 C ATOM 780 O VAL A 51 138.865 8.915 4.975 1.00 0.00 O ATOM 781 CB VAL A 51 138.870 7.495 2.122 1.00 0.00 C ATOM 782 CG1 VAL A 51 139.016 9.016 2.027 1.00 0.00 C ATOM 783 CG2 VAL A 51 139.833 6.833 1.133 1.00 0.00 C ATOM 0 H VAL A 51 138.343 5.183 2.871 1.00 0.00 H new ATOM 0 HA VAL A 51 140.267 7.138 3.732 1.00 0.00 H new ATOM 0 HB VAL A 51 137.842 7.221 1.884 1.00 0.00 H new ATOM 0 HG11 VAL A 51 138.779 9.342 1.014 1.00 0.00 H new ATOM 0 HG12 VAL A 51 138.333 9.492 2.730 1.00 0.00 H new ATOM 0 HG13 VAL A 51 140.040 9.299 2.269 1.00 0.00 H new ATOM 0 HG21 VAL A 51 139.603 7.168 0.122 1.00 0.00 H new ATOM 0 HG22 VAL A 51 140.857 7.109 1.382 1.00 0.00 H new ATOM 0 HG23 VAL A 51 139.725 5.750 1.190 1.00 0.00 H new ATOM 793 N LEU A 52 137.260 7.418 4.958 1.00 0.00 N ATOM 794 CA LEU A 52 136.443 8.209 5.931 1.00 0.00 C ATOM 795 C LEU A 52 136.827 7.847 7.365 1.00 0.00 C ATOM 796 O LEU A 52 136.138 8.206 8.299 1.00 0.00 O ATOM 797 CB LEU A 52 134.963 7.883 5.718 1.00 0.00 C ATOM 798 CG LEU A 52 134.501 8.394 4.347 1.00 0.00 C ATOM 799 CD1 LEU A 52 133.109 7.832 4.053 1.00 0.00 C ATOM 800 CD2 LEU A 52 134.449 9.937 4.333 1.00 0.00 C ATOM 0 H LEU A 52 136.837 6.543 4.649 1.00 0.00 H new ATOM 0 HA LEU A 52 136.627 9.271 5.769 1.00 0.00 H new ATOM 0 HB2 LEU A 52 134.807 6.806 5.785 1.00 0.00 H new ATOM 0 HB3 LEU A 52 134.365 8.341 6.506 1.00 0.00 H new ATOM 0 HG LEU A 52 135.208 8.065 3.585 1.00 0.00 H new ATOM 0 HD11 LEU A 52 132.770 8.189 3.080 1.00 0.00 H new ATOM 0 HD12 LEU A 52 133.150 6.743 4.045 1.00 0.00 H new ATOM 0 HD13 LEU A 52 132.413 8.163 4.823 1.00 0.00 H new ATOM 0 HD21 LEU A 52 134.119 10.281 3.353 1.00 0.00 H new ATOM 0 HD22 LEU A 52 133.750 10.284 5.094 1.00 0.00 H new ATOM 0 HD23 LEU A 52 135.441 10.336 4.543 1.00 0.00 H new ATOM 812 N LYS A 53 137.914 7.157 7.565 1.00 0.00 N ATOM 813 CA LYS A 53 138.319 6.802 8.954 1.00 0.00 C ATOM 814 C LYS A 53 137.111 6.242 9.720 1.00 0.00 C ATOM 815 O LYS A 53 136.922 6.527 10.884 1.00 0.00 O ATOM 816 CB LYS A 53 138.850 8.053 9.661 1.00 0.00 C ATOM 817 CG LYS A 53 140.098 8.557 8.927 1.00 0.00 C ATOM 818 CD LYS A 53 140.641 9.809 9.623 1.00 0.00 C ATOM 819 CE LYS A 53 141.886 10.305 8.883 1.00 0.00 C ATOM 820 NZ LYS A 53 142.550 11.375 9.680 1.00 0.00 N ATOM 0 H LYS A 53 138.538 6.824 6.830 1.00 0.00 H new ATOM 0 HA LYS A 53 139.101 6.043 8.923 1.00 0.00 H new ATOM 0 HB2 LYS A 53 138.085 8.829 9.676 1.00 0.00 H new ATOM 0 HB3 LYS A 53 139.092 7.823 10.699 1.00 0.00 H new ATOM 0 HG2 LYS A 53 140.861 7.779 8.912 1.00 0.00 H new ATOM 0 HG3 LYS A 53 139.854 8.784 7.889 1.00 0.00 H new ATOM 0 HD2 LYS A 53 139.879 10.589 9.639 1.00 0.00 H new ATOM 0 HD3 LYS A 53 140.887 9.583 10.661 1.00 0.00 H new ATOM 0 HE2 LYS A 53 142.577 9.478 8.719 1.00 0.00 H new ATOM 0 HE3 LYS A 53 141.609 10.688 7.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 143.395 11.710 9.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 141.890 12.168 9.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 142.829 10.995 10.607 1.00 0.00 H new ATOM 834 N LYS A 54 136.299 5.443 9.061 1.00 0.00 N ATOM 835 CA LYS A 54 135.095 4.827 9.708 1.00 0.00 C ATOM 836 C LYS A 54 134.135 5.915 10.216 1.00 0.00 C ATOM 837 O LYS A 54 133.307 5.657 11.065 1.00 0.00 O ATOM 838 CB LYS A 54 135.535 3.950 10.887 1.00 0.00 C ATOM 839 CG LYS A 54 136.474 2.851 10.385 1.00 0.00 C ATOM 840 CD LYS A 54 136.911 1.978 11.563 1.00 0.00 C ATOM 841 CE LYS A 54 137.911 0.926 11.079 1.00 0.00 C ATOM 842 NZ LYS A 54 137.253 0.022 10.094 1.00 0.00 N ATOM 0 H LYS A 54 136.425 5.188 8.081 1.00 0.00 H new ATOM 0 HA LYS A 54 134.578 4.219 8.966 1.00 0.00 H new ATOM 0 HB2 LYS A 54 136.039 4.558 11.638 1.00 0.00 H new ATOM 0 HB3 LYS A 54 134.664 3.506 11.369 1.00 0.00 H new ATOM 0 HG2 LYS A 54 135.970 2.242 9.634 1.00 0.00 H new ATOM 0 HG3 LYS A 54 137.346 3.294 9.904 1.00 0.00 H new ATOM 0 HD2 LYS A 54 137.364 2.596 12.338 1.00 0.00 H new ATOM 0 HD3 LYS A 54 136.044 1.492 12.010 1.00 0.00 H new ATOM 0 HE2 LYS A 54 138.772 1.413 10.621 1.00 0.00 H new ATOM 0 HE3 LYS A 54 138.283 0.348 11.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 137.801 -0.858 10.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 136.289 -0.200 10.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 137.209 0.492 9.167 1.00 0.00 H new ATOM 856 N ASP A 55 134.212 7.115 9.705 1.00 0.00 N ATOM 857 CA ASP A 55 133.263 8.169 10.183 1.00 0.00 C ATOM 858 C ASP A 55 131.850 7.845 9.662 1.00 0.00 C ATOM 859 O ASP A 55 131.572 7.940 8.483 1.00 0.00 O ATOM 860 CB ASP A 55 133.709 9.535 9.666 1.00 0.00 C ATOM 861 CG ASP A 55 132.769 10.614 10.209 1.00 0.00 C ATOM 862 OD1 ASP A 55 131.603 10.591 9.852 1.00 0.00 O ATOM 863 OD2 ASP A 55 133.232 11.445 10.974 1.00 0.00 O ATOM 0 H ASP A 55 134.877 7.410 8.990 1.00 0.00 H new ATOM 0 HA ASP A 55 133.253 8.191 11.273 1.00 0.00 H new ATOM 0 HB2 ASP A 55 134.733 9.738 9.979 1.00 0.00 H new ATOM 0 HB3 ASP A 55 133.701 9.544 8.576 1.00 0.00 H new ATOM 868 N GLU A 56 130.975 7.429 10.540 1.00 0.00 N ATOM 869 CA GLU A 56 129.582 7.047 10.136 1.00 0.00 C ATOM 870 C GLU A 56 128.772 8.225 9.560 1.00 0.00 C ATOM 871 O GLU A 56 128.017 8.059 8.626 1.00 0.00 O ATOM 872 CB GLU A 56 128.848 6.497 11.365 1.00 0.00 C ATOM 873 CG GLU A 56 127.438 6.036 10.973 1.00 0.00 C ATOM 874 CD GLU A 56 126.743 5.429 12.192 1.00 0.00 C ATOM 875 OE1 GLU A 56 127.394 5.292 13.215 1.00 0.00 O ATOM 876 OE2 GLU A 56 125.570 5.110 12.081 1.00 0.00 O ATOM 0 H GLU A 56 131.167 7.335 11.537 1.00 0.00 H new ATOM 0 HA GLU A 56 129.667 6.300 9.347 1.00 0.00 H new ATOM 0 HB2 GLU A 56 129.407 5.663 11.789 1.00 0.00 H new ATOM 0 HB3 GLU A 56 128.787 7.265 12.136 1.00 0.00 H new ATOM 0 HG2 GLU A 56 126.860 6.879 10.594 1.00 0.00 H new ATOM 0 HG3 GLU A 56 127.494 5.301 10.170 1.00 0.00 H new ATOM 883 N ASP A 57 128.889 9.398 10.119 1.00 0.00 N ATOM 884 CA ASP A 57 128.086 10.557 9.608 1.00 0.00 C ATOM 885 C ASP A 57 128.568 10.987 8.222 1.00 0.00 C ATOM 886 O ASP A 57 127.783 11.331 7.361 1.00 0.00 O ATOM 887 CB ASP A 57 128.219 11.735 10.573 1.00 0.00 C ATOM 888 CG ASP A 57 127.482 11.416 11.874 1.00 0.00 C ATOM 889 OD1 ASP A 57 126.296 11.694 11.943 1.00 0.00 O ATOM 890 OD2 ASP A 57 128.112 10.889 12.776 1.00 0.00 O ATOM 0 H ASP A 57 129.503 9.609 10.906 1.00 0.00 H new ATOM 0 HA ASP A 57 127.044 10.247 9.535 1.00 0.00 H new ATOM 0 HB2 ASP A 57 129.271 11.933 10.778 1.00 0.00 H new ATOM 0 HB3 ASP A 57 127.807 12.637 10.121 1.00 0.00 H new ATOM 895 N LEU A 58 129.839 10.976 8.001 1.00 0.00 N ATOM 896 CA LEU A 58 130.343 11.393 6.664 1.00 0.00 C ATOM 897 C LEU A 58 129.950 10.336 5.630 1.00 0.00 C ATOM 898 O LEU A 58 129.587 10.651 4.514 1.00 0.00 O ATOM 899 CB LEU A 58 131.866 11.548 6.697 1.00 0.00 C ATOM 900 CG LEU A 58 132.259 12.753 7.570 1.00 0.00 C ATOM 901 CD1 LEU A 58 133.778 12.751 7.775 1.00 0.00 C ATOM 902 CD2 LEU A 58 131.831 14.072 6.895 1.00 0.00 C ATOM 0 H LEU A 58 130.552 10.700 8.676 1.00 0.00 H new ATOM 0 HA LEU A 58 129.902 12.353 6.395 1.00 0.00 H new ATOM 0 HB2 LEU A 58 132.323 10.640 7.091 1.00 0.00 H new ATOM 0 HB3 LEU A 58 132.247 11.683 5.685 1.00 0.00 H new ATOM 0 HG LEU A 58 131.753 12.675 8.532 1.00 0.00 H new ATOM 0 HD11 LEU A 58 134.063 13.603 8.393 1.00 0.00 H new ATOM 0 HD12 LEU A 58 134.077 11.827 8.270 1.00 0.00 H new ATOM 0 HD13 LEU A 58 134.276 12.822 6.808 1.00 0.00 H new ATOM 0 HD21 LEU A 58 132.117 14.913 7.526 1.00 0.00 H new ATOM 0 HD22 LEU A 58 132.323 14.161 5.927 1.00 0.00 H new ATOM 0 HD23 LEU A 58 130.750 14.075 6.754 1.00 0.00 H new ATOM 914 N PHE A 59 129.990 9.088 6.001 1.00 0.00 N ATOM 915 CA PHE A 59 129.588 8.013 5.050 1.00 0.00 C ATOM 916 C PHE A 59 128.106 8.173 4.691 1.00 0.00 C ATOM 917 O PHE A 59 127.720 8.075 3.543 1.00 0.00 O ATOM 918 CB PHE A 59 129.817 6.649 5.704 1.00 0.00 C ATOM 919 CG PHE A 59 129.394 5.545 4.760 1.00 0.00 C ATOM 920 CD1 PHE A 59 130.204 5.209 3.668 1.00 0.00 C ATOM 921 CD2 PHE A 59 128.197 4.850 4.982 1.00 0.00 C ATOM 922 CE1 PHE A 59 129.820 4.180 2.800 1.00 0.00 C ATOM 923 CE2 PHE A 59 127.813 3.822 4.113 1.00 0.00 C ATOM 924 CZ PHE A 59 128.624 3.487 3.022 1.00 0.00 C ATOM 0 H PHE A 59 130.284 8.764 6.923 1.00 0.00 H new ATOM 0 HA PHE A 59 130.186 8.085 4.142 1.00 0.00 H new ATOM 0 HB2 PHE A 59 130.869 6.533 5.964 1.00 0.00 H new ATOM 0 HB3 PHE A 59 129.250 6.582 6.633 1.00 0.00 H new ATOM 0 HD1 PHE A 59 131.126 5.744 3.495 1.00 0.00 H new ATOM 0 HD2 PHE A 59 127.571 5.108 5.824 1.00 0.00 H new ATOM 0 HE1 PHE A 59 130.446 3.921 1.959 1.00 0.00 H new ATOM 0 HE2 PHE A 59 126.891 3.287 4.284 1.00 0.00 H new ATOM 0 HZ PHE A 59 128.327 2.694 2.352 1.00 0.00 H new ATOM 934 N ARG A 60 127.272 8.392 5.673 1.00 0.00 N ATOM 935 CA ARG A 60 125.810 8.529 5.405 1.00 0.00 C ATOM 936 C ARG A 60 125.531 9.696 4.458 1.00 0.00 C ATOM 937 O ARG A 60 124.814 9.551 3.488 1.00 0.00 O ATOM 938 CB ARG A 60 125.066 8.770 6.722 1.00 0.00 C ATOM 939 CG ARG A 60 125.080 7.499 7.572 1.00 0.00 C ATOM 940 CD ARG A 60 124.490 7.802 8.951 1.00 0.00 C ATOM 941 NE ARG A 60 123.113 8.352 8.790 1.00 0.00 N ATOM 942 CZ ARG A 60 122.310 8.423 9.817 1.00 0.00 C ATOM 943 NH1 ARG A 60 122.704 7.996 10.986 1.00 0.00 N ATOM 944 NH2 ARG A 60 121.112 8.921 9.675 1.00 0.00 N ATOM 0 H ARG A 60 127.541 8.482 6.653 1.00 0.00 H new ATOM 0 HA ARG A 60 125.464 7.607 4.938 1.00 0.00 H new ATOM 0 HB2 ARG A 60 125.534 9.588 7.269 1.00 0.00 H new ATOM 0 HB3 ARG A 60 124.038 9.070 6.519 1.00 0.00 H new ATOM 0 HG2 ARG A 60 124.503 6.715 7.082 1.00 0.00 H new ATOM 0 HG3 ARG A 60 126.100 7.128 7.674 1.00 0.00 H new ATOM 0 HD2 ARG A 60 124.463 6.895 9.555 1.00 0.00 H new ATOM 0 HD3 ARG A 60 125.120 8.518 9.479 1.00 0.00 H new ATOM 0 HE ARG A 60 122.798 8.674 7.875 1.00 0.00 H new ATOM 0 HH11 ARG A 60 123.640 7.606 11.098 1.00 0.00 H new ATOM 0 HH12 ARG A 60 122.076 8.052 11.788 1.00 0.00 H new ATOM 0 HH21 ARG A 60 120.803 9.255 8.762 1.00 0.00 H new ATOM 0 HH22 ARG A 60 120.484 8.977 10.477 1.00 0.00 H new ATOM 958 N GLU A 61 126.082 10.851 4.712 1.00 0.00 N ATOM 959 CA GLU A 61 125.826 11.998 3.800 1.00 0.00 C ATOM 960 C GLU A 61 126.392 11.666 2.417 1.00 0.00 C ATOM 961 O GLU A 61 125.795 11.968 1.403 1.00 0.00 O ATOM 962 CB GLU A 61 126.505 13.257 4.353 1.00 0.00 C ATOM 963 CG GLU A 61 126.159 14.469 3.480 1.00 0.00 C ATOM 964 CD GLU A 61 124.657 14.752 3.562 1.00 0.00 C ATOM 965 OE1 GLU A 61 124.038 14.289 4.506 1.00 0.00 O ATOM 966 OE2 GLU A 61 124.153 15.428 2.680 1.00 0.00 O ATOM 0 H GLU A 61 126.693 11.048 5.505 1.00 0.00 H new ATOM 0 HA GLU A 61 124.754 12.180 3.724 1.00 0.00 H new ATOM 0 HB2 GLU A 61 126.181 13.434 5.379 1.00 0.00 H new ATOM 0 HB3 GLU A 61 127.585 13.115 4.380 1.00 0.00 H new ATOM 0 HG2 GLU A 61 126.722 15.341 3.812 1.00 0.00 H new ATOM 0 HG3 GLU A 61 126.447 14.279 2.446 1.00 0.00 H new ATOM 973 N TRP A 62 127.538 11.048 2.366 1.00 0.00 N ATOM 974 CA TRP A 62 128.139 10.701 1.046 1.00 0.00 C ATOM 975 C TRP A 62 127.265 9.699 0.283 1.00 0.00 C ATOM 976 O TRP A 62 126.988 9.870 -0.884 1.00 0.00 O ATOM 977 CB TRP A 62 129.531 10.087 1.261 1.00 0.00 C ATOM 978 CG TRP A 62 130.035 9.516 -0.033 1.00 0.00 C ATOM 979 CD1 TRP A 62 130.670 10.213 -1.001 1.00 0.00 C ATOM 980 CD2 TRP A 62 129.929 8.145 -0.518 1.00 0.00 C ATOM 981 NE1 TRP A 62 130.967 9.356 -2.049 1.00 0.00 N ATOM 982 CE2 TRP A 62 130.530 8.069 -1.797 1.00 0.00 C ATOM 983 CE3 TRP A 62 129.377 6.969 0.027 1.00 0.00 C ATOM 984 CZ2 TRP A 62 130.580 6.868 -2.511 1.00 0.00 C ATOM 985 CZ3 TRP A 62 129.429 5.763 -0.689 1.00 0.00 C ATOM 986 CH2 TRP A 62 130.028 5.712 -1.954 1.00 0.00 C ATOM 0 H TRP A 62 128.085 10.768 3.180 1.00 0.00 H new ATOM 0 HA TRP A 62 128.214 11.616 0.458 1.00 0.00 H new ATOM 0 HB2 TRP A 62 130.222 10.846 1.629 1.00 0.00 H new ATOM 0 HB3 TRP A 62 129.482 9.306 2.020 1.00 0.00 H new ATOM 0 HD1 TRP A 62 130.907 11.266 -0.964 1.00 0.00 H new ATOM 0 HE1 TRP A 62 131.449 9.640 -2.902 1.00 0.00 H new ATOM 0 HE3 TRP A 62 128.911 6.996 1.001 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 131.042 6.834 -3.487 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 129.004 4.867 -0.261 1.00 0.00 H new ATOM 0 HH2 TRP A 62 130.063 4.780 -2.498 1.00 0.00 H new ATOM 997 N LEU A 63 126.844 8.649 0.926 1.00 0.00 N ATOM 998 CA LEU A 63 126.012 7.632 0.223 1.00 0.00 C ATOM 999 C LEU A 63 124.657 8.229 -0.160 1.00 0.00 C ATOM 1000 O LEU A 63 124.174 8.037 -1.258 1.00 0.00 O ATOM 1001 CB LEU A 63 125.810 6.427 1.154 1.00 0.00 C ATOM 1002 CG LEU A 63 124.955 5.349 0.472 1.00 0.00 C ATOM 1003 CD1 LEU A 63 125.663 4.816 -0.784 1.00 0.00 C ATOM 1004 CD2 LEU A 63 124.723 4.202 1.462 1.00 0.00 C ATOM 0 H LEU A 63 127.039 8.449 1.907 1.00 0.00 H new ATOM 0 HA LEU A 63 126.518 7.314 -0.689 1.00 0.00 H new ATOM 0 HB2 LEU A 63 126.778 6.009 1.431 1.00 0.00 H new ATOM 0 HB3 LEU A 63 125.327 6.751 2.076 1.00 0.00 H new ATOM 0 HG LEU A 63 124.001 5.782 0.171 1.00 0.00 H new ATOM 0 HD11 LEU A 63 125.043 4.053 -1.255 1.00 0.00 H new ATOM 0 HD12 LEU A 63 125.826 5.635 -1.485 1.00 0.00 H new ATOM 0 HD13 LEU A 63 126.623 4.382 -0.504 1.00 0.00 H new ATOM 0 HD21 LEU A 63 124.117 3.430 0.989 1.00 0.00 H new ATOM 0 HD22 LEU A 63 125.682 3.778 1.759 1.00 0.00 H new ATOM 0 HD23 LEU A 63 124.205 4.581 2.343 1.00 0.00 H new ATOM 1016 N LYS A 64 124.035 8.941 0.731 1.00 0.00 N ATOM 1017 CA LYS A 64 122.707 9.541 0.420 1.00 0.00 C ATOM 1018 C LYS A 64 122.836 10.489 -0.774 1.00 0.00 C ATOM 1019 O LYS A 64 122.065 10.435 -1.712 1.00 0.00 O ATOM 1020 CB LYS A 64 122.203 10.309 1.654 1.00 0.00 C ATOM 1021 CG LYS A 64 120.816 10.933 1.404 1.00 0.00 C ATOM 1022 CD LYS A 64 119.739 9.840 1.357 1.00 0.00 C ATOM 1023 CE LYS A 64 118.352 10.486 1.421 1.00 0.00 C ATOM 1024 NZ LYS A 64 118.103 11.250 0.166 1.00 0.00 N ATOM 0 H LYS A 64 124.389 9.136 1.668 1.00 0.00 H new ATOM 0 HA LYS A 64 121.996 8.755 0.167 1.00 0.00 H new ATOM 0 HB2 LYS A 64 122.151 9.633 2.508 1.00 0.00 H new ATOM 0 HB3 LYS A 64 122.915 11.093 1.911 1.00 0.00 H new ATOM 0 HG2 LYS A 64 120.584 11.648 2.194 1.00 0.00 H new ATOM 0 HG3 LYS A 64 120.823 11.487 0.465 1.00 0.00 H new ATOM 0 HD2 LYS A 64 119.838 9.256 0.442 1.00 0.00 H new ATOM 0 HD3 LYS A 64 119.869 9.150 2.191 1.00 0.00 H new ATOM 0 HE2 LYS A 64 117.588 9.720 1.551 1.00 0.00 H new ATOM 0 HE3 LYS A 64 118.288 11.150 2.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 117.120 11.590 0.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 118.751 12.062 0.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 118.264 10.632 -0.655 1.00 0.00 H new ATOM 1038 N ASP A 65 123.801 11.362 -0.738 1.00 0.00 N ATOM 1039 CA ASP A 65 123.982 12.325 -1.858 1.00 0.00 C ATOM 1040 C ASP A 65 124.463 11.592 -3.109 1.00 0.00 C ATOM 1041 O ASP A 65 124.225 12.023 -4.220 1.00 0.00 O ATOM 1042 CB ASP A 65 125.010 13.385 -1.458 1.00 0.00 C ATOM 1043 CG ASP A 65 124.381 14.353 -0.454 1.00 0.00 C ATOM 1044 OD1 ASP A 65 123.262 14.777 -0.693 1.00 0.00 O ATOM 1045 OD2 ASP A 65 125.026 14.650 0.538 1.00 0.00 O ATOM 0 H ASP A 65 124.475 11.451 0.022 1.00 0.00 H new ATOM 0 HA ASP A 65 123.027 12.804 -2.073 1.00 0.00 H new ATOM 0 HB2 ASP A 65 125.887 12.909 -1.020 1.00 0.00 H new ATOM 0 HB3 ASP A 65 125.349 13.929 -2.340 1.00 0.00 H new ATOM 1050 N THR A 66 125.169 10.507 -2.946 1.00 0.00 N ATOM 1051 CA THR A 66 125.698 9.782 -4.133 1.00 0.00 C ATOM 1052 C THR A 66 124.603 8.966 -4.826 1.00 0.00 C ATOM 1053 O THR A 66 124.602 8.869 -6.037 1.00 0.00 O ATOM 1054 CB THR A 66 126.831 8.844 -3.703 1.00 0.00 C ATOM 1055 OG1 THR A 66 127.838 9.595 -3.040 1.00 0.00 O ATOM 1056 CG2 THR A 66 127.438 8.173 -4.937 1.00 0.00 C ATOM 0 H THR A 66 125.402 10.093 -2.043 1.00 0.00 H new ATOM 0 HA THR A 66 126.072 10.524 -4.839 1.00 0.00 H new ATOM 0 HB THR A 66 126.434 8.083 -3.031 1.00 0.00 H new ATOM 0 HG1 THR A 66 127.745 9.482 -2.071 1.00 0.00 H new ATOM 0 HG21 THR A 66 128.244 7.506 -4.629 1.00 0.00 H new ATOM 0 HG22 THR A 66 126.669 7.599 -5.454 1.00 0.00 H new ATOM 0 HG23 THR A 66 127.834 8.935 -5.608 1.00 0.00 H new ATOM 1064 N CYS A 67 123.696 8.335 -4.102 1.00 0.00 N ATOM 1065 CA CYS A 67 122.654 7.489 -4.780 1.00 0.00 C ATOM 1066 C CYS A 67 121.239 7.811 -4.297 1.00 0.00 C ATOM 1067 O CYS A 67 120.279 7.642 -5.022 1.00 0.00 O ATOM 1068 CB CYS A 67 122.944 6.019 -4.476 1.00 0.00 C ATOM 1069 SG CYS A 67 123.003 5.778 -2.683 1.00 0.00 S ATOM 0 H CYS A 67 123.634 8.370 -3.084 1.00 0.00 H new ATOM 0 HA CYS A 67 122.701 7.698 -5.849 1.00 0.00 H new ATOM 0 HB2 CYS A 67 122.172 5.386 -4.914 1.00 0.00 H new ATOM 0 HB3 CYS A 67 123.892 5.723 -4.925 1.00 0.00 H new ATOM 0 HG CYS A 67 123.838 6.625 -2.159 1.00 0.00 H new ATOM 1075 N GLY A 68 121.094 8.245 -3.071 1.00 0.00 N ATOM 1076 CA GLY A 68 119.733 8.549 -2.530 1.00 0.00 C ATOM 1077 C GLY A 68 119.305 7.399 -1.613 1.00 0.00 C ATOM 1078 O GLY A 68 118.153 7.280 -1.246 1.00 0.00 O ATOM 0 H GLY A 68 121.862 8.403 -2.418 1.00 0.00 H new ATOM 0 HA2 GLY A 68 119.746 9.489 -1.978 1.00 0.00 H new ATOM 0 HA3 GLY A 68 119.020 8.669 -3.345 1.00 0.00 H new ATOM 1082 N ALA A 69 120.229 6.553 -1.234 1.00 0.00 N ATOM 1083 CA ALA A 69 119.877 5.414 -0.335 1.00 0.00 C ATOM 1084 C ALA A 69 119.108 5.946 0.875 1.00 0.00 C ATOM 1085 O ALA A 69 119.225 7.102 1.233 1.00 0.00 O ATOM 1086 CB ALA A 69 121.158 4.726 0.140 1.00 0.00 C ATOM 0 H ALA A 69 121.210 6.602 -1.508 1.00 0.00 H new ATOM 0 HA ALA A 69 119.259 4.698 -0.876 1.00 0.00 H new ATOM 0 HB1 ALA A 69 120.902 3.894 0.796 1.00 0.00 H new ATOM 0 HB2 ALA A 69 121.711 4.352 -0.722 1.00 0.00 H new ATOM 0 HB3 ALA A 69 121.775 5.441 0.684 1.00 0.00 H new ATOM 1092 N ASN A 70 118.310 5.124 1.503 1.00 0.00 N ATOM 1093 CA ASN A 70 117.521 5.603 2.677 1.00 0.00 C ATOM 1094 C ASN A 70 118.330 5.448 3.966 1.00 0.00 C ATOM 1095 O ASN A 70 119.370 4.820 3.998 1.00 0.00 O ATOM 1096 CB ASN A 70 116.240 4.775 2.793 1.00 0.00 C ATOM 1097 CG ASN A 70 115.470 5.203 4.046 1.00 0.00 C ATOM 1098 OD1 ASN A 70 115.244 6.471 4.254 1.00 0.00 O flip ATOM 1099 ND2 ASN A 70 115.076 4.376 4.843 1.00 0.00 N flip ATOM 0 H ASN A 70 118.170 4.144 1.255 1.00 0.00 H new ATOM 0 HA ASN A 70 117.281 6.656 2.532 1.00 0.00 H new ATOM 0 HB2 ASN A 70 115.621 4.916 1.907 1.00 0.00 H new ATOM 0 HB3 ASN A 70 116.483 3.714 2.847 1.00 0.00 H new ATOM 0 HD21 ASN A 70 115.253 3.385 4.679 1.00 0.00 H new ATOM 0 HD22 ASN A 70 114.568 4.672 5.676 1.00 0.00 H new ATOM 1106 N ALA A 71 117.848 6.031 5.029 1.00 0.00 N ATOM 1107 CA ALA A 71 118.559 5.952 6.338 1.00 0.00 C ATOM 1108 C ALA A 71 118.671 4.497 6.800 1.00 0.00 C ATOM 1109 O ALA A 71 119.631 4.117 7.440 1.00 0.00 O ATOM 1110 CB ALA A 71 117.775 6.747 7.382 1.00 0.00 C ATOM 0 H ALA A 71 116.980 6.566 5.047 1.00 0.00 H new ATOM 0 HA ALA A 71 119.561 6.365 6.221 1.00 0.00 H new ATOM 0 HB1 ALA A 71 118.289 6.694 8.342 1.00 0.00 H new ATOM 0 HB2 ALA A 71 117.702 7.788 7.067 1.00 0.00 H new ATOM 0 HB3 ALA A 71 116.774 6.327 7.483 1.00 0.00 H new ATOM 1116 N LYS A 72 117.698 3.682 6.500 1.00 0.00 N ATOM 1117 CA LYS A 72 117.762 2.260 6.950 1.00 0.00 C ATOM 1118 C LYS A 72 118.830 1.511 6.151 1.00 0.00 C ATOM 1119 O LYS A 72 119.568 0.700 6.680 1.00 0.00 O ATOM 1120 CB LYS A 72 116.399 1.598 6.723 1.00 0.00 C ATOM 1121 CG LYS A 72 116.429 0.156 7.239 1.00 0.00 C ATOM 1122 CD LYS A 72 115.067 -0.497 6.998 1.00 0.00 C ATOM 1123 CE LYS A 72 115.094 -1.937 7.511 1.00 0.00 C ATOM 1124 NZ LYS A 72 113.833 -2.627 7.121 1.00 0.00 N ATOM 0 H LYS A 72 116.866 3.935 5.967 1.00 0.00 H new ATOM 0 HA LYS A 72 118.017 2.226 8.009 1.00 0.00 H new ATOM 0 HB2 LYS A 72 115.621 2.162 7.237 1.00 0.00 H new ATOM 0 HB3 LYS A 72 116.152 1.609 5.661 1.00 0.00 H new ATOM 0 HG2 LYS A 72 117.210 -0.408 6.730 1.00 0.00 H new ATOM 0 HG3 LYS A 72 116.668 0.143 8.302 1.00 0.00 H new ATOM 0 HD2 LYS A 72 114.286 0.067 7.508 1.00 0.00 H new ATOM 0 HD3 LYS A 72 114.828 -0.483 5.935 1.00 0.00 H new ATOM 0 HE2 LYS A 72 115.953 -2.465 7.098 1.00 0.00 H new ATOM 0 HE3 LYS A 72 115.206 -1.946 8.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 113.851 -3.607 7.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 113.021 -2.127 7.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 113.745 -2.630 6.085 1.00 0.00 H new ATOM 1138 N GLN A 73 118.899 1.760 4.874 1.00 0.00 N ATOM 1139 CA GLN A 73 119.888 1.052 4.019 1.00 0.00 C ATOM 1140 C GLN A 73 121.305 1.460 4.403 1.00 0.00 C ATOM 1141 O GLN A 73 122.226 0.668 4.344 1.00 0.00 O ATOM 1142 CB GLN A 73 119.632 1.409 2.552 1.00 0.00 C ATOM 1143 CG GLN A 73 118.315 0.778 2.096 1.00 0.00 C ATOM 1144 CD GLN A 73 118.056 1.132 0.631 1.00 0.00 C ATOM 1145 OE1 GLN A 73 118.006 2.292 0.273 1.00 0.00 O ATOM 1146 NE2 GLN A 73 117.888 0.174 -0.239 1.00 0.00 N ATOM 0 H GLN A 73 118.307 2.430 4.383 1.00 0.00 H new ATOM 0 HA GLN A 73 119.781 -0.023 4.163 1.00 0.00 H new ATOM 0 HB2 GLN A 73 119.590 2.492 2.432 1.00 0.00 H new ATOM 0 HB3 GLN A 73 120.453 1.051 1.931 1.00 0.00 H new ATOM 0 HG2 GLN A 73 118.358 -0.304 2.217 1.00 0.00 H new ATOM 0 HG3 GLN A 73 117.494 1.136 2.718 1.00 0.00 H new ATOM 0 HE21 GLN A 73 117.930 -0.800 0.061 1.00 0.00 H new ATOM 0 HE22 GLN A 73 117.715 0.399 -1.219 1.00 0.00 H new ATOM 1155 N SER A 74 121.496 2.690 4.781 1.00 0.00 N ATOM 1156 CA SER A 74 122.858 3.150 5.152 1.00 0.00 C ATOM 1157 C SER A 74 123.313 2.479 6.451 1.00 0.00 C ATOM 1158 O SER A 74 124.467 2.130 6.601 1.00 0.00 O ATOM 1159 CB SER A 74 122.847 4.665 5.336 1.00 0.00 C ATOM 1160 OG SER A 74 124.185 5.136 5.414 1.00 0.00 O ATOM 0 H SER A 74 120.765 3.398 4.849 1.00 0.00 H new ATOM 0 HA SER A 74 123.552 2.879 4.356 1.00 0.00 H new ATOM 0 HB2 SER A 74 122.329 5.141 4.503 1.00 0.00 H new ATOM 0 HB3 SER A 74 122.302 4.929 6.242 1.00 0.00 H new ATOM 0 HG SER A 74 124.401 5.644 4.604 1.00 0.00 H new ATOM 1166 N ARG A 75 122.429 2.302 7.401 1.00 0.00 N ATOM 1167 CA ARG A 75 122.843 1.663 8.683 1.00 0.00 C ATOM 1168 C ARG A 75 123.370 0.257 8.408 1.00 0.00 C ATOM 1169 O ARG A 75 124.301 -0.191 9.048 1.00 0.00 O ATOM 1170 CB ARG A 75 121.658 1.593 9.649 1.00 0.00 C ATOM 1171 CG ARG A 75 121.311 3.003 10.132 1.00 0.00 C ATOM 1172 CD ARG A 75 120.190 2.931 11.171 1.00 0.00 C ATOM 1173 NE ARG A 75 118.991 2.283 10.568 1.00 0.00 N ATOM 1174 CZ ARG A 75 118.025 1.861 11.337 1.00 0.00 C ATOM 1175 NH1 ARG A 75 118.101 2.031 12.629 1.00 0.00 N ATOM 1176 NH2 ARG A 75 116.982 1.274 10.816 1.00 0.00 N ATOM 0 H ARG A 75 121.447 2.571 7.344 1.00 0.00 H new ATOM 0 HA ARG A 75 123.631 2.263 9.139 1.00 0.00 H new ATOM 0 HB2 ARG A 75 120.797 1.144 9.154 1.00 0.00 H new ATOM 0 HB3 ARG A 75 121.904 0.956 10.499 1.00 0.00 H new ATOM 0 HG2 ARG A 75 122.192 3.476 10.566 1.00 0.00 H new ATOM 0 HG3 ARG A 75 121.000 3.620 9.289 1.00 0.00 H new ATOM 0 HD2 ARG A 75 120.523 2.365 12.041 1.00 0.00 H new ATOM 0 HD3 ARG A 75 119.938 3.933 11.519 1.00 0.00 H new ATOM 0 HE ARG A 75 118.926 2.170 9.556 1.00 0.00 H new ATOM 0 HH11 ARG A 75 118.914 2.493 13.036 1.00 0.00 H new ATOM 0 HH12 ARG A 75 117.347 1.702 13.232 1.00 0.00 H new ATOM 0 HH21 ARG A 75 116.921 1.144 9.806 1.00 0.00 H new ATOM 0 HH22 ARG A 75 116.228 0.945 11.419 1.00 0.00 H new ATOM 1190 N ASP A 76 122.784 -0.464 7.490 1.00 0.00 N ATOM 1191 CA ASP A 76 123.249 -1.851 7.215 1.00 0.00 C ATOM 1192 C ASP A 76 124.639 -1.841 6.577 1.00 0.00 C ATOM 1193 O ASP A 76 125.467 -2.677 6.877 1.00 0.00 O ATOM 1194 CB ASP A 76 122.262 -2.542 6.272 1.00 0.00 C ATOM 1195 CG ASP A 76 120.950 -2.814 7.013 1.00 0.00 C ATOM 1196 OD1 ASP A 76 120.968 -2.795 8.233 1.00 0.00 O ATOM 1197 OD2 ASP A 76 119.953 -3.040 6.348 1.00 0.00 O ATOM 0 H ASP A 76 122.001 -0.149 6.918 1.00 0.00 H new ATOM 0 HA ASP A 76 123.303 -2.393 8.159 1.00 0.00 H new ATOM 0 HB2 ASP A 76 122.076 -1.915 5.400 1.00 0.00 H new ATOM 0 HB3 ASP A 76 122.686 -3.477 5.907 1.00 0.00 H new ATOM 1202 N CYS A 77 124.913 -0.914 5.702 1.00 0.00 N ATOM 1203 CA CYS A 77 126.258 -0.881 5.061 1.00 0.00 C ATOM 1204 C CYS A 77 127.332 -0.556 6.104 1.00 0.00 C ATOM 1205 O CYS A 77 128.413 -1.109 6.071 1.00 0.00 O ATOM 1206 CB CYS A 77 126.274 0.185 3.965 1.00 0.00 C ATOM 1207 SG CYS A 77 125.241 -0.359 2.582 1.00 0.00 S ATOM 0 H CYS A 77 124.268 -0.182 5.404 1.00 0.00 H new ATOM 0 HA CYS A 77 126.468 -1.858 4.627 1.00 0.00 H new ATOM 0 HB2 CYS A 77 125.905 1.132 4.358 1.00 0.00 H new ATOM 0 HB3 CYS A 77 127.295 0.357 3.625 1.00 0.00 H new ATOM 0 HG CYS A 77 125.056 -1.644 2.658 1.00 0.00 H new ATOM 1213 N PHE A 78 127.070 0.344 7.015 1.00 0.00 N ATOM 1214 CA PHE A 78 128.117 0.683 8.017 1.00 0.00 C ATOM 1215 C PHE A 78 128.522 -0.572 8.789 1.00 0.00 C ATOM 1216 O PHE A 78 129.672 -0.965 8.791 1.00 0.00 O ATOM 1217 CB PHE A 78 127.575 1.738 8.987 1.00 0.00 C ATOM 1218 CG PHE A 78 128.633 2.084 10.010 1.00 0.00 C ATOM 1219 CD1 PHE A 78 129.538 3.124 9.761 1.00 0.00 C ATOM 1220 CD2 PHE A 78 128.700 1.372 11.214 1.00 0.00 C ATOM 1221 CE1 PHE A 78 130.511 3.449 10.715 1.00 0.00 C ATOM 1222 CE2 PHE A 78 129.674 1.698 12.167 1.00 0.00 C ATOM 1223 CZ PHE A 78 130.579 2.736 11.918 1.00 0.00 C ATOM 0 H PHE A 78 126.190 0.851 7.107 1.00 0.00 H new ATOM 0 HA PHE A 78 128.992 1.081 7.503 1.00 0.00 H new ATOM 0 HB2 PHE A 78 127.280 2.633 8.438 1.00 0.00 H new ATOM 0 HB3 PHE A 78 126.682 1.362 9.486 1.00 0.00 H new ATOM 0 HD1 PHE A 78 129.486 3.675 8.834 1.00 0.00 H new ATOM 0 HD2 PHE A 78 128.001 0.572 11.408 1.00 0.00 H new ATOM 0 HE1 PHE A 78 131.209 4.250 10.522 1.00 0.00 H new ATOM 0 HE2 PHE A 78 129.726 1.148 13.095 1.00 0.00 H new ATOM 0 HZ PHE A 78 131.329 2.987 12.653 1.00 0.00 H new ATOM 1233 N GLY A 79 127.592 -1.204 9.447 1.00 0.00 N ATOM 1234 CA GLY A 79 127.926 -2.432 10.223 1.00 0.00 C ATOM 1235 C GLY A 79 128.454 -3.529 9.292 1.00 0.00 C ATOM 1236 O GLY A 79 129.293 -4.321 9.664 1.00 0.00 O ATOM 0 H GLY A 79 126.612 -0.923 9.482 1.00 0.00 H new ATOM 0 HA2 GLY A 79 128.674 -2.198 10.980 1.00 0.00 H new ATOM 0 HA3 GLY A 79 127.041 -2.789 10.749 1.00 0.00 H new ATOM 1240 N CYS A 80 127.969 -3.589 8.088 1.00 0.00 N ATOM 1241 CA CYS A 80 128.452 -4.647 7.154 1.00 0.00 C ATOM 1242 C CYS A 80 129.914 -4.389 6.786 1.00 0.00 C ATOM 1243 O CYS A 80 130.757 -5.259 6.892 1.00 0.00 O ATOM 1244 CB CYS A 80 127.602 -4.623 5.885 1.00 0.00 C ATOM 1245 SG CYS A 80 128.107 -5.975 4.792 1.00 0.00 S ATOM 0 H CYS A 80 127.264 -2.958 7.708 1.00 0.00 H new ATOM 0 HA CYS A 80 128.370 -5.620 7.639 1.00 0.00 H new ATOM 0 HB2 CYS A 80 126.547 -4.722 6.140 1.00 0.00 H new ATOM 0 HB3 CYS A 80 127.718 -3.667 5.375 1.00 0.00 H new ATOM 0 HG CYS A 80 128.310 -5.512 3.594 1.00 0.00 H new ATOM 1251 N LEU A 81 130.222 -3.197 6.368 1.00 0.00 N ATOM 1252 CA LEU A 81 131.636 -2.890 6.012 1.00 0.00 C ATOM 1253 C LEU A 81 132.487 -2.862 7.288 1.00 0.00 C ATOM 1254 O LEU A 81 133.611 -3.324 7.302 1.00 0.00 O ATOM 1255 CB LEU A 81 131.699 -1.531 5.308 1.00 0.00 C ATOM 1256 CG LEU A 81 130.849 -1.567 4.028 1.00 0.00 C ATOM 1257 CD1 LEU A 81 130.868 -0.185 3.368 1.00 0.00 C ATOM 1258 CD2 LEU A 81 131.407 -2.617 3.047 1.00 0.00 C ATOM 0 H LEU A 81 129.564 -2.426 6.257 1.00 0.00 H new ATOM 0 HA LEU A 81 132.023 -3.657 5.342 1.00 0.00 H new ATOM 0 HB2 LEU A 81 131.336 -0.749 5.975 1.00 0.00 H new ATOM 0 HB3 LEU A 81 132.732 -1.286 5.062 1.00 0.00 H new ATOM 0 HG LEU A 81 129.825 -1.837 4.287 1.00 0.00 H new ATOM 0 HD11 LEU A 81 130.266 -0.207 2.460 1.00 0.00 H new ATOM 0 HD12 LEU A 81 130.458 0.553 4.057 1.00 0.00 H new ATOM 0 HD13 LEU A 81 131.894 0.084 3.117 1.00 0.00 H new ATOM 0 HD21 LEU A 81 130.796 -2.633 2.144 1.00 0.00 H new ATOM 0 HD22 LEU A 81 132.434 -2.361 2.786 1.00 0.00 H new ATOM 0 HD23 LEU A 81 131.386 -3.601 3.516 1.00 0.00 H new ATOM 1270 N ARG A 82 131.968 -2.316 8.356 1.00 0.00 N ATOM 1271 CA ARG A 82 132.761 -2.256 9.621 1.00 0.00 C ATOM 1272 C ARG A 82 133.074 -3.665 10.133 1.00 0.00 C ATOM 1273 O ARG A 82 134.153 -3.926 10.626 1.00 0.00 O ATOM 1274 CB ARG A 82 131.983 -1.489 10.694 1.00 0.00 C ATOM 1275 CG ARG A 82 132.855 -1.362 11.947 1.00 0.00 C ATOM 1276 CD ARG A 82 132.144 -0.508 12.997 1.00 0.00 C ATOM 1277 NE ARG A 82 132.999 -0.425 14.214 1.00 0.00 N ATOM 1278 CZ ARG A 82 132.749 0.467 15.132 1.00 0.00 C ATOM 1279 NH1 ARG A 82 131.763 1.308 14.974 1.00 0.00 N ATOM 1280 NH2 ARG A 82 133.488 0.520 16.207 1.00 0.00 N ATOM 0 H ARG A 82 131.034 -1.910 8.408 1.00 0.00 H new ATOM 0 HA ARG A 82 133.698 -1.740 9.409 1.00 0.00 H new ATOM 0 HB2 ARG A 82 131.708 -0.501 10.325 1.00 0.00 H new ATOM 0 HB3 ARG A 82 131.056 -2.010 10.932 1.00 0.00 H new ATOM 0 HG2 ARG A 82 133.067 -2.351 12.354 1.00 0.00 H new ATOM 0 HG3 ARG A 82 133.813 -0.911 11.689 1.00 0.00 H new ATOM 0 HD2 ARG A 82 131.952 0.490 12.603 1.00 0.00 H new ATOM 0 HD3 ARG A 82 131.177 -0.945 13.245 1.00 0.00 H new ATOM 0 HE ARG A 82 133.782 -1.068 14.330 1.00 0.00 H new ATOM 0 HH11 ARG A 82 131.188 1.267 14.132 1.00 0.00 H new ATOM 0 HH12 ARG A 82 131.568 2.006 15.692 1.00 0.00 H new ATOM 0 HH21 ARG A 82 134.260 -0.136 16.328 1.00 0.00 H new ATOM 0 HH22 ARG A 82 133.294 1.217 16.926 1.00 0.00 H new ATOM 1294 N GLU A 83 132.140 -4.572 10.045 1.00 0.00 N ATOM 1295 CA GLU A 83 132.388 -5.952 10.553 1.00 0.00 C ATOM 1296 C GLU A 83 133.409 -6.674 9.672 1.00 0.00 C ATOM 1297 O GLU A 83 134.267 -7.376 10.169 1.00 0.00 O ATOM 1298 CB GLU A 83 131.073 -6.738 10.570 1.00 0.00 C ATOM 1299 CG GLU A 83 130.178 -6.217 11.698 1.00 0.00 C ATOM 1300 CD GLU A 83 130.760 -6.630 13.050 1.00 0.00 C ATOM 1301 OE1 GLU A 83 131.537 -7.570 13.076 1.00 0.00 O ATOM 1302 OE2 GLU A 83 130.420 -5.999 14.038 1.00 0.00 O ATOM 0 H GLU A 83 131.215 -4.417 9.643 1.00 0.00 H new ATOM 0 HA GLU A 83 132.787 -5.885 11.565 1.00 0.00 H new ATOM 0 HB2 GLU A 83 130.564 -6.636 9.612 1.00 0.00 H new ATOM 0 HB3 GLU A 83 131.274 -7.800 10.712 1.00 0.00 H new ATOM 0 HG2 GLU A 83 130.100 -5.131 11.641 1.00 0.00 H new ATOM 0 HG3 GLU A 83 129.169 -6.615 11.588 1.00 0.00 H new ATOM 1309 N TRP A 84 133.354 -6.503 8.378 1.00 0.00 N ATOM 1310 CA TRP A 84 134.354 -7.174 7.502 1.00 0.00 C ATOM 1311 C TRP A 84 135.754 -6.686 7.891 1.00 0.00 C ATOM 1312 O TRP A 84 136.689 -7.455 7.995 1.00 0.00 O ATOM 1313 CB TRP A 84 134.068 -6.822 6.041 1.00 0.00 C ATOM 1314 CG TRP A 84 134.961 -7.624 5.148 1.00 0.00 C ATOM 1315 CD1 TRP A 84 134.646 -8.828 4.619 1.00 0.00 C ATOM 1316 CD2 TRP A 84 136.303 -7.308 4.675 1.00 0.00 C ATOM 1317 NE1 TRP A 84 135.706 -9.268 3.846 1.00 0.00 N ATOM 1318 CE2 TRP A 84 136.750 -8.366 3.850 1.00 0.00 C ATOM 1319 CE3 TRP A 84 137.168 -6.217 4.877 1.00 0.00 C ATOM 1320 CZ2 TRP A 84 138.008 -8.344 3.248 1.00 0.00 C ATOM 1321 CZ3 TRP A 84 138.435 -6.193 4.273 1.00 0.00 C ATOM 1322 CH2 TRP A 84 138.854 -7.255 3.459 1.00 0.00 C ATOM 0 H TRP A 84 132.663 -5.930 7.893 1.00 0.00 H new ATOM 0 HA TRP A 84 134.295 -8.255 7.624 1.00 0.00 H new ATOM 0 HB2 TRP A 84 133.023 -7.025 5.805 1.00 0.00 H new ATOM 0 HB3 TRP A 84 134.231 -5.757 5.874 1.00 0.00 H new ATOM 0 HD1 TRP A 84 133.719 -9.359 4.774 1.00 0.00 H new ATOM 0 HE1 TRP A 84 135.714 -10.151 3.336 1.00 0.00 H new ATOM 0 HE3 TRP A 84 136.855 -5.393 5.501 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 138.325 -9.165 2.622 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 139.091 -5.351 4.436 1.00 0.00 H new ATOM 0 HH2 TRP A 84 139.830 -7.230 2.996 1.00 0.00 H new ATOM 1333 N CYS A 85 135.902 -5.404 8.095 1.00 0.00 N ATOM 1334 CA CYS A 85 137.239 -4.853 8.465 1.00 0.00 C ATOM 1335 C CYS A 85 137.715 -5.485 9.775 1.00 0.00 C ATOM 1336 O CYS A 85 138.873 -5.817 9.933 1.00 0.00 O ATOM 1337 CB CYS A 85 137.125 -3.335 8.640 1.00 0.00 C ATOM 1338 SG CYS A 85 137.053 -2.544 7.014 1.00 0.00 S ATOM 0 H CYS A 85 135.154 -4.714 8.021 1.00 0.00 H new ATOM 0 HA CYS A 85 137.958 -5.080 7.678 1.00 0.00 H new ATOM 0 HB2 CYS A 85 136.232 -3.091 9.215 1.00 0.00 H new ATOM 0 HB3 CYS A 85 137.979 -2.958 9.202 1.00 0.00 H new ATOM 0 HG CYS A 85 136.954 -1.256 7.162 1.00 0.00 H new ATOM 1344 N ASP A 86 136.828 -5.657 10.713 1.00 0.00 N ATOM 1345 CA ASP A 86 137.218 -6.272 12.013 1.00 0.00 C ATOM 1346 C ASP A 86 137.764 -7.684 11.783 1.00 0.00 C ATOM 1347 O ASP A 86 138.609 -8.157 12.517 1.00 0.00 O ATOM 1348 CB ASP A 86 136.002 -6.335 12.940 1.00 0.00 C ATOM 1349 CG ASP A 86 135.642 -4.922 13.408 1.00 0.00 C ATOM 1350 OD1 ASP A 86 136.506 -4.062 13.351 1.00 0.00 O ATOM 1351 OD2 ASP A 86 134.510 -4.725 13.818 1.00 0.00 O ATOM 0 H ASP A 86 135.845 -5.397 10.636 1.00 0.00 H new ATOM 0 HA ASP A 86 137.994 -5.662 12.475 1.00 0.00 H new ATOM 0 HB2 ASP A 86 135.156 -6.783 12.418 1.00 0.00 H new ATOM 0 HB3 ASP A 86 136.219 -6.970 13.799 1.00 0.00 H new ATOM 1356 N ALA A 87 137.272 -8.373 10.786 1.00 0.00 N ATOM 1357 CA ALA A 87 137.749 -9.766 10.533 1.00 0.00 C ATOM 1358 C ALA A 87 138.996 -9.749 9.647 1.00 0.00 C ATOM 1359 O ALA A 87 139.878 -10.571 9.799 1.00 0.00 O ATOM 1360 CB ALA A 87 136.645 -10.561 9.829 1.00 0.00 C ATOM 0 H ALA A 87 136.562 -8.033 10.137 1.00 0.00 H new ATOM 0 HA ALA A 87 137.996 -10.232 11.487 1.00 0.00 H new ATOM 0 HB1 ALA A 87 136.991 -11.578 9.643 1.00 0.00 H new ATOM 0 HB2 ALA A 87 135.757 -10.589 10.461 1.00 0.00 H new ATOM 0 HB3 ALA A 87 136.400 -10.082 8.881 1.00 0.00 H new ATOM 1366 N PHE A 88 139.060 -8.845 8.703 1.00 0.00 N ATOM 1367 CA PHE A 88 140.235 -8.800 7.778 1.00 0.00 C ATOM 1368 C PHE A 88 141.124 -7.603 8.106 1.00 0.00 C ATOM 1369 O PHE A 88 142.062 -7.708 8.871 1.00 0.00 O ATOM 1370 CB PHE A 88 139.733 -8.671 6.340 1.00 0.00 C ATOM 1371 CG PHE A 88 138.999 -9.933 5.949 1.00 0.00 C ATOM 1372 CD1 PHE A 88 139.717 -11.045 5.494 1.00 0.00 C ATOM 1373 CD2 PHE A 88 137.603 -9.991 6.041 1.00 0.00 C ATOM 1374 CE1 PHE A 88 139.039 -12.215 5.131 1.00 0.00 C ATOM 1375 CE2 PHE A 88 136.924 -11.160 5.678 1.00 0.00 C ATOM 1376 CZ PHE A 88 137.643 -12.272 5.222 1.00 0.00 C ATOM 0 H PHE A 88 138.348 -8.134 8.532 1.00 0.00 H new ATOM 0 HA PHE A 88 140.815 -9.715 7.895 1.00 0.00 H new ATOM 0 HB2 PHE A 88 139.071 -7.810 6.250 1.00 0.00 H new ATOM 0 HB3 PHE A 88 140.571 -8.501 5.664 1.00 0.00 H new ATOM 0 HD1 PHE A 88 140.794 -11.001 5.423 1.00 0.00 H new ATOM 0 HD2 PHE A 88 137.050 -9.133 6.392 1.00 0.00 H new ATOM 0 HE1 PHE A 88 139.593 -13.074 4.781 1.00 0.00 H new ATOM 0 HE2 PHE A 88 135.847 -11.204 5.749 1.00 0.00 H new ATOM 0 HZ PHE A 88 137.120 -13.174 4.940 1.00 0.00 H new ATOM 1386 N LEU A 89 140.845 -6.463 7.531 1.00 0.00 N ATOM 1387 CA LEU A 89 141.678 -5.255 7.803 1.00 0.00 C ATOM 1388 C LEU A 89 141.140 -4.545 9.047 1.00 0.00 C ATOM 1389 O LEU A 89 141.748 -4.686 10.095 1.00 0.00 O ATOM 1390 CB LEU A 89 141.604 -4.312 6.593 1.00 0.00 C ATOM 1391 CG LEU A 89 142.259 -2.961 6.919 1.00 0.00 C ATOM 1392 CD1 LEU A 89 143.682 -3.180 7.448 1.00 0.00 C ATOM 1393 CD2 LEU A 89 142.318 -2.113 5.644 1.00 0.00 C ATOM 1394 OXT LEU A 89 140.130 -3.873 8.929 1.00 0.00 O ATOM 0 H LEU A 89 140.072 -6.316 6.882 1.00 0.00 H new ATOM 0 HA LEU A 89 142.715 -5.546 7.973 1.00 0.00 H new ATOM 0 HB2 LEU A 89 142.104 -4.768 5.739 1.00 0.00 H new ATOM 0 HB3 LEU A 89 140.563 -4.158 6.308 1.00 0.00 H new ATOM 0 HG LEU A 89 141.671 -2.450 7.681 1.00 0.00 H new ATOM 0 HD11 LEU A 89 144.138 -2.216 7.676 1.00 0.00 H new ATOM 0 HD12 LEU A 89 143.644 -3.787 8.353 1.00 0.00 H new ATOM 0 HD13 LEU A 89 144.276 -3.692 6.692 1.00 0.00 H new ATOM 0 HD21 LEU A 89 142.782 -1.152 5.867 1.00 0.00 H new ATOM 0 HD22 LEU A 89 142.906 -2.633 4.888 1.00 0.00 H new ATOM 0 HD23 LEU A 89 141.308 -1.950 5.269 1.00 0.00 H new TER 1406 LEU A 89 ATOM 1407 N MET B 1 165.601 -9.109 -3.104 1.00 0.00 N ATOM 1408 CA MET B 1 166.971 -9.187 -2.522 1.00 0.00 C ATOM 1409 C MET B 1 167.486 -7.776 -2.229 1.00 0.00 C ATOM 1410 O MET B 1 168.416 -7.593 -1.469 1.00 0.00 O ATOM 1411 CB MET B 1 167.908 -9.872 -3.520 1.00 0.00 C ATOM 1412 CG MET B 1 167.906 -9.095 -4.839 1.00 0.00 C ATOM 1413 SD MET B 1 168.744 -10.066 -6.116 1.00 0.00 S ATOM 1414 CE MET B 1 167.310 -11.038 -6.645 1.00 0.00 C ATOM 0 H1 MET B 1 165.320 -10.046 -3.458 1.00 0.00 H new ATOM 0 H2 MET B 1 164.930 -8.800 -2.372 1.00 0.00 H new ATOM 0 H3 MET B 1 165.596 -8.427 -3.889 1.00 0.00 H new ATOM 0 HA MET B 1 166.939 -9.761 -1.596 1.00 0.00 H new ATOM 0 HB2 MET B 1 168.919 -9.917 -3.114 1.00 0.00 H new ATOM 0 HB3 MET B 1 167.587 -10.899 -3.690 1.00 0.00 H new ATOM 0 HG2 MET B 1 166.882 -8.880 -5.145 1.00 0.00 H new ATOM 0 HG3 MET B 1 168.408 -8.136 -4.709 1.00 0.00 H new ATOM 0 HE1 MET B 1 167.643 -12.013 -7.002 1.00 0.00 H new ATOM 0 HE2 MET B 1 166.631 -11.172 -5.803 1.00 0.00 H new ATOM 0 HE3 MET B 1 166.792 -10.515 -7.449 1.00 0.00 H new ATOM 1426 N THR B 2 166.895 -6.774 -2.834 1.00 0.00 N ATOM 1427 CA THR B 2 167.356 -5.367 -2.604 1.00 0.00 C ATOM 1428 C THR B 2 166.405 -4.646 -1.645 1.00 0.00 C ATOM 1429 O THR B 2 166.757 -3.649 -1.046 1.00 0.00 O ATOM 1430 CB THR B 2 167.366 -4.621 -3.940 1.00 0.00 C ATOM 1431 OG1 THR B 2 168.195 -5.314 -4.864 1.00 0.00 O ATOM 1432 CG2 THR B 2 167.904 -3.206 -3.730 1.00 0.00 C ATOM 0 H THR B 2 166.111 -6.870 -3.479 1.00 0.00 H new ATOM 0 HA THR B 2 168.356 -5.388 -2.170 1.00 0.00 H new ATOM 0 HB THR B 2 166.351 -4.567 -4.334 1.00 0.00 H new ATOM 0 HG1 THR B 2 168.200 -4.837 -5.720 1.00 0.00 H new ATOM 0 HG21 THR B 2 167.911 -2.675 -4.682 1.00 0.00 H new ATOM 0 HG22 THR B 2 167.266 -2.676 -3.023 1.00 0.00 H new ATOM 0 HG23 THR B 2 168.919 -3.257 -3.335 1.00 0.00 H new ATOM 1440 N THR B 3 165.204 -5.129 -1.499 1.00 0.00 N ATOM 1441 CA THR B 3 164.240 -4.450 -0.588 1.00 0.00 C ATOM 1442 C THR B 3 164.647 -4.677 0.868 1.00 0.00 C ATOM 1443 O THR B 3 165.302 -5.646 1.199 1.00 0.00 O ATOM 1444 CB THR B 3 162.839 -5.021 -0.817 1.00 0.00 C ATOM 1445 OG1 THR B 3 162.839 -6.409 -0.508 1.00 0.00 O ATOM 1446 CG2 THR B 3 162.439 -4.821 -2.280 1.00 0.00 C ATOM 0 H THR B 3 164.848 -5.962 -1.969 1.00 0.00 H new ATOM 0 HA THR B 3 164.243 -3.380 -0.797 1.00 0.00 H new ATOM 0 HB THR B 3 162.125 -4.506 -0.174 1.00 0.00 H new ATOM 0 HG1 THR B 3 161.942 -6.776 -0.652 1.00 0.00 H new ATOM 0 HG21 THR B 3 161.441 -5.228 -2.443 1.00 0.00 H new ATOM 0 HG22 THR B 3 162.440 -3.757 -2.515 1.00 0.00 H new ATOM 0 HG23 THR B 3 163.151 -5.336 -2.925 1.00 0.00 H new ATOM 1454 N SER B 4 164.252 -3.792 1.742 1.00 0.00 N ATOM 1455 CA SER B 4 164.601 -3.957 3.180 1.00 0.00 C ATOM 1456 C SER B 4 163.720 -5.053 3.779 1.00 0.00 C ATOM 1457 O SER B 4 162.744 -5.475 3.195 1.00 0.00 O ATOM 1458 CB SER B 4 164.360 -2.642 3.923 1.00 0.00 C ATOM 1459 OG SER B 4 164.339 -2.893 5.323 1.00 0.00 O ATOM 0 H SER B 4 163.702 -2.962 1.521 1.00 0.00 H new ATOM 0 HA SER B 4 165.651 -4.232 3.276 1.00 0.00 H new ATOM 0 HB2 SER B 4 165.145 -1.925 3.682 1.00 0.00 H new ATOM 0 HB3 SER B 4 163.416 -2.199 3.607 1.00 0.00 H new ATOM 0 HG SER B 4 164.187 -2.053 5.804 1.00 0.00 H new ATOM 1465 N GLN B 5 164.081 -5.528 4.938 1.00 0.00 N ATOM 1466 CA GLN B 5 163.301 -6.616 5.592 1.00 0.00 C ATOM 1467 C GLN B 5 161.872 -6.152 5.883 1.00 0.00 C ATOM 1468 O GLN B 5 160.969 -6.953 6.020 1.00 0.00 O ATOM 1469 CB GLN B 5 163.982 -6.999 6.906 1.00 0.00 C ATOM 1470 CG GLN B 5 165.301 -7.714 6.611 1.00 0.00 C ATOM 1471 CD GLN B 5 166.002 -8.048 7.929 1.00 0.00 C ATOM 1472 OE1 GLN B 5 165.702 -7.467 8.953 1.00 0.00 O ATOM 1473 NE2 GLN B 5 166.932 -8.963 7.946 1.00 0.00 N ATOM 0 H GLN B 5 164.892 -5.205 5.466 1.00 0.00 H new ATOM 0 HA GLN B 5 163.262 -7.475 4.922 1.00 0.00 H new ATOM 0 HB2 GLN B 5 164.166 -6.107 7.505 1.00 0.00 H new ATOM 0 HB3 GLN B 5 163.329 -7.647 7.491 1.00 0.00 H new ATOM 0 HG2 GLN B 5 165.114 -8.626 6.044 1.00 0.00 H new ATOM 0 HG3 GLN B 5 165.941 -7.081 5.996 1.00 0.00 H new ATOM 0 HE21 GLN B 5 167.184 -9.451 7.086 1.00 0.00 H new ATOM 0 HE22 GLN B 5 167.407 -9.191 8.819 1.00 0.00 H new ATOM 1482 N LYS B 6 161.656 -4.869 5.991 1.00 0.00 N ATOM 1483 CA LYS B 6 160.287 -4.358 6.287 1.00 0.00 C ATOM 1484 C LYS B 6 159.328 -4.772 5.171 1.00 0.00 C ATOM 1485 O LYS B 6 158.177 -5.073 5.413 1.00 0.00 O ATOM 1486 CB LYS B 6 160.335 -2.833 6.366 1.00 0.00 C ATOM 1487 CG LYS B 6 161.095 -2.415 7.626 1.00 0.00 C ATOM 1488 CD LYS B 6 161.146 -0.889 7.710 1.00 0.00 C ATOM 1489 CE LYS B 6 161.906 -0.478 8.971 1.00 0.00 C ATOM 1490 NZ LYS B 6 161.091 -0.818 10.170 1.00 0.00 N ATOM 0 H LYS B 6 162.372 -4.150 5.886 1.00 0.00 H new ATOM 0 HA LYS B 6 159.939 -4.773 7.233 1.00 0.00 H new ATOM 0 HB2 LYS B 6 160.825 -2.427 5.481 1.00 0.00 H new ATOM 0 HB3 LYS B 6 159.324 -2.427 6.386 1.00 0.00 H new ATOM 0 HG2 LYS B 6 160.605 -2.822 8.511 1.00 0.00 H new ATOM 0 HG3 LYS B 6 162.106 -2.822 7.606 1.00 0.00 H new ATOM 0 HD2 LYS B 6 161.637 -0.481 6.826 1.00 0.00 H new ATOM 0 HD3 LYS B 6 160.136 -0.480 7.731 1.00 0.00 H new ATOM 0 HE2 LYS B 6 162.867 -0.990 9.013 1.00 0.00 H new ATOM 0 HE3 LYS B 6 162.115 0.591 8.951 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 161.441 -0.284 10.991 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 160.096 -0.571 9.995 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 161.166 -1.837 10.363 1.00 0.00 H new ATOM 1504 N HIS B 7 159.780 -4.771 3.952 1.00 0.00 N ATOM 1505 CA HIS B 7 158.875 -5.143 2.830 1.00 0.00 C ATOM 1506 C HIS B 7 158.335 -6.564 3.031 1.00 0.00 C ATOM 1507 O HIS B 7 157.147 -6.801 2.950 1.00 0.00 O ATOM 1508 CB HIS B 7 159.654 -5.055 1.512 1.00 0.00 C ATOM 1509 CG HIS B 7 158.864 -5.686 0.395 1.00 0.00 C ATOM 1510 ND1 HIS B 7 157.912 -4.988 -0.334 1.00 0.00 N ATOM 1511 CD2 HIS B 7 158.876 -6.958 -0.122 1.00 0.00 C ATOM 1512 CE1 HIS B 7 157.395 -5.838 -1.243 1.00 0.00 C ATOM 1513 NE2 HIS B 7 157.950 -7.048 -1.153 1.00 0.00 N ATOM 0 H HIS B 7 160.734 -4.530 3.682 1.00 0.00 H new ATOM 0 HA HIS B 7 158.029 -4.457 2.802 1.00 0.00 H new ATOM 0 HB2 HIS B 7 159.864 -4.012 1.274 1.00 0.00 H new ATOM 0 HB3 HIS B 7 160.616 -5.558 1.616 1.00 0.00 H new ATOM 0 HD2 HIS B 7 159.508 -7.764 0.220 1.00 0.00 H new ATOM 0 HE1 HIS B 7 156.628 -5.573 -1.955 1.00 0.00 H new ATOM 0 HE2 HIS B 7 157.738 -7.868 -1.722 1.00 0.00 H new ATOM 1521 N ARG B 8 159.196 -7.514 3.295 1.00 0.00 N ATOM 1522 CA ARG B 8 158.732 -8.915 3.501 1.00 0.00 C ATOM 1523 C ARG B 8 157.964 -9.036 4.818 1.00 0.00 C ATOM 1524 O ARG B 8 157.032 -9.806 4.935 1.00 0.00 O ATOM 1525 CB ARG B 8 159.943 -9.850 3.526 1.00 0.00 C ATOM 1526 CG ARG B 8 160.545 -9.944 2.124 1.00 0.00 C ATOM 1527 CD ARG B 8 161.795 -10.827 2.160 1.00 0.00 C ATOM 1528 NE ARG B 8 162.253 -11.096 0.768 1.00 0.00 N ATOM 1529 CZ ARG B 8 163.455 -11.552 0.551 1.00 0.00 C ATOM 1530 NH1 ARG B 8 164.265 -11.764 1.552 1.00 0.00 N ATOM 1531 NH2 ARG B 8 163.849 -11.798 -0.669 1.00 0.00 N ATOM 0 H ARG B 8 160.203 -7.377 3.377 1.00 0.00 H new ATOM 0 HA ARG B 8 158.067 -9.192 2.683 1.00 0.00 H new ATOM 0 HB2 ARG B 8 160.688 -9.478 4.229 1.00 0.00 H new ATOM 0 HB3 ARG B 8 159.644 -10.840 3.872 1.00 0.00 H new ATOM 0 HG2 ARG B 8 159.814 -10.359 1.430 1.00 0.00 H new ATOM 0 HG3 ARG B 8 160.801 -8.949 1.760 1.00 0.00 H new ATOM 0 HD2 ARG B 8 162.586 -10.334 2.725 1.00 0.00 H new ATOM 0 HD3 ARG B 8 161.576 -11.765 2.670 1.00 0.00 H new ATOM 0 HE ARG B 8 161.625 -10.923 -0.017 1.00 0.00 H new ATOM 0 HH11 ARG B 8 163.958 -11.573 2.506 1.00 0.00 H new ATOM 0 HH12 ARG B 8 165.205 -12.121 1.381 1.00 0.00 H new ATOM 0 HH21 ARG B 8 163.217 -11.633 -1.452 1.00 0.00 H new ATOM 0 HH22 ARG B 8 164.789 -12.155 -0.839 1.00 0.00 H new ATOM 1545 N ASP B 9 158.341 -8.277 5.803 1.00 0.00 N ATOM 1546 CA ASP B 9 157.625 -8.344 7.107 1.00 0.00 C ATOM 1547 C ASP B 9 156.245 -7.690 6.986 1.00 0.00 C ATOM 1548 O ASP B 9 155.285 -8.130 7.587 1.00 0.00 O ATOM 1549 CB ASP B 9 158.445 -7.639 8.189 1.00 0.00 C ATOM 1550 CG ASP B 9 159.665 -8.494 8.548 1.00 0.00 C ATOM 1551 OD1 ASP B 9 159.637 -9.682 8.268 1.00 0.00 O ATOM 1552 OD2 ASP B 9 160.604 -7.947 9.102 1.00 0.00 O ATOM 0 H ASP B 9 159.114 -7.612 5.764 1.00 0.00 H new ATOM 0 HA ASP B 9 157.495 -9.390 7.384 1.00 0.00 H new ATOM 0 HB2 ASP B 9 158.766 -6.659 7.836 1.00 0.00 H new ATOM 0 HB3 ASP B 9 157.831 -7.473 9.074 1.00 0.00 H new ATOM 1557 N PHE B 10 156.143 -6.630 6.230 1.00 0.00 N ATOM 1558 CA PHE B 10 154.828 -5.938 6.093 1.00 0.00 C ATOM 1559 C PHE B 10 153.833 -6.838 5.354 1.00 0.00 C ATOM 1560 O PHE B 10 152.674 -6.917 5.710 1.00 0.00 O ATOM 1561 CB PHE B 10 155.019 -4.643 5.297 1.00 0.00 C ATOM 1562 CG PHE B 10 153.745 -3.832 5.324 1.00 0.00 C ATOM 1563 CD1 PHE B 10 152.746 -4.057 4.369 1.00 0.00 C ATOM 1564 CD2 PHE B 10 153.564 -2.849 6.308 1.00 0.00 C ATOM 1565 CE1 PHE B 10 151.566 -3.302 4.397 1.00 0.00 C ATOM 1566 CE2 PHE B 10 152.386 -2.092 6.334 1.00 0.00 C ATOM 1567 CZ PHE B 10 151.386 -2.319 5.379 1.00 0.00 C ATOM 0 H PHE B 10 156.911 -6.214 5.703 1.00 0.00 H new ATOM 0 HA PHE B 10 154.439 -5.713 7.086 1.00 0.00 H new ATOM 0 HB2 PHE B 10 155.839 -4.063 5.720 1.00 0.00 H new ATOM 0 HB3 PHE B 10 155.291 -4.875 4.267 1.00 0.00 H new ATOM 0 HD1 PHE B 10 152.885 -4.813 3.610 1.00 0.00 H new ATOM 0 HD2 PHE B 10 154.333 -2.676 7.046 1.00 0.00 H new ATOM 0 HE1 PHE B 10 150.795 -3.478 3.661 1.00 0.00 H new ATOM 0 HE2 PHE B 10 152.248 -1.333 7.090 1.00 0.00 H new ATOM 0 HZ PHE B 10 150.477 -1.736 5.400 1.00 0.00 H new ATOM 1577 N VAL B 11 154.272 -7.511 4.325 1.00 0.00 N ATOM 1578 CA VAL B 11 153.346 -8.396 3.561 1.00 0.00 C ATOM 1579 C VAL B 11 153.240 -9.759 4.249 1.00 0.00 C ATOM 1580 O VAL B 11 152.815 -10.730 3.653 1.00 0.00 O ATOM 1581 CB VAL B 11 153.881 -8.581 2.139 1.00 0.00 C ATOM 1582 CG1 VAL B 11 154.092 -7.210 1.491 1.00 0.00 C ATOM 1583 CG2 VAL B 11 155.212 -9.329 2.195 1.00 0.00 C ATOM 0 H VAL B 11 155.232 -7.486 3.980 1.00 0.00 H new ATOM 0 HA VAL B 11 152.358 -7.938 3.525 1.00 0.00 H new ATOM 0 HB VAL B 11 153.165 -9.153 1.550 1.00 0.00 H new ATOM 0 HG11 VAL B 11 154.473 -7.341 0.478 1.00 0.00 H new ATOM 0 HG12 VAL B 11 153.143 -6.675 1.455 1.00 0.00 H new ATOM 0 HG13 VAL B 11 154.810 -6.637 2.078 1.00 0.00 H new ATOM 0 HG21 VAL B 11 155.597 -9.463 1.184 1.00 0.00 H new ATOM 0 HG22 VAL B 11 155.928 -8.754 2.783 1.00 0.00 H new ATOM 0 HG23 VAL B 11 155.062 -10.304 2.658 1.00 0.00 H new ATOM 1593 N ALA B 12 153.640 -9.841 5.497 1.00 0.00 N ATOM 1594 CA ALA B 12 153.583 -11.143 6.240 1.00 0.00 C ATOM 1595 C ALA B 12 152.685 -11.010 7.472 1.00 0.00 C ATOM 1596 O ALA B 12 152.410 -11.979 8.152 1.00 0.00 O ATOM 1597 CB ALA B 12 154.996 -11.524 6.687 1.00 0.00 C ATOM 0 H ALA B 12 154.006 -9.057 6.037 1.00 0.00 H new ATOM 0 HA ALA B 12 153.175 -11.912 5.584 1.00 0.00 H new ATOM 0 HB1 ALA B 12 154.964 -12.470 7.228 1.00 0.00 H new ATOM 0 HB2 ALA B 12 155.639 -11.628 5.813 1.00 0.00 H new ATOM 0 HB3 ALA B 12 155.393 -10.746 7.339 1.00 0.00 H new ATOM 1603 N GLU B 13 152.218 -9.825 7.772 1.00 0.00 N ATOM 1604 CA GLU B 13 151.333 -9.654 8.966 1.00 0.00 C ATOM 1605 C GLU B 13 150.399 -8.448 8.750 1.00 0.00 C ATOM 1606 O GLU B 13 150.757 -7.513 8.062 1.00 0.00 O ATOM 1607 CB GLU B 13 152.205 -9.416 10.204 1.00 0.00 C ATOM 1608 CG GLU B 13 152.945 -8.086 10.064 1.00 0.00 C ATOM 1609 CD GLU B 13 154.046 -8.004 11.123 1.00 0.00 C ATOM 1610 OE1 GLU B 13 154.604 -9.038 11.451 1.00 0.00 O ATOM 1611 OE2 GLU B 13 154.312 -6.908 11.589 1.00 0.00 O ATOM 0 H GLU B 13 152.409 -8.972 7.246 1.00 0.00 H new ATOM 0 HA GLU B 13 150.730 -10.551 9.108 1.00 0.00 H new ATOM 0 HB2 GLU B 13 151.585 -9.406 11.101 1.00 0.00 H new ATOM 0 HB3 GLU B 13 152.920 -10.231 10.319 1.00 0.00 H new ATOM 0 HG2 GLU B 13 153.377 -8.001 9.067 1.00 0.00 H new ATOM 0 HG3 GLU B 13 152.249 -7.256 10.182 1.00 0.00 H new ATOM 1618 N PRO B 14 149.219 -8.446 9.339 1.00 0.00 N ATOM 1619 CA PRO B 14 148.268 -7.304 9.194 1.00 0.00 C ATOM 1620 C PRO B 14 148.978 -5.950 9.316 1.00 0.00 C ATOM 1621 O PRO B 14 150.053 -5.852 9.872 1.00 0.00 O ATOM 1622 CB PRO B 14 147.284 -7.502 10.357 1.00 0.00 C ATOM 1623 CG PRO B 14 147.279 -8.977 10.623 1.00 0.00 C ATOM 1624 CD PRO B 14 148.656 -9.514 10.193 1.00 0.00 C ATOM 0 HA PRO B 14 147.787 -7.293 8.216 1.00 0.00 H new ATOM 0 HB2 PRO B 14 147.600 -6.944 11.239 1.00 0.00 H new ATOM 0 HB3 PRO B 14 146.288 -7.146 10.094 1.00 0.00 H new ATOM 0 HG2 PRO B 14 147.099 -9.178 11.679 1.00 0.00 H new ATOM 0 HG3 PRO B 14 146.482 -9.467 10.064 1.00 0.00 H new ATOM 0 HD2 PRO B 14 149.293 -9.710 11.056 1.00 0.00 H new ATOM 0 HD3 PRO B 14 148.563 -10.452 9.646 1.00 0.00 H new ATOM 1632 N MET B 15 148.384 -4.902 8.807 1.00 0.00 N ATOM 1633 CA MET B 15 149.025 -3.556 8.903 1.00 0.00 C ATOM 1634 C MET B 15 148.507 -2.832 10.147 1.00 0.00 C ATOM 1635 O MET B 15 149.177 -1.995 10.719 1.00 0.00 O ATOM 1636 CB MET B 15 148.691 -2.739 7.653 1.00 0.00 C ATOM 1637 CG MET B 15 147.197 -2.859 7.340 1.00 0.00 C ATOM 1638 SD MET B 15 146.723 -1.571 6.155 1.00 0.00 S ATOM 1639 CE MET B 15 147.196 -2.443 4.641 1.00 0.00 C ATOM 0 H MET B 15 147.483 -4.920 8.329 1.00 0.00 H new ATOM 0 HA MET B 15 150.106 -3.672 8.977 1.00 0.00 H new ATOM 0 HB2 MET B 15 148.957 -1.693 7.809 1.00 0.00 H new ATOM 0 HB3 MET B 15 149.279 -3.095 6.807 1.00 0.00 H new ATOM 0 HG2 MET B 15 146.979 -3.845 6.929 1.00 0.00 H new ATOM 0 HG3 MET B 15 146.613 -2.759 8.255 1.00 0.00 H new ATOM 0 HE1 MET B 15 147.496 -1.719 3.883 1.00 0.00 H new ATOM 0 HE2 MET B 15 148.029 -3.113 4.852 1.00 0.00 H new ATOM 0 HE3 MET B 15 146.348 -3.022 4.275 1.00 0.00 H new ATOM 1649 N GLY B 16 147.318 -3.159 10.573 1.00 0.00 N ATOM 1650 CA GLY B 16 146.747 -2.504 11.785 1.00 0.00 C ATOM 1651 C GLY B 16 146.766 -0.984 11.617 1.00 0.00 C ATOM 1652 O GLY B 16 146.399 -0.458 10.584 1.00 0.00 O ATOM 0 H GLY B 16 146.715 -3.854 10.133 1.00 0.00 H new ATOM 0 HA2 GLY B 16 145.725 -2.847 11.947 1.00 0.00 H new ATOM 0 HA3 GLY B 16 147.322 -2.788 12.667 1.00 0.00 H new ATOM 1656 N GLU B 17 147.164 -0.273 12.643 1.00 0.00 N ATOM 1657 CA GLU B 17 147.180 1.224 12.586 1.00 0.00 C ATOM 1658 C GLU B 17 148.615 1.744 12.485 1.00 0.00 C ATOM 1659 O GLU B 17 148.921 2.824 12.951 1.00 0.00 O ATOM 1660 CB GLU B 17 146.536 1.771 13.861 1.00 0.00 C ATOM 1661 CG GLU B 17 145.034 1.480 13.833 1.00 0.00 C ATOM 1662 CD GLU B 17 144.395 1.973 15.132 1.00 0.00 C ATOM 1663 OE1 GLU B 17 145.130 2.407 16.004 1.00 0.00 O ATOM 1664 OE2 GLU B 17 143.181 1.904 15.235 1.00 0.00 O ATOM 0 H GLU B 17 147.482 -0.669 13.527 1.00 0.00 H new ATOM 0 HA GLU B 17 146.627 1.553 11.706 1.00 0.00 H new ATOM 0 HB2 GLU B 17 146.991 1.311 14.738 1.00 0.00 H new ATOM 0 HB3 GLU B 17 146.709 2.844 13.938 1.00 0.00 H new ATOM 0 HG2 GLU B 17 144.573 1.974 12.978 1.00 0.00 H new ATOM 0 HG3 GLU B 17 144.862 0.410 13.714 1.00 0.00 H new ATOM 1671 N LYS B 18 149.502 0.998 11.886 1.00 0.00 N ATOM 1672 CA LYS B 18 150.908 1.476 11.770 1.00 0.00 C ATOM 1673 C LYS B 18 150.899 2.797 10.983 1.00 0.00 C ATOM 1674 O LYS B 18 150.049 3.005 10.141 1.00 0.00 O ATOM 1675 CB LYS B 18 151.733 0.424 11.012 1.00 0.00 C ATOM 1676 CG LYS B 18 151.711 -0.917 11.772 1.00 0.00 C ATOM 1677 CD LYS B 18 152.819 -0.947 12.832 1.00 0.00 C ATOM 1678 CE LYS B 18 152.659 -2.200 13.698 1.00 0.00 C ATOM 1679 NZ LYS B 18 152.187 -3.331 12.850 1.00 0.00 N ATOM 0 H LYS B 18 149.316 0.084 11.474 1.00 0.00 H new ATOM 0 HA LYS B 18 151.347 1.632 12.756 1.00 0.00 H new ATOM 0 HB2 LYS B 18 151.330 0.289 10.009 1.00 0.00 H new ATOM 0 HB3 LYS B 18 152.761 0.769 10.898 1.00 0.00 H new ATOM 0 HG2 LYS B 18 150.740 -1.058 12.247 1.00 0.00 H new ATOM 0 HG3 LYS B 18 151.846 -1.742 11.072 1.00 0.00 H new ATOM 0 HD2 LYS B 18 153.797 -0.946 12.352 1.00 0.00 H new ATOM 0 HD3 LYS B 18 152.768 -0.053 13.453 1.00 0.00 H new ATOM 0 HE2 LYS B 18 153.609 -2.455 14.167 1.00 0.00 H new ATOM 0 HE3 LYS B 18 151.947 -2.012 14.502 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 152.350 -4.230 13.348 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 151.171 -3.221 12.658 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 152.711 -3.333 11.951 1.00 0.00 H new ATOM 1693 N PRO B 19 151.814 3.698 11.263 1.00 0.00 N ATOM 1694 CA PRO B 19 151.865 5.024 10.574 1.00 0.00 C ATOM 1695 C PRO B 19 152.175 4.901 9.076 1.00 0.00 C ATOM 1696 O PRO B 19 152.771 3.942 8.625 1.00 0.00 O ATOM 1697 CB PRO B 19 152.973 5.792 11.317 1.00 0.00 C ATOM 1698 CG PRO B 19 153.825 4.736 11.949 1.00 0.00 C ATOM 1699 CD PRO B 19 152.896 3.560 12.257 1.00 0.00 C ATOM 0 HA PRO B 19 150.901 5.532 10.609 1.00 0.00 H new ATOM 0 HB2 PRO B 19 153.554 6.408 10.630 1.00 0.00 H new ATOM 0 HB3 PRO B 19 152.553 6.461 12.068 1.00 0.00 H new ATOM 0 HG2 PRO B 19 154.628 4.431 11.278 1.00 0.00 H new ATOM 0 HG3 PRO B 19 154.295 5.109 12.859 1.00 0.00 H new ATOM 0 HD2 PRO B 19 153.412 2.605 12.157 1.00 0.00 H new ATOM 0 HD3 PRO B 19 152.512 3.609 13.276 1.00 0.00 H new ATOM 1707 N VAL B 20 151.751 5.868 8.310 1.00 0.00 N ATOM 1708 CA VAL B 20 151.980 5.832 6.839 1.00 0.00 C ATOM 1709 C VAL B 20 153.465 5.616 6.525 1.00 0.00 C ATOM 1710 O VAL B 20 153.822 4.822 5.678 1.00 0.00 O ATOM 1711 CB VAL B 20 151.513 7.155 6.228 1.00 0.00 C ATOM 1712 CG1 VAL B 20 152.401 8.302 6.724 1.00 0.00 C ATOM 1713 CG2 VAL B 20 151.595 7.067 4.704 1.00 0.00 C ATOM 0 H VAL B 20 151.250 6.691 8.645 1.00 0.00 H new ATOM 0 HA VAL B 20 151.415 5.003 6.413 1.00 0.00 H new ATOM 0 HB VAL B 20 150.483 7.346 6.529 1.00 0.00 H new ATOM 0 HG11 VAL B 20 152.062 9.240 6.285 1.00 0.00 H new ATOM 0 HG12 VAL B 20 152.339 8.367 7.810 1.00 0.00 H new ATOM 0 HG13 VAL B 20 153.434 8.116 6.430 1.00 0.00 H new ATOM 0 HG21 VAL B 20 151.263 8.009 4.267 1.00 0.00 H new ATOM 0 HG22 VAL B 20 152.625 6.872 4.406 1.00 0.00 H new ATOM 0 HG23 VAL B 20 150.956 6.258 4.351 1.00 0.00 H new ATOM 1723 N GLY B 21 154.333 6.334 7.194 1.00 0.00 N ATOM 1724 CA GLY B 21 155.793 6.192 6.930 1.00 0.00 C ATOM 1725 C GLY B 21 156.235 4.751 7.178 1.00 0.00 C ATOM 1726 O GLY B 21 157.379 4.401 6.960 1.00 0.00 O ATOM 0 H GLY B 21 154.089 7.014 7.914 1.00 0.00 H new ATOM 0 HA2 GLY B 21 156.013 6.476 5.901 1.00 0.00 H new ATOM 0 HA3 GLY B 21 156.354 6.869 7.575 1.00 0.00 H new ATOM 1730 N SER B 22 155.347 3.902 7.623 1.00 0.00 N ATOM 1731 CA SER B 22 155.734 2.486 7.867 1.00 0.00 C ATOM 1732 C SER B 22 155.690 1.728 6.542 1.00 0.00 C ATOM 1733 O SER B 22 156.310 0.696 6.381 1.00 0.00 O ATOM 1734 CB SER B 22 154.755 1.848 8.854 1.00 0.00 C ATOM 1735 OG SER B 22 155.211 0.546 9.194 1.00 0.00 O ATOM 0 H SER B 22 154.374 4.129 7.827 1.00 0.00 H new ATOM 0 HA SER B 22 156.740 2.445 8.285 1.00 0.00 H new ATOM 0 HB2 SER B 22 154.673 2.462 9.751 1.00 0.00 H new ATOM 0 HB3 SER B 22 153.760 1.793 8.413 1.00 0.00 H new ATOM 0 HG SER B 22 154.586 0.136 9.828 1.00 0.00 H new ATOM 1741 N LEU B 23 154.963 2.241 5.587 1.00 0.00 N ATOM 1742 CA LEU B 23 154.880 1.558 4.268 1.00 0.00 C ATOM 1743 C LEU B 23 156.255 1.581 3.603 1.00 0.00 C ATOM 1744 O LEU B 23 156.971 2.560 3.656 1.00 0.00 O ATOM 1745 CB LEU B 23 153.869 2.283 3.379 1.00 0.00 C ATOM 1746 CG LEU B 23 152.465 2.180 3.992 1.00 0.00 C ATOM 1747 CD1 LEU B 23 151.514 3.101 3.222 1.00 0.00 C ATOM 1748 CD2 LEU B 23 151.955 0.725 3.926 1.00 0.00 C ATOM 0 H LEU B 23 154.424 3.103 5.665 1.00 0.00 H new ATOM 0 HA LEU B 23 154.559 0.526 4.410 1.00 0.00 H new ATOM 0 HB2 LEU B 23 154.152 3.330 3.271 1.00 0.00 H new ATOM 0 HB3 LEU B 23 153.872 1.847 2.380 1.00 0.00 H new ATOM 0 HG LEU B 23 152.506 2.484 5.038 1.00 0.00 H new ATOM 0 HD11 LEU B 23 150.515 3.033 3.652 1.00 0.00 H new ATOM 0 HD12 LEU B 23 151.869 4.129 3.290 1.00 0.00 H new ATOM 0 HD13 LEU B 23 151.481 2.797 2.176 1.00 0.00 H new ATOM 0 HD21 LEU B 23 150.959 0.668 4.364 1.00 0.00 H new ATOM 0 HD22 LEU B 23 151.913 0.401 2.886 1.00 0.00 H new ATOM 0 HD23 LEU B 23 152.633 0.076 4.481 1.00 0.00 H new ATOM 1760 N ALA B 24 156.618 0.508 2.976 1.00 0.00 N ATOM 1761 CA ALA B 24 157.944 0.467 2.302 1.00 0.00 C ATOM 1762 C ALA B 24 157.975 1.505 1.176 1.00 0.00 C ATOM 1763 O ALA B 24 157.049 1.630 0.399 1.00 0.00 O ATOM 1764 CB ALA B 24 158.185 -0.927 1.725 1.00 0.00 C ATOM 0 H ALA B 24 156.060 -0.342 2.898 1.00 0.00 H new ATOM 0 HA ALA B 24 158.726 0.694 3.026 1.00 0.00 H new ATOM 0 HB1 ALA B 24 159.157 -0.954 1.232 1.00 0.00 H new ATOM 0 HB2 ALA B 24 158.166 -1.662 2.530 1.00 0.00 H new ATOM 0 HB3 ALA B 24 157.404 -1.161 1.001 1.00 0.00 H new ATOM 1770 N GLY B 25 159.044 2.252 1.093 1.00 0.00 N ATOM 1771 CA GLY B 25 159.166 3.298 0.027 1.00 0.00 C ATOM 1772 C GLY B 25 158.837 4.678 0.607 1.00 0.00 C ATOM 1773 O GLY B 25 159.215 5.693 0.056 1.00 0.00 O ATOM 0 H GLY B 25 159.845 2.184 1.721 1.00 0.00 H new ATOM 0 HA2 GLY B 25 160.177 3.297 -0.381 1.00 0.00 H new ATOM 0 HA3 GLY B 25 158.490 3.070 -0.797 1.00 0.00 H new ATOM 1777 N ILE B 26 158.146 4.730 1.718 1.00 0.00 N ATOM 1778 CA ILE B 26 157.804 6.051 2.337 1.00 0.00 C ATOM 1779 C ILE B 26 158.811 6.335 3.451 1.00 0.00 C ATOM 1780 O ILE B 26 158.899 5.596 4.412 1.00 0.00 O ATOM 1781 CB ILE B 26 156.393 5.983 2.928 1.00 0.00 C ATOM 1782 CG1 ILE B 26 155.412 5.469 1.864 1.00 0.00 C ATOM 1783 CG2 ILE B 26 155.961 7.375 3.398 1.00 0.00 C ATOM 1784 CD1 ILE B 26 155.510 6.314 0.587 1.00 0.00 C ATOM 0 H ILE B 26 157.803 3.914 2.225 1.00 0.00 H new ATOM 0 HA ILE B 26 157.841 6.842 1.587 1.00 0.00 H new ATOM 0 HB ILE B 26 156.392 5.301 3.778 1.00 0.00 H new ATOM 0 HG12 ILE B 26 155.630 4.426 1.634 1.00 0.00 H new ATOM 0 HG13 ILE B 26 154.394 5.504 2.253 1.00 0.00 H new ATOM 0 HG21 ILE B 26 154.956 7.322 3.818 1.00 0.00 H new ATOM 0 HG22 ILE B 26 156.654 7.733 4.159 1.00 0.00 H new ATOM 0 HG23 ILE B 26 155.965 8.062 2.552 1.00 0.00 H new ATOM 0 HD11 ILE B 26 154.808 5.935 -0.155 1.00 0.00 H new ATOM 0 HD12 ILE B 26 155.269 7.352 0.818 1.00 0.00 H new ATOM 0 HD13 ILE B 26 156.523 6.257 0.190 1.00 0.00 H new ATOM 1796 N GLY B 27 159.585 7.389 3.343 1.00 0.00 N ATOM 1797 CA GLY B 27 160.586 7.696 4.408 1.00 0.00 C ATOM 1798 C GLY B 27 159.985 8.661 5.437 1.00 0.00 C ATOM 1799 O GLY B 27 158.867 9.118 5.300 1.00 0.00 O ATOM 0 H GLY B 27 159.565 8.047 2.564 1.00 0.00 H new ATOM 0 HA2 GLY B 27 160.898 6.775 4.901 1.00 0.00 H new ATOM 0 HA3 GLY B 27 161.478 8.137 3.963 1.00 0.00 H new ATOM 1803 N GLU B 28 160.718 8.951 6.479 1.00 0.00 N ATOM 1804 CA GLU B 28 160.193 9.866 7.537 1.00 0.00 C ATOM 1805 C GLU B 28 159.822 11.229 6.939 1.00 0.00 C ATOM 1806 O GLU B 28 158.821 11.814 7.302 1.00 0.00 O ATOM 1807 CB GLU B 28 161.265 10.058 8.613 1.00 0.00 C ATOM 1808 CG GLU B 28 161.428 8.762 9.409 1.00 0.00 C ATOM 1809 CD GLU B 28 160.214 8.572 10.323 1.00 0.00 C ATOM 1810 OE1 GLU B 28 160.220 9.135 11.406 1.00 0.00 O ATOM 1811 OE2 GLU B 28 159.304 7.862 9.928 1.00 0.00 O ATOM 0 H GLU B 28 161.659 8.594 6.644 1.00 0.00 H new ATOM 0 HA GLU B 28 159.298 9.422 7.974 1.00 0.00 H new ATOM 0 HB2 GLU B 28 162.213 10.335 8.152 1.00 0.00 H new ATOM 0 HB3 GLU B 28 160.984 10.874 9.279 1.00 0.00 H new ATOM 0 HG2 GLU B 28 161.522 7.914 8.730 1.00 0.00 H new ATOM 0 HG3 GLU B 28 162.342 8.799 10.002 1.00 0.00 H new ATOM 1818 N VAL B 29 160.606 11.742 6.031 1.00 0.00 N ATOM 1819 CA VAL B 29 160.269 13.069 5.432 1.00 0.00 C ATOM 1820 C VAL B 29 158.999 12.942 4.588 1.00 0.00 C ATOM 1821 O VAL B 29 158.125 13.785 4.633 1.00 0.00 O ATOM 1822 CB VAL B 29 161.435 13.545 4.558 1.00 0.00 C ATOM 1823 CG1 VAL B 29 161.011 14.772 3.744 1.00 0.00 C ATOM 1824 CG2 VAL B 29 162.615 13.924 5.455 1.00 0.00 C ATOM 0 H VAL B 29 161.458 11.306 5.679 1.00 0.00 H new ATOM 0 HA VAL B 29 160.097 13.796 6.226 1.00 0.00 H new ATOM 0 HB VAL B 29 161.724 12.743 3.879 1.00 0.00 H new ATOM 0 HG11 VAL B 29 161.845 15.104 3.126 1.00 0.00 H new ATOM 0 HG12 VAL B 29 160.167 14.511 3.105 1.00 0.00 H new ATOM 0 HG13 VAL B 29 160.719 15.575 4.421 1.00 0.00 H new ATOM 0 HG21 VAL B 29 163.447 14.263 4.838 1.00 0.00 H new ATOM 0 HG22 VAL B 29 162.315 14.724 6.132 1.00 0.00 H new ATOM 0 HG23 VAL B 29 162.925 13.055 6.035 1.00 0.00 H new ATOM 1834 N LEU B 30 158.896 11.903 3.813 1.00 0.00 N ATOM 1835 CA LEU B 30 157.692 11.725 2.956 1.00 0.00 C ATOM 1836 C LEU B 30 156.464 11.494 3.837 1.00 0.00 C ATOM 1837 O LEU B 30 155.375 11.935 3.528 1.00 0.00 O ATOM 1838 CB LEU B 30 157.897 10.526 2.024 1.00 0.00 C ATOM 1839 CG LEU B 30 159.111 10.767 1.115 1.00 0.00 C ATOM 1840 CD1 LEU B 30 159.318 9.543 0.217 1.00 0.00 C ATOM 1841 CD2 LEU B 30 158.883 12.014 0.238 1.00 0.00 C ATOM 0 H LEU B 30 159.596 11.165 3.735 1.00 0.00 H new ATOM 0 HA LEU B 30 157.538 12.622 2.357 1.00 0.00 H new ATOM 0 HB2 LEU B 30 158.047 9.620 2.611 1.00 0.00 H new ATOM 0 HB3 LEU B 30 157.004 10.369 1.418 1.00 0.00 H new ATOM 0 HG LEU B 30 159.994 10.928 1.734 1.00 0.00 H new ATOM 0 HD11 LEU B 30 160.179 9.708 -0.431 1.00 0.00 H new ATOM 0 HD12 LEU B 30 159.493 8.663 0.836 1.00 0.00 H new ATOM 0 HD13 LEU B 30 158.429 9.385 -0.394 1.00 0.00 H new ATOM 0 HD21 LEU B 30 159.751 12.173 -0.401 1.00 0.00 H new ATOM 0 HD22 LEU B 30 157.998 11.866 -0.382 1.00 0.00 H new ATOM 0 HD23 LEU B 30 158.738 12.886 0.876 1.00 0.00 H new ATOM 1853 N GLY B 31 156.629 10.807 4.929 1.00 0.00 N ATOM 1854 CA GLY B 31 155.470 10.553 5.827 1.00 0.00 C ATOM 1855 C GLY B 31 154.889 11.885 6.314 1.00 0.00 C ATOM 1856 O GLY B 31 153.690 12.047 6.422 1.00 0.00 O ATOM 0 H GLY B 31 157.516 10.410 5.240 1.00 0.00 H new ATOM 0 HA2 GLY B 31 154.706 9.984 5.297 1.00 0.00 H new ATOM 0 HA3 GLY B 31 155.784 9.949 6.679 1.00 0.00 H new ATOM 1860 N LYS B 32 155.731 12.835 6.625 1.00 0.00 N ATOM 1861 CA LYS B 32 155.228 14.151 7.123 1.00 0.00 C ATOM 1862 C LYS B 32 154.437 14.879 6.031 1.00 0.00 C ATOM 1863 O LYS B 32 153.443 15.522 6.308 1.00 0.00 O ATOM 1864 CB LYS B 32 156.408 15.024 7.552 1.00 0.00 C ATOM 1865 CG LYS B 32 157.037 14.443 8.818 1.00 0.00 C ATOM 1866 CD LYS B 32 158.217 15.315 9.249 1.00 0.00 C ATOM 1867 CE LYS B 32 158.844 14.730 10.517 1.00 0.00 C ATOM 1868 NZ LYS B 32 159.810 15.708 11.092 1.00 0.00 N ATOM 0 H LYS B 32 156.746 12.757 6.556 1.00 0.00 H new ATOM 0 HA LYS B 32 154.571 13.967 7.973 1.00 0.00 H new ATOM 0 HB2 LYS B 32 157.149 15.071 6.754 1.00 0.00 H new ATOM 0 HB3 LYS B 32 156.072 16.044 7.735 1.00 0.00 H new ATOM 0 HG2 LYS B 32 156.296 14.395 9.616 1.00 0.00 H new ATOM 0 HG3 LYS B 32 157.373 13.423 8.634 1.00 0.00 H new ATOM 0 HD2 LYS B 32 158.959 15.363 8.452 1.00 0.00 H new ATOM 0 HD3 LYS B 32 157.881 16.335 9.433 1.00 0.00 H new ATOM 0 HE2 LYS B 32 158.067 14.499 11.246 1.00 0.00 H new ATOM 0 HE3 LYS B 32 159.352 13.794 10.285 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 160.236 15.310 11.953 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 160.557 15.907 10.397 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 159.312 16.590 11.328 1.00 0.00 H new ATOM 1882 N LYS B 33 154.868 14.814 4.799 1.00 0.00 N ATOM 1883 CA LYS B 33 154.132 15.538 3.722 1.00 0.00 C ATOM 1884 C LYS B 33 152.754 14.903 3.520 1.00 0.00 C ATOM 1885 O LYS B 33 151.749 15.584 3.484 1.00 0.00 O ATOM 1886 CB LYS B 33 154.930 15.443 2.422 1.00 0.00 C ATOM 1887 CG LYS B 33 156.201 16.284 2.545 1.00 0.00 C ATOM 1888 CD LYS B 33 157.003 16.192 1.247 1.00 0.00 C ATOM 1889 CE LYS B 33 158.273 17.034 1.371 1.00 0.00 C ATOM 1890 NZ LYS B 33 157.914 18.479 1.346 1.00 0.00 N ATOM 0 H LYS B 33 155.691 14.295 4.494 1.00 0.00 H new ATOM 0 HA LYS B 33 154.007 16.583 4.005 1.00 0.00 H new ATOM 0 HB2 LYS B 33 155.187 14.404 2.215 1.00 0.00 H new ATOM 0 HB3 LYS B 33 154.327 15.795 1.585 1.00 0.00 H new ATOM 0 HG2 LYS B 33 155.943 17.323 2.753 1.00 0.00 H new ATOM 0 HG3 LYS B 33 156.803 15.931 3.382 1.00 0.00 H new ATOM 0 HD2 LYS B 33 157.261 15.154 1.040 1.00 0.00 H new ATOM 0 HD3 LYS B 33 156.401 16.544 0.409 1.00 0.00 H new ATOM 0 HE2 LYS B 33 158.793 16.793 2.298 1.00 0.00 H new ATOM 0 HE3 LYS B 33 158.956 16.804 0.554 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 158.766 19.045 1.158 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 157.212 18.650 0.597 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 157.513 18.753 2.265 1.00 0.00 H new ATOM 1904 N LEU B 34 152.694 13.606 3.413 1.00 0.00 N ATOM 1905 CA LEU B 34 151.375 12.935 3.241 1.00 0.00 C ATOM 1906 C LEU B 34 150.512 13.248 4.471 1.00 0.00 C ATOM 1907 O LEU B 34 149.321 13.467 4.378 1.00 0.00 O ATOM 1908 CB LEU B 34 151.582 11.422 3.095 1.00 0.00 C ATOM 1909 CG LEU B 34 152.256 11.104 1.747 1.00 0.00 C ATOM 1910 CD1 LEU B 34 152.863 9.700 1.802 1.00 0.00 C ATOM 1911 CD2 LEU B 34 151.227 11.147 0.603 1.00 0.00 C ATOM 0 H LEU B 34 153.500 12.981 3.437 1.00 0.00 H new ATOM 0 HA LEU B 34 150.875 13.298 2.343 1.00 0.00 H new ATOM 0 HB2 LEU B 34 152.198 11.051 3.914 1.00 0.00 H new ATOM 0 HB3 LEU B 34 150.623 10.909 3.160 1.00 0.00 H new ATOM 0 HG LEU B 34 153.030 11.849 1.564 1.00 0.00 H new ATOM 0 HD11 LEU B 34 153.341 9.473 0.849 1.00 0.00 H new ATOM 0 HD12 LEU B 34 153.605 9.655 2.599 1.00 0.00 H new ATOM 0 HD13 LEU B 34 152.076 8.971 1.997 1.00 0.00 H new ATOM 0 HD21 LEU B 34 151.723 10.920 -0.341 1.00 0.00 H new ATOM 0 HD22 LEU B 34 150.445 10.411 0.789 1.00 0.00 H new ATOM 0 HD23 LEU B 34 150.784 12.141 0.550 1.00 0.00 H new ATOM 1923 N GLU B 35 151.125 13.269 5.618 1.00 0.00 N ATOM 1924 CA GLU B 35 150.356 13.569 6.864 1.00 0.00 C ATOM 1925 C GLU B 35 149.722 14.959 6.755 1.00 0.00 C ATOM 1926 O GLU B 35 148.585 15.164 7.129 1.00 0.00 O ATOM 1927 CB GLU B 35 151.300 13.518 8.070 1.00 0.00 C ATOM 1928 CG GLU B 35 150.526 13.828 9.356 1.00 0.00 C ATOM 1929 CD GLU B 35 151.471 13.732 10.555 1.00 0.00 C ATOM 1930 OE1 GLU B 35 152.582 13.262 10.373 1.00 0.00 O ATOM 1931 OE2 GLU B 35 151.069 14.132 11.635 1.00 0.00 O ATOM 0 H GLU B 35 152.121 13.093 5.752 1.00 0.00 H new ATOM 0 HA GLU B 35 149.567 12.828 6.994 1.00 0.00 H new ATOM 0 HB2 GLU B 35 151.759 12.532 8.141 1.00 0.00 H new ATOM 0 HB3 GLU B 35 152.108 14.238 7.940 1.00 0.00 H new ATOM 0 HG2 GLU B 35 150.092 14.826 9.300 1.00 0.00 H new ATOM 0 HG3 GLU B 35 149.699 13.127 9.474 1.00 0.00 H new ATOM 1938 N GLU B 36 150.447 15.909 6.238 1.00 0.00 N ATOM 1939 CA GLU B 36 149.890 17.283 6.092 1.00 0.00 C ATOM 1940 C GLU B 36 148.775 17.254 5.046 1.00 0.00 C ATOM 1941 O GLU B 36 147.952 18.145 4.963 1.00 0.00 O ATOM 1942 CB GLU B 36 151.003 18.236 5.649 1.00 0.00 C ATOM 1943 CG GLU B 36 150.455 19.660 5.537 1.00 0.00 C ATOM 1944 CD GLU B 36 151.595 20.616 5.184 1.00 0.00 C ATOM 1945 OE1 GLU B 36 152.736 20.187 5.229 1.00 0.00 O ATOM 1946 OE2 GLU B 36 151.309 21.762 4.881 1.00 0.00 O ATOM 0 H GLU B 36 151.405 15.794 5.909 1.00 0.00 H new ATOM 0 HA GLU B 36 149.486 17.629 7.043 1.00 0.00 H new ATOM 0 HB2 GLU B 36 151.824 18.208 6.365 1.00 0.00 H new ATOM 0 HB3 GLU B 36 151.407 17.916 4.689 1.00 0.00 H new ATOM 0 HG2 GLU B 36 149.679 19.704 4.773 1.00 0.00 H new ATOM 0 HG3 GLU B 36 149.993 19.959 6.478 1.00 0.00 H new ATOM 1953 N ARG B 37 148.764 16.237 4.233 1.00 0.00 N ATOM 1954 CA ARG B 37 147.729 16.137 3.160 1.00 0.00 C ATOM 1955 C ARG B 37 146.492 15.391 3.687 1.00 0.00 C ATOM 1956 O ARG B 37 145.513 15.236 2.983 1.00 0.00 O ATOM 1957 CB ARG B 37 148.326 15.381 1.966 1.00 0.00 C ATOM 1958 CG ARG B 37 149.392 16.236 1.264 1.00 0.00 C ATOM 1959 CD ARG B 37 148.741 17.270 0.337 1.00 0.00 C ATOM 1960 NE ARG B 37 149.803 17.928 -0.474 1.00 0.00 N ATOM 1961 CZ ARG B 37 149.485 18.615 -1.536 1.00 0.00 C ATOM 1962 NH1 ARG B 37 148.235 18.718 -1.899 1.00 0.00 N ATOM 1963 NH2 ARG B 37 150.420 19.195 -2.239 1.00 0.00 N ATOM 0 H ARG B 37 149.430 15.465 4.263 1.00 0.00 H new ATOM 0 HA ARG B 37 147.425 17.137 2.850 1.00 0.00 H new ATOM 0 HB2 ARG B 37 148.769 14.445 2.306 1.00 0.00 H new ATOM 0 HB3 ARG B 37 147.536 15.123 1.260 1.00 0.00 H new ATOM 0 HG2 ARG B 37 150.005 16.744 2.009 1.00 0.00 H new ATOM 0 HG3 ARG B 37 150.058 15.593 0.688 1.00 0.00 H new ATOM 0 HD2 ARG B 37 148.014 16.786 -0.315 1.00 0.00 H new ATOM 0 HD3 ARG B 37 148.199 18.013 0.923 1.00 0.00 H new ATOM 0 HE ARG B 37 150.781 17.841 -0.198 1.00 0.00 H new ATOM 0 HH11 ARG B 37 147.506 18.261 -1.352 1.00 0.00 H new ATOM 0 HH12 ARG B 37 147.988 19.256 -2.730 1.00 0.00 H new ATOM 0 HH21 ARG B 37 151.397 19.110 -1.957 1.00 0.00 H new ATOM 0 HH22 ARG B 37 150.174 19.733 -3.070 1.00 0.00 H new ATOM 1977 N GLY B 38 146.506 14.967 4.931 1.00 0.00 N ATOM 1978 CA GLY B 38 145.302 14.278 5.514 1.00 0.00 C ATOM 1979 C GLY B 38 145.502 12.761 5.612 1.00 0.00 C ATOM 1980 O GLY B 38 144.600 12.046 6.002 1.00 0.00 O ATOM 0 H GLY B 38 147.296 15.067 5.568 1.00 0.00 H new ATOM 0 HA2 GLY B 38 145.098 14.682 6.506 1.00 0.00 H new ATOM 0 HA3 GLY B 38 144.429 14.490 4.897 1.00 0.00 H new ATOM 1984 N PHE B 39 146.662 12.259 5.282 1.00 0.00 N ATOM 1985 CA PHE B 39 146.902 10.780 5.379 1.00 0.00 C ATOM 1986 C PHE B 39 147.759 10.495 6.616 1.00 0.00 C ATOM 1987 O PHE B 39 148.942 10.240 6.518 1.00 0.00 O ATOM 1988 CB PHE B 39 147.654 10.316 4.134 1.00 0.00 C ATOM 1989 CG PHE B 39 146.823 10.590 2.905 1.00 0.00 C ATOM 1990 CD1 PHE B 39 146.950 11.811 2.247 1.00 0.00 C ATOM 1991 CD2 PHE B 39 145.931 9.626 2.428 1.00 0.00 C ATOM 1992 CE1 PHE B 39 146.183 12.080 1.108 1.00 0.00 C ATOM 1993 CE2 PHE B 39 145.162 9.889 1.288 1.00 0.00 C ATOM 1994 CZ PHE B 39 145.287 11.118 0.627 1.00 0.00 C ATOM 0 H PHE B 39 147.457 12.805 4.949 1.00 0.00 H new ATOM 0 HA PHE B 39 145.951 10.253 5.456 1.00 0.00 H new ATOM 0 HB2 PHE B 39 148.610 10.834 4.061 1.00 0.00 H new ATOM 0 HB3 PHE B 39 147.873 9.251 4.206 1.00 0.00 H new ATOM 0 HD1 PHE B 39 147.643 12.552 2.617 1.00 0.00 H new ATOM 0 HD2 PHE B 39 145.835 8.679 2.938 1.00 0.00 H new ATOM 0 HE1 PHE B 39 146.282 13.028 0.601 1.00 0.00 H new ATOM 0 HE2 PHE B 39 144.472 9.145 0.918 1.00 0.00 H new ATOM 0 HZ PHE B 39 144.693 11.323 -0.252 1.00 0.00 H new ATOM 2004 N ASP B 40 147.170 10.555 7.785 1.00 0.00 N ATOM 2005 CA ASP B 40 147.964 10.307 9.027 1.00 0.00 C ATOM 2006 C ASP B 40 148.095 8.803 9.294 1.00 0.00 C ATOM 2007 O ASP B 40 148.871 8.390 10.133 1.00 0.00 O ATOM 2008 CB ASP B 40 147.278 10.985 10.216 1.00 0.00 C ATOM 2009 CG ASP B 40 145.920 10.332 10.474 1.00 0.00 C ATOM 2010 OD1 ASP B 40 145.408 9.694 9.569 1.00 0.00 O ATOM 2011 OD2 ASP B 40 145.413 10.480 11.574 1.00 0.00 O ATOM 0 H ASP B 40 146.182 10.763 7.932 1.00 0.00 H new ATOM 0 HA ASP B 40 148.963 10.723 8.893 1.00 0.00 H new ATOM 0 HB2 ASP B 40 147.905 10.904 11.104 1.00 0.00 H new ATOM 0 HB3 ASP B 40 147.148 12.048 10.014 1.00 0.00 H new ATOM 2016 N LYS B 41 147.349 7.979 8.594 1.00 0.00 N ATOM 2017 CA LYS B 41 147.440 6.496 8.814 1.00 0.00 C ATOM 2018 C LYS B 41 147.614 5.787 7.469 1.00 0.00 C ATOM 2019 O LYS B 41 147.199 6.272 6.434 1.00 0.00 O ATOM 2020 CB LYS B 41 146.171 5.987 9.506 1.00 0.00 C ATOM 2021 CG LYS B 41 145.998 6.680 10.868 1.00 0.00 C ATOM 2022 CD LYS B 41 147.084 6.211 11.851 1.00 0.00 C ATOM 2023 CE LYS B 41 146.643 6.500 13.289 1.00 0.00 C ATOM 2024 NZ LYS B 41 147.663 5.970 14.240 1.00 0.00 N ATOM 0 H LYS B 41 146.681 8.268 7.880 1.00 0.00 H new ATOM 0 HA LYS B 41 148.299 6.283 9.450 1.00 0.00 H new ATOM 0 HB2 LYS B 41 145.302 6.181 8.877 1.00 0.00 H new ATOM 0 HB3 LYS B 41 146.230 4.907 9.643 1.00 0.00 H new ATOM 0 HG2 LYS B 41 146.055 7.761 10.743 1.00 0.00 H new ATOM 0 HG3 LYS B 41 145.011 6.457 11.274 1.00 0.00 H new ATOM 0 HD2 LYS B 41 147.266 5.144 11.724 1.00 0.00 H new ATOM 0 HD3 LYS B 41 148.024 6.721 11.640 1.00 0.00 H new ATOM 0 HE2 LYS B 41 146.519 7.573 13.434 1.00 0.00 H new ATOM 0 HE3 LYS B 41 145.675 6.038 13.483 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 147.363 6.167 15.216 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 147.760 4.943 14.108 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 148.578 6.430 14.060 1.00 0.00 H new ATOM 2038 N ALA B 42 148.248 4.648 7.486 1.00 0.00 N ATOM 2039 CA ALA B 42 148.491 3.888 6.225 1.00 0.00 C ATOM 2040 C ALA B 42 147.175 3.429 5.586 1.00 0.00 C ATOM 2041 O ALA B 42 147.033 3.438 4.380 1.00 0.00 O ATOM 2042 CB ALA B 42 149.347 2.660 6.542 1.00 0.00 C ATOM 0 H ALA B 42 148.613 4.205 8.329 1.00 0.00 H new ATOM 0 HA ALA B 42 149.002 4.544 5.521 1.00 0.00 H new ATOM 0 HB1 ALA B 42 149.530 2.098 5.626 1.00 0.00 H new ATOM 0 HB2 ALA B 42 150.298 2.980 6.968 1.00 0.00 H new ATOM 0 HB3 ALA B 42 148.823 2.027 7.258 1.00 0.00 H new ATOM 2048 N TYR B 43 146.224 2.993 6.368 1.00 0.00 N ATOM 2049 CA TYR B 43 144.952 2.496 5.768 1.00 0.00 C ATOM 2050 C TYR B 43 144.265 3.593 4.939 1.00 0.00 C ATOM 2051 O TYR B 43 143.454 3.302 4.083 1.00 0.00 O ATOM 2052 CB TYR B 43 144.006 1.959 6.853 1.00 0.00 C ATOM 2053 CG TYR B 43 143.607 3.048 7.819 1.00 0.00 C ATOM 2054 CD1 TYR B 43 142.642 3.988 7.449 1.00 0.00 C ATOM 2055 CD2 TYR B 43 144.185 3.101 9.093 1.00 0.00 C ATOM 2056 CE1 TYR B 43 142.253 4.984 8.352 1.00 0.00 C ATOM 2057 CE2 TYR B 43 143.798 4.098 9.995 1.00 0.00 C ATOM 2058 CZ TYR B 43 142.831 5.040 9.625 1.00 0.00 C ATOM 2059 OH TYR B 43 142.447 6.021 10.516 1.00 0.00 O ATOM 0 H TYR B 43 146.271 2.959 7.386 1.00 0.00 H new ATOM 0 HA TYR B 43 145.200 1.674 5.097 1.00 0.00 H new ATOM 0 HB2 TYR B 43 143.115 1.539 6.386 1.00 0.00 H new ATOM 0 HB3 TYR B 43 144.494 1.149 7.396 1.00 0.00 H new ATOM 0 HD1 TYR B 43 142.196 3.946 6.466 1.00 0.00 H new ATOM 0 HD2 TYR B 43 144.929 2.373 9.379 1.00 0.00 H new ATOM 0 HE1 TYR B 43 141.506 5.710 8.066 1.00 0.00 H new ATOM 0 HE2 TYR B 43 144.245 4.141 10.977 1.00 0.00 H new ATOM 0 HH TYR B 43 142.753 5.783 11.416 1.00 0.00 H new ATOM 2069 N VAL B 44 144.593 4.843 5.146 1.00 0.00 N ATOM 2070 CA VAL B 44 143.958 5.912 4.312 1.00 0.00 C ATOM 2071 C VAL B 44 144.676 5.936 2.957 1.00 0.00 C ATOM 2072 O VAL B 44 144.092 6.193 1.921 1.00 0.00 O ATOM 2073 CB VAL B 44 144.095 7.280 4.995 1.00 0.00 C ATOM 2074 CG1 VAL B 44 143.353 8.352 4.180 1.00 0.00 C ATOM 2075 CG2 VAL B 44 143.489 7.215 6.397 1.00 0.00 C ATOM 0 H VAL B 44 145.262 5.168 5.844 1.00 0.00 H new ATOM 0 HA VAL B 44 142.896 5.703 4.184 1.00 0.00 H new ATOM 0 HB VAL B 44 145.152 7.538 5.058 1.00 0.00 H new ATOM 0 HG11 VAL B 44 143.456 9.319 4.672 1.00 0.00 H new ATOM 0 HG12 VAL B 44 143.779 8.407 3.178 1.00 0.00 H new ATOM 0 HG13 VAL B 44 142.297 8.090 4.111 1.00 0.00 H new ATOM 0 HG21 VAL B 44 143.587 8.187 6.881 1.00 0.00 H new ATOM 0 HG22 VAL B 44 142.434 6.950 6.326 1.00 0.00 H new ATOM 0 HG23 VAL B 44 144.013 6.462 6.985 1.00 0.00 H new ATOM 2085 N VAL B 45 145.950 5.648 2.982 1.00 0.00 N ATOM 2086 CA VAL B 45 146.752 5.625 1.725 1.00 0.00 C ATOM 2087 C VAL B 45 146.440 4.322 0.996 1.00 0.00 C ATOM 2088 O VAL B 45 146.320 4.283 -0.213 1.00 0.00 O ATOM 2089 CB VAL B 45 148.245 5.686 2.057 1.00 0.00 C ATOM 2090 CG1 VAL B 45 149.057 5.639 0.759 1.00 0.00 C ATOM 2091 CG2 VAL B 45 148.551 6.985 2.813 1.00 0.00 C ATOM 0 H VAL B 45 146.474 5.426 3.828 1.00 0.00 H new ATOM 0 HA VAL B 45 146.502 6.483 1.100 1.00 0.00 H new ATOM 0 HB VAL B 45 148.514 4.835 2.683 1.00 0.00 H new ATOM 0 HG11 VAL B 45 150.121 5.682 0.993 1.00 0.00 H new ATOM 0 HG12 VAL B 45 148.840 4.712 0.227 1.00 0.00 H new ATOM 0 HG13 VAL B 45 148.789 6.489 0.131 1.00 0.00 H new ATOM 0 HG21 VAL B 45 149.614 7.027 3.049 1.00 0.00 H new ATOM 0 HG22 VAL B 45 148.283 7.839 2.191 1.00 0.00 H new ATOM 0 HG23 VAL B 45 147.973 7.013 3.737 1.00 0.00 H new ATOM 2101 N LEU B 46 146.266 3.261 1.732 1.00 0.00 N ATOM 2102 CA LEU B 46 145.916 1.965 1.098 1.00 0.00 C ATOM 2103 C LEU B 46 144.594 2.169 0.360 1.00 0.00 C ATOM 2104 O LEU B 46 144.377 1.656 -0.719 1.00 0.00 O ATOM 2105 CB LEU B 46 145.743 0.896 2.186 1.00 0.00 C ATOM 2106 CG LEU B 46 145.421 -0.477 1.560 1.00 0.00 C ATOM 2107 CD1 LEU B 46 146.689 -1.090 0.942 1.00 0.00 C ATOM 2108 CD2 LEU B 46 144.840 -1.419 2.638 1.00 0.00 C ATOM 0 H LEU B 46 146.352 3.238 2.748 1.00 0.00 H new ATOM 0 HA LEU B 46 146.697 1.639 0.411 1.00 0.00 H new ATOM 0 HB2 LEU B 46 146.654 0.825 2.780 1.00 0.00 H new ATOM 0 HB3 LEU B 46 144.942 1.188 2.865 1.00 0.00 H new ATOM 0 HG LEU B 46 144.682 -0.344 0.770 1.00 0.00 H new ATOM 0 HD11 LEU B 46 146.448 -2.059 0.504 1.00 0.00 H new ATOM 0 HD12 LEU B 46 147.074 -0.427 0.167 1.00 0.00 H new ATOM 0 HD13 LEU B 46 147.445 -1.220 1.716 1.00 0.00 H new ATOM 0 HD21 LEU B 46 144.614 -2.387 2.192 1.00 0.00 H new ATOM 0 HD22 LEU B 46 145.569 -1.549 3.438 1.00 0.00 H new ATOM 0 HD23 LEU B 46 143.927 -0.986 3.046 1.00 0.00 H new ATOM 2120 N GLY B 47 143.707 2.924 0.952 1.00 0.00 N ATOM 2121 CA GLY B 47 142.388 3.181 0.313 1.00 0.00 C ATOM 2122 C GLY B 47 142.609 3.843 -1.045 1.00 0.00 C ATOM 2123 O GLY B 47 141.943 3.529 -2.012 1.00 0.00 O ATOM 0 H GLY B 47 143.843 3.376 1.857 1.00 0.00 H new ATOM 0 HA2 GLY B 47 141.841 2.246 0.191 1.00 0.00 H new ATOM 0 HA3 GLY B 47 141.781 3.824 0.950 1.00 0.00 H new ATOM 2127 N GLN B 48 143.545 4.750 -1.134 1.00 0.00 N ATOM 2128 CA GLN B 48 143.813 5.412 -2.442 1.00 0.00 C ATOM 2129 C GLN B 48 144.215 4.337 -3.455 1.00 0.00 C ATOM 2130 O GLN B 48 143.773 4.335 -4.586 1.00 0.00 O ATOM 2131 CB GLN B 48 144.959 6.421 -2.272 1.00 0.00 C ATOM 2132 CG GLN B 48 145.234 7.142 -3.599 1.00 0.00 C ATOM 2133 CD GLN B 48 144.024 7.997 -3.981 1.00 0.00 C ATOM 2134 OE1 GLN B 48 143.298 8.537 -3.041 1.00 0.00 O flip ATOM 2135 NE2 GLN B 48 143.738 8.178 -5.148 1.00 0.00 N flip ATOM 0 H GLN B 48 144.133 5.060 -0.360 1.00 0.00 H new ATOM 0 HA GLN B 48 142.924 5.937 -2.792 1.00 0.00 H new ATOM 0 HB2 GLN B 48 144.702 7.148 -1.502 1.00 0.00 H new ATOM 0 HB3 GLN B 48 145.859 5.906 -1.936 1.00 0.00 H new ATOM 0 HG2 GLN B 48 146.120 7.770 -3.506 1.00 0.00 H new ATOM 0 HG3 GLN B 48 145.440 6.414 -4.384 1.00 0.00 H new ATOM 0 HE21 GLN B 48 144.305 7.756 -5.883 1.00 0.00 H new ATOM 0 HE22 GLN B 48 142.931 8.752 -5.392 1.00 0.00 H new ATOM 2144 N PHE B 49 145.045 3.416 -3.045 1.00 0.00 N ATOM 2145 CA PHE B 49 145.480 2.325 -3.961 1.00 0.00 C ATOM 2146 C PHE B 49 144.239 1.542 -4.410 1.00 0.00 C ATOM 2147 O PHE B 49 144.108 1.160 -5.556 1.00 0.00 O ATOM 2148 CB PHE B 49 146.450 1.412 -3.205 1.00 0.00 C ATOM 2149 CG PHE B 49 146.924 0.292 -4.101 1.00 0.00 C ATOM 2150 CD1 PHE B 49 147.792 0.571 -5.163 1.00 0.00 C ATOM 2151 CD2 PHE B 49 146.514 -1.025 -3.860 1.00 0.00 C ATOM 2152 CE1 PHE B 49 148.248 -0.465 -5.986 1.00 0.00 C ATOM 2153 CE2 PHE B 49 146.968 -2.061 -4.683 1.00 0.00 C ATOM 2154 CZ PHE B 49 147.835 -1.781 -5.746 1.00 0.00 C ATOM 0 H PHE B 49 145.443 3.373 -2.107 1.00 0.00 H new ATOM 0 HA PHE B 49 145.984 2.728 -4.840 1.00 0.00 H new ATOM 0 HB2 PHE B 49 147.304 1.990 -2.852 1.00 0.00 H new ATOM 0 HB3 PHE B 49 145.959 0.999 -2.324 1.00 0.00 H new ATOM 0 HD1 PHE B 49 148.110 1.586 -5.347 1.00 0.00 H new ATOM 0 HD2 PHE B 49 145.847 -1.241 -3.038 1.00 0.00 H new ATOM 0 HE1 PHE B 49 148.918 -0.250 -6.805 1.00 0.00 H new ATOM 0 HE2 PHE B 49 146.650 -3.076 -4.498 1.00 0.00 H new ATOM 0 HZ PHE B 49 148.186 -2.581 -6.381 1.00 0.00 H new ATOM 2164 N LEU B 50 143.330 1.319 -3.511 1.00 0.00 N ATOM 2165 CA LEU B 50 142.088 0.575 -3.881 1.00 0.00 C ATOM 2166 C LEU B 50 141.251 1.456 -4.814 1.00 0.00 C ATOM 2167 O LEU B 50 140.648 0.985 -5.757 1.00 0.00 O ATOM 2168 CB LEU B 50 141.276 0.242 -2.622 1.00 0.00 C ATOM 2169 CG LEU B 50 142.096 -0.648 -1.674 1.00 0.00 C ATOM 2170 CD1 LEU B 50 141.262 -0.943 -0.423 1.00 0.00 C ATOM 2171 CD2 LEU B 50 142.462 -1.973 -2.369 1.00 0.00 C ATOM 0 H LEU B 50 143.387 1.616 -2.537 1.00 0.00 H new ATOM 0 HA LEU B 50 142.354 -0.357 -4.381 1.00 0.00 H new ATOM 0 HB2 LEU B 50 140.991 1.162 -2.112 1.00 0.00 H new ATOM 0 HB3 LEU B 50 140.353 -0.267 -2.901 1.00 0.00 H new ATOM 0 HG LEU B 50 143.015 -0.130 -1.399 1.00 0.00 H new ATOM 0 HD11 LEU B 50 141.835 -1.574 0.256 1.00 0.00 H new ATOM 0 HD12 LEU B 50 141.011 -0.007 0.076 1.00 0.00 H new ATOM 0 HD13 LEU B 50 140.345 -1.458 -0.710 1.00 0.00 H new ATOM 0 HD21 LEU B 50 143.043 -2.594 -1.686 1.00 0.00 H new ATOM 0 HD22 LEU B 50 141.550 -2.499 -2.652 1.00 0.00 H new ATOM 0 HD23 LEU B 50 143.052 -1.765 -3.261 1.00 0.00 H new ATOM 2183 N VAL B 51 141.202 2.730 -4.547 1.00 0.00 N ATOM 2184 CA VAL B 51 140.399 3.657 -5.400 1.00 0.00 C ATOM 2185 C VAL B 51 141.000 3.742 -6.810 1.00 0.00 C ATOM 2186 O VAL B 51 140.311 4.017 -7.772 1.00 0.00 O ATOM 2187 CB VAL B 51 140.387 5.049 -4.757 1.00 0.00 C ATOM 2188 CG1 VAL B 51 139.769 6.069 -5.719 1.00 0.00 C ATOM 2189 CG2 VAL B 51 139.559 5.003 -3.472 1.00 0.00 C ATOM 0 H VAL B 51 141.687 3.175 -3.768 1.00 0.00 H new ATOM 0 HA VAL B 51 139.380 3.278 -5.479 1.00 0.00 H new ATOM 0 HB VAL B 51 141.411 5.346 -4.531 1.00 0.00 H new ATOM 0 HG11 VAL B 51 139.766 7.054 -5.252 1.00 0.00 H new ATOM 0 HG12 VAL B 51 140.355 6.105 -6.637 1.00 0.00 H new ATOM 0 HG13 VAL B 51 138.746 5.775 -5.953 1.00 0.00 H new ATOM 0 HG21 VAL B 51 139.548 5.991 -3.011 1.00 0.00 H new ATOM 0 HG22 VAL B 51 138.539 4.700 -3.707 1.00 0.00 H new ATOM 0 HG23 VAL B 51 140.000 4.285 -2.781 1.00 0.00 H new ATOM 2199 N LEU B 52 142.282 3.532 -6.937 1.00 0.00 N ATOM 2200 CA LEU B 52 142.931 3.630 -8.281 1.00 0.00 C ATOM 2201 C LEU B 52 142.858 2.286 -9.005 1.00 0.00 C ATOM 2202 O LEU B 52 143.516 2.087 -10.007 1.00 0.00 O ATOM 2203 CB LEU B 52 144.401 4.015 -8.099 1.00 0.00 C ATOM 2204 CG LEU B 52 144.508 5.436 -7.531 1.00 0.00 C ATOM 2205 CD1 LEU B 52 145.958 5.694 -7.115 1.00 0.00 C ATOM 2206 CD2 LEU B 52 144.083 6.477 -8.588 1.00 0.00 C ATOM 0 H LEU B 52 142.911 3.296 -6.169 1.00 0.00 H new ATOM 0 HA LEU B 52 142.411 4.384 -8.872 1.00 0.00 H new ATOM 0 HB2 LEU B 52 144.889 3.309 -7.427 1.00 0.00 H new ATOM 0 HB3 LEU B 52 144.921 3.957 -9.055 1.00 0.00 H new ATOM 0 HG LEU B 52 143.846 5.527 -6.670 1.00 0.00 H new ATOM 0 HD11 LEU B 52 146.046 6.702 -6.709 1.00 0.00 H new ATOM 0 HD12 LEU B 52 146.253 4.970 -6.355 1.00 0.00 H new ATOM 0 HD13 LEU B 52 146.609 5.594 -7.984 1.00 0.00 H new ATOM 0 HD21 LEU B 52 144.166 7.479 -8.166 1.00 0.00 H new ATOM 0 HD22 LEU B 52 144.732 6.396 -9.460 1.00 0.00 H new ATOM 0 HD23 LEU B 52 143.051 6.293 -8.886 1.00 0.00 H new ATOM 2218 N LYS B 53 142.067 1.363 -8.532 1.00 0.00 N ATOM 2219 CA LYS B 53 141.969 0.049 -9.227 1.00 0.00 C ATOM 2220 C LYS B 53 143.376 -0.477 -9.546 1.00 0.00 C ATOM 2221 O LYS B 53 143.612 -1.035 -10.597 1.00 0.00 O ATOM 2222 CB LYS B 53 141.170 0.222 -10.523 1.00 0.00 C ATOM 2223 CG LYS B 53 139.747 0.676 -10.183 1.00 0.00 C ATOM 2224 CD LYS B 53 138.937 0.855 -11.470 1.00 0.00 C ATOM 2225 CE LYS B 53 137.517 1.308 -11.120 1.00 0.00 C ATOM 2226 NZ LYS B 53 136.662 1.259 -12.340 1.00 0.00 N ATOM 0 H LYS B 53 141.487 1.461 -7.699 1.00 0.00 H new ATOM 0 HA LYS B 53 141.462 -0.668 -8.581 1.00 0.00 H new ATOM 0 HB2 LYS B 53 141.654 0.956 -11.167 1.00 0.00 H new ATOM 0 HB3 LYS B 53 141.142 -0.717 -11.075 1.00 0.00 H new ATOM 0 HG2 LYS B 53 139.265 -0.060 -9.539 1.00 0.00 H new ATOM 0 HG3 LYS B 53 139.778 1.614 -9.629 1.00 0.00 H new ATOM 0 HD2 LYS B 53 139.417 1.591 -12.115 1.00 0.00 H new ATOM 0 HD3 LYS B 53 138.905 -0.082 -12.025 1.00 0.00 H new ATOM 0 HE2 LYS B 53 137.100 0.665 -10.345 1.00 0.00 H new ATOM 0 HE3 LYS B 53 137.536 2.321 -10.717 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 135.698 1.567 -12.101 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 137.057 1.890 -13.066 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 136.634 0.286 -12.705 1.00 0.00 H new ATOM 2240 N LYS B 54 144.305 -0.300 -8.631 1.00 0.00 N ATOM 2241 CA LYS B 54 145.712 -0.782 -8.824 1.00 0.00 C ATOM 2242 C LYS B 54 146.346 -0.124 -10.060 1.00 0.00 C ATOM 2243 O LYS B 54 147.314 -0.625 -10.597 1.00 0.00 O ATOM 2244 CB LYS B 54 145.713 -2.306 -9.004 1.00 0.00 C ATOM 2245 CG LYS B 54 145.102 -2.969 -7.768 1.00 0.00 C ATOM 2246 CD LYS B 54 145.104 -4.488 -7.950 1.00 0.00 C ATOM 2247 CE LYS B 54 144.425 -5.152 -6.750 1.00 0.00 C ATOM 2248 NZ LYS B 54 145.200 -4.863 -5.511 1.00 0.00 N ATOM 0 H LYS B 54 144.141 0.169 -7.740 1.00 0.00 H new ATOM 0 HA LYS B 54 146.295 -0.511 -7.944 1.00 0.00 H new ATOM 0 HB2 LYS B 54 145.144 -2.578 -9.893 1.00 0.00 H new ATOM 0 HB3 LYS B 54 146.731 -2.664 -9.155 1.00 0.00 H new ATOM 0 HG2 LYS B 54 145.671 -2.698 -6.878 1.00 0.00 H new ATOM 0 HG3 LYS B 54 144.083 -2.612 -7.617 1.00 0.00 H new ATOM 0 HD2 LYS B 54 144.582 -4.755 -8.869 1.00 0.00 H new ATOM 0 HD3 LYS B 54 146.127 -4.851 -8.048 1.00 0.00 H new ATOM 0 HE2 LYS B 54 143.405 -4.782 -6.647 1.00 0.00 H new ATOM 0 HE3 LYS B 54 144.360 -6.229 -6.907 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 144.958 -5.561 -4.779 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 146.218 -4.917 -5.718 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 144.966 -3.909 -5.170 1.00 0.00 H new ATOM 2262 N ASP B 55 145.840 0.991 -10.513 1.00 0.00 N ATOM 2263 CA ASP B 55 146.470 1.645 -11.702 1.00 0.00 C ATOM 2264 C ASP B 55 147.837 2.222 -11.291 1.00 0.00 C ATOM 2265 O ASP B 55 147.923 3.182 -10.551 1.00 0.00 O ATOM 2266 CB ASP B 55 145.564 2.763 -12.215 1.00 0.00 C ATOM 2267 CG ASP B 55 146.189 3.386 -13.465 1.00 0.00 C ATOM 2268 OD1 ASP B 55 147.249 3.976 -13.344 1.00 0.00 O ATOM 2269 OD2 ASP B 55 145.594 3.262 -14.524 1.00 0.00 O ATOM 0 H ASP B 55 145.031 1.473 -10.121 1.00 0.00 H new ATOM 0 HA ASP B 55 146.608 0.912 -12.497 1.00 0.00 H new ATOM 0 HB2 ASP B 55 144.575 2.368 -12.447 1.00 0.00 H new ATOM 0 HB3 ASP B 55 145.431 3.522 -11.444 1.00 0.00 H new ATOM 2274 N GLU B 56 148.900 1.611 -11.745 1.00 0.00 N ATOM 2275 CA GLU B 56 150.281 2.063 -11.374 1.00 0.00 C ATOM 2276 C GLU B 56 150.613 3.481 -11.879 1.00 0.00 C ATOM 2277 O GLU B 56 151.258 4.247 -11.195 1.00 0.00 O ATOM 2278 CB GLU B 56 151.297 1.078 -11.967 1.00 0.00 C ATOM 2279 CG GLU B 56 152.720 1.477 -11.557 1.00 0.00 C ATOM 2280 CD GLU B 56 153.713 0.450 -12.099 1.00 0.00 C ATOM 2281 OE1 GLU B 56 153.268 -0.548 -12.640 1.00 0.00 O ATOM 2282 OE2 GLU B 56 154.904 0.679 -11.963 1.00 0.00 O ATOM 0 H GLU B 56 148.872 0.804 -12.368 1.00 0.00 H new ATOM 0 HA GLU B 56 150.330 2.090 -10.285 1.00 0.00 H new ATOM 0 HB2 GLU B 56 151.080 0.068 -11.620 1.00 0.00 H new ATOM 0 HB3 GLU B 56 151.213 1.067 -13.054 1.00 0.00 H new ATOM 0 HG2 GLU B 56 152.957 2.468 -11.944 1.00 0.00 H new ATOM 0 HG3 GLU B 56 152.795 1.533 -10.471 1.00 0.00 H new ATOM 2289 N ASP B 57 150.211 3.832 -13.070 1.00 0.00 N ATOM 2290 CA ASP B 57 150.547 5.191 -13.609 1.00 0.00 C ATOM 2291 C ASP B 57 149.787 6.282 -12.854 1.00 0.00 C ATOM 2292 O ASP B 57 150.314 7.341 -12.579 1.00 0.00 O ATOM 2293 CB ASP B 57 150.177 5.253 -15.091 1.00 0.00 C ATOM 2294 CG ASP B 57 151.136 4.373 -15.894 1.00 0.00 C ATOM 2295 OD1 ASP B 57 152.195 4.860 -16.253 1.00 0.00 O ATOM 2296 OD2 ASP B 57 150.793 3.228 -16.139 1.00 0.00 O ATOM 0 H ASP B 57 149.665 3.241 -13.696 1.00 0.00 H new ATOM 0 HA ASP B 57 151.616 5.360 -13.480 1.00 0.00 H new ATOM 0 HB2 ASP B 57 149.151 4.916 -15.235 1.00 0.00 H new ATOM 0 HB3 ASP B 57 150.227 6.282 -15.446 1.00 0.00 H new ATOM 2301 N LEU B 58 148.564 6.037 -12.522 1.00 0.00 N ATOM 2302 CA LEU B 58 147.794 7.079 -11.789 1.00 0.00 C ATOM 2303 C LEU B 58 148.362 7.218 -10.375 1.00 0.00 C ATOM 2304 O LEU B 58 148.469 8.303 -9.842 1.00 0.00 O ATOM 2305 CB LEU B 58 146.314 6.692 -11.721 1.00 0.00 C ATOM 2306 CG LEU B 58 145.681 6.762 -13.122 1.00 0.00 C ATOM 2307 CD1 LEU B 58 144.274 6.157 -13.068 1.00 0.00 C ATOM 2308 CD2 LEU B 58 145.593 8.225 -13.604 1.00 0.00 C ATOM 0 H LEU B 58 148.061 5.172 -12.720 1.00 0.00 H new ATOM 0 HA LEU B 58 147.880 8.030 -12.314 1.00 0.00 H new ATOM 0 HB2 LEU B 58 146.212 5.684 -11.318 1.00 0.00 H new ATOM 0 HB3 LEU B 58 145.786 7.362 -11.042 1.00 0.00 H new ATOM 0 HG LEU B 58 146.303 6.202 -13.820 1.00 0.00 H new ATOM 0 HD11 LEU B 58 143.820 6.203 -14.058 1.00 0.00 H new ATOM 0 HD12 LEU B 58 144.337 5.118 -12.746 1.00 0.00 H new ATOM 0 HD13 LEU B 58 143.663 6.719 -12.362 1.00 0.00 H new ATOM 0 HD21 LEU B 58 145.143 8.255 -14.596 1.00 0.00 H new ATOM 0 HD22 LEU B 58 144.980 8.800 -12.910 1.00 0.00 H new ATOM 0 HD23 LEU B 58 146.594 8.655 -13.647 1.00 0.00 H new ATOM 2320 N PHE B 59 148.754 6.129 -9.775 1.00 0.00 N ATOM 2321 CA PHE B 59 149.347 6.202 -8.410 1.00 0.00 C ATOM 2322 C PHE B 59 150.650 7.006 -8.455 1.00 0.00 C ATOM 2323 O PHE B 59 150.902 7.851 -7.621 1.00 0.00 O ATOM 2324 CB PHE B 59 149.630 4.784 -7.908 1.00 0.00 C ATOM 2325 CG PHE B 59 150.252 4.840 -6.530 1.00 0.00 C ATOM 2326 CD1 PHE B 59 149.456 5.123 -5.414 1.00 0.00 C ATOM 2327 CD2 PHE B 59 151.624 4.597 -6.367 1.00 0.00 C ATOM 2328 CE1 PHE B 59 150.028 5.165 -4.136 1.00 0.00 C ATOM 2329 CE2 PHE B 59 152.196 4.639 -5.090 1.00 0.00 C ATOM 2330 CZ PHE B 59 151.398 4.923 -3.973 1.00 0.00 C ATOM 0 H PHE B 59 148.690 5.191 -10.171 1.00 0.00 H new ATOM 0 HA PHE B 59 148.649 6.695 -7.734 1.00 0.00 H new ATOM 0 HB2 PHE B 59 148.705 4.209 -7.876 1.00 0.00 H new ATOM 0 HB3 PHE B 59 150.300 4.271 -8.598 1.00 0.00 H new ATOM 0 HD1 PHE B 59 148.399 5.309 -5.538 1.00 0.00 H new ATOM 0 HD2 PHE B 59 152.239 4.377 -7.227 1.00 0.00 H new ATOM 0 HE1 PHE B 59 149.412 5.384 -3.276 1.00 0.00 H new ATOM 0 HE2 PHE B 59 153.252 4.453 -4.965 1.00 0.00 H new ATOM 0 HZ PHE B 59 151.839 4.955 -2.988 1.00 0.00 H new ATOM 2340 N ARG B 60 151.492 6.726 -9.418 1.00 0.00 N ATOM 2341 CA ARG B 60 152.796 7.447 -9.510 1.00 0.00 C ATOM 2342 C ARG B 60 152.583 8.952 -9.674 1.00 0.00 C ATOM 2343 O ARG B 60 153.181 9.743 -8.973 1.00 0.00 O ATOM 2344 CB ARG B 60 153.590 6.924 -10.712 1.00 0.00 C ATOM 2345 CG ARG B 60 154.071 5.497 -10.442 1.00 0.00 C ATOM 2346 CD ARG B 60 154.708 4.926 -11.711 1.00 0.00 C ATOM 2347 NE ARG B 60 155.818 5.819 -12.153 1.00 0.00 N ATOM 2348 CZ ARG B 60 156.681 5.403 -13.040 1.00 0.00 C ATOM 2349 NH1 ARG B 60 156.586 4.198 -13.530 1.00 0.00 N ATOM 2350 NH2 ARG B 60 157.642 6.196 -13.435 1.00 0.00 N ATOM 0 H ARG B 60 151.331 6.028 -10.145 1.00 0.00 H new ATOM 0 HA ARG B 60 153.347 7.269 -8.586 1.00 0.00 H new ATOM 0 HB2 ARG B 60 152.967 6.943 -11.606 1.00 0.00 H new ATOM 0 HB3 ARG B 60 154.444 7.574 -10.905 1.00 0.00 H new ATOM 0 HG2 ARG B 60 154.794 5.493 -9.626 1.00 0.00 H new ATOM 0 HG3 ARG B 60 153.234 4.873 -10.129 1.00 0.00 H new ATOM 0 HD2 ARG B 60 155.088 3.922 -11.520 1.00 0.00 H new ATOM 0 HD3 ARG B 60 153.960 4.839 -12.499 1.00 0.00 H new ATOM 0 HE ARG B 60 155.903 6.757 -11.761 1.00 0.00 H new ATOM 0 HH11 ARG B 60 155.837 3.579 -13.220 1.00 0.00 H new ATOM 0 HH12 ARG B 60 157.261 3.875 -14.223 1.00 0.00 H new ATOM 0 HH21 ARG B 60 157.717 7.138 -13.050 1.00 0.00 H new ATOM 0 HH22 ARG B 60 158.317 5.873 -14.128 1.00 0.00 H new ATOM 2364 N GLU B 61 151.744 9.366 -10.581 1.00 0.00 N ATOM 2365 CA GLU B 61 151.518 10.827 -10.754 1.00 0.00 C ATOM 2366 C GLU B 61 150.913 11.391 -9.465 1.00 0.00 C ATOM 2367 O GLU B 61 151.258 12.471 -9.029 1.00 0.00 O ATOM 2368 CB GLU B 61 150.558 11.064 -11.927 1.00 0.00 C ATOM 2369 CG GLU B 61 150.401 12.569 -12.182 1.00 0.00 C ATOM 2370 CD GLU B 61 151.740 13.159 -12.627 1.00 0.00 C ATOM 2371 OE1 GLU B 61 152.587 12.396 -13.061 1.00 0.00 O ATOM 2372 OE2 GLU B 61 151.896 14.366 -12.527 1.00 0.00 O ATOM 0 H GLU B 61 151.209 8.762 -11.205 1.00 0.00 H new ATOM 0 HA GLU B 61 152.464 11.326 -10.964 1.00 0.00 H new ATOM 0 HB2 GLU B 61 150.938 10.573 -12.823 1.00 0.00 H new ATOM 0 HB3 GLU B 61 149.587 10.621 -11.708 1.00 0.00 H new ATOM 0 HG2 GLU B 61 149.644 12.741 -12.948 1.00 0.00 H new ATOM 0 HG3 GLU B 61 150.056 13.067 -11.276 1.00 0.00 H new ATOM 2379 N TRP B 62 150.017 10.670 -8.853 1.00 0.00 N ATOM 2380 CA TRP B 62 149.393 11.170 -7.593 1.00 0.00 C ATOM 2381 C TRP B 62 150.430 11.305 -6.472 1.00 0.00 C ATOM 2382 O TRP B 62 150.493 12.307 -5.793 1.00 0.00 O ATOM 2383 CB TRP B 62 148.294 10.195 -7.142 1.00 0.00 C ATOM 2384 CG TRP B 62 147.834 10.559 -5.761 1.00 0.00 C ATOM 2385 CD1 TRP B 62 146.901 11.490 -5.468 1.00 0.00 C ATOM 2386 CD2 TRP B 62 148.296 10.025 -4.485 1.00 0.00 C ATOM 2387 NE1 TRP B 62 146.752 11.559 -4.092 1.00 0.00 N ATOM 2388 CE2 TRP B 62 147.593 10.673 -3.442 1.00 0.00 C ATOM 2389 CE3 TRP B 62 149.245 9.045 -4.135 1.00 0.00 C ATOM 2390 CZ2 TRP B 62 147.825 10.361 -2.098 1.00 0.00 C ATOM 2391 CZ3 TRP B 62 149.478 8.729 -2.787 1.00 0.00 C ATOM 2392 CH2 TRP B 62 148.771 9.386 -1.772 1.00 0.00 C ATOM 0 H TRP B 62 149.689 9.757 -9.168 1.00 0.00 H new ATOM 0 HA TRP B 62 148.969 12.154 -7.794 1.00 0.00 H new ATOM 0 HB2 TRP B 62 147.455 10.230 -7.837 1.00 0.00 H new ATOM 0 HB3 TRP B 62 148.674 9.173 -7.152 1.00 0.00 H new ATOM 0 HD1 TRP B 62 146.359 12.084 -6.189 1.00 0.00 H new ATOM 0 HE1 TRP B 62 146.102 12.186 -3.617 1.00 0.00 H new ATOM 0 HE3 TRP B 62 149.797 8.533 -4.909 1.00 0.00 H new ATOM 0 HZ2 TRP B 62 147.277 10.870 -1.319 1.00 0.00 H new ATOM 0 HZ3 TRP B 62 150.207 7.974 -2.531 1.00 0.00 H new ATOM 0 HH2 TRP B 62 148.957 9.139 -0.737 1.00 0.00 H new ATOM 2403 N LEU B 63 151.230 10.301 -6.263 1.00 0.00 N ATOM 2404 CA LEU B 63 152.240 10.372 -5.170 1.00 0.00 C ATOM 2405 C LEU B 63 153.286 11.443 -5.484 1.00 0.00 C ATOM 2406 O LEU B 63 153.663 12.221 -4.631 1.00 0.00 O ATOM 2407 CB LEU B 63 152.917 9.000 -5.032 1.00 0.00 C ATOM 2408 CG LEU B 63 153.969 9.023 -3.913 1.00 0.00 C ATOM 2409 CD1 LEU B 63 153.311 9.325 -2.558 1.00 0.00 C ATOM 2410 CD2 LEU B 63 154.664 7.659 -3.858 1.00 0.00 C ATOM 0 H LEU B 63 151.230 9.434 -6.800 1.00 0.00 H new ATOM 0 HA LEU B 63 151.748 10.637 -4.234 1.00 0.00 H new ATOM 0 HB2 LEU B 63 152.167 8.239 -4.817 1.00 0.00 H new ATOM 0 HB3 LEU B 63 153.389 8.725 -5.976 1.00 0.00 H new ATOM 0 HG LEU B 63 154.698 9.806 -4.122 1.00 0.00 H new ATOM 0 HD11 LEU B 63 154.073 9.337 -1.778 1.00 0.00 H new ATOM 0 HD12 LEU B 63 152.820 10.297 -2.601 1.00 0.00 H new ATOM 0 HD13 LEU B 63 152.573 8.555 -2.332 1.00 0.00 H new ATOM 0 HD21 LEU B 63 155.413 7.664 -3.066 1.00 0.00 H new ATOM 0 HD22 LEU B 63 153.926 6.883 -3.654 1.00 0.00 H new ATOM 0 HD23 LEU B 63 155.147 7.458 -4.814 1.00 0.00 H new ATOM 2422 N LYS B 64 153.766 11.485 -6.692 1.00 0.00 N ATOM 2423 CA LYS B 64 154.795 12.498 -7.055 1.00 0.00 C ATOM 2424 C LYS B 64 154.233 13.904 -6.841 1.00 0.00 C ATOM 2425 O LYS B 64 154.859 14.752 -6.236 1.00 0.00 O ATOM 2426 CB LYS B 64 155.186 12.304 -8.530 1.00 0.00 C ATOM 2427 CG LYS B 64 156.271 13.309 -8.966 1.00 0.00 C ATOM 2428 CD LYS B 64 157.618 12.954 -8.322 1.00 0.00 C ATOM 2429 CE LYS B 64 158.734 13.757 -8.993 1.00 0.00 C ATOM 2430 NZ LYS B 64 158.580 15.200 -8.656 1.00 0.00 N ATOM 0 H LYS B 64 153.490 10.859 -7.448 1.00 0.00 H new ATOM 0 HA LYS B 64 155.676 12.374 -6.425 1.00 0.00 H new ATOM 0 HB2 LYS B 64 155.549 11.287 -8.680 1.00 0.00 H new ATOM 0 HB3 LYS B 64 154.304 12.424 -9.160 1.00 0.00 H new ATOM 0 HG2 LYS B 64 156.367 13.302 -10.052 1.00 0.00 H new ATOM 0 HG3 LYS B 64 155.978 14.318 -8.678 1.00 0.00 H new ATOM 0 HD2 LYS B 64 157.591 13.172 -7.254 1.00 0.00 H new ATOM 0 HD3 LYS B 64 157.812 11.886 -8.425 1.00 0.00 H new ATOM 0 HE2 LYS B 64 159.707 13.397 -8.659 1.00 0.00 H new ATOM 0 HE3 LYS B 64 158.697 13.619 -10.074 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 159.402 15.729 -9.012 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 157.713 15.569 -9.097 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 158.517 15.311 -7.624 1.00 0.00 H new ATOM 2444 N ASP B 65 153.058 14.157 -7.342 1.00 0.00 N ATOM 2445 CA ASP B 65 152.448 15.507 -7.183 1.00 0.00 C ATOM 2446 C ASP B 65 152.067 15.741 -5.722 1.00 0.00 C ATOM 2447 O ASP B 65 152.027 16.861 -5.255 1.00 0.00 O ATOM 2448 CB ASP B 65 151.199 15.609 -8.062 1.00 0.00 C ATOM 2449 CG ASP B 65 151.619 15.747 -9.528 1.00 0.00 C ATOM 2450 OD1 ASP B 65 152.513 16.533 -9.794 1.00 0.00 O ATOM 2451 OD2 ASP B 65 151.042 15.064 -10.357 1.00 0.00 O ATOM 0 H ASP B 65 152.490 13.484 -7.857 1.00 0.00 H new ATOM 0 HA ASP B 65 153.171 16.264 -7.487 1.00 0.00 H new ATOM 0 HB2 ASP B 65 150.576 14.724 -7.932 1.00 0.00 H new ATOM 0 HB3 ASP B 65 150.599 16.468 -7.762 1.00 0.00 H new ATOM 2456 N THR B 66 151.749 14.701 -5.002 1.00 0.00 N ATOM 2457 CA THR B 66 151.328 14.881 -3.586 1.00 0.00 C ATOM 2458 C THR B 66 152.526 15.158 -2.674 1.00 0.00 C ATOM 2459 O THR B 66 152.405 15.931 -1.744 1.00 0.00 O ATOM 2460 CB THR B 66 150.604 13.622 -3.099 1.00 0.00 C ATOM 2461 OG1 THR B 66 149.505 13.350 -3.956 1.00 0.00 O ATOM 2462 CG2 THR B 66 150.086 13.844 -1.676 1.00 0.00 C ATOM 0 H THR B 66 151.763 13.736 -5.333 1.00 0.00 H new ATOM 0 HA THR B 66 150.659 15.741 -3.543 1.00 0.00 H new ATOM 0 HB THR B 66 151.298 12.781 -3.108 1.00 0.00 H new ATOM 0 HG1 THR B 66 149.782 12.719 -4.653 1.00 0.00 H new ATOM 0 HG21 THR B 66 149.571 12.947 -1.332 1.00 0.00 H new ATOM 0 HG22 THR B 66 150.924 14.058 -1.013 1.00 0.00 H new ATOM 0 HG23 THR B 66 149.393 14.685 -1.668 1.00 0.00 H new ATOM 2470 N CYS B 67 153.666 14.522 -2.873 1.00 0.00 N ATOM 2471 CA CYS B 67 154.825 14.754 -1.942 1.00 0.00 C ATOM 2472 C CYS B 67 156.120 15.065 -2.694 1.00 0.00 C ATOM 2473 O CYS B 67 156.987 15.748 -2.186 1.00 0.00 O ATOM 2474 CB CYS B 67 155.043 13.490 -1.110 1.00 0.00 C ATOM 2475 SG CYS B 67 155.290 12.079 -2.217 1.00 0.00 S ATOM 0 H CYS B 67 153.841 13.861 -3.630 1.00 0.00 H new ATOM 0 HA CYS B 67 154.583 15.613 -1.316 1.00 0.00 H new ATOM 0 HB2 CYS B 67 155.910 13.613 -0.461 1.00 0.00 H new ATOM 0 HB3 CYS B 67 154.183 13.314 -0.464 1.00 0.00 H new ATOM 0 HG CYS B 67 154.328 12.039 -3.091 1.00 0.00 H new ATOM 2481 N GLY B 68 156.276 14.548 -3.886 1.00 0.00 N ATOM 2482 CA GLY B 68 157.535 14.791 -4.659 1.00 0.00 C ATOM 2483 C GLY B 68 158.407 13.535 -4.576 1.00 0.00 C ATOM 2484 O GLY B 68 159.576 13.556 -4.904 1.00 0.00 O ATOM 0 H GLY B 68 155.585 13.966 -4.360 1.00 0.00 H new ATOM 0 HA2 GLY B 68 157.302 15.022 -5.698 1.00 0.00 H new ATOM 0 HA3 GLY B 68 158.069 15.650 -4.253 1.00 0.00 H new ATOM 2488 N ALA B 69 157.843 12.435 -4.144 1.00 0.00 N ATOM 2489 CA ALA B 69 158.637 11.176 -4.046 1.00 0.00 C ATOM 2490 C ALA B 69 159.349 10.925 -5.376 1.00 0.00 C ATOM 2491 O ALA B 69 158.930 11.402 -6.412 1.00 0.00 O ATOM 2492 CB ALA B 69 157.700 10.004 -3.744 1.00 0.00 C ATOM 0 H ALA B 69 156.868 12.356 -3.856 1.00 0.00 H new ATOM 0 HA ALA B 69 159.372 11.269 -3.247 1.00 0.00 H new ATOM 0 HB1 ALA B 69 158.280 9.084 -3.672 1.00 0.00 H new ATOM 0 HB2 ALA B 69 157.186 10.183 -2.800 1.00 0.00 H new ATOM 0 HB3 ALA B 69 156.966 9.909 -4.545 1.00 0.00 H new ATOM 2498 N ASN B 70 160.435 10.195 -5.361 1.00 0.00 N ATOM 2499 CA ASN B 70 161.178 9.939 -6.630 1.00 0.00 C ATOM 2500 C ASN B 70 160.620 8.702 -7.339 1.00 0.00 C ATOM 2501 O ASN B 70 159.834 7.953 -6.795 1.00 0.00 O ATOM 2502 CB ASN B 70 162.655 9.703 -6.310 1.00 0.00 C ATOM 2503 CG ASN B 70 163.405 9.356 -7.597 1.00 0.00 C ATOM 2504 OD1 ASN B 70 163.257 10.116 -8.648 1.00 0.00 O flip ATOM 2505 ND2 ASN B 70 164.131 8.383 -7.649 1.00 0.00 N flip ATOM 0 H ASN B 70 160.838 9.767 -4.527 1.00 0.00 H new ATOM 0 HA ASN B 70 161.065 10.805 -7.283 1.00 0.00 H new ATOM 0 HB2 ASN B 70 163.086 10.594 -5.854 1.00 0.00 H new ATOM 0 HB3 ASN B 70 162.757 8.894 -5.587 1.00 0.00 H new ATOM 0 HD21 ASN B 70 164.247 7.789 -6.828 1.00 0.00 H new ATOM 0 HD22 ASN B 70 164.624 8.160 -8.514 1.00 0.00 H new ATOM 2512 N ALA B 71 161.031 8.497 -8.561 1.00 0.00 N ATOM 2513 CA ALA B 71 160.548 7.326 -9.347 1.00 0.00 C ATOM 2514 C ALA B 71 160.947 6.017 -8.662 1.00 0.00 C ATOM 2515 O ALA B 71 160.238 5.034 -8.732 1.00 0.00 O ATOM 2516 CB ALA B 71 161.172 7.368 -10.743 1.00 0.00 C ATOM 0 H ALA B 71 161.690 9.100 -9.054 1.00 0.00 H new ATOM 0 HA ALA B 71 159.461 7.372 -9.415 1.00 0.00 H new ATOM 0 HB1 ALA B 71 160.823 6.514 -11.323 1.00 0.00 H new ATOM 0 HB2 ALA B 71 160.881 8.291 -11.244 1.00 0.00 H new ATOM 0 HB3 ALA B 71 162.258 7.329 -10.657 1.00 0.00 H new ATOM 2522 N LYS B 72 162.078 5.986 -8.012 1.00 0.00 N ATOM 2523 CA LYS B 72 162.510 4.723 -7.347 1.00 0.00 C ATOM 2524 C LYS B 72 161.634 4.455 -6.123 1.00 0.00 C ATOM 2525 O LYS B 72 161.251 3.332 -5.847 1.00 0.00 O ATOM 2526 CB LYS B 72 163.970 4.860 -6.906 1.00 0.00 C ATOM 2527 CG LYS B 72 164.451 3.549 -6.275 1.00 0.00 C ATOM 2528 CD LYS B 72 165.907 3.702 -5.834 1.00 0.00 C ATOM 2529 CE LYS B 72 166.388 2.393 -5.205 1.00 0.00 C ATOM 2530 NZ LYS B 72 167.740 2.594 -4.613 1.00 0.00 N ATOM 0 H LYS B 72 162.718 6.774 -7.913 1.00 0.00 H new ATOM 0 HA LYS B 72 162.411 3.894 -8.047 1.00 0.00 H new ATOM 0 HB2 LYS B 72 164.595 5.112 -7.763 1.00 0.00 H new ATOM 0 HB3 LYS B 72 164.067 5.676 -6.189 1.00 0.00 H new ATOM 0 HG2 LYS B 72 163.825 3.293 -5.420 1.00 0.00 H new ATOM 0 HG3 LYS B 72 164.360 2.733 -6.992 1.00 0.00 H new ATOM 0 HD2 LYS B 72 166.532 3.959 -6.689 1.00 0.00 H new ATOM 0 HD3 LYS B 72 165.997 4.518 -5.117 1.00 0.00 H new ATOM 0 HE2 LYS B 72 165.687 2.068 -4.436 1.00 0.00 H new ATOM 0 HE3 LYS B 72 166.422 1.606 -5.958 1.00 0.00 H new ATOM 0 HZ1 LYS B 72 168.067 1.704 -4.185 1.00 0.00 H new ATOM 0 HZ2 LYS B 72 168.405 2.886 -5.357 1.00 0.00 H new ATOM 0 HZ3 LYS B 72 167.693 3.333 -3.882 1.00 0.00 H new ATOM 2544 N GLN B 73 161.333 5.478 -5.373 1.00 0.00 N ATOM 2545 CA GLN B 73 160.511 5.300 -4.148 1.00 0.00 C ATOM 2546 C GLN B 73 159.097 4.869 -4.517 1.00 0.00 C ATOM 2547 O GLN B 73 158.465 4.110 -3.811 1.00 0.00 O ATOM 2548 CB GLN B 73 160.460 6.623 -3.380 1.00 0.00 C ATOM 2549 CG GLN B 73 161.841 6.926 -2.794 1.00 0.00 C ATOM 2550 CD GLN B 73 161.795 8.248 -2.025 1.00 0.00 C ATOM 2551 OE1 GLN B 73 161.450 9.274 -2.578 1.00 0.00 O ATOM 2552 NE2 GLN B 73 162.128 8.268 -0.764 1.00 0.00 N ATOM 0 H GLN B 73 161.625 6.437 -5.560 1.00 0.00 H new ATOM 0 HA GLN B 73 160.961 4.527 -3.525 1.00 0.00 H new ATOM 0 HB2 GLN B 73 160.150 7.430 -4.044 1.00 0.00 H new ATOM 0 HB3 GLN B 73 159.719 6.565 -2.582 1.00 0.00 H new ATOM 0 HG2 GLN B 73 162.150 6.119 -2.130 1.00 0.00 H new ATOM 0 HG3 GLN B 73 162.581 6.984 -3.592 1.00 0.00 H new ATOM 0 HE21 GLN B 73 162.418 7.407 -0.299 1.00 0.00 H new ATOM 0 HE22 GLN B 73 162.099 9.144 -0.243 1.00 0.00 H new ATOM 2561 N SER B 74 158.585 5.359 -5.610 1.00 0.00 N ATOM 2562 CA SER B 74 157.205 4.990 -6.014 1.00 0.00 C ATOM 2563 C SER B 74 157.145 3.515 -6.420 1.00 0.00 C ATOM 2564 O SER B 74 156.184 2.829 -6.135 1.00 0.00 O ATOM 2565 CB SER B 74 156.774 5.862 -7.191 1.00 0.00 C ATOM 2566 OG SER B 74 155.376 5.717 -7.393 1.00 0.00 O ATOM 0 H SER B 74 159.065 6.000 -6.241 1.00 0.00 H new ATOM 0 HA SER B 74 156.533 5.149 -5.170 1.00 0.00 H new ATOM 0 HB2 SER B 74 157.019 6.906 -6.994 1.00 0.00 H new ATOM 0 HB3 SER B 74 157.316 5.572 -8.091 1.00 0.00 H new ATOM 0 HG SER B 74 154.939 6.588 -7.291 1.00 0.00 H new ATOM 2572 N ARG B 75 158.152 3.014 -7.092 1.00 0.00 N ATOM 2573 CA ARG B 75 158.118 1.584 -7.513 1.00 0.00 C ATOM 2574 C ARG B 75 158.020 0.689 -6.280 1.00 0.00 C ATOM 2575 O ARG B 75 157.360 -0.331 -6.306 1.00 0.00 O ATOM 2576 CB ARG B 75 159.379 1.232 -8.306 1.00 0.00 C ATOM 2577 CG ARG B 75 159.333 1.932 -9.667 1.00 0.00 C ATOM 2578 CD ARG B 75 160.542 1.509 -10.503 1.00 0.00 C ATOM 2579 NE ARG B 75 161.797 1.862 -9.783 1.00 0.00 N ATOM 2580 CZ ARG B 75 162.934 1.348 -10.166 1.00 0.00 C ATOM 2581 NH1 ARG B 75 162.970 0.545 -11.193 1.00 0.00 N ATOM 2582 NH2 ARG B 75 164.033 1.639 -9.525 1.00 0.00 N ATOM 0 H ARG B 75 158.988 3.530 -7.364 1.00 0.00 H new ATOM 0 HA ARG B 75 157.247 1.425 -8.149 1.00 0.00 H new ATOM 0 HB2 ARG B 75 160.267 1.541 -7.755 1.00 0.00 H new ATOM 0 HB3 ARG B 75 159.448 0.153 -8.441 1.00 0.00 H new ATOM 0 HG2 ARG B 75 158.410 1.676 -10.188 1.00 0.00 H new ATOM 0 HG3 ARG B 75 159.333 3.013 -9.531 1.00 0.00 H new ATOM 0 HD2 ARG B 75 160.509 0.436 -10.691 1.00 0.00 H new ATOM 0 HD3 ARG B 75 160.516 2.004 -11.474 1.00 0.00 H new ATOM 0 HE ARG B 75 161.768 2.505 -8.991 1.00 0.00 H new ATOM 0 HH11 ARG B 75 162.111 0.320 -11.695 1.00 0.00 H new ATOM 0 HH12 ARG B 75 163.857 0.142 -11.494 1.00 0.00 H new ATOM 0 HH21 ARG B 75 164.004 2.269 -8.723 1.00 0.00 H new ATOM 0 HH22 ARG B 75 164.921 1.236 -9.826 1.00 0.00 H new ATOM 2596 N ASP B 76 158.679 1.027 -5.203 1.00 0.00 N ATOM 2597 CA ASP B 76 158.630 0.163 -3.991 1.00 0.00 C ATOM 2598 C ASP B 76 157.236 0.187 -3.362 1.00 0.00 C ATOM 2599 O ASP B 76 156.749 -0.821 -2.891 1.00 0.00 O ATOM 2600 CB ASP B 76 159.658 0.660 -2.972 1.00 0.00 C ATOM 2601 CG ASP B 76 161.071 0.371 -3.484 1.00 0.00 C ATOM 2602 OD1 ASP B 76 161.201 -0.470 -4.360 1.00 0.00 O ATOM 2603 OD2 ASP B 76 161.998 0.989 -2.989 1.00 0.00 O ATOM 0 H ASP B 76 159.250 1.867 -5.112 1.00 0.00 H new ATOM 0 HA ASP B 76 158.860 -0.861 -4.284 1.00 0.00 H new ATOM 0 HB2 ASP B 76 159.532 1.730 -2.806 1.00 0.00 H new ATOM 0 HB3 ASP B 76 159.501 0.168 -2.012 1.00 0.00 H new ATOM 2608 N CYS B 77 156.585 1.317 -3.342 1.00 0.00 N ATOM 2609 CA CYS B 77 155.227 1.370 -2.733 1.00 0.00 C ATOM 2610 C CYS B 77 154.243 0.537 -3.560 1.00 0.00 C ATOM 2611 O CYS B 77 153.389 -0.135 -3.016 1.00 0.00 O ATOM 2612 CB CYS B 77 154.748 2.822 -2.684 1.00 0.00 C ATOM 2613 SG CYS B 77 155.719 3.734 -1.458 1.00 0.00 S ATOM 0 H CYS B 77 156.931 2.200 -3.718 1.00 0.00 H new ATOM 0 HA CYS B 77 155.275 0.963 -1.723 1.00 0.00 H new ATOM 0 HB2 CYS B 77 154.854 3.285 -3.665 1.00 0.00 H new ATOM 0 HB3 CYS B 77 153.690 2.859 -2.426 1.00 0.00 H new ATOM 0 HG CYS B 77 156.297 2.895 -0.651 1.00 0.00 H new ATOM 2619 N PHE B 78 154.327 0.580 -4.863 1.00 0.00 N ATOM 2620 CA PHE B 78 153.358 -0.209 -5.674 1.00 0.00 C ATOM 2621 C PHE B 78 153.457 -1.689 -5.308 1.00 0.00 C ATOM 2622 O PHE B 78 152.494 -2.300 -4.891 1.00 0.00 O ATOM 2623 CB PHE B 78 153.664 -0.020 -7.163 1.00 0.00 C ATOM 2624 CG PHE B 78 152.686 -0.822 -7.993 1.00 0.00 C ATOM 2625 CD1 PHE B 78 151.481 -0.244 -8.411 1.00 0.00 C ATOM 2626 CD2 PHE B 78 152.992 -2.139 -8.353 1.00 0.00 C ATOM 2627 CE1 PHE B 78 150.581 -0.986 -9.188 1.00 0.00 C ATOM 2628 CE2 PHE B 78 152.092 -2.881 -9.129 1.00 0.00 C ATOM 2629 CZ PHE B 78 150.887 -2.304 -9.546 1.00 0.00 C ATOM 0 H PHE B 78 155.013 1.118 -5.393 1.00 0.00 H new ATOM 0 HA PHE B 78 152.347 0.140 -5.466 1.00 0.00 H new ATOM 0 HB2 PHE B 78 153.598 1.036 -7.426 1.00 0.00 H new ATOM 0 HB3 PHE B 78 154.684 -0.339 -7.377 1.00 0.00 H new ATOM 0 HD1 PHE B 78 151.245 0.773 -8.135 1.00 0.00 H new ATOM 0 HD2 PHE B 78 153.922 -2.584 -8.032 1.00 0.00 H new ATOM 0 HE1 PHE B 78 149.651 -0.541 -9.510 1.00 0.00 H new ATOM 0 HE2 PHE B 78 152.328 -3.898 -9.405 1.00 0.00 H new ATOM 0 HZ PHE B 78 150.193 -2.876 -10.144 1.00 0.00 H new ATOM 2639 N GLY B 79 154.612 -2.275 -5.463 1.00 0.00 N ATOM 2640 CA GLY B 79 154.771 -3.719 -5.128 1.00 0.00 C ATOM 2641 C GLY B 79 154.493 -3.959 -3.640 1.00 0.00 C ATOM 2642 O GLY B 79 153.992 -4.991 -3.253 1.00 0.00 O ATOM 0 H GLY B 79 155.455 -1.815 -5.808 1.00 0.00 H new ATOM 0 HA2 GLY B 79 154.088 -4.316 -5.732 1.00 0.00 H new ATOM 0 HA3 GLY B 79 155.782 -4.046 -5.372 1.00 0.00 H new ATOM 2646 N CYS B 80 154.818 -3.020 -2.803 1.00 0.00 N ATOM 2647 CA CYS B 80 154.573 -3.218 -1.345 1.00 0.00 C ATOM 2648 C CYS B 80 153.069 -3.241 -1.068 1.00 0.00 C ATOM 2649 O CYS B 80 152.556 -4.141 -0.433 1.00 0.00 O ATOM 2650 CB CYS B 80 155.211 -2.069 -0.566 1.00 0.00 C ATOM 2651 SG CYS B 80 155.011 -2.357 1.210 1.00 0.00 S ATOM 0 H CYS B 80 155.240 -2.128 -3.059 1.00 0.00 H new ATOM 0 HA CYS B 80 155.011 -4.166 -1.033 1.00 0.00 H new ATOM 0 HB2 CYS B 80 156.269 -1.990 -0.815 1.00 0.00 H new ATOM 0 HB3 CYS B 80 154.746 -1.124 -0.846 1.00 0.00 H new ATOM 0 HG CYS B 80 154.529 -1.288 1.771 1.00 0.00 H new ATOM 2657 N LEU B 81 152.360 -2.264 -1.552 1.00 0.00 N ATOM 2658 CA LEU B 81 150.889 -2.247 -1.325 1.00 0.00 C ATOM 2659 C LEU B 81 150.235 -3.367 -2.143 1.00 0.00 C ATOM 2660 O LEU B 81 149.317 -4.022 -1.689 1.00 0.00 O ATOM 2661 CB LEU B 81 150.323 -0.887 -1.749 1.00 0.00 C ATOM 2662 CG LEU B 81 150.978 0.231 -0.923 1.00 0.00 C ATOM 2663 CD1 LEU B 81 150.449 1.588 -1.400 1.00 0.00 C ATOM 2664 CD2 LEU B 81 150.655 0.047 0.574 1.00 0.00 C ATOM 0 H LEU B 81 152.730 -1.481 -2.091 1.00 0.00 H new ATOM 0 HA LEU B 81 150.678 -2.407 -0.268 1.00 0.00 H new ATOM 0 HB2 LEU B 81 150.506 -0.722 -2.811 1.00 0.00 H new ATOM 0 HB3 LEU B 81 149.243 -0.872 -1.606 1.00 0.00 H new ATOM 0 HG LEU B 81 152.059 0.188 -1.057 1.00 0.00 H new ATOM 0 HD11 LEU B 81 150.911 2.384 -0.816 1.00 0.00 H new ATOM 0 HD12 LEU B 81 150.692 1.723 -2.454 1.00 0.00 H new ATOM 0 HD13 LEU B 81 149.367 1.623 -1.269 1.00 0.00 H new ATOM 0 HD21 LEU B 81 151.125 0.845 1.148 1.00 0.00 H new ATOM 0 HD22 LEU B 81 149.575 0.082 0.720 1.00 0.00 H new ATOM 0 HD23 LEU B 81 151.036 -0.916 0.913 1.00 0.00 H new ATOM 2676 N ARG B 82 150.690 -3.588 -3.347 1.00 0.00 N ATOM 2677 CA ARG B 82 150.080 -4.661 -4.188 1.00 0.00 C ATOM 2678 C ARG B 82 150.283 -6.037 -3.543 1.00 0.00 C ATOM 2679 O ARG B 82 149.405 -6.877 -3.572 1.00 0.00 O ATOM 2680 CB ARG B 82 150.711 -4.660 -5.583 1.00 0.00 C ATOM 2681 CG ARG B 82 150.006 -5.707 -6.452 1.00 0.00 C ATOM 2682 CD ARG B 82 150.549 -5.657 -7.879 1.00 0.00 C ATOM 2683 NE ARG B 82 149.864 -6.700 -8.695 1.00 0.00 N ATOM 2684 CZ ARG B 82 149.944 -6.673 -9.996 1.00 0.00 C ATOM 2685 NH1 ARG B 82 150.599 -5.715 -10.591 1.00 0.00 N ATOM 2686 NH2 ARG B 82 149.361 -7.602 -10.703 1.00 0.00 N ATOM 0 H ARG B 82 151.455 -3.074 -3.784 1.00 0.00 H new ATOM 0 HA ARG B 82 149.012 -4.461 -4.269 1.00 0.00 H new ATOM 0 HB2 ARG B 82 150.621 -3.673 -6.036 1.00 0.00 H new ATOM 0 HB3 ARG B 82 151.776 -4.883 -5.514 1.00 0.00 H new ATOM 0 HG2 ARG B 82 150.157 -6.701 -6.032 1.00 0.00 H new ATOM 0 HG3 ARG B 82 148.932 -5.523 -6.457 1.00 0.00 H new ATOM 0 HD2 ARG B 82 150.382 -4.670 -8.311 1.00 0.00 H new ATOM 0 HD3 ARG B 82 151.626 -5.826 -7.878 1.00 0.00 H new ATOM 0 HE ARG B 82 149.331 -7.437 -8.234 1.00 0.00 H new ATOM 0 HH11 ARG B 82 151.050 -4.986 -10.038 1.00 0.00 H new ATOM 0 HH12 ARG B 82 150.661 -5.695 -11.609 1.00 0.00 H new ATOM 0 HH21 ARG B 82 148.844 -8.348 -10.238 1.00 0.00 H new ATOM 0 HH22 ARG B 82 149.423 -7.582 -11.721 1.00 0.00 H new ATOM 2700 N GLU B 83 151.432 -6.286 -2.979 1.00 0.00 N ATOM 2701 CA GLU B 83 151.685 -7.619 -2.357 1.00 0.00 C ATOM 2702 C GLU B 83 150.834 -7.796 -1.099 1.00 0.00 C ATOM 2703 O GLU B 83 150.303 -8.862 -0.857 1.00 0.00 O ATOM 2704 CB GLU B 83 153.169 -7.744 -1.999 1.00 0.00 C ATOM 2705 CG GLU B 83 153.995 -7.908 -3.278 1.00 0.00 C ATOM 2706 CD GLU B 83 153.743 -9.291 -3.879 1.00 0.00 C ATOM 2707 OE1 GLU B 83 153.298 -10.160 -3.148 1.00 0.00 O ATOM 2708 OE2 GLU B 83 153.998 -9.456 -5.060 1.00 0.00 O ATOM 0 H GLU B 83 152.207 -5.626 -2.921 1.00 0.00 H new ATOM 0 HA GLU B 83 151.414 -8.396 -3.072 1.00 0.00 H new ATOM 0 HB2 GLU B 83 153.497 -6.859 -1.453 1.00 0.00 H new ATOM 0 HB3 GLU B 83 153.324 -8.600 -1.342 1.00 0.00 H new ATOM 0 HG2 GLU B 83 153.727 -7.134 -3.997 1.00 0.00 H new ATOM 0 HG3 GLU B 83 155.055 -7.785 -3.056 1.00 0.00 H new ATOM 2715 N TRP B 84 150.670 -6.775 -0.300 1.00 0.00 N ATOM 2716 CA TRP B 84 149.825 -6.917 0.917 1.00 0.00 C ATOM 2717 C TRP B 84 148.403 -7.291 0.486 1.00 0.00 C ATOM 2718 O TRP B 84 147.770 -8.153 1.063 1.00 0.00 O ATOM 2719 CB TRP B 84 149.804 -5.592 1.680 1.00 0.00 C ATOM 2720 CG TRP B 84 149.098 -5.773 2.984 1.00 0.00 C ATOM 2721 CD1 TRP B 84 149.700 -6.102 4.150 1.00 0.00 C ATOM 2722 CD2 TRP B 84 147.676 -5.650 3.279 1.00 0.00 C ATOM 2723 NE1 TRP B 84 148.741 -6.180 5.142 1.00 0.00 N ATOM 2724 CE2 TRP B 84 147.479 -5.913 4.654 1.00 0.00 C ATOM 2725 CE3 TRP B 84 146.550 -5.339 2.496 1.00 0.00 C ATOM 2726 CZ2 TRP B 84 146.213 -5.868 5.234 1.00 0.00 C ATOM 2727 CZ3 TRP B 84 145.271 -5.294 3.078 1.00 0.00 C ATOM 2728 CH2 TRP B 84 145.105 -5.559 4.444 1.00 0.00 C ATOM 0 H TRP B 84 151.084 -5.853 -0.438 1.00 0.00 H new ATOM 0 HA TRP B 84 150.230 -7.694 1.566 1.00 0.00 H new ATOM 0 HB2 TRP B 84 150.823 -5.244 1.852 1.00 0.00 H new ATOM 0 HB3 TRP B 84 149.302 -4.828 1.087 1.00 0.00 H new ATOM 0 HD1 TRP B 84 150.758 -6.275 4.284 1.00 0.00 H new ATOM 0 HE1 TRP B 84 148.942 -6.407 6.116 1.00 0.00 H new ATOM 0 HE3 TRP B 84 146.668 -5.134 1.442 1.00 0.00 H new ATOM 0 HZ2 TRP B 84 146.090 -6.071 6.288 1.00 0.00 H new ATOM 0 HZ3 TRP B 84 144.412 -5.054 2.469 1.00 0.00 H new ATOM 0 HH2 TRP B 84 144.120 -5.524 4.885 1.00 0.00 H new ATOM 2739 N CYS B 85 147.896 -6.636 -0.524 1.00 0.00 N ATOM 2740 CA CYS B 85 146.512 -6.937 -0.995 1.00 0.00 C ATOM 2741 C CYS B 85 146.420 -8.402 -1.431 1.00 0.00 C ATOM 2742 O CYS B 85 145.450 -9.081 -1.163 1.00 0.00 O ATOM 2743 CB CYS B 85 146.174 -6.027 -2.179 1.00 0.00 C ATOM 2744 SG CYS B 85 145.797 -4.364 -1.574 1.00 0.00 S ATOM 0 H CYS B 85 148.381 -5.905 -1.044 1.00 0.00 H new ATOM 0 HA CYS B 85 145.806 -6.761 -0.184 1.00 0.00 H new ATOM 0 HB2 CYS B 85 147.012 -5.991 -2.875 1.00 0.00 H new ATOM 0 HB3 CYS B 85 145.322 -6.428 -2.728 1.00 0.00 H new ATOM 0 HG CYS B 85 145.512 -3.591 -2.579 1.00 0.00 H new ATOM 2750 N ASP B 86 147.426 -8.891 -2.097 1.00 0.00 N ATOM 2751 CA ASP B 86 147.409 -10.311 -2.549 1.00 0.00 C ATOM 2752 C ASP B 86 147.301 -11.246 -1.342 1.00 0.00 C ATOM 2753 O ASP B 86 146.741 -12.321 -1.428 1.00 0.00 O ATOM 2754 CB ASP B 86 148.691 -10.619 -3.325 1.00 0.00 C ATOM 2755 CG ASP B 86 148.653 -9.906 -4.679 1.00 0.00 C ATOM 2756 OD1 ASP B 86 147.567 -9.560 -5.114 1.00 0.00 O ATOM 2757 OD2 ASP B 86 149.711 -9.717 -5.257 1.00 0.00 O ATOM 0 H ASP B 86 148.264 -8.367 -2.350 1.00 0.00 H new ATOM 0 HA ASP B 86 146.546 -10.467 -3.197 1.00 0.00 H new ATOM 0 HB2 ASP B 86 149.561 -10.293 -2.755 1.00 0.00 H new ATOM 0 HB3 ASP B 86 148.791 -11.695 -3.471 1.00 0.00 H new ATOM 2762 N ALA B 87 147.852 -10.858 -0.220 1.00 0.00 N ATOM 2763 CA ALA B 87 147.801 -11.742 0.983 1.00 0.00 C ATOM 2764 C ALA B 87 146.508 -11.505 1.763 1.00 0.00 C ATOM 2765 O ALA B 87 145.948 -12.419 2.335 1.00 0.00 O ATOM 2766 CB ALA B 87 148.997 -11.438 1.890 1.00 0.00 C ATOM 0 H ALA B 87 148.334 -9.969 -0.085 1.00 0.00 H new ATOM 0 HA ALA B 87 147.835 -12.781 0.656 1.00 0.00 H new ATOM 0 HB1 ALA B 87 148.961 -12.083 2.768 1.00 0.00 H new ATOM 0 HB2 ALA B 87 149.923 -11.620 1.344 1.00 0.00 H new ATOM 0 HB3 ALA B 87 148.960 -10.395 2.204 1.00 0.00 H new ATOM 2772 N PHE B 88 146.050 -10.279 1.825 1.00 0.00 N ATOM 2773 CA PHE B 88 144.811 -9.972 2.606 1.00 0.00 C ATOM 2774 C PHE B 88 143.647 -9.684 1.663 1.00 0.00 C ATOM 2775 O PHE B 88 142.890 -10.566 1.311 1.00 0.00 O ATOM 2776 CB PHE B 88 145.065 -8.743 3.480 1.00 0.00 C ATOM 2777 CG PHE B 88 146.097 -9.077 4.531 1.00 0.00 C ATOM 2778 CD1 PHE B 88 145.708 -9.713 5.715 1.00 0.00 C ATOM 2779 CD2 PHE B 88 147.443 -8.751 4.322 1.00 0.00 C ATOM 2780 CE1 PHE B 88 146.663 -10.024 6.690 1.00 0.00 C ATOM 2781 CE2 PHE B 88 148.399 -9.060 5.297 1.00 0.00 C ATOM 2782 CZ PHE B 88 148.008 -9.696 6.481 1.00 0.00 C ATOM 0 H PHE B 88 146.481 -9.476 1.368 1.00 0.00 H new ATOM 0 HA PHE B 88 144.559 -10.832 3.227 1.00 0.00 H new ATOM 0 HB2 PHE B 88 145.412 -7.912 2.866 1.00 0.00 H new ATOM 0 HB3 PHE B 88 144.137 -8.423 3.955 1.00 0.00 H new ATOM 0 HD1 PHE B 88 144.670 -9.964 5.877 1.00 0.00 H new ATOM 0 HD2 PHE B 88 147.744 -8.261 3.408 1.00 0.00 H new ATOM 0 HE1 PHE B 88 146.363 -10.517 7.603 1.00 0.00 H new ATOM 0 HE2 PHE B 88 149.437 -8.808 5.136 1.00 0.00 H new ATOM 0 HZ PHE B 88 148.745 -9.934 7.234 1.00 0.00 H new ATOM 2792 N LEU B 89 143.487 -8.453 1.252 1.00 0.00 N ATOM 2793 CA LEU B 89 142.364 -8.102 0.334 1.00 0.00 C ATOM 2794 C LEU B 89 142.811 -8.324 -1.111 1.00 0.00 C ATOM 2795 O LEU B 89 142.417 -9.324 -1.687 1.00 0.00 O ATOM 2796 CB LEU B 89 141.987 -6.628 0.546 1.00 0.00 C ATOM 2797 CG LEU B 89 140.998 -6.163 -0.533 1.00 0.00 C ATOM 2798 CD1 LEU B 89 139.788 -7.103 -0.575 1.00 0.00 C ATOM 2799 CD2 LEU B 89 140.525 -4.744 -0.196 1.00 0.00 C ATOM 2800 OXT LEU B 89 143.540 -7.488 -1.618 1.00 0.00 O ATOM 0 H LEU B 89 144.089 -7.672 1.514 1.00 0.00 H new ATOM 0 HA LEU B 89 141.498 -8.730 0.542 1.00 0.00 H new ATOM 0 HB2 LEU B 89 141.544 -6.499 1.533 1.00 0.00 H new ATOM 0 HB3 LEU B 89 142.884 -6.010 0.516 1.00 0.00 H new ATOM 0 HG LEU B 89 141.491 -6.173 -1.505 1.00 0.00 H new ATOM 0 HD11 LEU B 89 139.092 -6.766 -1.343 1.00 0.00 H new ATOM 0 HD12 LEU B 89 140.121 -8.115 -0.806 1.00 0.00 H new ATOM 0 HD13 LEU B 89 139.289 -7.098 0.394 1.00 0.00 H new ATOM 0 HD21 LEU B 89 139.822 -4.405 -0.957 1.00 0.00 H new ATOM 0 HD22 LEU B 89 140.034 -4.746 0.777 1.00 0.00 H new ATOM 0 HD23 LEU B 89 141.382 -4.072 -0.169 1.00 0.00 H new TER 2812 LEU B 89