USER MOD reduce.3.24.130724 H: found=0, std=0, add=1006, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 1000 hydrogens (45 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 143:sc= 1.47 (180deg=0.602) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 92:sc= 0.115 USER MOD Single : A 10 SER OG : rot 116:sc= -2.47! USER MOD Single : A 28 LYS NZ :NH3+ 152:sc= -1 (180deg=-2.46!) USER MOD Single : A 38 HIS : no HE2:sc= 0.438 K(o=0.44,f=-7.6!) USER MOD Single : A 39 THR OG1 : rot 180:sc= -0.598 USER MOD Single : A 49 ASN : amide:sc= -0.296 K(o=-0.3,f=-2.5) USER MOD Single : A 54 GLN : amide:sc=-0.00604 X(o=-0.006,f=0) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 72 HIS : no HD1:sc= -4.31! C(o=-4.3!,f=-14!) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN :FLIP amide:sc= -3.76! C(o=-5.3!,f=-3.8!) USER MOD Single : A 92 HIS : no HD1:sc= -0.907 K(o=-0.91,f=-3.8!) USER MOD Single : A 99 GLN : amide:sc= -3.62! C(o=-3.6!,f=-9.6!) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= -0.0273 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 113 ASN :FLIP amide:sc= -0.295 F(o=-0.97!,f=-0.3) USER MOD Single : A 121 THR OG1 : rot 69:sc= 0.0226! USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 TYR OH : rot 180:sc= -0.0588 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 77.292 23.599 -21.805 1.00 1.00 N ATOM 2 CA MET A 1 77.651 22.156 -21.869 1.00 1.00 C ATOM 3 C MET A 1 76.396 21.326 -21.640 1.00 1.00 C ATOM 4 O MET A 1 75.380 21.837 -21.168 1.00 1.00 O ATOM 5 CB MET A 1 78.702 21.832 -20.799 1.00 1.00 C ATOM 6 CG MET A 1 80.079 22.361 -21.228 1.00 1.00 C ATOM 7 SD MET A 1 80.164 24.142 -20.918 1.00 1.00 S ATOM 8 CE MET A 1 81.917 24.215 -20.482 1.00 1.00 C ATOM 0 H1 MET A 1 78.061 24.128 -21.346 1.00 1.00 H new ATOM 0 H2 MET A 1 77.148 23.964 -22.768 1.00 1.00 H new ATOM 0 H3 MET A 1 76.416 23.715 -21.256 1.00 1.00 H new ATOM 0 HA MET A 1 78.070 21.922 -22.848 1.00 1.00 H new ATOM 0 HB2 MET A 1 78.413 22.280 -19.848 1.00 1.00 H new ATOM 0 HB3 MET A 1 78.751 20.754 -20.642 1.00 1.00 H new ATOM 0 HG2 MET A 1 80.866 21.847 -20.676 1.00 1.00 H new ATOM 0 HG3 MET A 1 80.246 22.157 -22.286 1.00 1.00 H new ATOM 0 HE1 MET A 1 82.191 25.244 -20.248 1.00 1.00 H new ATOM 0 HE2 MET A 1 82.102 23.584 -19.613 1.00 1.00 H new ATOM 0 HE3 MET A 1 82.516 23.862 -21.321 1.00 1.00 H new ATOM 18 N SER A 2 76.468 20.043 -21.981 1.00 1.00 N ATOM 19 CA SER A 2 75.343 19.123 -21.829 1.00 1.00 C ATOM 20 C SER A 2 75.590 18.169 -20.666 1.00 1.00 C ATOM 21 O SER A 2 74.853 17.203 -20.485 1.00 1.00 O ATOM 22 CB SER A 2 75.146 18.322 -23.118 1.00 1.00 C ATOM 23 OG SER A 2 76.316 17.558 -23.382 1.00 1.00 O ATOM 0 H SER A 2 77.306 19.611 -22.370 1.00 1.00 H new ATOM 0 HA SER A 2 74.444 19.704 -21.624 1.00 1.00 H new ATOM 0 HB2 SER A 2 74.282 17.664 -23.022 1.00 1.00 H new ATOM 0 HB3 SER A 2 74.942 18.996 -23.950 1.00 1.00 H new ATOM 0 HG SER A 2 76.191 17.043 -24.206 1.00 1.00 H new ATOM 29 N ASP A 3 76.629 18.462 -19.880 1.00 1.00 N ATOM 30 CA ASP A 3 76.982 17.639 -18.720 1.00 1.00 C ATOM 31 C ASP A 3 78.386 18.003 -18.227 1.00 1.00 C ATOM 32 O ASP A 3 79.382 17.469 -18.717 1.00 1.00 O ATOM 33 CB ASP A 3 76.918 16.144 -19.095 1.00 1.00 C ATOM 34 CG ASP A 3 77.762 15.293 -18.142 1.00 1.00 C ATOM 35 OD1 ASP A 3 77.359 15.136 -17.002 1.00 1.00 O ATOM 36 OD2 ASP A 3 78.798 14.814 -18.573 1.00 1.00 O ATOM 0 H ASP A 3 77.242 19.264 -20.026 1.00 1.00 H new ATOM 0 HA ASP A 3 76.269 17.830 -17.918 1.00 1.00 H new ATOM 0 HB2 ASP A 3 75.883 15.805 -19.068 1.00 1.00 H new ATOM 0 HB3 ASP A 3 77.272 16.008 -20.117 1.00 1.00 H new ATOM 41 N PHE A 4 78.462 18.900 -17.248 1.00 1.00 N ATOM 42 CA PHE A 4 79.751 19.307 -16.696 1.00 1.00 C ATOM 43 C PHE A 4 79.604 19.673 -15.229 1.00 1.00 C ATOM 44 O PHE A 4 78.579 20.215 -14.819 1.00 1.00 O ATOM 45 CB PHE A 4 80.294 20.511 -17.452 1.00 1.00 C ATOM 46 CG PHE A 4 81.701 20.776 -16.988 1.00 1.00 C ATOM 47 CD1 PHE A 4 82.772 20.144 -17.627 1.00 1.00 C ATOM 48 CD2 PHE A 4 81.937 21.640 -15.914 1.00 1.00 C ATOM 49 CE1 PHE A 4 84.081 20.377 -17.195 1.00 1.00 C ATOM 50 CE2 PHE A 4 83.247 21.877 -15.481 1.00 1.00 C ATOM 51 CZ PHE A 4 84.320 21.244 -16.122 1.00 1.00 C ATOM 0 H PHE A 4 77.654 19.356 -16.823 1.00 1.00 H new ATOM 0 HA PHE A 4 80.443 18.471 -16.797 1.00 1.00 H new ATOM 0 HB2 PHE A 4 80.279 20.322 -18.525 1.00 1.00 H new ATOM 0 HB3 PHE A 4 79.666 21.384 -17.274 1.00 1.00 H new ATOM 0 HD1 PHE A 4 82.588 19.475 -18.455 1.00 1.00 H new ATOM 0 HD2 PHE A 4 81.109 22.124 -15.419 1.00 1.00 H new ATOM 0 HE1 PHE A 4 84.908 19.888 -17.689 1.00 1.00 H new ATOM 0 HE2 PHE A 4 83.430 22.547 -14.654 1.00 1.00 H new ATOM 0 HZ PHE A 4 85.331 21.425 -15.789 1.00 1.00 H new ATOM 61 N ASP A 5 80.624 19.369 -14.434 1.00 1.00 N ATOM 62 CA ASP A 5 80.580 19.662 -13.009 1.00 1.00 C ATOM 63 C ASP A 5 81.996 19.811 -12.447 1.00 1.00 C ATOM 64 O ASP A 5 82.945 19.229 -12.969 1.00 1.00 O ATOM 65 CB ASP A 5 79.849 18.518 -12.290 1.00 1.00 C ATOM 66 CG ASP A 5 80.116 17.195 -13.010 1.00 1.00 C ATOM 67 OD1 ASP A 5 81.103 17.119 -13.721 1.00 1.00 O ATOM 68 OD2 ASP A 5 79.324 16.283 -12.841 1.00 1.00 O ATOM 0 H ASP A 5 81.485 18.923 -14.751 1.00 1.00 H new ATOM 0 HA ASP A 5 80.050 20.601 -12.850 1.00 1.00 H new ATOM 0 HB2 ASP A 5 80.186 18.453 -11.255 1.00 1.00 H new ATOM 0 HB3 ASP A 5 78.778 18.718 -12.265 1.00 1.00 H new ATOM 73 N THR A 6 82.132 20.612 -11.395 1.00 1.00 N ATOM 74 CA THR A 6 83.435 20.837 -10.780 1.00 1.00 C ATOM 75 C THR A 6 83.937 19.557 -10.100 1.00 1.00 C ATOM 76 O THR A 6 83.274 18.550 -10.116 1.00 1.00 O ATOM 77 CB THR A 6 83.322 21.986 -9.751 1.00 1.00 C ATOM 78 OG1 THR A 6 82.166 22.762 -10.042 1.00 1.00 O ATOM 79 CG2 THR A 6 84.561 22.886 -9.815 1.00 1.00 C ATOM 0 H THR A 6 81.361 21.113 -10.953 1.00 1.00 H new ATOM 0 HA THR A 6 84.153 21.113 -11.552 1.00 1.00 H new ATOM 0 HB THR A 6 83.247 21.559 -8.751 1.00 1.00 H new ATOM 0 HG1 THR A 6 81.403 22.415 -9.534 1.00 1.00 H new ATOM 0 HG21 THR A 6 84.465 23.689 -9.085 1.00 1.00 H new ATOM 0 HG22 THR A 6 85.451 22.297 -9.592 1.00 1.00 H new ATOM 0 HG23 THR A 6 84.650 23.313 -10.814 1.00 1.00 H new ATOM 87 N GLU A 7 85.145 19.621 -9.576 1.00 1.00 N ATOM 88 CA GLU A 7 85.786 18.462 -8.937 1.00 1.00 C ATOM 89 C GLU A 7 84.922 17.951 -7.772 1.00 1.00 C ATOM 90 O GLU A 7 84.512 16.792 -7.737 1.00 1.00 O ATOM 91 CB GLU A 7 87.165 18.894 -8.418 1.00 1.00 C ATOM 92 CG GLU A 7 87.915 17.690 -7.855 1.00 1.00 C ATOM 93 CD GLU A 7 89.309 18.110 -7.394 1.00 1.00 C ATOM 94 OE1 GLU A 7 89.549 19.300 -7.296 1.00 1.00 O ATOM 95 OE2 GLU A 7 90.116 17.228 -7.143 1.00 1.00 O ATOM 0 H GLU A 7 85.716 20.466 -9.575 1.00 1.00 H new ATOM 0 HA GLU A 7 85.895 17.655 -9.661 1.00 1.00 H new ATOM 0 HB2 GLU A 7 87.741 19.346 -9.226 1.00 1.00 H new ATOM 0 HB3 GLU A 7 87.049 19.654 -7.645 1.00 1.00 H new ATOM 0 HG2 GLU A 7 87.360 17.264 -7.019 1.00 1.00 H new ATOM 0 HG3 GLU A 7 87.993 16.913 -8.615 1.00 1.00 H new ATOM 102 N ARG A 8 84.684 18.838 -6.820 1.00 1.00 N ATOM 103 CA ARG A 8 83.892 18.458 -5.646 1.00 1.00 C ATOM 104 C ARG A 8 82.641 17.741 -6.161 1.00 1.00 C ATOM 105 O ARG A 8 82.372 16.603 -5.837 1.00 1.00 O ATOM 106 CB ARG A 8 83.481 19.722 -4.855 1.00 1.00 C ATOM 107 CG ARG A 8 84.417 19.961 -3.663 1.00 1.00 C ATOM 108 CD ARG A 8 84.029 21.281 -2.991 1.00 1.00 C ATOM 109 NE ARG A 8 82.619 21.259 -2.615 1.00 1.00 N ATOM 110 CZ ARG A 8 82.033 22.335 -2.106 1.00 1.00 C ATOM 111 NH1 ARG A 8 82.736 23.412 -1.890 1.00 1.00 N ATOM 112 NH2 ARG A 8 80.760 22.315 -1.818 1.00 1.00 N ATOM 0 H ARG A 8 85.015 19.803 -6.827 1.00 1.00 H new ATOM 0 HA ARG A 8 84.468 17.813 -4.982 1.00 1.00 H new ATOM 0 HB2 ARG A 8 83.500 20.589 -5.515 1.00 1.00 H new ATOM 0 HB3 ARG A 8 82.456 19.614 -4.500 1.00 1.00 H new ATOM 0 HG2 ARG A 8 84.341 19.138 -2.952 1.00 1.00 H new ATOM 0 HG3 ARG A 8 85.454 19.998 -3.998 1.00 1.00 H new ATOM 0 HD2 ARG A 8 84.646 21.443 -2.107 1.00 1.00 H new ATOM 0 HD3 ARG A 8 84.219 22.113 -3.669 1.00 1.00 H new ATOM 0 HE ARG A 8 82.077 20.405 -2.745 1.00 1.00 H new ATOM 0 HH11 ARG A 8 83.731 23.424 -2.112 1.00 1.00 H new ATOM 0 HH12 ARG A 8 82.290 24.242 -1.499 1.00 1.00 H new ATOM 0 HH21 ARG A 8 80.213 21.470 -1.984 1.00 1.00 H new ATOM 0 HH22 ARG A 8 80.313 23.144 -1.427 1.00 1.00 H new ATOM 126 N VAL A 9 81.947 18.425 -7.021 1.00 1.00 N ATOM 127 CA VAL A 9 80.752 17.846 -7.629 1.00 1.00 C ATOM 128 C VAL A 9 81.119 16.637 -8.504 1.00 1.00 C ATOM 129 O VAL A 9 80.519 15.605 -8.394 1.00 1.00 O ATOM 130 CB VAL A 9 79.991 18.888 -8.434 1.00 1.00 C ATOM 131 CG1 VAL A 9 78.730 18.271 -9.075 1.00 1.00 C ATOM 132 CG2 VAL A 9 79.570 20.012 -7.493 1.00 1.00 C ATOM 0 H VAL A 9 82.171 19.373 -7.324 1.00 1.00 H new ATOM 0 HA VAL A 9 80.099 17.500 -6.828 1.00 1.00 H new ATOM 0 HB VAL A 9 80.635 19.266 -9.228 1.00 1.00 H new ATOM 0 HG11 VAL A 9 78.201 19.034 -9.646 1.00 1.00 H new ATOM 0 HG12 VAL A 9 79.021 17.457 -9.739 1.00 1.00 H new ATOM 0 HG13 VAL A 9 78.076 17.885 -8.293 1.00 1.00 H new ATOM 0 HG21 VAL A 9 79.022 20.770 -8.053 1.00 1.00 H new ATOM 0 HG22 VAL A 9 78.931 19.609 -6.708 1.00 1.00 H new ATOM 0 HG23 VAL A 9 80.456 20.462 -7.045 1.00 1.00 H new ATOM 142 N SER A 10 82.095 16.778 -9.375 1.00 1.00 N ATOM 143 CA SER A 10 82.454 15.655 -10.260 1.00 1.00 C ATOM 144 C SER A 10 83.069 14.492 -9.490 1.00 1.00 C ATOM 145 O SER A 10 82.529 13.395 -9.499 1.00 1.00 O ATOM 146 CB SER A 10 83.457 16.120 -11.308 1.00 1.00 C ATOM 147 OG SER A 10 82.836 17.072 -12.155 1.00 1.00 O ATOM 0 H SER A 10 82.648 17.626 -9.500 1.00 1.00 H new ATOM 0 HA SER A 10 81.532 15.312 -10.730 1.00 1.00 H new ATOM 0 HB2 SER A 10 84.329 16.560 -10.824 1.00 1.00 H new ATOM 0 HB3 SER A 10 83.811 15.271 -11.893 1.00 1.00 H new ATOM 0 HG SER A 10 83.285 17.938 -12.059 1.00 1.00 H new ATOM 153 N ARG A 11 84.240 14.697 -8.907 1.00 1.00 N ATOM 154 CA ARG A 11 84.920 13.590 -8.226 1.00 1.00 C ATOM 155 C ARG A 11 84.123 13.091 -7.020 1.00 1.00 C ATOM 156 O ARG A 11 83.792 11.911 -6.934 1.00 1.00 O ATOM 157 CB ARG A 11 86.321 14.044 -7.794 1.00 1.00 C ATOM 158 CG ARG A 11 87.009 12.930 -6.990 1.00 1.00 C ATOM 159 CD ARG A 11 88.529 13.140 -7.004 1.00 1.00 C ATOM 160 NE ARG A 11 89.051 12.843 -8.343 1.00 1.00 N ATOM 161 CZ ARG A 11 90.084 12.015 -8.547 1.00 1.00 C ATOM 162 NH1 ARG A 11 90.750 11.511 -7.541 1.00 1.00 N ATOM 163 NH2 ARG A 11 90.445 11.724 -9.767 1.00 1.00 N ATOM 0 H ARG A 11 84.733 15.590 -8.887 1.00 1.00 H new ATOM 0 HA ARG A 11 85.003 12.756 -8.923 1.00 1.00 H new ATOM 0 HB2 ARG A 11 86.918 14.293 -8.671 1.00 1.00 H new ATOM 0 HB3 ARG A 11 86.249 14.949 -7.190 1.00 1.00 H new ATOM 0 HG2 ARG A 11 86.642 12.931 -5.964 1.00 1.00 H new ATOM 0 HG3 ARG A 11 86.763 11.957 -7.416 1.00 1.00 H new ATOM 0 HD2 ARG A 11 88.768 14.167 -6.729 1.00 1.00 H new ATOM 0 HD3 ARG A 11 89.003 12.494 -6.265 1.00 1.00 H new ATOM 0 HE ARG A 11 88.610 13.284 -9.150 1.00 1.00 H new ATOM 0 HH11 ARG A 11 90.485 11.747 -6.585 1.00 1.00 H new ATOM 0 HH12 ARG A 11 91.534 10.882 -7.713 1.00 1.00 H new ATOM 0 HH21 ARG A 11 89.941 12.126 -10.558 1.00 1.00 H new ATOM 0 HH22 ARG A 11 91.231 11.094 -9.930 1.00 1.00 H new ATOM 177 N ALA A 12 83.861 13.986 -6.077 1.00 1.00 N ATOM 178 CA ALA A 12 83.141 13.564 -4.872 1.00 1.00 C ATOM 179 C ALA A 12 81.925 12.748 -5.346 1.00 1.00 C ATOM 180 O ALA A 12 81.698 11.637 -4.894 1.00 1.00 O ATOM 181 CB ALA A 12 82.723 14.768 -4.021 1.00 1.00 C ATOM 0 H ALA A 12 84.122 14.972 -6.112 1.00 1.00 H new ATOM 0 HA ALA A 12 83.779 12.957 -4.230 1.00 1.00 H new ATOM 0 HB1 ALA A 12 82.191 14.420 -3.135 1.00 1.00 H new ATOM 0 HB2 ALA A 12 83.610 15.324 -3.717 1.00 1.00 H new ATOM 0 HB3 ALA A 12 82.070 15.417 -4.605 1.00 1.00 H new ATOM 187 N VAL A 13 81.202 13.311 -6.305 1.00 1.00 N ATOM 188 CA VAL A 13 80.059 12.572 -6.857 1.00 1.00 C ATOM 189 C VAL A 13 80.559 11.282 -7.509 1.00 1.00 C ATOM 190 O VAL A 13 80.065 10.237 -7.210 1.00 1.00 O ATOM 191 CB VAL A 13 79.236 13.365 -7.872 1.00 1.00 C ATOM 192 CG1 VAL A 13 78.127 12.476 -8.456 1.00 1.00 C ATOM 193 CG2 VAL A 13 78.591 14.564 -7.172 1.00 1.00 C ATOM 0 H VAL A 13 81.369 14.234 -6.707 1.00 1.00 H new ATOM 0 HA VAL A 13 79.394 12.363 -6.019 1.00 1.00 H new ATOM 0 HB VAL A 13 79.891 13.705 -8.674 1.00 1.00 H new ATOM 0 HG11 VAL A 13 77.545 13.048 -9.178 1.00 1.00 H new ATOM 0 HG12 VAL A 13 78.574 11.614 -8.951 1.00 1.00 H new ATOM 0 HG13 VAL A 13 77.474 12.134 -7.653 1.00 1.00 H new ATOM 0 HG21 VAL A 13 78.003 15.133 -7.892 1.00 1.00 H new ATOM 0 HG22 VAL A 13 77.941 14.211 -6.371 1.00 1.00 H new ATOM 0 HG23 VAL A 13 79.369 15.203 -6.754 1.00 1.00 H new ATOM 203 N ALA A 14 81.556 11.339 -8.387 1.00 1.00 N ATOM 204 CA ALA A 14 82.027 10.093 -9.008 1.00 1.00 C ATOM 205 C ALA A 14 82.450 9.111 -7.924 1.00 1.00 C ATOM 206 O ALA A 14 81.894 8.045 -7.816 1.00 1.00 O ATOM 207 CB ALA A 14 83.223 10.374 -9.902 1.00 1.00 C ATOM 0 H ALA A 14 82.038 12.189 -8.679 1.00 1.00 H new ATOM 0 HA ALA A 14 81.217 9.671 -9.602 1.00 1.00 H new ATOM 0 HB1 ALA A 14 83.564 9.444 -10.357 1.00 1.00 H new ATOM 0 HB2 ALA A 14 82.935 11.077 -10.684 1.00 1.00 H new ATOM 0 HB3 ALA A 14 84.029 10.803 -9.307 1.00 1.00 H new ATOM 213 N ALA A 15 83.451 9.478 -7.148 1.00 1.00 N ATOM 214 CA ALA A 15 83.954 8.585 -6.093 1.00 1.00 C ATOM 215 C ALA A 15 82.778 8.109 -5.230 1.00 1.00 C ATOM 216 O ALA A 15 82.570 6.920 -5.022 1.00 1.00 O ATOM 217 CB ALA A 15 84.941 9.357 -5.207 1.00 1.00 C ATOM 0 H ALA A 15 83.934 10.374 -7.217 1.00 1.00 H new ATOM 0 HA ALA A 15 84.453 7.728 -6.546 1.00 1.00 H new ATOM 0 HB1 ALA A 15 85.317 8.700 -4.423 1.00 1.00 H new ATOM 0 HB2 ALA A 15 85.774 9.712 -5.814 1.00 1.00 H new ATOM 0 HB3 ALA A 15 84.434 10.209 -4.754 1.00 1.00 H new ATOM 223 N ALA A 16 82.045 9.070 -4.730 1.00 1.00 N ATOM 224 CA ALA A 16 80.906 8.754 -3.877 1.00 1.00 C ATOM 225 C ALA A 16 79.900 7.927 -4.693 1.00 1.00 C ATOM 226 O ALA A 16 79.458 6.851 -4.288 1.00 1.00 O ATOM 227 CB ALA A 16 80.260 10.049 -3.362 1.00 1.00 C ATOM 0 H ALA A 16 82.204 10.065 -4.889 1.00 1.00 H new ATOM 0 HA ALA A 16 81.231 8.176 -3.012 1.00 1.00 H new ATOM 0 HB1 ALA A 16 79.410 9.803 -2.726 1.00 1.00 H new ATOM 0 HB2 ALA A 16 80.992 10.617 -2.787 1.00 1.00 H new ATOM 0 HB3 ALA A 16 79.920 10.647 -4.207 1.00 1.00 H new ATOM 233 N LEU A 17 79.532 8.505 -5.816 1.00 1.00 N ATOM 234 CA LEU A 17 78.522 7.880 -6.696 1.00 1.00 C ATOM 235 C LEU A 17 78.976 6.466 -7.050 1.00 1.00 C ATOM 236 O LEU A 17 78.241 5.506 -6.823 1.00 1.00 O ATOM 237 CB LEU A 17 78.245 8.675 -7.988 1.00 1.00 C ATOM 238 CG LEU A 17 77.095 8.026 -8.773 1.00 1.00 C ATOM 239 CD1 LEU A 17 75.773 8.122 -7.979 1.00 1.00 C ATOM 240 CD2 LEU A 17 76.949 8.744 -10.120 1.00 1.00 C ATOM 0 H LEU A 17 79.901 9.394 -6.153 1.00 1.00 H new ATOM 0 HA LEU A 17 77.584 7.866 -6.141 1.00 1.00 H new ATOM 0 HB2 LEU A 17 77.991 9.706 -7.742 1.00 1.00 H new ATOM 0 HB3 LEU A 17 79.144 8.706 -8.604 1.00 1.00 H new ATOM 0 HG LEU A 17 77.319 6.972 -8.935 1.00 1.00 H new ATOM 0 HD11 LEU A 17 74.970 7.657 -8.551 1.00 1.00 H new ATOM 0 HD12 LEU A 17 75.884 7.607 -7.025 1.00 1.00 H new ATOM 0 HD13 LEU A 17 75.531 9.170 -7.800 1.00 1.00 H new ATOM 0 HD21 LEU A 17 76.135 8.292 -10.687 1.00 1.00 H new ATOM 0 HD22 LEU A 17 76.730 9.798 -9.949 1.00 1.00 H new ATOM 0 HD23 LEU A 17 77.878 8.653 -10.683 1.00 1.00 H new ATOM 252 N VAL A 18 80.189 6.339 -7.582 1.00 1.00 N ATOM 253 CA VAL A 18 80.702 5.012 -7.925 1.00 1.00 C ATOM 254 C VAL A 18 80.958 4.228 -6.635 1.00 1.00 C ATOM 255 O VAL A 18 80.416 3.141 -6.438 1.00 1.00 O ATOM 256 CB VAL A 18 81.985 5.096 -8.805 1.00 1.00 C ATOM 257 CG1 VAL A 18 81.793 6.125 -9.957 1.00 1.00 C ATOM 258 CG2 VAL A 18 83.212 5.475 -7.952 1.00 1.00 C ATOM 0 H VAL A 18 80.821 7.114 -7.781 1.00 1.00 H new ATOM 0 HA VAL A 18 79.955 4.489 -8.522 1.00 1.00 H new ATOM 0 HB VAL A 18 82.159 4.112 -9.241 1.00 1.00 H new ATOM 0 HG11 VAL A 18 82.700 6.169 -10.560 1.00 1.00 H new ATOM 0 HG12 VAL A 18 80.955 5.818 -10.583 1.00 1.00 H new ATOM 0 HG13 VAL A 18 81.589 7.109 -9.535 1.00 1.00 H new ATOM 0 HG21 VAL A 18 84.095 5.527 -8.588 1.00 1.00 H new ATOM 0 HG22 VAL A 18 83.044 6.445 -7.484 1.00 1.00 H new ATOM 0 HG23 VAL A 18 83.365 4.721 -7.180 1.00 1.00 H new ATOM 268 N GLY A 19 81.787 4.783 -5.756 1.00 1.00 N ATOM 269 CA GLY A 19 82.111 4.139 -4.495 1.00 1.00 C ATOM 270 C GLY A 19 80.867 3.992 -3.626 1.00 1.00 C ATOM 271 O GLY A 19 79.749 4.210 -4.095 1.00 1.00 O ATOM 0 H GLY A 19 82.247 5.682 -5.898 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.546 3.158 -4.684 1.00 1.00 H new ATOM 0 HA3 GLY A 19 82.863 4.724 -3.965 1.00 1.00 H new ATOM 275 N PRO A 20 81.037 3.600 -2.390 1.00 1.00 N ATOM 276 CA PRO A 20 79.900 3.382 -1.447 1.00 1.00 C ATOM 277 C PRO A 20 79.341 4.664 -0.837 1.00 1.00 C ATOM 278 O PRO A 20 78.206 4.699 -0.453 1.00 1.00 O ATOM 279 CB PRO A 20 80.516 2.502 -0.356 1.00 1.00 C ATOM 280 CG PRO A 20 81.951 2.914 -0.310 1.00 1.00 C ATOM 281 CD PRO A 20 82.335 3.330 -1.741 1.00 1.00 C ATOM 0 HA PRO A 20 79.046 2.941 -1.962 1.00 1.00 H new ATOM 0 HB2 PRO A 20 80.027 2.660 0.605 1.00 1.00 H new ATOM 0 HB3 PRO A 20 80.414 1.443 -0.595 1.00 1.00 H new ATOM 0 HG2 PRO A 20 82.095 3.741 0.386 1.00 1.00 H new ATOM 0 HG3 PRO A 20 82.579 2.093 0.037 1.00 1.00 H new ATOM 0 HD2 PRO A 20 82.974 4.213 -1.743 1.00 1.00 H new ATOM 0 HD3 PRO A 20 82.882 2.539 -2.254 1.00 1.00 H new ATOM 289 N GLY A 21 80.170 5.685 -0.730 1.00 1.00 N ATOM 290 CA GLY A 21 79.712 6.940 -0.101 1.00 1.00 C ATOM 291 C GLY A 21 78.478 7.501 -0.823 1.00 1.00 C ATOM 292 O GLY A 21 77.446 7.762 -0.213 1.00 1.00 O ATOM 0 H GLY A 21 81.137 5.688 -1.055 1.00 1.00 H new ATOM 0 HA2 GLY A 21 79.473 6.759 0.947 1.00 1.00 H new ATOM 0 HA3 GLY A 21 80.516 7.676 -0.123 1.00 1.00 H new ATOM 296 N GLY A 22 78.621 7.717 -2.113 1.00 1.00 N ATOM 297 CA GLY A 22 77.504 8.286 -2.877 1.00 1.00 C ATOM 298 C GLY A 22 76.331 7.352 -2.778 1.00 1.00 C ATOM 299 O GLY A 22 75.233 7.733 -2.365 1.00 1.00 O ATOM 0 H GLY A 22 79.465 7.519 -2.651 1.00 1.00 H new ATOM 0 HA2 GLY A 22 77.240 9.268 -2.486 1.00 1.00 H new ATOM 0 HA3 GLY A 22 77.790 8.425 -3.920 1.00 1.00 H new ATOM 303 N VAL A 23 76.577 6.127 -3.166 1.00 1.00 N ATOM 304 CA VAL A 23 75.539 5.114 -3.128 1.00 1.00 C ATOM 305 C VAL A 23 75.043 4.948 -1.691 1.00 1.00 C ATOM 306 O VAL A 23 73.866 4.675 -1.459 1.00 1.00 O ATOM 307 CB VAL A 23 76.080 3.787 -3.729 1.00 1.00 C ATOM 308 CG1 VAL A 23 75.762 2.574 -2.836 1.00 1.00 C ATOM 309 CG2 VAL A 23 75.462 3.554 -5.117 1.00 1.00 C ATOM 0 H VAL A 23 77.480 5.802 -3.511 1.00 1.00 H new ATOM 0 HA VAL A 23 74.687 5.419 -3.735 1.00 1.00 H new ATOM 0 HB VAL A 23 77.163 3.884 -3.801 1.00 1.00 H new ATOM 0 HG11 VAL A 23 76.159 1.669 -3.296 1.00 1.00 H new ATOM 0 HG12 VAL A 23 76.219 2.714 -1.856 1.00 1.00 H new ATOM 0 HG13 VAL A 23 74.682 2.479 -2.722 1.00 1.00 H new ATOM 0 HG21 VAL A 23 75.845 2.622 -5.534 1.00 1.00 H new ATOM 0 HG22 VAL A 23 74.377 3.493 -5.027 1.00 1.00 H new ATOM 0 HG23 VAL A 23 75.725 4.381 -5.776 1.00 1.00 H new ATOM 319 N ALA A 24 75.958 5.086 -0.738 1.00 1.00 N ATOM 320 CA ALA A 24 75.562 4.913 0.648 1.00 1.00 C ATOM 321 C ALA A 24 74.446 5.899 0.993 1.00 1.00 C ATOM 322 O ALA A 24 73.352 5.481 1.360 1.00 1.00 O ATOM 323 CB ALA A 24 76.747 5.122 1.595 1.00 1.00 C ATOM 0 H ALA A 24 76.941 5.309 -0.892 1.00 1.00 H new ATOM 0 HA ALA A 24 75.203 3.891 0.773 1.00 1.00 H new ATOM 0 HB1 ALA A 24 76.418 4.986 2.625 1.00 1.00 H new ATOM 0 HB2 ALA A 24 77.529 4.398 1.365 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.139 6.131 1.470 1.00 1.00 H new ATOM 329 N LEU A 25 74.711 7.208 0.908 1.00 1.00 N ATOM 330 CA LEU A 25 73.690 8.176 1.262 1.00 1.00 C ATOM 331 C LEU A 25 72.503 8.122 0.312 1.00 1.00 C ATOM 332 O LEU A 25 71.365 8.226 0.757 1.00 1.00 O ATOM 333 CB LEU A 25 74.250 9.600 1.268 1.00 1.00 C ATOM 334 CG LEU A 25 73.240 10.567 1.923 1.00 1.00 C ATOM 335 CD1 LEU A 25 73.232 10.390 3.453 1.00 1.00 C ATOM 336 CD2 LEU A 25 73.625 12.011 1.586 1.00 1.00 C ATOM 0 H LEU A 25 75.601 7.605 0.605 1.00 1.00 H new ATOM 0 HA LEU A 25 73.354 7.912 2.265 1.00 1.00 H new ATOM 0 HB2 LEU A 25 75.194 9.625 1.812 1.00 1.00 H new ATOM 0 HB3 LEU A 25 74.462 9.920 0.248 1.00 1.00 H new ATOM 0 HG LEU A 25 72.245 10.344 1.537 1.00 1.00 H new ATOM 0 HD11 LEU A 25 72.514 11.080 3.895 1.00 1.00 H new ATOM 0 HD12 LEU A 25 72.950 9.366 3.699 1.00 1.00 H new ATOM 0 HD13 LEU A 25 74.226 10.598 3.849 1.00 1.00 H new ATOM 0 HD21 LEU A 25 72.913 12.695 2.048 1.00 1.00 H new ATOM 0 HD22 LEU A 25 74.626 12.219 1.965 1.00 1.00 H new ATOM 0 HD23 LEU A 25 73.611 12.148 0.505 1.00 1.00 H new ATOM 348 N VAL A 26 72.743 7.995 -0.995 1.00 1.00 N ATOM 349 CA VAL A 26 71.615 7.988 -1.920 1.00 1.00 C ATOM 350 C VAL A 26 70.698 6.809 -1.626 1.00 1.00 C ATOM 351 O VAL A 26 69.517 7.009 -1.344 1.00 1.00 O ATOM 352 CB VAL A 26 72.129 7.896 -3.362 1.00 1.00 C ATOM 353 CG1 VAL A 26 70.951 7.770 -4.333 1.00 1.00 C ATOM 354 CG2 VAL A 26 72.931 9.152 -3.712 1.00 1.00 C ATOM 0 H VAL A 26 73.665 7.900 -1.420 1.00 1.00 H new ATOM 0 HA VAL A 26 71.051 8.912 -1.794 1.00 1.00 H new ATOM 0 HB VAL A 26 72.768 7.017 -3.448 1.00 1.00 H new ATOM 0 HG11 VAL A 26 71.327 7.705 -5.354 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.381 6.871 -4.099 1.00 1.00 H new ATOM 0 HG13 VAL A 26 70.306 8.644 -4.238 1.00 1.00 H new ATOM 0 HG21 VAL A 26 73.293 9.079 -4.738 1.00 1.00 H new ATOM 0 HG22 VAL A 26 72.293 10.030 -3.614 1.00 1.00 H new ATOM 0 HG23 VAL A 26 73.780 9.243 -3.034 1.00 1.00 H new ATOM 364 N VAL A 27 71.195 5.578 -1.717 1.00 1.00 N ATOM 365 CA VAL A 27 70.362 4.399 -1.484 1.00 1.00 C ATOM 366 C VAL A 27 69.812 4.335 -0.063 1.00 1.00 C ATOM 367 O VAL A 27 68.681 3.906 0.157 1.00 1.00 O ATOM 368 CB VAL A 27 71.206 3.144 -1.754 1.00 1.00 C ATOM 369 CG1 VAL A 27 70.410 1.881 -1.420 1.00 1.00 C ATOM 370 CG2 VAL A 27 71.621 3.110 -3.225 1.00 1.00 C ATOM 0 H VAL A 27 72.166 5.370 -1.949 1.00 1.00 H new ATOM 0 HA VAL A 27 69.507 4.458 -2.157 1.00 1.00 H new ATOM 0 HB VAL A 27 72.094 3.178 -1.122 1.00 1.00 H new ATOM 0 HG11 VAL A 27 71.023 1.002 -1.617 1.00 1.00 H new ATOM 0 HG12 VAL A 27 70.127 1.897 -0.368 1.00 1.00 H new ATOM 0 HG13 VAL A 27 69.512 1.843 -2.037 1.00 1.00 H new ATOM 0 HG21 VAL A 27 72.220 2.219 -3.414 1.00 1.00 H new ATOM 0 HG22 VAL A 27 70.731 3.089 -3.854 1.00 1.00 H new ATOM 0 HG23 VAL A 27 72.209 3.998 -3.458 1.00 1.00 H new ATOM 380 N LYS A 28 70.620 4.728 0.896 1.00 1.00 N ATOM 381 CA LYS A 28 70.185 4.661 2.282 1.00 1.00 C ATOM 382 C LYS A 28 69.016 5.608 2.473 1.00 1.00 C ATOM 383 O LYS A 28 67.945 5.233 2.956 1.00 1.00 O ATOM 384 CB LYS A 28 71.360 5.054 3.186 1.00 1.00 C ATOM 385 CG LYS A 28 70.957 4.981 4.661 1.00 1.00 C ATOM 386 CD LYS A 28 72.149 5.387 5.563 1.00 1.00 C ATOM 387 CE LYS A 28 72.997 4.158 5.931 1.00 1.00 C ATOM 388 NZ LYS A 28 73.717 3.669 4.722 1.00 1.00 N ATOM 0 H LYS A 28 71.563 5.091 0.753 1.00 1.00 H new ATOM 0 HA LYS A 28 69.864 3.652 2.541 1.00 1.00 H new ATOM 0 HB2 LYS A 28 72.205 4.390 3.002 1.00 1.00 H new ATOM 0 HB3 LYS A 28 71.690 6.064 2.944 1.00 1.00 H new ATOM 0 HG2 LYS A 28 70.110 5.641 4.847 1.00 1.00 H new ATOM 0 HG3 LYS A 28 70.633 3.970 4.907 1.00 1.00 H new ATOM 0 HD2 LYS A 28 72.768 6.121 5.047 1.00 1.00 H new ATOM 0 HD3 LYS A 28 71.779 5.864 6.470 1.00 1.00 H new ATOM 0 HE2 LYS A 28 73.711 4.417 6.712 1.00 1.00 H new ATOM 0 HE3 LYS A 28 72.359 3.370 6.331 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 74.598 3.197 5.010 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 73.115 2.995 4.208 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 73.942 4.474 4.103 1.00 1.00 H new ATOM 402 N VAL A 29 69.273 6.842 2.106 1.00 1.00 N ATOM 403 CA VAL A 29 68.273 7.887 2.251 1.00 1.00 C ATOM 404 C VAL A 29 67.088 7.590 1.358 1.00 1.00 C ATOM 405 O VAL A 29 65.944 7.701 1.799 1.00 1.00 O ATOM 406 CB VAL A 29 68.827 9.283 1.954 1.00 1.00 C ATOM 407 CG1 VAL A 29 67.673 10.294 1.873 1.00 1.00 C ATOM 408 CG2 VAL A 29 69.772 9.698 3.083 1.00 1.00 C ATOM 0 H VAL A 29 70.159 7.151 1.706 1.00 1.00 H new ATOM 0 HA VAL A 29 67.958 7.891 3.295 1.00 1.00 H new ATOM 0 HB VAL A 29 69.362 9.264 1.004 1.00 1.00 H new ATOM 0 HG11 VAL A 29 68.072 11.286 1.662 1.00 1.00 H new ATOM 0 HG12 VAL A 29 66.988 10.001 1.077 1.00 1.00 H new ATOM 0 HG13 VAL A 29 67.139 10.313 2.823 1.00 1.00 H new ATOM 0 HG21 VAL A 29 70.170 10.692 2.877 1.00 1.00 H new ATOM 0 HG22 VAL A 29 69.227 9.714 4.027 1.00 1.00 H new ATOM 0 HG23 VAL A 29 70.594 8.985 3.150 1.00 1.00 H new ATOM 418 N CYS A 30 67.338 7.204 0.106 1.00 1.00 N ATOM 419 CA CYS A 30 66.223 6.909 -0.764 1.00 1.00 C ATOM 420 C CYS A 30 65.500 5.688 -0.232 1.00 1.00 C ATOM 421 O CYS A 30 64.305 5.745 0.053 1.00 1.00 O ATOM 422 CB CYS A 30 66.739 6.632 -2.181 1.00 1.00 C ATOM 423 SG CYS A 30 65.367 6.148 -3.263 1.00 1.00 S ATOM 0 H CYS A 30 68.265 7.094 -0.306 1.00 1.00 H new ATOM 0 HA CYS A 30 65.539 7.757 -0.796 1.00 1.00 H new ATOM 0 HB2 CYS A 30 67.229 7.521 -2.578 1.00 1.00 H new ATOM 0 HB3 CYS A 30 67.488 5.841 -2.155 1.00 1.00 H new ATOM 428 N ALA A 31 66.189 4.552 -0.160 1.00 1.00 N ATOM 429 CA ALA A 31 65.571 3.307 0.261 1.00 1.00 C ATOM 430 C ALA A 31 65.073 3.334 1.688 1.00 1.00 C ATOM 431 O ALA A 31 63.898 3.080 1.947 1.00 1.00 O ATOM 432 CB ALA A 31 66.620 2.198 0.131 1.00 1.00 C ATOM 0 H ALA A 31 67.180 4.473 -0.390 1.00 1.00 H new ATOM 0 HA ALA A 31 64.701 3.138 -0.373 1.00 1.00 H new ATOM 0 HB1 ALA A 31 66.185 1.248 0.441 1.00 1.00 H new ATOM 0 HB2 ALA A 31 66.947 2.126 -0.906 1.00 1.00 H new ATOM 0 HB3 ALA A 31 67.475 2.430 0.766 1.00 1.00 H new ATOM 438 N GLY A 32 65.975 3.620 2.613 1.00 1.00 N ATOM 439 CA GLY A 32 65.615 3.651 4.018 1.00 1.00 C ATOM 440 C GLY A 32 65.801 2.278 4.657 1.00 1.00 C ATOM 441 O GLY A 32 64.827 1.579 4.929 1.00 1.00 O ATOM 0 H GLY A 32 66.953 3.832 2.417 1.00 1.00 H new ATOM 0 HA2 GLY A 32 66.229 4.385 4.539 1.00 1.00 H new ATOM 0 HA3 GLY A 32 64.578 3.969 4.125 1.00 1.00 H new ATOM 445 N LEU A 33 67.065 1.898 4.888 1.00 1.00 N ATOM 446 CA LEU A 33 67.399 0.607 5.506 1.00 1.00 C ATOM 447 C LEU A 33 67.518 -0.507 4.443 1.00 1.00 C ATOM 448 O LEU A 33 66.564 -1.245 4.187 1.00 1.00 O ATOM 449 CB LEU A 33 66.349 0.236 6.584 1.00 1.00 C ATOM 450 CG LEU A 33 67.027 -0.394 7.816 1.00 1.00 C ATOM 451 CD1 LEU A 33 67.928 0.654 8.530 1.00 1.00 C ATOM 452 CD2 LEU A 33 65.937 -0.898 8.780 1.00 1.00 C ATOM 0 H LEU A 33 67.877 2.470 4.655 1.00 1.00 H new ATOM 0 HA LEU A 33 68.370 0.704 5.991 1.00 1.00 H new ATOM 0 HB2 LEU A 33 65.798 1.128 6.883 1.00 1.00 H new ATOM 0 HB3 LEU A 33 65.624 -0.462 6.166 1.00 1.00 H new ATOM 0 HG LEU A 33 67.655 -1.228 7.501 1.00 1.00 H new ATOM 0 HD11 LEU A 33 68.401 0.196 9.399 1.00 1.00 H new ATOM 0 HD12 LEU A 33 68.697 1.003 7.840 1.00 1.00 H new ATOM 0 HD13 LEU A 33 67.319 1.499 8.852 1.00 1.00 H new ATOM 0 HD21 LEU A 33 66.405 -1.346 9.656 1.00 1.00 H new ATOM 0 HD22 LEU A 33 65.311 -0.061 9.091 1.00 1.00 H new ATOM 0 HD23 LEU A 33 65.322 -1.644 8.276 1.00 1.00 H new ATOM 464 N PRO A 34 68.671 -0.626 3.822 1.00 1.00 N ATOM 465 CA PRO A 34 68.945 -1.650 2.757 1.00 1.00 C ATOM 466 C PRO A 34 68.685 -3.109 3.166 1.00 1.00 C ATOM 467 O PRO A 34 68.297 -3.918 2.323 1.00 1.00 O ATOM 468 CB PRO A 34 70.437 -1.445 2.432 1.00 1.00 C ATOM 469 CG PRO A 34 70.729 -0.040 2.834 1.00 1.00 C ATOM 470 CD PRO A 34 69.855 0.225 4.054 1.00 1.00 C ATOM 0 HA PRO A 34 68.266 -1.502 1.917 1.00 1.00 H new ATOM 0 HB2 PRO A 34 71.061 -2.150 2.981 1.00 1.00 H new ATOM 0 HB3 PRO A 34 70.635 -1.602 1.372 1.00 1.00 H new ATOM 0 HG2 PRO A 34 71.785 0.089 3.072 1.00 1.00 H new ATOM 0 HG3 PRO A 34 70.497 0.655 2.027 1.00 1.00 H new ATOM 0 HD2 PRO A 34 70.366 -0.042 4.979 1.00 1.00 H new ATOM 0 HD3 PRO A 34 69.583 1.278 4.132 1.00 1.00 H new ATOM 478 N GLY A 35 68.909 -3.468 4.434 1.00 1.00 N ATOM 479 CA GLY A 35 68.685 -4.869 4.815 1.00 1.00 C ATOM 480 C GLY A 35 67.258 -5.252 4.443 1.00 1.00 C ATOM 481 O GLY A 35 67.038 -6.157 3.642 1.00 1.00 O ATOM 0 H GLY A 35 69.228 -2.849 5.179 1.00 1.00 H new ATOM 0 HA2 GLY A 35 69.396 -5.518 4.304 1.00 1.00 H new ATOM 0 HA3 GLY A 35 68.845 -5.000 5.885 1.00 1.00 H new ATOM 485 N VAL A 36 66.296 -4.525 4.999 1.00 1.00 N ATOM 486 CA VAL A 36 64.891 -4.768 4.675 1.00 1.00 C ATOM 487 C VAL A 36 64.574 -3.958 3.443 1.00 1.00 C ATOM 488 O VAL A 36 65.314 -3.023 3.162 1.00 1.00 O ATOM 489 CB VAL A 36 63.965 -4.373 5.825 1.00 1.00 C ATOM 490 CG1 VAL A 36 64.213 -5.309 7.003 1.00 1.00 C ATOM 491 CG2 VAL A 36 64.240 -2.931 6.245 1.00 1.00 C ATOM 0 H VAL A 36 66.457 -3.772 5.668 1.00 1.00 H new ATOM 0 HA VAL A 36 64.731 -5.832 4.501 1.00 1.00 H new ATOM 0 HB VAL A 36 62.927 -4.452 5.502 1.00 1.00 H new ATOM 0 HG11 VAL A 36 63.557 -5.036 7.829 1.00 1.00 H new ATOM 0 HG12 VAL A 36 64.008 -6.336 6.701 1.00 1.00 H new ATOM 0 HG13 VAL A 36 65.252 -5.225 7.322 1.00 1.00 H new ATOM 0 HG21 VAL A 36 63.576 -2.658 7.065 1.00 1.00 H new ATOM 0 HG22 VAL A 36 65.276 -2.838 6.571 1.00 1.00 H new ATOM 0 HG23 VAL A 36 64.065 -2.266 5.399 1.00 1.00 H new ATOM 501 N ILE A 37 63.497 -4.315 2.718 1.00 1.00 N ATOM 502 CA ILE A 37 63.072 -3.617 1.488 1.00 1.00 C ATOM 503 C ILE A 37 62.909 -4.607 0.342 1.00 1.00 C ATOM 504 O ILE A 37 63.885 -5.199 -0.125 1.00 1.00 O ATOM 505 CB ILE A 37 64.059 -2.540 1.006 1.00 1.00 C ATOM 506 CG1 ILE A 37 63.449 -1.800 -0.203 1.00 1.00 C ATOM 507 CG2 ILE A 37 65.406 -3.196 0.589 1.00 1.00 C ATOM 508 CD1 ILE A 37 64.379 -0.672 -0.666 1.00 1.00 C ATOM 0 H ILE A 37 62.894 -5.099 2.969 1.00 1.00 H new ATOM 0 HA ILE A 37 62.132 -3.134 1.754 1.00 1.00 H new ATOM 0 HB ILE A 37 64.246 -1.835 1.816 1.00 1.00 H new ATOM 0 HG12 ILE A 37 63.283 -2.502 -1.021 1.00 1.00 H new ATOM 0 HG13 ILE A 37 62.476 -1.390 0.067 1.00 1.00 H new ATOM 0 HG21 ILE A 37 66.097 -2.424 0.250 1.00 1.00 H new ATOM 0 HG22 ILE A 37 65.836 -3.718 1.444 1.00 1.00 H new ATOM 0 HG23 ILE A 37 65.230 -3.906 -0.219 1.00 1.00 H new ATOM 0 HD11 ILE A 37 63.934 -0.160 -1.519 1.00 1.00 H new ATOM 0 HD12 ILE A 37 64.523 0.038 0.148 1.00 1.00 H new ATOM 0 HD13 ILE A 37 65.342 -1.091 -0.956 1.00 1.00 H new ATOM 520 N HIS A 38 61.686 -4.761 -0.143 1.00 1.00 N ATOM 521 CA HIS A 38 61.417 -5.640 -1.274 1.00 1.00 C ATOM 522 C HIS A 38 60.378 -4.969 -2.159 1.00 1.00 C ATOM 523 O HIS A 38 59.359 -4.475 -1.672 1.00 1.00 O ATOM 524 CB HIS A 38 60.920 -7.022 -0.791 1.00 1.00 C ATOM 525 CG HIS A 38 62.060 -8.009 -0.760 1.00 1.00 C ATOM 526 ND1 HIS A 38 63.374 -7.615 -0.557 1.00 1.00 N ATOM 527 CD2 HIS A 38 62.099 -9.371 -0.928 1.00 1.00 C ATOM 528 CE1 HIS A 38 64.141 -8.720 -0.609 1.00 1.00 C ATOM 529 NE2 HIS A 38 63.414 -9.817 -0.833 1.00 1.00 N ATOM 0 H HIS A 38 60.862 -4.288 0.229 1.00 1.00 H new ATOM 0 HA HIS A 38 62.333 -5.808 -1.840 1.00 1.00 H new ATOM 0 HB2 HIS A 38 60.482 -6.931 0.203 1.00 1.00 H new ATOM 0 HB3 HIS A 38 60.134 -7.385 -1.453 1.00 1.00 H new ATOM 0 HD1 HIS A 38 63.700 -6.662 -0.397 1.00 1.00 H new ATOM 0 HD2 HIS A 38 61.240 -10.001 -1.107 1.00 1.00 H new ATOM 0 HE1 HIS A 38 65.214 -8.719 -0.485 1.00 1.00 H new ATOM 537 N THR A 39 60.639 -4.960 -3.463 1.00 1.00 N ATOM 538 CA THR A 39 59.722 -4.359 -4.426 1.00 1.00 C ATOM 539 C THR A 39 59.177 -5.457 -5.337 1.00 1.00 C ATOM 540 O THR A 39 59.904 -6.392 -5.671 1.00 1.00 O ATOM 541 CB THR A 39 60.441 -3.303 -5.266 1.00 1.00 C ATOM 542 OG1 THR A 39 61.391 -3.938 -6.107 1.00 1.00 O ATOM 543 CG2 THR A 39 61.146 -2.309 -4.346 1.00 1.00 C ATOM 0 H THR A 39 61.479 -5.363 -3.877 1.00 1.00 H new ATOM 0 HA THR A 39 58.905 -3.874 -3.891 1.00 1.00 H new ATOM 0 HB THR A 39 59.716 -2.768 -5.879 1.00 1.00 H new ATOM 0 HG1 THR A 39 61.852 -3.263 -6.648 1.00 1.00 H new ATOM 0 HG21 THR A 39 61.658 -1.557 -4.947 1.00 1.00 H new ATOM 0 HG22 THR A 39 60.411 -1.822 -3.705 1.00 1.00 H new ATOM 0 HG23 THR A 39 61.873 -2.837 -3.729 1.00 1.00 H new ATOM 551 N PRO A 40 57.936 -5.382 -5.736 1.00 1.00 N ATOM 552 CA PRO A 40 57.332 -6.422 -6.613 1.00 1.00 C ATOM 553 C PRO A 40 57.858 -6.358 -8.045 1.00 1.00 C ATOM 554 O PRO A 40 58.725 -7.131 -8.449 1.00 1.00 O ATOM 555 CB PRO A 40 55.826 -6.102 -6.564 1.00 1.00 C ATOM 556 CG PRO A 40 55.745 -4.637 -6.259 1.00 1.00 C ATOM 557 CD PRO A 40 56.972 -4.312 -5.405 1.00 1.00 C ATOM 0 HA PRO A 40 57.574 -7.430 -6.276 1.00 1.00 H new ATOM 0 HB2 PRO A 40 55.343 -6.334 -7.513 1.00 1.00 H new ATOM 0 HB3 PRO A 40 55.323 -6.692 -5.798 1.00 1.00 H new ATOM 0 HG2 PRO A 40 55.742 -4.048 -7.176 1.00 1.00 H new ATOM 0 HG3 PRO A 40 54.825 -4.401 -5.725 1.00 1.00 H new ATOM 0 HD2 PRO A 40 57.373 -3.327 -5.642 1.00 1.00 H new ATOM 0 HD3 PRO A 40 56.729 -4.309 -4.343 1.00 1.00 H new ATOM 565 N ALA A 41 57.261 -5.470 -8.803 1.00 1.00 N ATOM 566 CA ALA A 41 57.561 -5.296 -10.213 1.00 1.00 C ATOM 567 C ALA A 41 58.837 -4.513 -10.420 1.00 1.00 C ATOM 568 O ALA A 41 58.981 -3.383 -9.953 1.00 1.00 O ATOM 569 CB ALA A 41 56.389 -4.570 -10.900 1.00 1.00 C ATOM 0 H ALA A 41 56.541 -4.836 -8.457 1.00 1.00 H new ATOM 0 HA ALA A 41 57.701 -6.283 -10.654 1.00 1.00 H new ATOM 0 HB1 ALA A 41 56.613 -4.439 -11.959 1.00 1.00 H new ATOM 0 HB2 ALA A 41 55.480 -5.162 -10.792 1.00 1.00 H new ATOM 0 HB3 ALA A 41 56.243 -3.594 -10.436 1.00 1.00 H new ATOM 575 N ARG A 42 59.741 -5.123 -11.152 1.00 1.00 N ATOM 576 CA ARG A 42 61.004 -4.496 -11.463 1.00 1.00 C ATOM 577 C ARG A 42 61.748 -5.327 -12.498 1.00 1.00 C ATOM 578 O ARG A 42 61.373 -6.466 -12.775 1.00 1.00 O ATOM 579 CB ARG A 42 61.835 -4.344 -10.178 1.00 1.00 C ATOM 580 CG ARG A 42 62.459 -5.692 -9.790 1.00 1.00 C ATOM 581 CD ARG A 42 62.849 -5.690 -8.320 1.00 1.00 C ATOM 582 NE ARG A 42 63.451 -6.975 -7.978 1.00 1.00 N ATOM 583 CZ ARG A 42 64.380 -7.079 -7.036 1.00 1.00 C ATOM 584 NH1 ARG A 42 64.762 -6.019 -6.381 1.00 1.00 N ATOM 585 NH2 ARG A 42 64.909 -8.242 -6.767 1.00 1.00 N ATOM 0 H ARG A 42 59.624 -6.057 -11.544 1.00 1.00 H new ATOM 0 HA ARG A 42 60.830 -3.504 -11.880 1.00 1.00 H new ATOM 0 HB2 ARG A 42 62.619 -3.602 -10.328 1.00 1.00 H new ATOM 0 HB3 ARG A 42 61.203 -3.981 -9.368 1.00 1.00 H new ATOM 0 HG2 ARG A 42 61.751 -6.498 -9.984 1.00 1.00 H new ATOM 0 HG3 ARG A 42 63.337 -5.884 -10.406 1.00 1.00 H new ATOM 0 HD2 ARG A 42 63.552 -4.881 -8.120 1.00 1.00 H new ATOM 0 HD3 ARG A 42 61.971 -5.510 -7.699 1.00 1.00 H new ATOM 0 HE ARG A 42 63.150 -7.813 -8.475 1.00 1.00 H new ATOM 0 HH11 ARG A 42 64.347 -5.112 -6.593 1.00 1.00 H new ATOM 0 HH12 ARG A 42 65.476 -6.097 -5.657 1.00 1.00 H new ATOM 0 HH21 ARG A 42 64.608 -9.070 -7.281 1.00 1.00 H new ATOM 0 HH22 ARG A 42 65.623 -8.322 -6.043 1.00 1.00 H new ATOM 599 N ARG A 43 62.821 -4.772 -13.035 1.00 1.00 N ATOM 600 CA ARG A 43 63.625 -5.502 -14.011 1.00 1.00 C ATOM 601 C ARG A 43 64.203 -6.769 -13.370 1.00 1.00 C ATOM 602 O ARG A 43 65.162 -7.352 -13.871 1.00 1.00 O ATOM 603 CB ARG A 43 64.771 -4.628 -14.524 1.00 1.00 C ATOM 604 CG ARG A 43 65.378 -5.249 -15.810 1.00 1.00 C ATOM 605 CD ARG A 43 64.846 -4.533 -17.053 1.00 1.00 C ATOM 606 NE ARG A 43 65.380 -5.163 -18.253 1.00 1.00 N ATOM 607 CZ ARG A 43 64.824 -4.963 -19.442 1.00 1.00 C ATOM 608 NH1 ARG A 43 63.782 -4.187 -19.552 1.00 1.00 N ATOM 609 NH2 ARG A 43 65.321 -5.542 -20.499 1.00 1.00 N ATOM 0 H ARG A 43 63.155 -3.833 -12.819 1.00 1.00 H new ATOM 0 HA ARG A 43 62.983 -5.775 -14.849 1.00 1.00 H new ATOM 0 HB2 ARG A 43 64.407 -3.622 -14.733 1.00 1.00 H new ATOM 0 HB3 ARG A 43 65.540 -4.535 -13.757 1.00 1.00 H new ATOM 0 HG2 ARG A 43 66.465 -5.176 -15.778 1.00 1.00 H new ATOM 0 HG3 ARG A 43 65.131 -6.310 -15.860 1.00 1.00 H new ATOM 0 HD2 ARG A 43 63.757 -4.569 -17.066 1.00 1.00 H new ATOM 0 HD3 ARG A 43 65.129 -3.481 -17.027 1.00 1.00 H new ATOM 0 HE ARG A 43 66.197 -5.769 -18.178 1.00 1.00 H new ATOM 0 HH11 ARG A 43 63.394 -3.734 -18.725 1.00 1.00 H new ATOM 0 HH12 ARG A 43 63.355 -4.033 -20.465 1.00 1.00 H new ATOM 0 HH21 ARG A 43 66.137 -6.148 -20.412 1.00 1.00 H new ATOM 0 HH22 ARG A 43 64.894 -5.389 -21.413 1.00 1.00 H new ATOM 623 N GLY A 44 63.620 -7.181 -12.255 1.00 1.00 N ATOM 624 CA GLY A 44 64.072 -8.358 -11.546 1.00 1.00 C ATOM 625 C GLY A 44 65.247 -8.019 -10.648 1.00 1.00 C ATOM 626 O GLY A 44 65.499 -8.700 -9.652 1.00 1.00 O ATOM 0 H GLY A 44 62.826 -6.710 -11.822 1.00 1.00 H new ATOM 0 HA2 GLY A 44 63.256 -8.766 -10.949 1.00 1.00 H new ATOM 0 HA3 GLY A 44 64.362 -9.130 -12.259 1.00 1.00 H new ATOM 630 N PHE A 45 65.970 -6.959 -11.004 1.00 1.00 N ATOM 631 CA PHE A 45 67.131 -6.541 -10.223 1.00 1.00 C ATOM 632 C PHE A 45 67.549 -5.117 -10.597 1.00 1.00 C ATOM 633 O PHE A 45 67.006 -4.549 -11.532 1.00 1.00 O ATOM 634 CB PHE A 45 68.323 -7.503 -10.468 1.00 1.00 C ATOM 635 CG PHE A 45 67.835 -8.893 -10.821 1.00 1.00 C ATOM 636 CD1 PHE A 45 67.382 -9.170 -12.120 1.00 1.00 C ATOM 637 CD2 PHE A 45 67.833 -9.903 -9.855 1.00 1.00 C ATOM 638 CE1 PHE A 45 66.931 -10.453 -12.448 1.00 1.00 C ATOM 639 CE2 PHE A 45 67.383 -11.189 -10.183 1.00 1.00 C ATOM 640 CZ PHE A 45 66.934 -11.465 -11.479 1.00 1.00 C ATOM 0 H PHE A 45 65.775 -6.379 -11.820 1.00 1.00 H new ATOM 0 HA PHE A 45 66.854 -6.568 -9.169 1.00 1.00 H new ATOM 0 HB2 PHE A 45 68.947 -7.117 -11.274 1.00 1.00 H new ATOM 0 HB3 PHE A 45 68.948 -7.549 -9.576 1.00 1.00 H new ATOM 0 HD1 PHE A 45 67.382 -8.391 -12.868 1.00 1.00 H new ATOM 0 HD2 PHE A 45 68.179 -9.692 -8.854 1.00 1.00 H new ATOM 0 HE1 PHE A 45 66.581 -10.663 -13.448 1.00 1.00 H new ATOM 0 HE2 PHE A 45 67.383 -11.968 -9.435 1.00 1.00 H new ATOM 0 HZ PHE A 45 66.590 -12.457 -11.732 1.00 1.00 H new ATOM 650 N PHE A 46 68.514 -4.596 -9.821 1.00 1.00 N ATOM 651 CA PHE A 46 69.091 -3.240 -9.997 1.00 1.00 C ATOM 652 C PHE A 46 69.041 -2.438 -8.710 1.00 1.00 C ATOM 653 O PHE A 46 68.059 -1.748 -8.473 1.00 1.00 O ATOM 654 CB PHE A 46 68.355 -2.405 -11.060 1.00 1.00 C ATOM 655 CG PHE A 46 68.509 -2.949 -12.476 1.00 1.00 C ATOM 656 CD1 PHE A 46 69.547 -3.830 -12.840 1.00 1.00 C ATOM 657 CD2 PHE A 46 67.569 -2.555 -13.435 1.00 1.00 C ATOM 658 CE1 PHE A 46 69.630 -4.299 -14.153 1.00 1.00 C ATOM 659 CE2 PHE A 46 67.658 -3.027 -14.746 1.00 1.00 C ATOM 660 CZ PHE A 46 68.687 -3.899 -15.105 1.00 1.00 C ATOM 0 H PHE A 46 68.926 -5.108 -9.040 1.00 1.00 H new ATOM 0 HA PHE A 46 70.119 -3.420 -10.312 1.00 1.00 H new ATOM 0 HB2 PHE A 46 67.295 -2.364 -10.808 1.00 1.00 H new ATOM 0 HB3 PHE A 46 68.729 -1.382 -11.030 1.00 1.00 H new ATOM 0 HD1 PHE A 46 70.276 -4.141 -12.106 1.00 1.00 H new ATOM 0 HD2 PHE A 46 66.770 -1.882 -13.159 1.00 1.00 H new ATOM 0 HE1 PHE A 46 70.426 -4.973 -14.434 1.00 1.00 H new ATOM 0 HE2 PHE A 46 66.931 -2.717 -15.482 1.00 1.00 H new ATOM 0 HZ PHE A 46 68.755 -4.265 -16.119 1.00 1.00 H new ATOM 670 N ARG A 47 70.120 -2.554 -7.920 1.00 1.00 N ATOM 671 CA ARG A 47 70.297 -1.857 -6.630 1.00 1.00 C ATOM 672 C ARG A 47 70.492 -2.886 -5.529 1.00 1.00 C ATOM 673 O ARG A 47 70.096 -4.024 -5.709 1.00 1.00 O ATOM 674 CB ARG A 47 69.103 -0.938 -6.272 1.00 1.00 C ATOM 675 CG ARG A 47 67.915 -1.779 -5.743 1.00 1.00 C ATOM 676 CD ARG A 47 66.641 -0.928 -5.706 1.00 1.00 C ATOM 677 NE ARG A 47 66.964 0.445 -5.343 1.00 1.00 N ATOM 678 CZ ARG A 47 67.403 0.758 -4.127 1.00 1.00 C ATOM 679 NH1 ARG A 47 67.544 -0.171 -3.218 1.00 1.00 N ATOM 680 NH2 ARG A 47 67.687 1.999 -3.839 1.00 1.00 N ATOM 0 H ARG A 47 70.913 -3.148 -8.163 1.00 1.00 H new ATOM 0 HA ARG A 47 71.175 -1.217 -6.725 1.00 1.00 H new ATOM 0 HB2 ARG A 47 69.408 -0.212 -5.518 1.00 1.00 H new ATOM 0 HB3 ARG A 47 68.794 -0.373 -7.151 1.00 1.00 H new ATOM 0 HG2 ARG A 47 67.762 -2.649 -6.382 1.00 1.00 H new ATOM 0 HG3 ARG A 47 68.141 -2.153 -4.744 1.00 1.00 H new ATOM 0 HD2 ARG A 47 66.152 -0.949 -6.680 1.00 1.00 H new ATOM 0 HD3 ARG A 47 65.936 -1.346 -4.987 1.00 1.00 H new ATOM 0 HE ARG A 47 66.851 1.184 -6.037 1.00 1.00 H new ATOM 0 HH11 ARG A 47 67.317 -1.140 -3.440 1.00 1.00 H new ATOM 0 HH12 ARG A 47 67.881 0.074 -2.287 1.00 1.00 H new ATOM 0 HH21 ARG A 47 67.572 2.726 -4.546 1.00 1.00 H new ATOM 0 HH22 ARG A 47 68.024 2.242 -2.907 1.00 1.00 H new ATOM 694 N CYS A 48 71.130 -2.492 -4.417 1.00 1.00 N ATOM 695 CA CYS A 48 71.384 -3.411 -3.307 1.00 1.00 C ATOM 696 C CYS A 48 72.395 -4.476 -3.745 1.00 1.00 C ATOM 697 O CYS A 48 72.082 -5.655 -3.867 1.00 1.00 O ATOM 698 CB CYS A 48 70.045 -4.026 -2.800 1.00 1.00 C ATOM 699 SG CYS A 48 69.567 -5.467 -3.788 1.00 1.00 S ATOM 0 H CYS A 48 71.477 -1.545 -4.266 1.00 1.00 H new ATOM 0 HA CYS A 48 71.820 -2.871 -2.466 1.00 1.00 H new ATOM 0 HB2 CYS A 48 70.149 -4.317 -1.755 1.00 1.00 H new ATOM 0 HB3 CYS A 48 69.257 -3.274 -2.845 1.00 1.00 H new ATOM 704 N ASN A 49 73.649 -4.066 -3.961 1.00 1.00 N ATOM 705 CA ASN A 49 74.692 -5.002 -4.379 1.00 1.00 C ATOM 706 C ASN A 49 76.004 -4.599 -3.693 1.00 1.00 C ATOM 707 O ASN A 49 76.198 -3.425 -3.381 1.00 1.00 O ATOM 708 CB ASN A 49 74.856 -4.961 -5.921 1.00 1.00 C ATOM 709 CG ASN A 49 73.654 -4.269 -6.557 1.00 1.00 C ATOM 710 OD1 ASN A 49 72.654 -4.918 -6.860 1.00 1.00 O ATOM 711 ND2 ASN A 49 73.691 -2.981 -6.764 1.00 1.00 N ATOM 0 H ASN A 49 73.962 -3.101 -3.854 1.00 1.00 H new ATOM 0 HA ASN A 49 74.421 -6.018 -4.093 1.00 1.00 H new ATOM 0 HB2 ASN A 49 75.772 -4.431 -6.183 1.00 1.00 H new ATOM 0 HB3 ASN A 49 74.951 -5.974 -6.312 1.00 1.00 H new ATOM 0 HD21 ASN A 49 72.888 -2.508 -7.179 1.00 1.00 H new ATOM 0 HD22 ASN A 49 74.523 -2.447 -6.511 1.00 1.00 H new ATOM 718 N PRO A 50 76.898 -5.521 -3.445 1.00 1.00 N ATOM 719 CA PRO A 50 78.192 -5.207 -2.777 1.00 1.00 C ATOM 720 C PRO A 50 79.198 -4.555 -3.723 1.00 1.00 C ATOM 721 O PRO A 50 80.207 -5.164 -4.080 1.00 1.00 O ATOM 722 CB PRO A 50 78.680 -6.579 -2.303 1.00 1.00 C ATOM 723 CG PRO A 50 78.143 -7.534 -3.319 1.00 1.00 C ATOM 724 CD PRO A 50 76.791 -6.960 -3.770 1.00 1.00 C ATOM 0 HA PRO A 50 78.076 -4.484 -1.970 1.00 1.00 H new ATOM 0 HB2 PRO A 50 79.768 -6.619 -2.255 1.00 1.00 H new ATOM 0 HB3 PRO A 50 78.309 -6.810 -1.305 1.00 1.00 H new ATOM 0 HG2 PRO A 50 78.826 -7.631 -4.163 1.00 1.00 H new ATOM 0 HG3 PRO A 50 78.021 -8.529 -2.892 1.00 1.00 H new ATOM 0 HD2 PRO A 50 76.623 -7.119 -4.835 1.00 1.00 H new ATOM 0 HD3 PRO A 50 75.960 -7.429 -3.243 1.00 1.00 H new ATOM 732 N GLU A 51 78.932 -3.312 -4.118 1.00 1.00 N ATOM 733 CA GLU A 51 79.833 -2.590 -5.006 1.00 1.00 C ATOM 734 C GLU A 51 79.915 -3.255 -6.382 1.00 1.00 C ATOM 735 O GLU A 51 80.916 -3.120 -7.087 1.00 1.00 O ATOM 736 CB GLU A 51 81.228 -2.503 -4.357 1.00 1.00 C ATOM 737 CG GLU A 51 81.885 -1.164 -4.707 1.00 1.00 C ATOM 738 CD GLU A 51 81.222 -0.045 -3.907 1.00 1.00 C ATOM 739 OE1 GLU A 51 80.396 -0.356 -3.063 1.00 1.00 O ATOM 740 OE2 GLU A 51 81.548 1.103 -4.148 1.00 1.00 O ATOM 0 H GLU A 51 78.103 -2.788 -3.837 1.00 1.00 H new ATOM 0 HA GLU A 51 79.441 -1.584 -5.158 1.00 1.00 H new ATOM 0 HB2 GLU A 51 81.142 -2.604 -3.275 1.00 1.00 H new ATOM 0 HB3 GLU A 51 81.852 -3.326 -4.705 1.00 1.00 H new ATOM 0 HG2 GLU A 51 82.951 -1.201 -4.485 1.00 1.00 H new ATOM 0 HG3 GLU A 51 81.789 -0.968 -5.775 1.00 1.00 H new ATOM 747 N ARG A 52 78.852 -3.956 -6.766 1.00 1.00 N ATOM 748 CA ARG A 52 78.801 -4.623 -8.071 1.00 1.00 C ATOM 749 C ARG A 52 77.950 -3.816 -9.043 1.00 1.00 C ATOM 750 O ARG A 52 76.894 -3.303 -8.674 1.00 1.00 O ATOM 751 CB ARG A 52 78.188 -6.019 -7.918 1.00 1.00 C ATOM 752 CG ARG A 52 79.161 -6.971 -7.175 1.00 1.00 C ATOM 753 CD ARG A 52 79.930 -7.897 -8.150 1.00 1.00 C ATOM 754 NE ARG A 52 80.062 -9.219 -7.551 1.00 1.00 N ATOM 755 CZ ARG A 52 79.039 -10.070 -7.553 1.00 1.00 C ATOM 756 NH1 ARG A 52 77.911 -9.732 -8.119 1.00 1.00 N ATOM 757 NH2 ARG A 52 79.162 -11.238 -6.993 1.00 1.00 N ATOM 0 H ARG A 52 78.015 -4.079 -6.197 1.00 1.00 H new ATOM 0 HA ARG A 52 79.817 -4.704 -8.458 1.00 1.00 H new ATOM 0 HB2 ARG A 52 77.249 -5.950 -7.368 1.00 1.00 H new ATOM 0 HB3 ARG A 52 77.953 -6.427 -8.901 1.00 1.00 H new ATOM 0 HG2 ARG A 52 79.874 -6.382 -6.598 1.00 1.00 H new ATOM 0 HG3 ARG A 52 78.601 -7.579 -6.465 1.00 1.00 H new ATOM 0 HD2 ARG A 52 79.399 -7.966 -9.100 1.00 1.00 H new ATOM 0 HD3 ARG A 52 80.915 -7.482 -8.365 1.00 1.00 H new ATOM 0 HE ARG A 52 80.947 -9.495 -7.126 1.00 1.00 H new ATOM 0 HH11 ARG A 52 77.815 -8.817 -8.559 1.00 1.00 H new ATOM 0 HH12 ARG A 52 77.126 -10.383 -8.121 1.00 1.00 H new ATOM 0 HH21 ARG A 52 80.043 -11.502 -6.552 1.00 1.00 H new ATOM 0 HH22 ARG A 52 78.377 -11.890 -6.995 1.00 1.00 H new ATOM 771 N ILE A 53 78.404 -3.715 -10.290 1.00 1.00 N ATOM 772 CA ILE A 53 77.656 -2.973 -11.292 1.00 1.00 C ATOM 773 C ILE A 53 76.331 -3.669 -11.603 1.00 1.00 C ATOM 774 O ILE A 53 76.250 -4.895 -11.667 1.00 1.00 O ATOM 775 CB ILE A 53 78.482 -2.819 -12.573 1.00 1.00 C ATOM 776 CG1 ILE A 53 77.714 -1.947 -13.572 1.00 1.00 C ATOM 777 CG2 ILE A 53 78.731 -4.190 -13.191 1.00 1.00 C ATOM 778 CD1 ILE A 53 78.636 -1.553 -14.729 1.00 1.00 C ATOM 0 H ILE A 53 79.273 -4.132 -10.624 1.00 1.00 H new ATOM 0 HA ILE A 53 77.442 -1.982 -10.891 1.00 1.00 H new ATOM 0 HB ILE A 53 79.436 -2.350 -12.332 1.00 1.00 H new ATOM 0 HG12 ILE A 53 76.849 -2.489 -13.953 1.00 1.00 H new ATOM 0 HG13 ILE A 53 77.337 -1.054 -13.075 1.00 1.00 H new ATOM 0 HG21 ILE A 53 79.319 -4.077 -14.102 1.00 1.00 H new ATOM 0 HG22 ILE A 53 79.275 -4.815 -12.483 1.00 1.00 H new ATOM 0 HG23 ILE A 53 77.777 -4.660 -13.431 1.00 1.00 H new ATOM 0 HD11 ILE A 53 78.086 -0.933 -15.437 1.00 1.00 H new ATOM 0 HD12 ILE A 53 79.487 -0.993 -14.341 1.00 1.00 H new ATOM 0 HD13 ILE A 53 78.992 -2.452 -15.233 1.00 1.00 H new ATOM 790 N GLN A 54 75.300 -2.855 -11.757 1.00 1.00 N ATOM 791 CA GLN A 54 73.972 -3.399 -12.024 1.00 1.00 C ATOM 792 C GLN A 54 73.979 -4.132 -13.363 1.00 1.00 C ATOM 793 O GLN A 54 73.516 -3.608 -14.376 1.00 1.00 O ATOM 794 CB GLN A 54 72.934 -2.272 -12.068 1.00 1.00 C ATOM 795 CG GLN A 54 73.521 -1.073 -12.815 1.00 1.00 C ATOM 796 CD GLN A 54 72.426 -0.055 -13.112 1.00 1.00 C ATOM 797 OE1 GLN A 54 72.454 1.059 -12.590 1.00 1.00 O ATOM 798 NE2 GLN A 54 71.456 -0.371 -13.929 1.00 1.00 N ATOM 0 H GLN A 54 75.349 -1.838 -11.704 1.00 1.00 H new ATOM 0 HA GLN A 54 73.710 -4.093 -11.225 1.00 1.00 H new ATOM 0 HB2 GLN A 54 72.027 -2.616 -12.565 1.00 1.00 H new ATOM 0 HB3 GLN A 54 72.652 -1.982 -11.056 1.00 1.00 H new ATOM 0 HG2 GLN A 54 74.306 -0.610 -12.217 1.00 1.00 H new ATOM 0 HG3 GLN A 54 73.983 -1.404 -13.745 1.00 1.00 H new ATOM 0 HE21 GLN A 54 71.434 -1.295 -14.361 1.00 1.00 H new ATOM 0 HE22 GLN A 54 70.721 0.306 -14.134 1.00 1.00 H new ATOM 807 N ILE A 55 74.475 -5.376 -13.359 1.00 1.00 N ATOM 808 CA ILE A 55 74.510 -6.210 -14.560 1.00 1.00 C ATOM 809 C ILE A 55 74.349 -7.688 -14.175 1.00 1.00 C ATOM 810 O ILE A 55 74.639 -8.056 -13.037 1.00 1.00 O ATOM 811 CB ILE A 55 75.847 -6.020 -15.297 1.00 1.00 C ATOM 812 CG1 ILE A 55 75.701 -6.508 -16.749 1.00 1.00 C ATOM 813 CG2 ILE A 55 76.960 -6.819 -14.586 1.00 1.00 C ATOM 814 CD1 ILE A 55 77.079 -6.722 -17.384 1.00 1.00 C ATOM 0 H ILE A 55 74.860 -5.827 -12.529 1.00 1.00 H new ATOM 0 HA ILE A 55 73.691 -5.913 -15.216 1.00 1.00 H new ATOM 0 HB ILE A 55 76.115 -4.963 -15.293 1.00 1.00 H new ATOM 0 HG12 ILE A 55 75.135 -7.439 -16.771 1.00 1.00 H new ATOM 0 HG13 ILE A 55 75.136 -5.778 -17.329 1.00 1.00 H new ATOM 0 HG21 ILE A 55 77.903 -6.679 -15.115 1.00 1.00 H new ATOM 0 HG22 ILE A 55 77.063 -6.466 -13.560 1.00 1.00 H new ATOM 0 HG23 ILE A 55 76.701 -7.878 -14.581 1.00 1.00 H new ATOM 0 HD11 ILE A 55 76.957 -7.067 -18.411 1.00 1.00 H new ATOM 0 HD12 ILE A 55 77.631 -5.782 -17.380 1.00 1.00 H new ATOM 0 HD13 ILE A 55 77.631 -7.469 -16.813 1.00 1.00 H new ATOM 826 N GLY A 56 73.893 -8.530 -15.104 1.00 1.00 N ATOM 827 CA GLY A 56 73.703 -9.957 -14.824 1.00 1.00 C ATOM 828 C GLY A 56 72.229 -10.319 -14.870 1.00 1.00 C ATOM 829 O GLY A 56 71.863 -11.491 -14.794 1.00 1.00 O ATOM 0 H GLY A 56 73.649 -8.251 -16.054 1.00 1.00 H new ATOM 0 HA2 GLY A 56 74.252 -10.552 -15.553 1.00 1.00 H new ATOM 0 HA3 GLY A 56 74.112 -10.198 -13.843 1.00 1.00 H new ATOM 833 N ASP A 57 71.397 -9.303 -15.049 1.00 1.00 N ATOM 834 CA ASP A 57 69.963 -9.539 -15.161 1.00 1.00 C ATOM 835 C ASP A 57 69.639 -10.021 -16.574 1.00 1.00 C ATOM 836 O ASP A 57 69.513 -9.223 -17.501 1.00 1.00 O ATOM 837 CB ASP A 57 69.192 -8.251 -14.898 1.00 1.00 C ATOM 838 CG ASP A 57 69.670 -7.172 -15.856 1.00 1.00 C ATOM 839 OD1 ASP A 57 70.869 -6.964 -15.929 1.00 1.00 O ATOM 840 OD2 ASP A 57 68.831 -6.574 -16.507 1.00 1.00 O ATOM 0 H ASP A 57 71.681 -8.326 -15.119 1.00 1.00 H new ATOM 0 HA ASP A 57 69.674 -10.291 -14.427 1.00 1.00 H new ATOM 0 HB2 ASP A 57 68.123 -8.421 -15.028 1.00 1.00 H new ATOM 0 HB3 ASP A 57 69.340 -7.929 -13.867 1.00 1.00 H new ATOM 845 N TRP A 58 69.543 -11.338 -16.732 1.00 1.00 N ATOM 846 CA TRP A 58 69.272 -11.954 -18.036 1.00 1.00 C ATOM 847 C TRP A 58 67.771 -12.054 -18.342 1.00 1.00 C ATOM 848 O TRP A 58 66.914 -11.697 -17.539 1.00 1.00 O ATOM 849 CB TRP A 58 69.953 -13.339 -18.138 1.00 1.00 C ATOM 850 CG TRP A 58 71.195 -13.264 -18.978 1.00 1.00 C ATOM 851 CD1 TRP A 58 72.128 -12.294 -18.886 1.00 1.00 C ATOM 852 CD2 TRP A 58 71.651 -14.173 -20.023 1.00 1.00 C ATOM 853 NE1 TRP A 58 73.130 -12.548 -19.800 1.00 1.00 N ATOM 854 CE2 TRP A 58 72.883 -13.696 -20.525 1.00 1.00 C ATOM 855 CE3 TRP A 58 71.123 -15.354 -20.574 1.00 1.00 C ATOM 856 CZ2 TRP A 58 73.568 -14.365 -21.541 1.00 1.00 C ATOM 857 CZ3 TRP A 58 71.810 -16.031 -21.598 1.00 1.00 C ATOM 858 CH2 TRP A 58 73.030 -15.537 -22.079 1.00 1.00 C ATOM 0 H TRP A 58 69.649 -12.007 -15.970 1.00 1.00 H new ATOM 0 HA TRP A 58 69.700 -11.297 -18.793 1.00 1.00 H new ATOM 0 HB2 TRP A 58 70.205 -13.699 -17.141 1.00 1.00 H new ATOM 0 HB3 TRP A 58 69.259 -14.059 -18.571 1.00 1.00 H new ATOM 0 HD1 TRP A 58 72.096 -11.455 -18.207 1.00 1.00 H new ATOM 0 HE1 TRP A 58 73.953 -11.959 -19.925 1.00 1.00 H new ATOM 0 HE3 TRP A 58 70.184 -15.744 -20.209 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 74.507 -13.979 -21.909 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 71.395 -16.936 -22.016 1.00 1.00 H new ATOM 0 HH2 TRP A 58 73.554 -16.061 -22.865 1.00 1.00 H new ATOM 869 N ARG A 59 67.513 -12.537 -19.546 1.00 1.00 N ATOM 870 CA ARG A 59 66.139 -12.698 -20.033 1.00 1.00 C ATOM 871 C ARG A 59 65.534 -14.047 -19.636 1.00 1.00 C ATOM 872 O ARG A 59 64.467 -14.108 -19.037 1.00 1.00 O ATOM 873 CB ARG A 59 66.089 -12.572 -21.559 1.00 1.00 C ATOM 874 CG ARG A 59 66.956 -11.382 -22.038 1.00 1.00 C ATOM 875 CD ARG A 59 68.357 -11.862 -22.445 1.00 1.00 C ATOM 876 NE ARG A 59 68.262 -13.032 -23.314 1.00 1.00 N ATOM 877 CZ ARG A 59 69.239 -13.928 -23.374 1.00 1.00 C ATOM 878 NH1 ARG A 59 70.337 -13.737 -22.695 1.00 1.00 N ATOM 879 NH2 ARG A 59 69.099 -14.998 -24.107 1.00 1.00 N ATOM 0 H ARG A 59 68.232 -12.826 -20.209 1.00 1.00 H new ATOM 0 HA ARG A 59 65.553 -11.905 -19.567 1.00 1.00 H new ATOM 0 HB2 ARG A 59 66.444 -13.495 -22.017 1.00 1.00 H new ATOM 0 HB3 ARG A 59 65.058 -12.431 -21.884 1.00 1.00 H new ATOM 0 HG2 ARG A 59 66.474 -10.891 -22.884 1.00 1.00 H new ATOM 0 HG3 ARG A 59 67.037 -10.641 -21.243 1.00 1.00 H new ATOM 0 HD2 ARG A 59 68.887 -11.061 -22.960 1.00 1.00 H new ATOM 0 HD3 ARG A 59 68.937 -12.108 -21.555 1.00 1.00 H new ATOM 0 HE ARG A 59 67.428 -13.163 -23.886 1.00 1.00 H new ATOM 0 HH11 ARG A 59 70.442 -12.901 -22.120 1.00 1.00 H new ATOM 0 HH12 ARG A 59 71.090 -14.424 -22.739 1.00 1.00 H new ATOM 0 HH21 ARG A 59 68.238 -15.146 -24.634 1.00 1.00 H new ATOM 0 HH22 ARG A 59 69.850 -15.687 -24.153 1.00 1.00 H new ATOM 893 N TYR A 60 66.218 -15.113 -20.020 1.00 1.00 N ATOM 894 CA TYR A 60 65.782 -16.492 -19.746 1.00 1.00 C ATOM 895 C TYR A 60 66.386 -17.070 -18.468 1.00 1.00 C ATOM 896 O TYR A 60 65.917 -18.090 -17.921 1.00 1.00 O ATOM 897 CB TYR A 60 66.117 -17.411 -20.918 1.00 1.00 C ATOM 898 CG TYR A 60 65.518 -18.771 -20.643 1.00 1.00 C ATOM 899 CD1 TYR A 60 64.140 -18.972 -20.800 1.00 1.00 C ATOM 900 CD2 TYR A 60 66.334 -19.827 -20.221 1.00 1.00 C ATOM 901 CE1 TYR A 60 63.581 -20.227 -20.535 1.00 1.00 C ATOM 902 CE2 TYR A 60 65.775 -21.082 -19.955 1.00 1.00 C ATOM 903 CZ TYR A 60 64.398 -21.282 -20.113 1.00 1.00 C ATOM 904 OH TYR A 60 63.845 -22.518 -19.849 1.00 1.00 O ATOM 0 H TYR A 60 67.097 -15.056 -20.534 1.00 1.00 H new ATOM 0 HA TYR A 60 64.702 -16.440 -19.607 1.00 1.00 H new ATOM 0 HB2 TYR A 60 65.719 -17.002 -21.847 1.00 1.00 H new ATOM 0 HB3 TYR A 60 67.197 -17.490 -21.041 1.00 1.00 H new ATOM 0 HD1 TYR A 60 63.509 -18.158 -21.126 1.00 1.00 H new ATOM 0 HD2 TYR A 60 67.396 -19.673 -20.101 1.00 1.00 H new ATOM 0 HE1 TYR A 60 62.519 -20.382 -20.656 1.00 1.00 H new ATOM 0 HE2 TYR A 60 66.405 -21.896 -19.628 1.00 1.00 H new ATOM 0 HH TYR A 60 64.550 -23.138 -19.568 1.00 1.00 H new ATOM 914 N GLU A 61 67.442 -16.447 -17.974 1.00 1.00 N ATOM 915 CA GLU A 61 68.111 -16.934 -16.791 1.00 1.00 C ATOM 916 C GLU A 61 67.361 -16.550 -15.530 1.00 1.00 C ATOM 917 O GLU A 61 67.692 -17.004 -14.452 1.00 1.00 O ATOM 918 CB GLU A 61 69.536 -16.357 -16.742 1.00 1.00 C ATOM 919 CG GLU A 61 70.486 -17.341 -16.055 1.00 1.00 C ATOM 920 CD GLU A 61 71.820 -16.663 -15.760 1.00 1.00 C ATOM 921 OE1 GLU A 61 71.799 -15.538 -15.284 1.00 1.00 O ATOM 922 OE2 GLU A 61 72.844 -17.276 -16.010 1.00 1.00 O ATOM 0 H GLU A 61 67.851 -15.604 -18.377 1.00 1.00 H new ATOM 0 HA GLU A 61 68.146 -18.022 -16.840 1.00 1.00 H new ATOM 0 HB2 GLU A 61 69.886 -16.149 -17.753 1.00 1.00 H new ATOM 0 HB3 GLU A 61 69.533 -15.409 -16.204 1.00 1.00 H new ATOM 0 HG2 GLU A 61 70.040 -17.702 -15.128 1.00 1.00 H new ATOM 0 HG3 GLU A 61 70.644 -18.211 -16.693 1.00 1.00 H new ATOM 929 N VAL A 62 66.411 -15.643 -15.634 1.00 1.00 N ATOM 930 CA VAL A 62 65.730 -15.174 -14.419 1.00 1.00 C ATOM 931 C VAL A 62 65.318 -16.364 -13.576 1.00 1.00 C ATOM 932 O VAL A 62 65.659 -16.428 -12.419 1.00 1.00 O ATOM 933 CB VAL A 62 64.495 -14.312 -14.777 1.00 1.00 C ATOM 934 CG1 VAL A 62 64.849 -12.818 -14.712 1.00 1.00 C ATOM 935 CG2 VAL A 62 64.054 -14.649 -16.193 1.00 1.00 C ATOM 0 H VAL A 62 66.093 -15.222 -16.507 1.00 1.00 H new ATOM 0 HA VAL A 62 66.419 -14.551 -13.849 1.00 1.00 H new ATOM 0 HB VAL A 62 63.696 -14.522 -14.066 1.00 1.00 H new ATOM 0 HG11 VAL A 62 63.971 -12.225 -14.966 1.00 1.00 H new ATOM 0 HG12 VAL A 62 65.178 -12.566 -13.704 1.00 1.00 H new ATOM 0 HG13 VAL A 62 65.650 -12.603 -15.420 1.00 1.00 H new ATOM 0 HG21 VAL A 62 63.184 -14.047 -16.456 1.00 1.00 H new ATOM 0 HG22 VAL A 62 64.866 -14.435 -16.888 1.00 1.00 H new ATOM 0 HG23 VAL A 62 63.795 -15.706 -16.252 1.00 1.00 H new ATOM 945 N ALA A 63 64.571 -17.290 -14.124 1.00 1.00 N ATOM 946 CA ALA A 63 64.168 -18.431 -13.337 1.00 1.00 C ATOM 947 C ALA A 63 65.402 -19.244 -12.965 1.00 1.00 C ATOM 948 O ALA A 63 65.647 -19.529 -11.782 1.00 1.00 O ATOM 949 CB ALA A 63 63.191 -19.298 -14.139 1.00 1.00 C ATOM 0 H ALA A 63 64.236 -17.280 -15.087 1.00 1.00 H new ATOM 0 HA ALA A 63 63.670 -18.091 -12.429 1.00 1.00 H new ATOM 0 HB1 ALA A 63 62.891 -20.157 -13.540 1.00 1.00 H new ATOM 0 HB2 ALA A 63 62.310 -18.710 -14.397 1.00 1.00 H new ATOM 0 HB3 ALA A 63 63.676 -19.644 -15.052 1.00 1.00 H new ATOM 955 N HIS A 64 66.201 -19.593 -13.980 1.00 1.00 N ATOM 956 CA HIS A 64 67.403 -20.384 -13.711 1.00 1.00 C ATOM 957 C HIS A 64 68.218 -19.730 -12.585 1.00 1.00 C ATOM 958 O HIS A 64 68.487 -20.339 -11.560 1.00 1.00 O ATOM 959 CB HIS A 64 68.242 -20.506 -14.991 1.00 1.00 C ATOM 960 CG HIS A 64 69.098 -21.742 -14.933 1.00 1.00 C ATOM 961 ND1 HIS A 64 70.478 -21.682 -14.818 1.00 1.00 N ATOM 962 CD2 HIS A 64 68.782 -23.076 -14.976 1.00 1.00 C ATOM 963 CE1 HIS A 64 70.938 -22.948 -14.798 1.00 1.00 C ATOM 964 NE2 HIS A 64 69.944 -23.835 -14.892 1.00 1.00 N ATOM 0 H HIS A 64 66.045 -19.351 -14.959 1.00 1.00 H new ATOM 0 HA HIS A 64 67.114 -21.385 -13.390 1.00 1.00 H new ATOM 0 HB2 HIS A 64 67.587 -20.548 -15.861 1.00 1.00 H new ATOM 0 HB3 HIS A 64 68.871 -19.624 -15.108 1.00 1.00 H new ATOM 0 HD2 HIS A 64 67.783 -23.476 -15.062 1.00 1.00 H new ATOM 0 HE1 HIS A 64 71.982 -23.213 -14.716 1.00 1.00 H new ATOM 0 HE2 HIS A 64 70.021 -24.852 -14.900 1.00 1.00 H new ATOM 972 N ASP A 65 68.605 -18.490 -12.782 1.00 1.00 N ATOM 973 CA ASP A 65 69.370 -17.763 -11.772 1.00 1.00 C ATOM 974 C ASP A 65 68.482 -17.443 -10.558 1.00 1.00 C ATOM 975 O ASP A 65 68.848 -17.670 -9.399 1.00 1.00 O ATOM 976 CB ASP A 65 69.918 -16.463 -12.385 1.00 1.00 C ATOM 977 CG ASP A 65 70.564 -15.584 -11.320 1.00 1.00 C ATOM 978 OD1 ASP A 65 69.935 -15.351 -10.302 1.00 1.00 O ATOM 979 OD2 ASP A 65 71.682 -15.150 -11.540 1.00 1.00 O ATOM 0 H ASP A 65 68.407 -17.957 -13.629 1.00 1.00 H new ATOM 0 HA ASP A 65 70.201 -18.383 -11.437 1.00 1.00 H new ATOM 0 HB2 ASP A 65 70.650 -16.701 -13.157 1.00 1.00 H new ATOM 0 HB3 ASP A 65 69.109 -15.917 -12.870 1.00 1.00 H new ATOM 984 N GLY A 66 67.295 -16.938 -10.817 1.00 1.00 N ATOM 985 CA GLY A 66 66.356 -16.597 -9.754 1.00 1.00 C ATOM 986 C GLY A 66 65.805 -17.837 -9.075 1.00 1.00 C ATOM 987 O GLY A 66 64.718 -17.809 -8.502 1.00 1.00 O ATOM 0 H GLY A 66 66.950 -16.751 -11.758 1.00 1.00 H new ATOM 0 HA2 GLY A 66 66.854 -15.968 -9.016 1.00 1.00 H new ATOM 0 HA3 GLY A 66 65.534 -16.013 -10.168 1.00 1.00 H new ATOM 991 N ARG A 67 66.592 -18.895 -9.082 1.00 1.00 N ATOM 992 CA ARG A 67 66.238 -20.132 -8.411 1.00 1.00 C ATOM 993 C ARG A 67 66.569 -19.977 -6.939 1.00 1.00 C ATOM 994 O ARG A 67 66.319 -20.877 -6.133 1.00 1.00 O ATOM 995 CB ARG A 67 66.998 -21.324 -9.015 1.00 1.00 C ATOM 996 CG ARG A 67 66.085 -22.556 -9.090 1.00 1.00 C ATOM 997 CD ARG A 67 65.141 -22.442 -10.304 1.00 1.00 C ATOM 998 NE ARG A 67 63.806 -22.912 -9.962 1.00 1.00 N ATOM 999 CZ ARG A 67 63.526 -24.205 -9.880 1.00 1.00 C ATOM 1000 NH1 ARG A 67 64.464 -25.094 -10.058 1.00 1.00 N ATOM 1001 NH2 ARG A 67 62.307 -24.585 -9.617 1.00 1.00 N ATOM 0 H ARG A 67 67.496 -18.922 -9.553 1.00 1.00 H new ATOM 0 HA ARG A 67 65.174 -20.331 -8.539 1.00 1.00 H new ATOM 0 HB2 ARG A 67 67.357 -21.068 -10.012 1.00 1.00 H new ATOM 0 HB3 ARG A 67 67.875 -21.550 -8.409 1.00 1.00 H new ATOM 0 HG2 ARG A 67 66.688 -23.461 -9.172 1.00 1.00 H new ATOM 0 HG3 ARG A 67 65.502 -22.643 -8.173 1.00 1.00 H new ATOM 0 HD2 ARG A 67 65.093 -21.405 -10.638 1.00 1.00 H new ATOM 0 HD3 ARG A 67 65.536 -23.026 -11.135 1.00 1.00 H new ATOM 0 HE ARG A 67 63.069 -22.230 -9.781 1.00 1.00 H new ATOM 0 HH11 ARG A 67 65.418 -24.795 -10.261 1.00 1.00 H new ATOM 0 HH12 ARG A 67 64.244 -26.088 -9.994 1.00 1.00 H new ATOM 0 HH21 ARG A 67 61.575 -23.889 -9.476 1.00 1.00 H new ATOM 0 HH22 ARG A 67 62.085 -25.579 -9.553 1.00 1.00 H new ATOM 1015 N LEU A 68 67.146 -18.824 -6.597 1.00 1.00 N ATOM 1016 CA LEU A 68 67.515 -18.554 -5.214 1.00 1.00 C ATOM 1017 C LEU A 68 66.405 -19.021 -4.294 1.00 1.00 C ATOM 1018 O LEU A 68 66.646 -19.382 -3.158 1.00 1.00 O ATOM 1019 CB LEU A 68 67.753 -17.052 -4.971 1.00 1.00 C ATOM 1020 CG LEU A 68 68.383 -16.817 -3.568 1.00 1.00 C ATOM 1021 CD1 LEU A 68 69.907 -16.965 -3.637 1.00 1.00 C ATOM 1022 CD2 LEU A 68 68.045 -15.407 -3.066 1.00 1.00 C ATOM 0 H LEU A 68 67.364 -18.073 -7.252 1.00 1.00 H new ATOM 0 HA LEU A 68 68.441 -19.091 -5.008 1.00 1.00 H new ATOM 0 HB2 LEU A 68 68.412 -16.653 -5.743 1.00 1.00 H new ATOM 0 HB3 LEU A 68 66.809 -16.512 -5.047 1.00 1.00 H new ATOM 0 HG LEU A 68 67.975 -17.560 -2.883 1.00 1.00 H new ATOM 0 HD11 LEU A 68 70.334 -16.798 -2.648 1.00 1.00 H new ATOM 0 HD12 LEU A 68 70.160 -17.969 -3.976 1.00 1.00 H new ATOM 0 HD13 LEU A 68 70.312 -16.233 -4.336 1.00 1.00 H new ATOM 0 HD21 LEU A 68 68.491 -15.254 -2.083 1.00 1.00 H new ATOM 0 HD22 LEU A 68 68.440 -14.668 -3.763 1.00 1.00 H new ATOM 0 HD23 LEU A 68 66.963 -15.296 -2.995 1.00 1.00 H new ATOM 1034 N LEU A 69 65.166 -18.958 -4.756 1.00 1.00 N ATOM 1035 CA LEU A 69 64.065 -19.349 -3.863 1.00 1.00 C ATOM 1036 C LEU A 69 64.065 -20.854 -3.536 1.00 1.00 C ATOM 1037 O LEU A 69 64.262 -21.230 -2.383 1.00 1.00 O ATOM 1038 CB LEU A 69 62.741 -18.999 -4.549 1.00 1.00 C ATOM 1039 CG LEU A 69 61.528 -19.352 -3.636 1.00 1.00 C ATOM 1040 CD1 LEU A 69 60.537 -18.185 -3.614 1.00 1.00 C ATOM 1041 CD2 LEU A 69 60.792 -20.600 -4.166 1.00 1.00 C ATOM 0 H LEU A 69 64.896 -18.658 -5.693 1.00 1.00 H new ATOM 0 HA LEU A 69 64.194 -18.811 -2.924 1.00 1.00 H new ATOM 0 HB2 LEU A 69 62.722 -17.936 -4.790 1.00 1.00 H new ATOM 0 HB3 LEU A 69 62.661 -19.541 -5.491 1.00 1.00 H new ATOM 0 HG LEU A 69 61.907 -19.549 -2.633 1.00 1.00 H new ATOM 0 HD11 LEU A 69 59.691 -18.438 -2.974 1.00 1.00 H new ATOM 0 HD12 LEU A 69 61.032 -17.295 -3.226 1.00 1.00 H new ATOM 0 HD13 LEU A 69 60.181 -17.991 -4.626 1.00 1.00 H new ATOM 0 HD21 LEU A 69 59.949 -20.829 -3.514 1.00 1.00 H new ATOM 0 HD22 LEU A 69 60.429 -20.407 -5.175 1.00 1.00 H new ATOM 0 HD23 LEU A 69 61.478 -21.447 -4.183 1.00 1.00 H new ATOM 1053 N ALA A 70 63.775 -21.712 -4.513 1.00 1.00 N ATOM 1054 CA ALA A 70 63.705 -23.134 -4.146 1.00 1.00 C ATOM 1055 C ALA A 70 65.111 -23.661 -3.940 1.00 1.00 C ATOM 1056 O ALA A 70 65.613 -23.700 -2.820 1.00 1.00 O ATOM 1057 CB ALA A 70 63.047 -23.933 -5.273 1.00 1.00 C ATOM 0 H ALA A 70 63.597 -21.481 -5.490 1.00 1.00 H new ATOM 0 HA ALA A 70 63.119 -23.239 -3.233 1.00 1.00 H new ATOM 0 HB1 ALA A 70 62.999 -24.985 -4.993 1.00 1.00 H new ATOM 0 HB2 ALA A 70 62.038 -23.557 -5.445 1.00 1.00 H new ATOM 0 HB3 ALA A 70 63.634 -23.827 -6.185 1.00 1.00 H new ATOM 1063 N ALA A 71 65.739 -24.050 -5.019 1.00 1.00 N ATOM 1064 CA ALA A 71 67.082 -24.589 -5.049 1.00 1.00 C ATOM 1065 C ALA A 71 68.112 -23.675 -4.439 1.00 1.00 C ATOM 1066 O ALA A 71 69.280 -23.828 -4.755 1.00 1.00 O ATOM 1067 CB ALA A 71 67.485 -25.008 -6.454 1.00 1.00 C ATOM 0 H ALA A 71 65.313 -23.999 -5.944 1.00 1.00 H new ATOM 0 HA ALA A 71 67.055 -25.478 -4.419 1.00 1.00 H new ATOM 0 HB1 ALA A 71 68.499 -25.408 -6.438 1.00 1.00 H new ATOM 0 HB2 ALA A 71 66.799 -25.774 -6.816 1.00 1.00 H new ATOM 0 HB3 ALA A 71 67.446 -24.143 -7.117 1.00 1.00 H new ATOM 1073 N HIS A 72 67.683 -22.672 -3.662 1.00 1.00 N ATOM 1074 CA HIS A 72 68.591 -21.657 -3.102 1.00 1.00 C ATOM 1075 C HIS A 72 70.058 -22.098 -3.123 1.00 1.00 C ATOM 1076 O HIS A 72 70.941 -21.259 -3.277 1.00 1.00 O ATOM 1077 CB HIS A 72 68.191 -21.390 -1.638 1.00 1.00 C ATOM 1078 CG HIS A 72 67.772 -22.680 -1.001 1.00 1.00 C ATOM 1079 ND1 HIS A 72 68.168 -23.907 -1.498 1.00 1.00 N ATOM 1080 CD2 HIS A 72 66.989 -22.949 0.090 1.00 1.00 C ATOM 1081 CE1 HIS A 72 67.627 -24.854 -0.713 1.00 1.00 C ATOM 1082 NE2 HIS A 72 66.899 -24.322 0.273 1.00 1.00 N ATOM 0 H HIS A 72 66.705 -22.540 -3.404 1.00 1.00 H new ATOM 0 HA HIS A 72 68.501 -20.764 -3.720 1.00 1.00 H new ATOM 0 HB2 HIS A 72 69.029 -20.956 -1.092 1.00 1.00 H new ATOM 0 HB3 HIS A 72 67.376 -20.668 -1.597 1.00 1.00 H new ATOM 0 HD2 HIS A 72 66.514 -22.206 0.713 1.00 1.00 H new ATOM 0 HE1 HIS A 72 67.764 -25.915 -0.861 1.00 1.00 H new ATOM 0 HE2 HIS A 72 66.387 -24.818 1.003 1.00 1.00 H new ATOM 1090 N MET A 73 70.319 -23.391 -3.038 1.00 1.00 N ATOM 1091 CA MET A 73 71.686 -23.853 -3.133 1.00 1.00 C ATOM 1092 C MET A 73 72.221 -23.538 -4.544 1.00 1.00 C ATOM 1093 O MET A 73 73.284 -22.938 -4.674 1.00 1.00 O ATOM 1094 CB MET A 73 71.769 -25.356 -2.856 1.00 1.00 C ATOM 1095 CG MET A 73 71.141 -25.667 -1.491 1.00 1.00 C ATOM 1096 SD MET A 73 72.279 -25.172 -0.173 1.00 1.00 S ATOM 1097 CE MET A 73 71.265 -25.697 1.233 1.00 1.00 C ATOM 0 H MET A 73 69.619 -24.121 -2.907 1.00 1.00 H new ATOM 0 HA MET A 73 72.293 -23.341 -2.386 1.00 1.00 H new ATOM 0 HB2 MET A 73 71.251 -25.909 -3.640 1.00 1.00 H new ATOM 0 HB3 MET A 73 72.809 -25.681 -2.871 1.00 1.00 H new ATOM 0 HG2 MET A 73 70.194 -25.137 -1.386 1.00 1.00 H new ATOM 0 HG3 MET A 73 70.921 -26.732 -1.415 1.00 1.00 H new ATOM 0 HE1 MET A 73 71.791 -25.479 2.162 1.00 1.00 H new ATOM 0 HE2 MET A 73 70.316 -25.160 1.218 1.00 1.00 H new ATOM 0 HE3 MET A 73 71.077 -26.768 1.166 1.00 1.00 H new ATOM 1107 N VAL A 74 71.538 -24.029 -5.596 1.00 1.00 N ATOM 1108 CA VAL A 74 72.070 -23.854 -6.961 1.00 1.00 C ATOM 1109 C VAL A 74 72.589 -22.445 -7.181 1.00 1.00 C ATOM 1110 O VAL A 74 73.710 -22.316 -7.675 1.00 1.00 O ATOM 1111 CB VAL A 74 71.047 -24.183 -8.039 1.00 1.00 C ATOM 1112 CG1 VAL A 74 70.646 -25.662 -7.940 1.00 1.00 C ATOM 1113 CG2 VAL A 74 69.833 -23.262 -7.899 1.00 1.00 C ATOM 0 H VAL A 74 70.652 -24.531 -5.534 1.00 1.00 H new ATOM 0 HA VAL A 74 72.894 -24.562 -7.047 1.00 1.00 H new ATOM 0 HB VAL A 74 71.483 -24.018 -9.024 1.00 1.00 H new ATOM 0 HG11 VAL A 74 69.914 -25.893 -8.714 1.00 1.00 H new ATOM 0 HG12 VAL A 74 71.528 -26.288 -8.077 1.00 1.00 H new ATOM 0 HG13 VAL A 74 70.212 -25.856 -6.959 1.00 1.00 H new ATOM 0 HG21 VAL A 74 69.104 -23.501 -8.673 1.00 1.00 H new ATOM 0 HG22 VAL A 74 69.380 -23.403 -6.918 1.00 1.00 H new ATOM 0 HG23 VAL A 74 70.149 -22.224 -8.007 1.00 1.00 H new ATOM 1123 N ASN A 75 71.834 -21.375 -6.885 1.00 1.00 N ATOM 1124 CA ASN A 75 72.334 -20.010 -7.101 1.00 1.00 C ATOM 1125 C ASN A 75 73.833 -19.885 -6.801 1.00 1.00 C ATOM 1126 O ASN A 75 74.497 -18.957 -7.252 1.00 1.00 O ATOM 1127 CB ASN A 75 71.524 -19.076 -6.179 1.00 1.00 C ATOM 1128 CG ASN A 75 71.324 -17.708 -6.815 1.00 1.00 C ATOM 1129 OD1 ASN A 75 70.742 -17.633 -7.974 1.00 1.00 O flip ATOM 1130 ND2 ASN A 75 71.698 -16.685 -6.237 1.00 1.00 N flip ATOM 0 H ASN A 75 70.890 -21.427 -6.502 1.00 1.00 H new ATOM 0 HA ASN A 75 72.209 -19.740 -8.150 1.00 1.00 H new ATOM 0 HB2 ASN A 75 70.554 -19.525 -5.965 1.00 1.00 H new ATOM 0 HB3 ASN A 75 72.041 -18.964 -5.226 1.00 1.00 H new ATOM 0 HD21 ASN A 75 72.154 -16.751 -5.327 1.00 1.00 H new ATOM 0 HD22 ASN A 75 71.551 -15.773 -6.669 1.00 1.00 H new ATOM 1137 N GLY A 76 74.349 -20.848 -6.067 1.00 1.00 N ATOM 1138 CA GLY A 76 75.766 -20.869 -5.757 1.00 1.00 C ATOM 1139 C GLY A 76 76.568 -20.629 -7.046 1.00 1.00 C ATOM 1140 O GLY A 76 77.663 -20.114 -7.008 1.00 1.00 O ATOM 0 H GLY A 76 73.814 -21.623 -5.675 1.00 1.00 H new ATOM 0 HA2 GLY A 76 76.001 -20.101 -5.020 1.00 1.00 H new ATOM 0 HA3 GLY A 76 76.040 -21.828 -5.317 1.00 1.00 H new ATOM 1144 N ILE A 77 75.997 -21.017 -8.184 1.00 1.00 N ATOM 1145 CA ILE A 77 76.684 -20.831 -9.466 1.00 1.00 C ATOM 1146 C ILE A 77 76.741 -19.332 -9.784 1.00 1.00 C ATOM 1147 O ILE A 77 77.762 -18.788 -10.138 1.00 1.00 O ATOM 1148 CB ILE A 77 75.968 -21.626 -10.573 1.00 1.00 C ATOM 1149 CG1 ILE A 77 74.529 -21.116 -10.748 1.00 1.00 C ATOM 1150 CG2 ILE A 77 75.946 -23.113 -10.189 1.00 1.00 C ATOM 1151 CD1 ILE A 77 73.729 -22.090 -11.622 1.00 1.00 C ATOM 0 H ILE A 77 75.078 -21.454 -8.249 1.00 1.00 H new ATOM 0 HA ILE A 77 77.704 -21.211 -9.407 1.00 1.00 H new ATOM 0 HB ILE A 77 76.502 -21.494 -11.514 1.00 1.00 H new ATOM 0 HG12 ILE A 77 74.051 -21.012 -9.774 1.00 1.00 H new ATOM 0 HG13 ILE A 77 74.538 -20.127 -11.206 1.00 1.00 H new ATOM 0 HG21 ILE A 77 75.440 -23.683 -10.969 1.00 1.00 H new ATOM 0 HG22 ILE A 77 76.968 -23.476 -10.080 1.00 1.00 H new ATOM 0 HG23 ILE A 77 75.414 -23.237 -9.246 1.00 1.00 H new ATOM 0 HD11 ILE A 77 72.711 -21.720 -11.740 1.00 1.00 H new ATOM 0 HD12 ILE A 77 74.201 -22.172 -12.601 1.00 1.00 H new ATOM 0 HD13 ILE A 77 73.706 -23.071 -11.147 1.00 1.00 H new ATOM 1163 N VAL A 78 75.568 -18.746 -9.707 1.00 1.00 N ATOM 1164 CA VAL A 78 75.410 -17.332 -10.046 1.00 1.00 C ATOM 1165 C VAL A 78 76.682 -16.602 -9.571 1.00 1.00 C ATOM 1166 O VAL A 78 77.163 -15.674 -10.217 1.00 1.00 O ATOM 1167 CB VAL A 78 74.172 -16.719 -9.416 1.00 1.00 C ATOM 1168 CG1 VAL A 78 74.173 -15.207 -9.665 1.00 1.00 C ATOM 1169 CG2 VAL A 78 72.947 -17.339 -10.076 1.00 1.00 C ATOM 0 H VAL A 78 74.710 -19.214 -9.416 1.00 1.00 H new ATOM 0 HA VAL A 78 75.277 -17.231 -11.123 1.00 1.00 H new ATOM 0 HB VAL A 78 74.159 -16.906 -8.342 1.00 1.00 H new ATOM 0 HG11 VAL A 78 73.285 -14.763 -9.214 1.00 1.00 H new ATOM 0 HG12 VAL A 78 75.065 -14.766 -9.220 1.00 1.00 H new ATOM 0 HG13 VAL A 78 74.169 -15.015 -10.738 1.00 1.00 H new ATOM 0 HG21 VAL A 78 72.044 -16.913 -9.639 1.00 1.00 H new ATOM 0 HG22 VAL A 78 72.965 -17.131 -11.146 1.00 1.00 H new ATOM 0 HG23 VAL A 78 72.954 -18.417 -9.916 1.00 1.00 H new ATOM 1179 N ILE A 79 77.257 -17.098 -8.454 1.00 1.00 N ATOM 1180 CA ILE A 79 78.516 -16.555 -7.918 1.00 1.00 C ATOM 1181 C ILE A 79 79.725 -17.398 -8.386 1.00 1.00 C ATOM 1182 O ILE A 79 80.805 -16.886 -8.593 1.00 1.00 O ATOM 1183 CB ILE A 79 78.457 -16.464 -6.363 1.00 1.00 C ATOM 1184 CG1 ILE A 79 78.964 -17.761 -5.665 1.00 1.00 C ATOM 1185 CG2 ILE A 79 77.009 -16.195 -5.938 1.00 1.00 C ATOM 1186 CD1 ILE A 79 80.416 -17.589 -5.216 1.00 1.00 C ATOM 0 H ILE A 79 76.869 -17.869 -7.911 1.00 1.00 H new ATOM 0 HA ILE A 79 78.647 -15.546 -8.308 1.00 1.00 H new ATOM 0 HB ILE A 79 79.116 -15.653 -6.054 1.00 1.00 H new ATOM 0 HG12 ILE A 79 78.335 -17.989 -4.805 1.00 1.00 H new ATOM 0 HG13 ILE A 79 78.886 -18.605 -6.350 1.00 1.00 H new ATOM 0 HG21 ILE A 79 76.955 -16.129 -4.851 1.00 1.00 H new ATOM 0 HG22 ILE A 79 76.670 -15.256 -6.376 1.00 1.00 H new ATOM 0 HG23 ILE A 79 76.371 -17.008 -6.284 1.00 1.00 H new ATOM 0 HD11 ILE A 79 80.757 -18.503 -4.730 1.00 1.00 H new ATOM 0 HD12 ILE A 79 81.043 -17.384 -6.083 1.00 1.00 H new ATOM 0 HD13 ILE A 79 80.484 -16.758 -4.514 1.00 1.00 H new ATOM 1198 N ALA A 80 79.505 -18.700 -8.573 1.00 1.00 N ATOM 1199 CA ALA A 80 80.554 -19.627 -9.030 1.00 1.00 C ATOM 1200 C ALA A 80 80.735 -19.604 -10.547 1.00 1.00 C ATOM 1201 O ALA A 80 81.659 -20.228 -11.064 1.00 1.00 O ATOM 1202 CB ALA A 80 80.291 -21.079 -8.558 1.00 1.00 C ATOM 0 H ALA A 80 78.601 -19.145 -8.414 1.00 1.00 H new ATOM 0 HA ALA A 80 81.478 -19.273 -8.573 1.00 1.00 H new ATOM 0 HB1 ALA A 80 81.089 -21.729 -8.917 1.00 1.00 H new ATOM 0 HB2 ALA A 80 80.262 -21.108 -7.469 1.00 1.00 H new ATOM 0 HB3 ALA A 80 79.336 -21.423 -8.955 1.00 1.00 H new ATOM 1208 N GLU A 81 79.848 -18.926 -11.272 1.00 1.00 N ATOM 1209 CA GLU A 81 79.942 -18.897 -12.708 1.00 1.00 C ATOM 1210 C GLU A 81 80.777 -17.713 -13.205 1.00 1.00 C ATOM 1211 O GLU A 81 81.896 -17.919 -13.676 1.00 1.00 O ATOM 1212 CB GLU A 81 78.506 -18.814 -13.277 1.00 1.00 C ATOM 1213 CG GLU A 81 78.009 -20.205 -13.686 1.00 1.00 C ATOM 1214 CD GLU A 81 78.630 -20.596 -15.023 1.00 1.00 C ATOM 1215 OE1 GLU A 81 78.580 -19.785 -15.934 1.00 1.00 O ATOM 1216 OE2 GLU A 81 79.148 -21.696 -15.118 1.00 1.00 O ATOM 0 H GLU A 81 79.067 -18.398 -10.882 1.00 1.00 H new ATOM 0 HA GLU A 81 80.445 -19.801 -13.050 1.00 1.00 H new ATOM 0 HB2 GLU A 81 77.837 -18.387 -12.530 1.00 1.00 H new ATOM 0 HB3 GLU A 81 78.488 -18.147 -14.139 1.00 1.00 H new ATOM 0 HG2 GLU A 81 78.274 -20.936 -12.922 1.00 1.00 H new ATOM 0 HG3 GLU A 81 76.922 -20.206 -13.764 1.00 1.00 H new ATOM 1223 N ASP A 82 80.259 -16.473 -13.134 1.00 1.00 N ATOM 1224 CA ASP A 82 81.006 -15.307 -13.618 1.00 1.00 C ATOM 1225 C ASP A 82 81.849 -14.590 -12.556 1.00 1.00 C ATOM 1226 O ASP A 82 82.675 -13.749 -12.906 1.00 1.00 O ATOM 1227 CB ASP A 82 80.044 -14.304 -14.241 1.00 1.00 C ATOM 1228 CG ASP A 82 80.817 -13.341 -15.140 1.00 1.00 C ATOM 1229 OD1 ASP A 82 81.472 -12.460 -14.612 1.00 1.00 O ATOM 1230 OD2 ASP A 82 80.751 -13.510 -16.346 1.00 1.00 O ATOM 0 H ASP A 82 79.338 -16.258 -12.751 1.00 1.00 H new ATOM 0 HA ASP A 82 81.711 -15.702 -14.349 1.00 1.00 H new ATOM 0 HB2 ASP A 82 79.283 -14.827 -14.821 1.00 1.00 H new ATOM 0 HB3 ASP A 82 79.524 -13.750 -13.459 1.00 1.00 H new ATOM 1235 N ALA A 83 81.633 -14.862 -11.270 1.00 1.00 N ATOM 1236 CA ALA A 83 82.404 -14.132 -10.264 1.00 1.00 C ATOM 1237 C ALA A 83 83.925 -14.229 -10.488 1.00 1.00 C ATOM 1238 O ALA A 83 84.618 -13.229 -10.335 1.00 1.00 O ATOM 1239 CB ALA A 83 82.068 -14.586 -8.850 1.00 1.00 C ATOM 0 H ALA A 83 80.967 -15.546 -10.912 1.00 1.00 H new ATOM 0 HA ALA A 83 82.113 -13.088 -10.380 1.00 1.00 H new ATOM 0 HB1 ALA A 83 82.663 -14.018 -8.135 1.00 1.00 H new ATOM 0 HB2 ALA A 83 81.009 -14.417 -8.656 1.00 1.00 H new ATOM 0 HB3 ALA A 83 82.291 -15.648 -8.746 1.00 1.00 H new ATOM 1245 N LEU A 84 84.464 -15.420 -10.783 1.00 1.00 N ATOM 1246 CA LEU A 84 85.923 -15.546 -10.951 1.00 1.00 C ATOM 1247 C LEU A 84 86.489 -14.372 -11.765 1.00 1.00 C ATOM 1248 O LEU A 84 87.700 -14.149 -11.777 1.00 1.00 O ATOM 1249 CB LEU A 84 86.336 -16.899 -11.607 1.00 1.00 C ATOM 1250 CG LEU A 84 85.117 -17.635 -12.200 1.00 1.00 C ATOM 1251 CD1 LEU A 84 84.173 -18.131 -11.066 1.00 1.00 C ATOM 1252 CD2 LEU A 84 84.371 -16.713 -13.193 1.00 1.00 C ATOM 0 H LEU A 84 83.936 -16.284 -10.907 1.00 1.00 H new ATOM 0 HA LEU A 84 86.350 -15.524 -9.949 1.00 1.00 H new ATOM 0 HB2 LEU A 84 87.069 -16.715 -12.393 1.00 1.00 H new ATOM 0 HB3 LEU A 84 86.819 -17.533 -10.863 1.00 1.00 H new ATOM 0 HG LEU A 84 85.464 -18.512 -12.747 1.00 1.00 H new ATOM 0 HD11 LEU A 84 83.319 -18.648 -11.504 1.00 1.00 H new ATOM 0 HD12 LEU A 84 84.716 -18.815 -10.414 1.00 1.00 H new ATOM 0 HD13 LEU A 84 83.822 -17.278 -10.485 1.00 1.00 H new ATOM 0 HD21 LEU A 84 83.512 -17.242 -13.606 1.00 1.00 H new ATOM 0 HD22 LEU A 84 84.030 -15.818 -12.673 1.00 1.00 H new ATOM 0 HD23 LEU A 84 85.045 -16.428 -14.001 1.00 1.00 H new ATOM 1264 N ILE A 85 85.622 -13.617 -12.438 1.00 1.00 N ATOM 1265 CA ILE A 85 86.082 -12.468 -13.220 1.00 1.00 C ATOM 1266 C ILE A 85 85.997 -11.195 -12.386 1.00 1.00 C ATOM 1267 O ILE A 85 86.790 -10.271 -12.576 1.00 1.00 O ATOM 1268 CB ILE A 85 85.259 -12.323 -14.517 1.00 1.00 C ATOM 1269 CG1 ILE A 85 85.723 -13.376 -15.549 1.00 1.00 C ATOM 1270 CG2 ILE A 85 85.432 -10.906 -15.099 1.00 1.00 C ATOM 1271 CD1 ILE A 85 86.959 -12.879 -16.322 1.00 1.00 C ATOM 0 H ILE A 85 84.614 -13.775 -12.459 1.00 1.00 H new ATOM 0 HA ILE A 85 87.123 -12.634 -13.497 1.00 1.00 H new ATOM 0 HB ILE A 85 84.205 -12.483 -14.289 1.00 1.00 H new ATOM 0 HG12 ILE A 85 85.959 -14.311 -15.040 1.00 1.00 H new ATOM 0 HG13 ILE A 85 84.913 -13.588 -16.247 1.00 1.00 H new ATOM 0 HG21 ILE A 85 84.847 -10.815 -16.014 1.00 1.00 H new ATOM 0 HG22 ILE A 85 85.087 -10.170 -14.373 1.00 1.00 H new ATOM 0 HG23 ILE A 85 86.484 -10.730 -15.322 1.00 1.00 H new ATOM 0 HD11 ILE A 85 87.267 -13.637 -17.042 1.00 1.00 H new ATOM 0 HD12 ILE A 85 86.712 -11.957 -16.849 1.00 1.00 H new ATOM 0 HD13 ILE A 85 87.774 -12.691 -15.623 1.00 1.00 H new ATOM 1283 N ALA A 86 85.046 -11.138 -11.449 1.00 1.00 N ATOM 1284 CA ALA A 86 84.900 -9.965 -10.592 1.00 1.00 C ATOM 1285 C ALA A 86 85.690 -10.166 -9.307 1.00 1.00 C ATOM 1286 O ALA A 86 86.070 -9.214 -8.632 1.00 1.00 O ATOM 1287 CB ALA A 86 83.430 -9.747 -10.243 1.00 1.00 C ATOM 0 H ALA A 86 84.374 -11.884 -11.268 1.00 1.00 H new ATOM 0 HA ALA A 86 85.278 -9.093 -11.126 1.00 1.00 H new ATOM 0 HB1 ALA A 86 83.334 -8.869 -9.604 1.00 1.00 H new ATOM 0 HB2 ALA A 86 82.858 -9.594 -11.158 1.00 1.00 H new ATOM 0 HB3 ALA A 86 83.047 -10.622 -9.718 1.00 1.00 H new ATOM 1293 N GLU A 87 85.914 -11.419 -8.959 1.00 1.00 N ATOM 1294 CA GLU A 87 86.642 -11.720 -7.736 1.00 1.00 C ATOM 1295 C GLU A 87 88.085 -11.193 -7.825 1.00 1.00 C ATOM 1296 O GLU A 87 88.991 -11.687 -7.158 1.00 1.00 O ATOM 1297 CB GLU A 87 86.628 -13.225 -7.442 1.00 1.00 C ATOM 1298 CG GLU A 87 86.891 -13.452 -5.951 1.00 1.00 C ATOM 1299 CD GLU A 87 86.870 -14.940 -5.636 1.00 1.00 C ATOM 1300 OE1 GLU A 87 87.511 -15.685 -6.353 1.00 1.00 O ATOM 1301 OE2 GLU A 87 86.210 -15.311 -4.678 1.00 1.00 O ATOM 0 H GLU A 87 85.610 -12.233 -9.493 1.00 1.00 H new ATOM 0 HA GLU A 87 86.141 -11.215 -6.910 1.00 1.00 H new ATOM 0 HB2 GLU A 87 85.666 -13.653 -7.722 1.00 1.00 H new ATOM 0 HB3 GLU A 87 87.388 -13.731 -8.038 1.00 1.00 H new ATOM 0 HG2 GLU A 87 87.857 -13.028 -5.676 1.00 1.00 H new ATOM 0 HG3 GLU A 87 86.136 -12.936 -5.358 1.00 1.00 H new ATOM 1308 N ALA A 88 88.292 -10.153 -8.650 1.00 1.00 N ATOM 1309 CA ALA A 88 89.615 -9.525 -8.820 1.00 1.00 C ATOM 1310 C ALA A 88 89.492 -8.041 -8.494 1.00 1.00 C ATOM 1311 O ALA A 88 90.471 -7.311 -8.394 1.00 1.00 O ATOM 1312 CB ALA A 88 90.089 -9.695 -10.260 1.00 1.00 C ATOM 0 H ALA A 88 87.556 -9.727 -9.213 1.00 1.00 H new ATOM 0 HA ALA A 88 90.338 -9.997 -8.154 1.00 1.00 H new ATOM 0 HB1 ALA A 88 91.067 -9.229 -10.379 1.00 1.00 H new ATOM 0 HB2 ALA A 88 90.162 -10.757 -10.496 1.00 1.00 H new ATOM 0 HB3 ALA A 88 89.377 -9.221 -10.936 1.00 1.00 H new ATOM 1318 N VAL A 89 88.231 -7.659 -8.298 1.00 1.00 N ATOM 1319 CA VAL A 89 87.890 -6.287 -7.940 1.00 1.00 C ATOM 1320 C VAL A 89 88.025 -6.116 -6.443 1.00 1.00 C ATOM 1321 O VAL A 89 87.239 -5.410 -5.840 1.00 1.00 O ATOM 1322 CB VAL A 89 86.495 -5.852 -8.425 1.00 1.00 C ATOM 1323 CG1 VAL A 89 86.448 -4.306 -8.489 1.00 1.00 C ATOM 1324 CG2 VAL A 89 86.194 -6.421 -9.829 1.00 1.00 C ATOM 0 H VAL A 89 87.429 -8.283 -8.382 1.00 1.00 H new ATOM 0 HA VAL A 89 88.591 -5.631 -8.456 1.00 1.00 H new ATOM 0 HB VAL A 89 85.748 -6.233 -7.728 1.00 1.00 H new ATOM 0 HG11 VAL A 89 85.464 -3.986 -8.832 1.00 1.00 H new ATOM 0 HG12 VAL A 89 86.639 -3.895 -7.498 1.00 1.00 H new ATOM 0 HG13 VAL A 89 87.208 -3.947 -9.183 1.00 1.00 H new ATOM 0 HG21 VAL A 89 85.203 -6.099 -10.147 1.00 1.00 H new ATOM 0 HG22 VAL A 89 86.939 -6.057 -10.537 1.00 1.00 H new ATOM 0 HG23 VAL A 89 86.228 -7.510 -9.795 1.00 1.00 H new ATOM 1334 N GLY A 90 89.023 -6.756 -5.808 1.00 1.00 N ATOM 1335 CA GLY A 90 89.195 -6.613 -4.376 1.00 1.00 C ATOM 1336 C GLY A 90 89.778 -5.244 -4.018 1.00 1.00 C ATOM 1337 O GLY A 90 89.362 -4.640 -3.039 1.00 1.00 O ATOM 0 H GLY A 90 89.704 -7.363 -6.265 1.00 1.00 H new ATOM 0 HA2 GLY A 90 88.234 -6.743 -3.878 1.00 1.00 H new ATOM 0 HA3 GLY A 90 89.854 -7.399 -4.007 1.00 1.00 H new ATOM 1341 N PRO A 91 90.739 -4.725 -4.770 1.00 1.00 N ATOM 1342 CA PRO A 91 91.347 -3.393 -4.459 1.00 1.00 C ATOM 1343 C PRO A 91 90.260 -2.407 -4.092 1.00 1.00 C ATOM 1344 O PRO A 91 90.486 -1.395 -3.430 1.00 1.00 O ATOM 1345 CB PRO A 91 92.067 -3.020 -5.751 1.00 1.00 C ATOM 1346 CG PRO A 91 92.467 -4.335 -6.341 1.00 1.00 C ATOM 1347 CD PRO A 91 91.354 -5.331 -5.967 1.00 1.00 C ATOM 0 HA PRO A 91 92.030 -3.400 -3.609 1.00 1.00 H new ATOM 0 HB2 PRO A 91 91.415 -2.463 -6.424 1.00 1.00 H new ATOM 0 HB3 PRO A 91 92.935 -2.391 -5.556 1.00 1.00 H new ATOM 0 HG2 PRO A 91 92.574 -4.260 -7.423 1.00 1.00 H new ATOM 0 HG3 PRO A 91 93.430 -4.661 -5.947 1.00 1.00 H new ATOM 0 HD2 PRO A 91 90.631 -5.447 -6.775 1.00 1.00 H new ATOM 0 HD3 PRO A 91 91.756 -6.321 -5.754 1.00 1.00 H new ATOM 1355 N HIS A 92 89.060 -2.730 -4.535 1.00 1.00 N ATOM 1356 CA HIS A 92 87.930 -1.880 -4.256 1.00 1.00 C ATOM 1357 C HIS A 92 87.862 -1.705 -2.749 1.00 1.00 C ATOM 1358 O HIS A 92 87.251 -0.795 -2.275 1.00 1.00 O ATOM 1359 CB HIS A 92 86.629 -2.518 -4.787 1.00 1.00 C ATOM 1360 CG HIS A 92 85.759 -1.507 -5.479 1.00 1.00 C ATOM 1361 ND1 HIS A 92 85.861 -0.150 -5.236 1.00 1.00 N ATOM 1362 CD2 HIS A 92 84.783 -1.651 -6.431 1.00 1.00 C ATOM 1363 CE1 HIS A 92 84.970 0.469 -6.032 1.00 1.00 C ATOM 1364 NE2 HIS A 92 84.288 -0.401 -6.782 1.00 1.00 N ATOM 0 H HIS A 92 88.849 -3.565 -5.082 1.00 1.00 H new ATOM 0 HA HIS A 92 88.043 -0.915 -4.750 1.00 1.00 H new ATOM 0 HB2 HIS A 92 86.874 -3.323 -5.480 1.00 1.00 H new ATOM 0 HB3 HIS A 92 86.079 -2.966 -3.960 1.00 1.00 H new ATOM 0 HD2 HIS A 92 84.450 -2.591 -6.845 1.00 1.00 H new ATOM 0 HE1 HIS A 92 84.824 1.539 -6.061 1.00 1.00 H new ATOM 0 HE2 HIS A 92 83.560 -0.192 -7.466 1.00 1.00 H new ATOM 1372 N LEU A 93 88.512 -2.576 -1.988 1.00 1.00 N ATOM 1373 CA LEU A 93 88.497 -2.423 -0.534 1.00 1.00 C ATOM 1374 C LEU A 93 88.900 -0.977 -0.186 1.00 1.00 C ATOM 1375 O LEU A 93 88.203 -0.272 0.540 1.00 1.00 O ATOM 1376 CB LEU A 93 89.427 -3.468 0.122 1.00 1.00 C ATOM 1377 CG LEU A 93 90.876 -3.380 -0.441 1.00 1.00 C ATOM 1378 CD1 LEU A 93 91.772 -2.528 0.485 1.00 1.00 C ATOM 1379 CD2 LEU A 93 91.481 -4.795 -0.568 1.00 1.00 C ATOM 0 H LEU A 93 89.042 -3.374 -2.337 1.00 1.00 H new ATOM 0 HA LEU A 93 87.497 -2.603 -0.140 1.00 1.00 H new ATOM 0 HB2 LEU A 93 89.445 -3.313 1.201 1.00 1.00 H new ATOM 0 HB3 LEU A 93 89.029 -4.468 -0.050 1.00 1.00 H new ATOM 0 HG LEU A 93 90.830 -2.909 -1.423 1.00 1.00 H new ATOM 0 HD11 LEU A 93 92.780 -2.480 0.073 1.00 1.00 H new ATOM 0 HD12 LEU A 93 91.363 -1.521 0.561 1.00 1.00 H new ATOM 0 HD13 LEU A 93 91.807 -2.981 1.476 1.00 1.00 H new ATOM 0 HD21 LEU A 93 92.495 -4.723 -0.963 1.00 1.00 H new ATOM 0 HD22 LEU A 93 91.506 -5.269 0.413 1.00 1.00 H new ATOM 0 HD23 LEU A 93 90.870 -5.393 -1.244 1.00 1.00 H new ATOM 1391 N ALA A 94 90.042 -0.584 -0.717 1.00 1.00 N ATOM 1392 CA ALA A 94 90.582 0.756 -0.476 1.00 1.00 C ATOM 1393 C ALA A 94 89.501 1.796 -0.803 1.00 1.00 C ATOM 1394 O ALA A 94 89.280 2.734 -0.043 1.00 1.00 O ATOM 1395 CB ALA A 94 91.847 0.987 -1.318 1.00 1.00 C ATOM 0 H ALA A 94 90.620 -1.169 -1.320 1.00 1.00 H new ATOM 0 HA ALA A 94 90.865 0.855 0.572 1.00 1.00 H new ATOM 0 HB1 ALA A 94 92.234 1.988 -1.126 1.00 1.00 H new ATOM 0 HB2 ALA A 94 92.602 0.248 -1.050 1.00 1.00 H new ATOM 0 HB3 ALA A 94 91.603 0.889 -2.376 1.00 1.00 H new ATOM 1401 N ARG A 95 88.831 1.601 -1.931 1.00 1.00 N ATOM 1402 CA ARG A 95 87.739 2.497 -2.371 1.00 1.00 C ATOM 1403 C ARG A 95 86.451 2.161 -1.571 1.00 1.00 C ATOM 1404 O ARG A 95 85.829 2.936 -0.846 1.00 1.00 O ATOM 1405 CB ARG A 95 87.531 2.266 -3.893 1.00 1.00 C ATOM 1406 CG ARG A 95 87.902 3.527 -4.690 1.00 1.00 C ATOM 1407 CD ARG A 95 86.944 4.675 -4.335 1.00 1.00 C ATOM 1408 NE ARG A 95 87.595 5.591 -3.409 1.00 1.00 N ATOM 1409 CZ ARG A 95 86.930 6.602 -2.863 1.00 1.00 C ATOM 1410 NH1 ARG A 95 85.672 6.785 -3.155 1.00 1.00 N ATOM 1411 NH2 ARG A 95 87.535 7.412 -2.038 1.00 1.00 N ATOM 0 H ARG A 95 89.017 0.828 -2.570 1.00 1.00 H new ATOM 0 HA ARG A 95 87.982 3.544 -2.191 1.00 1.00 H new ATOM 0 HB2 ARG A 95 88.142 1.427 -4.225 1.00 1.00 H new ATOM 0 HB3 ARG A 95 86.492 2.000 -4.087 1.00 1.00 H new ATOM 0 HG2 ARG A 95 88.929 3.818 -4.469 1.00 1.00 H new ATOM 0 HG3 ARG A 95 87.853 3.319 -5.759 1.00 1.00 H new ATOM 0 HD2 ARG A 95 86.648 5.207 -5.239 1.00 1.00 H new ATOM 0 HD3 ARG A 95 86.034 4.276 -3.887 1.00 1.00 H new ATOM 0 HE ARG A 95 88.578 5.454 -3.176 1.00 1.00 H new ATOM 0 HH11 ARG A 95 85.201 6.152 -3.802 1.00 1.00 H new ATOM 0 HH12 ARG A 95 85.159 7.561 -2.737 1.00 1.00 H new ATOM 0 HH21 ARG A 95 88.519 7.269 -1.812 1.00 1.00 H new ATOM 0 HH22 ARG A 95 87.024 8.189 -1.619 1.00 1.00 H new ATOM 1425 N ALA A 96 86.181 0.931 -1.571 1.00 1.00 N ATOM 1426 CA ALA A 96 85.146 0.319 -0.807 1.00 1.00 C ATOM 1427 C ALA A 96 85.550 0.410 0.653 1.00 1.00 C ATOM 1428 O ALA A 96 85.143 -0.420 1.439 1.00 1.00 O ATOM 1429 CB ALA A 96 84.859 -1.114 -1.265 1.00 1.00 C ATOM 0 H ALA A 96 86.702 0.261 -2.137 1.00 1.00 H new ATOM 0 HA ALA A 96 84.201 0.842 -0.956 1.00 1.00 H new ATOM 0 HB1 ALA A 96 84.063 -1.539 -0.653 1.00 1.00 H new ATOM 0 HB2 ALA A 96 84.549 -1.107 -2.310 1.00 1.00 H new ATOM 0 HB3 ALA A 96 85.760 -1.718 -1.158 1.00 1.00 H new ATOM 1435 N LEU A 97 86.346 1.428 1.049 1.00 1.00 N ATOM 1436 CA LEU A 97 86.728 1.563 2.442 1.00 1.00 C ATOM 1437 C LEU A 97 85.505 1.320 3.313 1.00 1.00 C ATOM 1438 O LEU A 97 85.589 0.637 4.298 1.00 1.00 O ATOM 1439 CB LEU A 97 87.385 2.957 2.678 1.00 1.00 C ATOM 1440 CG LEU A 97 86.390 4.159 2.857 1.00 1.00 C ATOM 1441 CD1 LEU A 97 85.382 4.264 1.687 1.00 1.00 C ATOM 1442 CD2 LEU A 97 85.662 4.087 4.226 1.00 1.00 C ATOM 0 H LEU A 97 86.721 2.145 0.428 1.00 1.00 H new ATOM 0 HA LEU A 97 87.477 0.820 2.716 1.00 1.00 H new ATOM 0 HB2 LEU A 97 88.015 2.896 3.566 1.00 1.00 H new ATOM 0 HB3 LEU A 97 88.042 3.176 1.836 1.00 1.00 H new ATOM 0 HG LEU A 97 86.987 5.071 2.842 1.00 1.00 H new ATOM 0 HD11 LEU A 97 84.715 5.110 1.856 1.00 1.00 H new ATOM 0 HD12 LEU A 97 85.923 4.410 0.752 1.00 1.00 H new ATOM 0 HD13 LEU A 97 84.796 3.347 1.628 1.00 1.00 H new ATOM 0 HD21 LEU A 97 84.980 4.932 4.320 1.00 1.00 H new ATOM 0 HD22 LEU A 97 85.098 3.157 4.289 1.00 1.00 H new ATOM 0 HD23 LEU A 97 86.396 4.121 5.031 1.00 1.00 H new ATOM 1454 N GLY A 98 84.387 1.917 2.980 1.00 1.00 N ATOM 1455 CA GLY A 98 83.168 1.744 3.758 1.00 1.00 C ATOM 1456 C GLY A 98 82.966 0.274 3.976 1.00 1.00 C ATOM 1457 O GLY A 98 82.417 -0.153 4.994 1.00 1.00 O ATOM 0 H GLY A 98 84.288 2.532 2.172 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.247 2.264 4.713 1.00 1.00 H new ATOM 0 HA3 GLY A 98 82.315 2.173 3.232 1.00 1.00 H new ATOM 1461 N GLN A 99 83.475 -0.517 3.030 1.00 1.00 N ATOM 1462 CA GLN A 99 83.378 -1.960 3.212 1.00 1.00 C ATOM 1463 C GLN A 99 84.106 -2.287 4.507 1.00 1.00 C ATOM 1464 O GLN A 99 83.867 -3.297 5.140 1.00 1.00 O ATOM 1465 CB GLN A 99 83.985 -2.756 2.036 1.00 1.00 C ATOM 1466 CG GLN A 99 85.506 -2.951 2.219 1.00 1.00 C ATOM 1467 CD GLN A 99 85.805 -4.162 3.094 1.00 1.00 C ATOM 1468 OE1 GLN A 99 86.168 -4.007 4.260 1.00 1.00 O ATOM 1469 NE2 GLN A 99 85.690 -5.362 2.598 1.00 1.00 N ATOM 0 H GLN A 99 83.934 -0.203 2.175 1.00 1.00 H new ATOM 0 HA GLN A 99 82.328 -2.250 3.251 1.00 1.00 H new ATOM 0 HB2 GLN A 99 83.498 -3.728 1.961 1.00 1.00 H new ATOM 0 HB3 GLN A 99 83.793 -2.231 1.100 1.00 1.00 H new ATOM 0 HG2 GLN A 99 85.979 -3.077 1.245 1.00 1.00 H new ATOM 0 HG3 GLN A 99 85.938 -2.058 2.670 1.00 1.00 H new ATOM 0 HE21 GLN A 99 85.389 -5.488 1.632 1.00 1.00 H new ATOM 0 HE22 GLN A 99 85.901 -6.175 3.176 1.00 1.00 H new ATOM 1478 N ILE A 100 84.995 -1.394 4.897 1.00 1.00 N ATOM 1479 CA ILE A 100 85.742 -1.572 6.135 1.00 1.00 C ATOM 1480 C ILE A 100 84.810 -1.455 7.326 1.00 1.00 C ATOM 1481 O ILE A 100 84.803 -2.307 8.181 1.00 1.00 O ATOM 1482 CB ILE A 100 86.850 -0.515 6.296 1.00 1.00 C ATOM 1483 CG1 ILE A 100 87.888 -0.656 5.165 1.00 1.00 C ATOM 1484 CG2 ILE A 100 87.529 -0.689 7.663 1.00 1.00 C ATOM 1485 CD1 ILE A 100 88.917 -1.748 5.501 1.00 1.00 C ATOM 0 H ILE A 100 85.219 -0.543 4.382 1.00 1.00 H new ATOM 0 HA ILE A 100 86.197 -2.561 6.090 1.00 1.00 H new ATOM 0 HB ILE A 100 86.408 0.480 6.238 1.00 1.00 H new ATOM 0 HG12 ILE A 100 87.383 -0.901 4.231 1.00 1.00 H new ATOM 0 HG13 ILE A 100 88.397 0.295 5.012 1.00 1.00 H new ATOM 0 HG21 ILE A 100 88.313 0.059 7.777 1.00 1.00 H new ATOM 0 HG22 ILE A 100 86.790 -0.564 8.455 1.00 1.00 H new ATOM 0 HG23 ILE A 100 87.966 -1.686 7.728 1.00 1.00 H new ATOM 0 HD11 ILE A 100 89.639 -1.830 4.689 1.00 1.00 H new ATOM 0 HD12 ILE A 100 89.436 -1.487 6.423 1.00 1.00 H new ATOM 0 HD13 ILE A 100 88.406 -2.702 5.629 1.00 1.00 H new ATOM 1497 N VAL A 101 84.027 -0.388 7.395 1.00 1.00 N ATOM 1498 CA VAL A 101 83.142 -0.227 8.553 1.00 1.00 C ATOM 1499 C VAL A 101 82.291 -1.481 8.752 1.00 1.00 C ATOM 1500 O VAL A 101 82.329 -2.096 9.797 1.00 1.00 O ATOM 1501 CB VAL A 101 82.255 1.055 8.377 1.00 1.00 C ATOM 1502 CG1 VAL A 101 80.780 0.746 8.020 1.00 1.00 C ATOM 1503 CG2 VAL A 101 82.257 1.895 9.665 1.00 1.00 C ATOM 0 H VAL A 101 83.980 0.355 6.697 1.00 1.00 H new ATOM 0 HA VAL A 101 83.746 -0.095 9.451 1.00 1.00 H new ATOM 0 HB VAL A 101 82.701 1.599 7.545 1.00 1.00 H new ATOM 0 HG11 VAL A 101 80.228 1.680 7.914 1.00 1.00 H new ATOM 0 HG12 VAL A 101 80.741 0.193 7.082 1.00 1.00 H new ATOM 0 HG13 VAL A 101 80.331 0.147 8.813 1.00 1.00 H new ATOM 0 HG21 VAL A 101 81.636 2.780 9.523 1.00 1.00 H new ATOM 0 HG22 VAL A 101 81.859 1.301 10.488 1.00 1.00 H new ATOM 0 HG23 VAL A 101 83.277 2.201 9.898 1.00 1.00 H new ATOM 1513 N CYS A 102 81.478 -1.824 7.776 1.00 1.00 N ATOM 1514 CA CYS A 102 80.610 -2.967 7.957 1.00 1.00 C ATOM 1515 C CYS A 102 81.433 -4.197 8.304 1.00 1.00 C ATOM 1516 O CYS A 102 80.926 -5.114 8.930 1.00 1.00 O ATOM 1517 CB CYS A 102 79.718 -3.232 6.724 1.00 1.00 C ATOM 1518 SG CYS A 102 80.613 -2.900 5.189 1.00 1.00 S ATOM 0 H CYS A 102 81.399 -1.347 6.878 1.00 1.00 H new ATOM 0 HA CYS A 102 79.938 -2.740 8.785 1.00 1.00 H new ATOM 0 HB2 CYS A 102 79.378 -4.267 6.733 1.00 1.00 H new ATOM 0 HB3 CYS A 102 78.829 -2.604 6.773 1.00 1.00 H new ATOM 1523 N ARG A 103 82.716 -4.150 7.946 1.00 1.00 N ATOM 1524 CA ARG A 103 83.652 -5.260 8.236 1.00 1.00 C ATOM 1525 C ARG A 103 84.245 -5.171 9.649 1.00 1.00 C ATOM 1526 O ARG A 103 84.161 -6.104 10.446 1.00 1.00 O ATOM 1527 CB ARG A 103 84.786 -5.264 7.185 1.00 1.00 C ATOM 1528 CG ARG A 103 85.721 -6.481 7.384 1.00 1.00 C ATOM 1529 CD ARG A 103 86.930 -6.148 8.300 1.00 1.00 C ATOM 1530 NE ARG A 103 88.174 -6.531 7.638 1.00 1.00 N ATOM 1531 CZ ARG A 103 88.550 -7.804 7.548 1.00 1.00 C ATOM 1532 NH1 ARG A 103 87.802 -8.748 8.044 1.00 1.00 N ATOM 1533 NH2 ARG A 103 89.670 -8.105 6.956 1.00 1.00 N ATOM 0 H ARG A 103 83.139 -3.362 7.456 1.00 1.00 H new ATOM 0 HA ARG A 103 83.088 -6.191 8.184 1.00 1.00 H new ATOM 0 HB2 ARG A 103 84.358 -5.290 6.183 1.00 1.00 H new ATOM 0 HB3 ARG A 103 85.362 -4.342 7.262 1.00 1.00 H new ATOM 0 HG2 ARG A 103 85.155 -7.305 7.818 1.00 1.00 H new ATOM 0 HG3 ARG A 103 86.085 -6.820 6.414 1.00 1.00 H new ATOM 0 HD2 ARG A 103 86.942 -5.082 8.528 1.00 1.00 H new ATOM 0 HD3 ARG A 103 86.835 -6.676 9.249 1.00 1.00 H new ATOM 0 HE ARG A 103 88.768 -5.806 7.235 1.00 1.00 H new ATOM 0 HH11 ARG A 103 86.923 -8.513 8.504 1.00 1.00 H new ATOM 0 HH12 ARG A 103 88.096 -9.722 7.972 1.00 1.00 H new ATOM 0 HH21 ARG A 103 90.254 -7.366 6.564 1.00 1.00 H new ATOM 0 HH22 ARG A 103 89.963 -9.079 6.884 1.00 1.00 H new ATOM 1547 N TYR A 104 84.813 -4.022 9.913 1.00 1.00 N ATOM 1548 CA TYR A 104 85.431 -3.635 11.165 1.00 1.00 C ATOM 1549 C TYR A 104 84.426 -2.851 11.982 1.00 1.00 C ATOM 1550 O TYR A 104 84.800 -2.104 12.888 1.00 1.00 O ATOM 1551 CB TYR A 104 86.715 -2.830 10.950 1.00 1.00 C ATOM 1552 CG TYR A 104 87.544 -2.893 12.221 1.00 1.00 C ATOM 1553 CD1 TYR A 104 88.172 -4.096 12.583 1.00 1.00 C ATOM 1554 CD2 TYR A 104 87.671 -1.767 13.042 1.00 1.00 C ATOM 1555 CE1 TYR A 104 88.928 -4.165 13.759 1.00 1.00 C ATOM 1556 CE2 TYR A 104 88.427 -1.839 14.220 1.00 1.00 C ATOM 1557 CZ TYR A 104 89.057 -3.037 14.577 1.00 1.00 C ATOM 1558 OH TYR A 104 89.803 -3.106 15.736 1.00 1.00 O ATOM 0 H TYR A 104 84.862 -3.280 9.215 1.00 1.00 H new ATOM 0 HA TYR A 104 85.723 -4.536 11.704 1.00 1.00 H new ATOM 0 HB2 TYR A 104 87.279 -3.235 10.110 1.00 1.00 H new ATOM 0 HB3 TYR A 104 86.476 -1.795 10.705 1.00 1.00 H new ATOM 0 HD1 TYR A 104 88.072 -4.968 11.954 1.00 1.00 H new ATOM 0 HD2 TYR A 104 87.186 -0.842 12.768 1.00 1.00 H new ATOM 0 HE1 TYR A 104 89.412 -5.090 14.035 1.00 1.00 H new ATOM 0 HE2 TYR A 104 88.524 -0.969 14.853 1.00 1.00 H new ATOM 0 HH TYR A 104 89.790 -2.235 16.185 1.00 1.00 H new ATOM 1568 N GLY A 105 83.139 -3.026 11.674 1.00 1.00 N ATOM 1569 CA GLY A 105 82.074 -2.351 12.396 1.00 1.00 C ATOM 1570 C GLY A 105 80.820 -3.204 12.284 1.00 1.00 C ATOM 1571 O GLY A 105 80.626 -4.141 13.062 1.00 1.00 O ATOM 0 H GLY A 105 82.814 -3.635 10.923 1.00 1.00 H new ATOM 0 HA2 GLY A 105 82.350 -2.213 13.442 1.00 1.00 H new ATOM 0 HA3 GLY A 105 81.899 -1.359 11.979 1.00 1.00 H new ATOM 1575 N ALA A 106 79.957 -2.867 11.322 1.00 1.00 N ATOM 1576 CA ALA A 106 78.708 -3.586 11.120 1.00 1.00 C ATOM 1577 C ALA A 106 77.743 -3.375 12.303 1.00 1.00 C ATOM 1578 O ALA A 106 77.965 -3.926 13.383 1.00 1.00 O ATOM 1579 CB ALA A 106 79.016 -5.090 10.910 1.00 1.00 C ATOM 0 H ALA A 106 80.107 -2.096 10.671 1.00 1.00 H new ATOM 0 HA ALA A 106 78.212 -3.195 10.232 1.00 1.00 H new ATOM 0 HB1 ALA A 106 78.084 -5.634 10.758 1.00 1.00 H new ATOM 0 HB2 ALA A 106 79.654 -5.212 10.035 1.00 1.00 H new ATOM 0 HB3 ALA A 106 79.527 -5.483 11.789 1.00 1.00 H new ATOM 1585 N THR A 107 76.644 -2.616 12.088 1.00 1.00 N ATOM 1586 CA THR A 107 75.616 -2.395 13.115 1.00 1.00 C ATOM 1587 C THR A 107 74.269 -2.587 12.410 1.00 1.00 C ATOM 1588 O THR A 107 73.497 -3.476 12.754 1.00 1.00 O ATOM 1589 CB THR A 107 75.701 -0.981 13.718 1.00 1.00 C ATOM 1590 OG1 THR A 107 74.387 -0.485 13.943 1.00 1.00 O ATOM 1591 CG2 THR A 107 76.441 -0.041 12.766 1.00 1.00 C ATOM 0 H THR A 107 76.451 -2.146 11.204 1.00 1.00 H new ATOM 0 HA THR A 107 75.750 -3.090 13.944 1.00 1.00 H new ATOM 0 HB THR A 107 76.246 -1.031 14.661 1.00 1.00 H new ATOM 0 HG1 THR A 107 74.438 0.415 14.328 1.00 1.00 H new ATOM 0 HG21 THR A 107 76.493 0.955 13.206 1.00 1.00 H new ATOM 0 HG22 THR A 107 77.450 -0.416 12.596 1.00 1.00 H new ATOM 0 HG23 THR A 107 75.908 0.009 11.817 1.00 1.00 H new ATOM 1599 N VAL A 108 73.963 -1.737 11.442 1.00 1.00 N ATOM 1600 CA VAL A 108 72.707 -1.867 10.730 1.00 1.00 C ATOM 1601 C VAL A 108 72.719 -3.150 9.911 1.00 1.00 C ATOM 1602 O VAL A 108 71.933 -3.296 8.977 1.00 1.00 O ATOM 1603 CB VAL A 108 72.488 -0.681 9.788 1.00 1.00 C ATOM 1604 CG1 VAL A 108 72.370 0.612 10.597 1.00 1.00 C ATOM 1605 CG2 VAL A 108 73.662 -0.570 8.810 1.00 1.00 C ATOM 0 H VAL A 108 74.556 -0.965 11.138 1.00 1.00 H new ATOM 0 HA VAL A 108 71.899 -1.891 11.462 1.00 1.00 H new ATOM 0 HB VAL A 108 71.566 -0.839 9.228 1.00 1.00 H new ATOM 0 HG11 VAL A 108 72.214 1.452 9.920 1.00 1.00 H new ATOM 0 HG12 VAL A 108 71.526 0.537 11.282 1.00 1.00 H new ATOM 0 HG13 VAL A 108 73.286 0.770 11.166 1.00 1.00 H new ATOM 0 HG21 VAL A 108 73.500 0.276 8.142 1.00 1.00 H new ATOM 0 HG22 VAL A 108 74.587 -0.421 9.367 1.00 1.00 H new ATOM 0 HG23 VAL A 108 73.735 -1.486 8.224 1.00 1.00 H new ATOM 1615 N ILE A 109 73.549 -4.125 10.318 1.00 1.00 N ATOM 1616 CA ILE A 109 73.600 -5.440 9.683 1.00 1.00 C ATOM 1617 C ILE A 109 73.138 -6.499 10.719 1.00 1.00 C ATOM 1618 O ILE A 109 72.175 -7.207 10.453 1.00 1.00 O ATOM 1619 CB ILE A 109 74.987 -5.734 9.010 1.00 1.00 C ATOM 1620 CG1 ILE A 109 75.454 -7.198 9.233 1.00 1.00 C ATOM 1621 CG2 ILE A 109 76.086 -4.758 9.479 1.00 1.00 C ATOM 1622 CD1 ILE A 109 76.880 -7.387 8.686 1.00 1.00 C ATOM 0 H ILE A 109 74.200 -4.018 11.096 1.00 1.00 H new ATOM 0 HA ILE A 109 72.910 -5.478 8.840 1.00 1.00 H new ATOM 0 HB ILE A 109 74.829 -5.584 7.942 1.00 1.00 H new ATOM 0 HG12 ILE A 109 75.429 -7.438 10.296 1.00 1.00 H new ATOM 0 HG13 ILE A 109 74.771 -7.886 8.735 1.00 1.00 H new ATOM 0 HG21 ILE A 109 77.026 -5.004 8.985 1.00 1.00 H new ATOM 0 HG22 ILE A 109 75.799 -3.738 9.226 1.00 1.00 H new ATOM 0 HG23 ILE A 109 76.211 -4.842 10.559 1.00 1.00 H new ATOM 0 HD11 ILE A 109 77.198 -8.417 8.847 1.00 1.00 H new ATOM 0 HD12 ILE A 109 76.892 -7.166 7.619 1.00 1.00 H new ATOM 0 HD13 ILE A 109 77.561 -6.712 9.204 1.00 1.00 H new ATOM 1634 N PRO A 110 73.777 -6.612 11.902 1.00 1.00 N ATOM 1635 CA PRO A 110 73.345 -7.582 12.970 1.00 1.00 C ATOM 1636 C PRO A 110 71.862 -7.415 13.335 1.00 1.00 C ATOM 1637 O PRO A 110 71.164 -8.397 13.598 1.00 1.00 O ATOM 1638 CB PRO A 110 74.259 -7.236 14.173 1.00 1.00 C ATOM 1639 CG PRO A 110 74.804 -5.883 13.874 1.00 1.00 C ATOM 1640 CD PRO A 110 74.966 -5.873 12.371 1.00 1.00 C ATOM 0 HA PRO A 110 73.439 -8.619 12.646 1.00 1.00 H new ATOM 0 HB2 PRO A 110 73.697 -7.236 15.107 1.00 1.00 H new ATOM 0 HB3 PRO A 110 75.060 -7.968 14.282 1.00 1.00 H new ATOM 0 HG2 PRO A 110 74.125 -5.098 14.207 1.00 1.00 H new ATOM 0 HG3 PRO A 110 75.756 -5.717 14.378 1.00 1.00 H new ATOM 0 HD2 PRO A 110 74.992 -4.858 11.975 1.00 1.00 H new ATOM 0 HD3 PRO A 110 75.891 -6.360 12.062 1.00 1.00 H new ATOM 1648 N ASN A 111 71.399 -6.169 13.395 1.00 1.00 N ATOM 1649 CA ASN A 111 70.009 -5.926 13.771 1.00 1.00 C ATOM 1650 C ASN A 111 69.062 -6.445 12.685 1.00 1.00 C ATOM 1651 O ASN A 111 68.322 -7.412 12.906 1.00 1.00 O ATOM 1652 CB ASN A 111 69.783 -4.431 13.989 1.00 1.00 C ATOM 1653 CG ASN A 111 68.319 -4.177 14.318 1.00 1.00 C ATOM 1654 OD1 ASN A 111 67.779 -4.768 15.253 1.00 1.00 O ATOM 1655 ND2 ASN A 111 67.639 -3.328 13.598 1.00 1.00 N ATOM 0 H ASN A 111 71.948 -5.333 13.194 1.00 1.00 H new ATOM 0 HA ASN A 111 69.800 -6.459 14.699 1.00 1.00 H new ATOM 0 HB2 ASN A 111 70.416 -4.072 14.801 1.00 1.00 H new ATOM 0 HB3 ASN A 111 70.066 -3.876 13.095 1.00 1.00 H new ATOM 0 HD21 ASN A 111 66.657 -3.152 13.809 1.00 1.00 H new ATOM 0 HD22 ASN A 111 68.090 -2.840 12.824 1.00 1.00 H new ATOM 1662 N ILE A 112 69.076 -5.813 11.513 1.00 1.00 N ATOM 1663 CA ILE A 112 68.204 -6.243 10.427 1.00 1.00 C ATOM 1664 C ILE A 112 68.413 -7.729 10.196 1.00 1.00 C ATOM 1665 O ILE A 112 67.578 -8.418 9.650 1.00 1.00 O ATOM 1666 CB ILE A 112 68.529 -5.436 9.154 1.00 1.00 C ATOM 1667 CG1 ILE A 112 69.861 -5.916 8.531 1.00 1.00 C ATOM 1668 CG2 ILE A 112 68.664 -3.948 9.519 1.00 1.00 C ATOM 1669 CD1 ILE A 112 69.665 -7.169 7.657 1.00 1.00 C ATOM 0 H ILE A 112 69.672 -5.014 11.295 1.00 1.00 H new ATOM 0 HA ILE A 112 67.160 -6.066 10.684 1.00 1.00 H new ATOM 0 HB ILE A 112 67.724 -5.582 8.434 1.00 1.00 H new ATOM 0 HG12 ILE A 112 70.289 -5.116 7.928 1.00 1.00 H new ATOM 0 HG13 ILE A 112 70.576 -6.135 9.325 1.00 1.00 H new ATOM 0 HG21 ILE A 112 68.894 -3.373 8.622 1.00 1.00 H new ATOM 0 HG22 ILE A 112 67.727 -3.592 9.948 1.00 1.00 H new ATOM 0 HG23 ILE A 112 69.467 -3.823 10.246 1.00 1.00 H new ATOM 0 HD11 ILE A 112 70.624 -7.474 7.238 1.00 1.00 H new ATOM 0 HD12 ILE A 112 69.261 -7.978 8.266 1.00 1.00 H new ATOM 0 HD13 ILE A 112 68.971 -6.943 6.848 1.00 1.00 H new ATOM 1681 N ASN A 113 69.565 -8.155 10.654 1.00 1.00 N ATOM 1682 CA ASN A 113 69.956 -9.568 10.524 1.00 1.00 C ATOM 1683 C ASN A 113 68.940 -10.429 11.264 1.00 1.00 C ATOM 1684 O ASN A 113 68.383 -11.350 10.671 1.00 1.00 O ATOM 1685 CB ASN A 113 71.401 -9.858 10.976 1.00 1.00 C ATOM 1686 CG ASN A 113 71.495 -11.109 11.862 1.00 1.00 C ATOM 1687 OD1 ASN A 113 71.069 -12.252 11.409 1.00 1.00 O flip ATOM 1688 ND2 ASN A 113 71.964 -11.027 12.999 1.00 1.00 N flip ATOM 0 H ASN A 113 70.253 -7.563 11.118 1.00 1.00 H new ATOM 0 HA ASN A 113 69.950 -9.821 9.464 1.00 1.00 H new ATOM 0 HB2 ASN A 113 72.034 -9.989 10.099 1.00 1.00 H new ATOM 0 HB3 ASN A 113 71.788 -8.998 11.523 1.00 1.00 H new ATOM 0 HD21 ASN A 113 72.297 -10.129 13.350 1.00 1.00 H new ATOM 0 HD22 ASN A 113 72.019 -11.857 13.589 1.00 1.00 H new ATOM 1695 N ALA A 114 68.657 -10.146 12.539 1.00 1.00 N ATOM 1696 CA ALA A 114 67.677 -10.946 13.258 1.00 1.00 C ATOM 1697 C ALA A 114 66.324 -10.924 12.565 1.00 1.00 C ATOM 1698 O ALA A 114 65.582 -11.903 12.635 1.00 1.00 O ATOM 1699 CB ALA A 114 67.514 -10.389 14.679 1.00 1.00 C ATOM 0 H ALA A 114 69.081 -9.390 13.077 1.00 1.00 H new ATOM 0 HA ALA A 114 68.035 -11.975 13.285 1.00 1.00 H new ATOM 0 HB1 ALA A 114 66.781 -10.985 15.222 1.00 1.00 H new ATOM 0 HB2 ALA A 114 68.471 -10.431 15.198 1.00 1.00 H new ATOM 0 HB3 ALA A 114 67.174 -9.355 14.628 1.00 1.00 H new ATOM 1705 N ALA A 115 66.002 -9.839 11.848 1.00 1.00 N ATOM 1706 CA ALA A 115 64.735 -9.792 11.119 1.00 1.00 C ATOM 1707 C ALA A 115 64.889 -10.549 9.797 1.00 1.00 C ATOM 1708 O ALA A 115 64.113 -11.435 9.483 1.00 1.00 O ATOM 1709 CB ALA A 115 64.312 -8.334 10.872 1.00 1.00 C ATOM 0 H ALA A 115 66.584 -9.006 11.760 1.00 1.00 H new ATOM 0 HA ALA A 115 63.954 -10.268 11.712 1.00 1.00 H new ATOM 0 HB1 ALA A 115 63.367 -8.316 10.328 1.00 1.00 H new ATOM 0 HB2 ALA A 115 64.191 -7.824 11.827 1.00 1.00 H new ATOM 0 HB3 ALA A 115 65.078 -7.827 10.285 1.00 1.00 H new ATOM 1715 N ILE A 116 65.937 -10.159 9.066 1.00 1.00 N ATOM 1716 CA ILE A 116 66.244 -10.783 7.762 1.00 1.00 C ATOM 1717 C ILE A 116 66.029 -12.289 7.964 1.00 1.00 C ATOM 1718 O ILE A 116 65.326 -12.977 7.230 1.00 1.00 O ATOM 1719 CB ILE A 116 67.683 -10.429 7.271 1.00 1.00 C ATOM 1720 CG1 ILE A 116 67.610 -9.893 5.824 1.00 1.00 C ATOM 1721 CG2 ILE A 116 68.642 -11.635 7.306 1.00 1.00 C ATOM 1722 CD1 ILE A 116 66.848 -8.549 5.784 1.00 1.00 C ATOM 0 H ILE A 116 66.585 -9.423 9.345 1.00 1.00 H new ATOM 0 HA ILE A 116 65.595 -10.407 6.971 1.00 1.00 H new ATOM 0 HB ILE A 116 68.077 -9.676 7.953 1.00 1.00 H new ATOM 0 HG12 ILE A 116 68.617 -9.759 5.428 1.00 1.00 H new ATOM 0 HG13 ILE A 116 67.110 -10.621 5.185 1.00 1.00 H new ATOM 0 HG21 ILE A 116 69.627 -11.327 6.954 1.00 1.00 H new ATOM 0 HG22 ILE A 116 68.722 -12.007 8.328 1.00 1.00 H new ATOM 0 HG23 ILE A 116 68.257 -12.425 6.662 1.00 1.00 H new ATOM 0 HD11 ILE A 116 66.806 -8.185 4.757 1.00 1.00 H new ATOM 0 HD12 ILE A 116 65.835 -8.694 6.160 1.00 1.00 H new ATOM 0 HD13 ILE A 116 67.365 -7.819 6.407 1.00 1.00 H new ATOM 1734 N GLU A 117 66.659 -12.703 9.038 1.00 1.00 N ATOM 1735 CA GLU A 117 66.591 -14.089 9.481 1.00 1.00 C ATOM 1736 C GLU A 117 65.120 -14.487 9.382 1.00 1.00 C ATOM 1737 O GLU A 117 64.768 -15.401 8.658 1.00 1.00 O ATOM 1738 CB GLU A 117 67.156 -14.307 10.890 1.00 1.00 C ATOM 1739 CG GLU A 117 68.682 -14.463 10.808 1.00 1.00 C ATOM 1740 CD GLU A 117 69.253 -14.824 12.174 1.00 1.00 C ATOM 1741 OE1 GLU A 117 68.468 -15.058 13.080 1.00 1.00 O ATOM 1742 OE2 GLU A 117 70.464 -14.882 12.288 1.00 1.00 O ATOM 0 H GLU A 117 67.230 -12.100 9.630 1.00 1.00 H new ATOM 0 HA GLU A 117 67.219 -14.718 8.851 1.00 1.00 H new ATOM 0 HB2 GLU A 117 66.899 -13.464 11.531 1.00 1.00 H new ATOM 0 HB3 GLU A 117 66.712 -15.196 11.339 1.00 1.00 H new ATOM 0 HG2 GLU A 117 68.936 -15.237 10.084 1.00 1.00 H new ATOM 0 HG3 GLU A 117 69.130 -13.535 10.453 1.00 1.00 H new ATOM 1749 N VAL A 118 64.256 -13.752 10.071 1.00 1.00 N ATOM 1750 CA VAL A 118 62.812 -14.031 10.005 1.00 1.00 C ATOM 1751 C VAL A 118 62.245 -13.703 8.599 1.00 1.00 C ATOM 1752 O VAL A 118 61.639 -14.562 7.968 1.00 1.00 O ATOM 1753 CB VAL A 118 62.068 -13.216 11.069 1.00 1.00 C ATOM 1754 CG1 VAL A 118 60.563 -13.535 11.047 1.00 1.00 C ATOM 1755 CG2 VAL A 118 62.633 -13.567 12.440 1.00 1.00 C ATOM 0 H VAL A 118 64.515 -12.971 10.673 1.00 1.00 H new ATOM 0 HA VAL A 118 62.664 -15.094 10.196 1.00 1.00 H new ATOM 0 HB VAL A 118 62.202 -12.155 10.860 1.00 1.00 H new ATOM 0 HG11 VAL A 118 60.055 -12.945 11.810 1.00 1.00 H new ATOM 0 HG12 VAL A 118 60.153 -13.290 10.067 1.00 1.00 H new ATOM 0 HG13 VAL A 118 60.413 -14.596 11.248 1.00 1.00 H new ATOM 0 HG21 VAL A 118 62.112 -12.993 13.206 1.00 1.00 H new ATOM 0 HG22 VAL A 118 62.496 -14.632 12.628 1.00 1.00 H new ATOM 0 HG23 VAL A 118 63.696 -13.327 12.468 1.00 1.00 H new ATOM 1765 N LEU A 119 62.411 -12.454 8.137 1.00 1.00 N ATOM 1766 CA LEU A 119 61.901 -12.003 6.840 1.00 1.00 C ATOM 1767 C LEU A 119 62.327 -12.895 5.662 1.00 1.00 C ATOM 1768 O LEU A 119 61.603 -12.947 4.666 1.00 1.00 O ATOM 1769 CB LEU A 119 62.325 -10.546 6.589 1.00 1.00 C ATOM 1770 CG LEU A 119 61.790 -10.035 5.239 1.00 1.00 C ATOM 1771 CD1 LEU A 119 60.262 -10.002 5.259 1.00 1.00 C ATOM 1772 CD2 LEU A 119 62.328 -8.622 4.979 1.00 1.00 C ATOM 0 H LEU A 119 62.905 -11.729 8.657 1.00 1.00 H new ATOM 0 HA LEU A 119 60.815 -12.075 6.893 1.00 1.00 H new ATOM 0 HB2 LEU A 119 61.953 -9.912 7.394 1.00 1.00 H new ATOM 0 HB3 LEU A 119 63.412 -10.473 6.603 1.00 1.00 H new ATOM 0 HG LEU A 119 62.121 -10.706 4.447 1.00 1.00 H new ATOM 0 HD11 LEU A 119 59.893 -9.639 4.300 1.00 1.00 H new ATOM 0 HD12 LEU A 119 59.879 -11.006 5.439 1.00 1.00 H new ATOM 0 HD13 LEU A 119 59.923 -9.337 6.053 1.00 1.00 H new ATOM 0 HD21 LEU A 119 61.950 -8.259 4.023 1.00 1.00 H new ATOM 0 HD22 LEU A 119 61.999 -7.955 5.776 1.00 1.00 H new ATOM 0 HD23 LEU A 119 63.417 -8.647 4.953 1.00 1.00 H new ATOM 1784 N GLY A 120 63.388 -13.708 5.797 1.00 1.00 N ATOM 1785 CA GLY A 120 63.718 -14.681 4.750 1.00 1.00 C ATOM 1786 C GLY A 120 63.839 -16.056 5.449 1.00 1.00 C ATOM 1787 O GLY A 120 62.970 -16.910 5.329 1.00 1.00 O ATOM 0 H GLY A 120 64.016 -13.711 6.601 1.00 1.00 H new ATOM 0 HA2 GLY A 120 62.944 -14.703 3.983 1.00 1.00 H new ATOM 0 HA3 GLY A 120 64.651 -14.415 4.254 1.00 1.00 H new ATOM 1791 N THR A 121 64.956 -16.172 6.164 1.00 1.00 N ATOM 1792 CA THR A 121 65.325 -17.387 6.952 1.00 1.00 C ATOM 1793 C THR A 121 66.811 -17.435 7.305 1.00 1.00 C ATOM 1794 O THR A 121 67.178 -17.801 8.422 1.00 1.00 O ATOM 1795 CB THR A 121 64.987 -18.674 6.165 1.00 1.00 C ATOM 1796 OG1 THR A 121 63.581 -18.855 6.111 1.00 1.00 O ATOM 1797 CG2 THR A 121 65.583 -19.918 6.852 1.00 1.00 C ATOM 0 H THR A 121 65.650 -15.427 6.225 1.00 1.00 H new ATOM 0 HA THR A 121 64.745 -17.329 7.873 1.00 1.00 H new ATOM 0 HB THR A 121 65.407 -18.562 5.166 1.00 1.00 H new ATOM 0 HG1 THR A 121 63.183 -18.161 5.545 1.00 1.00 H new ATOM 0 HG21 THR A 121 65.329 -20.808 6.276 1.00 1.00 H new ATOM 0 HG22 THR A 121 66.667 -19.819 6.908 1.00 1.00 H new ATOM 0 HG23 THR A 121 65.175 -20.008 7.859 1.00 1.00 H new ATOM 1805 N GLY A 122 67.661 -17.130 6.326 1.00 1.00 N ATOM 1806 CA GLY A 122 69.118 -17.221 6.505 1.00 1.00 C ATOM 1807 C GLY A 122 69.613 -18.467 5.776 1.00 1.00 C ATOM 1808 O GLY A 122 70.801 -18.630 5.527 1.00 1.00 O ATOM 0 H GLY A 122 67.371 -16.817 5.399 1.00 1.00 H new ATOM 0 HA2 GLY A 122 69.606 -16.330 6.109 1.00 1.00 H new ATOM 0 HA3 GLY A 122 69.368 -17.277 7.565 1.00 1.00 H new ATOM 1812 N THR A 123 68.632 -19.310 5.455 1.00 1.00 N ATOM 1813 CA THR A 123 68.924 -20.547 4.718 1.00 1.00 C ATOM 1814 C THR A 123 69.621 -20.078 3.436 1.00 1.00 C ATOM 1815 O THR A 123 69.019 -19.991 2.367 1.00 1.00 O ATOM 1816 CB THR A 123 67.646 -21.336 4.389 1.00 1.00 C ATOM 1817 OG1 THR A 123 67.998 -22.514 3.670 1.00 1.00 O ATOM 1818 CG2 THR A 123 66.694 -20.480 3.536 1.00 1.00 C ATOM 0 H THR A 123 67.649 -19.168 5.686 1.00 1.00 H new ATOM 0 HA THR A 123 69.540 -21.227 5.306 1.00 1.00 H new ATOM 0 HB THR A 123 67.141 -21.602 5.318 1.00 1.00 H new ATOM 0 HG1 THR A 123 67.187 -23.023 3.458 1.00 1.00 H new ATOM 0 HG21 THR A 123 65.794 -21.052 3.311 1.00 1.00 H new ATOM 0 HG22 THR A 123 66.423 -19.579 4.086 1.00 1.00 H new ATOM 0 HG23 THR A 123 67.189 -20.202 2.606 1.00 1.00 H new ATOM 1826 N ASP A 124 70.919 -19.813 3.603 1.00 1.00 N ATOM 1827 CA ASP A 124 71.795 -19.354 2.522 1.00 1.00 C ATOM 1828 C ASP A 124 73.263 -19.440 2.917 1.00 1.00 C ATOM 1829 O ASP A 124 73.598 -19.749 4.059 1.00 1.00 O ATOM 1830 CB ASP A 124 71.491 -17.894 2.179 1.00 1.00 C ATOM 1831 CG ASP A 124 70.026 -17.716 1.812 1.00 1.00 C ATOM 1832 OD1 ASP A 124 69.648 -18.157 0.740 1.00 1.00 O ATOM 1833 OD2 ASP A 124 69.305 -17.147 2.612 1.00 1.00 O ATOM 0 H ASP A 124 71.395 -19.912 4.499 1.00 1.00 H new ATOM 0 HA ASP A 124 71.609 -20.002 1.665 1.00 1.00 H new ATOM 0 HB2 ASP A 124 71.737 -17.258 3.029 1.00 1.00 H new ATOM 0 HB3 ASP A 124 72.120 -17.573 1.348 1.00 1.00 H new ATOM 1838 N TYR A 125 74.123 -19.073 1.977 1.00 1.00 N ATOM 1839 CA TYR A 125 75.560 -19.011 2.226 1.00 1.00 C ATOM 1840 C TYR A 125 76.122 -17.787 1.480 1.00 1.00 C ATOM 1841 O TYR A 125 75.681 -17.479 0.374 1.00 1.00 O ATOM 1842 CB TYR A 125 76.244 -20.327 1.777 1.00 1.00 C ATOM 1843 CG TYR A 125 77.155 -20.078 0.600 1.00 1.00 C ATOM 1844 CD1 TYR A 125 78.449 -19.598 0.819 1.00 1.00 C ATOM 1845 CD2 TYR A 125 76.696 -20.297 -0.700 1.00 1.00 C ATOM 1846 CE1 TYR A 125 79.289 -19.338 -0.265 1.00 1.00 C ATOM 1847 CE2 TYR A 125 77.536 -20.040 -1.787 1.00 1.00 C ATOM 1848 CZ TYR A 125 78.834 -19.558 -1.570 1.00 1.00 C ATOM 1849 OH TYR A 125 79.661 -19.300 -2.642 1.00 1.00 O ATOM 0 H TYR A 125 73.850 -18.812 1.029 1.00 1.00 H new ATOM 0 HA TYR A 125 75.761 -18.902 3.292 1.00 1.00 H new ATOM 0 HB2 TYR A 125 76.816 -20.746 2.604 1.00 1.00 H new ATOM 0 HB3 TYR A 125 75.487 -21.063 1.508 1.00 1.00 H new ATOM 0 HD1 TYR A 125 78.799 -19.428 1.827 1.00 1.00 H new ATOM 0 HD2 TYR A 125 75.694 -20.664 -0.865 1.00 1.00 H new ATOM 0 HE1 TYR A 125 80.289 -18.967 -0.097 1.00 1.00 H new ATOM 0 HE2 TYR A 125 77.185 -20.213 -2.794 1.00 1.00 H new ATOM 0 HH TYR A 125 79.190 -19.508 -3.476 1.00 1.00 H new ATOM 1859 N ARG A 126 77.095 -17.102 2.078 1.00 1.00 N ATOM 1860 CA ARG A 126 77.703 -15.932 1.446 1.00 1.00 C ATOM 1861 C ARG A 126 79.177 -15.830 1.840 1.00 1.00 C ATOM 1862 O ARG A 126 79.546 -16.171 2.964 1.00 1.00 O ATOM 1863 CB ARG A 126 76.967 -14.669 1.890 1.00 1.00 C ATOM 1864 CG ARG A 126 77.405 -13.453 1.032 1.00 1.00 C ATOM 1865 CD ARG A 126 76.381 -13.154 -0.074 1.00 1.00 C ATOM 1866 NE ARG A 126 76.531 -14.100 -1.169 1.00 1.00 N ATOM 1867 CZ ARG A 126 75.634 -14.164 -2.144 1.00 1.00 C ATOM 1868 NH1 ARG A 126 74.582 -13.395 -2.114 1.00 1.00 N ATOM 1869 NH2 ARG A 126 75.803 -14.996 -3.131 1.00 1.00 N ATOM 0 H ARG A 126 77.478 -17.335 2.994 1.00 1.00 H new ATOM 0 HA ARG A 126 77.630 -16.035 0.363 1.00 1.00 H new ATOM 0 HB2 ARG A 126 75.891 -14.817 1.798 1.00 1.00 H new ATOM 0 HB3 ARG A 126 77.173 -14.472 2.942 1.00 1.00 H new ATOM 0 HG2 ARG A 126 77.520 -12.577 1.670 1.00 1.00 H new ATOM 0 HG3 ARG A 126 78.379 -13.652 0.585 1.00 1.00 H new ATOM 0 HD2 ARG A 126 75.371 -13.213 0.331 1.00 1.00 H new ATOM 0 HD3 ARG A 126 76.519 -12.137 -0.441 1.00 1.00 H new ATOM 0 HE ARG A 126 77.338 -14.723 -1.187 1.00 1.00 H new ATOM 0 HH11 ARG A 126 74.448 -12.744 -1.341 1.00 1.00 H new ATOM 0 HH12 ARG A 126 73.892 -13.445 -2.864 1.00 1.00 H new ATOM 0 HH21 ARG A 126 76.625 -15.599 -3.155 1.00 1.00 H new ATOM 0 HH22 ARG A 126 75.113 -15.045 -3.881 1.00 1.00 H new ATOM 1883 N PHE A 127 80.015 -15.344 0.922 1.00 1.00 N ATOM 1884 CA PHE A 127 81.449 -15.189 1.188 1.00 1.00 C ATOM 1885 C PHE A 127 81.893 -13.775 0.796 1.00 1.00 C ATOM 1886 O PHE A 127 82.416 -13.081 1.654 1.00 1.00 O ATOM 1887 CB PHE A 127 82.234 -16.260 0.391 1.00 1.00 C ATOM 1888 CG PHE A 127 83.611 -15.756 0.015 1.00 1.00 C ATOM 1889 CD1 PHE A 127 84.668 -15.850 0.928 1.00 1.00 C ATOM 1890 CD2 PHE A 127 83.822 -15.188 -1.246 1.00 1.00 C ATOM 1891 CE1 PHE A 127 85.936 -15.375 0.577 1.00 1.00 C ATOM 1892 CE2 PHE A 127 85.090 -14.715 -1.598 1.00 1.00 C ATOM 1893 CZ PHE A 127 86.149 -14.808 -0.685 1.00 1.00 C ATOM 1894 OXT PHE A 127 81.710 -13.414 -0.354 1.00 1.00 O ATOM 0 H PHE A 127 79.727 -15.051 -0.012 1.00 1.00 H new ATOM 0 HA PHE A 127 81.651 -15.329 2.250 1.00 1.00 H new ATOM 0 HB2 PHE A 127 82.326 -17.168 0.988 1.00 1.00 H new ATOM 0 HB3 PHE A 127 81.681 -16.525 -0.510 1.00 1.00 H new ATOM 0 HD1 PHE A 127 84.505 -16.288 1.901 1.00 1.00 H new ATOM 0 HD2 PHE A 127 83.005 -15.115 -1.948 1.00 1.00 H new ATOM 0 HE1 PHE A 127 86.752 -15.446 1.281 1.00 1.00 H new ATOM 0 HE2 PHE A 127 85.253 -14.279 -2.572 1.00 1.00 H new ATOM 0 HZ PHE A 127 87.129 -14.442 -0.955 1.00 1.00 H new TER 1904 PHE A 127 HETATM 1905 O1 MTN A 128 66.153 4.074 -10.717 1.00 1.00 O HETATM 1906 N1 MTN A 128 66.308 4.111 -9.460 1.00 1.00 N HETATM 1907 C1 MTN A 128 66.599 2.913 -8.641 1.00 1.00 C HETATM 1908 C2 MTN A 128 66.681 3.530 -7.294 1.00 1.00 C HETATM 1909 C3 MTN A 128 66.476 4.830 -7.289 1.00 1.00 C HETATM 1910 C4 MTN A 128 66.496 5.688 -6.063 1.00 1.00 C HETATM 1911 S1 MTN A 128 66.179 4.782 -4.522 1.00 1.00 S HETATM 1912 C5 MTN A 128 66.209 5.382 -8.674 1.00 1.00 C HETATM 1913 C6 MTN A 128 64.870 6.106 -8.783 1.00 1.00 C HETATM 1914 C7 MTN A 128 67.356 6.301 -9.087 1.00 1.00 C HETATM 1915 C8 MTN A 128 65.487 1.867 -8.702 1.00 1.00 C HETATM 1916 C9 MTN A 128 67.940 2.319 -9.035 1.00 1.00 C HETATM 0 H93 MTN A 128 67.917 2.034 -10.087 1.00 1.00 H new HETATM 0 H92 MTN A 128 68.726 3.058 -8.877 1.00 1.00 H new HETATM 0 H91 MTN A 128 68.141 1.439 -8.425 1.00 1.00 H new HETATM 0 H83 MTN A 128 64.558 2.302 -8.335 1.00 1.00 H new HETATM 0 H82 MTN A 128 65.352 1.539 -9.733 1.00 1.00 H new HETATM 0 H81 MTN A 128 65.757 1.012 -8.082 1.00 1.00 H new HETATM 0 H73 MTN A 128 68.307 5.811 -8.881 1.00 1.00 H new HETATM 0 H72 MTN A 128 67.283 6.518 -10.153 1.00 1.00 H new HETATM 0 H71 MTN A 128 67.298 7.232 -8.523 1.00 1.00 H new HETATM 0 H63 MTN A 128 64.682 6.368 -9.824 1.00 1.00 H new HETATM 0 H62 MTN A 128 64.074 5.454 -8.423 1.00 1.00 H new HETATM 0 H61 MTN A 128 64.897 7.013 -8.180 1.00 1.00 H new HETATM 0 H42 MTN A 128 67.467 6.178 -5.991 1.00 1.00 H new HETATM 0 H41 MTN A 128 65.749 6.474 -6.170 1.00 1.00 H new HETATM 0 H2 MTN A 128 66.892 2.958 -6.390 1.00 1.00 H new HETATM 1932 O1 MTN A 129 71.688 -9.912 -4.194 1.00 1.00 O HETATM 1933 N1 MTN A 129 70.646 -9.279 -4.536 1.00 1.00 N HETATM 1934 C1 MTN A 129 70.392 -8.854 -5.922 1.00 1.00 C HETATM 1935 C2 MTN A 129 69.085 -8.171 -5.742 1.00 1.00 C HETATM 1936 C3 MTN A 129 68.644 -8.181 -4.491 1.00 1.00 C HETATM 1937 C4 MTN A 129 67.380 -7.524 -4.020 1.00 1.00 C HETATM 1938 S1 MTN A 129 67.625 -5.844 -3.376 1.00 1.00 S HETATM 1939 C5 MTN A 129 69.586 -8.911 -3.552 1.00 1.00 C HETATM 1940 C6 MTN A 129 70.067 -8.068 -2.359 1.00 1.00 C HETATM 1941 C7 MTN A 129 68.928 -10.208 -3.069 1.00 1.00 C HETATM 1942 C8 MTN A 129 71.456 -7.895 -6.448 1.00 1.00 C HETATM 1943 C9 MTN A 129 70.266 -10.088 -6.818 1.00 1.00 C HETATM 0 H93 MTN A 129 71.191 -10.663 -6.778 1.00 1.00 H new HETATM 0 H92 MTN A 129 69.439 -10.707 -6.470 1.00 1.00 H new HETATM 0 H91 MTN A 129 70.078 -9.774 -7.845 1.00 1.00 H new HETATM 0 H83 MTN A 129 71.481 -7.001 -5.824 1.00 1.00 H new HETATM 0 H82 MTN A 129 72.430 -8.383 -6.422 1.00 1.00 H new HETATM 0 H81 MTN A 129 71.218 -7.615 -7.474 1.00 1.00 H new HETATM 0 H73 MTN A 129 68.491 -10.732 -3.919 1.00 1.00 H new HETATM 0 H72 MTN A 129 69.678 -10.843 -2.598 1.00 1.00 H new HETATM 0 H71 MTN A 129 68.147 -9.972 -2.347 1.00 1.00 H new HETATM 0 H63 MTN A 129 70.826 -8.621 -1.806 1.00 1.00 H new HETATM 0 H62 MTN A 129 70.492 -7.132 -2.722 1.00 1.00 H new HETATM 0 H61 MTN A 129 69.224 -7.853 -1.702 1.00 1.00 H new HETATM 0 H42 MTN A 129 66.671 -7.486 -4.847 1.00 1.00 H new HETATM 0 H41 MTN A 129 66.930 -8.140 -3.241 1.00 1.00 H new HETATM 0 H2 MTN A 129 68.539 -7.705 -6.562 1.00 1.00 H new HETATM 1959 O1 MTN A 130 82.299 -10.353 4.867 1.00 1.00 O HETATM 1960 N1 MTN A 130 81.647 -9.282 5.047 1.00 1.00 N HETATM 1961 C1 MTN A 130 80.739 -9.077 6.199 1.00 1.00 C HETATM 1962 C2 MTN A 130 80.274 -7.698 5.910 1.00 1.00 C HETATM 1963 C3 MTN A 130 80.794 -7.179 4.811 1.00 1.00 C HETATM 1964 C4 MTN A 130 80.514 -5.808 4.294 1.00 1.00 C HETATM 1965 S1 MTN A 130 81.690 -4.577 4.883 1.00 1.00 S HETATM 1966 C5 MTN A 130 81.741 -8.130 4.113 1.00 1.00 C HETATM 1967 C6 MTN A 130 81.335 -8.434 2.676 1.00 1.00 C HETATM 1968 C7 MTN A 130 83.166 -7.585 4.174 1.00 1.00 C HETATM 1969 C8 MTN A 130 79.580 -10.073 6.233 1.00 1.00 C HETATM 1970 C9 MTN A 130 81.534 -9.114 7.496 1.00 1.00 C HETATM 0 H93 MTN A 130 82.026 -10.082 7.594 1.00 1.00 H new HETATM 0 H92 MTN A 130 82.285 -8.324 7.485 1.00 1.00 H new HETATM 0 H91 MTN A 130 80.861 -8.963 8.340 1.00 1.00 H new HETATM 0 H83 MTN A 130 78.987 -9.973 5.324 1.00 1.00 H new HETATM 0 H82 MTN A 130 79.974 -11.087 6.300 1.00 1.00 H new HETATM 0 H81 MTN A 130 78.951 -9.870 7.100 1.00 1.00 H new HETATM 0 H73 MTN A 130 83.389 -7.263 5.191 1.00 1.00 H new HETATM 0 H72 MTN A 130 83.867 -8.366 3.879 1.00 1.00 H new HETATM 0 H71 MTN A 130 83.261 -6.737 3.496 1.00 1.00 H new HETATM 0 H63 MTN A 130 81.979 -9.216 2.274 1.00 1.00 H new HETATM 0 H62 MTN A 130 80.298 -8.770 2.654 1.00 1.00 H new HETATM 0 H61 MTN A 130 81.437 -7.533 2.071 1.00 1.00 H new HETATM 0 H42 MTN A 130 80.532 -5.826 3.204 1.00 1.00 H new HETATM 0 H41 MTN A 130 79.508 -5.512 4.592 1.00 1.00 H new HETATM 0 H2 MTN A 130 79.569 -7.162 6.545 1.00 1.00 H new