USER MOD reduce.3.24.130724 H: found=0, std=0, add=889, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 889 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 5 THR OG1 : rot 61:sc= 0.43 USER MOD Set 1.2: A 6 GLN :FLIP amide:sc= -0.393 F(o=-2,f=0.038) USER MOD Single : A 1 MET CE :methyl 167:sc=-0.00643 (180deg=-0.232) USER MOD Single : A 1 MET N :NH3+ -107:sc= 0.032 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0242 USER MOD Single : A 18 MET CE :methyl -134:sc= -0.631 (180deg=-0.892) USER MOD Single : A 19 MET CE :methyl -131:sc= -0.0642 (180deg=-0.966) USER MOD Single : A 29 LYS NZ :NH3+ -162:sc= 0.616 (180deg=0.195) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 160:sc= 1.2 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 1.07 K(o=1.1,f=-2.2!) USER MOD Single : A 64 LYS NZ :NH3+ -178:sc= 1.24 (180deg=1.19) USER MOD Single : A 65 SER OG : rot 130:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= -0.108 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 102 LYS NZ :NH3+ -159:sc= -0.108 (180deg=-0.565) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0.0729 USER MOD Single : A 106 MET CE :methyl -171:sc= -2.5! (180deg=-2.91!) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.680 4.435 -7.313 1.00 0.00 N ATOM 2 CA MET A 1 2.925 3.638 -7.255 1.00 0.00 C ATOM 3 C MET A 1 3.853 4.192 -6.180 1.00 0.00 C ATOM 4 O MET A 1 3.880 5.400 -5.944 1.00 0.00 O ATOM 5 CB MET A 1 3.610 3.603 -8.628 1.00 0.00 C ATOM 6 CG MET A 1 4.905 2.791 -8.581 1.00 0.00 C ATOM 7 SD MET A 1 4.683 1.047 -8.135 1.00 0.00 S ATOM 8 CE MET A 1 3.789 0.467 -9.600 1.00 0.00 C ATOM 0 H1 MET A 1 0.897 3.886 -6.905 1.00 0.00 H new ATOM 0 H2 MET A 1 1.805 5.314 -6.772 1.00 0.00 H new ATOM 0 H3 MET A 1 1.462 4.666 -8.303 1.00 0.00 H new ATOM 0 HA MET A 1 2.676 2.611 -6.988 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.933 3.170 -9.364 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.827 4.620 -8.955 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.388 2.845 -9.556 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.583 3.253 -7.863 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.771 -0.623 -9.607 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.768 0.847 -9.577 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.290 0.828 -10.498 1.00 0.00 H new ATOM 20 N SER A 2 4.620 3.308 -5.531 1.00 0.00 N ATOM 21 CA SER A 2 5.544 3.699 -4.475 1.00 0.00 C ATOM 22 C SER A 2 6.684 4.547 -5.034 1.00 0.00 C ATOM 23 O SER A 2 6.986 4.492 -6.225 1.00 0.00 O ATOM 24 CB SER A 2 6.084 2.445 -3.791 1.00 0.00 C ATOM 25 OG SER A 2 7.045 2.800 -2.817 1.00 0.00 O ATOM 0 H SER A 2 4.613 2.307 -5.726 1.00 0.00 H new ATOM 0 HA SER A 2 5.013 4.307 -3.743 1.00 0.00 H new ATOM 0 HB2 SER A 2 5.267 1.895 -3.324 1.00 0.00 H new ATOM 0 HB3 SER A 2 6.532 1.782 -4.531 1.00 0.00 H new ATOM 0 HG SER A 2 7.385 1.990 -2.382 1.00 0.00 H new ATOM 31 N ALA A 3 7.325 5.336 -4.164 1.00 0.00 N ATOM 32 CA ALA A 3 8.439 6.192 -4.546 1.00 0.00 C ATOM 33 C ALA A 3 9.727 5.382 -4.725 1.00 0.00 C ATOM 34 O ALA A 3 10.760 5.944 -5.082 1.00 0.00 O ATOM 35 CB ALA A 3 8.622 7.276 -3.485 1.00 0.00 C ATOM 0 H ALA A 3 7.081 5.394 -3.175 1.00 0.00 H new ATOM 0 HA ALA A 3 8.216 6.657 -5.506 1.00 0.00 H new ATOM 0 HB1 ALA A 3 9.455 7.921 -3.764 1.00 0.00 H new ATOM 0 HB2 ALA A 3 7.711 7.870 -3.411 1.00 0.00 H new ATOM 0 HB3 ALA A 3 8.831 6.811 -2.522 1.00 0.00 H new ATOM 41 N LEU A 4 9.668 4.070 -4.477 1.00 0.00 N ATOM 42 CA LEU A 4 10.822 3.199 -4.622 1.00 0.00 C ATOM 43 C LEU A 4 10.367 1.769 -4.917 1.00 0.00 C ATOM 44 O LEU A 4 9.904 1.064 -4.023 1.00 0.00 O ATOM 45 CB LEU A 4 11.663 3.266 -3.339 1.00 0.00 C ATOM 46 CG LEU A 4 12.795 2.228 -3.321 1.00 0.00 C ATOM 47 CD1 LEU A 4 13.712 2.411 -4.525 1.00 0.00 C ATOM 48 CD2 LEU A 4 13.614 2.398 -2.042 1.00 0.00 C ATOM 0 H LEU A 4 8.821 3.591 -4.172 1.00 0.00 H new ATOM 0 HA LEU A 4 11.436 3.529 -5.460 1.00 0.00 H new ATOM 0 HB2 LEU A 4 12.089 4.264 -3.240 1.00 0.00 H new ATOM 0 HB3 LEU A 4 11.016 3.108 -2.476 1.00 0.00 H new ATOM 0 HG LEU A 4 12.355 1.231 -3.360 1.00 0.00 H new ATOM 0 HD11 LEU A 4 14.507 1.666 -4.493 1.00 0.00 H new ATOM 0 HD12 LEU A 4 13.136 2.289 -5.443 1.00 0.00 H new ATOM 0 HD13 LEU A 4 14.149 3.409 -4.501 1.00 0.00 H new ATOM 0 HD21 LEU A 4 14.419 1.663 -2.025 1.00 0.00 H new ATOM 0 HD22 LEU A 4 14.038 3.402 -2.012 1.00 0.00 H new ATOM 0 HD23 LEU A 4 12.970 2.251 -1.175 1.00 0.00 H new ATOM 60 N THR A 5 10.508 1.350 -6.177 1.00 0.00 N ATOM 61 CA THR A 5 10.174 -0.008 -6.594 1.00 0.00 C ATOM 62 C THR A 5 11.118 -0.377 -7.737 1.00 0.00 C ATOM 63 O THR A 5 11.574 -1.516 -7.806 1.00 0.00 O ATOM 64 CB THR A 5 8.730 -0.053 -7.118 1.00 0.00 C ATOM 65 OG1 THR A 5 8.324 1.218 -7.587 1.00 0.00 O ATOM 66 CG2 THR A 5 7.783 -0.476 -5.999 1.00 0.00 C ATOM 0 H THR A 5 10.856 1.942 -6.931 1.00 0.00 H new ATOM 0 HA THR A 5 10.271 -0.697 -5.755 1.00 0.00 H new ATOM 0 HB THR A 5 8.695 -0.771 -7.937 1.00 0.00 H new ATOM 0 HG1 THR A 5 8.910 1.499 -8.320 1.00 0.00 H new ATOM 0 HG21 THR A 5 6.762 -0.505 -6.378 1.00 0.00 H new ATOM 0 HG22 THR A 5 8.065 -1.465 -5.638 1.00 0.00 H new ATOM 0 HG23 THR A 5 7.845 0.240 -5.180 1.00 0.00 H new ATOM 74 N GLN A 6 11.421 0.563 -8.635 1.00 0.00 N ATOM 75 CA GLN A 6 12.335 0.297 -9.733 1.00 0.00 C ATOM 76 C GLN A 6 13.772 0.406 -9.240 1.00 0.00 C ATOM 77 O GLN A 6 14.219 1.490 -8.873 1.00 0.00 O ATOM 78 CB GLN A 6 12.082 1.267 -10.889 1.00 0.00 C ATOM 79 CG GLN A 6 10.766 0.953 -11.611 1.00 0.00 C ATOM 80 CD GLN A 6 9.541 1.190 -10.741 1.00 0.00 C ATOM 81 OE1 GLN A 6 9.502 2.304 -10.016 1.00 0.00 O flip ATOM 82 NE2 GLN A 6 8.626 0.371 -10.718 1.00 0.00 N flip ATOM 0 H GLN A 6 11.045 1.511 -8.618 1.00 0.00 H new ATOM 0 HA GLN A 6 12.165 -0.715 -10.102 1.00 0.00 H new ATOM 0 HB2 GLN A 6 12.054 2.288 -10.509 1.00 0.00 H new ATOM 0 HB3 GLN A 6 12.908 1.213 -11.598 1.00 0.00 H new ATOM 0 HG2 GLN A 6 10.693 1.569 -12.507 1.00 0.00 H new ATOM 0 HG3 GLN A 6 10.777 -0.086 -11.939 1.00 0.00 H new ATOM 0 HE21 GLN A 6 8.684 -0.475 -11.285 1.00 0.00 H new ATOM 0 HE22 GLN A 6 7.808 0.537 -10.132 1.00 0.00 H new ATOM 91 N ILE A 7 14.492 -0.718 -9.228 1.00 0.00 N ATOM 92 CA ILE A 7 15.867 -0.764 -8.750 1.00 0.00 C ATOM 93 C ILE A 7 16.763 -1.473 -9.762 1.00 0.00 C ATOM 94 O ILE A 7 16.377 -2.501 -10.316 1.00 0.00 O ATOM 95 CB ILE A 7 15.907 -1.448 -7.374 1.00 0.00 C ATOM 96 CG1 ILE A 7 15.080 -0.616 -6.383 1.00 0.00 C ATOM 97 CG2 ILE A 7 17.359 -1.587 -6.899 1.00 0.00 C ATOM 98 CD1 ILE A 7 15.149 -1.171 -4.959 1.00 0.00 C ATOM 0 H ILE A 7 14.135 -1.618 -9.550 1.00 0.00 H new ATOM 0 HA ILE A 7 16.250 0.251 -8.639 1.00 0.00 H new ATOM 0 HB ILE A 7 15.480 -2.449 -7.441 1.00 0.00 H new ATOM 0 HG12 ILE A 7 15.440 0.413 -6.387 1.00 0.00 H new ATOM 0 HG13 ILE A 7 14.041 -0.592 -6.711 1.00 0.00 H new ATOM 0 HG21 ILE A 7 17.378 -2.073 -5.923 1.00 0.00 H new ATOM 0 HG22 ILE A 7 17.920 -2.188 -7.614 1.00 0.00 H new ATOM 0 HG23 ILE A 7 17.813 -0.599 -6.821 1.00 0.00 H new ATOM 0 HD11 ILE A 7 14.548 -0.548 -4.296 1.00 0.00 H new ATOM 0 HD12 ILE A 7 14.764 -2.191 -4.947 1.00 0.00 H new ATOM 0 HD13 ILE A 7 16.184 -1.170 -4.618 1.00 0.00 H new ATOM 110 N LEU A 8 17.958 -0.922 -9.999 1.00 0.00 N ATOM 111 CA LEU A 8 18.953 -1.560 -10.850 1.00 0.00 C ATOM 112 C LEU A 8 19.944 -2.341 -9.992 1.00 0.00 C ATOM 113 O LEU A 8 20.163 -2.005 -8.832 1.00 0.00 O ATOM 114 CB LEU A 8 19.678 -0.507 -11.696 1.00 0.00 C ATOM 115 CG LEU A 8 20.389 -1.156 -12.893 1.00 0.00 C ATOM 116 CD1 LEU A 8 19.379 -1.447 -14.005 1.00 0.00 C ATOM 117 CD2 LEU A 8 21.462 -0.224 -13.448 1.00 0.00 C ATOM 0 H LEU A 8 18.256 -0.028 -9.607 1.00 0.00 H new ATOM 0 HA LEU A 8 18.455 -2.256 -11.525 1.00 0.00 H new ATOM 0 HB2 LEU A 8 18.962 0.234 -12.052 1.00 0.00 H new ATOM 0 HB3 LEU A 8 20.405 0.022 -11.080 1.00 0.00 H new ATOM 0 HG LEU A 8 20.850 -2.083 -12.551 1.00 0.00 H new ATOM 0 HD11 LEU A 8 19.891 -1.907 -14.850 1.00 0.00 H new ATOM 0 HD12 LEU A 8 18.612 -2.126 -13.632 1.00 0.00 H new ATOM 0 HD13 LEU A 8 18.913 -0.515 -14.326 1.00 0.00 H new ATOM 0 HD21 LEU A 8 21.955 -0.701 -14.295 1.00 0.00 H new ATOM 0 HD22 LEU A 8 21.001 0.708 -13.774 1.00 0.00 H new ATOM 0 HD23 LEU A 8 22.198 -0.013 -12.672 1.00 0.00 H new ATOM 129 N ILE A 9 20.547 -3.379 -10.569 1.00 0.00 N ATOM 130 CA ILE A 9 21.558 -4.174 -9.890 1.00 0.00 C ATOM 131 C ILE A 9 22.832 -4.191 -10.726 1.00 0.00 C ATOM 132 O ILE A 9 22.773 -4.251 -11.952 1.00 0.00 O ATOM 133 CB ILE A 9 21.024 -5.595 -9.654 1.00 0.00 C ATOM 134 CG1 ILE A 9 19.700 -5.574 -8.875 1.00 0.00 C ATOM 135 CG2 ILE A 9 22.057 -6.425 -8.885 1.00 0.00 C ATOM 136 CD1 ILE A 9 18.966 -6.907 -9.027 1.00 0.00 C ATOM 0 H ILE A 9 20.346 -3.689 -11.520 1.00 0.00 H new ATOM 0 HA ILE A 9 21.791 -3.735 -8.920 1.00 0.00 H new ATOM 0 HB ILE A 9 20.842 -6.047 -10.629 1.00 0.00 H new ATOM 0 HG12 ILE A 9 19.895 -5.378 -7.821 1.00 0.00 H new ATOM 0 HG13 ILE A 9 19.070 -4.762 -9.239 1.00 0.00 H new ATOM 0 HG21 ILE A 9 21.668 -7.430 -8.723 1.00 0.00 H new ATOM 0 HG22 ILE A 9 22.980 -6.481 -9.461 1.00 0.00 H new ATOM 0 HG23 ILE A 9 22.258 -5.954 -7.923 1.00 0.00 H new ATOM 0 HD11 ILE A 9 18.031 -6.873 -8.468 1.00 0.00 H new ATOM 0 HD12 ILE A 9 18.753 -7.087 -10.081 1.00 0.00 H new ATOM 0 HD13 ILE A 9 19.590 -7.712 -8.640 1.00 0.00 H new ATOM 148 N VAL A 10 23.985 -4.139 -10.056 1.00 0.00 N ATOM 149 CA VAL A 10 25.282 -4.217 -10.718 1.00 0.00 C ATOM 150 C VAL A 10 26.164 -5.205 -9.975 1.00 0.00 C ATOM 151 O VAL A 10 26.669 -4.905 -8.896 1.00 0.00 O ATOM 152 CB VAL A 10 25.935 -2.834 -10.805 1.00 0.00 C ATOM 153 CG1 VAL A 10 27.212 -2.908 -11.642 1.00 0.00 C ATOM 154 CG2 VAL A 10 24.985 -1.819 -11.433 1.00 0.00 C ATOM 0 H VAL A 10 24.043 -4.042 -9.042 1.00 0.00 H new ATOM 0 HA VAL A 10 25.146 -4.570 -11.740 1.00 0.00 H new ATOM 0 HB VAL A 10 26.175 -2.513 -9.791 1.00 0.00 H new ATOM 0 HG11 VAL A 10 27.668 -1.920 -11.698 1.00 0.00 H new ATOM 0 HG12 VAL A 10 27.911 -3.605 -11.179 1.00 0.00 H new ATOM 0 HG13 VAL A 10 26.969 -3.252 -12.647 1.00 0.00 H new ATOM 0 HG21 VAL A 10 25.473 -0.846 -11.483 1.00 0.00 H new ATOM 0 HG22 VAL A 10 24.719 -2.143 -12.439 1.00 0.00 H new ATOM 0 HG23 VAL A 10 24.083 -1.741 -10.826 1.00 0.00 H new ATOM 164 N GLU A 11 26.345 -6.389 -10.559 1.00 0.00 N ATOM 165 CA GLU A 11 27.030 -7.493 -9.904 1.00 0.00 C ATOM 166 C GLU A 11 27.553 -8.467 -10.958 1.00 0.00 C ATOM 167 O GLU A 11 26.861 -8.743 -11.935 1.00 0.00 O ATOM 168 CB GLU A 11 26.032 -8.193 -8.970 1.00 0.00 C ATOM 169 CG GLU A 11 26.626 -9.438 -8.309 1.00 0.00 C ATOM 170 CD GLU A 11 27.634 -9.096 -7.215 1.00 0.00 C ATOM 171 OE1 GLU A 11 27.681 -7.914 -6.812 1.00 0.00 O ATOM 172 OE2 GLU A 11 28.351 -10.029 -6.788 1.00 0.00 O ATOM 0 H GLU A 11 26.019 -6.606 -11.501 1.00 0.00 H new ATOM 0 HA GLU A 11 27.878 -7.128 -9.324 1.00 0.00 H new ATOM 0 HB2 GLU A 11 25.709 -7.494 -8.198 1.00 0.00 H new ATOM 0 HB3 GLU A 11 25.144 -8.474 -9.537 1.00 0.00 H new ATOM 0 HG2 GLU A 11 25.822 -10.037 -7.883 1.00 0.00 H new ATOM 0 HG3 GLU A 11 27.113 -10.051 -9.068 1.00 0.00 H new ATOM 179 N ASP A 12 28.770 -8.987 -10.767 1.00 0.00 N ATOM 180 CA ASP A 12 29.348 -9.943 -11.699 1.00 0.00 C ATOM 181 C ASP A 12 29.054 -11.401 -11.323 1.00 0.00 C ATOM 182 O ASP A 12 28.944 -12.259 -12.199 1.00 0.00 O ATOM 183 CB ASP A 12 30.842 -9.653 -11.883 1.00 0.00 C ATOM 184 CG ASP A 12 31.594 -10.809 -12.541 1.00 0.00 C ATOM 185 OD1 ASP A 12 31.092 -11.321 -13.566 1.00 0.00 O ATOM 186 OD2 ASP A 12 32.668 -11.168 -12.006 1.00 0.00 O ATOM 0 H ASP A 12 29.369 -8.758 -9.974 1.00 0.00 H new ATOM 0 HA ASP A 12 28.861 -9.812 -12.665 1.00 0.00 H new ATOM 0 HB2 ASP A 12 30.961 -8.756 -12.491 1.00 0.00 H new ATOM 0 HB3 ASP A 12 31.289 -9.442 -10.911 1.00 0.00 H new ATOM 191 N GLU A 13 28.921 -11.693 -10.023 1.00 0.00 N ATOM 192 CA GLU A 13 28.599 -13.043 -9.578 1.00 0.00 C ATOM 193 C GLU A 13 27.147 -13.360 -9.946 1.00 0.00 C ATOM 194 O GLU A 13 26.257 -12.558 -9.663 1.00 0.00 O ATOM 195 CB GLU A 13 28.799 -13.139 -8.059 1.00 0.00 C ATOM 196 CG GLU A 13 28.618 -14.575 -7.556 1.00 0.00 C ATOM 197 CD GLU A 13 29.780 -15.489 -7.953 1.00 0.00 C ATOM 198 OE1 GLU A 13 29.709 -16.683 -7.586 1.00 0.00 O ATOM 199 OE2 GLU A 13 30.722 -14.997 -8.611 1.00 0.00 O ATOM 0 H GLU A 13 29.032 -11.014 -9.270 1.00 0.00 H new ATOM 0 HA GLU A 13 29.255 -13.764 -10.065 1.00 0.00 H new ATOM 0 HB2 GLU A 13 29.797 -12.785 -7.800 1.00 0.00 H new ATOM 0 HB3 GLU A 13 28.088 -12.484 -7.556 1.00 0.00 H new ATOM 0 HG2 GLU A 13 28.522 -14.566 -6.470 1.00 0.00 H new ATOM 0 HG3 GLU A 13 27.688 -14.981 -7.955 1.00 0.00 H new ATOM 206 N PRO A 14 26.886 -14.516 -10.570 1.00 0.00 N ATOM 207 CA PRO A 14 25.545 -14.901 -10.970 1.00 0.00 C ATOM 208 C PRO A 14 24.663 -15.180 -9.760 1.00 0.00 C ATOM 209 O PRO A 14 23.492 -14.811 -9.753 1.00 0.00 O ATOM 210 CB PRO A 14 25.709 -16.164 -11.810 1.00 0.00 C ATOM 211 CG PRO A 14 27.085 -16.721 -11.435 1.00 0.00 C ATOM 212 CD PRO A 14 27.874 -15.504 -10.957 1.00 0.00 C ATOM 0 HA PRO A 14 25.059 -14.100 -11.528 1.00 0.00 H new ATOM 0 HB2 PRO A 14 24.920 -16.885 -11.595 1.00 0.00 H new ATOM 0 HB3 PRO A 14 25.653 -15.939 -12.875 1.00 0.00 H new ATOM 0 HG2 PRO A 14 27.008 -17.476 -10.653 1.00 0.00 H new ATOM 0 HG3 PRO A 14 27.567 -17.196 -12.290 1.00 0.00 H new ATOM 0 HD2 PRO A 14 28.518 -15.762 -10.116 1.00 0.00 H new ATOM 0 HD3 PRO A 14 28.519 -15.122 -11.748 1.00 0.00 H new ATOM 220 N LEU A 15 25.219 -15.830 -8.733 1.00 0.00 N ATOM 221 CA LEU A 15 24.442 -16.253 -7.578 1.00 0.00 C ATOM 222 C LEU A 15 23.889 -15.042 -6.831 1.00 0.00 C ATOM 223 O LEU A 15 22.727 -15.043 -6.441 1.00 0.00 O ATOM 224 CB LEU A 15 25.325 -17.084 -6.640 1.00 0.00 C ATOM 225 CG LEU A 15 25.374 -18.559 -7.060 1.00 0.00 C ATOM 226 CD1 LEU A 15 26.091 -18.741 -8.397 1.00 0.00 C ATOM 227 CD2 LEU A 15 26.113 -19.355 -5.990 1.00 0.00 C ATOM 0 H LEU A 15 26.209 -16.073 -8.684 1.00 0.00 H new ATOM 0 HA LEU A 15 23.605 -16.860 -7.922 1.00 0.00 H new ATOM 0 HB2 LEU A 15 26.335 -16.674 -6.634 1.00 0.00 H new ATOM 0 HB3 LEU A 15 24.944 -17.009 -5.621 1.00 0.00 H new ATOM 0 HG LEU A 15 24.350 -18.915 -7.172 1.00 0.00 H new ATOM 0 HD11 LEU A 15 26.106 -19.798 -8.661 1.00 0.00 H new ATOM 0 HD12 LEU A 15 25.566 -18.181 -9.171 1.00 0.00 H new ATOM 0 HD13 LEU A 15 27.114 -18.374 -8.314 1.00 0.00 H new ATOM 0 HD21 LEU A 15 26.153 -20.405 -6.280 1.00 0.00 H new ATOM 0 HD22 LEU A 15 27.127 -18.969 -5.885 1.00 0.00 H new ATOM 0 HD23 LEU A 15 25.588 -19.261 -5.039 1.00 0.00 H new ATOM 239 N ILE A 16 24.706 -14.008 -6.628 1.00 0.00 N ATOM 240 CA ILE A 16 24.261 -12.832 -5.892 1.00 0.00 C ATOM 241 C ILE A 16 23.303 -12.011 -6.753 1.00 0.00 C ATOM 242 O ILE A 16 22.389 -11.380 -6.225 1.00 0.00 O ATOM 243 CB ILE A 16 25.476 -11.991 -5.481 1.00 0.00 C ATOM 244 CG1 ILE A 16 26.517 -12.822 -4.713 1.00 0.00 C ATOM 245 CG2 ILE A 16 25.027 -10.793 -4.637 1.00 0.00 C ATOM 246 CD1 ILE A 16 25.960 -13.412 -3.416 1.00 0.00 C ATOM 0 H ILE A 16 25.669 -13.963 -6.960 1.00 0.00 H new ATOM 0 HA ILE A 16 23.732 -13.145 -4.992 1.00 0.00 H new ATOM 0 HB ILE A 16 25.952 -11.633 -6.394 1.00 0.00 H new ATOM 0 HG12 ILE A 16 26.874 -13.630 -5.351 1.00 0.00 H new ATOM 0 HG13 ILE A 16 27.378 -12.195 -4.482 1.00 0.00 H new ATOM 0 HG21 ILE A 16 25.898 -10.203 -4.351 1.00 0.00 H new ATOM 0 HG22 ILE A 16 24.344 -10.174 -5.219 1.00 0.00 H new ATOM 0 HG23 ILE A 16 24.519 -11.149 -3.741 1.00 0.00 H new ATOM 0 HD11 ILE A 16 26.738 -13.989 -2.915 1.00 0.00 H new ATOM 0 HD12 ILE A 16 25.629 -12.605 -2.762 1.00 0.00 H new ATOM 0 HD13 ILE A 16 25.116 -14.063 -3.645 1.00 0.00 H new ATOM 258 N ALA A 17 23.505 -12.012 -8.073 1.00 0.00 N ATOM 259 CA ALA A 17 22.684 -11.224 -8.979 1.00 0.00 C ATOM 260 C ALA A 17 21.273 -11.807 -9.085 1.00 0.00 C ATOM 261 O ALA A 17 20.297 -11.065 -9.014 1.00 0.00 O ATOM 262 CB ALA A 17 23.353 -11.185 -10.351 1.00 0.00 C ATOM 0 H ALA A 17 24.235 -12.555 -8.534 1.00 0.00 H new ATOM 0 HA ALA A 17 22.593 -10.210 -8.589 1.00 0.00 H new ATOM 0 HB1 ALA A 17 22.744 -10.596 -11.036 1.00 0.00 H new ATOM 0 HB2 ALA A 17 24.340 -10.731 -10.262 1.00 0.00 H new ATOM 0 HB3 ALA A 17 23.454 -12.200 -10.736 1.00 0.00 H new ATOM 268 N MET A 18 21.152 -13.128 -9.256 1.00 0.00 N ATOM 269 CA MET A 18 19.848 -13.754 -9.440 1.00 0.00 C ATOM 270 C MET A 18 19.072 -13.780 -8.124 1.00 0.00 C ATOM 271 O MET A 18 17.847 -13.837 -8.134 1.00 0.00 O ATOM 272 CB MET A 18 20.031 -15.169 -10.000 1.00 0.00 C ATOM 273 CG MET A 18 20.637 -16.122 -8.971 1.00 0.00 C ATOM 274 SD MET A 18 20.845 -17.824 -9.566 1.00 0.00 S ATOM 275 CE MET A 18 22.141 -17.571 -10.804 1.00 0.00 C ATOM 0 H MET A 18 21.939 -13.777 -9.270 1.00 0.00 H new ATOM 0 HA MET A 18 19.268 -13.168 -10.153 1.00 0.00 H new ATOM 0 HB2 MET A 18 19.066 -15.556 -10.327 1.00 0.00 H new ATOM 0 HB3 MET A 18 20.674 -15.130 -10.879 1.00 0.00 H new ATOM 0 HG2 MET A 18 21.608 -15.736 -8.662 1.00 0.00 H new ATOM 0 HG3 MET A 18 20.002 -16.134 -8.085 1.00 0.00 H new ATOM 0 HE1 MET A 18 21.878 -18.100 -11.720 1.00 0.00 H new ATOM 0 HE2 MET A 18 22.239 -16.506 -11.016 1.00 0.00 H new ATOM 0 HE3 MET A 18 23.088 -17.954 -10.423 1.00 0.00 H new ATOM 285 N MET A 19 19.781 -13.738 -6.991 1.00 0.00 N ATOM 286 CA MET A 19 19.147 -13.679 -5.683 1.00 0.00 C ATOM 287 C MET A 19 18.578 -12.286 -5.419 1.00 0.00 C ATOM 288 O MET A 19 17.550 -12.159 -4.755 1.00 0.00 O ATOM 289 CB MET A 19 20.170 -14.061 -4.611 1.00 0.00 C ATOM 290 CG MET A 19 20.396 -15.577 -4.620 1.00 0.00 C ATOM 291 SD MET A 19 18.929 -16.568 -4.224 1.00 0.00 S ATOM 292 CE MET A 19 18.663 -16.049 -2.509 1.00 0.00 C ATOM 0 H MET A 19 20.801 -13.744 -6.961 1.00 0.00 H new ATOM 0 HA MET A 19 18.317 -14.384 -5.654 1.00 0.00 H new ATOM 0 HB2 MET A 19 21.112 -13.543 -4.794 1.00 0.00 H new ATOM 0 HB3 MET A 19 19.817 -13.743 -3.630 1.00 0.00 H new ATOM 0 HG2 MET A 19 20.760 -15.870 -5.605 1.00 0.00 H new ATOM 0 HG3 MET A 19 21.183 -15.817 -3.905 1.00 0.00 H new ATOM 0 HE1 MET A 19 18.530 -16.929 -1.879 1.00 0.00 H new ATOM 0 HE2 MET A 19 19.527 -15.482 -2.162 1.00 0.00 H new ATOM 0 HE3 MET A 19 17.772 -15.424 -2.452 1.00 0.00 H new ATOM 302 N LEU A 20 19.232 -11.241 -5.932 1.00 0.00 N ATOM 303 CA LEU A 20 18.743 -9.877 -5.764 1.00 0.00 C ATOM 304 C LEU A 20 17.515 -9.646 -6.645 1.00 0.00 C ATOM 305 O LEU A 20 16.630 -8.878 -6.274 1.00 0.00 O ATOM 306 CB LEU A 20 19.857 -8.890 -6.125 1.00 0.00 C ATOM 307 CG LEU A 20 20.902 -8.796 -5.007 1.00 0.00 C ATOM 308 CD1 LEU A 20 22.101 -7.997 -5.506 1.00 0.00 C ATOM 309 CD2 LEU A 20 20.313 -8.084 -3.789 1.00 0.00 C ATOM 0 H LEU A 20 20.098 -11.316 -6.465 1.00 0.00 H new ATOM 0 HA LEU A 20 18.452 -9.721 -4.725 1.00 0.00 H new ATOM 0 HB2 LEU A 20 20.339 -9.205 -7.051 1.00 0.00 H new ATOM 0 HB3 LEU A 20 19.428 -7.905 -6.308 1.00 0.00 H new ATOM 0 HG LEU A 20 21.207 -9.804 -4.725 1.00 0.00 H new ATOM 0 HD11 LEU A 20 22.847 -7.927 -4.714 1.00 0.00 H new ATOM 0 HD12 LEU A 20 22.536 -8.496 -6.372 1.00 0.00 H new ATOM 0 HD13 LEU A 20 21.778 -6.995 -5.789 1.00 0.00 H new ATOM 0 HD21 LEU A 20 21.066 -8.024 -3.003 1.00 0.00 H new ATOM 0 HD22 LEU A 20 20.002 -7.078 -4.071 1.00 0.00 H new ATOM 0 HD23 LEU A 20 19.450 -8.641 -3.424 1.00 0.00 H new ATOM 321 N GLU A 21 17.450 -10.305 -7.804 1.00 0.00 N ATOM 322 CA GLU A 21 16.292 -10.192 -8.680 1.00 0.00 C ATOM 323 C GLU A 21 15.083 -10.888 -8.059 1.00 0.00 C ATOM 324 O GLU A 21 13.945 -10.467 -8.267 1.00 0.00 O ATOM 325 CB GLU A 21 16.618 -10.811 -10.042 1.00 0.00 C ATOM 326 CG GLU A 21 17.680 -9.983 -10.766 1.00 0.00 C ATOM 327 CD GLU A 21 18.157 -10.664 -12.050 1.00 0.00 C ATOM 328 OE1 GLU A 21 19.025 -10.066 -12.727 1.00 0.00 O ATOM 329 OE2 GLU A 21 17.653 -11.770 -12.343 1.00 0.00 O ATOM 0 H GLU A 21 18.185 -10.920 -8.153 1.00 0.00 H new ATOM 0 HA GLU A 21 16.049 -9.138 -8.813 1.00 0.00 H new ATOM 0 HB2 GLU A 21 16.974 -11.833 -9.908 1.00 0.00 H new ATOM 0 HB3 GLU A 21 15.714 -10.865 -10.649 1.00 0.00 H new ATOM 0 HG2 GLU A 21 17.273 -9.001 -11.006 1.00 0.00 H new ATOM 0 HG3 GLU A 21 18.530 -9.823 -10.103 1.00 0.00 H new ATOM 336 N ASP A 22 15.327 -11.957 -7.292 1.00 0.00 N ATOM 337 CA ASP A 22 14.265 -12.709 -6.642 1.00 0.00 C ATOM 338 C ASP A 22 13.723 -11.939 -5.439 1.00 0.00 C ATOM 339 O ASP A 22 12.513 -11.910 -5.208 1.00 0.00 O ATOM 340 CB ASP A 22 14.819 -14.073 -6.218 1.00 0.00 C ATOM 341 CG ASP A 22 13.774 -14.934 -5.509 1.00 0.00 C ATOM 342 OD1 ASP A 22 12.566 -14.706 -5.750 1.00 0.00 O ATOM 343 OD2 ASP A 22 14.196 -15.818 -4.731 1.00 0.00 O ATOM 0 H ASP A 22 16.263 -12.318 -7.110 1.00 0.00 H new ATOM 0 HA ASP A 22 13.437 -12.856 -7.336 1.00 0.00 H new ATOM 0 HB2 ASP A 22 15.185 -14.602 -7.098 1.00 0.00 H new ATOM 0 HB3 ASP A 22 15.673 -13.925 -5.557 1.00 0.00 H new ATOM 348 N PHE A 23 14.614 -11.303 -4.670 1.00 0.00 N ATOM 349 CA PHE A 23 14.207 -10.554 -3.490 1.00 0.00 C ATOM 350 C PHE A 23 13.419 -9.281 -3.775 1.00 0.00 C ATOM 351 O PHE A 23 12.613 -8.853 -2.955 1.00 0.00 O ATOM 352 CB PHE A 23 15.402 -10.276 -2.583 1.00 0.00 C ATOM 353 CG PHE A 23 15.840 -11.459 -1.746 1.00 0.00 C ATOM 354 CD1 PHE A 23 17.181 -11.872 -1.763 1.00 0.00 C ATOM 355 CD2 PHE A 23 14.910 -12.139 -0.946 1.00 0.00 C ATOM 356 CE1 PHE A 23 17.586 -12.961 -0.983 1.00 0.00 C ATOM 357 CE2 PHE A 23 15.316 -13.230 -0.162 1.00 0.00 C ATOM 358 CZ PHE A 23 16.657 -13.641 -0.184 1.00 0.00 C ATOM 0 H PHE A 23 15.618 -11.296 -4.848 1.00 0.00 H new ATOM 0 HA PHE A 23 13.503 -11.203 -2.970 1.00 0.00 H new ATOM 0 HB2 PHE A 23 16.241 -9.951 -3.198 1.00 0.00 H new ATOM 0 HB3 PHE A 23 15.154 -9.448 -1.919 1.00 0.00 H new ATOM 0 HD1 PHE A 23 17.900 -11.350 -2.377 1.00 0.00 H new ATOM 0 HD2 PHE A 23 13.878 -11.822 -0.933 1.00 0.00 H new ATOM 0 HE1 PHE A 23 18.618 -13.279 -0.997 1.00 0.00 H new ATOM 0 HE2 PHE A 23 14.599 -13.751 0.455 1.00 0.00 H new ATOM 0 HZ PHE A 23 16.974 -14.482 0.415 1.00 0.00 H new ATOM 368 N LEU A 24 13.638 -8.669 -4.941 1.00 0.00 N ATOM 369 CA LEU A 24 12.902 -7.471 -5.304 1.00 0.00 C ATOM 370 C LEU A 24 11.471 -7.838 -5.676 1.00 0.00 C ATOM 371 O LEU A 24 10.539 -7.125 -5.319 1.00 0.00 O ATOM 372 CB LEU A 24 13.604 -6.773 -6.474 1.00 0.00 C ATOM 373 CG LEU A 24 14.913 -6.116 -6.027 1.00 0.00 C ATOM 374 CD1 LEU A 24 15.685 -5.640 -7.253 1.00 0.00 C ATOM 375 CD2 LEU A 24 14.633 -4.917 -5.122 1.00 0.00 C ATOM 0 H LEU A 24 14.313 -8.984 -5.638 1.00 0.00 H new ATOM 0 HA LEU A 24 12.873 -6.787 -4.456 1.00 0.00 H new ATOM 0 HB2 LEU A 24 13.809 -7.498 -7.262 1.00 0.00 H new ATOM 0 HB3 LEU A 24 12.943 -6.018 -6.899 1.00 0.00 H new ATOM 0 HG LEU A 24 15.498 -6.850 -5.473 1.00 0.00 H new ATOM 0 HD11 LEU A 24 16.617 -5.172 -6.937 1.00 0.00 H new ATOM 0 HD12 LEU A 24 15.906 -6.491 -7.897 1.00 0.00 H new ATOM 0 HD13 LEU A 24 15.084 -4.916 -7.803 1.00 0.00 H new ATOM 0 HD21 LEU A 24 15.576 -4.464 -4.815 1.00 0.00 H new ATOM 0 HD22 LEU A 24 14.038 -4.183 -5.665 1.00 0.00 H new ATOM 0 HD23 LEU A 24 14.085 -5.247 -4.239 1.00 0.00 H new ATOM 387 N GLU A 25 11.289 -8.950 -6.390 1.00 0.00 N ATOM 388 CA GLU A 25 9.975 -9.339 -6.871 1.00 0.00 C ATOM 389 C GLU A 25 9.048 -9.735 -5.722 1.00 0.00 C ATOM 390 O GLU A 25 7.848 -9.466 -5.775 1.00 0.00 O ATOM 391 CB GLU A 25 10.141 -10.493 -7.861 1.00 0.00 C ATOM 392 CG GLU A 25 8.780 -10.997 -8.347 1.00 0.00 C ATOM 393 CD GLU A 25 8.917 -12.093 -9.404 1.00 0.00 C ATOM 394 OE1 GLU A 25 10.067 -12.372 -9.811 1.00 0.00 O ATOM 395 OE2 GLU A 25 7.862 -12.638 -9.802 1.00 0.00 O ATOM 0 H GLU A 25 12.039 -9.593 -6.645 1.00 0.00 H new ATOM 0 HA GLU A 25 9.511 -8.488 -7.368 1.00 0.00 H new ATOM 0 HB2 GLU A 25 10.736 -10.164 -8.713 1.00 0.00 H new ATOM 0 HB3 GLU A 25 10.687 -11.309 -7.387 1.00 0.00 H new ATOM 0 HG2 GLU A 25 8.212 -11.380 -7.499 1.00 0.00 H new ATOM 0 HG3 GLU A 25 8.212 -10.164 -8.761 1.00 0.00 H new ATOM 402 N VAL A 26 9.595 -10.372 -4.679 1.00 0.00 N ATOM 403 CA VAL A 26 8.798 -10.786 -3.532 1.00 0.00 C ATOM 404 C VAL A 26 8.452 -9.598 -2.628 1.00 0.00 C ATOM 405 O VAL A 26 7.464 -9.643 -1.899 1.00 0.00 O ATOM 406 CB VAL A 26 9.515 -11.911 -2.776 1.00 0.00 C ATOM 407 CG1 VAL A 26 10.718 -11.373 -2.005 1.00 0.00 C ATOM 408 CG2 VAL A 26 8.563 -12.587 -1.790 1.00 0.00 C ATOM 0 H VAL A 26 10.585 -10.609 -4.612 1.00 0.00 H new ATOM 0 HA VAL A 26 7.846 -11.179 -3.889 1.00 0.00 H new ATOM 0 HB VAL A 26 9.856 -12.636 -3.516 1.00 0.00 H new ATOM 0 HG11 VAL A 26 11.208 -12.192 -1.478 1.00 0.00 H new ATOM 0 HG12 VAL A 26 11.422 -10.917 -2.701 1.00 0.00 H new ATOM 0 HG13 VAL A 26 10.384 -10.626 -1.285 1.00 0.00 H new ATOM 0 HG21 VAL A 26 9.090 -13.383 -1.263 1.00 0.00 H new ATOM 0 HG22 VAL A 26 8.202 -11.852 -1.070 1.00 0.00 H new ATOM 0 HG23 VAL A 26 7.717 -13.009 -2.332 1.00 0.00 H new ATOM 418 N LEU A 27 9.265 -8.536 -2.672 1.00 0.00 N ATOM 419 CA LEU A 27 8.975 -7.297 -1.960 1.00 0.00 C ATOM 420 C LEU A 27 8.064 -6.396 -2.802 1.00 0.00 C ATOM 421 O LEU A 27 7.941 -5.205 -2.518 1.00 0.00 O ATOM 422 CB LEU A 27 10.283 -6.573 -1.613 1.00 0.00 C ATOM 423 CG LEU A 27 11.100 -7.356 -0.576 1.00 0.00 C ATOM 424 CD1 LEU A 27 12.458 -6.679 -0.398 1.00 0.00 C ATOM 425 CD2 LEU A 27 10.385 -7.377 0.775 1.00 0.00 C ATOM 0 H LEU A 27 10.137 -8.516 -3.201 1.00 0.00 H new ATOM 0 HA LEU A 27 8.453 -7.536 -1.033 1.00 0.00 H new ATOM 0 HB2 LEU A 27 10.876 -6.437 -2.517 1.00 0.00 H new ATOM 0 HB3 LEU A 27 10.059 -5.579 -1.226 1.00 0.00 H new ATOM 0 HG LEU A 27 11.221 -8.380 -0.930 1.00 0.00 H new ATOM 0 HD11 LEU A 27 13.045 -7.229 0.337 1.00 0.00 H new ATOM 0 HD12 LEU A 27 12.987 -6.669 -1.351 1.00 0.00 H new ATOM 0 HD13 LEU A 27 12.312 -5.655 -0.053 1.00 0.00 H new ATOM 0 HD21 LEU A 27 10.982 -7.937 1.494 1.00 0.00 H new ATOM 0 HD22 LEU A 27 10.251 -6.356 1.132 1.00 0.00 H new ATOM 0 HD23 LEU A 27 9.411 -7.853 0.664 1.00 0.00 H new ATOM 437 N ASP A 28 7.429 -6.964 -3.833 1.00 0.00 N ATOM 438 CA ASP A 28 6.577 -6.220 -4.752 1.00 0.00 C ATOM 439 C ASP A 28 7.305 -5.084 -5.476 1.00 0.00 C ATOM 440 O ASP A 28 6.677 -4.130 -5.934 1.00 0.00 O ATOM 441 CB ASP A 28 5.275 -5.772 -4.070 1.00 0.00 C ATOM 442 CG ASP A 28 4.343 -6.945 -3.760 1.00 0.00 C ATOM 443 OD1 ASP A 28 4.674 -8.083 -4.161 1.00 0.00 O ATOM 444 OD2 ASP A 28 3.301 -6.681 -3.119 1.00 0.00 O ATOM 0 H ASP A 28 7.496 -7.958 -4.050 1.00 0.00 H new ATOM 0 HA ASP A 28 6.296 -6.911 -5.547 1.00 0.00 H new ATOM 0 HB2 ASP A 28 5.515 -5.248 -3.145 1.00 0.00 H new ATOM 0 HB3 ASP A 28 4.757 -5.061 -4.714 1.00 0.00 H new ATOM 449 N LYS A 29 8.636 -5.191 -5.574 1.00 0.00 N ATOM 450 CA LYS A 29 9.460 -4.238 -6.308 1.00 0.00 C ATOM 451 C LYS A 29 9.788 -4.802 -7.687 1.00 0.00 C ATOM 452 O LYS A 29 9.390 -5.920 -8.015 1.00 0.00 O ATOM 453 CB LYS A 29 10.730 -3.912 -5.514 1.00 0.00 C ATOM 454 CG LYS A 29 10.363 -3.319 -4.154 1.00 0.00 C ATOM 455 CD LYS A 29 11.604 -2.728 -3.482 1.00 0.00 C ATOM 456 CE LYS A 29 11.248 -2.185 -2.097 1.00 0.00 C ATOM 457 NZ LYS A 29 10.212 -1.136 -2.170 1.00 0.00 N ATOM 0 H LYS A 29 9.169 -5.946 -5.142 1.00 0.00 H new ATOM 0 HA LYS A 29 8.910 -3.307 -6.443 1.00 0.00 H new ATOM 0 HB2 LYS A 29 11.324 -4.815 -5.377 1.00 0.00 H new ATOM 0 HB3 LYS A 29 11.346 -3.207 -6.072 1.00 0.00 H new ATOM 0 HG2 LYS A 29 9.605 -2.545 -4.279 1.00 0.00 H new ATOM 0 HG3 LYS A 29 9.929 -4.091 -3.518 1.00 0.00 H new ATOM 0 HD2 LYS A 29 12.377 -3.492 -3.393 1.00 0.00 H new ATOM 0 HD3 LYS A 29 12.015 -1.929 -4.099 1.00 0.00 H new ATOM 0 HE2 LYS A 29 10.895 -3.001 -1.466 1.00 0.00 H new ATOM 0 HE3 LYS A 29 12.143 -1.780 -1.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 10.212 -0.586 -1.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 10.414 -0.504 -2.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 9.280 -1.577 -2.303 1.00 0.00 H new ATOM 471 N THR A 30 10.514 -4.028 -8.498 1.00 0.00 N ATOM 472 CA THR A 30 10.815 -4.404 -9.872 1.00 0.00 C ATOM 473 C THR A 30 12.293 -4.277 -10.239 1.00 0.00 C ATOM 474 O THR A 30 12.831 -3.172 -10.244 1.00 0.00 O ATOM 475 CB THR A 30 9.930 -3.625 -10.851 1.00 0.00 C ATOM 476 OG1 THR A 30 8.628 -3.475 -10.321 1.00 0.00 O ATOM 477 CG2 THR A 30 9.860 -4.344 -12.195 1.00 0.00 C ATOM 0 H THR A 30 10.906 -3.129 -8.218 1.00 0.00 H new ATOM 0 HA THR A 30 10.586 -5.467 -9.953 1.00 0.00 H new ATOM 0 HB THR A 30 10.370 -2.639 -11.001 1.00 0.00 H new ATOM 0 HG1 THR A 30 8.073 -2.974 -10.955 1.00 0.00 H new ATOM 0 HG21 THR A 30 9.228 -3.777 -12.878 1.00 0.00 H new ATOM 0 HG22 THR A 30 10.862 -4.429 -12.615 1.00 0.00 H new ATOM 0 HG23 THR A 30 9.440 -5.340 -12.053 1.00 0.00 H new ATOM 485 N PRO A 31 12.963 -5.399 -10.549 1.00 0.00 N ATOM 486 CA PRO A 31 14.304 -5.390 -11.101 1.00 0.00 C ATOM 487 C PRO A 31 14.225 -4.959 -12.566 1.00 0.00 C ATOM 488 O PRO A 31 14.039 -5.793 -13.454 1.00 0.00 O ATOM 489 CB PRO A 31 14.807 -6.824 -10.953 1.00 0.00 C ATOM 490 CG PRO A 31 13.530 -7.669 -10.991 1.00 0.00 C ATOM 491 CD PRO A 31 12.459 -6.754 -10.401 1.00 0.00 C ATOM 0 HA PRO A 31 14.980 -4.697 -10.599 1.00 0.00 H new ATOM 0 HB2 PRO A 31 15.488 -7.094 -11.760 1.00 0.00 H new ATOM 0 HB3 PRO A 31 15.350 -6.962 -10.018 1.00 0.00 H new ATOM 0 HG2 PRO A 31 13.281 -7.969 -12.009 1.00 0.00 H new ATOM 0 HG3 PRO A 31 13.639 -8.583 -10.407 1.00 0.00 H new ATOM 0 HD2 PRO A 31 11.510 -6.877 -10.924 1.00 0.00 H new ATOM 0 HD3 PRO A 31 12.278 -6.991 -9.352 1.00 0.00 H new ATOM 499 N VAL A 32 14.366 -3.658 -12.821 1.00 0.00 N ATOM 500 CA VAL A 32 14.213 -3.111 -14.165 1.00 0.00 C ATOM 501 C VAL A 32 15.394 -3.488 -15.056 1.00 0.00 C ATOM 502 O VAL A 32 15.354 -3.242 -16.261 1.00 0.00 O ATOM 503 CB VAL A 32 14.045 -1.590 -14.096 1.00 0.00 C ATOM 504 CG1 VAL A 32 12.785 -1.247 -13.304 1.00 0.00 C ATOM 505 CG2 VAL A 32 15.248 -0.920 -13.422 1.00 0.00 C ATOM 0 H VAL A 32 14.587 -2.962 -12.109 1.00 0.00 H new ATOM 0 HA VAL A 32 13.317 -3.543 -14.611 1.00 0.00 H new ATOM 0 HB VAL A 32 13.967 -1.219 -15.118 1.00 0.00 H new ATOM 0 HG11 VAL A 32 12.668 -0.164 -13.257 1.00 0.00 H new ATOM 0 HG12 VAL A 32 11.916 -1.684 -13.795 1.00 0.00 H new ATOM 0 HG13 VAL A 32 12.870 -1.647 -12.294 1.00 0.00 H new ATOM 0 HG21 VAL A 32 15.094 0.159 -13.391 1.00 0.00 H new ATOM 0 HG22 VAL A 32 15.355 -1.301 -12.406 1.00 0.00 H new ATOM 0 HG23 VAL A 32 16.152 -1.141 -13.989 1.00 0.00 H new ATOM 515 N GLY A 33 16.450 -4.084 -14.489 1.00 0.00 N ATOM 516 CA GLY A 33 17.582 -4.535 -15.278 1.00 0.00 C ATOM 517 C GLY A 33 18.782 -4.876 -14.406 1.00 0.00 C ATOM 518 O GLY A 33 18.803 -4.581 -13.211 1.00 0.00 O ATOM 0 H GLY A 33 16.536 -4.261 -13.488 1.00 0.00 H new ATOM 0 HA2 GLY A 33 17.294 -5.412 -15.858 1.00 0.00 H new ATOM 0 HA3 GLY A 33 17.860 -3.759 -15.991 1.00 0.00 H new ATOM 522 N THR A 34 19.783 -5.499 -15.031 1.00 0.00 N ATOM 523 CA THR A 34 21.035 -5.859 -14.387 1.00 0.00 C ATOM 524 C THR A 34 22.199 -5.734 -15.358 1.00 0.00 C ATOM 525 O THR A 34 22.080 -6.119 -16.522 1.00 0.00 O ATOM 526 CB THR A 34 20.953 -7.278 -13.806 1.00 0.00 C ATOM 527 OG1 THR A 34 19.780 -7.424 -13.041 1.00 0.00 O ATOM 528 CG2 THR A 34 22.172 -7.571 -12.930 1.00 0.00 C ATOM 0 H THR A 34 19.740 -5.769 -16.014 1.00 0.00 H new ATOM 0 HA THR A 34 21.210 -5.165 -13.565 1.00 0.00 H new ATOM 0 HB THR A 34 20.934 -7.985 -14.635 1.00 0.00 H new ATOM 0 HG1 THR A 34 19.566 -8.376 -12.949 1.00 0.00 H new ATOM 0 HG21 THR A 34 22.096 -8.581 -12.527 1.00 0.00 H new ATOM 0 HG22 THR A 34 23.079 -7.486 -13.529 1.00 0.00 H new ATOM 0 HG23 THR A 34 22.211 -6.855 -12.109 1.00 0.00 H new ATOM 536 N VAL A 35 23.321 -5.196 -14.882 1.00 0.00 N ATOM 537 CA VAL A 35 24.498 -4.983 -15.710 1.00 0.00 C ATOM 538 C VAL A 35 25.770 -5.355 -14.947 1.00 0.00 C ATOM 539 O VAL A 35 25.730 -5.593 -13.739 1.00 0.00 O ATOM 540 CB VAL A 35 24.542 -3.528 -16.211 1.00 0.00 C ATOM 541 CG1 VAL A 35 23.226 -3.127 -16.883 1.00 0.00 C ATOM 542 CG2 VAL A 35 24.787 -2.572 -15.049 1.00 0.00 C ATOM 0 H VAL A 35 23.436 -4.898 -13.913 1.00 0.00 H new ATOM 0 HA VAL A 35 24.438 -5.635 -16.582 1.00 0.00 H new ATOM 0 HB VAL A 35 25.354 -3.465 -16.935 1.00 0.00 H new ATOM 0 HG11 VAL A 35 23.292 -2.094 -17.225 1.00 0.00 H new ATOM 0 HG12 VAL A 35 23.039 -3.780 -17.735 1.00 0.00 H new ATOM 0 HG13 VAL A 35 22.409 -3.221 -16.168 1.00 0.00 H new ATOM 0 HG21 VAL A 35 24.815 -1.548 -15.420 1.00 0.00 H new ATOM 0 HG22 VAL A 35 23.983 -2.672 -14.320 1.00 0.00 H new ATOM 0 HG23 VAL A 35 25.738 -2.812 -14.575 1.00 0.00 H new ATOM 552 N ASP A 36 26.900 -5.406 -15.658 1.00 0.00 N ATOM 553 CA ASP A 36 28.181 -5.791 -15.078 1.00 0.00 C ATOM 554 C ASP A 36 29.326 -4.835 -15.425 1.00 0.00 C ATOM 555 O ASP A 36 30.482 -5.101 -15.095 1.00 0.00 O ATOM 556 CB ASP A 36 28.513 -7.253 -15.402 1.00 0.00 C ATOM 557 CG ASP A 36 28.268 -7.611 -16.870 1.00 0.00 C ATOM 558 OD1 ASP A 36 28.194 -6.675 -17.699 1.00 0.00 O ATOM 559 OD2 ASP A 36 28.157 -8.827 -17.144 1.00 0.00 O ATOM 0 H ASP A 36 26.948 -5.181 -16.652 1.00 0.00 H new ATOM 0 HA ASP A 36 28.070 -5.707 -13.997 1.00 0.00 H new ATOM 0 HB2 ASP A 36 29.557 -7.446 -15.156 1.00 0.00 H new ATOM 0 HB3 ASP A 36 27.911 -7.905 -14.769 1.00 0.00 H new ATOM 564 N THR A 37 29.000 -3.722 -16.093 1.00 0.00 N ATOM 565 CA THR A 37 29.952 -2.660 -16.406 1.00 0.00 C ATOM 566 C THR A 37 29.368 -1.280 -16.142 1.00 0.00 C ATOM 567 O THR A 37 28.150 -1.105 -16.150 1.00 0.00 O ATOM 568 CB THR A 37 30.483 -2.771 -17.838 1.00 0.00 C ATOM 569 OG1 THR A 37 29.538 -2.236 -18.739 1.00 0.00 O ATOM 570 CG2 THR A 37 30.793 -4.216 -18.223 1.00 0.00 C ATOM 0 H THR A 37 28.057 -3.535 -16.433 1.00 0.00 H new ATOM 0 HA THR A 37 30.799 -2.792 -15.733 1.00 0.00 H new ATOM 0 HB THR A 37 31.413 -2.205 -17.889 1.00 0.00 H new ATOM 0 HG1 THR A 37 29.882 -2.307 -19.654 1.00 0.00 H new ATOM 0 HG21 THR A 37 31.167 -4.248 -19.246 1.00 0.00 H new ATOM 0 HG22 THR A 37 31.548 -4.618 -17.548 1.00 0.00 H new ATOM 0 HG23 THR A 37 29.885 -4.815 -18.150 1.00 0.00 H new ATOM 578 N VAL A 38 30.232 -0.291 -15.904 1.00 0.00 N ATOM 579 CA VAL A 38 29.769 1.054 -15.590 1.00 0.00 C ATOM 580 C VAL A 38 29.139 1.750 -16.790 1.00 0.00 C ATOM 581 O VAL A 38 28.312 2.641 -16.619 1.00 0.00 O ATOM 582 CB VAL A 38 30.878 1.899 -14.954 1.00 0.00 C ATOM 583 CG1 VAL A 38 31.743 1.069 -14.003 1.00 0.00 C ATOM 584 CG2 VAL A 38 31.771 2.543 -16.014 1.00 0.00 C ATOM 0 H VAL A 38 31.246 -0.398 -15.923 1.00 0.00 H new ATOM 0 HA VAL A 38 28.977 0.947 -14.849 1.00 0.00 H new ATOM 0 HB VAL A 38 30.381 2.684 -14.385 1.00 0.00 H new ATOM 0 HG11 VAL A 38 32.519 1.701 -13.571 1.00 0.00 H new ATOM 0 HG12 VAL A 38 31.120 0.663 -13.206 1.00 0.00 H new ATOM 0 HG13 VAL A 38 32.207 0.251 -14.554 1.00 0.00 H new ATOM 0 HG21 VAL A 38 32.546 3.134 -15.526 1.00 0.00 H new ATOM 0 HG22 VAL A 38 32.236 1.765 -16.620 1.00 0.00 H new ATOM 0 HG23 VAL A 38 31.169 3.189 -16.653 1.00 0.00 H new ATOM 594 N ALA A 39 29.525 1.349 -18.003 1.00 0.00 N ATOM 595 CA ALA A 39 28.971 1.934 -19.214 1.00 0.00 C ATOM 596 C ALA A 39 27.497 1.552 -19.340 1.00 0.00 C ATOM 597 O ALA A 39 26.688 2.351 -19.816 1.00 0.00 O ATOM 598 CB ALA A 39 29.762 1.432 -20.420 1.00 0.00 C ATOM 0 H ALA A 39 30.220 0.621 -18.167 1.00 0.00 H new ATOM 0 HA ALA A 39 29.044 3.021 -19.170 1.00 0.00 H new ATOM 0 HB1 ALA A 39 29.351 1.867 -21.331 1.00 0.00 H new ATOM 0 HB2 ALA A 39 30.807 1.725 -20.317 1.00 0.00 H new ATOM 0 HB3 ALA A 39 29.693 0.346 -20.474 1.00 0.00 H new ATOM 604 N GLY A 40 27.142 0.338 -18.909 1.00 0.00 N ATOM 605 CA GLY A 40 25.760 -0.117 -18.932 1.00 0.00 C ATOM 606 C GLY A 40 24.997 0.432 -17.735 1.00 0.00 C ATOM 607 O GLY A 40 23.797 0.683 -17.830 1.00 0.00 O ATOM 0 H GLY A 40 27.801 -0.347 -18.539 1.00 0.00 H new ATOM 0 HA2 GLY A 40 25.280 0.206 -19.856 1.00 0.00 H new ATOM 0 HA3 GLY A 40 25.730 -1.207 -18.921 1.00 0.00 H new ATOM 611 N ALA A 41 25.686 0.616 -16.605 1.00 0.00 N ATOM 612 CA ALA A 41 25.059 1.105 -15.392 1.00 0.00 C ATOM 613 C ALA A 41 24.711 2.587 -15.516 1.00 0.00 C ATOM 614 O ALA A 41 23.668 3.015 -15.026 1.00 0.00 O ATOM 615 CB ALA A 41 26.001 0.864 -14.216 1.00 0.00 C ATOM 0 H ALA A 41 26.685 0.430 -16.514 1.00 0.00 H new ATOM 0 HA ALA A 41 24.126 0.566 -15.225 1.00 0.00 H new ATOM 0 HB1 ALA A 41 25.538 1.228 -13.299 1.00 0.00 H new ATOM 0 HB2 ALA A 41 26.201 -0.203 -14.122 1.00 0.00 H new ATOM 0 HB3 ALA A 41 26.938 1.395 -14.386 1.00 0.00 H new ATOM 621 N LEU A 42 25.573 3.367 -16.172 1.00 0.00 N ATOM 622 CA LEU A 42 25.322 4.786 -16.388 1.00 0.00 C ATOM 623 C LEU A 42 24.207 4.965 -17.410 1.00 0.00 C ATOM 624 O LEU A 42 23.405 5.890 -17.294 1.00 0.00 O ATOM 625 CB LEU A 42 26.607 5.456 -16.889 1.00 0.00 C ATOM 626 CG LEU A 42 27.637 5.622 -15.770 1.00 0.00 C ATOM 627 CD1 LEU A 42 28.979 6.022 -16.378 1.00 0.00 C ATOM 628 CD2 LEU A 42 27.194 6.714 -14.795 1.00 0.00 C ATOM 0 H LEU A 42 26.454 3.034 -16.563 1.00 0.00 H new ATOM 0 HA LEU A 42 25.015 5.249 -15.450 1.00 0.00 H new ATOM 0 HB2 LEU A 42 27.038 4.860 -17.693 1.00 0.00 H new ATOM 0 HB3 LEU A 42 26.367 6.433 -17.310 1.00 0.00 H new ATOM 0 HG LEU A 42 27.728 4.677 -15.234 1.00 0.00 H new ATOM 0 HD11 LEU A 42 29.717 6.142 -15.585 1.00 0.00 H new ATOM 0 HD12 LEU A 42 29.311 5.247 -17.068 1.00 0.00 H new ATOM 0 HD13 LEU A 42 28.869 6.964 -16.916 1.00 0.00 H new ATOM 0 HD21 LEU A 42 27.937 6.820 -14.005 1.00 0.00 H new ATOM 0 HD22 LEU A 42 27.094 7.659 -15.328 1.00 0.00 H new ATOM 0 HD23 LEU A 42 26.234 6.442 -14.356 1.00 0.00 H new ATOM 640 N ALA A 43 24.151 4.083 -18.414 1.00 0.00 N ATOM 641 CA ALA A 43 23.136 4.160 -19.450 1.00 0.00 C ATOM 642 C ALA A 43 21.771 3.749 -18.901 1.00 0.00 C ATOM 643 O ALA A 43 20.748 4.234 -19.375 1.00 0.00 O ATOM 644 CB ALA A 43 23.544 3.250 -20.609 1.00 0.00 C ATOM 0 H ALA A 43 24.804 3.307 -18.524 1.00 0.00 H new ATOM 0 HA ALA A 43 23.055 5.188 -19.803 1.00 0.00 H new ATOM 0 HB1 ALA A 43 22.789 3.299 -21.394 1.00 0.00 H new ATOM 0 HB2 ALA A 43 24.504 3.577 -21.008 1.00 0.00 H new ATOM 0 HB3 ALA A 43 23.630 2.224 -20.253 1.00 0.00 H new ATOM 650 N ARG A 44 21.748 2.859 -17.903 1.00 0.00 N ATOM 651 CA ARG A 44 20.501 2.384 -17.320 1.00 0.00 C ATOM 652 C ARG A 44 19.911 3.386 -16.335 1.00 0.00 C ATOM 653 O ARG A 44 18.706 3.626 -16.363 1.00 0.00 O ATOM 654 CB ARG A 44 20.736 1.032 -16.635 1.00 0.00 C ATOM 655 CG ARG A 44 20.738 -0.122 -17.641 1.00 0.00 C ATOM 656 CD ARG A 44 19.393 -0.205 -18.362 1.00 0.00 C ATOM 657 NE ARG A 44 19.219 -1.515 -19.002 1.00 0.00 N ATOM 658 CZ ARG A 44 18.179 -2.324 -18.781 1.00 0.00 C ATOM 659 NH1 ARG A 44 17.212 -1.966 -17.941 1.00 0.00 N ATOM 660 NH2 ARG A 44 18.108 -3.497 -19.400 1.00 0.00 N ATOM 0 H ARG A 44 22.586 2.455 -17.485 1.00 0.00 H new ATOM 0 HA ARG A 44 19.777 2.265 -18.126 1.00 0.00 H new ATOM 0 HB2 ARG A 44 21.688 1.054 -16.105 1.00 0.00 H new ATOM 0 HB3 ARG A 44 19.960 0.863 -15.889 1.00 0.00 H new ATOM 0 HG2 ARG A 44 21.538 0.022 -18.367 1.00 0.00 H new ATOM 0 HG3 ARG A 44 20.940 -1.061 -17.126 1.00 0.00 H new ATOM 0 HD2 ARG A 44 18.584 -0.033 -17.652 1.00 0.00 H new ATOM 0 HD3 ARG A 44 19.330 0.582 -19.113 1.00 0.00 H new ATOM 0 HE ARG A 44 19.937 -1.827 -19.656 1.00 0.00 H new ATOM 0 HH11 ARG A 44 17.261 -1.068 -17.460 1.00 0.00 H new ATOM 0 HH12 ARG A 44 16.421 -2.590 -17.778 1.00 0.00 H new ATOM 0 HH21 ARG A 44 18.847 -3.780 -20.044 1.00 0.00 H new ATOM 0 HH22 ARG A 44 17.314 -4.115 -19.232 1.00 0.00 H new ATOM 674 N VAL A 45 20.737 3.972 -15.463 1.00 0.00 N ATOM 675 CA VAL A 45 20.232 4.902 -14.458 1.00 0.00 C ATOM 676 C VAL A 45 19.821 6.241 -15.072 1.00 0.00 C ATOM 677 O VAL A 45 19.010 6.962 -14.495 1.00 0.00 O ATOM 678 CB VAL A 45 21.247 5.057 -13.313 1.00 0.00 C ATOM 679 CG1 VAL A 45 22.444 5.921 -13.706 1.00 0.00 C ATOM 680 CG2 VAL A 45 20.567 5.696 -12.106 1.00 0.00 C ATOM 0 H VAL A 45 21.745 3.819 -15.435 1.00 0.00 H new ATOM 0 HA VAL A 45 19.321 4.483 -14.031 1.00 0.00 H new ATOM 0 HB VAL A 45 21.611 4.058 -13.075 1.00 0.00 H new ATOM 0 HG11 VAL A 45 23.130 5.998 -12.862 1.00 0.00 H new ATOM 0 HG12 VAL A 45 22.959 5.466 -14.552 1.00 0.00 H new ATOM 0 HG13 VAL A 45 22.098 6.916 -13.985 1.00 0.00 H new ATOM 0 HG21 VAL A 45 21.289 5.804 -11.297 1.00 0.00 H new ATOM 0 HG22 VAL A 45 20.182 6.678 -12.383 1.00 0.00 H new ATOM 0 HG23 VAL A 45 19.743 5.063 -11.775 1.00 0.00 H new ATOM 690 N GLU A 46 20.376 6.581 -16.241 1.00 0.00 N ATOM 691 CA GLU A 46 20.028 7.807 -16.940 1.00 0.00 C ATOM 692 C GLU A 46 18.741 7.638 -17.755 1.00 0.00 C ATOM 693 O GLU A 46 17.945 8.574 -17.857 1.00 0.00 O ATOM 694 CB GLU A 46 21.199 8.198 -17.847 1.00 0.00 C ATOM 695 CG GLU A 46 20.852 9.327 -18.824 1.00 0.00 C ATOM 696 CD GLU A 46 20.527 10.648 -18.121 1.00 0.00 C ATOM 697 OE1 GLU A 46 20.600 10.687 -16.873 1.00 0.00 O ATOM 698 OE2 GLU A 46 20.204 11.617 -18.851 1.00 0.00 O ATOM 0 H GLU A 46 21.074 6.013 -16.720 1.00 0.00 H new ATOM 0 HA GLU A 46 19.842 8.597 -16.213 1.00 0.00 H new ATOM 0 HB2 GLU A 46 22.042 8.507 -17.229 1.00 0.00 H new ATOM 0 HB3 GLU A 46 21.521 7.323 -18.412 1.00 0.00 H new ATOM 0 HG2 GLU A 46 21.689 9.481 -19.505 1.00 0.00 H new ATOM 0 HG3 GLU A 46 19.998 9.025 -19.431 1.00 0.00 H new ATOM 705 N ASP A 47 18.531 6.452 -18.335 1.00 0.00 N ATOM 706 CA ASP A 47 17.410 6.219 -19.236 1.00 0.00 C ATOM 707 C ASP A 47 16.166 5.709 -18.506 1.00 0.00 C ATOM 708 O ASP A 47 15.044 6.084 -18.841 1.00 0.00 O ATOM 709 CB ASP A 47 17.847 5.220 -20.316 1.00 0.00 C ATOM 710 CG ASP A 47 16.716 4.876 -21.287 1.00 0.00 C ATOM 711 OD1 ASP A 47 15.861 5.756 -21.526 1.00 0.00 O ATOM 712 OD2 ASP A 47 16.722 3.727 -21.786 1.00 0.00 O ATOM 0 H ASP A 47 19.129 5.638 -18.192 1.00 0.00 H new ATOM 0 HA ASP A 47 17.132 7.171 -19.688 1.00 0.00 H new ATOM 0 HB2 ASP A 47 18.686 5.636 -20.873 1.00 0.00 H new ATOM 0 HB3 ASP A 47 18.203 4.307 -19.839 1.00 0.00 H new ATOM 717 N GLY A 48 16.368 4.852 -17.501 1.00 0.00 N ATOM 718 CA GLY A 48 15.273 4.148 -16.846 1.00 0.00 C ATOM 719 C GLY A 48 14.540 5.012 -15.820 1.00 0.00 C ATOM 720 O GLY A 48 13.457 4.637 -15.374 1.00 0.00 O ATOM 0 H GLY A 48 17.290 4.631 -17.124 1.00 0.00 H new ATOM 0 HA2 GLY A 48 14.564 3.808 -17.600 1.00 0.00 H new ATOM 0 HA3 GLY A 48 15.664 3.258 -16.352 1.00 0.00 H new ATOM 724 N GLY A 49 15.110 6.161 -15.440 1.00 0.00 N ATOM 725 CA GLY A 49 14.513 6.997 -14.405 1.00 0.00 C ATOM 726 C GLY A 49 14.403 6.205 -13.100 1.00 0.00 C ATOM 727 O GLY A 49 13.454 6.375 -12.336 1.00 0.00 O ATOM 0 H GLY A 49 15.977 6.527 -15.833 1.00 0.00 H new ATOM 0 HA2 GLY A 49 15.120 7.889 -14.250 1.00 0.00 H new ATOM 0 HA3 GLY A 49 13.526 7.334 -14.721 1.00 0.00 H new ATOM 731 N ILE A 50 15.387 5.334 -12.858 1.00 0.00 N ATOM 732 CA ILE A 50 15.357 4.345 -11.791 1.00 0.00 C ATOM 733 C ILE A 50 15.384 5.012 -10.414 1.00 0.00 C ATOM 734 O ILE A 50 16.011 6.058 -10.238 1.00 0.00 O ATOM 735 CB ILE A 50 16.544 3.389 -11.982 1.00 0.00 C ATOM 736 CG1 ILE A 50 16.556 2.903 -13.441 1.00 0.00 C ATOM 737 CG2 ILE A 50 16.435 2.216 -11.003 1.00 0.00 C ATOM 738 CD1 ILE A 50 17.621 1.837 -13.678 1.00 0.00 C ATOM 0 H ILE A 50 16.242 5.301 -13.413 1.00 0.00 H new ATOM 0 HA ILE A 50 14.427 3.779 -11.839 1.00 0.00 H new ATOM 0 HB ILE A 50 17.482 3.904 -11.774 1.00 0.00 H new ATOM 0 HG12 ILE A 50 15.576 2.500 -13.697 1.00 0.00 H new ATOM 0 HG13 ILE A 50 16.736 3.749 -14.104 1.00 0.00 H new ATOM 0 HG21 ILE A 50 17.281 1.543 -11.146 1.00 0.00 H new ATOM 0 HG22 ILE A 50 16.440 2.594 -9.981 1.00 0.00 H new ATOM 0 HG23 ILE A 50 15.506 1.675 -11.185 1.00 0.00 H new ATOM 0 HD11 ILE A 50 17.595 1.522 -14.721 1.00 0.00 H new ATOM 0 HD12 ILE A 50 18.604 2.247 -13.448 1.00 0.00 H new ATOM 0 HD13 ILE A 50 17.426 0.979 -13.035 1.00 0.00 H new ATOM 750 N ASP A 51 14.701 4.403 -9.441 1.00 0.00 N ATOM 751 CA ASP A 51 14.519 4.997 -8.122 1.00 0.00 C ATOM 752 C ASP A 51 15.762 4.785 -7.263 1.00 0.00 C ATOM 753 O ASP A 51 16.069 5.625 -6.420 1.00 0.00 O ATOM 754 CB ASP A 51 13.324 4.335 -7.430 1.00 0.00 C ATOM 755 CG ASP A 51 12.060 4.344 -8.280 1.00 0.00 C ATOM 756 OD1 ASP A 51 11.955 5.213 -9.176 1.00 0.00 O ATOM 757 OD2 ASP A 51 11.201 3.473 -8.017 1.00 0.00 O ATOM 0 H ASP A 51 14.262 3.489 -9.548 1.00 0.00 H new ATOM 0 HA ASP A 51 14.345 6.066 -8.242 1.00 0.00 H new ATOM 0 HB2 ASP A 51 13.580 3.305 -7.182 1.00 0.00 H new ATOM 0 HB3 ASP A 51 13.126 4.849 -6.490 1.00 0.00 H new ATOM 762 N ALA A 52 16.478 3.676 -7.469 1.00 0.00 N ATOM 763 CA ALA A 52 17.677 3.357 -6.703 1.00 0.00 C ATOM 764 C ALA A 52 18.517 2.326 -7.458 1.00 0.00 C ATOM 765 O ALA A 52 18.074 1.782 -8.467 1.00 0.00 O ATOM 766 CB ALA A 52 17.271 2.805 -5.336 1.00 0.00 C ATOM 0 H ALA A 52 16.239 2.977 -8.172 1.00 0.00 H new ATOM 0 HA ALA A 52 18.272 4.260 -6.565 1.00 0.00 H new ATOM 0 HB1 ALA A 52 18.165 2.565 -4.760 1.00 0.00 H new ATOM 0 HB2 ALA A 52 16.685 3.552 -4.801 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.674 1.903 -5.471 1.00 0.00 H new ATOM 772 N ALA A 53 19.728 2.054 -6.974 1.00 0.00 N ATOM 773 CA ALA A 53 20.602 1.082 -7.620 1.00 0.00 C ATOM 774 C ALA A 53 21.489 0.370 -6.600 1.00 0.00 C ATOM 775 O ALA A 53 21.609 0.801 -5.456 1.00 0.00 O ATOM 776 CB ALA A 53 21.450 1.795 -8.672 1.00 0.00 C ATOM 0 H ALA A 53 20.123 2.491 -6.141 1.00 0.00 H new ATOM 0 HA ALA A 53 19.990 0.320 -8.102 1.00 0.00 H new ATOM 0 HB1 ALA A 53 22.106 1.074 -9.160 1.00 0.00 H new ATOM 0 HB2 ALA A 53 20.798 2.253 -9.416 1.00 0.00 H new ATOM 0 HB3 ALA A 53 22.052 2.567 -8.192 1.00 0.00 H new ATOM 782 N ILE A 54 22.116 -0.731 -7.029 1.00 0.00 N ATOM 783 CA ILE A 54 23.050 -1.498 -6.214 1.00 0.00 C ATOM 784 C ILE A 54 24.362 -1.652 -6.981 1.00 0.00 C ATOM 785 O ILE A 54 24.338 -1.805 -8.201 1.00 0.00 O ATOM 786 CB ILE A 54 22.443 -2.857 -5.836 1.00 0.00 C ATOM 787 CG1 ILE A 54 21.021 -2.664 -5.284 1.00 0.00 C ATOM 788 CG2 ILE A 54 23.332 -3.548 -4.798 1.00 0.00 C ATOM 789 CD1 ILE A 54 20.416 -3.995 -4.833 1.00 0.00 C ATOM 0 H ILE A 54 21.984 -1.115 -7.965 1.00 0.00 H new ATOM 0 HA ILE A 54 23.253 -0.972 -5.281 1.00 0.00 H new ATOM 0 HB ILE A 54 22.386 -3.486 -6.725 1.00 0.00 H new ATOM 0 HG12 ILE A 54 21.045 -1.970 -4.444 1.00 0.00 H new ATOM 0 HG13 ILE A 54 20.389 -2.215 -6.050 1.00 0.00 H new ATOM 0 HG21 ILE A 54 22.899 -4.512 -4.532 1.00 0.00 H new ATOM 0 HG22 ILE A 54 24.327 -3.700 -5.215 1.00 0.00 H new ATOM 0 HG23 ILE A 54 23.404 -2.924 -3.907 1.00 0.00 H new ATOM 0 HD11 ILE A 54 19.411 -3.826 -4.448 1.00 0.00 H new ATOM 0 HD12 ILE A 54 20.369 -4.679 -5.680 1.00 0.00 H new ATOM 0 HD13 ILE A 54 21.036 -4.430 -4.049 1.00 0.00 H new ATOM 801 N LEU A 55 25.501 -1.612 -6.280 1.00 0.00 N ATOM 802 CA LEU A 55 26.804 -1.557 -6.930 1.00 0.00 C ATOM 803 C LEU A 55 27.842 -2.441 -6.237 1.00 0.00 C ATOM 804 O LEU A 55 28.070 -2.309 -5.040 1.00 0.00 O ATOM 805 CB LEU A 55 27.284 -0.103 -6.947 1.00 0.00 C ATOM 806 CG LEU A 55 28.650 0.042 -7.627 1.00 0.00 C ATOM 807 CD1 LEU A 55 28.560 -0.348 -9.103 1.00 0.00 C ATOM 808 CD2 LEU A 55 29.105 1.494 -7.534 1.00 0.00 C ATOM 0 H LEU A 55 25.541 -1.617 -5.261 1.00 0.00 H new ATOM 0 HA LEU A 55 26.692 -1.938 -7.945 1.00 0.00 H new ATOM 0 HB2 LEU A 55 26.552 0.514 -7.468 1.00 0.00 H new ATOM 0 HB3 LEU A 55 27.346 0.270 -5.925 1.00 0.00 H new ATOM 0 HG LEU A 55 29.360 -0.615 -7.125 1.00 0.00 H new ATOM 0 HD11 LEU A 55 29.539 -0.239 -9.569 1.00 0.00 H new ATOM 0 HD12 LEU A 55 28.232 -1.384 -9.186 1.00 0.00 H new ATOM 0 HD13 LEU A 55 27.844 0.300 -9.608 1.00 0.00 H new ATOM 0 HD21 LEU A 55 30.076 1.602 -8.016 1.00 0.00 H new ATOM 0 HD22 LEU A 55 28.379 2.136 -8.033 1.00 0.00 H new ATOM 0 HD23 LEU A 55 29.186 1.784 -6.486 1.00 0.00 H new ATOM 820 N ASP A 56 28.471 -3.338 -7.000 1.00 0.00 N ATOM 821 CA ASP A 56 29.571 -4.159 -6.507 1.00 0.00 C ATOM 822 C ASP A 56 30.837 -3.298 -6.486 1.00 0.00 C ATOM 823 O ASP A 56 31.047 -2.476 -7.377 1.00 0.00 O ATOM 824 CB ASP A 56 29.727 -5.368 -7.432 1.00 0.00 C ATOM 825 CG ASP A 56 30.726 -6.404 -6.909 1.00 0.00 C ATOM 826 OD1 ASP A 56 31.286 -6.182 -5.814 1.00 0.00 O ATOM 827 OD2 ASP A 56 30.916 -7.415 -7.624 1.00 0.00 O ATOM 0 H ASP A 56 28.230 -3.513 -7.976 1.00 0.00 H new ATOM 0 HA ASP A 56 29.381 -4.523 -5.497 1.00 0.00 H new ATOM 0 HB2 ASP A 56 28.755 -5.844 -7.564 1.00 0.00 H new ATOM 0 HB3 ASP A 56 30.050 -5.026 -8.415 1.00 0.00 H new ATOM 832 N VAL A 57 31.681 -3.485 -5.470 1.00 0.00 N ATOM 833 CA VAL A 57 32.893 -2.685 -5.306 1.00 0.00 C ATOM 834 C VAL A 57 33.844 -2.931 -6.476 1.00 0.00 C ATOM 835 O VAL A 57 34.529 -2.005 -6.912 1.00 0.00 O ATOM 836 CB VAL A 57 33.573 -3.051 -3.981 1.00 0.00 C ATOM 837 CG1 VAL A 57 34.910 -2.320 -3.833 1.00 0.00 C ATOM 838 CG2 VAL A 57 32.673 -2.652 -2.814 1.00 0.00 C ATOM 0 H VAL A 57 31.545 -4.189 -4.744 1.00 0.00 H new ATOM 0 HA VAL A 57 32.629 -1.628 -5.290 1.00 0.00 H new ATOM 0 HB VAL A 57 33.749 -4.127 -3.978 1.00 0.00 H new ATOM 0 HG11 VAL A 57 35.373 -2.596 -2.885 1.00 0.00 H new ATOM 0 HG12 VAL A 57 35.570 -2.599 -4.654 1.00 0.00 H new ATOM 0 HG13 VAL A 57 34.740 -1.243 -3.854 1.00 0.00 H new ATOM 0 HG21 VAL A 57 33.159 -2.913 -1.874 1.00 0.00 H new ATOM 0 HG22 VAL A 57 32.494 -1.577 -2.843 1.00 0.00 H new ATOM 0 HG23 VAL A 57 31.723 -3.180 -2.890 1.00 0.00 H new ATOM 848 N ASN A 58 33.882 -4.164 -6.988 1.00 0.00 N ATOM 849 CA ASN A 58 34.728 -4.509 -8.120 1.00 0.00 C ATOM 850 C ASN A 58 33.890 -5.178 -9.204 1.00 0.00 C ATOM 851 O ASN A 58 33.300 -6.232 -8.980 1.00 0.00 O ATOM 852 CB ASN A 58 35.871 -5.425 -7.669 1.00 0.00 C ATOM 853 CG ASN A 58 36.732 -4.786 -6.591 1.00 0.00 C ATOM 854 OD1 ASN A 58 37.074 -3.611 -6.676 1.00 0.00 O ATOM 855 ND2 ASN A 58 37.088 -5.559 -5.571 1.00 0.00 N ATOM 0 H ASN A 58 33.329 -4.942 -6.628 1.00 0.00 H new ATOM 0 HA ASN A 58 35.166 -3.600 -8.531 1.00 0.00 H new ATOM 0 HB2 ASN A 58 35.457 -6.361 -7.293 1.00 0.00 H new ATOM 0 HB3 ASN A 58 36.494 -5.675 -8.528 1.00 0.00 H new ATOM 0 HD21 ASN A 58 37.667 -5.180 -4.821 1.00 0.00 H new ATOM 0 HD22 ASN A 58 36.783 -6.532 -5.537 1.00 0.00 H new ATOM 862 N LEU A 59 33.843 -4.557 -10.383 1.00 0.00 N ATOM 863 CA LEU A 59 33.137 -5.097 -11.535 1.00 0.00 C ATOM 864 C LEU A 59 34.074 -6.034 -12.296 1.00 0.00 C ATOM 865 O LEU A 59 35.201 -6.272 -11.865 1.00 0.00 O ATOM 866 CB LEU A 59 32.651 -3.936 -12.408 1.00 0.00 C ATOM 867 CG LEU A 59 31.240 -3.492 -11.998 1.00 0.00 C ATOM 868 CD1 LEU A 59 31.125 -3.259 -10.496 1.00 0.00 C ATOM 869 CD2 LEU A 59 30.909 -2.185 -12.711 1.00 0.00 C ATOM 0 H LEU A 59 34.297 -3.661 -10.562 1.00 0.00 H new ATOM 0 HA LEU A 59 32.265 -5.673 -11.227 1.00 0.00 H new ATOM 0 HB2 LEU A 59 33.340 -3.096 -12.319 1.00 0.00 H new ATOM 0 HB3 LEU A 59 32.651 -4.239 -13.455 1.00 0.00 H new ATOM 0 HG LEU A 59 30.548 -4.287 -12.275 1.00 0.00 H new ATOM 0 HD11 LEU A 59 30.109 -2.946 -10.253 1.00 0.00 H new ATOM 0 HD12 LEU A 59 31.357 -4.183 -9.966 1.00 0.00 H new ATOM 0 HD13 LEU A 59 31.826 -2.481 -10.194 1.00 0.00 H new ATOM 0 HD21 LEU A 59 29.908 -1.859 -12.428 1.00 0.00 H new ATOM 0 HD22 LEU A 59 31.633 -1.422 -12.426 1.00 0.00 H new ATOM 0 HD23 LEU A 59 30.949 -2.339 -13.789 1.00 0.00 H new ATOM 881 N ARG A 60 33.609 -6.564 -13.433 1.00 0.00 N ATOM 882 CA ARG A 60 34.405 -7.471 -14.249 1.00 0.00 C ATOM 883 C ARG A 60 35.769 -6.869 -14.557 1.00 0.00 C ATOM 884 O ARG A 60 35.902 -5.660 -14.755 1.00 0.00 O ATOM 885 CB ARG A 60 33.642 -7.812 -15.528 1.00 0.00 C ATOM 886 CG ARG A 60 32.653 -8.943 -15.231 1.00 0.00 C ATOM 887 CD ARG A 60 31.833 -9.282 -16.471 1.00 0.00 C ATOM 888 NE ARG A 60 30.982 -10.453 -16.225 1.00 0.00 N ATOM 889 CZ ARG A 60 30.375 -11.151 -17.183 1.00 0.00 C ATOM 890 NH1 ARG A 60 30.506 -10.811 -18.462 1.00 0.00 N ATOM 891 NH2 ARG A 60 29.626 -12.205 -16.858 1.00 0.00 N ATOM 0 H ARG A 60 32.679 -6.375 -13.806 1.00 0.00 H new ATOM 0 HA ARG A 60 34.579 -8.392 -13.693 1.00 0.00 H new ATOM 0 HB2 ARG A 60 33.111 -6.934 -15.895 1.00 0.00 H new ATOM 0 HB3 ARG A 60 34.337 -8.115 -16.311 1.00 0.00 H new ATOM 0 HG2 ARG A 60 33.194 -9.827 -14.894 1.00 0.00 H new ATOM 0 HG3 ARG A 60 31.988 -8.648 -14.419 1.00 0.00 H new ATOM 0 HD2 ARG A 60 31.215 -8.429 -16.749 1.00 0.00 H new ATOM 0 HD3 ARG A 60 32.499 -9.480 -17.311 1.00 0.00 H new ATOM 0 HE ARG A 60 30.847 -10.751 -15.259 1.00 0.00 H new ATOM 0 HH11 ARG A 60 31.077 -10.006 -18.720 1.00 0.00 H new ATOM 0 HH12 ARG A 60 30.035 -11.355 -19.185 1.00 0.00 H new ATOM 0 HH21 ARG A 60 29.520 -12.473 -15.880 1.00 0.00 H new ATOM 0 HH22 ARG A 60 29.159 -12.743 -17.588 1.00 0.00 H new ATOM 905 N GLY A 61 36.789 -7.729 -14.591 1.00 0.00 N ATOM 906 CA GLY A 61 38.176 -7.306 -14.708 1.00 0.00 C ATOM 907 C GLY A 61 38.773 -7.000 -13.332 1.00 0.00 C ATOM 908 O GLY A 61 39.965 -6.714 -13.223 1.00 0.00 O ATOM 0 H GLY A 61 36.670 -8.741 -14.538 1.00 0.00 H new ATOM 0 HA2 GLY A 61 38.759 -8.088 -15.196 1.00 0.00 H new ATOM 0 HA3 GLY A 61 38.238 -6.421 -15.341 1.00 0.00 H new ATOM 912 N GLY A 62 37.946 -7.066 -12.278 1.00 0.00 N ATOM 913 CA GLY A 62 38.379 -6.835 -10.906 1.00 0.00 C ATOM 914 C GLY A 62 38.662 -5.357 -10.635 1.00 0.00 C ATOM 915 O GLY A 62 39.111 -5.004 -9.543 1.00 0.00 O ATOM 0 H GLY A 62 36.953 -7.283 -12.362 1.00 0.00 H new ATOM 0 HA2 GLY A 62 37.610 -7.189 -10.219 1.00 0.00 H new ATOM 0 HA3 GLY A 62 39.278 -7.419 -10.706 1.00 0.00 H new ATOM 919 N GLU A 63 38.409 -4.490 -11.616 1.00 0.00 N ATOM 920 CA GLU A 63 38.639 -3.061 -11.476 1.00 0.00 C ATOM 921 C GLU A 63 37.573 -2.450 -10.570 1.00 0.00 C ATOM 922 O GLU A 63 36.386 -2.748 -10.714 1.00 0.00 O ATOM 923 CB GLU A 63 38.626 -2.417 -12.869 1.00 0.00 C ATOM 924 CG GLU A 63 38.862 -0.904 -12.826 1.00 0.00 C ATOM 925 CD GLU A 63 40.284 -0.537 -12.395 1.00 0.00 C ATOM 926 OE1 GLU A 63 40.574 0.681 -12.371 1.00 0.00 O ATOM 927 OE2 GLU A 63 41.070 -1.463 -12.092 1.00 0.00 O ATOM 0 H GLU A 63 38.040 -4.763 -12.527 1.00 0.00 H new ATOM 0 HA GLU A 63 39.610 -2.878 -11.015 1.00 0.00 H new ATOM 0 HB2 GLU A 63 39.394 -2.882 -13.487 1.00 0.00 H new ATOM 0 HB3 GLU A 63 37.667 -2.617 -13.348 1.00 0.00 H new ATOM 0 HG2 GLU A 63 38.666 -0.482 -13.812 1.00 0.00 H new ATOM 0 HG3 GLU A 63 38.150 -0.449 -12.137 1.00 0.00 H new ATOM 934 N LYS A 64 37.991 -1.593 -9.630 1.00 0.00 N ATOM 935 CA LYS A 64 37.068 -0.927 -8.718 1.00 0.00 C ATOM 936 C LYS A 64 36.224 0.092 -9.478 1.00 0.00 C ATOM 937 O LYS A 64 36.661 0.623 -10.496 1.00 0.00 O ATOM 938 CB LYS A 64 37.827 -0.278 -7.554 1.00 0.00 C ATOM 939 CG LYS A 64 38.581 1.007 -7.940 1.00 0.00 C ATOM 940 CD LYS A 64 39.705 0.750 -8.944 1.00 0.00 C ATOM 941 CE LYS A 64 40.521 2.028 -9.127 1.00 0.00 C ATOM 942 NZ LYS A 64 41.628 1.820 -10.081 1.00 0.00 N ATOM 0 H LYS A 64 38.970 -1.347 -9.485 1.00 0.00 H new ATOM 0 HA LYS A 64 36.395 -1.670 -8.291 1.00 0.00 H new ATOM 0 HB2 LYS A 64 37.121 -0.047 -6.756 1.00 0.00 H new ATOM 0 HB3 LYS A 64 38.539 -0.998 -7.151 1.00 0.00 H new ATOM 0 HG2 LYS A 64 37.877 1.723 -8.364 1.00 0.00 H new ATOM 0 HG3 LYS A 64 38.998 1.463 -7.042 1.00 0.00 H new ATOM 0 HD2 LYS A 64 40.347 -0.057 -8.590 1.00 0.00 H new ATOM 0 HD3 LYS A 64 39.289 0.431 -9.899 1.00 0.00 H new ATOM 0 HE2 LYS A 64 39.874 2.828 -9.485 1.00 0.00 H new ATOM 0 HE3 LYS A 64 40.921 2.348 -8.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 42.186 2.694 -10.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 42.238 1.049 -9.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 41.241 1.570 -11.013 1.00 0.00 H new ATOM 956 N SER A 65 35.016 0.365 -8.981 1.00 0.00 N ATOM 957 CA SER A 65 34.093 1.254 -9.666 1.00 0.00 C ATOM 958 C SER A 65 33.250 2.066 -8.690 1.00 0.00 C ATOM 959 O SER A 65 32.677 1.516 -7.752 1.00 0.00 O ATOM 960 CB SER A 65 33.182 0.433 -10.580 1.00 0.00 C ATOM 961 OG SER A 65 33.921 -0.077 -11.671 1.00 0.00 O ATOM 0 H SER A 65 34.660 -0.020 -8.106 1.00 0.00 H new ATOM 0 HA SER A 65 34.681 1.959 -10.254 1.00 0.00 H new ATOM 0 HB2 SER A 65 32.735 -0.387 -10.019 1.00 0.00 H new ATOM 0 HB3 SER A 65 32.364 1.054 -10.944 1.00 0.00 H new ATOM 0 HG SER A 65 33.753 -1.038 -11.759 1.00 0.00 H new ATOM 967 N THR A 66 33.183 3.379 -8.925 1.00 0.00 N ATOM 968 CA THR A 66 32.290 4.288 -8.216 1.00 0.00 C ATOM 969 C THR A 66 31.591 5.340 -9.087 1.00 0.00 C ATOM 970 O THR A 66 30.971 6.246 -8.529 1.00 0.00 O ATOM 971 CB THR A 66 33.014 4.965 -7.043 1.00 0.00 C ATOM 972 OG1 THR A 66 33.715 6.096 -7.519 1.00 0.00 O ATOM 973 CG2 THR A 66 33.990 4.035 -6.331 1.00 0.00 C ATOM 0 H THR A 66 33.759 3.844 -9.626 1.00 0.00 H new ATOM 0 HA THR A 66 31.490 3.647 -7.846 1.00 0.00 H new ATOM 0 HB THR A 66 32.253 5.252 -6.317 1.00 0.00 H new ATOM 0 HG1 THR A 66 34.177 6.532 -6.773 1.00 0.00 H new ATOM 0 HG21 THR A 66 34.471 4.570 -5.512 1.00 0.00 H new ATOM 0 HG22 THR A 66 33.450 3.175 -5.935 1.00 0.00 H new ATOM 0 HG23 THR A 66 34.748 3.694 -7.036 1.00 0.00 H new ATOM 981 N PRO A 67 31.655 5.273 -10.432 1.00 0.00 N ATOM 982 CA PRO A 67 31.166 6.353 -11.277 1.00 0.00 C ATOM 983 C PRO A 67 29.653 6.494 -11.158 1.00 0.00 C ATOM 984 O PRO A 67 29.120 7.580 -11.382 1.00 0.00 O ATOM 985 CB PRO A 67 31.566 5.980 -12.706 1.00 0.00 C ATOM 986 CG PRO A 67 31.690 4.461 -12.658 1.00 0.00 C ATOM 987 CD PRO A 67 32.169 4.184 -11.239 1.00 0.00 C ATOM 0 HA PRO A 67 31.591 7.312 -10.981 1.00 0.00 H new ATOM 0 HB2 PRO A 67 30.815 6.298 -13.429 1.00 0.00 H new ATOM 0 HB3 PRO A 67 32.506 6.450 -12.995 1.00 0.00 H new ATOM 0 HG2 PRO A 67 30.736 3.975 -12.861 1.00 0.00 H new ATOM 0 HG3 PRO A 67 32.399 4.093 -13.399 1.00 0.00 H new ATOM 0 HD2 PRO A 67 31.799 3.223 -10.881 1.00 0.00 H new ATOM 0 HD3 PRO A 67 33.257 4.143 -11.194 1.00 0.00 H new ATOM 995 N VAL A 68 28.954 5.409 -10.807 1.00 0.00 N ATOM 996 CA VAL A 68 27.513 5.459 -10.619 1.00 0.00 C ATOM 997 C VAL A 68 27.140 5.793 -9.182 1.00 0.00 C ATOM 998 O VAL A 68 26.133 6.449 -8.953 1.00 0.00 O ATOM 999 CB VAL A 68 26.855 4.151 -11.074 1.00 0.00 C ATOM 1000 CG1 VAL A 68 27.336 3.771 -12.472 1.00 0.00 C ATOM 1001 CG2 VAL A 68 27.156 2.995 -10.125 1.00 0.00 C ATOM 0 H VAL A 68 29.368 4.490 -10.649 1.00 0.00 H new ATOM 0 HA VAL A 68 27.131 6.265 -11.245 1.00 0.00 H new ATOM 0 HB VAL A 68 25.779 4.326 -11.077 1.00 0.00 H new ATOM 0 HG11 VAL A 68 26.860 2.840 -12.780 1.00 0.00 H new ATOM 0 HG12 VAL A 68 27.075 4.562 -13.174 1.00 0.00 H new ATOM 0 HG13 VAL A 68 28.418 3.638 -12.461 1.00 0.00 H new ATOM 0 HG21 VAL A 68 26.669 2.090 -10.488 1.00 0.00 H new ATOM 0 HG22 VAL A 68 28.233 2.834 -10.078 1.00 0.00 H new ATOM 0 HG23 VAL A 68 26.781 3.234 -9.130 1.00 0.00 H new ATOM 1011 N ALA A 69 27.936 5.358 -8.207 1.00 0.00 N ATOM 1012 CA ALA A 69 27.623 5.637 -6.812 1.00 0.00 C ATOM 1013 C ALA A 69 27.673 7.143 -6.560 1.00 0.00 C ATOM 1014 O ALA A 69 26.974 7.655 -5.686 1.00 0.00 O ATOM 1015 CB ALA A 69 28.623 4.900 -5.929 1.00 0.00 C ATOM 0 H ALA A 69 28.789 4.819 -8.356 1.00 0.00 H new ATOM 0 HA ALA A 69 26.617 5.291 -6.574 1.00 0.00 H new ATOM 0 HB1 ALA A 69 28.400 5.100 -4.881 1.00 0.00 H new ATOM 0 HB2 ALA A 69 28.553 3.828 -6.116 1.00 0.00 H new ATOM 0 HB3 ALA A 69 29.632 5.243 -6.157 1.00 0.00 H new ATOM 1021 N GLU A 70 28.501 7.850 -7.333 1.00 0.00 N ATOM 1022 CA GLU A 70 28.574 9.300 -7.278 1.00 0.00 C ATOM 1023 C GLU A 70 27.399 9.921 -8.037 1.00 0.00 C ATOM 1024 O GLU A 70 26.972 11.029 -7.719 1.00 0.00 O ATOM 1025 CB GLU A 70 29.902 9.748 -7.890 1.00 0.00 C ATOM 1026 CG GLU A 70 31.092 9.300 -7.031 1.00 0.00 C ATOM 1027 CD GLU A 70 31.207 10.093 -5.726 1.00 0.00 C ATOM 1028 OE1 GLU A 70 30.411 11.044 -5.542 1.00 0.00 O ATOM 1029 OE2 GLU A 70 32.097 9.736 -4.923 1.00 0.00 O ATOM 0 H GLU A 70 29.136 7.428 -8.011 1.00 0.00 H new ATOM 0 HA GLU A 70 28.518 9.632 -6.241 1.00 0.00 H new ATOM 0 HB2 GLU A 70 30.000 9.335 -8.894 1.00 0.00 H new ATOM 0 HB3 GLU A 70 29.911 10.833 -7.990 1.00 0.00 H new ATOM 0 HG2 GLU A 70 30.990 8.240 -6.800 1.00 0.00 H new ATOM 0 HG3 GLU A 70 32.012 9.414 -7.604 1.00 0.00 H new ATOM 1036 N ALA A 71 26.876 9.204 -9.039 1.00 0.00 N ATOM 1037 CA ALA A 71 25.742 9.674 -9.819 1.00 0.00 C ATOM 1038 C ALA A 71 24.438 9.476 -9.042 1.00 0.00 C ATOM 1039 O ALA A 71 23.548 10.321 -9.110 1.00 0.00 O ATOM 1040 CB ALA A 71 25.692 8.915 -11.147 1.00 0.00 C ATOM 0 H ALA A 71 27.229 8.290 -9.324 1.00 0.00 H new ATOM 0 HA ALA A 71 25.860 10.739 -10.017 1.00 0.00 H new ATOM 0 HB1 ALA A 71 24.843 9.265 -11.734 1.00 0.00 H new ATOM 0 HB2 ALA A 71 26.614 9.091 -11.701 1.00 0.00 H new ATOM 0 HB3 ALA A 71 25.583 7.848 -10.952 1.00 0.00 H new ATOM 1046 N LEU A 72 24.318 8.368 -8.301 1.00 0.00 N ATOM 1047 CA LEU A 72 23.145 8.117 -7.471 1.00 0.00 C ATOM 1048 C LEU A 72 23.103 9.152 -6.349 1.00 0.00 C ATOM 1049 O LEU A 72 22.028 9.557 -5.923 1.00 0.00 O ATOM 1050 CB LEU A 72 23.236 6.693 -6.894 1.00 0.00 C ATOM 1051 CG LEU A 72 22.614 5.612 -7.794 1.00 0.00 C ATOM 1052 CD1 LEU A 72 21.099 5.759 -7.831 1.00 0.00 C ATOM 1053 CD2 LEU A 72 23.126 5.633 -9.230 1.00 0.00 C ATOM 0 H LEU A 72 25.023 7.632 -8.263 1.00 0.00 H new ATOM 0 HA LEU A 72 22.232 8.199 -8.061 1.00 0.00 H new ATOM 0 HB2 LEU A 72 24.284 6.448 -6.721 1.00 0.00 H new ATOM 0 HB3 LEU A 72 22.740 6.673 -5.924 1.00 0.00 H new ATOM 0 HG LEU A 72 22.912 4.662 -7.349 1.00 0.00 H new ATOM 0 HD11 LEU A 72 20.674 4.987 -8.472 1.00 0.00 H new ATOM 0 HD12 LEU A 72 20.699 5.654 -6.823 1.00 0.00 H new ATOM 0 HD13 LEU A 72 20.838 6.741 -8.225 1.00 0.00 H new ATOM 0 HD21 LEU A 72 22.640 4.842 -9.801 1.00 0.00 H new ATOM 0 HD22 LEU A 72 22.900 6.598 -9.683 1.00 0.00 H new ATOM 0 HD23 LEU A 72 24.204 5.474 -9.234 1.00 0.00 H new ATOM 1065 N ALA A 73 24.274 9.587 -5.872 1.00 0.00 N ATOM 1066 CA ALA A 73 24.351 10.606 -4.840 1.00 0.00 C ATOM 1067 C ALA A 73 24.046 11.992 -5.416 1.00 0.00 C ATOM 1068 O ALA A 73 23.499 12.842 -4.716 1.00 0.00 O ATOM 1069 CB ALA A 73 25.747 10.575 -4.221 1.00 0.00 C ATOM 0 H ALA A 73 25.180 9.243 -6.191 1.00 0.00 H new ATOM 0 HA ALA A 73 23.605 10.400 -4.072 1.00 0.00 H new ATOM 0 HB1 ALA A 73 25.817 11.336 -3.444 1.00 0.00 H new ATOM 0 HB2 ALA A 73 25.930 9.593 -3.785 1.00 0.00 H new ATOM 0 HB3 ALA A 73 26.491 10.774 -4.992 1.00 0.00 H new ATOM 1075 N ALA A 74 24.394 12.222 -6.687 1.00 0.00 N ATOM 1076 CA ALA A 74 24.136 13.498 -7.338 1.00 0.00 C ATOM 1077 C ALA A 74 22.663 13.612 -7.732 1.00 0.00 C ATOM 1078 O ALA A 74 22.098 14.708 -7.736 1.00 0.00 O ATOM 1079 CB ALA A 74 25.019 13.603 -8.578 1.00 0.00 C ATOM 0 H ALA A 74 24.856 11.534 -7.282 1.00 0.00 H new ATOM 0 HA ALA A 74 24.366 14.310 -6.648 1.00 0.00 H new ATOM 0 HB1 ALA A 74 24.836 14.555 -9.076 1.00 0.00 H new ATOM 0 HB2 ALA A 74 26.067 13.543 -8.285 1.00 0.00 H new ATOM 0 HB3 ALA A 74 24.786 12.786 -9.261 1.00 0.00 H new ATOM 1085 N ARG A 75 22.044 12.476 -8.065 1.00 0.00 N ATOM 1086 CA ARG A 75 20.638 12.408 -8.435 1.00 0.00 C ATOM 1087 C ARG A 75 19.740 12.345 -7.201 1.00 0.00 C ATOM 1088 O ARG A 75 18.518 12.282 -7.329 1.00 0.00 O ATOM 1089 CB ARG A 75 20.426 11.186 -9.331 1.00 0.00 C ATOM 1090 CG ARG A 75 21.148 11.370 -10.668 1.00 0.00 C ATOM 1091 CD ARG A 75 21.236 10.028 -11.398 1.00 0.00 C ATOM 1092 NE ARG A 75 22.076 10.134 -12.596 1.00 0.00 N ATOM 1093 CZ ARG A 75 21.602 10.309 -13.833 1.00 0.00 C ATOM 1094 NH1 ARG A 75 20.298 10.420 -14.055 1.00 0.00 N ATOM 1095 NH2 ARG A 75 22.442 10.377 -14.860 1.00 0.00 N ATOM 0 H ARG A 75 22.515 11.571 -8.084 1.00 0.00 H new ATOM 0 HA ARG A 75 20.365 13.313 -8.978 1.00 0.00 H new ATOM 0 HB2 ARG A 75 20.797 10.292 -8.830 1.00 0.00 H new ATOM 0 HB3 ARG A 75 19.360 11.035 -9.504 1.00 0.00 H new ATOM 0 HG2 ARG A 75 20.615 12.095 -11.283 1.00 0.00 H new ATOM 0 HG3 ARG A 75 22.148 11.769 -10.500 1.00 0.00 H new ATOM 0 HD2 ARG A 75 21.646 9.272 -10.728 1.00 0.00 H new ATOM 0 HD3 ARG A 75 20.236 9.697 -11.679 1.00 0.00 H new ATOM 0 HE ARG A 75 23.087 10.070 -12.477 1.00 0.00 H new ATOM 0 HH11 ARG A 75 19.642 10.372 -13.275 1.00 0.00 H new ATOM 0 HH12 ARG A 75 19.952 10.553 -15.005 1.00 0.00 H new ATOM 0 HH21 ARG A 75 23.447 10.296 -14.703 1.00 0.00 H new ATOM 0 HH22 ARG A 75 22.082 10.511 -15.805 1.00 0.00 H new ATOM 1109 N ASP A 76 20.346 12.358 -6.011 1.00 0.00 N ATOM 1110 CA ASP A 76 19.635 12.285 -4.743 1.00 0.00 C ATOM 1111 C ASP A 76 18.713 11.059 -4.686 1.00 0.00 C ATOM 1112 O ASP A 76 17.538 11.161 -4.330 1.00 0.00 O ATOM 1113 CB ASP A 76 18.902 13.606 -4.474 1.00 0.00 C ATOM 1114 CG ASP A 76 18.159 13.599 -3.138 1.00 0.00 C ATOM 1115 OD1 ASP A 76 18.565 12.815 -2.251 1.00 0.00 O ATOM 1116 OD2 ASP A 76 17.194 14.389 -3.021 1.00 0.00 O ATOM 0 H ASP A 76 21.359 12.421 -5.905 1.00 0.00 H new ATOM 0 HA ASP A 76 20.356 12.148 -3.937 1.00 0.00 H new ATOM 0 HB2 ASP A 76 19.621 14.425 -4.483 1.00 0.00 H new ATOM 0 HB3 ASP A 76 18.193 13.796 -5.280 1.00 0.00 H new ATOM 1121 N ILE A 77 19.255 9.894 -5.047 1.00 0.00 N ATOM 1122 CA ILE A 77 18.533 8.630 -4.976 1.00 0.00 C ATOM 1123 C ILE A 77 19.346 7.602 -4.189 1.00 0.00 C ATOM 1124 O ILE A 77 20.575 7.657 -4.198 1.00 0.00 O ATOM 1125 CB ILE A 77 18.183 8.109 -6.381 1.00 0.00 C ATOM 1126 CG1 ILE A 77 19.141 8.645 -7.449 1.00 0.00 C ATOM 1127 CG2 ILE A 77 16.766 8.556 -6.726 1.00 0.00 C ATOM 1128 CD1 ILE A 77 18.781 8.105 -8.837 1.00 0.00 C ATOM 0 H ILE A 77 20.209 9.804 -5.397 1.00 0.00 H new ATOM 0 HA ILE A 77 17.593 8.799 -4.451 1.00 0.00 H new ATOM 0 HB ILE A 77 18.267 7.022 -6.369 1.00 0.00 H new ATOM 0 HG12 ILE A 77 19.106 9.734 -7.459 1.00 0.00 H new ATOM 0 HG13 ILE A 77 20.163 8.362 -7.199 1.00 0.00 H new ATOM 0 HG21 ILE A 77 16.502 8.194 -7.720 1.00 0.00 H new ATOM 0 HG22 ILE A 77 16.068 8.149 -5.995 1.00 0.00 H new ATOM 0 HG23 ILE A 77 16.714 9.645 -6.710 1.00 0.00 H new ATOM 0 HD11 ILE A 77 19.478 8.503 -9.574 1.00 0.00 H new ATOM 0 HD12 ILE A 77 18.841 7.017 -8.831 1.00 0.00 H new ATOM 0 HD13 ILE A 77 17.767 8.411 -9.095 1.00 0.00 H new ATOM 1140 N PRO A 78 18.679 6.662 -3.502 1.00 0.00 N ATOM 1141 CA PRO A 78 19.320 5.688 -2.638 1.00 0.00 C ATOM 1142 C PRO A 78 20.224 4.728 -3.406 1.00 0.00 C ATOM 1143 O PRO A 78 20.036 4.505 -4.604 1.00 0.00 O ATOM 1144 CB PRO A 78 18.184 4.923 -1.954 1.00 0.00 C ATOM 1145 CG PRO A 78 16.938 5.776 -2.182 1.00 0.00 C ATOM 1146 CD PRO A 78 17.245 6.505 -3.483 1.00 0.00 C ATOM 0 HA PRO A 78 19.970 6.191 -1.922 1.00 0.00 H new ATOM 0 HB2 PRO A 78 18.065 3.928 -2.382 1.00 0.00 H new ATOM 0 HB3 PRO A 78 18.382 4.790 -0.890 1.00 0.00 H new ATOM 0 HG2 PRO A 78 16.041 5.163 -2.267 1.00 0.00 H new ATOM 0 HG3 PRO A 78 16.772 6.473 -1.360 1.00 0.00 H new ATOM 0 HD2 PRO A 78 16.900 5.934 -4.345 1.00 0.00 H new ATOM 0 HD3 PRO A 78 16.743 7.472 -3.520 1.00 0.00 H new ATOM 1154 N PHE A 79 21.205 4.156 -2.706 1.00 0.00 N ATOM 1155 CA PHE A 79 22.097 3.166 -3.288 1.00 0.00 C ATOM 1156 C PHE A 79 22.670 2.213 -2.241 1.00 0.00 C ATOM 1157 O PHE A 79 22.933 2.618 -1.108 1.00 0.00 O ATOM 1158 CB PHE A 79 23.215 3.854 -4.075 1.00 0.00 C ATOM 1159 CG PHE A 79 23.980 4.895 -3.290 1.00 0.00 C ATOM 1160 CD1 PHE A 79 23.503 6.209 -3.213 1.00 0.00 C ATOM 1161 CD2 PHE A 79 25.174 4.548 -2.644 1.00 0.00 C ATOM 1162 CE1 PHE A 79 24.219 7.180 -2.496 1.00 0.00 C ATOM 1163 CE2 PHE A 79 25.887 5.518 -1.921 1.00 0.00 C ATOM 1164 CZ PHE A 79 25.411 6.834 -1.849 1.00 0.00 C ATOM 0 H PHE A 79 21.398 4.367 -1.727 1.00 0.00 H new ATOM 0 HA PHE A 79 21.506 2.558 -3.974 1.00 0.00 H new ATOM 0 HB2 PHE A 79 23.914 3.096 -4.428 1.00 0.00 H new ATOM 0 HB3 PHE A 79 22.784 4.326 -4.958 1.00 0.00 H new ATOM 0 HD1 PHE A 79 22.581 6.476 -3.707 1.00 0.00 H new ATOM 0 HD2 PHE A 79 25.546 3.536 -2.702 1.00 0.00 H new ATOM 0 HE1 PHE A 79 23.850 8.194 -2.443 1.00 0.00 H new ATOM 0 HE2 PHE A 79 26.805 5.249 -1.419 1.00 0.00 H new ATOM 0 HZ PHE A 79 25.963 7.580 -1.296 1.00 0.00 H new ATOM 1174 N VAL A 80 22.868 0.946 -2.620 1.00 0.00 N ATOM 1175 CA VAL A 80 23.492 -0.051 -1.758 1.00 0.00 C ATOM 1176 C VAL A 80 24.750 -0.585 -2.433 1.00 0.00 C ATOM 1177 O VAL A 80 24.811 -0.662 -3.658 1.00 0.00 O ATOM 1178 CB VAL A 80 22.523 -1.207 -1.475 1.00 0.00 C ATOM 1179 CG1 VAL A 80 23.149 -2.229 -0.527 1.00 0.00 C ATOM 1180 CG2 VAL A 80 21.243 -0.726 -0.815 1.00 0.00 C ATOM 0 H VAL A 80 22.598 0.587 -3.536 1.00 0.00 H new ATOM 0 HA VAL A 80 23.753 0.418 -0.809 1.00 0.00 H new ATOM 0 HB VAL A 80 22.303 -1.654 -2.444 1.00 0.00 H new ATOM 0 HG11 VAL A 80 22.441 -3.037 -0.344 1.00 0.00 H new ATOM 0 HG12 VAL A 80 24.055 -2.636 -0.977 1.00 0.00 H new ATOM 0 HG13 VAL A 80 23.399 -1.744 0.417 1.00 0.00 H new ATOM 0 HG21 VAL A 80 20.586 -1.576 -0.633 1.00 0.00 H new ATOM 0 HG22 VAL A 80 21.482 -0.242 0.132 1.00 0.00 H new ATOM 0 HG23 VAL A 80 20.741 -0.014 -1.470 1.00 0.00 H new ATOM 1190 N PHE A 81 25.751 -0.954 -1.640 1.00 0.00 N ATOM 1191 CA PHE A 81 26.923 -1.634 -2.162 1.00 0.00 C ATOM 1192 C PHE A 81 26.856 -3.151 -2.044 1.00 0.00 C ATOM 1193 O PHE A 81 26.094 -3.681 -1.239 1.00 0.00 O ATOM 1194 CB PHE A 81 28.210 -1.049 -1.574 1.00 0.00 C ATOM 1195 CG PHE A 81 28.649 0.230 -2.249 1.00 0.00 C ATOM 1196 CD1 PHE A 81 28.144 1.461 -1.813 1.00 0.00 C ATOM 1197 CD2 PHE A 81 29.558 0.185 -3.315 1.00 0.00 C ATOM 1198 CE1 PHE A 81 28.564 2.646 -2.432 1.00 0.00 C ATOM 1199 CE2 PHE A 81 29.993 1.370 -3.921 1.00 0.00 C ATOM 1200 CZ PHE A 81 29.496 2.604 -3.480 1.00 0.00 C ATOM 0 H PHE A 81 25.771 -0.792 -0.633 1.00 0.00 H new ATOM 0 HA PHE A 81 26.937 -1.444 -3.235 1.00 0.00 H new ATOM 0 HB2 PHE A 81 28.062 -0.858 -0.511 1.00 0.00 H new ATOM 0 HB3 PHE A 81 29.007 -1.787 -1.657 1.00 0.00 H new ATOM 0 HD1 PHE A 81 27.432 1.497 -1.001 1.00 0.00 H new ATOM 0 HD2 PHE A 81 29.924 -0.767 -3.670 1.00 0.00 H new ATOM 0 HE1 PHE A 81 28.169 3.595 -2.101 1.00 0.00 H new ATOM 0 HE2 PHE A 81 30.711 1.333 -4.727 1.00 0.00 H new ATOM 0 HZ PHE A 81 29.829 3.520 -3.945 1.00 0.00 H new ATOM 1210 N ALA A 82 27.657 -3.850 -2.845 1.00 0.00 N ATOM 1211 CA ALA A 82 27.772 -5.291 -2.758 1.00 0.00 C ATOM 1212 C ALA A 82 29.241 -5.659 -2.577 1.00 0.00 C ATOM 1213 O ALA A 82 30.114 -5.046 -3.189 1.00 0.00 O ATOM 1214 CB ALA A 82 27.166 -5.942 -4.000 1.00 0.00 C ATOM 0 H ALA A 82 28.240 -3.429 -3.568 1.00 0.00 H new ATOM 0 HA ALA A 82 27.217 -5.665 -1.898 1.00 0.00 H new ATOM 0 HB1 ALA A 82 27.258 -7.025 -3.924 1.00 0.00 H new ATOM 0 HB2 ALA A 82 26.113 -5.671 -4.075 1.00 0.00 H new ATOM 0 HB3 ALA A 82 27.694 -5.594 -4.888 1.00 0.00 H new ATOM 1220 N THR A 83 29.509 -6.658 -1.735 1.00 0.00 N ATOM 1221 CA THR A 83 30.874 -7.050 -1.398 1.00 0.00 C ATOM 1222 C THR A 83 30.931 -8.571 -1.294 1.00 0.00 C ATOM 1223 O THR A 83 29.912 -9.254 -1.411 1.00 0.00 O ATOM 1224 CB THR A 83 31.266 -6.420 -0.058 1.00 0.00 C ATOM 1225 OG1 THR A 83 30.265 -6.663 0.907 1.00 0.00 O ATOM 1226 CG2 THR A 83 31.460 -4.912 -0.206 1.00 0.00 C ATOM 0 H THR A 83 28.790 -7.213 -1.271 1.00 0.00 H new ATOM 0 HA THR A 83 31.567 -6.708 -2.167 1.00 0.00 H new ATOM 0 HB THR A 83 32.204 -6.872 0.264 1.00 0.00 H new ATOM 0 HG1 THR A 83 30.527 -6.257 1.760 1.00 0.00 H new ATOM 0 HG21 THR A 83 31.738 -4.485 0.757 1.00 0.00 H new ATOM 0 HG22 THR A 83 32.250 -4.716 -0.931 1.00 0.00 H new ATOM 0 HG23 THR A 83 30.531 -4.458 -0.550 1.00 0.00 H new ATOM 1234 N GLY A 84 32.133 -9.104 -1.072 1.00 0.00 N ATOM 1235 CA GLY A 84 32.354 -10.535 -0.954 1.00 0.00 C ATOM 1236 C GLY A 84 33.832 -10.809 -0.680 1.00 0.00 C ATOM 1237 O GLY A 84 34.557 -9.914 -0.246 1.00 0.00 O ATOM 0 H GLY A 84 32.981 -8.547 -0.969 1.00 0.00 H new ATOM 0 HA2 GLY A 84 31.744 -10.941 -0.147 1.00 0.00 H new ATOM 0 HA3 GLY A 84 32.045 -11.037 -1.871 1.00 0.00 H new ATOM 1241 N GLY A 85 34.284 -12.039 -0.934 1.00 0.00 N ATOM 1242 CA GLY A 85 35.681 -12.394 -0.743 1.00 0.00 C ATOM 1243 C GLY A 85 36.568 -11.561 -1.663 1.00 0.00 C ATOM 1244 O GLY A 85 36.289 -11.442 -2.857 1.00 0.00 O ATOM 0 H GLY A 85 33.698 -12.802 -1.272 1.00 0.00 H new ATOM 0 HA2 GLY A 85 35.967 -12.229 0.296 1.00 0.00 H new ATOM 0 HA3 GLY A 85 35.826 -13.455 -0.949 1.00 0.00 H new ATOM 1248 N SER A 86 37.632 -10.980 -1.098 1.00 0.00 N ATOM 1249 CA SER A 86 38.547 -10.090 -1.808 1.00 0.00 C ATOM 1250 C SER A 86 37.835 -8.900 -2.458 1.00 0.00 C ATOM 1251 O SER A 86 38.436 -8.189 -3.261 1.00 0.00 O ATOM 1252 CB SER A 86 39.359 -10.878 -2.836 1.00 0.00 C ATOM 1253 OG SER A 86 40.149 -11.843 -2.170 1.00 0.00 O ATOM 0 H SER A 86 37.882 -11.119 -0.119 1.00 0.00 H new ATOM 0 HA SER A 86 39.226 -9.668 -1.067 1.00 0.00 H new ATOM 0 HB2 SER A 86 38.692 -11.366 -3.547 1.00 0.00 H new ATOM 0 HB3 SER A 86 39.995 -10.203 -3.408 1.00 0.00 H new ATOM 0 HG SER A 86 40.669 -12.350 -2.828 1.00 0.00 H new ATOM 1259 N ASP A 87 36.560 -8.682 -2.115 1.00 0.00 N ATOM 1260 CA ASP A 87 35.755 -7.601 -2.676 1.00 0.00 C ATOM 1261 C ASP A 87 35.170 -6.676 -1.609 1.00 0.00 C ATOM 1262 O ASP A 87 34.444 -5.736 -1.927 1.00 0.00 O ATOM 1263 CB ASP A 87 34.658 -8.164 -3.590 1.00 0.00 C ATOM 1264 CG ASP A 87 35.208 -8.717 -4.903 1.00 0.00 C ATOM 1265 OD1 ASP A 87 34.515 -9.576 -5.496 1.00 0.00 O ATOM 1266 OD2 ASP A 87 36.309 -8.282 -5.305 1.00 0.00 O ATOM 0 H ASP A 87 36.059 -9.256 -1.437 1.00 0.00 H new ATOM 0 HA ASP A 87 36.426 -6.984 -3.274 1.00 0.00 H new ATOM 0 HB2 ASP A 87 34.123 -8.955 -3.064 1.00 0.00 H new ATOM 0 HB3 ASP A 87 33.934 -7.379 -3.807 1.00 0.00 H new ATOM 1271 N ASP A 88 35.485 -6.941 -0.339 1.00 0.00 N ATOM 1272 CA ASP A 88 35.008 -6.140 0.779 1.00 0.00 C ATOM 1273 C ASP A 88 35.842 -4.875 0.990 1.00 0.00 C ATOM 1274 O ASP A 88 35.709 -4.202 2.011 1.00 0.00 O ATOM 1275 CB ASP A 88 34.907 -6.987 2.053 1.00 0.00 C ATOM 1276 CG ASP A 88 36.189 -7.765 2.365 1.00 0.00 C ATOM 1277 OD1 ASP A 88 37.207 -7.533 1.675 1.00 0.00 O ATOM 1278 OD2 ASP A 88 36.138 -8.593 3.303 1.00 0.00 O ATOM 0 H ASP A 88 36.081 -7.721 -0.061 1.00 0.00 H new ATOM 0 HA ASP A 88 34.004 -5.797 0.529 1.00 0.00 H new ATOM 0 HB2 ASP A 88 34.670 -6.337 2.895 1.00 0.00 H new ATOM 0 HB3 ASP A 88 34.080 -7.689 1.950 1.00 0.00 H new ATOM 1283 N SER A 89 36.707 -4.556 0.021 1.00 0.00 N ATOM 1284 CA SER A 89 37.581 -3.390 0.070 1.00 0.00 C ATOM 1285 C SER A 89 36.816 -2.105 -0.256 1.00 0.00 C ATOM 1286 O SER A 89 37.363 -1.212 -0.899 1.00 0.00 O ATOM 1287 CB SER A 89 38.748 -3.584 -0.902 1.00 0.00 C ATOM 1288 OG SER A 89 39.490 -4.729 -0.529 1.00 0.00 O ATOM 0 H SER A 89 36.817 -5.111 -0.828 1.00 0.00 H new ATOM 0 HA SER A 89 37.969 -3.290 1.084 1.00 0.00 H new ATOM 0 HB2 SER A 89 38.373 -3.697 -1.919 1.00 0.00 H new ATOM 0 HB3 SER A 89 39.391 -2.704 -0.895 1.00 0.00 H new ATOM 0 HG SER A 89 40.236 -4.853 -1.153 1.00 0.00 H new ATOM 1294 N VAL A 90 35.554 -2.006 0.179 1.00 0.00 N ATOM 1295 CA VAL A 90 34.729 -0.837 -0.086 1.00 0.00 C ATOM 1296 C VAL A 90 35.390 0.408 0.498 1.00 0.00 C ATOM 1297 O VAL A 90 36.011 0.356 1.561 1.00 0.00 O ATOM 1298 CB VAL A 90 33.314 -1.058 0.467 1.00 0.00 C ATOM 1299 CG1 VAL A 90 33.334 -1.318 1.972 1.00 0.00 C ATOM 1300 CG2 VAL A 90 32.434 0.158 0.183 1.00 0.00 C ATOM 0 H VAL A 90 35.085 -2.732 0.720 1.00 0.00 H new ATOM 0 HA VAL A 90 34.638 -0.684 -1.161 1.00 0.00 H new ATOM 0 HB VAL A 90 32.905 -1.936 -0.034 1.00 0.00 H new ATOM 0 HG11 VAL A 90 32.315 -1.470 2.329 1.00 0.00 H new ATOM 0 HG12 VAL A 90 33.928 -2.208 2.180 1.00 0.00 H new ATOM 0 HG13 VAL A 90 33.773 -0.462 2.483 1.00 0.00 H new ATOM 0 HG21 VAL A 90 31.434 -0.015 0.582 1.00 0.00 H new ATOM 0 HG22 VAL A 90 32.866 1.039 0.658 1.00 0.00 H new ATOM 0 HG23 VAL A 90 32.373 0.319 -0.893 1.00 0.00 H new ATOM 1310 N ASP A 91 35.253 1.534 -0.203 1.00 0.00 N ATOM 1311 CA ASP A 91 35.906 2.778 0.176 1.00 0.00 C ATOM 1312 C ASP A 91 35.199 3.351 1.403 1.00 0.00 C ATOM 1313 O ASP A 91 33.989 3.184 1.564 1.00 0.00 O ATOM 1314 CB ASP A 91 35.811 3.758 -0.998 1.00 0.00 C ATOM 1315 CG ASP A 91 36.726 4.969 -0.821 1.00 0.00 C ATOM 1316 OD1 ASP A 91 36.581 5.913 -1.628 1.00 0.00 O ATOM 1317 OD2 ASP A 91 37.558 4.939 0.113 1.00 0.00 O ATOM 0 H ASP A 91 34.686 1.605 -1.048 1.00 0.00 H new ATOM 0 HA ASP A 91 36.955 2.606 0.417 1.00 0.00 H new ATOM 0 HB2 ASP A 91 36.072 3.241 -1.921 1.00 0.00 H new ATOM 0 HB3 ASP A 91 34.780 4.097 -1.102 1.00 0.00 H new ATOM 1322 N SER A 92 35.952 4.033 2.273 1.00 0.00 N ATOM 1323 CA SER A 92 35.405 4.632 3.485 1.00 0.00 C ATOM 1324 C SER A 92 34.418 5.743 3.139 1.00 0.00 C ATOM 1325 O SER A 92 33.676 6.205 4.005 1.00 0.00 O ATOM 1326 CB SER A 92 36.547 5.177 4.343 1.00 0.00 C ATOM 1327 OG SER A 92 37.214 6.220 3.661 1.00 0.00 O ATOM 0 H SER A 92 36.954 4.182 2.153 1.00 0.00 H new ATOM 0 HA SER A 92 34.867 3.869 4.047 1.00 0.00 H new ATOM 0 HB2 SER A 92 36.156 5.545 5.292 1.00 0.00 H new ATOM 0 HB3 SER A 92 37.250 4.377 4.577 1.00 0.00 H new ATOM 0 HG SER A 92 37.942 6.563 4.220 1.00 0.00 H new ATOM 1333 N ARG A 93 34.403 6.171 1.871 1.00 0.00 N ATOM 1334 CA ARG A 93 33.463 7.165 1.379 1.00 0.00 C ATOM 1335 C ARG A 93 32.039 6.605 1.382 1.00 0.00 C ATOM 1336 O ARG A 93 31.078 7.369 1.318 1.00 0.00 O ATOM 1337 CB ARG A 93 33.895 7.584 -0.033 1.00 0.00 C ATOM 1338 CG ARG A 93 32.932 8.612 -0.637 1.00 0.00 C ATOM 1339 CD ARG A 93 33.426 9.058 -2.012 1.00 0.00 C ATOM 1340 NE ARG A 93 34.709 9.765 -1.916 1.00 0.00 N ATOM 1341 CZ ARG A 93 35.146 10.633 -2.837 1.00 0.00 C ATOM 1342 NH1 ARG A 93 34.433 10.880 -3.930 1.00 0.00 N ATOM 1343 NH2 ARG A 93 36.309 11.257 -2.660 1.00 0.00 N ATOM 0 H ARG A 93 35.050 5.831 1.159 1.00 0.00 H new ATOM 0 HA ARG A 93 33.466 8.039 2.031 1.00 0.00 H new ATOM 0 HB2 ARG A 93 34.900 8.004 0.003 1.00 0.00 H new ATOM 0 HB3 ARG A 93 33.940 6.705 -0.676 1.00 0.00 H new ATOM 0 HG2 ARG A 93 31.935 8.179 -0.724 1.00 0.00 H new ATOM 0 HG3 ARG A 93 32.849 9.474 0.024 1.00 0.00 H new ATOM 0 HD2 ARG A 93 33.535 8.189 -2.661 1.00 0.00 H new ATOM 0 HD3 ARG A 93 32.684 9.709 -2.474 1.00 0.00 H new ATOM 0 HE ARG A 93 35.299 9.585 -1.104 1.00 0.00 H new ATOM 0 HH11 ARG A 93 33.541 10.406 -4.075 1.00 0.00 H new ATOM 0 HH12 ARG A 93 34.777 11.544 -4.624 1.00 0.00 H new ATOM 0 HH21 ARG A 93 36.864 11.073 -1.824 1.00 0.00 H new ATOM 0 HH22 ARG A 93 36.644 11.919 -3.360 1.00 0.00 H new ATOM 1357 N PHE A 94 31.900 5.277 1.454 1.00 0.00 N ATOM 1358 CA PHE A 94 30.602 4.629 1.337 1.00 0.00 C ATOM 1359 C PHE A 94 30.350 3.663 2.495 1.00 0.00 C ATOM 1360 O PHE A 94 29.346 2.957 2.499 1.00 0.00 O ATOM 1361 CB PHE A 94 30.519 3.902 -0.003 1.00 0.00 C ATOM 1362 CG PHE A 94 30.762 4.803 -1.193 1.00 0.00 C ATOM 1363 CD1 PHE A 94 31.935 4.662 -1.953 1.00 0.00 C ATOM 1364 CD2 PHE A 94 29.820 5.784 -1.536 1.00 0.00 C ATOM 1365 CE1 PHE A 94 32.163 5.501 -3.049 1.00 0.00 C ATOM 1366 CE2 PHE A 94 30.043 6.617 -2.639 1.00 0.00 C ATOM 1367 CZ PHE A 94 31.216 6.473 -3.395 1.00 0.00 C ATOM 0 H PHE A 94 32.678 4.633 1.594 1.00 0.00 H new ATOM 0 HA PHE A 94 29.826 5.393 1.383 1.00 0.00 H new ATOM 0 HB2 PHE A 94 31.249 3.093 -0.014 1.00 0.00 H new ATOM 0 HB3 PHE A 94 29.535 3.444 -0.099 1.00 0.00 H new ATOM 0 HD1 PHE A 94 32.661 3.906 -1.691 1.00 0.00 H new ATOM 0 HD2 PHE A 94 28.921 5.897 -0.948 1.00 0.00 H new ATOM 0 HE1 PHE A 94 33.069 5.399 -3.628 1.00 0.00 H new ATOM 0 HE2 PHE A 94 29.314 7.368 -2.907 1.00 0.00 H new ATOM 0 HZ PHE A 94 31.389 7.114 -4.247 1.00 0.00 H new ATOM 1377 N ARG A 95 31.251 3.621 3.482 1.00 0.00 N ATOM 1378 CA ARG A 95 31.040 2.811 4.678 1.00 0.00 C ATOM 1379 C ARG A 95 29.962 3.426 5.573 1.00 0.00 C ATOM 1380 O ARG A 95 29.510 2.796 6.527 1.00 0.00 O ATOM 1381 CB ARG A 95 32.366 2.626 5.416 1.00 0.00 C ATOM 1382 CG ARG A 95 33.250 1.681 4.600 1.00 0.00 C ATOM 1383 CD ARG A 95 34.583 1.436 5.305 1.00 0.00 C ATOM 1384 NE ARG A 95 35.477 0.641 4.454 1.00 0.00 N ATOM 1385 CZ ARG A 95 36.188 -0.410 4.870 1.00 0.00 C ATOM 1386 NH1 ARG A 95 36.145 -0.804 6.140 1.00 0.00 N ATOM 1387 NH2 ARG A 95 36.946 -1.071 4.001 1.00 0.00 N ATOM 0 H ARG A 95 32.130 4.138 3.473 1.00 0.00 H new ATOM 0 HA ARG A 95 30.678 1.826 4.385 1.00 0.00 H new ATOM 0 HB2 ARG A 95 32.862 3.587 5.550 1.00 0.00 H new ATOM 0 HB3 ARG A 95 32.191 2.216 6.411 1.00 0.00 H new ATOM 0 HG2 ARG A 95 32.734 0.733 4.450 1.00 0.00 H new ATOM 0 HG3 ARG A 95 33.429 2.106 3.612 1.00 0.00 H new ATOM 0 HD2 ARG A 95 35.054 2.389 5.547 1.00 0.00 H new ATOM 0 HD3 ARG A 95 34.412 0.917 6.248 1.00 0.00 H new ATOM 0 HE ARG A 95 35.561 0.911 3.474 1.00 0.00 H new ATOM 0 HH11 ARG A 95 35.563 -0.301 6.810 1.00 0.00 H new ATOM 0 HH12 ARG A 95 36.694 -1.609 6.443 1.00 0.00 H new ATOM 0 HH21 ARG A 95 36.981 -0.774 3.026 1.00 0.00 H new ATOM 0 HH22 ARG A 95 37.493 -1.875 4.309 1.00 0.00 H new ATOM 1401 N ASP A 96 29.553 4.659 5.255 1.00 0.00 N ATOM 1402 CA ASP A 96 28.408 5.309 5.883 1.00 0.00 C ATOM 1403 C ASP A 96 27.099 4.925 5.183 1.00 0.00 C ATOM 1404 O ASP A 96 26.049 5.498 5.466 1.00 0.00 O ATOM 1405 CB ASP A 96 28.606 6.829 5.896 1.00 0.00 C ATOM 1406 CG ASP A 96 29.791 7.255 6.765 1.00 0.00 C ATOM 1407 OD1 ASP A 96 30.379 6.377 7.437 1.00 0.00 O ATOM 1408 OD2 ASP A 96 30.097 8.468 6.749 1.00 0.00 O ATOM 0 H ASP A 96 30.013 5.234 4.549 1.00 0.00 H new ATOM 0 HA ASP A 96 28.337 4.962 6.914 1.00 0.00 H new ATOM 0 HB2 ASP A 96 28.762 7.181 4.876 1.00 0.00 H new ATOM 0 HB3 ASP A 96 27.698 7.308 6.264 1.00 0.00 H new ATOM 1413 N ARG A 97 27.173 3.955 4.266 1.00 0.00 N ATOM 1414 CA ARG A 97 26.033 3.470 3.499 1.00 0.00 C ATOM 1415 C ARG A 97 25.931 1.952 3.651 1.00 0.00 C ATOM 1416 O ARG A 97 26.934 1.299 3.946 1.00 0.00 O ATOM 1417 CB ARG A 97 26.208 3.877 2.028 1.00 0.00 C ATOM 1418 CG ARG A 97 26.254 5.400 1.860 1.00 0.00 C ATOM 1419 CD ARG A 97 24.922 6.032 2.267 1.00 0.00 C ATOM 1420 NE ARG A 97 24.931 7.481 2.033 1.00 0.00 N ATOM 1421 CZ ARG A 97 25.175 8.396 2.979 1.00 0.00 C ATOM 1422 NH1 ARG A 97 25.450 8.028 4.229 1.00 0.00 N ATOM 1423 NH2 ARG A 97 25.143 9.688 2.672 1.00 0.00 N ATOM 0 H ARG A 97 28.045 3.479 4.036 1.00 0.00 H new ATOM 0 HA ARG A 97 25.107 3.911 3.869 1.00 0.00 H new ATOM 0 HB2 ARG A 97 27.127 3.440 1.637 1.00 0.00 H new ATOM 0 HB3 ARG A 97 25.386 3.471 1.438 1.00 0.00 H new ATOM 0 HG2 ARG A 97 27.059 5.813 2.468 1.00 0.00 H new ATOM 0 HG3 ARG A 97 26.478 5.649 0.823 1.00 0.00 H new ATOM 0 HD2 ARG A 97 24.111 5.574 1.701 1.00 0.00 H new ATOM 0 HD3 ARG A 97 24.728 5.832 3.321 1.00 0.00 H new ATOM 0 HE ARG A 97 24.739 7.812 1.088 1.00 0.00 H new ATOM 0 HH11 ARG A 97 25.477 7.039 4.475 1.00 0.00 H new ATOM 0 HH12 ARG A 97 25.634 8.736 4.940 1.00 0.00 H new ATOM 0 HH21 ARG A 97 24.933 9.980 1.718 1.00 0.00 H new ATOM 0 HH22 ARG A 97 25.328 10.388 3.391 1.00 0.00 H new ATOM 1437 N PRO A 98 24.735 1.378 3.463 1.00 0.00 N ATOM 1438 CA PRO A 98 24.506 -0.043 3.634 1.00 0.00 C ATOM 1439 C PRO A 98 25.243 -0.839 2.562 1.00 0.00 C ATOM 1440 O PRO A 98 25.539 -0.323 1.483 1.00 0.00 O ATOM 1441 CB PRO A 98 22.994 -0.238 3.522 1.00 0.00 C ATOM 1442 CG PRO A 98 22.519 0.972 2.718 1.00 0.00 C ATOM 1443 CD PRO A 98 23.520 2.067 3.072 1.00 0.00 C ATOM 0 HA PRO A 98 24.880 -0.398 4.594 1.00 0.00 H new ATOM 0 HB2 PRO A 98 22.749 -1.173 3.017 1.00 0.00 H new ATOM 0 HB3 PRO A 98 22.523 -0.273 4.504 1.00 0.00 H new ATOM 0 HG2 PRO A 98 22.517 0.764 1.648 1.00 0.00 H new ATOM 0 HG3 PRO A 98 21.503 1.257 2.989 1.00 0.00 H new ATOM 0 HD2 PRO A 98 23.699 2.724 2.221 1.00 0.00 H new ATOM 0 HD3 PRO A 98 23.146 2.692 3.883 1.00 0.00 H new ATOM 1451 N VAL A 99 25.537 -2.104 2.865 1.00 0.00 N ATOM 1452 CA VAL A 99 26.250 -2.972 1.944 1.00 0.00 C ATOM 1453 C VAL A 99 25.809 -4.413 2.160 1.00 0.00 C ATOM 1454 O VAL A 99 25.839 -4.926 3.279 1.00 0.00 O ATOM 1455 CB VAL A 99 27.762 -2.803 2.148 1.00 0.00 C ATOM 1456 CG1 VAL A 99 28.171 -2.951 3.616 1.00 0.00 C ATOM 1457 CG2 VAL A 99 28.540 -3.838 1.336 1.00 0.00 C ATOM 0 H VAL A 99 25.288 -2.547 3.749 1.00 0.00 H new ATOM 0 HA VAL A 99 26.018 -2.701 0.914 1.00 0.00 H new ATOM 0 HB VAL A 99 28.000 -1.794 1.812 1.00 0.00 H new ATOM 0 HG11 VAL A 99 29.250 -2.823 3.708 1.00 0.00 H new ATOM 0 HG12 VAL A 99 27.664 -2.193 4.213 1.00 0.00 H new ATOM 0 HG13 VAL A 99 27.891 -3.942 3.973 1.00 0.00 H new ATOM 0 HG21 VAL A 99 29.609 -3.698 1.497 1.00 0.00 H new ATOM 0 HG22 VAL A 99 28.253 -4.840 1.654 1.00 0.00 H new ATOM 0 HG23 VAL A 99 28.313 -3.715 0.277 1.00 0.00 H new ATOM 1467 N LEU A 100 25.404 -5.063 1.067 1.00 0.00 N ATOM 1468 CA LEU A 100 25.161 -6.495 1.049 1.00 0.00 C ATOM 1469 C LEU A 100 26.484 -7.216 0.783 1.00 0.00 C ATOM 1470 O LEU A 100 27.396 -6.642 0.197 1.00 0.00 O ATOM 1471 CB LEU A 100 24.117 -6.830 -0.020 1.00 0.00 C ATOM 1472 CG LEU A 100 22.769 -6.167 0.283 1.00 0.00 C ATOM 1473 CD1 LEU A 100 21.804 -6.448 -0.863 1.00 0.00 C ATOM 1474 CD2 LEU A 100 22.174 -6.741 1.572 1.00 0.00 C ATOM 0 H LEU A 100 25.237 -4.605 0.171 1.00 0.00 H new ATOM 0 HA LEU A 100 24.769 -6.826 2.011 1.00 0.00 H new ATOM 0 HB2 LEU A 100 24.475 -6.500 -0.995 1.00 0.00 H new ATOM 0 HB3 LEU A 100 23.987 -7.911 -0.077 1.00 0.00 H new ATOM 0 HG LEU A 100 22.923 -5.094 0.400 1.00 0.00 H new ATOM 0 HD11 LEU A 100 20.843 -5.979 -0.653 1.00 0.00 H new ATOM 0 HD12 LEU A 100 22.211 -6.042 -1.789 1.00 0.00 H new ATOM 0 HD13 LEU A 100 21.667 -7.524 -0.968 1.00 0.00 H new ATOM 0 HD21 LEU A 100 21.217 -6.262 1.776 1.00 0.00 H new ATOM 0 HD22 LEU A 100 22.025 -7.815 1.457 1.00 0.00 H new ATOM 0 HD23 LEU A 100 22.856 -6.556 2.402 1.00 0.00 H new ATOM 1486 N GLN A 101 26.596 -8.472 1.218 1.00 0.00 N ATOM 1487 CA GLN A 101 27.852 -9.206 1.147 1.00 0.00 C ATOM 1488 C GLN A 101 27.583 -10.655 0.735 1.00 0.00 C ATOM 1489 O GLN A 101 27.036 -10.898 -0.341 1.00 0.00 O ATOM 1490 CB GLN A 101 28.560 -9.066 2.501 1.00 0.00 C ATOM 1491 CG GLN A 101 30.033 -9.472 2.404 1.00 0.00 C ATOM 1492 CD GLN A 101 30.818 -9.007 3.625 1.00 0.00 C ATOM 1493 OE1 GLN A 101 30.251 -8.723 4.676 1.00 0.00 O ATOM 1494 NE2 GLN A 101 32.139 -8.926 3.493 1.00 0.00 N ATOM 0 H GLN A 101 25.825 -9.001 1.625 1.00 0.00 H new ATOM 0 HA GLN A 101 28.517 -8.801 0.384 1.00 0.00 H new ATOM 0 HB2 GLN A 101 28.487 -8.035 2.847 1.00 0.00 H new ATOM 0 HB3 GLN A 101 28.058 -9.687 3.242 1.00 0.00 H new ATOM 0 HG2 GLN A 101 30.108 -10.555 2.312 1.00 0.00 H new ATOM 0 HG3 GLN A 101 30.472 -9.044 1.503 1.00 0.00 H new ATOM 0 HE21 GLN A 101 32.579 -9.170 2.605 1.00 0.00 H new ATOM 0 HE22 GLN A 101 32.712 -8.620 4.279 1.00 0.00 H new ATOM 1503 N LYS A 102 27.964 -11.614 1.586 1.00 0.00 N ATOM 1504 CA LYS A 102 27.663 -13.030 1.394 1.00 0.00 C ATOM 1505 C LYS A 102 26.152 -13.227 1.226 1.00 0.00 C ATOM 1506 O LYS A 102 25.382 -12.314 1.522 1.00 0.00 O ATOM 1507 CB LYS A 102 28.251 -13.834 2.569 1.00 0.00 C ATOM 1508 CG LYS A 102 27.957 -13.234 3.952 1.00 0.00 C ATOM 1509 CD LYS A 102 26.474 -13.292 4.325 1.00 0.00 C ATOM 1510 CE LYS A 102 26.272 -12.880 5.787 1.00 0.00 C ATOM 1511 NZ LYS A 102 26.944 -13.810 6.714 1.00 0.00 N ATOM 0 H LYS A 102 28.496 -11.423 2.435 1.00 0.00 H new ATOM 0 HA LYS A 102 28.126 -13.402 0.480 1.00 0.00 H new ATOM 0 HB2 LYS A 102 27.855 -14.849 2.534 1.00 0.00 H new ATOM 0 HB3 LYS A 102 29.331 -13.908 2.440 1.00 0.00 H new ATOM 0 HG2 LYS A 102 28.537 -13.768 4.705 1.00 0.00 H new ATOM 0 HG3 LYS A 102 28.290 -12.196 3.970 1.00 0.00 H new ATOM 0 HD2 LYS A 102 25.903 -12.632 3.673 1.00 0.00 H new ATOM 0 HD3 LYS A 102 26.093 -14.301 4.169 1.00 0.00 H new ATOM 0 HE2 LYS A 102 26.659 -11.872 5.938 1.00 0.00 H new ATOM 0 HE3 LYS A 102 25.206 -12.849 6.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 26.515 -13.730 7.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 26.837 -14.784 6.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 27.955 -13.572 6.772 1.00 0.00 H new ATOM 1525 N PRO A 103 25.710 -14.399 0.753 1.00 0.00 N ATOM 1526 CA PRO A 103 24.301 -14.682 0.541 1.00 0.00 C ATOM 1527 C PRO A 103 23.457 -14.279 1.748 1.00 0.00 C ATOM 1528 O PRO A 103 23.881 -14.427 2.893 1.00 0.00 O ATOM 1529 CB PRO A 103 24.219 -16.178 0.237 1.00 0.00 C ATOM 1530 CG PRO A 103 25.594 -16.493 -0.359 1.00 0.00 C ATOM 1531 CD PRO A 103 26.532 -15.530 0.369 1.00 0.00 C ATOM 0 HA PRO A 103 23.894 -14.100 -0.285 1.00 0.00 H new ATOM 0 HB2 PRO A 103 24.028 -16.761 1.138 1.00 0.00 H new ATOM 0 HB3 PRO A 103 23.416 -16.402 -0.465 1.00 0.00 H new ATOM 0 HG2 PRO A 103 25.876 -17.532 -0.189 1.00 0.00 H new ATOM 0 HG3 PRO A 103 25.610 -16.330 -1.437 1.00 0.00 H new ATOM 0 HD2 PRO A 103 26.979 -16.004 1.243 1.00 0.00 H new ATOM 0 HD3 PRO A 103 27.351 -15.217 -0.278 1.00 0.00 H new ATOM 1539 N PHE A 104 22.256 -13.762 1.475 1.00 0.00 N ATOM 1540 CA PHE A 104 21.412 -13.134 2.477 1.00 0.00 C ATOM 1541 C PHE A 104 19.966 -13.618 2.491 1.00 0.00 C ATOM 1542 O PHE A 104 19.449 -14.085 1.478 1.00 0.00 O ATOM 1543 CB PHE A 104 21.526 -11.612 2.372 1.00 0.00 C ATOM 1544 CG PHE A 104 21.744 -11.136 0.953 1.00 0.00 C ATOM 1545 CD1 PHE A 104 20.699 -11.196 0.022 1.00 0.00 C ATOM 1546 CD2 PHE A 104 23.002 -10.651 0.565 1.00 0.00 C ATOM 1547 CE1 PHE A 104 20.920 -10.802 -1.305 1.00 0.00 C ATOM 1548 CE2 PHE A 104 23.224 -10.264 -0.763 1.00 0.00 C ATOM 1549 CZ PHE A 104 22.186 -10.340 -1.698 1.00 0.00 C ATOM 0 H PHE A 104 21.845 -13.771 0.542 1.00 0.00 H new ATOM 0 HA PHE A 104 21.792 -13.452 3.448 1.00 0.00 H new ATOM 0 HB2 PHE A 104 20.618 -11.156 2.768 1.00 0.00 H new ATOM 0 HB3 PHE A 104 22.352 -11.270 2.996 1.00 0.00 H new ATOM 0 HD1 PHE A 104 19.724 -11.546 0.326 1.00 0.00 H new ATOM 0 HD2 PHE A 104 23.799 -10.576 1.290 1.00 0.00 H new ATOM 0 HE1 PHE A 104 20.117 -10.854 -2.025 1.00 0.00 H new ATOM 0 HE2 PHE A 104 24.197 -9.907 -1.065 1.00 0.00 H new ATOM 0 HZ PHE A 104 22.359 -10.043 -2.722 1.00 0.00 H new ATOM 1559 N THR A 105 19.316 -13.504 3.652 1.00 0.00 N ATOM 1560 CA THR A 105 17.914 -13.860 3.813 1.00 0.00 C ATOM 1561 C THR A 105 16.972 -12.735 3.405 1.00 0.00 C ATOM 1562 O THR A 105 17.419 -11.648 3.038 1.00 0.00 O ATOM 1563 CB THR A 105 17.633 -14.336 5.244 1.00 0.00 C ATOM 1564 OG1 THR A 105 17.393 -13.214 6.064 1.00 0.00 O ATOM 1565 CG2 THR A 105 18.804 -15.136 5.819 1.00 0.00 C ATOM 0 H THR A 105 19.754 -13.160 4.507 1.00 0.00 H new ATOM 0 HA THR A 105 17.715 -14.687 3.132 1.00 0.00 H new ATOM 0 HB THR A 105 16.761 -14.989 5.217 1.00 0.00 H new ATOM 0 HG1 THR A 105 17.211 -13.511 6.980 1.00 0.00 H new ATOM 0 HG21 THR A 105 18.564 -15.454 6.834 1.00 0.00 H new ATOM 0 HG22 THR A 105 18.986 -16.013 5.197 1.00 0.00 H new ATOM 0 HG23 THR A 105 19.697 -14.512 5.836 1.00 0.00 H new ATOM 1573 N MET A 106 15.665 -12.992 3.473 1.00 0.00 N ATOM 1574 CA MET A 106 14.666 -11.981 3.165 1.00 0.00 C ATOM 1575 C MET A 106 14.803 -10.794 4.120 1.00 0.00 C ATOM 1576 O MET A 106 14.473 -9.665 3.761 1.00 0.00 O ATOM 1577 CB MET A 106 13.277 -12.618 3.277 1.00 0.00 C ATOM 1578 CG MET A 106 12.139 -11.636 2.985 1.00 0.00 C ATOM 1579 SD MET A 106 11.850 -11.281 1.231 1.00 0.00 S ATOM 1580 CE MET A 106 13.046 -9.947 0.958 1.00 0.00 C ATOM 0 H MET A 106 15.278 -13.897 3.740 1.00 0.00 H new ATOM 0 HA MET A 106 14.811 -11.608 2.151 1.00 0.00 H new ATOM 0 HB2 MET A 106 13.212 -13.457 2.584 1.00 0.00 H new ATOM 0 HB3 MET A 106 13.150 -13.024 4.281 1.00 0.00 H new ATOM 0 HG2 MET A 106 11.219 -12.034 3.414 1.00 0.00 H new ATOM 0 HG3 MET A 106 12.351 -10.698 3.498 1.00 0.00 H new ATOM 0 HE1 MET A 106 12.884 -9.509 -0.027 1.00 0.00 H new ATOM 0 HE2 MET A 106 12.917 -9.180 1.722 1.00 0.00 H new ATOM 0 HE3 MET A 106 14.058 -10.348 1.014 1.00 0.00 H new ATOM 1590 N ASP A 107 15.293 -11.050 5.337 1.00 0.00 N ATOM 1591 CA ASP A 107 15.497 -10.004 6.326 1.00 0.00 C ATOM 1592 C ASP A 107 16.822 -9.270 6.124 1.00 0.00 C ATOM 1593 O ASP A 107 16.981 -8.146 6.595 1.00 0.00 O ATOM 1594 CB ASP A 107 15.420 -10.601 7.735 1.00 0.00 C ATOM 1595 CG ASP A 107 14.024 -11.120 8.080 1.00 0.00 C ATOM 1596 OD1 ASP A 107 13.104 -10.926 7.253 1.00 0.00 O ATOM 1597 OD2 ASP A 107 13.894 -11.711 9.177 1.00 0.00 O ATOM 0 H ASP A 107 15.555 -11.983 5.656 1.00 0.00 H new ATOM 0 HA ASP A 107 14.704 -9.267 6.200 1.00 0.00 H new ATOM 0 HB2 ASP A 107 16.138 -11.417 7.819 1.00 0.00 H new ATOM 0 HB3 ASP A 107 15.712 -9.844 8.463 1.00 0.00 H new ATOM 1602 N GLY A 108 17.773 -9.901 5.430 1.00 0.00 N ATOM 1603 CA GLY A 108 19.082 -9.313 5.197 1.00 0.00 C ATOM 1604 C GLY A 108 19.002 -8.195 4.161 1.00 0.00 C ATOM 1605 O GLY A 108 19.663 -7.168 4.302 1.00 0.00 O ATOM 0 H GLY A 108 17.653 -10.827 5.019 1.00 0.00 H new ATOM 0 HA2 GLY A 108 19.480 -8.919 6.132 1.00 0.00 H new ATOM 0 HA3 GLY A 108 19.775 -10.082 4.855 1.00 0.00 H new ATOM 1609 N VAL A 109 18.191 -8.384 3.115 1.00 0.00 N ATOM 1610 CA VAL A 109 17.990 -7.354 2.112 1.00 0.00 C ATOM 1611 C VAL A 109 17.055 -6.272 2.638 1.00 0.00 C ATOM 1612 O VAL A 109 17.152 -5.115 2.227 1.00 0.00 O ATOM 1613 CB VAL A 109 17.463 -7.969 0.811 1.00 0.00 C ATOM 1614 CG1 VAL A 109 18.350 -9.133 0.381 1.00 0.00 C ATOM 1615 CG2 VAL A 109 16.033 -8.473 0.984 1.00 0.00 C ATOM 0 H VAL A 109 17.667 -9.243 2.948 1.00 0.00 H new ATOM 0 HA VAL A 109 18.949 -6.885 1.893 1.00 0.00 H new ATOM 0 HB VAL A 109 17.476 -7.192 0.047 1.00 0.00 H new ATOM 0 HG11 VAL A 109 17.965 -9.561 -0.544 1.00 0.00 H new ATOM 0 HG12 VAL A 109 19.367 -8.775 0.220 1.00 0.00 H new ATOM 0 HG13 VAL A 109 18.353 -9.895 1.160 1.00 0.00 H new ATOM 0 HG21 VAL A 109 15.683 -8.905 0.046 1.00 0.00 H new ATOM 0 HG22 VAL A 109 16.007 -9.233 1.765 1.00 0.00 H new ATOM 0 HG23 VAL A 109 15.386 -7.642 1.265 1.00 0.00 H new ATOM 1625 N ALA A 110 16.152 -6.636 3.552 1.00 0.00 N ATOM 1626 CA ALA A 110 15.258 -5.677 4.171 1.00 0.00 C ATOM 1627 C ALA A 110 16.037 -4.787 5.138 1.00 0.00 C ATOM 1628 O ALA A 110 15.637 -3.651 5.399 1.00 0.00 O ATOM 1629 CB ALA A 110 14.147 -6.428 4.905 1.00 0.00 C ATOM 0 H ALA A 110 16.027 -7.595 3.875 1.00 0.00 H new ATOM 0 HA ALA A 110 14.812 -5.041 3.406 1.00 0.00 H new ATOM 0 HB1 ALA A 110 13.471 -5.712 5.373 1.00 0.00 H new ATOM 0 HB2 ALA A 110 13.592 -7.041 4.195 1.00 0.00 H new ATOM 0 HB3 ALA A 110 14.585 -7.068 5.671 1.00 0.00 H new ATOM 1635 N LYS A 111 17.154 -5.302 5.668 1.00 0.00 N ATOM 1636 CA LYS A 111 18.016 -4.555 6.567 1.00 0.00 C ATOM 1637 C LYS A 111 18.727 -3.441 5.807 1.00 0.00 C ATOM 1638 O LYS A 111 18.886 -2.339 6.326 1.00 0.00 O ATOM 1639 CB LYS A 111 19.025 -5.526 7.178 1.00 0.00 C ATOM 1640 CG LYS A 111 19.899 -4.844 8.231 1.00 0.00 C ATOM 1641 CD LYS A 111 20.910 -5.867 8.751 1.00 0.00 C ATOM 1642 CE LYS A 111 21.669 -5.291 9.944 1.00 0.00 C ATOM 1643 NZ LYS A 111 22.639 -6.262 10.477 1.00 0.00 N ATOM 0 H LYS A 111 17.478 -6.251 5.480 1.00 0.00 H new ATOM 0 HA LYS A 111 17.427 -4.092 7.359 1.00 0.00 H new ATOM 0 HB2 LYS A 111 18.495 -6.364 7.632 1.00 0.00 H new ATOM 0 HB3 LYS A 111 19.657 -5.937 6.391 1.00 0.00 H new ATOM 0 HG2 LYS A 111 20.415 -3.986 7.799 1.00 0.00 H new ATOM 0 HG3 LYS A 111 19.284 -4.468 9.049 1.00 0.00 H new ATOM 0 HD2 LYS A 111 20.396 -6.782 9.044 1.00 0.00 H new ATOM 0 HD3 LYS A 111 21.610 -6.134 7.959 1.00 0.00 H new ATOM 0 HE2 LYS A 111 22.189 -4.382 9.643 1.00 0.00 H new ATOM 0 HE3 LYS A 111 20.964 -5.011 10.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 23.140 -5.844 11.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 22.138 -7.120 10.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 23.325 -6.510 9.736 1.00 0.00 H new ATOM 1657 N ALA A 112 19.155 -3.726 4.576 1.00 0.00 N ATOM 1658 CA ALA A 112 19.836 -2.742 3.750 1.00 0.00 C ATOM 1659 C ALA A 112 18.854 -1.685 3.254 1.00 0.00 C ATOM 1660 O ALA A 112 19.148 -0.493 3.300 1.00 0.00 O ATOM 1661 CB ALA A 112 20.495 -3.452 2.564 1.00 0.00 C ATOM 0 H ALA A 112 19.039 -4.637 4.132 1.00 0.00 H new ATOM 0 HA ALA A 112 20.599 -2.241 4.345 1.00 0.00 H new ATOM 0 HB1 ALA A 112 21.008 -2.719 1.940 1.00 0.00 H new ATOM 0 HB2 ALA A 112 21.215 -4.183 2.932 1.00 0.00 H new ATOM 0 HB3 ALA A 112 19.732 -3.960 1.974 1.00 0.00 H new ATOM 1667 N LEU A 113 17.680 -2.119 2.783 1.00 0.00 N ATOM 1668 CA LEU A 113 16.678 -1.210 2.240 1.00 0.00 C ATOM 1669 C LEU A 113 16.115 -0.320 3.349 1.00 0.00 C ATOM 1670 O LEU A 113 15.697 0.803 3.080 1.00 0.00 O ATOM 1671 CB LEU A 113 15.553 -2.037 1.603 1.00 0.00 C ATOM 1672 CG LEU A 113 15.748 -2.285 0.098 1.00 0.00 C ATOM 1673 CD1 LEU A 113 15.374 -1.030 -0.678 1.00 0.00 C ATOM 1674 CD2 LEU A 113 17.184 -2.673 -0.252 1.00 0.00 C ATOM 0 H LEU A 113 17.404 -3.101 2.769 1.00 0.00 H new ATOM 0 HA LEU A 113 17.135 -0.569 1.486 1.00 0.00 H new ATOM 0 HB2 LEU A 113 15.484 -2.997 2.115 1.00 0.00 H new ATOM 0 HB3 LEU A 113 14.604 -1.524 1.758 1.00 0.00 H new ATOM 0 HG LEU A 113 15.102 -3.119 -0.175 1.00 0.00 H new ATOM 0 HD11 LEU A 113 15.513 -1.207 -1.745 1.00 0.00 H new ATOM 0 HD12 LEU A 113 14.331 -0.780 -0.484 1.00 0.00 H new ATOM 0 HD13 LEU A 113 16.010 -0.203 -0.362 1.00 0.00 H new ATOM 0 HD21 LEU A 113 17.265 -2.836 -1.327 1.00 0.00 H new ATOM 0 HD22 LEU A 113 17.860 -1.871 0.045 1.00 0.00 H new ATOM 0 HD23 LEU A 113 17.452 -3.588 0.275 1.00 0.00 H new ATOM 1686 N ALA A 114 16.104 -0.811 4.592 1.00 0.00 N ATOM 1687 CA ALA A 114 15.654 -0.018 5.728 1.00 0.00 C ATOM 1688 C ALA A 114 16.745 0.958 6.173 1.00 0.00 C ATOM 1689 O ALA A 114 16.450 1.998 6.759 1.00 0.00 O ATOM 1690 CB ALA A 114 15.274 -0.953 6.874 1.00 0.00 C ATOM 0 H ALA A 114 16.403 -1.756 4.832 1.00 0.00 H new ATOM 0 HA ALA A 114 14.783 0.567 5.433 1.00 0.00 H new ATOM 0 HB1 ALA A 114 14.936 -0.364 7.727 1.00 0.00 H new ATOM 0 HB2 ALA A 114 14.472 -1.617 6.551 1.00 0.00 H new ATOM 0 HB3 ALA A 114 16.142 -1.546 7.163 1.00 0.00 H new ATOM 1696 N ALA A 115 18.011 0.627 5.899 1.00 0.00 N ATOM 1697 CA ALA A 115 19.135 1.475 6.270 1.00 0.00 C ATOM 1698 C ALA A 115 19.276 2.656 5.309 1.00 0.00 C ATOM 1699 O ALA A 115 19.986 3.611 5.607 1.00 0.00 O ATOM 1700 CB ALA A 115 20.409 0.638 6.299 1.00 0.00 C ATOM 0 H ALA A 115 18.278 -0.231 5.417 1.00 0.00 H new ATOM 0 HA ALA A 115 18.956 1.887 7.263 1.00 0.00 H new ATOM 0 HB1 ALA A 115 21.253 1.270 6.576 1.00 0.00 H new ATOM 0 HB2 ALA A 115 20.301 -0.164 7.029 1.00 0.00 H new ATOM 0 HB3 ALA A 115 20.585 0.210 5.312 1.00 0.00 H new ATOM 1706 N LEU A 116 18.602 2.601 4.154 1.00 0.00 N ATOM 1707 CA LEU A 116 18.610 3.717 3.215 1.00 0.00 C ATOM 1708 C LEU A 116 17.810 4.909 3.758 1.00 0.00 C ATOM 1709 O LEU A 116 17.864 5.992 3.178 1.00 0.00 O ATOM 1710 CB LEU A 116 18.035 3.261 1.870 1.00 0.00 C ATOM 1711 CG LEU A 116 18.938 2.227 1.199 1.00 0.00 C ATOM 1712 CD1 LEU A 116 18.228 1.682 -0.033 1.00 0.00 C ATOM 1713 CD2 LEU A 116 20.266 2.849 0.774 1.00 0.00 C ATOM 0 H LEU A 116 18.049 1.799 3.853 1.00 0.00 H new ATOM 0 HA LEU A 116 19.641 4.044 3.078 1.00 0.00 H new ATOM 0 HB2 LEU A 116 17.043 2.836 2.022 1.00 0.00 H new ATOM 0 HB3 LEU A 116 17.915 4.122 1.213 1.00 0.00 H new ATOM 0 HG LEU A 116 19.144 1.429 1.912 1.00 0.00 H new ATOM 0 HD11 LEU A 116 18.863 0.942 -0.521 1.00 0.00 H new ATOM 0 HD12 LEU A 116 17.289 1.215 0.265 1.00 0.00 H new ATOM 0 HD13 LEU A 116 18.023 2.498 -0.726 1.00 0.00 H new ATOM 0 HD21 LEU A 116 20.888 2.090 0.300 1.00 0.00 H new ATOM 0 HD22 LEU A 116 20.079 3.658 0.068 1.00 0.00 H new ATOM 0 HD23 LEU A 116 20.780 3.243 1.651 1.00 0.00 H new ATOM 1725 N LEU A 117 17.073 4.720 4.860 1.00 0.00 N ATOM 1726 CA LEU A 117 16.230 5.767 5.425 1.00 0.00 C ATOM 1727 C LEU A 117 16.937 6.499 6.570 1.00 0.00 C ATOM 1728 O LEU A 117 16.426 7.506 7.060 1.00 0.00 O ATOM 1729 CB LEU A 117 14.916 5.154 5.931 1.00 0.00 C ATOM 1730 CG LEU A 117 13.912 4.809 4.818 1.00 0.00 C ATOM 1731 CD1 LEU A 117 13.500 6.058 4.038 1.00 0.00 C ATOM 1732 CD2 LEU A 117 14.467 3.769 3.845 1.00 0.00 C ATOM 0 H LEU A 117 17.048 3.842 5.378 1.00 0.00 H new ATOM 0 HA LEU A 117 16.021 6.494 4.641 1.00 0.00 H new ATOM 0 HB2 LEU A 117 15.143 4.248 6.493 1.00 0.00 H new ATOM 0 HB3 LEU A 117 14.447 5.851 6.625 1.00 0.00 H new ATOM 0 HG LEU A 117 13.038 4.387 5.313 1.00 0.00 H new ATOM 0 HD11 LEU A 117 12.790 5.782 3.258 1.00 0.00 H new ATOM 0 HD12 LEU A 117 13.035 6.773 4.716 1.00 0.00 H new ATOM 0 HD13 LEU A 117 14.381 6.510 3.583 1.00 0.00 H new ATOM 0 HD21 LEU A 117 13.724 3.557 3.077 1.00 0.00 H new ATOM 0 HD22 LEU A 117 15.373 4.155 3.377 1.00 0.00 H new ATOM 0 HD23 LEU A 117 14.701 2.852 4.387 1.00 0.00 H new ATOM 1744 N VAL A 118 18.104 6.009 7.002 1.00 0.00 N ATOM 1745 CA VAL A 118 18.836 6.609 8.117 1.00 0.00 C ATOM 1746 C VAL A 118 19.500 7.933 7.748 1.00 0.00 C ATOM 1747 O VAL A 118 19.771 8.132 6.541 1.00 0.00 O ATOM 1748 CB VAL A 118 19.837 5.611 8.730 1.00 0.00 C ATOM 1749 CG1 VAL A 118 19.232 4.212 8.804 1.00 0.00 C ATOM 1750 CG2 VAL A 118 21.129 5.581 7.916 1.00 0.00 C ATOM 0 H VAL A 118 18.562 5.195 6.593 1.00 0.00 H new ATOM 0 HA VAL A 118 18.098 6.850 8.883 1.00 0.00 H new ATOM 0 HB VAL A 118 20.067 5.942 9.743 1.00 0.00 H new ATOM 0 HG11 VAL A 118 19.957 3.525 9.240 1.00 0.00 H new ATOM 0 HG12 VAL A 118 18.336 4.235 9.424 1.00 0.00 H new ATOM 0 HG13 VAL A 118 18.971 3.875 7.801 1.00 0.00 H new ATOM 0 HG21 VAL A 118 21.824 4.871 8.363 1.00 0.00 H new ATOM 0 HG22 VAL A 118 20.908 5.277 6.893 1.00 0.00 H new ATOM 0 HG23 VAL A 118 21.578 6.574 7.910 1.00 0.00 H new TER 1760 VAL A 118