USER MOD reduce.3.24.130724 H: found=0, std=0, add=862, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 858 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 62 TYR OH : rot 60:sc= 0.775 USER MOD Set 1.2: A 87 TYR OH : rot 38:sc= 1.13 USER MOD Set 2.1: A 5 SER OG : rot -150:sc= 0.0162 USER MOD Set 2.2: A 8 SER OG : rot 180:sc= 0.0129 USER MOD Single : A 1 GLY N :NH3+ -127:sc= 0.0568 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= -0.102 USER MOD Single : A 10 HIS : no HD1:sc= -0.0593 X(o=-0.059,f=-0.043) USER MOD Single : A 21 SER OG : rot 137:sc= 1.31 USER MOD Single : A 25 ASN : amide:sc= -2.37 K(o=-2.4,f=-12!) USER MOD Single : A 26 CYS SG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -132:sc= -0.425 (180deg=-1.22) USER MOD Single : A 53 GLN : amide:sc= -0.188 X(o=-0.19,f=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN : amide:sc= -0.0789 K(o=-0.079,f=-1.3!) USER MOD Single : A 60 MET CE :methyl 148:sc= -0.312 (180deg=-2!) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0667) USER MOD Single : A 66 SER OG : rot 92:sc= 1.15 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 TYR OH : rot 110:sc= 0.589 USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 LYS NZ :NH3+ -156:sc= 0.333 (180deg=0.0713) USER MOD Single : A 75 THR OG1 : rot -22:sc= 0.296 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc= -1.7 X(o=-1.7,f=-2.2) USER MOD Single : A 94 HIS : no HD1:sc= -0.465 K(o=-0.47,f=-1.4) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 47:sc= 0.489 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.135 -6.797 -3.299 1.00 0.00 N ATOM 2 CA GLY A 1 11.693 -5.509 -3.667 1.00 0.00 C ATOM 3 C GLY A 1 11.554 -4.480 -2.563 1.00 0.00 C ATOM 4 O GLY A 1 11.368 -4.832 -1.398 1.00 0.00 O ATOM 0 H1 GLY A 1 11.848 -7.539 -3.448 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.856 -6.781 -2.297 1.00 0.00 H new ATOM 0 H3 GLY A 1 10.301 -6.995 -3.888 1.00 0.00 H new ATOM 0 HA2 GLY A 1 12.747 -5.631 -3.915 1.00 0.00 H new ATOM 0 HA3 GLY A 1 11.194 -5.144 -4.565 1.00 0.00 H new ATOM 8 N SER A 2 11.646 -3.206 -2.928 1.00 0.00 N ATOM 9 CA SER A 2 11.535 -2.122 -1.958 1.00 0.00 C ATOM 10 C SER A 2 11.391 -0.776 -2.661 1.00 0.00 C ATOM 11 O SER A 2 12.317 -0.306 -3.322 1.00 0.00 O ATOM 12 CB SER A 2 12.760 -2.103 -1.041 1.00 0.00 C ATOM 13 OG SER A 2 12.377 -2.168 0.322 1.00 0.00 O ATOM 0 H SER A 2 11.797 -2.898 -3.889 1.00 0.00 H new ATOM 0 HA SER A 2 10.642 -2.295 -1.357 1.00 0.00 H new ATOM 0 HB2 SER A 2 13.410 -2.945 -1.280 1.00 0.00 H new ATOM 0 HB3 SER A 2 13.336 -1.195 -1.217 1.00 0.00 H new ATOM 0 HG SER A 2 13.177 -2.156 0.888 1.00 0.00 H new ATOM 19 N SER A 3 10.222 -0.160 -2.513 1.00 0.00 N ATOM 20 CA SER A 3 9.954 1.130 -3.137 1.00 0.00 C ATOM 21 C SER A 3 10.965 2.176 -2.677 1.00 0.00 C ATOM 22 O SER A 3 10.774 2.834 -1.655 1.00 0.00 O ATOM 23 CB SER A 3 8.535 1.596 -2.804 1.00 0.00 C ATOM 24 OG SER A 3 7.807 1.894 -3.983 1.00 0.00 O ATOM 0 H SER A 3 9.446 -0.534 -1.967 1.00 0.00 H new ATOM 0 HA SER A 3 10.046 1.010 -4.216 1.00 0.00 H new ATOM 0 HB2 SER A 3 8.017 0.821 -2.239 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.579 2.479 -2.167 1.00 0.00 H new ATOM 0 HG SER A 3 6.903 2.188 -3.744 1.00 0.00 H new ATOM 30 N GLY A 4 12.043 2.324 -3.441 1.00 0.00 N ATOM 31 CA GLY A 4 13.069 3.291 -3.097 1.00 0.00 C ATOM 32 C GLY A 4 14.157 2.697 -2.226 1.00 0.00 C ATOM 33 O GLY A 4 13.983 2.553 -1.015 1.00 0.00 O ATOM 0 H GLY A 4 12.224 1.792 -4.292 1.00 0.00 H new ATOM 0 HA2 GLY A 4 13.514 3.685 -4.011 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.611 4.133 -2.577 1.00 0.00 H new ATOM 37 N SER A 5 15.282 2.348 -2.841 1.00 0.00 N ATOM 38 CA SER A 5 16.401 1.760 -2.114 1.00 0.00 C ATOM 39 C SER A 5 17.681 1.824 -2.942 1.00 0.00 C ATOM 40 O SER A 5 17.642 1.762 -4.171 1.00 0.00 O ATOM 41 CB SER A 5 16.091 0.308 -1.745 1.00 0.00 C ATOM 42 OG SER A 5 17.014 -0.184 -0.789 1.00 0.00 O ATOM 0 H SER A 5 15.443 2.462 -3.842 1.00 0.00 H new ATOM 0 HA SER A 5 16.551 2.335 -1.200 1.00 0.00 H new ATOM 0 HB2 SER A 5 15.079 0.239 -1.347 1.00 0.00 H new ATOM 0 HB3 SER A 5 16.124 -0.313 -2.640 1.00 0.00 H new ATOM 0 HG SER A 5 17.125 -1.150 -0.908 1.00 0.00 H new ATOM 48 N SER A 6 18.815 1.947 -2.259 1.00 0.00 N ATOM 49 CA SER A 6 20.107 2.023 -2.931 1.00 0.00 C ATOM 50 C SER A 6 21.232 1.591 -1.995 1.00 0.00 C ATOM 51 O SER A 6 21.828 2.414 -1.302 1.00 0.00 O ATOM 52 CB SER A 6 20.363 3.446 -3.431 1.00 0.00 C ATOM 53 OG SER A 6 20.389 3.492 -4.847 1.00 0.00 O ATOM 0 H SER A 6 18.865 1.996 -1.241 1.00 0.00 H new ATOM 0 HA SER A 6 20.086 1.344 -3.784 1.00 0.00 H new ATOM 0 HB2 SER A 6 19.585 4.112 -3.057 1.00 0.00 H new ATOM 0 HB3 SER A 6 21.311 3.809 -3.035 1.00 0.00 H new ATOM 0 HG SER A 6 20.552 4.412 -5.141 1.00 0.00 H new ATOM 59 N GLY A 7 21.515 0.292 -1.980 1.00 0.00 N ATOM 60 CA GLY A 7 22.567 -0.228 -1.126 1.00 0.00 C ATOM 61 C GLY A 7 22.315 -1.662 -0.705 1.00 0.00 C ATOM 62 O GLY A 7 23.169 -2.530 -0.889 1.00 0.00 O ATOM 0 H GLY A 7 21.035 -0.409 -2.544 1.00 0.00 H new ATOM 0 HA2 GLY A 7 23.520 -0.169 -1.652 1.00 0.00 H new ATOM 0 HA3 GLY A 7 22.653 0.398 -0.238 1.00 0.00 H new ATOM 66 N SER A 8 21.140 -1.912 -0.135 1.00 0.00 N ATOM 67 CA SER A 8 20.780 -3.250 0.319 1.00 0.00 C ATOM 68 C SER A 8 20.804 -4.242 -0.839 1.00 0.00 C ATOM 69 O SER A 8 20.421 -3.912 -1.962 1.00 0.00 O ATOM 70 CB SER A 8 19.394 -3.237 0.966 1.00 0.00 C ATOM 71 OG SER A 8 18.398 -2.864 0.029 1.00 0.00 O ATOM 0 H SER A 8 20.422 -1.205 0.023 1.00 0.00 H new ATOM 0 HA SER A 8 21.515 -3.565 1.059 1.00 0.00 H new ATOM 0 HB2 SER A 8 19.168 -4.224 1.369 1.00 0.00 H new ATOM 0 HB3 SER A 8 19.387 -2.541 1.805 1.00 0.00 H new ATOM 0 HG SER A 8 17.521 -2.865 0.466 1.00 0.00 H new ATOM 77 N SER A 9 21.257 -5.460 -0.558 1.00 0.00 N ATOM 78 CA SER A 9 21.335 -6.501 -1.577 1.00 0.00 C ATOM 79 C SER A 9 21.919 -7.785 -0.998 1.00 0.00 C ATOM 80 O SER A 9 21.323 -8.857 -1.109 1.00 0.00 O ATOM 81 CB SER A 9 22.186 -6.026 -2.757 1.00 0.00 C ATOM 82 OG SER A 9 23.477 -5.631 -2.328 1.00 0.00 O ATOM 0 H SER A 9 21.575 -5.750 0.367 1.00 0.00 H new ATOM 0 HA SER A 9 20.324 -6.709 -1.928 1.00 0.00 H new ATOM 0 HB2 SER A 9 22.273 -6.826 -3.492 1.00 0.00 H new ATOM 0 HB3 SER A 9 21.692 -5.190 -3.252 1.00 0.00 H new ATOM 0 HG SER A 9 24.002 -5.333 -3.100 1.00 0.00 H new ATOM 88 N HIS A 10 23.090 -7.669 -0.380 1.00 0.00 N ATOM 89 CA HIS A 10 23.757 -8.821 0.218 1.00 0.00 C ATOM 90 C HIS A 10 24.069 -9.876 -0.838 1.00 0.00 C ATOM 91 O HIS A 10 23.178 -10.338 -1.552 1.00 0.00 O ATOM 92 CB HIS A 10 22.885 -9.426 1.319 1.00 0.00 C ATOM 93 CG HIS A 10 22.222 -8.403 2.188 1.00 0.00 C ATOM 94 ND1 HIS A 10 22.887 -7.710 3.177 1.00 0.00 N ATOM 95 CD2 HIS A 10 20.944 -7.956 2.212 1.00 0.00 C ATOM 96 CE1 HIS A 10 22.047 -6.882 3.773 1.00 0.00 C ATOM 97 NE2 HIS A 10 20.862 -7.011 3.205 1.00 0.00 N ATOM 0 H HIS A 10 23.597 -6.789 -0.280 1.00 0.00 H new ATOM 0 HA HIS A 10 24.696 -8.481 0.654 1.00 0.00 H new ATOM 0 HB2 HIS A 10 22.120 -10.053 0.862 1.00 0.00 H new ATOM 0 HB3 HIS A 10 23.500 -10.076 1.942 1.00 0.00 H new ATOM 0 HD2 HIS A 10 20.139 -8.282 1.570 1.00 0.00 H new ATOM 0 HE1 HIS A 10 22.289 -6.214 4.586 1.00 0.00 H new ATOM 0 HE2 HIS A 10 20.022 -6.493 3.462 1.00 0.00 H new ATOM 105 N LEU A 11 25.339 -10.254 -0.933 1.00 0.00 N ATOM 106 CA LEU A 11 25.770 -11.254 -1.903 1.00 0.00 C ATOM 107 C LEU A 11 24.967 -12.542 -1.750 1.00 0.00 C ATOM 108 O LEU A 11 24.324 -13.000 -2.694 1.00 0.00 O ATOM 109 CB LEU A 11 27.262 -11.547 -1.735 1.00 0.00 C ATOM 110 CG LEU A 11 27.788 -12.790 -2.455 1.00 0.00 C ATOM 111 CD1 LEU A 11 27.670 -12.623 -3.962 1.00 0.00 C ATOM 112 CD2 LEU A 11 29.230 -13.066 -2.058 1.00 0.00 C ATOM 0 H LEU A 11 26.089 -9.883 -0.350 1.00 0.00 H new ATOM 0 HA LEU A 11 25.595 -10.854 -2.902 1.00 0.00 H new ATOM 0 HB2 LEU A 11 27.824 -10.682 -2.088 1.00 0.00 H new ATOM 0 HB3 LEU A 11 27.474 -11.651 -0.671 1.00 0.00 H new ATOM 0 HG LEU A 11 27.181 -13.644 -2.156 1.00 0.00 H new ATOM 0 HD11 LEU A 11 28.049 -13.517 -4.458 1.00 0.00 H new ATOM 0 HD12 LEU A 11 26.624 -12.475 -4.231 1.00 0.00 H new ATOM 0 HD13 LEU A 11 28.252 -11.758 -4.279 1.00 0.00 H new ATOM 0 HD21 LEU A 11 29.587 -13.954 -2.580 1.00 0.00 H new ATOM 0 HD22 LEU A 11 29.851 -12.212 -2.327 1.00 0.00 H new ATOM 0 HD23 LEU A 11 29.286 -13.230 -0.982 1.00 0.00 H new ATOM 124 N TRP A 12 25.008 -13.120 -0.555 1.00 0.00 N ATOM 125 CA TRP A 12 24.282 -14.354 -0.277 1.00 0.00 C ATOM 126 C TRP A 12 22.900 -14.329 -0.921 1.00 0.00 C ATOM 127 O TRP A 12 22.380 -15.365 -1.333 1.00 0.00 O ATOM 128 CB TRP A 12 24.152 -14.565 1.232 1.00 0.00 C ATOM 129 CG TRP A 12 23.023 -13.792 1.845 1.00 0.00 C ATOM 130 CD1 TRP A 12 23.094 -12.558 2.424 1.00 0.00 C ATOM 131 CD2 TRP A 12 21.655 -14.204 1.939 1.00 0.00 C ATOM 132 NE1 TRP A 12 21.853 -12.177 2.874 1.00 0.00 N ATOM 133 CE2 TRP A 12 20.953 -13.169 2.588 1.00 0.00 C ATOM 134 CE3 TRP A 12 20.954 -15.344 1.538 1.00 0.00 C ATOM 135 CZ2 TRP A 12 19.586 -13.244 2.843 1.00 0.00 C ATOM 136 CZ3 TRP A 12 19.598 -15.417 1.793 1.00 0.00 C ATOM 137 CH2 TRP A 12 18.925 -14.372 2.440 1.00 0.00 C ATOM 0 H TRP A 12 25.536 -12.754 0.237 1.00 0.00 H new ATOM 0 HA TRP A 12 24.846 -15.183 -0.705 1.00 0.00 H new ATOM 0 HB2 TRP A 12 24.007 -15.627 1.432 1.00 0.00 H new ATOM 0 HB3 TRP A 12 25.086 -14.275 1.714 1.00 0.00 H new ATOM 0 HD1 TRP A 12 23.994 -11.968 2.515 1.00 0.00 H new ATOM 0 HE1 TRP A 12 21.637 -11.298 3.345 1.00 0.00 H new ATOM 0 HE3 TRP A 12 21.463 -16.154 1.037 1.00 0.00 H new ATOM 0 HZ2 TRP A 12 19.066 -12.440 3.342 1.00 0.00 H new ATOM 0 HZ3 TRP A 12 19.047 -16.295 1.488 1.00 0.00 H new ATOM 0 HH2 TRP A 12 17.864 -14.459 2.624 1.00 0.00 H new ATOM 148 N GLU A 13 22.312 -13.140 -1.003 1.00 0.00 N ATOM 149 CA GLU A 13 20.989 -12.982 -1.597 1.00 0.00 C ATOM 150 C GLU A 13 21.072 -12.989 -3.121 1.00 0.00 C ATOM 151 O GLU A 13 20.223 -13.569 -3.797 1.00 0.00 O ATOM 152 CB GLU A 13 20.342 -11.682 -1.116 1.00 0.00 C ATOM 153 CG GLU A 13 19.289 -11.888 -0.040 1.00 0.00 C ATOM 154 CD GLU A 13 18.043 -11.055 -0.275 1.00 0.00 C ATOM 155 OE1 GLU A 13 17.757 -10.736 -1.448 1.00 0.00 O ATOM 156 OE2 GLU A 13 17.356 -10.723 0.712 1.00 0.00 O ATOM 0 H GLU A 13 22.730 -12.273 -0.666 1.00 0.00 H new ATOM 0 HA GLU A 13 20.374 -13.824 -1.281 1.00 0.00 H new ATOM 0 HB2 GLU A 13 21.118 -11.021 -0.731 1.00 0.00 H new ATOM 0 HB3 GLU A 13 19.886 -11.177 -1.967 1.00 0.00 H new ATOM 0 HG2 GLU A 13 19.015 -12.942 -0.002 1.00 0.00 H new ATOM 0 HG3 GLU A 13 19.713 -11.634 0.931 1.00 0.00 H new ATOM 163 N PHE A 14 22.102 -12.339 -3.654 1.00 0.00 N ATOM 164 CA PHE A 14 22.296 -12.268 -5.098 1.00 0.00 C ATOM 165 C PHE A 14 22.494 -13.661 -5.689 1.00 0.00 C ATOM 166 O PHE A 14 21.752 -14.082 -6.576 1.00 0.00 O ATOM 167 CB PHE A 14 23.501 -11.385 -5.428 1.00 0.00 C ATOM 168 CG PHE A 14 24.166 -11.741 -6.727 1.00 0.00 C ATOM 169 CD1 PHE A 14 25.185 -12.679 -6.765 1.00 0.00 C ATOM 170 CD2 PHE A 14 23.773 -11.136 -7.910 1.00 0.00 C ATOM 171 CE1 PHE A 14 25.799 -13.009 -7.959 1.00 0.00 C ATOM 172 CE2 PHE A 14 24.383 -11.462 -9.107 1.00 0.00 C ATOM 173 CZ PHE A 14 25.398 -12.399 -9.131 1.00 0.00 C ATOM 0 H PHE A 14 22.814 -11.854 -3.108 1.00 0.00 H new ATOM 0 HA PHE A 14 21.401 -11.830 -5.539 1.00 0.00 H new ATOM 0 HB2 PHE A 14 23.179 -10.344 -5.467 1.00 0.00 H new ATOM 0 HB3 PHE A 14 24.231 -11.463 -4.622 1.00 0.00 H new ATOM 0 HD1 PHE A 14 25.503 -13.158 -5.851 1.00 0.00 H new ATOM 0 HD2 PHE A 14 22.981 -10.402 -7.897 1.00 0.00 H new ATOM 0 HE1 PHE A 14 26.591 -13.743 -7.975 1.00 0.00 H new ATOM 0 HE2 PHE A 14 24.066 -10.985 -10.023 1.00 0.00 H new ATOM 0 HZ PHE A 14 25.877 -12.654 -10.065 1.00 0.00 H new ATOM 183 N VAL A 15 23.502 -14.371 -5.191 1.00 0.00 N ATOM 184 CA VAL A 15 23.798 -15.716 -5.668 1.00 0.00 C ATOM 185 C VAL A 15 22.600 -16.640 -5.487 1.00 0.00 C ATOM 186 O VAL A 15 22.263 -17.419 -6.380 1.00 0.00 O ATOM 187 CB VAL A 15 25.012 -16.317 -4.934 1.00 0.00 C ATOM 188 CG1 VAL A 15 24.793 -16.290 -3.429 1.00 0.00 C ATOM 189 CG2 VAL A 15 25.277 -17.735 -5.417 1.00 0.00 C ATOM 0 H VAL A 15 24.127 -14.037 -4.457 1.00 0.00 H new ATOM 0 HA VAL A 15 24.030 -15.631 -6.730 1.00 0.00 H new ATOM 0 HB VAL A 15 25.889 -15.710 -5.160 1.00 0.00 H new ATOM 0 HG11 VAL A 15 25.661 -16.718 -2.927 1.00 0.00 H new ATOM 0 HG12 VAL A 15 24.655 -15.260 -3.100 1.00 0.00 H new ATOM 0 HG13 VAL A 15 23.906 -16.872 -3.180 1.00 0.00 H new ATOM 0 HG21 VAL A 15 26.138 -18.145 -4.888 1.00 0.00 H new ATOM 0 HG22 VAL A 15 24.402 -18.355 -5.222 1.00 0.00 H new ATOM 0 HG23 VAL A 15 25.481 -17.723 -6.488 1.00 0.00 H new ATOM 199 N ARG A 16 21.959 -16.549 -4.327 1.00 0.00 N ATOM 200 CA ARG A 16 20.797 -17.378 -4.028 1.00 0.00 C ATOM 201 C ARG A 16 19.675 -17.123 -5.030 1.00 0.00 C ATOM 202 O ARG A 16 18.963 -18.045 -5.427 1.00 0.00 O ATOM 203 CB ARG A 16 20.299 -17.103 -2.608 1.00 0.00 C ATOM 204 CG ARG A 16 19.025 -17.852 -2.253 1.00 0.00 C ATOM 205 CD ARG A 16 17.959 -16.913 -1.711 1.00 0.00 C ATOM 206 NE ARG A 16 17.689 -15.806 -2.624 1.00 0.00 N ATOM 207 CZ ARG A 16 16.704 -14.932 -2.448 1.00 0.00 C ATOM 208 NH1 ARG A 16 15.901 -15.035 -1.398 1.00 0.00 N ATOM 209 NH2 ARG A 16 16.522 -13.951 -3.323 1.00 0.00 N ATOM 0 H ARG A 16 22.224 -15.909 -3.578 1.00 0.00 H new ATOM 0 HA ARG A 16 21.098 -18.423 -4.104 1.00 0.00 H new ATOM 0 HB2 ARG A 16 21.080 -17.376 -1.899 1.00 0.00 H new ATOM 0 HB3 ARG A 16 20.125 -16.033 -2.494 1.00 0.00 H new ATOM 0 HG2 ARG A 16 18.645 -18.364 -3.137 1.00 0.00 H new ATOM 0 HG3 ARG A 16 19.247 -18.619 -1.511 1.00 0.00 H new ATOM 0 HD2 ARG A 16 17.039 -17.471 -1.536 1.00 0.00 H new ATOM 0 HD3 ARG A 16 18.280 -16.518 -0.747 1.00 0.00 H new ATOM 0 HE ARG A 16 18.289 -15.698 -3.441 1.00 0.00 H new ATOM 0 HH11 ARG A 16 16.039 -15.787 -0.723 1.00 0.00 H new ATOM 0 HH12 ARG A 16 15.146 -14.362 -1.266 1.00 0.00 H new ATOM 0 HH21 ARG A 16 17.139 -13.868 -4.131 1.00 0.00 H new ATOM 0 HH22 ARG A 16 15.766 -13.280 -3.187 1.00 0.00 H new ATOM 223 N ASP A 17 19.524 -15.866 -5.434 1.00 0.00 N ATOM 224 CA ASP A 17 18.489 -15.490 -6.390 1.00 0.00 C ATOM 225 C ASP A 17 18.642 -16.271 -7.692 1.00 0.00 C ATOM 226 O ASP A 17 17.683 -16.864 -8.189 1.00 0.00 O ATOM 227 CB ASP A 17 18.549 -13.988 -6.673 1.00 0.00 C ATOM 228 CG ASP A 17 17.444 -13.530 -7.605 1.00 0.00 C ATOM 229 OD1 ASP A 17 16.943 -14.365 -8.387 1.00 0.00 O ATOM 230 OD2 ASP A 17 17.080 -12.337 -7.552 1.00 0.00 O ATOM 0 H ASP A 17 20.105 -15.091 -5.114 1.00 0.00 H new ATOM 0 HA ASP A 17 17.520 -15.732 -5.953 1.00 0.00 H new ATOM 0 HB2 ASP A 17 18.478 -13.441 -5.733 1.00 0.00 H new ATOM 0 HB3 ASP A 17 19.516 -13.742 -7.112 1.00 0.00 H new ATOM 235 N LEU A 18 19.852 -16.268 -8.240 1.00 0.00 N ATOM 236 CA LEU A 18 20.130 -16.976 -9.484 1.00 0.00 C ATOM 237 C LEU A 18 19.499 -18.364 -9.474 1.00 0.00 C ATOM 238 O LEU A 18 18.883 -18.785 -10.453 1.00 0.00 O ATOM 239 CB LEU A 18 21.640 -17.090 -9.702 1.00 0.00 C ATOM 240 CG LEU A 18 22.281 -15.994 -10.554 1.00 0.00 C ATOM 241 CD1 LEU A 18 22.200 -14.651 -9.844 1.00 0.00 C ATOM 242 CD2 LEU A 18 23.727 -16.344 -10.874 1.00 0.00 C ATOM 0 H LEU A 18 20.656 -15.783 -7.842 1.00 0.00 H new ATOM 0 HA LEU A 18 19.693 -16.406 -10.304 1.00 0.00 H new ATOM 0 HB2 LEU A 18 22.128 -17.096 -8.727 1.00 0.00 H new ATOM 0 HB3 LEU A 18 21.848 -18.053 -10.169 1.00 0.00 H new ATOM 0 HG LEU A 18 21.730 -15.920 -11.492 1.00 0.00 H new ATOM 0 HD11 LEU A 18 22.661 -13.883 -10.465 1.00 0.00 H new ATOM 0 HD12 LEU A 18 21.155 -14.396 -9.667 1.00 0.00 H new ATOM 0 HD13 LEU A 18 22.726 -14.711 -8.891 1.00 0.00 H new ATOM 0 HD21 LEU A 18 24.167 -15.553 -11.481 1.00 0.00 H new ATOM 0 HD22 LEU A 18 24.291 -16.446 -9.947 1.00 0.00 H new ATOM 0 HD23 LEU A 18 23.761 -17.284 -11.424 1.00 0.00 H new ATOM 254 N LEU A 19 19.656 -19.071 -8.360 1.00 0.00 N ATOM 255 CA LEU A 19 19.100 -20.412 -8.220 1.00 0.00 C ATOM 256 C LEU A 19 17.586 -20.396 -8.407 1.00 0.00 C ATOM 257 O LEU A 19 17.013 -21.310 -9.002 1.00 0.00 O ATOM 258 CB LEU A 19 19.450 -20.990 -6.848 1.00 0.00 C ATOM 259 CG LEU A 19 20.896 -21.450 -6.662 1.00 0.00 C ATOM 260 CD1 LEU A 19 21.239 -21.551 -5.184 1.00 0.00 C ATOM 261 CD2 LEU A 19 21.124 -22.785 -7.356 1.00 0.00 C ATOM 0 H LEU A 19 20.164 -18.738 -7.541 1.00 0.00 H new ATOM 0 HA LEU A 19 19.537 -21.042 -8.995 1.00 0.00 H new ATOM 0 HB2 LEU A 19 19.229 -20.237 -6.092 1.00 0.00 H new ATOM 0 HB3 LEU A 19 18.793 -21.838 -6.655 1.00 0.00 H new ATOM 0 HG LEU A 19 21.554 -20.709 -7.116 1.00 0.00 H new ATOM 0 HD11 LEU A 19 22.272 -21.880 -5.072 1.00 0.00 H new ATOM 0 HD12 LEU A 19 21.116 -20.575 -4.714 1.00 0.00 H new ATOM 0 HD13 LEU A 19 20.575 -22.271 -4.705 1.00 0.00 H new ATOM 0 HD21 LEU A 19 22.159 -23.097 -7.213 1.00 0.00 H new ATOM 0 HD22 LEU A 19 20.457 -23.535 -6.931 1.00 0.00 H new ATOM 0 HD23 LEU A 19 20.920 -22.681 -8.422 1.00 0.00 H new ATOM 273 N LEU A 20 16.943 -19.351 -7.897 1.00 0.00 N ATOM 274 CA LEU A 20 15.495 -19.214 -8.009 1.00 0.00 C ATOM 275 C LEU A 20 15.119 -18.419 -9.255 1.00 0.00 C ATOM 276 O LEU A 20 13.941 -18.293 -9.591 1.00 0.00 O ATOM 277 CB LEU A 20 14.930 -18.530 -6.763 1.00 0.00 C ATOM 278 CG LEU A 20 15.606 -18.884 -5.438 1.00 0.00 C ATOM 279 CD1 LEU A 20 14.935 -18.154 -4.285 1.00 0.00 C ATOM 280 CD2 LEU A 20 15.576 -20.388 -5.209 1.00 0.00 C ATOM 0 H LEU A 20 17.402 -18.586 -7.402 1.00 0.00 H new ATOM 0 HA LEU A 20 15.065 -20.212 -8.094 1.00 0.00 H new ATOM 0 HB2 LEU A 20 14.995 -17.451 -6.904 1.00 0.00 H new ATOM 0 HB3 LEU A 20 13.871 -18.778 -6.685 1.00 0.00 H new ATOM 0 HG LEU A 20 16.647 -18.565 -5.487 1.00 0.00 H new ATOM 0 HD11 LEU A 20 15.429 -18.418 -3.350 1.00 0.00 H new ATOM 0 HD12 LEU A 20 15.009 -17.078 -4.443 1.00 0.00 H new ATOM 0 HD13 LEU A 20 13.885 -18.442 -4.234 1.00 0.00 H new ATOM 0 HD21 LEU A 20 16.061 -20.622 -4.261 1.00 0.00 H new ATOM 0 HD22 LEU A 20 14.542 -20.731 -5.181 1.00 0.00 H new ATOM 0 HD23 LEU A 20 16.103 -20.890 -6.020 1.00 0.00 H new ATOM 292 N SER A 21 16.127 -17.885 -9.937 1.00 0.00 N ATOM 293 CA SER A 21 15.901 -17.100 -11.146 1.00 0.00 C ATOM 294 C SER A 21 16.644 -17.706 -12.333 1.00 0.00 C ATOM 295 O SER A 21 17.734 -17.271 -12.704 1.00 0.00 O ATOM 296 CB SER A 21 16.353 -15.654 -10.932 1.00 0.00 C ATOM 297 OG SER A 21 15.332 -14.887 -10.317 1.00 0.00 O ATOM 0 H SER A 21 17.108 -17.981 -9.674 1.00 0.00 H new ATOM 0 HA SER A 21 14.833 -17.111 -11.363 1.00 0.00 H new ATOM 0 HB2 SER A 21 17.249 -15.638 -10.311 1.00 0.00 H new ATOM 0 HB3 SER A 21 16.621 -15.208 -11.890 1.00 0.00 H new ATOM 0 HG SER A 21 15.722 -14.328 -9.613 1.00 0.00 H new ATOM 303 N PRO A 22 16.040 -18.736 -12.944 1.00 0.00 N ATOM 304 CA PRO A 22 16.624 -19.424 -14.099 1.00 0.00 C ATOM 305 C PRO A 22 16.627 -18.555 -15.352 1.00 0.00 C ATOM 306 O PRO A 22 17.174 -18.940 -16.384 1.00 0.00 O ATOM 307 CB PRO A 22 15.708 -20.636 -14.291 1.00 0.00 C ATOM 308 CG PRO A 22 14.404 -20.222 -13.701 1.00 0.00 C ATOM 309 CD PRO A 22 14.739 -19.307 -12.555 1.00 0.00 C ATOM 0 HA PRO A 22 17.669 -19.684 -13.932 1.00 0.00 H new ATOM 0 HB2 PRO A 22 15.603 -20.890 -15.346 1.00 0.00 H new ATOM 0 HB3 PRO A 22 16.107 -21.518 -13.790 1.00 0.00 H new ATOM 0 HG2 PRO A 22 13.786 -19.712 -14.440 1.00 0.00 H new ATOM 0 HG3 PRO A 22 13.839 -21.088 -13.356 1.00 0.00 H new ATOM 0 HD2 PRO A 22 13.983 -18.533 -12.425 1.00 0.00 H new ATOM 0 HD3 PRO A 22 14.804 -19.851 -11.612 1.00 0.00 H new ATOM 317 N GLU A 23 16.012 -17.380 -15.253 1.00 0.00 N ATOM 318 CA GLU A 23 15.944 -16.457 -16.380 1.00 0.00 C ATOM 319 C GLU A 23 17.202 -15.598 -16.456 1.00 0.00 C ATOM 320 O GLU A 23 17.578 -15.124 -17.527 1.00 0.00 O ATOM 321 CB GLU A 23 14.708 -15.562 -16.260 1.00 0.00 C ATOM 322 CG GLU A 23 13.487 -16.112 -16.979 1.00 0.00 C ATOM 323 CD GLU A 23 12.266 -15.228 -16.812 1.00 0.00 C ATOM 324 OE1 GLU A 23 11.941 -14.876 -15.659 1.00 0.00 O ATOM 325 OE2 GLU A 23 11.635 -14.890 -17.835 1.00 0.00 O ATOM 0 H GLU A 23 15.554 -17.045 -14.405 1.00 0.00 H new ATOM 0 HA GLU A 23 15.871 -17.045 -17.295 1.00 0.00 H new ATOM 0 HB2 GLU A 23 14.468 -15.427 -15.205 1.00 0.00 H new ATOM 0 HB3 GLU A 23 14.943 -14.576 -16.662 1.00 0.00 H new ATOM 0 HG2 GLU A 23 13.712 -16.218 -18.040 1.00 0.00 H new ATOM 0 HG3 GLU A 23 13.264 -17.109 -16.599 1.00 0.00 H new ATOM 332 N GLU A 24 17.848 -15.401 -15.310 1.00 0.00 N ATOM 333 CA GLU A 24 19.063 -14.598 -15.247 1.00 0.00 C ATOM 334 C GLU A 24 20.299 -15.488 -15.150 1.00 0.00 C ATOM 335 O GLU A 24 21.284 -15.279 -15.858 1.00 0.00 O ATOM 336 CB GLU A 24 19.011 -13.647 -14.049 1.00 0.00 C ATOM 337 CG GLU A 24 18.579 -12.236 -14.410 1.00 0.00 C ATOM 338 CD GLU A 24 19.686 -11.219 -14.212 1.00 0.00 C ATOM 339 OE1 GLU A 24 20.594 -11.155 -15.067 1.00 0.00 O ATOM 340 OE2 GLU A 24 19.643 -10.486 -13.201 1.00 0.00 O ATOM 0 H GLU A 24 17.550 -15.786 -14.414 1.00 0.00 H new ATOM 0 HA GLU A 24 19.129 -14.013 -16.164 1.00 0.00 H new ATOM 0 HB2 GLU A 24 18.323 -14.050 -13.306 1.00 0.00 H new ATOM 0 HB3 GLU A 24 19.996 -13.608 -13.583 1.00 0.00 H new ATOM 0 HG2 GLU A 24 18.253 -12.215 -15.450 1.00 0.00 H new ATOM 0 HG3 GLU A 24 17.720 -11.956 -13.801 1.00 0.00 H new ATOM 347 N ASN A 25 20.239 -16.480 -14.269 1.00 0.00 N ATOM 348 CA ASN A 25 21.353 -17.402 -14.078 1.00 0.00 C ATOM 349 C ASN A 25 21.630 -18.193 -15.353 1.00 0.00 C ATOM 350 O ASN A 25 20.758 -18.902 -15.857 1.00 0.00 O ATOM 351 CB ASN A 25 21.057 -18.361 -12.924 1.00 0.00 C ATOM 352 CG ASN A 25 22.213 -19.302 -12.642 1.00 0.00 C ATOM 353 OD1 ASN A 25 23.366 -18.992 -12.940 1.00 0.00 O ATOM 354 ND2 ASN A 25 21.907 -20.459 -12.066 1.00 0.00 N ATOM 0 H ASN A 25 19.431 -16.667 -13.675 1.00 0.00 H new ATOM 0 HA ASN A 25 22.239 -16.815 -13.836 1.00 0.00 H new ATOM 0 HB2 ASN A 25 20.833 -17.786 -12.026 1.00 0.00 H new ATOM 0 HB3 ASN A 25 20.167 -18.944 -13.159 1.00 0.00 H new ATOM 0 HD21 ASN A 25 22.642 -21.133 -11.853 1.00 0.00 H new ATOM 0 HD22 ASN A 25 20.937 -20.674 -11.837 1.00 0.00 H new ATOM 361 N CYS A 26 22.847 -18.066 -15.869 1.00 0.00 N ATOM 362 CA CYS A 26 23.239 -18.769 -17.086 1.00 0.00 C ATOM 363 C CYS A 26 24.340 -19.783 -16.797 1.00 0.00 C ATOM 364 O CYS A 26 25.526 -19.479 -16.918 1.00 0.00 O ATOM 365 CB CYS A 26 23.712 -17.772 -18.145 1.00 0.00 C ATOM 366 SG CYS A 26 23.011 -18.052 -19.788 1.00 0.00 S ATOM 0 H CYS A 26 23.580 -17.483 -15.464 1.00 0.00 H new ATOM 0 HA CYS A 26 22.368 -19.304 -17.464 1.00 0.00 H new ATOM 0 HB2 CYS A 26 23.456 -16.764 -17.819 1.00 0.00 H new ATOM 0 HB3 CYS A 26 24.799 -17.819 -18.213 1.00 0.00 H new ATOM 0 HG CYS A 26 23.469 -17.158 -20.613 1.00 0.00 H new ATOM 372 N GLY A 27 23.939 -20.991 -16.413 1.00 0.00 N ATOM 373 CA GLY A 27 24.904 -22.032 -16.110 1.00 0.00 C ATOM 374 C GLY A 27 25.995 -21.557 -15.172 1.00 0.00 C ATOM 375 O GLY A 27 27.168 -21.879 -15.360 1.00 0.00 O ATOM 0 H GLY A 27 22.963 -21.267 -16.306 1.00 0.00 H new ATOM 0 HA2 GLY A 27 24.389 -22.881 -15.662 1.00 0.00 H new ATOM 0 HA3 GLY A 27 25.355 -22.386 -17.037 1.00 0.00 H new ATOM 379 N ILE A 28 25.608 -20.788 -14.160 1.00 0.00 N ATOM 380 CA ILE A 28 26.563 -20.267 -13.189 1.00 0.00 C ATOM 381 C ILE A 28 26.545 -21.089 -11.905 1.00 0.00 C ATOM 382 O ILE A 28 27.580 -21.290 -11.269 1.00 0.00 O ATOM 383 CB ILE A 28 26.270 -18.794 -12.846 1.00 0.00 C ATOM 384 CG1 ILE A 28 25.867 -18.025 -14.106 1.00 0.00 C ATOM 385 CG2 ILE A 28 27.484 -18.151 -12.193 1.00 0.00 C ATOM 386 CD1 ILE A 28 25.241 -16.678 -13.818 1.00 0.00 C ATOM 0 H ILE A 28 24.641 -20.512 -13.991 1.00 0.00 H new ATOM 0 HA ILE A 28 27.549 -20.336 -13.648 1.00 0.00 H new ATOM 0 HB ILE A 28 25.440 -18.759 -12.140 1.00 0.00 H new ATOM 0 HG12 ILE A 28 26.748 -17.881 -14.731 1.00 0.00 H new ATOM 0 HG13 ILE A 28 25.164 -18.628 -14.680 1.00 0.00 H new ATOM 0 HG21 ILE A 28 27.262 -17.110 -11.957 1.00 0.00 H new ATOM 0 HG22 ILE A 28 27.731 -18.687 -11.276 1.00 0.00 H new ATOM 0 HG23 ILE A 28 28.331 -18.194 -12.878 1.00 0.00 H new ATOM 0 HD11 ILE A 28 24.981 -16.190 -14.757 1.00 0.00 H new ATOM 0 HD12 ILE A 28 24.341 -16.816 -13.219 1.00 0.00 H new ATOM 0 HD13 ILE A 28 25.950 -16.057 -13.270 1.00 0.00 H new ATOM 398 N LEU A 29 25.362 -21.563 -11.529 1.00 0.00 N ATOM 399 CA LEU A 29 25.209 -22.366 -10.321 1.00 0.00 C ATOM 400 C LEU A 29 24.420 -23.639 -10.610 1.00 0.00 C ATOM 401 O LEU A 29 23.918 -23.831 -11.716 1.00 0.00 O ATOM 402 CB LEU A 29 24.506 -21.554 -9.231 1.00 0.00 C ATOM 403 CG LEU A 29 25.067 -20.156 -8.969 1.00 0.00 C ATOM 404 CD1 LEU A 29 23.940 -19.168 -8.711 1.00 0.00 C ATOM 405 CD2 LEU A 29 26.036 -20.181 -7.795 1.00 0.00 C ATOM 0 H LEU A 29 24.495 -21.405 -12.043 1.00 0.00 H new ATOM 0 HA LEU A 29 26.203 -22.647 -9.973 1.00 0.00 H new ATOM 0 HB2 LEU A 29 23.454 -21.457 -9.499 1.00 0.00 H new ATOM 0 HB3 LEU A 29 24.547 -22.120 -8.301 1.00 0.00 H new ATOM 0 HG LEU A 29 25.611 -19.832 -9.856 1.00 0.00 H new ATOM 0 HD11 LEU A 29 24.359 -18.179 -8.527 1.00 0.00 H new ATOM 0 HD12 LEU A 29 23.285 -19.128 -9.581 1.00 0.00 H new ATOM 0 HD13 LEU A 29 23.368 -19.488 -7.840 1.00 0.00 H new ATOM 0 HD21 LEU A 29 26.425 -19.178 -7.623 1.00 0.00 H new ATOM 0 HD22 LEU A 29 25.516 -20.527 -6.901 1.00 0.00 H new ATOM 0 HD23 LEU A 29 26.861 -20.857 -8.019 1.00 0.00 H new ATOM 417 N GLU A 30 24.315 -24.505 -9.606 1.00 0.00 N ATOM 418 CA GLU A 30 23.586 -25.759 -9.753 1.00 0.00 C ATOM 419 C GLU A 30 22.939 -26.170 -8.434 1.00 0.00 C ATOM 420 O GLU A 30 23.512 -25.976 -7.362 1.00 0.00 O ATOM 421 CB GLU A 30 24.524 -26.865 -10.240 1.00 0.00 C ATOM 422 CG GLU A 30 24.605 -26.973 -11.754 1.00 0.00 C ATOM 423 CD GLU A 30 24.216 -28.348 -12.263 1.00 0.00 C ATOM 424 OE1 GLU A 30 25.062 -29.264 -12.201 1.00 0.00 O ATOM 425 OE2 GLU A 30 23.066 -28.506 -12.722 1.00 0.00 O ATOM 0 H GLU A 30 24.725 -24.361 -8.683 1.00 0.00 H new ATOM 0 HA GLU A 30 22.799 -25.608 -10.492 1.00 0.00 H new ATOM 0 HB2 GLU A 30 25.523 -26.683 -9.843 1.00 0.00 H new ATOM 0 HB3 GLU A 30 24.188 -27.819 -9.834 1.00 0.00 H new ATOM 0 HG2 GLU A 30 23.951 -26.225 -12.203 1.00 0.00 H new ATOM 0 HG3 GLU A 30 25.621 -26.744 -12.077 1.00 0.00 H new ATOM 432 N TRP A 31 21.742 -26.739 -8.521 1.00 0.00 N ATOM 433 CA TRP A 31 21.016 -27.177 -7.335 1.00 0.00 C ATOM 434 C TRP A 31 21.412 -28.597 -6.947 1.00 0.00 C ATOM 435 O TRP A 31 20.843 -29.567 -7.446 1.00 0.00 O ATOM 436 CB TRP A 31 19.507 -27.104 -7.579 1.00 0.00 C ATOM 437 CG TRP A 31 18.892 -25.818 -7.116 1.00 0.00 C ATOM 438 CD1 TRP A 31 18.106 -24.975 -7.849 1.00 0.00 C ATOM 439 CD2 TRP A 31 19.015 -25.228 -5.817 1.00 0.00 C ATOM 440 NE1 TRP A 31 17.732 -23.897 -7.084 1.00 0.00 N ATOM 441 CE2 TRP A 31 18.276 -24.029 -5.833 1.00 0.00 C ATOM 442 CE3 TRP A 31 19.674 -25.597 -4.642 1.00 0.00 C ATOM 443 CZ2 TRP A 31 18.181 -23.198 -4.720 1.00 0.00 C ATOM 444 CZ3 TRP A 31 19.580 -24.771 -3.538 1.00 0.00 C ATOM 445 CH2 TRP A 31 18.837 -23.584 -3.583 1.00 0.00 C ATOM 0 H TRP A 31 21.254 -26.908 -9.401 1.00 0.00 H new ATOM 0 HA TRP A 31 21.277 -26.510 -6.513 1.00 0.00 H new ATOM 0 HB2 TRP A 31 19.312 -27.229 -8.644 1.00 0.00 H new ATOM 0 HB3 TRP A 31 19.023 -27.935 -7.067 1.00 0.00 H new ATOM 0 HD1 TRP A 31 17.821 -25.133 -8.879 1.00 0.00 H new ATOM 0 HE1 TRP A 31 17.145 -23.124 -7.396 1.00 0.00 H new ATOM 0 HE3 TRP A 31 20.247 -26.511 -4.597 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 17.610 -22.282 -4.753 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 20.088 -25.045 -2.625 1.00 0.00 H new ATOM 0 HH2 TRP A 31 18.781 -22.961 -2.702 1.00 0.00 H new ATOM 456 N GLU A 32 22.391 -28.711 -6.055 1.00 0.00 N ATOM 457 CA GLU A 32 22.863 -30.014 -5.602 1.00 0.00 C ATOM 458 C GLU A 32 21.830 -30.683 -4.699 1.00 0.00 C ATOM 459 O GLU A 32 21.684 -31.906 -4.705 1.00 0.00 O ATOM 460 CB GLU A 32 24.191 -29.870 -4.856 1.00 0.00 C ATOM 461 CG GLU A 32 25.328 -29.369 -5.730 1.00 0.00 C ATOM 462 CD GLU A 32 25.368 -30.052 -7.084 1.00 0.00 C ATOM 463 OE1 GLU A 32 24.478 -29.775 -7.915 1.00 0.00 O ATOM 464 OE2 GLU A 32 26.290 -30.863 -7.311 1.00 0.00 O ATOM 0 H GLU A 32 22.872 -27.917 -5.632 1.00 0.00 H new ATOM 0 HA GLU A 32 23.014 -30.642 -6.480 1.00 0.00 H new ATOM 0 HB2 GLU A 32 24.056 -29.183 -4.020 1.00 0.00 H new ATOM 0 HB3 GLU A 32 24.467 -30.836 -4.433 1.00 0.00 H new ATOM 0 HG2 GLU A 32 25.225 -28.293 -5.873 1.00 0.00 H new ATOM 0 HG3 GLU A 32 26.275 -29.533 -5.216 1.00 0.00 H new ATOM 471 N ASP A 33 21.117 -29.873 -3.924 1.00 0.00 N ATOM 472 CA ASP A 33 20.098 -30.385 -3.016 1.00 0.00 C ATOM 473 C ASP A 33 19.112 -29.286 -2.631 1.00 0.00 C ATOM 474 O ASP A 33 19.469 -28.332 -1.940 1.00 0.00 O ATOM 475 CB ASP A 33 20.749 -30.966 -1.760 1.00 0.00 C ATOM 476 CG ASP A 33 20.869 -32.476 -1.816 1.00 0.00 C ATOM 477 OD1 ASP A 33 20.082 -33.107 -2.552 1.00 0.00 O ATOM 478 OD2 ASP A 33 21.750 -33.028 -1.123 1.00 0.00 O ATOM 0 H ASP A 33 21.226 -28.859 -3.907 1.00 0.00 H new ATOM 0 HA ASP A 33 19.551 -31.175 -3.531 1.00 0.00 H new ATOM 0 HB2 ASP A 33 21.740 -30.530 -1.633 1.00 0.00 H new ATOM 0 HB3 ASP A 33 20.162 -30.683 -0.886 1.00 0.00 H new ATOM 483 N ARG A 34 17.870 -29.427 -3.083 1.00 0.00 N ATOM 484 CA ARG A 34 16.833 -28.446 -2.788 1.00 0.00 C ATOM 485 C ARG A 34 16.427 -28.510 -1.319 1.00 0.00 C ATOM 486 O ARG A 34 16.202 -27.481 -0.682 1.00 0.00 O ATOM 487 CB ARG A 34 15.611 -28.681 -3.678 1.00 0.00 C ATOM 488 CG ARG A 34 15.850 -28.347 -5.141 1.00 0.00 C ATOM 489 CD ARG A 34 15.985 -26.848 -5.356 1.00 0.00 C ATOM 490 NE ARG A 34 14.698 -26.164 -5.266 1.00 0.00 N ATOM 491 CZ ARG A 34 14.198 -25.683 -4.133 1.00 0.00 C ATOM 492 NH1 ARG A 34 14.875 -25.811 -3.000 1.00 0.00 N ATOM 493 NH2 ARG A 34 13.020 -25.073 -4.132 1.00 0.00 N ATOM 0 H ARG A 34 17.558 -30.212 -3.655 1.00 0.00 H new ATOM 0 HA ARG A 34 17.237 -27.454 -2.992 1.00 0.00 H new ATOM 0 HB2 ARG A 34 15.309 -29.725 -3.597 1.00 0.00 H new ATOM 0 HB3 ARG A 34 14.781 -28.079 -3.308 1.00 0.00 H new ATOM 0 HG2 ARG A 34 16.754 -28.848 -5.487 1.00 0.00 H new ATOM 0 HG3 ARG A 34 15.025 -28.729 -5.742 1.00 0.00 H new ATOM 0 HD2 ARG A 34 16.668 -26.435 -4.613 1.00 0.00 H new ATOM 0 HD3 ARG A 34 16.427 -26.661 -6.334 1.00 0.00 H new ATOM 0 HE ARG A 34 14.153 -26.049 -6.120 1.00 0.00 H new ATOM 0 HH11 ARG A 34 15.781 -26.279 -2.997 1.00 0.00 H new ATOM 0 HH12 ARG A 34 14.490 -25.441 -2.131 1.00 0.00 H new ATOM 0 HH21 ARG A 34 12.497 -24.973 -5.002 1.00 0.00 H new ATOM 0 HH22 ARG A 34 12.637 -24.704 -3.261 1.00 0.00 H new ATOM 507 N GLU A 35 16.334 -29.725 -0.788 1.00 0.00 N ATOM 508 CA GLU A 35 15.952 -29.923 0.605 1.00 0.00 C ATOM 509 C GLU A 35 16.988 -29.312 1.544 1.00 0.00 C ATOM 510 O GLU A 35 16.649 -28.538 2.439 1.00 0.00 O ATOM 511 CB GLU A 35 15.791 -31.414 0.907 1.00 0.00 C ATOM 512 CG GLU A 35 14.446 -31.979 0.483 1.00 0.00 C ATOM 513 CD GLU A 35 14.188 -31.819 -1.003 1.00 0.00 C ATOM 514 OE1 GLU A 35 14.638 -32.688 -1.779 1.00 0.00 O ATOM 515 OE2 GLU A 35 13.538 -30.826 -1.389 1.00 0.00 O ATOM 0 H GLU A 35 16.518 -30.587 -1.301 1.00 0.00 H new ATOM 0 HA GLU A 35 14.998 -29.422 0.768 1.00 0.00 H new ATOM 0 HB2 GLU A 35 16.583 -31.966 0.401 1.00 0.00 H new ATOM 0 HB3 GLU A 35 15.923 -31.576 1.977 1.00 0.00 H new ATOM 0 HG2 GLU A 35 14.402 -33.036 0.744 1.00 0.00 H new ATOM 0 HG3 GLU A 35 13.654 -31.480 1.041 1.00 0.00 H new ATOM 522 N GLN A 36 18.252 -29.666 1.334 1.00 0.00 N ATOM 523 CA GLN A 36 19.337 -29.154 2.162 1.00 0.00 C ATOM 524 C GLN A 36 19.679 -27.716 1.784 1.00 0.00 C ATOM 525 O GLN A 36 20.040 -26.908 2.638 1.00 0.00 O ATOM 526 CB GLN A 36 20.576 -30.039 2.021 1.00 0.00 C ATOM 527 CG GLN A 36 20.267 -31.527 2.054 1.00 0.00 C ATOM 528 CD GLN A 36 21.251 -32.309 2.902 1.00 0.00 C ATOM 529 OE1 GLN A 36 22.121 -33.008 2.380 1.00 0.00 O ATOM 530 NE2 GLN A 36 21.120 -32.195 4.219 1.00 0.00 N ATOM 0 H GLN A 36 18.550 -30.306 0.597 1.00 0.00 H new ATOM 0 HA GLN A 36 19.005 -29.168 3.200 1.00 0.00 H new ATOM 0 HB2 GLN A 36 21.077 -29.801 1.083 1.00 0.00 H new ATOM 0 HB3 GLN A 36 21.274 -29.803 2.824 1.00 0.00 H new ATOM 0 HG2 GLN A 36 19.260 -31.676 2.442 1.00 0.00 H new ATOM 0 HG3 GLN A 36 20.278 -31.919 1.037 1.00 0.00 H new ATOM 0 HE21 GLN A 36 20.385 -31.605 4.609 1.00 0.00 H new ATOM 0 HE22 GLN A 36 21.754 -32.697 4.840 1.00 0.00 H new ATOM 539 N GLY A 37 19.562 -27.405 0.497 1.00 0.00 N ATOM 540 CA GLY A 37 19.862 -26.064 0.028 1.00 0.00 C ATOM 541 C GLY A 37 21.294 -25.925 -0.449 1.00 0.00 C ATOM 542 O GLY A 37 21.851 -24.827 -0.449 1.00 0.00 O ATOM 0 H GLY A 37 19.265 -28.057 -0.229 1.00 0.00 H new ATOM 0 HA2 GLY A 37 19.184 -25.807 -0.786 1.00 0.00 H new ATOM 0 HA3 GLY A 37 19.679 -25.351 0.832 1.00 0.00 H new ATOM 546 N ILE A 38 21.892 -27.040 -0.855 1.00 0.00 N ATOM 547 CA ILE A 38 23.269 -27.036 -1.336 1.00 0.00 C ATOM 548 C ILE A 38 23.333 -26.678 -2.817 1.00 0.00 C ATOM 549 O ILE A 38 22.557 -27.190 -3.625 1.00 0.00 O ATOM 550 CB ILE A 38 23.944 -28.403 -1.120 1.00 0.00 C ATOM 551 CG1 ILE A 38 23.926 -28.777 0.364 1.00 0.00 C ATOM 552 CG2 ILE A 38 25.370 -28.379 -1.649 1.00 0.00 C ATOM 553 CD1 ILE A 38 23.813 -30.265 0.611 1.00 0.00 C ATOM 0 H ILE A 38 21.445 -27.957 -0.861 1.00 0.00 H new ATOM 0 HA ILE A 38 23.803 -26.281 -0.759 1.00 0.00 H new ATOM 0 HB ILE A 38 23.385 -29.159 -1.672 1.00 0.00 H new ATOM 0 HG12 ILE A 38 24.837 -28.407 0.835 1.00 0.00 H new ATOM 0 HG13 ILE A 38 23.090 -28.272 0.847 1.00 0.00 H new ATOM 0 HG21 ILE A 38 25.834 -29.352 -1.489 1.00 0.00 H new ATOM 0 HG22 ILE A 38 25.359 -28.153 -2.715 1.00 0.00 H new ATOM 0 HG23 ILE A 38 25.941 -27.614 -1.122 1.00 0.00 H new ATOM 0 HD11 ILE A 38 23.806 -30.456 1.684 1.00 0.00 H new ATOM 0 HD12 ILE A 38 22.889 -30.638 0.170 1.00 0.00 H new ATOM 0 HD13 ILE A 38 24.663 -30.775 0.157 1.00 0.00 H new ATOM 565 N PHE A 39 24.264 -25.797 -3.167 1.00 0.00 N ATOM 566 CA PHE A 39 24.430 -25.371 -4.552 1.00 0.00 C ATOM 567 C PHE A 39 25.904 -25.371 -4.948 1.00 0.00 C ATOM 568 O PHE A 39 26.783 -25.177 -4.108 1.00 0.00 O ATOM 569 CB PHE A 39 23.837 -23.975 -4.753 1.00 0.00 C ATOM 570 CG PHE A 39 24.534 -22.908 -3.959 1.00 0.00 C ATOM 571 CD1 PHE A 39 24.180 -22.664 -2.641 1.00 0.00 C ATOM 572 CD2 PHE A 39 25.542 -22.148 -4.529 1.00 0.00 C ATOM 573 CE1 PHE A 39 24.819 -21.682 -1.908 1.00 0.00 C ATOM 574 CE2 PHE A 39 26.185 -21.165 -3.801 1.00 0.00 C ATOM 575 CZ PHE A 39 25.823 -20.932 -2.488 1.00 0.00 C ATOM 0 H PHE A 39 24.915 -25.364 -2.511 1.00 0.00 H new ATOM 0 HA PHE A 39 23.900 -26.079 -5.190 1.00 0.00 H new ATOM 0 HB2 PHE A 39 23.884 -23.718 -5.811 1.00 0.00 H new ATOM 0 HB3 PHE A 39 22.783 -23.993 -4.476 1.00 0.00 H new ATOM 0 HD1 PHE A 39 23.396 -23.248 -2.182 1.00 0.00 H new ATOM 0 HD2 PHE A 39 25.829 -22.326 -5.555 1.00 0.00 H new ATOM 0 HE1 PHE A 39 24.533 -21.501 -0.882 1.00 0.00 H new ATOM 0 HE2 PHE A 39 26.969 -20.580 -4.258 1.00 0.00 H new ATOM 0 HZ PHE A 39 26.324 -20.165 -1.917 1.00 0.00 H new ATOM 585 N ARG A 40 26.166 -25.591 -6.232 1.00 0.00 N ATOM 586 CA ARG A 40 27.532 -25.619 -6.739 1.00 0.00 C ATOM 587 C ARG A 40 27.795 -24.430 -7.658 1.00 0.00 C ATOM 588 O ARG A 40 26.906 -23.982 -8.382 1.00 0.00 O ATOM 589 CB ARG A 40 27.793 -26.926 -7.491 1.00 0.00 C ATOM 590 CG ARG A 40 29.121 -26.948 -8.231 1.00 0.00 C ATOM 591 CD ARG A 40 29.183 -28.093 -9.230 1.00 0.00 C ATOM 592 NE ARG A 40 30.411 -28.063 -10.020 1.00 0.00 N ATOM 593 CZ ARG A 40 30.696 -28.950 -10.967 1.00 0.00 C ATOM 594 NH1 ARG A 40 29.846 -29.930 -11.240 1.00 0.00 N ATOM 595 NH2 ARG A 40 31.834 -28.857 -11.644 1.00 0.00 N ATOM 0 H ARG A 40 25.450 -25.752 -6.940 1.00 0.00 H new ATOM 0 HA ARG A 40 28.210 -25.556 -5.888 1.00 0.00 H new ATOM 0 HB2 ARG A 40 27.768 -27.754 -6.783 1.00 0.00 H new ATOM 0 HB3 ARG A 40 26.986 -27.092 -8.205 1.00 0.00 H new ATOM 0 HG2 ARG A 40 29.264 -26.001 -8.752 1.00 0.00 H new ATOM 0 HG3 ARG A 40 29.937 -27.044 -7.514 1.00 0.00 H new ATOM 0 HD2 ARG A 40 29.117 -29.042 -8.698 1.00 0.00 H new ATOM 0 HD3 ARG A 40 28.322 -28.040 -9.896 1.00 0.00 H new ATOM 0 HE ARG A 40 31.086 -27.321 -9.835 1.00 0.00 H new ATOM 0 HH11 ARG A 40 28.970 -30.005 -10.722 1.00 0.00 H new ATOM 0 HH12 ARG A 40 30.068 -30.609 -11.968 1.00 0.00 H new ATOM 0 HH21 ARG A 40 32.490 -28.104 -11.437 1.00 0.00 H new ATOM 0 HH22 ARG A 40 32.052 -29.538 -12.371 1.00 0.00 H new ATOM 609 N VAL A 41 29.023 -23.921 -7.622 1.00 0.00 N ATOM 610 CA VAL A 41 29.404 -22.784 -8.452 1.00 0.00 C ATOM 611 C VAL A 41 29.973 -23.245 -9.789 1.00 0.00 C ATOM 612 O VAL A 41 31.188 -23.350 -9.956 1.00 0.00 O ATOM 613 CB VAL A 41 30.444 -21.896 -7.743 1.00 0.00 C ATOM 614 CG1 VAL A 41 30.852 -20.734 -8.636 1.00 0.00 C ATOM 615 CG2 VAL A 41 29.897 -21.392 -6.415 1.00 0.00 C ATOM 0 H VAL A 41 29.771 -24.278 -7.027 1.00 0.00 H new ATOM 0 HA VAL A 41 28.499 -22.203 -8.627 1.00 0.00 H new ATOM 0 HB VAL A 41 31.331 -22.496 -7.541 1.00 0.00 H new ATOM 0 HG11 VAL A 41 31.587 -20.118 -8.118 1.00 0.00 H new ATOM 0 HG12 VAL A 41 31.287 -21.119 -9.558 1.00 0.00 H new ATOM 0 HG13 VAL A 41 29.975 -20.131 -8.872 1.00 0.00 H new ATOM 0 HG21 VAL A 41 30.645 -20.766 -5.927 1.00 0.00 H new ATOM 0 HG22 VAL A 41 28.994 -20.808 -6.592 1.00 0.00 H new ATOM 0 HG23 VAL A 41 29.660 -22.241 -5.773 1.00 0.00 H new ATOM 625 N VAL A 42 29.086 -23.519 -10.740 1.00 0.00 N ATOM 626 CA VAL A 42 29.500 -23.968 -12.064 1.00 0.00 C ATOM 627 C VAL A 42 30.519 -23.013 -12.674 1.00 0.00 C ATOM 628 O VAL A 42 31.580 -23.433 -13.137 1.00 0.00 O ATOM 629 CB VAL A 42 28.295 -24.092 -13.016 1.00 0.00 C ATOM 630 CG1 VAL A 42 28.748 -24.549 -14.394 1.00 0.00 C ATOM 631 CG2 VAL A 42 27.259 -25.047 -12.443 1.00 0.00 C ATOM 0 H VAL A 42 28.077 -23.438 -10.618 1.00 0.00 H new ATOM 0 HA VAL A 42 29.957 -24.950 -11.937 1.00 0.00 H new ATOM 0 HB VAL A 42 27.833 -23.110 -13.119 1.00 0.00 H new ATOM 0 HG11 VAL A 42 27.883 -24.631 -15.053 1.00 0.00 H new ATOM 0 HG12 VAL A 42 29.450 -23.824 -14.805 1.00 0.00 H new ATOM 0 HG13 VAL A 42 29.236 -25.520 -14.313 1.00 0.00 H new ATOM 0 HG21 VAL A 42 26.415 -25.122 -13.129 1.00 0.00 H new ATOM 0 HG22 VAL A 42 27.707 -26.032 -12.309 1.00 0.00 H new ATOM 0 HG23 VAL A 42 26.912 -24.672 -11.480 1.00 0.00 H new ATOM 641 N LYS A 43 30.191 -21.726 -12.672 1.00 0.00 N ATOM 642 CA LYS A 43 31.079 -20.708 -13.223 1.00 0.00 C ATOM 643 C LYS A 43 31.558 -19.756 -12.133 1.00 0.00 C ATOM 644 O LYS A 43 30.914 -18.745 -11.852 1.00 0.00 O ATOM 645 CB LYS A 43 30.365 -19.922 -14.325 1.00 0.00 C ATOM 646 CG LYS A 43 30.004 -20.764 -15.537 1.00 0.00 C ATOM 647 CD LYS A 43 29.155 -19.982 -16.525 1.00 0.00 C ATOM 648 CE LYS A 43 28.933 -20.765 -17.810 1.00 0.00 C ATOM 649 NZ LYS A 43 29.986 -20.480 -18.823 1.00 0.00 N ATOM 0 H LYS A 43 29.316 -21.362 -12.295 1.00 0.00 H new ATOM 0 HA LYS A 43 31.948 -21.211 -13.648 1.00 0.00 H new ATOM 0 HB2 LYS A 43 29.456 -19.482 -13.915 1.00 0.00 H new ATOM 0 HB3 LYS A 43 31.003 -19.097 -14.643 1.00 0.00 H new ATOM 0 HG2 LYS A 43 30.915 -21.105 -16.029 1.00 0.00 H new ATOM 0 HG3 LYS A 43 29.463 -21.654 -15.215 1.00 0.00 H new ATOM 0 HD2 LYS A 43 28.193 -19.744 -16.071 1.00 0.00 H new ATOM 0 HD3 LYS A 43 29.642 -19.034 -16.755 1.00 0.00 H new ATOM 0 HE2 LYS A 43 28.923 -21.832 -17.588 1.00 0.00 H new ATOM 0 HE3 LYS A 43 27.955 -20.516 -18.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 29.799 -21.033 -19.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 29.980 -19.466 -19.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 30.917 -20.742 -18.439 1.00 0.00 H new ATOM 663 N SER A 44 32.692 -20.084 -11.523 1.00 0.00 N ATOM 664 CA SER A 44 33.256 -19.258 -10.461 1.00 0.00 C ATOM 665 C SER A 44 33.631 -17.877 -10.989 1.00 0.00 C ATOM 666 O SER A 44 33.704 -16.910 -10.231 1.00 0.00 O ATOM 667 CB SER A 44 34.487 -19.937 -9.857 1.00 0.00 C ATOM 668 OG SER A 44 35.496 -20.127 -10.835 1.00 0.00 O ATOM 0 H SER A 44 33.239 -20.916 -11.746 1.00 0.00 H new ATOM 0 HA SER A 44 32.499 -19.139 -9.686 1.00 0.00 H new ATOM 0 HB2 SER A 44 34.877 -19.330 -9.040 1.00 0.00 H new ATOM 0 HB3 SER A 44 34.203 -20.899 -9.431 1.00 0.00 H new ATOM 0 HG SER A 44 36.273 -20.561 -10.424 1.00 0.00 H new ATOM 674 N GLU A 45 33.868 -17.793 -12.295 1.00 0.00 N ATOM 675 CA GLU A 45 34.236 -16.530 -12.924 1.00 0.00 C ATOM 676 C GLU A 45 33.002 -15.671 -13.183 1.00 0.00 C ATOM 677 O GLU A 45 32.948 -14.508 -12.787 1.00 0.00 O ATOM 678 CB GLU A 45 34.978 -16.787 -14.238 1.00 0.00 C ATOM 679 CG GLU A 45 36.426 -17.205 -14.048 1.00 0.00 C ATOM 680 CD GLU A 45 37.388 -16.036 -14.142 1.00 0.00 C ATOM 681 OE1 GLU A 45 37.124 -14.999 -13.499 1.00 0.00 O ATOM 682 OE2 GLU A 45 38.403 -16.159 -14.858 1.00 0.00 O ATOM 0 H GLU A 45 33.812 -18.584 -12.937 1.00 0.00 H new ATOM 0 HA GLU A 45 34.895 -15.992 -12.242 1.00 0.00 H new ATOM 0 HB2 GLU A 45 34.455 -17.564 -14.795 1.00 0.00 H new ATOM 0 HB3 GLU A 45 34.947 -15.883 -14.846 1.00 0.00 H new ATOM 0 HG2 GLU A 45 36.537 -17.685 -13.076 1.00 0.00 H new ATOM 0 HG3 GLU A 45 36.688 -17.948 -14.802 1.00 0.00 H new ATOM 689 N ALA A 46 32.013 -16.254 -13.852 1.00 0.00 N ATOM 690 CA ALA A 46 30.779 -15.543 -14.163 1.00 0.00 C ATOM 691 C ALA A 46 30.066 -15.098 -12.891 1.00 0.00 C ATOM 692 O ALA A 46 29.412 -14.054 -12.866 1.00 0.00 O ATOM 693 CB ALA A 46 29.863 -16.420 -15.005 1.00 0.00 C ATOM 0 H ALA A 46 32.042 -17.216 -14.189 1.00 0.00 H new ATOM 0 HA ALA A 46 31.037 -14.651 -14.734 1.00 0.00 H new ATOM 0 HB1 ALA A 46 28.945 -15.877 -15.230 1.00 0.00 H new ATOM 0 HB2 ALA A 46 30.366 -16.684 -15.935 1.00 0.00 H new ATOM 0 HB3 ALA A 46 29.621 -17.328 -14.453 1.00 0.00 H new ATOM 699 N LEU A 47 30.194 -15.896 -11.837 1.00 0.00 N ATOM 700 CA LEU A 47 29.561 -15.584 -10.560 1.00 0.00 C ATOM 701 C LEU A 47 30.001 -14.215 -10.053 1.00 0.00 C ATOM 702 O LEU A 47 29.172 -13.372 -9.712 1.00 0.00 O ATOM 703 CB LEU A 47 29.901 -16.657 -9.524 1.00 0.00 C ATOM 704 CG LEU A 47 29.537 -16.331 -8.075 1.00 0.00 C ATOM 705 CD1 LEU A 47 28.036 -16.128 -7.935 1.00 0.00 C ATOM 706 CD2 LEU A 47 30.017 -17.435 -7.143 1.00 0.00 C ATOM 0 H LEU A 47 30.730 -16.764 -11.841 1.00 0.00 H new ATOM 0 HA LEU A 47 28.482 -15.564 -10.714 1.00 0.00 H new ATOM 0 HB2 LEU A 47 29.394 -17.580 -9.806 1.00 0.00 H new ATOM 0 HB3 LEU A 47 30.972 -16.854 -9.573 1.00 0.00 H new ATOM 0 HG LEU A 47 30.036 -15.404 -7.795 1.00 0.00 H new ATOM 0 HD11 LEU A 47 27.795 -15.897 -6.897 1.00 0.00 H new ATOM 0 HD12 LEU A 47 27.719 -15.303 -8.573 1.00 0.00 H new ATOM 0 HD13 LEU A 47 27.516 -17.038 -8.234 1.00 0.00 H new ATOM 0 HD21 LEU A 47 29.749 -17.186 -6.116 1.00 0.00 H new ATOM 0 HD22 LEU A 47 29.546 -18.377 -7.423 1.00 0.00 H new ATOM 0 HD23 LEU A 47 31.100 -17.533 -7.222 1.00 0.00 H new ATOM 718 N ALA A 48 31.312 -13.999 -10.010 1.00 0.00 N ATOM 719 CA ALA A 48 31.863 -12.731 -9.549 1.00 0.00 C ATOM 720 C ALA A 48 31.607 -11.621 -10.564 1.00 0.00 C ATOM 721 O ALA A 48 31.314 -10.484 -10.195 1.00 0.00 O ATOM 722 CB ALA A 48 33.354 -12.869 -9.280 1.00 0.00 C ATOM 0 H ALA A 48 32.012 -14.686 -10.289 1.00 0.00 H new ATOM 0 HA ALA A 48 31.361 -12.462 -8.619 1.00 0.00 H new ATOM 0 HB1 ALA A 48 33.752 -11.914 -8.936 1.00 0.00 H new ATOM 0 HB2 ALA A 48 33.517 -13.627 -8.514 1.00 0.00 H new ATOM 0 HB3 ALA A 48 33.863 -13.165 -10.197 1.00 0.00 H new ATOM 728 N LYS A 49 31.721 -11.958 -11.844 1.00 0.00 N ATOM 729 CA LYS A 49 31.501 -10.991 -12.913 1.00 0.00 C ATOM 730 C LYS A 49 30.117 -10.359 -12.799 1.00 0.00 C ATOM 731 O LYS A 49 29.976 -9.138 -12.855 1.00 0.00 O ATOM 732 CB LYS A 49 31.656 -11.665 -14.278 1.00 0.00 C ATOM 733 CG LYS A 49 32.949 -11.308 -14.990 1.00 0.00 C ATOM 734 CD LYS A 49 33.848 -12.521 -15.156 1.00 0.00 C ATOM 735 CE LYS A 49 34.880 -12.305 -16.251 1.00 0.00 C ATOM 736 NZ LYS A 49 35.898 -11.289 -15.861 1.00 0.00 N ATOM 0 H LYS A 49 31.965 -12.894 -12.167 1.00 0.00 H new ATOM 0 HA LYS A 49 32.249 -10.204 -12.817 1.00 0.00 H new ATOM 0 HB2 LYS A 49 31.610 -12.746 -14.147 1.00 0.00 H new ATOM 0 HB3 LYS A 49 30.814 -11.384 -14.910 1.00 0.00 H new ATOM 0 HG2 LYS A 49 32.722 -10.886 -15.969 1.00 0.00 H new ATOM 0 HG3 LYS A 49 33.476 -10.538 -14.426 1.00 0.00 H new ATOM 0 HD2 LYS A 49 34.354 -12.731 -14.214 1.00 0.00 H new ATOM 0 HD3 LYS A 49 33.241 -13.395 -15.394 1.00 0.00 H new ATOM 0 HE2 LYS A 49 35.376 -13.250 -16.474 1.00 0.00 H new ATOM 0 HE3 LYS A 49 34.379 -11.985 -17.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 36.584 -11.170 -16.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 35.428 -10.381 -15.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 36.394 -11.606 -15.004 1.00 0.00 H new ATOM 750 N MET A 50 29.100 -11.199 -12.639 1.00 0.00 N ATOM 751 CA MET A 50 27.728 -10.722 -12.515 1.00 0.00 C ATOM 752 C MET A 50 27.547 -9.914 -11.233 1.00 0.00 C ATOM 753 O MET A 50 26.982 -8.820 -11.253 1.00 0.00 O ATOM 754 CB MET A 50 26.752 -11.900 -12.531 1.00 0.00 C ATOM 755 CG MET A 50 26.120 -12.147 -13.892 1.00 0.00 C ATOM 756 SD MET A 50 24.388 -11.648 -13.954 1.00 0.00 S ATOM 757 CE MET A 50 23.682 -12.720 -12.705 1.00 0.00 C ATOM 0 H MET A 50 29.200 -12.213 -12.592 1.00 0.00 H new ATOM 0 HA MET A 50 27.517 -10.074 -13.365 1.00 0.00 H new ATOM 0 HB2 MET A 50 27.277 -12.801 -12.215 1.00 0.00 H new ATOM 0 HB3 MET A 50 25.963 -11.718 -11.801 1.00 0.00 H new ATOM 0 HG2 MET A 50 26.679 -11.601 -14.652 1.00 0.00 H new ATOM 0 HG3 MET A 50 26.198 -13.206 -14.138 1.00 0.00 H new ATOM 0 HE1 MET A 50 22.784 -13.196 -13.099 1.00 0.00 H new ATOM 0 HE2 MET A 50 24.408 -13.485 -12.430 1.00 0.00 H new ATOM 0 HE3 MET A 50 23.424 -12.132 -11.824 1.00 0.00 H new ATOM 767 N TRP A 51 28.028 -10.460 -10.123 1.00 0.00 N ATOM 768 CA TRP A 51 27.919 -9.790 -8.832 1.00 0.00 C ATOM 769 C TRP A 51 28.471 -8.370 -8.907 1.00 0.00 C ATOM 770 O TRP A 51 27.770 -7.405 -8.606 1.00 0.00 O ATOM 771 CB TRP A 51 28.663 -10.583 -7.757 1.00 0.00 C ATOM 772 CG TRP A 51 28.675 -9.906 -6.420 1.00 0.00 C ATOM 773 CD1 TRP A 51 29.765 -9.662 -5.634 1.00 0.00 C ATOM 774 CD2 TRP A 51 27.543 -9.389 -5.712 1.00 0.00 C ATOM 775 NE1 TRP A 51 29.379 -9.024 -4.480 1.00 0.00 N ATOM 776 CE2 TRP A 51 28.022 -8.844 -4.504 1.00 0.00 C ATOM 777 CE3 TRP A 51 26.174 -9.331 -5.981 1.00 0.00 C ATOM 778 CZ2 TRP A 51 27.177 -8.251 -3.569 1.00 0.00 C ATOM 779 CZ3 TRP A 51 25.337 -8.742 -5.052 1.00 0.00 C ATOM 780 CH2 TRP A 51 25.840 -8.208 -3.859 1.00 0.00 C ATOM 0 H TRP A 51 28.497 -11.365 -10.090 1.00 0.00 H new ATOM 0 HA TRP A 51 26.863 -9.736 -8.567 1.00 0.00 H new ATOM 0 HB2 TRP A 51 28.201 -11.565 -7.655 1.00 0.00 H new ATOM 0 HB3 TRP A 51 29.690 -10.747 -8.082 1.00 0.00 H new ATOM 0 HD1 TRP A 51 30.781 -9.931 -5.883 1.00 0.00 H new ATOM 0 HE1 TRP A 51 30.002 -8.732 -3.727 1.00 0.00 H new ATOM 0 HE3 TRP A 51 25.776 -9.739 -6.898 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 27.563 -7.840 -2.648 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 24.276 -8.693 -5.250 1.00 0.00 H new ATOM 0 HH2 TRP A 51 25.160 -7.753 -3.154 1.00 0.00 H new ATOM 791 N GLY A 52 29.732 -8.251 -9.311 1.00 0.00 N ATOM 792 CA GLY A 52 30.356 -6.945 -9.419 1.00 0.00 C ATOM 793 C GLY A 52 29.455 -5.925 -10.087 1.00 0.00 C ATOM 794 O GLY A 52 29.348 -4.789 -9.629 1.00 0.00 O ATOM 0 H GLY A 52 30.332 -9.035 -9.565 1.00 0.00 H new ATOM 0 HA2 GLY A 52 30.625 -6.591 -8.424 1.00 0.00 H new ATOM 0 HA3 GLY A 52 31.282 -7.034 -9.987 1.00 0.00 H new ATOM 798 N GLN A 53 28.808 -6.332 -11.174 1.00 0.00 N ATOM 799 CA GLN A 53 27.914 -5.444 -11.908 1.00 0.00 C ATOM 800 C GLN A 53 26.804 -4.920 -11.003 1.00 0.00 C ATOM 801 O GLN A 53 26.325 -3.800 -11.177 1.00 0.00 O ATOM 802 CB GLN A 53 27.308 -6.174 -13.108 1.00 0.00 C ATOM 803 CG GLN A 53 28.298 -6.413 -14.237 1.00 0.00 C ATOM 804 CD GLN A 53 27.620 -6.822 -15.530 1.00 0.00 C ATOM 805 OE1 GLN A 53 27.408 -5.998 -16.421 1.00 0.00 O ATOM 806 NE2 GLN A 53 27.276 -8.100 -15.641 1.00 0.00 N ATOM 0 H GLN A 53 28.886 -7.270 -11.566 1.00 0.00 H new ATOM 0 HA GLN A 53 28.498 -4.596 -12.265 1.00 0.00 H new ATOM 0 HB2 GLN A 53 26.909 -7.133 -12.776 1.00 0.00 H new ATOM 0 HB3 GLN A 53 26.468 -5.594 -13.489 1.00 0.00 H new ATOM 0 HG2 GLN A 53 28.877 -5.505 -14.406 1.00 0.00 H new ATOM 0 HG3 GLN A 53 29.003 -7.189 -13.939 1.00 0.00 H new ATOM 0 HE21 GLN A 53 27.471 -8.749 -14.878 1.00 0.00 H new ATOM 0 HE22 GLN A 53 26.817 -8.433 -16.489 1.00 0.00 H new ATOM 815 N ARG A 54 26.400 -5.738 -10.036 1.00 0.00 N ATOM 816 CA ARG A 54 25.345 -5.357 -9.105 1.00 0.00 C ATOM 817 C ARG A 54 25.849 -4.318 -8.108 1.00 0.00 C ATOM 818 O ARG A 54 25.110 -3.419 -7.704 1.00 0.00 O ATOM 819 CB ARG A 54 24.828 -6.588 -8.357 1.00 0.00 C ATOM 820 CG ARG A 54 24.700 -7.824 -9.232 1.00 0.00 C ATOM 821 CD ARG A 54 23.784 -7.573 -10.420 1.00 0.00 C ATOM 822 NE ARG A 54 22.440 -8.097 -10.195 1.00 0.00 N ATOM 823 CZ ARG A 54 21.423 -7.893 -11.024 1.00 0.00 C ATOM 824 NH1 ARG A 54 21.596 -7.180 -12.128 1.00 0.00 N ATOM 825 NH2 ARG A 54 20.229 -8.403 -10.750 1.00 0.00 N ATOM 0 H ARG A 54 26.787 -6.668 -9.877 1.00 0.00 H new ATOM 0 HA ARG A 54 24.529 -4.919 -9.679 1.00 0.00 H new ATOM 0 HB2 ARG A 54 25.501 -6.808 -7.528 1.00 0.00 H new ATOM 0 HB3 ARG A 54 23.855 -6.357 -7.924 1.00 0.00 H new ATOM 0 HG2 ARG A 54 25.686 -8.123 -9.588 1.00 0.00 H new ATOM 0 HG3 ARG A 54 24.311 -8.652 -8.639 1.00 0.00 H new ATOM 0 HD2 ARG A 54 23.728 -6.502 -10.614 1.00 0.00 H new ATOM 0 HD3 ARG A 54 24.209 -8.036 -11.310 1.00 0.00 H new ATOM 0 HE ARG A 54 22.273 -8.650 -9.355 1.00 0.00 H new ATOM 0 HH11 ARG A 54 22.512 -6.786 -12.343 1.00 0.00 H new ATOM 0 HH12 ARG A 54 20.813 -7.025 -12.763 1.00 0.00 H new ATOM 0 HH21 ARG A 54 20.092 -8.952 -9.902 1.00 0.00 H new ATOM 0 HH22 ARG A 54 19.449 -8.246 -11.388 1.00 0.00 H new ATOM 839 N LYS A 55 27.112 -4.447 -7.714 1.00 0.00 N ATOM 840 CA LYS A 55 27.716 -3.519 -6.765 1.00 0.00 C ATOM 841 C LYS A 55 28.404 -2.368 -7.493 1.00 0.00 C ATOM 842 O LYS A 55 29.043 -1.519 -6.870 1.00 0.00 O ATOM 843 CB LYS A 55 28.724 -4.251 -5.877 1.00 0.00 C ATOM 844 CG LYS A 55 28.088 -5.264 -4.942 1.00 0.00 C ATOM 845 CD LYS A 55 28.159 -4.809 -3.494 1.00 0.00 C ATOM 846 CE LYS A 55 26.960 -3.952 -3.119 1.00 0.00 C ATOM 847 NZ LYS A 55 27.287 -2.499 -3.142 1.00 0.00 N ATOM 0 H LYS A 55 27.737 -5.185 -8.037 1.00 0.00 H new ATOM 0 HA LYS A 55 26.923 -3.108 -6.141 1.00 0.00 H new ATOM 0 HB2 LYS A 55 29.451 -4.760 -6.510 1.00 0.00 H new ATOM 0 HB3 LYS A 55 29.274 -3.519 -5.286 1.00 0.00 H new ATOM 0 HG2 LYS A 55 27.047 -5.418 -5.225 1.00 0.00 H new ATOM 0 HG3 LYS A 55 28.592 -6.224 -5.048 1.00 0.00 H new ATOM 0 HD2 LYS A 55 28.204 -5.680 -2.840 1.00 0.00 H new ATOM 0 HD3 LYS A 55 29.076 -4.243 -3.334 1.00 0.00 H new ATOM 0 HE2 LYS A 55 26.141 -4.151 -3.810 1.00 0.00 H new ATOM 0 HE3 LYS A 55 26.612 -4.230 -2.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 26.444 -1.949 -2.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 28.051 -2.304 -2.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 27.595 -2.228 -4.098 1.00 0.00 H new ATOM 861 N LYS A 56 28.270 -2.345 -8.814 1.00 0.00 N ATOM 862 CA LYS A 56 28.876 -1.297 -9.627 1.00 0.00 C ATOM 863 C LYS A 56 30.390 -1.272 -9.442 1.00 0.00 C ATOM 864 O LYS A 56 31.021 -0.222 -9.552 1.00 0.00 O ATOM 865 CB LYS A 56 28.284 0.066 -9.263 1.00 0.00 C ATOM 866 CG LYS A 56 27.461 0.689 -10.377 1.00 0.00 C ATOM 867 CD LYS A 56 26.046 1.000 -9.917 1.00 0.00 C ATOM 868 CE LYS A 56 25.029 0.711 -11.010 1.00 0.00 C ATOM 869 NZ LYS A 56 24.265 1.930 -11.394 1.00 0.00 N ATOM 0 H LYS A 56 27.747 -3.041 -9.345 1.00 0.00 H new ATOM 0 HA LYS A 56 28.659 -1.512 -10.673 1.00 0.00 H new ATOM 0 HB2 LYS A 56 27.657 -0.044 -8.378 1.00 0.00 H new ATOM 0 HB3 LYS A 56 29.094 0.745 -8.998 1.00 0.00 H new ATOM 0 HG2 LYS A 56 27.943 1.605 -10.719 1.00 0.00 H new ATOM 0 HG3 LYS A 56 27.427 0.010 -11.229 1.00 0.00 H new ATOM 0 HD2 LYS A 56 25.811 0.407 -9.033 1.00 0.00 H new ATOM 0 HD3 LYS A 56 25.979 2.048 -9.624 1.00 0.00 H new ATOM 0 HE2 LYS A 56 25.541 0.312 -11.886 1.00 0.00 H new ATOM 0 HE3 LYS A 56 24.337 -0.058 -10.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 23.582 1.691 -12.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 23.756 2.296 -10.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 24.922 2.656 -11.745 1.00 0.00 H new ATOM 883 N ASN A 57 30.967 -2.436 -9.161 1.00 0.00 N ATOM 884 CA ASN A 57 32.407 -2.547 -8.961 1.00 0.00 C ATOM 885 C ASN A 57 33.076 -3.193 -10.170 1.00 0.00 C ATOM 886 O ASN A 57 32.566 -4.165 -10.729 1.00 0.00 O ATOM 887 CB ASN A 57 32.707 -3.363 -7.702 1.00 0.00 C ATOM 888 CG ASN A 57 34.113 -3.130 -7.183 1.00 0.00 C ATOM 889 OD1 ASN A 57 34.679 -2.050 -7.355 1.00 0.00 O ATOM 890 ND2 ASN A 57 34.683 -4.145 -6.544 1.00 0.00 N ATOM 0 H ASN A 57 30.459 -3.316 -9.067 1.00 0.00 H new ATOM 0 HA ASN A 57 32.810 -1.542 -8.839 1.00 0.00 H new ATOM 0 HB2 ASN A 57 31.988 -3.104 -6.925 1.00 0.00 H new ATOM 0 HB3 ASN A 57 32.574 -4.423 -7.919 1.00 0.00 H new ATOM 0 HD21 ASN A 57 35.628 -4.048 -6.172 1.00 0.00 H new ATOM 0 HD22 ASN A 57 34.176 -5.022 -6.425 1.00 0.00 H new ATOM 897 N ASP A 58 34.219 -2.647 -10.569 1.00 0.00 N ATOM 898 CA ASP A 58 34.959 -3.171 -11.711 1.00 0.00 C ATOM 899 C ASP A 58 36.119 -4.049 -11.251 1.00 0.00 C ATOM 900 O ASP A 58 36.813 -4.655 -12.067 1.00 0.00 O ATOM 901 CB ASP A 58 35.484 -2.023 -12.576 1.00 0.00 C ATOM 902 CG ASP A 58 34.686 -1.850 -13.853 1.00 0.00 C ATOM 903 OD1 ASP A 58 33.600 -1.236 -13.796 1.00 0.00 O ATOM 904 OD2 ASP A 58 35.149 -2.326 -14.910 1.00 0.00 O ATOM 0 H ASP A 58 34.654 -1.842 -10.119 1.00 0.00 H new ATOM 0 HA ASP A 58 34.278 -3.781 -12.304 1.00 0.00 H new ATOM 0 HB2 ASP A 58 35.453 -1.096 -12.003 1.00 0.00 H new ATOM 0 HB3 ASP A 58 36.529 -2.208 -12.826 1.00 0.00 H new ATOM 909 N ARG A 59 36.324 -4.110 -9.939 1.00 0.00 N ATOM 910 CA ARG A 59 37.401 -4.912 -9.371 1.00 0.00 C ATOM 911 C ARG A 59 36.850 -6.171 -8.708 1.00 0.00 C ATOM 912 O ARG A 59 37.477 -6.739 -7.815 1.00 0.00 O ATOM 913 CB ARG A 59 38.193 -4.091 -8.351 1.00 0.00 C ATOM 914 CG ARG A 59 39.165 -3.108 -8.984 1.00 0.00 C ATOM 915 CD ARG A 59 40.554 -3.711 -9.123 1.00 0.00 C ATOM 916 NE ARG A 59 41.546 -2.714 -9.518 1.00 0.00 N ATOM 917 CZ ARG A 59 42.824 -2.999 -9.745 1.00 0.00 C ATOM 918 NH1 ARG A 59 43.262 -4.244 -9.617 1.00 0.00 N ATOM 919 NH2 ARG A 59 43.666 -2.037 -10.100 1.00 0.00 N ATOM 0 H ARG A 59 35.759 -3.614 -9.250 1.00 0.00 H new ATOM 0 HA ARG A 59 38.065 -5.210 -10.182 1.00 0.00 H new ATOM 0 HB2 ARG A 59 37.495 -3.543 -7.718 1.00 0.00 H new ATOM 0 HB3 ARG A 59 38.747 -4.770 -7.702 1.00 0.00 H new ATOM 0 HG2 ARG A 59 38.796 -2.811 -9.966 1.00 0.00 H new ATOM 0 HG3 ARG A 59 39.218 -2.205 -8.376 1.00 0.00 H new ATOM 0 HD2 ARG A 59 40.850 -4.162 -8.176 1.00 0.00 H new ATOM 0 HD3 ARG A 59 40.530 -4.511 -9.863 1.00 0.00 H new ATOM 0 HE ARG A 59 41.241 -1.747 -9.625 1.00 0.00 H new ATOM 0 HH11 ARG A 59 42.617 -4.986 -9.344 1.00 0.00 H new ATOM 0 HH12 ARG A 59 44.243 -4.460 -9.792 1.00 0.00 H new ATOM 0 HH21 ARG A 59 43.332 -1.078 -10.199 1.00 0.00 H new ATOM 0 HH22 ARG A 59 44.647 -2.256 -10.274 1.00 0.00 H new ATOM 933 N MET A 60 35.674 -6.601 -9.153 1.00 0.00 N ATOM 934 CA MET A 60 35.039 -7.793 -8.603 1.00 0.00 C ATOM 935 C MET A 60 35.647 -9.058 -9.201 1.00 0.00 C ATOM 936 O MET A 60 35.842 -9.153 -10.413 1.00 0.00 O ATOM 937 CB MET A 60 33.532 -7.763 -8.869 1.00 0.00 C ATOM 938 CG MET A 60 32.779 -8.917 -8.227 1.00 0.00 C ATOM 939 SD MET A 60 33.237 -9.171 -6.501 1.00 0.00 S ATOM 940 CE MET A 60 32.451 -7.758 -5.731 1.00 0.00 C ATOM 0 H MET A 60 35.142 -6.142 -9.892 1.00 0.00 H new ATOM 0 HA MET A 60 35.211 -7.802 -7.527 1.00 0.00 H new ATOM 0 HB2 MET A 60 33.124 -6.823 -8.498 1.00 0.00 H new ATOM 0 HB3 MET A 60 33.361 -7.782 -9.945 1.00 0.00 H new ATOM 0 HG2 MET A 60 31.708 -8.727 -8.290 1.00 0.00 H new ATOM 0 HG3 MET A 60 32.974 -9.830 -8.789 1.00 0.00 H new ATOM 0 HE1 MET A 60 32.138 -8.022 -4.721 1.00 0.00 H new ATOM 0 HE2 MET A 60 33.156 -6.928 -5.688 1.00 0.00 H new ATOM 0 HE3 MET A 60 31.580 -7.463 -6.316 1.00 0.00 H new ATOM 950 N THR A 61 35.946 -10.028 -8.343 1.00 0.00 N ATOM 951 CA THR A 61 36.533 -11.286 -8.786 1.00 0.00 C ATOM 952 C THR A 61 36.340 -12.381 -7.743 1.00 0.00 C ATOM 953 O THR A 61 36.508 -12.147 -6.546 1.00 0.00 O ATOM 954 CB THR A 61 38.037 -11.131 -9.080 1.00 0.00 C ATOM 955 OG1 THR A 61 38.537 -12.313 -9.717 1.00 0.00 O ATOM 956 CG2 THR A 61 38.815 -10.873 -7.798 1.00 0.00 C ATOM 0 H THR A 61 35.791 -9.966 -7.337 1.00 0.00 H new ATOM 0 HA THR A 61 36.018 -11.569 -9.704 1.00 0.00 H new ATOM 0 HB THR A 61 38.168 -10.277 -9.745 1.00 0.00 H new ATOM 0 HG1 THR A 61 39.493 -12.205 -9.902 1.00 0.00 H new ATOM 0 HG21 THR A 61 39.875 -10.767 -8.031 1.00 0.00 H new ATOM 0 HG22 THR A 61 38.453 -9.957 -7.331 1.00 0.00 H new ATOM 0 HG23 THR A 61 38.676 -11.710 -7.113 1.00 0.00 H new ATOM 964 N TYR A 62 35.989 -13.576 -8.205 1.00 0.00 N ATOM 965 CA TYR A 62 35.772 -14.707 -7.310 1.00 0.00 C ATOM 966 C TYR A 62 36.726 -14.652 -6.122 1.00 0.00 C ATOM 967 O TYR A 62 36.327 -14.885 -4.981 1.00 0.00 O ATOM 968 CB TYR A 62 35.955 -16.024 -8.066 1.00 0.00 C ATOM 969 CG TYR A 62 35.357 -17.218 -7.357 1.00 0.00 C ATOM 970 CD1 TYR A 62 34.047 -17.189 -6.892 1.00 0.00 C ATOM 971 CD2 TYR A 62 36.100 -18.373 -7.151 1.00 0.00 C ATOM 972 CE1 TYR A 62 33.496 -18.277 -6.242 1.00 0.00 C ATOM 973 CE2 TYR A 62 35.557 -19.466 -6.504 1.00 0.00 C ATOM 974 CZ TYR A 62 34.255 -19.413 -6.051 1.00 0.00 C ATOM 975 OH TYR A 62 33.710 -20.499 -5.405 1.00 0.00 O ATOM 0 H TYR A 62 35.849 -13.787 -9.193 1.00 0.00 H new ATOM 0 HA TYR A 62 34.750 -14.650 -6.934 1.00 0.00 H new ATOM 0 HB2 TYR A 62 35.501 -15.933 -9.053 1.00 0.00 H new ATOM 0 HB3 TYR A 62 37.020 -16.200 -8.220 1.00 0.00 H new ATOM 0 HD1 TYR A 62 33.450 -16.301 -7.041 1.00 0.00 H new ATOM 0 HD2 TYR A 62 37.120 -18.417 -7.503 1.00 0.00 H new ATOM 0 HE1 TYR A 62 32.477 -18.238 -5.886 1.00 0.00 H new ATOM 0 HE2 TYR A 62 36.148 -20.357 -6.354 1.00 0.00 H new ATOM 0 HH TYR A 62 32.927 -20.816 -5.902 1.00 0.00 H new ATOM 985 N GLU A 63 37.989 -14.343 -6.399 1.00 0.00 N ATOM 986 CA GLU A 63 39.001 -14.258 -5.353 1.00 0.00 C ATOM 987 C GLU A 63 38.517 -13.389 -4.196 1.00 0.00 C ATOM 988 O GLU A 63 38.598 -13.781 -3.032 1.00 0.00 O ATOM 989 CB GLU A 63 40.306 -13.693 -5.919 1.00 0.00 C ATOM 990 CG GLU A 63 41.523 -14.549 -5.613 1.00 0.00 C ATOM 991 CD GLU A 63 42.786 -14.023 -6.268 1.00 0.00 C ATOM 992 OE1 GLU A 63 42.890 -12.792 -6.453 1.00 0.00 O ATOM 993 OE2 GLU A 63 43.669 -14.843 -6.596 1.00 0.00 O ATOM 0 H GLU A 63 38.335 -14.148 -7.338 1.00 0.00 H new ATOM 0 HA GLU A 63 39.183 -15.265 -4.977 1.00 0.00 H new ATOM 0 HB2 GLU A 63 40.208 -13.588 -7.000 1.00 0.00 H new ATOM 0 HB3 GLU A 63 40.465 -12.693 -5.515 1.00 0.00 H new ATOM 0 HG2 GLU A 63 41.669 -14.593 -4.534 1.00 0.00 H new ATOM 0 HG3 GLU A 63 41.340 -15.569 -5.952 1.00 0.00 H new ATOM 1000 N LYS A 64 38.013 -12.204 -4.525 1.00 0.00 N ATOM 1001 CA LYS A 64 37.514 -11.277 -3.516 1.00 0.00 C ATOM 1002 C LYS A 64 36.093 -11.641 -3.098 1.00 0.00 C ATOM 1003 O LYS A 64 35.759 -11.620 -1.912 1.00 0.00 O ATOM 1004 CB LYS A 64 37.548 -9.843 -4.050 1.00 0.00 C ATOM 1005 CG LYS A 64 38.901 -9.433 -4.606 1.00 0.00 C ATOM 1006 CD LYS A 64 38.811 -8.137 -5.393 1.00 0.00 C ATOM 1007 CE LYS A 64 40.141 -7.784 -6.040 1.00 0.00 C ATOM 1008 NZ LYS A 64 41.192 -7.497 -5.025 1.00 0.00 N ATOM 0 H LYS A 64 37.939 -11.863 -5.483 1.00 0.00 H new ATOM 0 HA LYS A 64 38.161 -11.348 -2.642 1.00 0.00 H new ATOM 0 HB2 LYS A 64 36.796 -9.737 -4.832 1.00 0.00 H new ATOM 0 HB3 LYS A 64 37.272 -9.159 -3.248 1.00 0.00 H new ATOM 0 HG2 LYS A 64 39.611 -9.314 -3.787 1.00 0.00 H new ATOM 0 HG3 LYS A 64 39.286 -10.224 -5.249 1.00 0.00 H new ATOM 0 HD2 LYS A 64 38.044 -8.230 -6.162 1.00 0.00 H new ATOM 0 HD3 LYS A 64 38.502 -7.329 -4.731 1.00 0.00 H new ATOM 0 HE2 LYS A 64 40.465 -8.608 -6.676 1.00 0.00 H new ATOM 0 HE3 LYS A 64 40.012 -6.915 -6.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 42.048 -7.146 -5.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 40.845 -6.776 -4.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 41.418 -8.368 -4.504 1.00 0.00 H new ATOM 1022 N LEU A 65 35.261 -11.977 -4.077 1.00 0.00 N ATOM 1023 CA LEU A 65 33.875 -12.348 -3.810 1.00 0.00 C ATOM 1024 C LEU A 65 33.800 -13.447 -2.755 1.00 0.00 C ATOM 1025 O LEU A 65 32.916 -13.438 -1.897 1.00 0.00 O ATOM 1026 CB LEU A 65 33.195 -12.815 -5.098 1.00 0.00 C ATOM 1027 CG LEU A 65 31.769 -13.348 -4.948 1.00 0.00 C ATOM 1028 CD1 LEU A 65 30.934 -12.987 -6.167 1.00 0.00 C ATOM 1029 CD2 LEU A 65 31.783 -14.855 -4.736 1.00 0.00 C ATOM 0 H LEU A 65 35.521 -12.000 -5.063 1.00 0.00 H new ATOM 0 HA LEU A 65 33.355 -11.468 -3.430 1.00 0.00 H new ATOM 0 HB2 LEU A 65 33.178 -11.981 -5.799 1.00 0.00 H new ATOM 0 HB3 LEU A 65 33.808 -13.596 -5.547 1.00 0.00 H new ATOM 0 HG LEU A 65 31.317 -12.882 -4.072 1.00 0.00 H new ATOM 0 HD11 LEU A 65 29.923 -13.374 -6.043 1.00 0.00 H new ATOM 0 HD12 LEU A 65 30.897 -11.903 -6.275 1.00 0.00 H new ATOM 0 HD13 LEU A 65 31.383 -13.425 -7.058 1.00 0.00 H new ATOM 0 HD21 LEU A 65 30.760 -15.217 -4.631 1.00 0.00 H new ATOM 0 HD22 LEU A 65 32.253 -15.339 -5.592 1.00 0.00 H new ATOM 0 HD23 LEU A 65 32.345 -15.090 -3.832 1.00 0.00 H new ATOM 1041 N SER A 66 34.733 -14.391 -2.822 1.00 0.00 N ATOM 1042 CA SER A 66 34.771 -15.497 -1.874 1.00 0.00 C ATOM 1043 C SER A 66 34.827 -14.981 -0.439 1.00 0.00 C ATOM 1044 O SER A 66 34.262 -15.586 0.472 1.00 0.00 O ATOM 1045 CB SER A 66 35.979 -16.395 -2.153 1.00 0.00 C ATOM 1046 OG SER A 66 35.991 -16.828 -3.502 1.00 0.00 O ATOM 0 H SER A 66 35.473 -14.412 -3.524 1.00 0.00 H new ATOM 0 HA SER A 66 33.858 -16.080 -1.997 1.00 0.00 H new ATOM 0 HB2 SER A 66 36.898 -15.852 -1.934 1.00 0.00 H new ATOM 0 HB3 SER A 66 35.954 -17.260 -1.490 1.00 0.00 H new ATOM 0 HG SER A 66 36.511 -16.198 -4.043 1.00 0.00 H new ATOM 1052 N ARG A 67 35.514 -13.860 -0.247 1.00 0.00 N ATOM 1053 CA ARG A 67 35.646 -13.262 1.076 1.00 0.00 C ATOM 1054 C ARG A 67 34.309 -13.269 1.812 1.00 0.00 C ATOM 1055 O ARG A 67 34.250 -13.543 3.010 1.00 0.00 O ATOM 1056 CB ARG A 67 36.170 -11.829 0.962 1.00 0.00 C ATOM 1057 CG ARG A 67 35.072 -10.791 0.791 1.00 0.00 C ATOM 1058 CD ARG A 67 35.626 -9.377 0.868 1.00 0.00 C ATOM 1059 NE ARG A 67 34.778 -8.500 1.670 1.00 0.00 N ATOM 1060 CZ ARG A 67 33.588 -8.063 1.273 1.00 0.00 C ATOM 1061 NH1 ARG A 67 33.108 -8.421 0.090 1.00 0.00 N ATOM 1062 NH2 ARG A 67 32.876 -7.267 2.060 1.00 0.00 N ATOM 0 H ARG A 67 35.988 -13.347 -0.991 1.00 0.00 H new ATOM 0 HA ARG A 67 36.359 -13.858 1.647 1.00 0.00 H new ATOM 0 HB2 ARG A 67 36.748 -11.590 1.855 1.00 0.00 H new ATOM 0 HB3 ARG A 67 36.852 -11.767 0.114 1.00 0.00 H new ATOM 0 HG2 ARG A 67 34.578 -10.938 -0.169 1.00 0.00 H new ATOM 0 HG3 ARG A 67 34.315 -10.929 1.563 1.00 0.00 H new ATOM 0 HD2 ARG A 67 36.628 -9.403 1.296 1.00 0.00 H new ATOM 0 HD3 ARG A 67 35.720 -8.969 -0.138 1.00 0.00 H new ATOM 0 HE ARG A 67 35.118 -8.207 2.586 1.00 0.00 H new ATOM 0 HH11 ARG A 67 33.653 -9.033 -0.517 1.00 0.00 H new ATOM 0 HH12 ARG A 67 32.194 -8.084 -0.213 1.00 0.00 H new ATOM 0 HH21 ARG A 67 33.242 -6.990 2.971 1.00 0.00 H new ATOM 0 HH22 ARG A 67 31.962 -6.932 1.754 1.00 0.00 H new ATOM 1076 N ALA A 68 33.238 -12.966 1.086 1.00 0.00 N ATOM 1077 CA ALA A 68 31.902 -12.938 1.668 1.00 0.00 C ATOM 1078 C ALA A 68 31.395 -14.350 1.944 1.00 0.00 C ATOM 1079 O ALA A 68 30.639 -14.575 2.890 1.00 0.00 O ATOM 1080 CB ALA A 68 30.941 -12.200 0.750 1.00 0.00 C ATOM 0 H ALA A 68 33.270 -12.736 0.093 1.00 0.00 H new ATOM 0 HA ALA A 68 31.957 -12.407 2.618 1.00 0.00 H new ATOM 0 HB1 ALA A 68 29.947 -12.187 1.198 1.00 0.00 H new ATOM 0 HB2 ALA A 68 31.288 -11.177 0.607 1.00 0.00 H new ATOM 0 HB3 ALA A 68 30.898 -12.706 -0.214 1.00 0.00 H new ATOM 1086 N LEU A 69 31.814 -15.297 1.112 1.00 0.00 N ATOM 1087 CA LEU A 69 31.401 -16.688 1.266 1.00 0.00 C ATOM 1088 C LEU A 69 31.958 -17.282 2.555 1.00 0.00 C ATOM 1089 O LEU A 69 31.292 -18.072 3.224 1.00 0.00 O ATOM 1090 CB LEU A 69 31.868 -17.514 0.066 1.00 0.00 C ATOM 1091 CG LEU A 69 31.384 -17.041 -1.305 1.00 0.00 C ATOM 1092 CD1 LEU A 69 31.961 -17.917 -2.406 1.00 0.00 C ATOM 1093 CD2 LEU A 69 29.863 -17.040 -1.363 1.00 0.00 C ATOM 0 H LEU A 69 32.439 -15.127 0.324 1.00 0.00 H new ATOM 0 HA LEU A 69 30.313 -16.715 1.317 1.00 0.00 H new ATOM 0 HB2 LEU A 69 32.958 -17.525 0.060 1.00 0.00 H new ATOM 0 HB3 LEU A 69 31.540 -18.543 0.209 1.00 0.00 H new ATOM 0 HG LEU A 69 31.734 -16.020 -1.460 1.00 0.00 H new ATOM 0 HD11 LEU A 69 31.606 -17.565 -3.375 1.00 0.00 H new ATOM 0 HD12 LEU A 69 33.049 -17.866 -2.379 1.00 0.00 H new ATOM 0 HD13 LEU A 69 31.642 -18.948 -2.255 1.00 0.00 H new ATOM 0 HD21 LEU A 69 29.537 -16.701 -2.346 1.00 0.00 H new ATOM 0 HD22 LEU A 69 29.491 -18.049 -1.186 1.00 0.00 H new ATOM 0 HD23 LEU A 69 29.470 -16.369 -0.599 1.00 0.00 H new ATOM 1105 N ARG A 70 33.182 -16.894 2.899 1.00 0.00 N ATOM 1106 CA ARG A 70 33.828 -17.387 4.109 1.00 0.00 C ATOM 1107 C ARG A 70 33.448 -16.533 5.315 1.00 0.00 C ATOM 1108 O ARG A 70 33.553 -16.975 6.460 1.00 0.00 O ATOM 1109 CB ARG A 70 35.347 -17.396 3.935 1.00 0.00 C ATOM 1110 CG ARG A 70 35.820 -18.221 2.749 1.00 0.00 C ATOM 1111 CD ARG A 70 36.784 -19.315 3.180 1.00 0.00 C ATOM 1112 NE ARG A 70 37.351 -20.026 2.038 1.00 0.00 N ATOM 1113 CZ ARG A 70 36.681 -20.925 1.325 1.00 0.00 C ATOM 1114 NH1 ARG A 70 35.427 -21.221 1.636 1.00 0.00 N ATOM 1115 NH2 ARG A 70 37.266 -21.530 0.299 1.00 0.00 N ATOM 0 H ARG A 70 33.746 -16.240 2.357 1.00 0.00 H new ATOM 0 HA ARG A 70 33.484 -18.406 4.284 1.00 0.00 H new ATOM 0 HB2 ARG A 70 35.697 -16.370 3.816 1.00 0.00 H new ATOM 0 HB3 ARG A 70 35.806 -17.786 4.844 1.00 0.00 H new ATOM 0 HG2 ARG A 70 34.960 -18.668 2.250 1.00 0.00 H new ATOM 0 HG3 ARG A 70 36.308 -17.570 2.023 1.00 0.00 H new ATOM 0 HD2 ARG A 70 37.589 -18.877 3.770 1.00 0.00 H new ATOM 0 HD3 ARG A 70 36.264 -20.023 3.826 1.00 0.00 H new ATOM 0 HE ARG A 70 38.314 -19.821 1.773 1.00 0.00 H new ATOM 0 HH11 ARG A 70 34.974 -20.758 2.424 1.00 0.00 H new ATOM 0 HH12 ARG A 70 34.915 -21.911 1.087 1.00 0.00 H new ATOM 0 HH21 ARG A 70 38.231 -21.305 0.057 1.00 0.00 H new ATOM 0 HH22 ARG A 70 36.751 -22.220 -0.248 1.00 0.00 H new ATOM 1129 N TYR A 71 33.008 -15.308 5.051 1.00 0.00 N ATOM 1130 CA TYR A 71 32.616 -14.391 6.114 1.00 0.00 C ATOM 1131 C TYR A 71 31.186 -14.664 6.569 1.00 0.00 C ATOM 1132 O TYR A 71 30.783 -14.266 7.663 1.00 0.00 O ATOM 1133 CB TYR A 71 32.744 -12.942 5.640 1.00 0.00 C ATOM 1134 CG TYR A 71 32.397 -11.924 6.702 1.00 0.00 C ATOM 1135 CD1 TYR A 71 33.365 -11.450 7.580 1.00 0.00 C ATOM 1136 CD2 TYR A 71 31.103 -11.437 6.830 1.00 0.00 C ATOM 1137 CE1 TYR A 71 33.053 -10.520 8.553 1.00 0.00 C ATOM 1138 CE2 TYR A 71 30.782 -10.506 7.799 1.00 0.00 C ATOM 1139 CZ TYR A 71 31.760 -10.051 8.658 1.00 0.00 C ATOM 1140 OH TYR A 71 31.444 -9.125 9.625 1.00 0.00 O ATOM 0 H TYR A 71 32.914 -14.927 4.110 1.00 0.00 H new ATOM 0 HA TYR A 71 33.284 -14.550 6.960 1.00 0.00 H new ATOM 0 HB2 TYR A 71 33.766 -12.768 5.302 1.00 0.00 H new ATOM 0 HB3 TYR A 71 32.093 -12.792 4.778 1.00 0.00 H new ATOM 0 HD1 TYR A 71 34.378 -11.815 7.500 1.00 0.00 H new ATOM 0 HD2 TYR A 71 30.334 -11.792 6.160 1.00 0.00 H new ATOM 0 HE1 TYR A 71 33.817 -10.162 9.227 1.00 0.00 H new ATOM 0 HE2 TYR A 71 29.771 -10.137 7.883 1.00 0.00 H new ATOM 0 HH TYR A 71 30.493 -8.899 9.563 1.00 0.00 H new ATOM 1150 N TYR A 72 30.423 -15.346 5.723 1.00 0.00 N ATOM 1151 CA TYR A 72 29.037 -15.672 6.036 1.00 0.00 C ATOM 1152 C TYR A 72 28.960 -16.778 7.085 1.00 0.00 C ATOM 1153 O TYR A 72 27.984 -16.877 7.828 1.00 0.00 O ATOM 1154 CB TYR A 72 28.294 -16.103 4.770 1.00 0.00 C ATOM 1155 CG TYR A 72 27.785 -14.944 3.943 1.00 0.00 C ATOM 1156 CD1 TYR A 72 26.996 -13.952 4.511 1.00 0.00 C ATOM 1157 CD2 TYR A 72 28.095 -14.840 2.592 1.00 0.00 C ATOM 1158 CE1 TYR A 72 26.529 -12.892 3.759 1.00 0.00 C ATOM 1159 CE2 TYR A 72 27.634 -13.783 1.832 1.00 0.00 C ATOM 1160 CZ TYR A 72 26.850 -12.812 2.420 1.00 0.00 C ATOM 1161 OH TYR A 72 26.388 -11.757 1.667 1.00 0.00 O ATOM 0 H TYR A 72 30.741 -15.684 4.815 1.00 0.00 H new ATOM 0 HA TYR A 72 28.563 -14.778 6.441 1.00 0.00 H new ATOM 0 HB2 TYR A 72 28.960 -16.711 4.157 1.00 0.00 H new ATOM 0 HB3 TYR A 72 27.452 -16.736 5.051 1.00 0.00 H new ATOM 0 HD1 TYR A 72 26.743 -14.011 5.559 1.00 0.00 H new ATOM 0 HD2 TYR A 72 28.707 -15.599 2.128 1.00 0.00 H new ATOM 0 HE1 TYR A 72 25.916 -12.130 4.217 1.00 0.00 H new ATOM 0 HE2 TYR A 72 27.886 -13.717 0.784 1.00 0.00 H new ATOM 0 HH TYR A 72 27.137 -11.170 1.432 1.00 0.00 H new ATOM 1171 N TYR A 73 29.997 -17.606 7.138 1.00 0.00 N ATOM 1172 CA TYR A 73 30.049 -18.706 8.094 1.00 0.00 C ATOM 1173 C TYR A 73 29.965 -18.187 9.526 1.00 0.00 C ATOM 1174 O TYR A 73 29.427 -18.854 10.410 1.00 0.00 O ATOM 1175 CB TYR A 73 31.334 -19.513 7.906 1.00 0.00 C ATOM 1176 CG TYR A 73 31.453 -20.153 6.542 1.00 0.00 C ATOM 1177 CD1 TYR A 73 30.351 -20.732 5.925 1.00 0.00 C ATOM 1178 CD2 TYR A 73 32.669 -20.179 5.868 1.00 0.00 C ATOM 1179 CE1 TYR A 73 30.455 -21.319 4.679 1.00 0.00 C ATOM 1180 CE2 TYR A 73 32.782 -20.763 4.621 1.00 0.00 C ATOM 1181 CZ TYR A 73 31.673 -21.332 4.031 1.00 0.00 C ATOM 1182 OH TYR A 73 31.780 -21.914 2.789 1.00 0.00 O ATOM 0 H TYR A 73 30.813 -17.537 6.530 1.00 0.00 H new ATOM 0 HA TYR A 73 29.192 -19.354 7.911 1.00 0.00 H new ATOM 0 HB2 TYR A 73 32.191 -18.859 8.067 1.00 0.00 H new ATOM 0 HB3 TYR A 73 31.379 -20.291 8.668 1.00 0.00 H new ATOM 0 HD1 TYR A 73 29.396 -20.723 6.429 1.00 0.00 H new ATOM 0 HD2 TYR A 73 33.540 -19.735 6.327 1.00 0.00 H new ATOM 0 HE1 TYR A 73 29.588 -21.765 4.215 1.00 0.00 H new ATOM 0 HE2 TYR A 73 33.734 -20.774 4.111 1.00 0.00 H new ATOM 0 HH TYR A 73 32.704 -21.838 2.470 1.00 0.00 H new ATOM 1192 N LYS A 74 30.502 -16.992 9.748 1.00 0.00 N ATOM 1193 CA LYS A 74 30.487 -16.380 11.071 1.00 0.00 C ATOM 1194 C LYS A 74 29.060 -16.077 11.515 1.00 0.00 C ATOM 1195 O LYS A 74 28.682 -16.348 12.656 1.00 0.00 O ATOM 1196 CB LYS A 74 31.316 -15.094 11.070 1.00 0.00 C ATOM 1197 CG LYS A 74 32.575 -15.182 10.225 1.00 0.00 C ATOM 1198 CD LYS A 74 33.688 -14.314 10.789 1.00 0.00 C ATOM 1199 CE LYS A 74 35.021 -14.613 10.121 1.00 0.00 C ATOM 1200 NZ LYS A 74 35.528 -13.446 9.347 1.00 0.00 N ATOM 0 H LYS A 74 30.953 -16.428 9.028 1.00 0.00 H new ATOM 0 HA LYS A 74 30.925 -17.087 11.775 1.00 0.00 H new ATOM 0 HB2 LYS A 74 30.699 -14.274 10.703 1.00 0.00 H new ATOM 0 HB3 LYS A 74 31.593 -14.850 12.095 1.00 0.00 H new ATOM 0 HG2 LYS A 74 32.910 -16.218 10.176 1.00 0.00 H new ATOM 0 HG3 LYS A 74 32.352 -14.871 9.204 1.00 0.00 H new ATOM 0 HD2 LYS A 74 33.437 -13.263 10.649 1.00 0.00 H new ATOM 0 HD3 LYS A 74 33.772 -14.481 11.863 1.00 0.00 H new ATOM 0 HE2 LYS A 74 35.753 -14.891 10.879 1.00 0.00 H new ATOM 0 HE3 LYS A 74 34.910 -15.469 9.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 36.178 -13.777 8.606 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 34.728 -12.946 8.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 36.033 -12.799 9.986 1.00 0.00 H new ATOM 1214 N THR A 75 28.269 -15.514 10.607 1.00 0.00 N ATOM 1215 CA THR A 75 26.884 -15.175 10.905 1.00 0.00 C ATOM 1216 C THR A 75 25.968 -16.376 10.704 1.00 0.00 C ATOM 1217 O THR A 75 24.820 -16.375 11.146 1.00 0.00 O ATOM 1218 CB THR A 75 26.388 -14.013 10.023 1.00 0.00 C ATOM 1219 OG1 THR A 75 26.333 -14.426 8.653 1.00 0.00 O ATOM 1220 CG2 THR A 75 27.301 -12.804 10.157 1.00 0.00 C ATOM 0 H THR A 75 28.565 -15.283 9.658 1.00 0.00 H new ATOM 0 HA THR A 75 26.852 -14.868 11.950 1.00 0.00 H new ATOM 0 HB THR A 75 25.389 -13.733 10.358 1.00 0.00 H new ATOM 0 HG1 THR A 75 26.927 -15.194 8.519 1.00 0.00 H new ATOM 0 HG21 THR A 75 26.931 -11.997 9.525 1.00 0.00 H new ATOM 0 HG22 THR A 75 27.317 -12.474 11.196 1.00 0.00 H new ATOM 0 HG23 THR A 75 28.310 -13.074 9.846 1.00 0.00 H new ATOM 1228 N GLY A 76 26.484 -17.403 10.034 1.00 0.00 N ATOM 1229 CA GLY A 76 25.698 -18.597 9.787 1.00 0.00 C ATOM 1230 C GLY A 76 25.028 -18.580 8.427 1.00 0.00 C ATOM 1231 O GLY A 76 24.551 -19.610 7.950 1.00 0.00 O ATOM 0 H GLY A 76 27.432 -17.429 9.658 1.00 0.00 H new ATOM 0 HA2 GLY A 76 26.342 -19.473 9.860 1.00 0.00 H new ATOM 0 HA3 GLY A 76 24.938 -18.694 10.562 1.00 0.00 H new ATOM 1235 N ILE A 77 24.992 -17.408 7.802 1.00 0.00 N ATOM 1236 CA ILE A 77 24.375 -17.262 6.489 1.00 0.00 C ATOM 1237 C ILE A 77 24.757 -18.417 5.571 1.00 0.00 C ATOM 1238 O ILE A 77 23.925 -18.930 4.821 1.00 0.00 O ATOM 1239 CB ILE A 77 24.781 -15.934 5.822 1.00 0.00 C ATOM 1240 CG1 ILE A 77 24.107 -14.756 6.529 1.00 0.00 C ATOM 1241 CG2 ILE A 77 24.416 -15.951 4.345 1.00 0.00 C ATOM 1242 CD1 ILE A 77 22.730 -14.437 5.992 1.00 0.00 C ATOM 0 H ILE A 77 25.382 -16.546 8.183 1.00 0.00 H new ATOM 0 HA ILE A 77 23.296 -17.267 6.644 1.00 0.00 H new ATOM 0 HB ILE A 77 25.861 -15.816 5.909 1.00 0.00 H new ATOM 0 HG12 ILE A 77 24.031 -14.977 7.594 1.00 0.00 H new ATOM 0 HG13 ILE A 77 24.740 -13.874 6.431 1.00 0.00 H new ATOM 0 HG21 ILE A 77 24.709 -15.006 3.887 1.00 0.00 H new ATOM 0 HG22 ILE A 77 24.937 -16.771 3.851 1.00 0.00 H new ATOM 0 HG23 ILE A 77 23.340 -16.088 4.238 1.00 0.00 H new ATOM 0 HD11 ILE A 77 22.313 -13.592 6.540 1.00 0.00 H new ATOM 0 HD12 ILE A 77 22.802 -14.184 4.934 1.00 0.00 H new ATOM 0 HD13 ILE A 77 22.082 -15.305 6.115 1.00 0.00 H new ATOM 1254 N LEU A 78 26.020 -18.824 5.635 1.00 0.00 N ATOM 1255 CA LEU A 78 26.513 -19.922 4.810 1.00 0.00 C ATOM 1256 C LEU A 78 26.981 -21.086 5.676 1.00 0.00 C ATOM 1257 O LEU A 78 27.250 -20.918 6.865 1.00 0.00 O ATOM 1258 CB LEU A 78 27.659 -19.441 3.918 1.00 0.00 C ATOM 1259 CG LEU A 78 27.259 -18.892 2.548 1.00 0.00 C ATOM 1260 CD1 LEU A 78 28.480 -18.375 1.803 1.00 0.00 C ATOM 1261 CD2 LEU A 78 26.548 -19.962 1.732 1.00 0.00 C ATOM 0 H LEU A 78 26.721 -18.410 6.249 1.00 0.00 H new ATOM 0 HA LEU A 78 25.693 -20.268 4.181 1.00 0.00 H new ATOM 0 HB2 LEU A 78 28.207 -18.665 4.452 1.00 0.00 H new ATOM 0 HB3 LEU A 78 28.348 -20.272 3.767 1.00 0.00 H new ATOM 0 HG LEU A 78 26.571 -18.060 2.698 1.00 0.00 H new ATOM 0 HD11 LEU A 78 28.176 -17.988 0.830 1.00 0.00 H new ATOM 0 HD12 LEU A 78 28.948 -17.578 2.380 1.00 0.00 H new ATOM 0 HD13 LEU A 78 29.192 -19.188 1.664 1.00 0.00 H new ATOM 0 HD21 LEU A 78 26.270 -19.554 0.760 1.00 0.00 H new ATOM 0 HD22 LEU A 78 27.213 -20.814 1.591 1.00 0.00 H new ATOM 0 HD23 LEU A 78 25.651 -20.285 2.259 1.00 0.00 H new ATOM 1273 N GLU A 79 27.079 -22.266 5.071 1.00 0.00 N ATOM 1274 CA GLU A 79 27.517 -23.457 5.788 1.00 0.00 C ATOM 1275 C GLU A 79 28.813 -24.003 5.195 1.00 0.00 C ATOM 1276 O GLU A 79 28.857 -24.400 4.030 1.00 0.00 O ATOM 1277 CB GLU A 79 26.431 -24.534 5.745 1.00 0.00 C ATOM 1278 CG GLU A 79 25.768 -24.783 7.089 1.00 0.00 C ATOM 1279 CD GLU A 79 26.030 -26.180 7.619 1.00 0.00 C ATOM 1280 OE1 GLU A 79 27.195 -26.478 7.956 1.00 0.00 O ATOM 1281 OE2 GLU A 79 25.070 -26.974 7.697 1.00 0.00 O ATOM 0 H GLU A 79 26.861 -22.422 4.087 1.00 0.00 H new ATOM 0 HA GLU A 79 27.701 -23.178 6.825 1.00 0.00 H new ATOM 0 HB2 GLU A 79 25.669 -24.242 5.022 1.00 0.00 H new ATOM 0 HB3 GLU A 79 26.869 -25.466 5.387 1.00 0.00 H new ATOM 0 HG2 GLU A 79 26.131 -24.051 7.810 1.00 0.00 H new ATOM 0 HG3 GLU A 79 24.693 -24.630 6.993 1.00 0.00 H new ATOM 1288 N ARG A 80 29.867 -24.020 6.005 1.00 0.00 N ATOM 1289 CA ARG A 80 31.164 -24.515 5.561 1.00 0.00 C ATOM 1290 C ARG A 80 31.016 -25.841 4.821 1.00 0.00 C ATOM 1291 O ARG A 80 30.377 -26.771 5.313 1.00 0.00 O ATOM 1292 CB ARG A 80 32.104 -24.689 6.756 1.00 0.00 C ATOM 1293 CG ARG A 80 33.562 -24.410 6.430 1.00 0.00 C ATOM 1294 CD ARG A 80 34.012 -23.070 6.991 1.00 0.00 C ATOM 1295 NE ARG A 80 35.202 -22.564 6.312 1.00 0.00 N ATOM 1296 CZ ARG A 80 36.403 -23.122 6.422 1.00 0.00 C ATOM 1297 NH1 ARG A 80 36.572 -24.197 7.179 1.00 0.00 N ATOM 1298 NH2 ARG A 80 37.438 -22.603 5.774 1.00 0.00 N ATOM 0 H ARG A 80 29.848 -23.697 6.972 1.00 0.00 H new ATOM 0 HA ARG A 80 31.589 -23.781 4.876 1.00 0.00 H new ATOM 0 HB2 ARG A 80 31.786 -24.023 7.558 1.00 0.00 H new ATOM 0 HB3 ARG A 80 32.013 -25.708 7.133 1.00 0.00 H new ATOM 0 HG2 ARG A 80 34.186 -25.205 6.839 1.00 0.00 H new ATOM 0 HG3 ARG A 80 33.702 -24.419 5.349 1.00 0.00 H new ATOM 0 HD2 ARG A 80 33.203 -22.346 6.893 1.00 0.00 H new ATOM 0 HD3 ARG A 80 34.219 -23.174 8.056 1.00 0.00 H new ATOM 0 HE ARG A 80 35.106 -21.738 5.722 1.00 0.00 H new ATOM 0 HH11 ARG A 80 35.779 -24.598 7.679 1.00 0.00 H new ATOM 0 HH12 ARG A 80 37.495 -24.623 7.261 1.00 0.00 H new ATOM 0 HH21 ARG A 80 37.312 -21.775 5.191 1.00 0.00 H new ATOM 0 HH22 ARG A 80 38.360 -23.032 5.859 1.00 0.00 H new ATOM 1312 N VAL A 81 31.609 -25.920 3.634 1.00 0.00 N ATOM 1313 CA VAL A 81 31.544 -27.131 2.825 1.00 0.00 C ATOM 1314 C VAL A 81 32.938 -27.684 2.550 1.00 0.00 C ATOM 1315 O VAL A 81 33.873 -26.931 2.280 1.00 0.00 O ATOM 1316 CB VAL A 81 30.831 -26.873 1.484 1.00 0.00 C ATOM 1317 CG1 VAL A 81 30.827 -28.132 0.631 1.00 0.00 C ATOM 1318 CG2 VAL A 81 29.414 -26.375 1.722 1.00 0.00 C ATOM 0 H VAL A 81 32.140 -25.159 3.211 1.00 0.00 H new ATOM 0 HA VAL A 81 30.973 -27.863 3.396 1.00 0.00 H new ATOM 0 HB VAL A 81 31.377 -26.099 0.944 1.00 0.00 H new ATOM 0 HG11 VAL A 81 30.319 -27.931 -0.312 1.00 0.00 H new ATOM 0 HG12 VAL A 81 31.853 -28.440 0.432 1.00 0.00 H new ATOM 0 HG13 VAL A 81 30.305 -28.929 1.161 1.00 0.00 H new ATOM 0 HG21 VAL A 81 28.925 -26.198 0.764 1.00 0.00 H new ATOM 0 HG22 VAL A 81 28.854 -27.124 2.282 1.00 0.00 H new ATOM 0 HG23 VAL A 81 29.446 -25.446 2.291 1.00 0.00 H new ATOM 1328 N ASP A 82 33.069 -29.004 2.619 1.00 0.00 N ATOM 1329 CA ASP A 82 34.348 -29.659 2.375 1.00 0.00 C ATOM 1330 C ASP A 82 34.393 -30.260 0.973 1.00 0.00 C ATOM 1331 O ASP A 82 35.025 -31.293 0.750 1.00 0.00 O ATOM 1332 CB ASP A 82 34.595 -30.750 3.419 1.00 0.00 C ATOM 1333 CG ASP A 82 35.067 -30.186 4.744 1.00 0.00 C ATOM 1334 OD1 ASP A 82 34.349 -29.342 5.320 1.00 0.00 O ATOM 1335 OD2 ASP A 82 36.155 -30.589 5.206 1.00 0.00 O ATOM 0 H ASP A 82 32.305 -29.641 2.842 1.00 0.00 H new ATOM 0 HA ASP A 82 35.133 -28.907 2.454 1.00 0.00 H new ATOM 0 HB2 ASP A 82 33.676 -31.315 3.575 1.00 0.00 H new ATOM 0 HB3 ASP A 82 35.339 -31.450 3.040 1.00 0.00 H new ATOM 1340 N ARG A 83 33.718 -29.607 0.033 1.00 0.00 N ATOM 1341 CA ARG A 83 33.678 -30.078 -1.346 1.00 0.00 C ATOM 1342 C ARG A 83 34.322 -29.063 -2.286 1.00 0.00 C ATOM 1343 O ARG A 83 34.861 -28.048 -1.844 1.00 0.00 O ATOM 1344 CB ARG A 83 32.234 -30.344 -1.776 1.00 0.00 C ATOM 1345 CG ARG A 83 31.827 -31.804 -1.673 1.00 0.00 C ATOM 1346 CD ARG A 83 30.460 -31.957 -1.024 1.00 0.00 C ATOM 1347 NE ARG A 83 30.287 -33.274 -0.416 1.00 0.00 N ATOM 1348 CZ ARG A 83 30.971 -33.690 0.643 1.00 0.00 C ATOM 1349 NH1 ARG A 83 31.870 -32.896 1.210 1.00 0.00 N ATOM 1350 NH2 ARG A 83 30.757 -34.902 1.139 1.00 0.00 N ATOM 0 H ARG A 83 33.191 -28.750 0.201 1.00 0.00 H new ATOM 0 HA ARG A 83 34.243 -31.009 -1.402 1.00 0.00 H new ATOM 0 HB2 ARG A 83 31.564 -29.745 -1.160 1.00 0.00 H new ATOM 0 HB3 ARG A 83 32.103 -30.011 -2.806 1.00 0.00 H new ATOM 0 HG2 ARG A 83 31.811 -32.249 -2.668 1.00 0.00 H new ATOM 0 HG3 ARG A 83 32.570 -32.350 -1.092 1.00 0.00 H new ATOM 0 HD2 ARG A 83 30.332 -31.187 -0.263 1.00 0.00 H new ATOM 0 HD3 ARG A 83 29.684 -31.798 -1.772 1.00 0.00 H new ATOM 0 HE ARG A 83 29.603 -33.909 -0.828 1.00 0.00 H new ATOM 0 HH11 ARG A 83 32.037 -31.963 0.832 1.00 0.00 H new ATOM 0 HH12 ARG A 83 32.394 -33.218 2.024 1.00 0.00 H new ATOM 0 HH21 ARG A 83 30.066 -35.515 0.707 1.00 0.00 H new ATOM 0 HH22 ARG A 83 31.283 -35.220 1.953 1.00 0.00 H new ATOM 1364 N ARG A 84 34.261 -29.344 -3.583 1.00 0.00 N ATOM 1365 CA ARG A 84 34.839 -28.457 -4.585 1.00 0.00 C ATOM 1366 C ARG A 84 33.769 -27.554 -5.193 1.00 0.00 C ATOM 1367 O ARG A 84 32.792 -28.032 -5.770 1.00 0.00 O ATOM 1368 CB ARG A 84 35.520 -29.271 -5.686 1.00 0.00 C ATOM 1369 CG ARG A 84 36.243 -28.418 -6.716 1.00 0.00 C ATOM 1370 CD ARG A 84 37.483 -29.118 -7.249 1.00 0.00 C ATOM 1371 NE ARG A 84 37.188 -29.936 -8.422 1.00 0.00 N ATOM 1372 CZ ARG A 84 38.101 -30.657 -9.064 1.00 0.00 C ATOM 1373 NH1 ARG A 84 39.359 -30.661 -8.648 1.00 0.00 N ATOM 1374 NH2 ARG A 84 37.755 -31.376 -10.124 1.00 0.00 N ATOM 0 H ARG A 84 33.817 -30.179 -3.965 1.00 0.00 H new ATOM 0 HA ARG A 84 35.583 -27.830 -4.093 1.00 0.00 H new ATOM 0 HB2 ARG A 84 36.233 -29.957 -5.230 1.00 0.00 H new ATOM 0 HB3 ARG A 84 34.771 -29.880 -6.192 1.00 0.00 H new ATOM 0 HG2 ARG A 84 35.568 -28.193 -7.542 1.00 0.00 H new ATOM 0 HG3 ARG A 84 36.526 -27.466 -6.267 1.00 0.00 H new ATOM 0 HD2 ARG A 84 38.237 -28.374 -7.506 1.00 0.00 H new ATOM 0 HD3 ARG A 84 37.909 -29.746 -6.467 1.00 0.00 H new ATOM 0 HE ARG A 84 36.228 -29.955 -8.768 1.00 0.00 H new ATOM 0 HH11 ARG A 84 39.628 -30.110 -7.833 1.00 0.00 H new ATOM 0 HH12 ARG A 84 40.058 -31.215 -9.143 1.00 0.00 H new ATOM 0 HH21 ARG A 84 36.787 -31.376 -10.447 1.00 0.00 H new ATOM 0 HH22 ARG A 84 38.457 -31.929 -10.616 1.00 0.00 H new ATOM 1388 N LEU A 85 33.962 -26.246 -5.061 1.00 0.00 N ATOM 1389 CA LEU A 85 33.014 -25.275 -5.597 1.00 0.00 C ATOM 1390 C LEU A 85 31.581 -25.656 -5.236 1.00 0.00 C ATOM 1391 O LEU A 85 30.662 -25.487 -6.037 1.00 0.00 O ATOM 1392 CB LEU A 85 33.159 -25.176 -7.116 1.00 0.00 C ATOM 1393 CG LEU A 85 34.322 -24.322 -7.624 1.00 0.00 C ATOM 1394 CD1 LEU A 85 34.279 -22.936 -7.001 1.00 0.00 C ATOM 1395 CD2 LEU A 85 35.651 -25.001 -7.328 1.00 0.00 C ATOM 0 H LEU A 85 34.766 -25.834 -4.588 1.00 0.00 H new ATOM 0 HA LEU A 85 33.236 -24.305 -5.153 1.00 0.00 H new ATOM 0 HB2 LEU A 85 33.272 -26.183 -7.517 1.00 0.00 H new ATOM 0 HB3 LEU A 85 32.232 -24.772 -7.524 1.00 0.00 H new ATOM 0 HG LEU A 85 34.224 -24.215 -8.704 1.00 0.00 H new ATOM 0 HD11 LEU A 85 35.114 -22.343 -7.374 1.00 0.00 H new ATOM 0 HD12 LEU A 85 33.341 -22.448 -7.264 1.00 0.00 H new ATOM 0 HD13 LEU A 85 34.351 -23.022 -5.917 1.00 0.00 H new ATOM 0 HD21 LEU A 85 36.467 -24.379 -7.696 1.00 0.00 H new ATOM 0 HD22 LEU A 85 35.757 -25.139 -6.252 1.00 0.00 H new ATOM 0 HD23 LEU A 85 35.682 -25.971 -7.823 1.00 0.00 H new ATOM 1407 N VAL A 86 31.399 -26.170 -4.023 1.00 0.00 N ATOM 1408 CA VAL A 86 30.078 -26.572 -3.554 1.00 0.00 C ATOM 1409 C VAL A 86 29.740 -25.905 -2.226 1.00 0.00 C ATOM 1410 O VAL A 86 30.263 -26.285 -1.178 1.00 0.00 O ATOM 1411 CB VAL A 86 29.983 -28.100 -3.388 1.00 0.00 C ATOM 1412 CG1 VAL A 86 28.795 -28.469 -2.512 1.00 0.00 C ATOM 1413 CG2 VAL A 86 29.884 -28.778 -4.746 1.00 0.00 C ATOM 0 H VAL A 86 32.149 -26.318 -3.348 1.00 0.00 H new ATOM 0 HA VAL A 86 29.362 -26.251 -4.311 1.00 0.00 H new ATOM 0 HB VAL A 86 30.890 -28.452 -2.897 1.00 0.00 H new ATOM 0 HG11 VAL A 86 28.744 -29.553 -2.406 1.00 0.00 H new ATOM 0 HG12 VAL A 86 28.912 -28.013 -1.529 1.00 0.00 H new ATOM 0 HG13 VAL A 86 27.876 -28.106 -2.973 1.00 0.00 H new ATOM 0 HG21 VAL A 86 29.818 -29.857 -4.610 1.00 0.00 H new ATOM 0 HG22 VAL A 86 28.995 -28.423 -5.266 1.00 0.00 H new ATOM 0 HG23 VAL A 86 30.769 -28.541 -5.337 1.00 0.00 H new ATOM 1423 N TYR A 87 28.863 -24.909 -2.276 1.00 0.00 N ATOM 1424 CA TYR A 87 28.456 -24.187 -1.076 1.00 0.00 C ATOM 1425 C TYR A 87 27.026 -24.546 -0.684 1.00 0.00 C ATOM 1426 O TYR A 87 26.310 -25.210 -1.434 1.00 0.00 O ATOM 1427 CB TYR A 87 28.573 -22.679 -1.299 1.00 0.00 C ATOM 1428 CG TYR A 87 29.969 -22.227 -1.664 1.00 0.00 C ATOM 1429 CD1 TYR A 87 30.544 -22.592 -2.874 1.00 0.00 C ATOM 1430 CD2 TYR A 87 30.712 -21.435 -0.797 1.00 0.00 C ATOM 1431 CE1 TYR A 87 31.820 -22.182 -3.211 1.00 0.00 C ATOM 1432 CE2 TYR A 87 31.988 -21.020 -1.126 1.00 0.00 C ATOM 1433 CZ TYR A 87 32.537 -21.396 -2.334 1.00 0.00 C ATOM 1434 OH TYR A 87 33.808 -20.985 -2.665 1.00 0.00 O ATOM 0 H TYR A 87 28.420 -24.583 -3.135 1.00 0.00 H new ATOM 0 HA TYR A 87 29.121 -24.479 -0.263 1.00 0.00 H new ATOM 0 HB2 TYR A 87 27.886 -22.383 -2.091 1.00 0.00 H new ATOM 0 HB3 TYR A 87 28.258 -22.161 -0.393 1.00 0.00 H new ATOM 0 HD1 TYR A 87 29.985 -23.207 -3.564 1.00 0.00 H new ATOM 0 HD2 TYR A 87 30.285 -21.139 0.150 1.00 0.00 H new ATOM 0 HE1 TYR A 87 32.253 -22.476 -4.156 1.00 0.00 H new ATOM 0 HE2 TYR A 87 32.552 -20.405 -0.441 1.00 0.00 H new ATOM 0 HH TYR A 87 33.846 -20.779 -3.622 1.00 0.00 H new ATOM 1444 N LYS A 88 26.615 -24.100 0.499 1.00 0.00 N ATOM 1445 CA LYS A 88 25.270 -24.370 0.993 1.00 0.00 C ATOM 1446 C LYS A 88 24.807 -23.268 1.940 1.00 0.00 C ATOM 1447 O LYS A 88 25.560 -22.824 2.808 1.00 0.00 O ATOM 1448 CB LYS A 88 25.229 -25.722 1.709 1.00 0.00 C ATOM 1449 CG LYS A 88 23.917 -25.993 2.424 1.00 0.00 C ATOM 1450 CD LYS A 88 24.125 -26.841 3.668 1.00 0.00 C ATOM 1451 CE LYS A 88 22.929 -27.743 3.934 1.00 0.00 C ATOM 1452 NZ LYS A 88 22.691 -27.934 5.391 1.00 0.00 N ATOM 0 H LYS A 88 27.194 -23.550 1.133 1.00 0.00 H new ATOM 0 HA LYS A 88 24.595 -24.398 0.138 1.00 0.00 H new ATOM 0 HB2 LYS A 88 25.407 -26.514 0.982 1.00 0.00 H new ATOM 0 HB3 LYS A 88 26.043 -25.765 2.433 1.00 0.00 H new ATOM 0 HG2 LYS A 88 23.450 -25.048 2.701 1.00 0.00 H new ATOM 0 HG3 LYS A 88 23.231 -26.501 1.747 1.00 0.00 H new ATOM 0 HD2 LYS A 88 25.022 -27.449 3.549 1.00 0.00 H new ATOM 0 HD3 LYS A 88 24.291 -26.192 4.528 1.00 0.00 H new ATOM 0 HE2 LYS A 88 22.040 -27.312 3.474 1.00 0.00 H new ATOM 0 HE3 LYS A 88 23.093 -28.712 3.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 21.868 -28.554 5.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 23.530 -28.369 5.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 22.509 -27.012 5.837 1.00 0.00 H new ATOM 1466 N PHE A 89 23.564 -22.831 1.770 1.00 0.00 N ATOM 1467 CA PHE A 89 23.000 -21.780 2.610 1.00 0.00 C ATOM 1468 C PHE A 89 22.681 -22.312 4.004 1.00 0.00 C ATOM 1469 O PHE A 89 22.105 -23.389 4.153 1.00 0.00 O ATOM 1470 CB PHE A 89 21.735 -21.208 1.967 1.00 0.00 C ATOM 1471 CG PHE A 89 21.980 -20.560 0.635 1.00 0.00 C ATOM 1472 CD1 PHE A 89 22.414 -19.246 0.557 1.00 0.00 C ATOM 1473 CD2 PHE A 89 21.776 -21.265 -0.541 1.00 0.00 C ATOM 1474 CE1 PHE A 89 22.640 -18.647 -0.668 1.00 0.00 C ATOM 1475 CE2 PHE A 89 22.001 -20.671 -1.768 1.00 0.00 C ATOM 1476 CZ PHE A 89 22.433 -19.360 -1.832 1.00 0.00 C ATOM 0 H PHE A 89 22.927 -23.188 1.058 1.00 0.00 H new ATOM 0 HA PHE A 89 23.741 -20.986 2.704 1.00 0.00 H new ATOM 0 HB2 PHE A 89 21.006 -22.009 1.844 1.00 0.00 H new ATOM 0 HB3 PHE A 89 21.293 -20.476 2.643 1.00 0.00 H new ATOM 0 HD1 PHE A 89 22.578 -18.683 1.464 1.00 0.00 H new ATOM 0 HD2 PHE A 89 21.438 -22.290 -0.498 1.00 0.00 H new ATOM 0 HE1 PHE A 89 22.978 -17.622 -0.715 1.00 0.00 H new ATOM 0 HE2 PHE A 89 21.839 -21.231 -2.677 1.00 0.00 H new ATOM 0 HZ PHE A 89 22.608 -18.894 -2.790 1.00 0.00 H new ATOM 1486 N GLY A 90 23.060 -21.547 5.024 1.00 0.00 N ATOM 1487 CA GLY A 90 22.806 -21.957 6.393 1.00 0.00 C ATOM 1488 C GLY A 90 21.388 -21.656 6.835 1.00 0.00 C ATOM 1489 O GLY A 90 20.484 -21.533 6.007 1.00 0.00 O ATOM 0 H GLY A 90 23.538 -20.651 4.927 1.00 0.00 H new ATOM 0 HA2 GLY A 90 22.994 -23.026 6.490 1.00 0.00 H new ATOM 0 HA3 GLY A 90 23.506 -21.449 7.057 1.00 0.00 H new ATOM 1493 N LYS A 91 21.190 -21.538 8.143 1.00 0.00 N ATOM 1494 CA LYS A 91 19.871 -21.250 8.695 1.00 0.00 C ATOM 1495 C LYS A 91 19.605 -19.748 8.713 1.00 0.00 C ATOM 1496 O LYS A 91 18.455 -19.312 8.734 1.00 0.00 O ATOM 1497 CB LYS A 91 19.754 -21.816 10.112 1.00 0.00 C ATOM 1498 CG LYS A 91 20.784 -21.256 11.078 1.00 0.00 C ATOM 1499 CD LYS A 91 21.617 -22.360 11.707 1.00 0.00 C ATOM 1500 CE LYS A 91 21.112 -22.716 13.097 1.00 0.00 C ATOM 1501 NZ LYS A 91 21.010 -24.189 13.289 1.00 0.00 N ATOM 0 H LYS A 91 21.927 -21.637 8.842 1.00 0.00 H new ATOM 0 HA LYS A 91 19.126 -21.726 8.057 1.00 0.00 H new ATOM 0 HB2 LYS A 91 18.756 -21.606 10.497 1.00 0.00 H new ATOM 0 HB3 LYS A 91 19.859 -22.900 10.071 1.00 0.00 H new ATOM 0 HG2 LYS A 91 21.438 -20.561 10.551 1.00 0.00 H new ATOM 0 HG3 LYS A 91 20.280 -20.689 11.860 1.00 0.00 H new ATOM 0 HD2 LYS A 91 21.590 -23.245 11.071 1.00 0.00 H new ATOM 0 HD3 LYS A 91 22.658 -22.042 11.767 1.00 0.00 H new ATOM 0 HE2 LYS A 91 21.784 -22.298 13.846 1.00 0.00 H new ATOM 0 HE3 LYS A 91 20.135 -22.260 13.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 20.662 -24.391 14.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 20.349 -24.585 12.591 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 21.947 -24.621 13.162 1.00 0.00 H new ATOM 1515 N ASN A 92 20.677 -18.961 8.703 1.00 0.00 N ATOM 1516 CA ASN A 92 20.558 -17.508 8.717 1.00 0.00 C ATOM 1517 C ASN A 92 19.919 -17.002 7.428 1.00 0.00 C ATOM 1518 O ASN A 92 19.231 -15.981 7.423 1.00 0.00 O ATOM 1519 CB ASN A 92 21.934 -16.865 8.904 1.00 0.00 C ATOM 1520 CG ASN A 92 22.212 -16.505 10.351 1.00 0.00 C ATOM 1521 OD1 ASN A 92 22.475 -15.346 10.674 1.00 0.00 O ATOM 1522 ND2 ASN A 92 22.155 -17.499 11.229 1.00 0.00 N ATOM 0 H ASN A 92 21.637 -19.306 8.685 1.00 0.00 H new ATOM 0 HA ASN A 92 19.917 -17.229 9.553 1.00 0.00 H new ATOM 0 HB2 ASN A 92 22.704 -17.550 8.549 1.00 0.00 H new ATOM 0 HB3 ASN A 92 21.999 -15.967 8.290 1.00 0.00 H new ATOM 0 HD21 ASN A 92 22.333 -17.318 12.217 1.00 0.00 H new ATOM 0 HD22 ASN A 92 21.933 -18.444 10.916 1.00 0.00 H new ATOM 1529 N ALA A 93 20.151 -17.723 6.336 1.00 0.00 N ATOM 1530 CA ALA A 93 19.596 -17.349 5.041 1.00 0.00 C ATOM 1531 C ALA A 93 18.151 -17.820 4.906 1.00 0.00 C ATOM 1532 O ALA A 93 17.838 -18.980 5.174 1.00 0.00 O ATOM 1533 CB ALA A 93 20.446 -17.922 3.917 1.00 0.00 C ATOM 0 H ALA A 93 20.720 -18.570 6.322 1.00 0.00 H new ATOM 0 HA ALA A 93 19.605 -16.261 4.971 1.00 0.00 H new ATOM 0 HB1 ALA A 93 20.020 -17.635 2.956 1.00 0.00 H new ATOM 0 HB2 ALA A 93 21.461 -17.533 3.994 1.00 0.00 H new ATOM 0 HB3 ALA A 93 20.467 -19.009 3.994 1.00 0.00 H new ATOM 1539 N HIS A 94 17.275 -16.911 4.490 1.00 0.00 N ATOM 1540 CA HIS A 94 15.862 -17.234 4.320 1.00 0.00 C ATOM 1541 C HIS A 94 15.437 -17.064 2.865 1.00 0.00 C ATOM 1542 O HIS A 94 16.151 -16.458 2.066 1.00 0.00 O ATOM 1543 CB HIS A 94 15.003 -16.347 5.222 1.00 0.00 C ATOM 1544 CG HIS A 94 15.179 -14.882 4.965 1.00 0.00 C ATOM 1545 ND1 HIS A 94 14.786 -14.271 3.793 1.00 0.00 N ATOM 1546 CD2 HIS A 94 15.709 -13.905 5.737 1.00 0.00 C ATOM 1547 CE1 HIS A 94 15.067 -12.982 3.855 1.00 0.00 C ATOM 1548 NE2 HIS A 94 15.628 -12.734 5.025 1.00 0.00 N ATOM 0 H HIS A 94 17.518 -15.946 4.265 1.00 0.00 H new ATOM 0 HA HIS A 94 15.716 -18.277 4.603 1.00 0.00 H new ATOM 0 HB2 HIS A 94 13.954 -16.609 5.082 1.00 0.00 H new ATOM 0 HB3 HIS A 94 15.248 -16.557 6.263 1.00 0.00 H new ATOM 0 HD2 HIS A 94 16.119 -14.024 6.729 1.00 0.00 H new ATOM 0 HE1 HIS A 94 14.871 -12.255 3.081 1.00 0.00 H new ATOM 0 HE2 HIS A 94 15.949 -11.821 5.347 1.00 0.00 H new ATOM 1556 N GLY A 95 14.270 -17.603 2.527 1.00 0.00 N ATOM 1557 CA GLY A 95 13.771 -17.500 1.168 1.00 0.00 C ATOM 1558 C GLY A 95 13.909 -18.800 0.400 1.00 0.00 C ATOM 1559 O GLY A 95 13.001 -19.197 -0.330 1.00 0.00 O ATOM 0 H GLY A 95 13.661 -18.109 3.170 1.00 0.00 H new ATOM 0 HA2 GLY A 95 12.722 -17.205 1.191 1.00 0.00 H new ATOM 0 HA3 GLY A 95 14.313 -16.713 0.644 1.00 0.00 H new ATOM 1563 N TRP A 96 15.049 -19.463 0.562 1.00 0.00 N ATOM 1564 CA TRP A 96 15.303 -20.724 -0.124 1.00 0.00 C ATOM 1565 C TRP A 96 14.611 -21.881 0.590 1.00 0.00 C ATOM 1566 O TRP A 96 14.061 -22.776 -0.051 1.00 0.00 O ATOM 1567 CB TRP A 96 16.807 -20.988 -0.209 1.00 0.00 C ATOM 1568 CG TRP A 96 17.419 -21.369 1.106 1.00 0.00 C ATOM 1569 CD1 TRP A 96 17.951 -20.524 2.038 1.00 0.00 C ATOM 1570 CD2 TRP A 96 17.563 -22.693 1.632 1.00 0.00 C ATOM 1571 NE1 TRP A 96 18.417 -21.243 3.112 1.00 0.00 N ATOM 1572 CE2 TRP A 96 18.190 -22.575 2.888 1.00 0.00 C ATOM 1573 CE3 TRP A 96 17.221 -23.965 1.166 1.00 0.00 C ATOM 1574 CZ2 TRP A 96 18.482 -23.683 3.680 1.00 0.00 C ATOM 1575 CZ3 TRP A 96 17.512 -25.063 1.954 1.00 0.00 C ATOM 1576 CH2 TRP A 96 18.136 -24.916 3.199 1.00 0.00 C ATOM 0 H TRP A 96 15.811 -19.148 1.162 1.00 0.00 H new ATOM 0 HA TRP A 96 14.897 -20.649 -1.133 1.00 0.00 H new ATOM 0 HB2 TRP A 96 16.989 -21.785 -0.930 1.00 0.00 H new ATOM 0 HB3 TRP A 96 17.304 -20.095 -0.588 1.00 0.00 H new ATOM 0 HD1 TRP A 96 17.998 -19.449 1.944 1.00 0.00 H new ATOM 0 HE1 TRP A 96 18.860 -20.849 3.942 1.00 0.00 H new ATOM 0 HE3 TRP A 96 16.738 -24.088 0.208 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 18.965 -23.573 4.640 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 17.254 -26.051 1.603 1.00 0.00 H new ATOM 0 HH2 TRP A 96 18.348 -25.794 3.791 1.00 0.00 H new ATOM 1587 N GLN A 97 14.644 -21.855 1.918 1.00 0.00 N ATOM 1588 CA GLN A 97 14.019 -22.903 2.717 1.00 0.00 C ATOM 1589 C GLN A 97 12.541 -23.044 2.371 1.00 0.00 C ATOM 1590 O GLN A 97 11.956 -22.166 1.738 1.00 0.00 O ATOM 1591 CB GLN A 97 14.179 -22.600 4.208 1.00 0.00 C ATOM 1592 CG GLN A 97 15.164 -23.519 4.913 1.00 0.00 C ATOM 1593 CD GLN A 97 15.696 -22.925 6.203 1.00 0.00 C ATOM 1594 OE1 GLN A 97 15.307 -23.337 7.296 1.00 0.00 O ATOM 1595 NE2 GLN A 97 16.591 -21.952 6.081 1.00 0.00 N ATOM 0 H GLN A 97 15.096 -21.121 2.463 1.00 0.00 H new ATOM 0 HA GLN A 97 14.518 -23.845 2.489 1.00 0.00 H new ATOM 0 HB2 GLN A 97 14.508 -21.568 4.327 1.00 0.00 H new ATOM 0 HB3 GLN A 97 13.207 -22.682 4.693 1.00 0.00 H new ATOM 0 HG2 GLN A 97 14.677 -24.470 5.129 1.00 0.00 H new ATOM 0 HG3 GLN A 97 15.998 -23.733 4.245 1.00 0.00 H new ATOM 0 HE21 GLN A 97 16.884 -21.642 5.155 1.00 0.00 H new ATOM 0 HE22 GLN A 97 16.985 -21.514 6.914 1.00 0.00 H new ATOM 1604 N GLU A 98 11.943 -24.155 2.790 1.00 0.00 N ATOM 1605 CA GLU A 98 10.533 -24.410 2.522 1.00 0.00 C ATOM 1606 C GLU A 98 9.682 -23.196 2.882 1.00 0.00 C ATOM 1607 O GLU A 98 9.367 -22.971 4.051 1.00 0.00 O ATOM 1608 CB GLU A 98 10.055 -25.633 3.307 1.00 0.00 C ATOM 1609 CG GLU A 98 9.160 -26.562 2.504 1.00 0.00 C ATOM 1610 CD GLU A 98 8.260 -27.409 3.382 1.00 0.00 C ATOM 1611 OE1 GLU A 98 7.263 -26.870 3.906 1.00 0.00 O ATOM 1612 OE2 GLU A 98 8.552 -28.612 3.544 1.00 0.00 O ATOM 0 H GLU A 98 12.413 -24.892 3.316 1.00 0.00 H new ATOM 0 HA GLU A 98 10.422 -24.606 1.455 1.00 0.00 H new ATOM 0 HB2 GLU A 98 10.923 -26.192 3.657 1.00 0.00 H new ATOM 0 HB3 GLU A 98 9.515 -25.297 4.192 1.00 0.00 H new ATOM 0 HG2 GLU A 98 8.546 -25.971 1.824 1.00 0.00 H new ATOM 0 HG3 GLU A 98 9.779 -27.215 1.889 1.00 0.00 H new ATOM 1619 N ASP A 99 9.314 -22.417 1.871 1.00 0.00 N ATOM 1620 CA ASP A 99 8.500 -21.226 2.080 1.00 0.00 C ATOM 1621 C ASP A 99 7.015 -21.576 2.080 1.00 0.00 C ATOM 1622 O ASP A 99 6.624 -22.669 1.670 1.00 0.00 O ATOM 1623 CB ASP A 99 8.791 -20.186 0.997 1.00 0.00 C ATOM 1624 CG ASP A 99 9.158 -18.834 1.576 1.00 0.00 C ATOM 1625 OD1 ASP A 99 8.363 -18.294 2.373 1.00 0.00 O ATOM 1626 OD2 ASP A 99 10.242 -18.317 1.233 1.00 0.00 O ATOM 0 H ASP A 99 9.567 -22.589 0.898 1.00 0.00 H new ATOM 0 HA ASP A 99 8.757 -20.807 3.053 1.00 0.00 H new ATOM 0 HB2 ASP A 99 9.606 -20.541 0.366 1.00 0.00 H new ATOM 0 HB3 ASP A 99 7.916 -20.078 0.356 1.00 0.00 H new ATOM 1631 N LYS A 100 6.192 -20.642 2.544 1.00 0.00 N ATOM 1632 CA LYS A 100 4.750 -20.850 2.598 1.00 0.00 C ATOM 1633 C LYS A 100 4.005 -19.663 1.996 1.00 0.00 C ATOM 1634 O LYS A 100 4.339 -18.508 2.263 1.00 0.00 O ATOM 1635 CB LYS A 100 4.299 -21.068 4.045 1.00 0.00 C ATOM 1636 CG LYS A 100 3.225 -22.132 4.193 1.00 0.00 C ATOM 1637 CD LYS A 100 3.201 -22.706 5.600 1.00 0.00 C ATOM 1638 CE LYS A 100 4.167 -23.872 5.743 1.00 0.00 C ATOM 1639 NZ LYS A 100 3.719 -24.841 6.781 1.00 0.00 N ATOM 0 H LYS A 100 6.500 -19.733 2.888 1.00 0.00 H new ATOM 0 HA LYS A 100 4.515 -21.739 2.012 1.00 0.00 H new ATOM 0 HB2 LYS A 100 5.163 -21.349 4.648 1.00 0.00 H new ATOM 0 HB3 LYS A 100 3.924 -20.126 4.446 1.00 0.00 H new ATOM 0 HG2 LYS A 100 2.251 -21.703 3.957 1.00 0.00 H new ATOM 0 HG3 LYS A 100 3.403 -22.933 3.475 1.00 0.00 H new ATOM 0 HD2 LYS A 100 3.461 -21.927 6.316 1.00 0.00 H new ATOM 0 HD3 LYS A 100 2.191 -23.037 5.842 1.00 0.00 H new ATOM 0 HE2 LYS A 100 4.262 -24.384 4.785 1.00 0.00 H new ATOM 0 HE3 LYS A 100 5.156 -23.494 6.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 4.404 -25.620 6.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 3.653 -24.359 7.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 2.786 -25.221 6.521 1.00 0.00 H new ATOM 1653 N LEU A 101 2.996 -19.954 1.183 1.00 0.00 N ATOM 1654 CA LEU A 101 2.203 -18.910 0.544 1.00 0.00 C ATOM 1655 C LEU A 101 0.779 -18.897 1.090 1.00 0.00 C ATOM 1656 O LEU A 101 -0.184 -18.743 0.338 1.00 0.00 O ATOM 1657 CB LEU A 101 2.178 -19.117 -0.972 1.00 0.00 C ATOM 1658 CG LEU A 101 1.388 -20.327 -1.471 1.00 0.00 C ATOM 1659 CD1 LEU A 101 0.635 -19.984 -2.747 1.00 0.00 C ATOM 1660 CD2 LEU A 101 2.315 -21.512 -1.699 1.00 0.00 C ATOM 0 H LEU A 101 2.708 -20.904 0.951 1.00 0.00 H new ATOM 0 HA LEU A 101 2.667 -17.949 0.766 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.763 -18.221 -1.434 1.00 0.00 H new ATOM 0 HB3 LEU A 101 3.206 -19.209 -1.323 1.00 0.00 H new ATOM 0 HG LEU A 101 0.661 -20.602 -0.707 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.079 -20.857 -3.087 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -0.058 -19.166 -2.552 1.00 0.00 H new ATOM 0 HD13 LEU A 101 1.344 -19.683 -3.518 1.00 0.00 H new ATOM 0 HD21 LEU A 101 1.736 -22.364 -2.054 1.00 0.00 H new ATOM 0 HD22 LEU A 101 3.066 -21.248 -2.444 1.00 0.00 H new ATOM 0 HD23 LEU A 101 2.808 -21.773 -0.763 1.00 0.00 H new ATOM 1672 N SER A 102 0.653 -19.056 2.404 1.00 0.00 N ATOM 1673 CA SER A 102 -0.654 -19.063 3.051 1.00 0.00 C ATOM 1674 C SER A 102 -0.509 -18.978 4.568 1.00 0.00 C ATOM 1675 O SER A 102 0.363 -19.615 5.156 1.00 0.00 O ATOM 1676 CB SER A 102 -1.427 -20.328 2.672 1.00 0.00 C ATOM 1677 OG SER A 102 -2.704 -20.348 3.285 1.00 0.00 O ATOM 0 H SER A 102 1.440 -19.182 3.041 1.00 0.00 H new ATOM 0 HA SER A 102 -1.208 -18.190 2.706 1.00 0.00 H new ATOM 0 HB2 SER A 102 -1.539 -20.379 1.589 1.00 0.00 H new ATOM 0 HB3 SER A 102 -0.861 -21.209 2.975 1.00 0.00 H new ATOM 0 HG SER A 102 -3.179 -21.165 3.026 1.00 0.00 H new ATOM 1683 N GLY A 103 -1.372 -18.183 5.194 1.00 0.00 N ATOM 1684 CA GLY A 103 -1.325 -18.028 6.636 1.00 0.00 C ATOM 1685 C GLY A 103 0.035 -17.570 7.126 1.00 0.00 C ATOM 1686 O GLY A 103 0.806 -18.343 7.694 1.00 0.00 O ATOM 0 H GLY A 103 -2.102 -17.644 4.728 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -2.081 -17.307 6.946 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -1.577 -18.977 7.109 1.00 0.00 H new ATOM 1690 N PRO A 104 0.345 -16.284 6.903 1.00 0.00 N ATOM 1691 CA PRO A 104 1.623 -15.696 7.317 1.00 0.00 C ATOM 1692 C PRO A 104 1.737 -15.563 8.832 1.00 0.00 C ATOM 1693 O PRO A 104 1.327 -14.556 9.409 1.00 0.00 O ATOM 1694 CB PRO A 104 1.606 -14.313 6.659 1.00 0.00 C ATOM 1695 CG PRO A 104 0.161 -13.993 6.488 1.00 0.00 C ATOM 1696 CD PRO A 104 -0.526 -15.306 6.232 1.00 0.00 C ATOM 0 HA PRO A 104 2.471 -16.314 7.022 1.00 0.00 H new ATOM 0 HB2 PRO A 104 2.105 -13.571 7.283 1.00 0.00 H new ATOM 0 HB3 PRO A 104 2.125 -14.324 5.701 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -0.240 -13.510 7.379 1.00 0.00 H new ATOM 0 HG3 PRO A 104 0.009 -13.305 5.657 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -1.535 -15.318 6.643 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -0.614 -15.512 5.165 1.00 0.00 H new ATOM 1704 N SER A 105 2.296 -16.586 9.470 1.00 0.00 N ATOM 1705 CA SER A 105 2.460 -16.585 10.919 1.00 0.00 C ATOM 1706 C SER A 105 2.964 -17.939 11.410 1.00 0.00 C ATOM 1707 O SER A 105 3.847 -18.012 12.265 1.00 0.00 O ATOM 1708 CB SER A 105 1.136 -16.243 11.604 1.00 0.00 C ATOM 1709 OG SER A 105 0.062 -16.965 11.027 1.00 0.00 O ATOM 0 H SER A 105 2.643 -17.426 9.007 1.00 0.00 H new ATOM 0 HA SER A 105 3.200 -15.826 11.175 1.00 0.00 H new ATOM 0 HB2 SER A 105 1.203 -16.473 12.667 1.00 0.00 H new ATOM 0 HB3 SER A 105 0.945 -15.173 11.521 1.00 0.00 H new ATOM 0 HG SER A 105 -0.773 -16.730 11.483 1.00 0.00 H new ATOM 1715 N SER A 106 2.397 -19.008 10.862 1.00 0.00 N ATOM 1716 CA SER A 106 2.785 -20.361 11.245 1.00 0.00 C ATOM 1717 C SER A 106 2.195 -21.388 10.284 1.00 0.00 C ATOM 1718 O SER A 106 2.921 -22.164 9.664 1.00 0.00 O ATOM 1719 CB SER A 106 2.327 -20.660 12.674 1.00 0.00 C ATOM 1720 OG SER A 106 3.393 -20.506 13.594 1.00 0.00 O ATOM 0 H SER A 106 1.667 -18.964 10.151 1.00 0.00 H new ATOM 0 HA SER A 106 3.872 -20.428 11.198 1.00 0.00 H new ATOM 0 HB2 SER A 106 1.510 -19.992 12.945 1.00 0.00 H new ATOM 0 HB3 SER A 106 1.939 -21.677 12.729 1.00 0.00 H new ATOM 0 HG SER A 106 3.858 -19.662 13.417 1.00 0.00 H new ATOM 1726 N GLY A 107 0.870 -21.387 10.166 1.00 0.00 N ATOM 1727 CA GLY A 107 0.203 -22.323 9.280 1.00 0.00 C ATOM 1728 C GLY A 107 -0.369 -23.515 10.020 1.00 0.00 C ATOM 1729 O GLY A 107 0.307 -24.122 10.851 1.00 0.00 O ATOM 0 H GLY A 107 0.247 -20.755 10.668 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -0.599 -21.809 8.751 1.00 0.00 H new ATOM 0 HA3 GLY A 107 0.909 -22.672 8.527 1.00 0.00 H new TER 1733 GLY A 107