USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 832 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: B 62 THR OG1 : rot 180:sc= -0.609 USER MOD Set 1.2: B 64 GLN : amide:sc= -1.39 K(o=-5.9,f=-8.7!) USER MOD Set 1.3: B 78 ASN : amide:sc= -3.85 K(o=-5.9,f=-8.7!) USER MOD Set 2.1: A 62 THR OG1 : rot 180:sc= -0.627 USER MOD Set 2.2: A 64 GLN : amide:sc= -1.32 K(o=-5.8,f=-8.8!) USER MOD Set 2.3: A 78 ASN : amide:sc= -3.9 K(o=-5.8,f=-8.8!) USER MOD Single : A 32 SER OG : rot 22:sc= 0.162 USER MOD Single : A 37 HIS : no HD1:sc= -0.0803 X(o=-0.08,f=0) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -1.68 X(o=-1.7,f=-1.7) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.0102) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 MET CE :methyl 159:sc= -1.82 (180deg=-3.35!) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : B 32 SER OG : rot 29:sc= 0.197 USER MOD Single : B 37 HIS : no HD1:sc= -0.0748 X(o=-0.075,f=0) USER MOD Single : B 38 TYR OH : rot 180:sc= 0 USER MOD Single : B 41 GLN : amide:sc= -1.7 X(o=-1.7,f=-1.7) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 CYS SG : rot 180:sc= 0 USER MOD Single : B 52 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.00974) USER MOD Single : B 53 TYR OH : rot 180:sc= 0 USER MOD Single : B 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 60 MET CE :methyl 156:sc= -1.87 (180deg=-3.39!) USER MOD Single : B 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 68 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.00466) USER MOD Single : B 73 SER OG : rot 180:sc= 0 USER MOD Single : B 80 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 27 N SER A 32 5.778 -0.068 1.078 1.00 0.00 N ATOM 28 CA SER A 32 7.190 -0.505 0.891 1.00 0.00 C ATOM 29 C SER A 32 7.768 0.111 -0.389 1.00 0.00 C ATOM 30 O SER A 32 8.968 0.111 -0.589 1.00 0.00 O ATOM 31 CB SER A 32 7.241 -2.029 0.790 1.00 0.00 C ATOM 32 OG SER A 32 6.617 -2.597 1.934 1.00 0.00 O ATOM 0 HA SER A 32 7.781 -0.172 1.744 1.00 0.00 H new ATOM 0 HB2 SER A 32 6.736 -2.362 -0.117 1.00 0.00 H new ATOM 0 HB3 SER A 32 8.275 -2.366 0.721 1.00 0.00 H new ATOM 0 HG SER A 32 6.010 -1.941 2.335 1.00 0.00 H new ATOM 38 N ASP A 33 6.932 0.635 -1.260 1.00 0.00 N ATOM 39 CA ASP A 33 7.449 1.245 -2.517 1.00 0.00 C ATOM 40 C ASP A 33 7.833 2.714 -2.288 1.00 0.00 C ATOM 41 O ASP A 33 8.048 3.450 -3.231 1.00 0.00 O ATOM 42 CB ASP A 33 6.379 1.171 -3.609 1.00 0.00 C ATOM 43 CG ASP A 33 5.852 -0.261 -3.723 1.00 0.00 C ATOM 44 OD1 ASP A 33 6.634 -1.135 -4.062 1.00 0.00 O ATOM 45 OD2 ASP A 33 4.675 -0.461 -3.470 1.00 0.00 O ATOM 0 H ASP A 33 5.918 0.663 -1.149 1.00 0.00 H new ATOM 0 HA ASP A 33 8.334 0.690 -2.828 1.00 0.00 H new ATOM 0 HB2 ASP A 33 5.560 1.852 -3.375 1.00 0.00 H new ATOM 0 HB3 ASP A 33 6.798 1.491 -4.563 1.00 0.00 H new ATOM 50 N ALA A 34 7.929 3.150 -1.053 1.00 0.00 N ATOM 51 CA ALA A 34 8.312 4.561 -0.782 1.00 0.00 C ATOM 52 C ALA A 34 9.838 4.665 -0.632 1.00 0.00 C ATOM 53 O ALA A 34 10.398 5.744 -0.684 1.00 0.00 O ATOM 54 CB ALA A 34 7.642 5.030 0.510 1.00 0.00 C ATOM 0 H ALA A 34 7.757 2.583 -0.223 1.00 0.00 H new ATOM 0 HA ALA A 34 7.987 5.188 -1.612 1.00 0.00 H new ATOM 0 HB1 ALA A 34 7.922 6.064 0.710 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.559 4.961 0.404 1.00 0.00 H new ATOM 0 HB3 ALA A 34 7.967 4.400 1.338 1.00 0.00 H new ATOM 60 N GLU A 35 10.515 3.554 -0.445 1.00 0.00 N ATOM 61 CA GLU A 35 11.999 3.585 -0.288 1.00 0.00 C ATOM 62 C GLU A 35 12.673 4.227 -1.519 1.00 0.00 C ATOM 63 O GLU A 35 13.564 5.036 -1.353 1.00 0.00 O ATOM 64 CB GLU A 35 12.536 2.159 -0.083 1.00 0.00 C ATOM 65 CG GLU A 35 11.746 1.451 1.029 1.00 0.00 C ATOM 66 CD GLU A 35 12.620 1.312 2.279 1.00 0.00 C ATOM 67 OE1 GLU A 35 13.315 0.315 2.383 1.00 0.00 O ATOM 68 OE2 GLU A 35 12.579 2.205 3.109 1.00 0.00 O ATOM 0 H GLU A 35 10.097 2.625 -0.395 1.00 0.00 H new ATOM 0 HA GLU A 35 12.236 4.190 0.587 1.00 0.00 H new ATOM 0 HB2 GLU A 35 12.456 1.595 -1.012 1.00 0.00 H new ATOM 0 HB3 GLU A 35 13.594 2.195 0.178 1.00 0.00 H new ATOM 0 HG2 GLU A 35 10.845 2.018 1.265 1.00 0.00 H new ATOM 0 HG3 GLU A 35 11.423 0.467 0.688 1.00 0.00 H new ATOM 75 N PRO A 36 12.257 3.867 -2.725 1.00 0.00 N ATOM 76 CA PRO A 36 12.845 4.425 -3.984 1.00 0.00 C ATOM 77 C PRO A 36 12.168 5.748 -4.366 1.00 0.00 C ATOM 78 O PRO A 36 12.822 6.701 -4.737 1.00 0.00 O ATOM 79 CB PRO A 36 12.554 3.346 -5.018 1.00 0.00 C ATOM 80 CG PRO A 36 11.357 2.554 -4.524 1.00 0.00 C ATOM 81 CD PRO A 36 11.161 2.878 -3.042 1.00 0.00 C ATOM 0 HA PRO A 36 13.907 4.652 -3.894 1.00 0.00 H new ATOM 0 HB2 PRO A 36 12.344 3.793 -5.990 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.418 2.695 -5.147 1.00 0.00 H new ATOM 0 HG2 PRO A 36 10.465 2.815 -5.093 1.00 0.00 H new ATOM 0 HG3 PRO A 36 11.522 1.486 -4.663 1.00 0.00 H new ATOM 0 HD2 PRO A 36 10.175 3.304 -2.856 1.00 0.00 H new ATOM 0 HD3 PRO A 36 11.243 1.983 -2.425 1.00 0.00 H new ATOM 89 N HIS A 37 10.856 5.803 -4.284 1.00 0.00 N ATOM 90 CA HIS A 37 10.095 7.049 -4.643 1.00 0.00 C ATOM 91 C HIS A 37 10.013 7.224 -6.170 1.00 0.00 C ATOM 92 O HIS A 37 9.397 8.156 -6.652 1.00 0.00 O ATOM 93 CB HIS A 37 10.749 8.292 -4.018 1.00 0.00 C ATOM 94 CG HIS A 37 9.692 9.317 -3.712 1.00 0.00 C ATOM 95 ND1 HIS A 37 9.164 9.477 -2.440 1.00 0.00 N ATOM 96 CD2 HIS A 37 9.054 10.241 -4.502 1.00 0.00 C ATOM 97 CE1 HIS A 37 8.251 10.465 -2.502 1.00 0.00 C ATOM 98 NE2 HIS A 37 8.146 10.965 -3.735 1.00 0.00 N ATOM 0 H HIS A 37 10.271 5.025 -3.979 1.00 0.00 H new ATOM 0 HA HIS A 37 9.086 6.942 -4.245 1.00 0.00 H new ATOM 0 HB2 HIS A 37 11.278 8.017 -3.106 1.00 0.00 H new ATOM 0 HB3 HIS A 37 11.488 8.710 -4.702 1.00 0.00 H new ATOM 0 HD2 HIS A 37 9.230 10.384 -5.558 1.00 0.00 H new ATOM 0 HE1 HIS A 37 7.674 10.811 -1.657 1.00 0.00 H new ATOM 0 HE2 HIS A 37 7.532 11.717 -4.048 1.00 0.00 H new ATOM 106 N TYR A 38 10.606 6.337 -6.936 1.00 0.00 N ATOM 107 CA TYR A 38 10.537 6.454 -8.424 1.00 0.00 C ATOM 108 C TYR A 38 9.868 5.199 -8.990 1.00 0.00 C ATOM 109 O TYR A 38 9.124 5.261 -9.948 1.00 0.00 O ATOM 110 CB TYR A 38 11.945 6.600 -9.013 1.00 0.00 C ATOM 111 CG TYR A 38 12.868 5.555 -8.428 1.00 0.00 C ATOM 112 CD1 TYR A 38 12.961 4.290 -9.019 1.00 0.00 C ATOM 113 CD2 TYR A 38 13.634 5.857 -7.296 1.00 0.00 C ATOM 114 CE1 TYR A 38 13.819 3.325 -8.476 1.00 0.00 C ATOM 115 CE2 TYR A 38 14.492 4.893 -6.753 1.00 0.00 C ATOM 116 CZ TYR A 38 14.584 3.628 -7.343 1.00 0.00 C ATOM 117 OH TYR A 38 15.430 2.677 -6.809 1.00 0.00 O ATOM 0 H TYR A 38 11.135 5.536 -6.591 1.00 0.00 H new ATOM 0 HA TYR A 38 9.957 7.337 -8.690 1.00 0.00 H new ATOM 0 HB2 TYR A 38 11.906 6.495 -10.097 1.00 0.00 H new ATOM 0 HB3 TYR A 38 12.333 7.597 -8.803 1.00 0.00 H new ATOM 0 HD1 TYR A 38 12.371 4.058 -9.894 1.00 0.00 H new ATOM 0 HD2 TYR A 38 13.563 6.834 -6.841 1.00 0.00 H new ATOM 0 HE1 TYR A 38 13.890 2.348 -8.931 1.00 0.00 H new ATOM 0 HE2 TYR A 38 15.082 5.126 -5.879 1.00 0.00 H new ATOM 0 HH TYR A 38 15.888 3.049 -6.026 1.00 0.00 H new ATOM 127 N LEU A 39 10.124 4.061 -8.392 1.00 0.00 N ATOM 128 CA LEU A 39 9.509 2.784 -8.866 1.00 0.00 C ATOM 129 C LEU A 39 7.979 2.939 -9.037 1.00 0.00 C ATOM 130 O LEU A 39 7.454 2.615 -10.086 1.00 0.00 O ATOM 131 CB LEU A 39 9.806 1.678 -7.840 1.00 0.00 C ATOM 132 CG LEU A 39 10.487 0.478 -8.525 1.00 0.00 C ATOM 133 CD1 LEU A 39 9.640 -0.024 -9.702 1.00 0.00 C ATOM 134 CD2 LEU A 39 11.861 0.907 -9.042 1.00 0.00 C ATOM 0 H LEU A 39 10.741 3.963 -7.586 1.00 0.00 H new ATOM 0 HA LEU A 39 9.935 2.523 -9.835 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.450 2.068 -7.052 1.00 0.00 H new ATOM 0 HB3 LEU A 39 8.879 1.356 -7.365 1.00 0.00 H new ATOM 0 HG LEU A 39 10.592 -0.328 -7.798 1.00 0.00 H new ATOM 0 HD11 LEU A 39 10.138 -0.872 -10.173 1.00 0.00 H new ATOM 0 HD12 LEU A 39 8.660 -0.334 -9.339 1.00 0.00 H new ATOM 0 HD13 LEU A 39 9.520 0.777 -10.431 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.347 0.061 -9.528 1.00 0.00 H new ATOM 0 HD22 LEU A 39 11.742 1.719 -9.760 1.00 0.00 H new ATOM 0 HD23 LEU A 39 12.474 1.247 -8.207 1.00 0.00 H new ATOM 146 N PRO A 40 7.299 3.435 -8.017 1.00 0.00 N ATOM 147 CA PRO A 40 5.814 3.640 -8.062 1.00 0.00 C ATOM 148 C PRO A 40 5.466 4.852 -8.937 1.00 0.00 C ATOM 149 O PRO A 40 4.341 5.009 -9.375 1.00 0.00 O ATOM 150 CB PRO A 40 5.429 3.860 -6.607 1.00 0.00 C ATOM 151 CG PRO A 40 6.668 4.346 -5.888 1.00 0.00 C ATOM 152 CD PRO A 40 7.878 3.872 -6.691 1.00 0.00 C ATOM 0 HA PRO A 40 5.276 2.800 -8.501 1.00 0.00 H new ATOM 0 HB2 PRO A 40 4.625 4.592 -6.528 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.063 2.935 -6.161 1.00 0.00 H new ATOM 0 HG2 PRO A 40 6.663 5.433 -5.807 1.00 0.00 H new ATOM 0 HG3 PRO A 40 6.702 3.951 -4.873 1.00 0.00 H new ATOM 0 HD2 PRO A 40 8.608 4.671 -6.820 1.00 0.00 H new ATOM 0 HD3 PRO A 40 8.390 3.050 -6.191 1.00 0.00 H new ATOM 160 N GLN A 41 6.430 5.697 -9.210 1.00 0.00 N ATOM 161 CA GLN A 41 6.174 6.881 -10.074 1.00 0.00 C ATOM 162 C GLN A 41 6.124 6.407 -11.530 1.00 0.00 C ATOM 163 O GLN A 41 5.382 6.930 -12.344 1.00 0.00 O ATOM 164 CB GLN A 41 7.318 7.891 -9.884 1.00 0.00 C ATOM 165 CG GLN A 41 7.152 9.079 -10.840 1.00 0.00 C ATOM 166 CD GLN A 41 5.878 9.848 -10.486 1.00 0.00 C ATOM 167 OE1 GLN A 41 5.576 10.046 -9.325 1.00 0.00 O ATOM 168 NE2 GLN A 41 5.112 10.293 -11.444 1.00 0.00 N ATOM 0 H GLN A 41 7.387 5.613 -8.867 1.00 0.00 H new ATOM 0 HA GLN A 41 5.231 7.360 -9.811 1.00 0.00 H new ATOM 0 HB2 GLN A 41 7.330 8.245 -8.853 1.00 0.00 H new ATOM 0 HB3 GLN A 41 8.276 7.403 -10.065 1.00 0.00 H new ATOM 0 HG2 GLN A 41 8.018 9.738 -10.771 1.00 0.00 H new ATOM 0 HG3 GLN A 41 7.101 8.726 -11.870 1.00 0.00 H new ATOM 0 HE21 GLN A 41 5.365 10.127 -12.418 1.00 0.00 H new ATOM 0 HE22 GLN A 41 4.260 10.807 -11.219 1.00 0.00 H new ATOM 177 N LEU A 42 6.920 5.424 -11.859 1.00 0.00 N ATOM 178 CA LEU A 42 6.947 4.911 -13.247 1.00 0.00 C ATOM 179 C LEU A 42 5.711 4.052 -13.506 1.00 0.00 C ATOM 180 O LEU A 42 5.084 4.154 -14.543 1.00 0.00 O ATOM 181 CB LEU A 42 8.205 4.053 -13.458 1.00 0.00 C ATOM 182 CG LEU A 42 9.544 4.848 -13.321 1.00 0.00 C ATOM 183 CD1 LEU A 42 9.354 6.324 -12.915 1.00 0.00 C ATOM 184 CD2 LEU A 42 10.427 4.165 -12.272 1.00 0.00 C ATOM 0 H LEU A 42 7.556 4.955 -11.214 1.00 0.00 H new ATOM 0 HA LEU A 42 6.957 5.756 -13.936 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.202 3.238 -12.735 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.162 3.600 -14.449 1.00 0.00 H new ATOM 0 HG LEU A 42 10.007 4.845 -14.308 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.327 6.809 -12.840 1.00 0.00 H new ATOM 0 HD12 LEU A 42 8.751 6.834 -13.667 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.849 6.374 -11.950 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.363 4.714 -12.171 1.00 0.00 H new ATOM 0 HD22 LEU A 42 9.909 4.152 -11.313 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.638 3.142 -12.584 1.00 0.00 H new ATOM 196 N ARG A 43 5.355 3.197 -12.574 1.00 0.00 N ATOM 197 CA ARG A 43 4.158 2.330 -12.776 1.00 0.00 C ATOM 198 C ARG A 43 2.926 3.213 -12.973 1.00 0.00 C ATOM 199 O ARG A 43 2.111 2.971 -13.846 1.00 0.00 O ATOM 200 CB ARG A 43 3.970 1.401 -11.566 1.00 0.00 C ATOM 201 CG ARG A 43 3.590 2.196 -10.313 1.00 0.00 C ATOM 202 CD ARG A 43 3.486 1.243 -9.120 1.00 0.00 C ATOM 203 NE ARG A 43 2.883 1.965 -7.956 1.00 0.00 N ATOM 204 CZ ARG A 43 1.609 2.302 -7.941 1.00 0.00 C ATOM 205 NH1 ARG A 43 0.810 2.019 -8.945 1.00 0.00 N ATOM 206 NH2 ARG A 43 1.129 2.932 -6.903 1.00 0.00 N ATOM 0 H ARG A 43 5.842 3.066 -11.687 1.00 0.00 H new ATOM 0 HA ARG A 43 4.299 1.711 -13.662 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.194 0.667 -11.784 1.00 0.00 H new ATOM 0 HB3 ARG A 43 4.890 0.846 -11.383 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.338 2.964 -10.115 1.00 0.00 H new ATOM 0 HG3 ARG A 43 2.640 2.708 -10.468 1.00 0.00 H new ATOM 0 HD2 ARG A 43 2.874 0.380 -9.383 1.00 0.00 H new ATOM 0 HD3 ARG A 43 4.474 0.865 -8.855 1.00 0.00 H new ATOM 0 HE ARG A 43 3.471 2.201 -7.157 1.00 0.00 H new ATOM 0 HH11 ARG A 43 1.172 1.527 -9.762 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -0.172 2.291 -8.908 1.00 0.00 H new ATOM 0 HH21 ARG A 43 1.738 3.158 -6.117 1.00 0.00 H new ATOM 0 HH22 ARG A 43 0.145 3.199 -6.878 1.00 0.00 H new ATOM 220 N LYS A 44 2.792 4.247 -12.176 1.00 0.00 N ATOM 221 CA LYS A 44 1.630 5.146 -12.335 1.00 0.00 C ATOM 222 C LYS A 44 1.744 5.851 -13.691 1.00 0.00 C ATOM 223 O LYS A 44 0.754 6.177 -14.317 1.00 0.00 O ATOM 224 CB LYS A 44 1.601 6.170 -11.193 1.00 0.00 C ATOM 225 CG LYS A 44 2.851 7.055 -11.233 1.00 0.00 C ATOM 226 CD LYS A 44 2.670 8.235 -10.276 1.00 0.00 C ATOM 227 CE LYS A 44 2.790 7.744 -8.832 1.00 0.00 C ATOM 228 NZ LYS A 44 1.898 8.554 -7.956 1.00 0.00 N ATOM 0 H LYS A 44 3.440 4.498 -11.429 1.00 0.00 H new ATOM 0 HA LYS A 44 0.703 4.574 -12.299 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.707 6.789 -11.274 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.545 5.653 -10.235 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.730 6.475 -10.951 1.00 0.00 H new ATOM 0 HG3 LYS A 44 3.021 7.418 -12.247 1.00 0.00 H new ATOM 0 HD2 LYS A 44 3.423 8.998 -10.476 1.00 0.00 H new ATOM 0 HD3 LYS A 44 1.696 8.699 -10.434 1.00 0.00 H new ATOM 0 HE2 LYS A 44 2.518 6.690 -8.771 1.00 0.00 H new ATOM 0 HE3 LYS A 44 3.823 7.827 -8.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 1.979 8.220 -6.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 2.178 9.554 -8.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 0.913 8.453 -8.275 1.00 0.00 H new ATOM 242 N ASP A 45 2.956 6.072 -14.151 1.00 0.00 N ATOM 243 CA ASP A 45 3.146 6.735 -15.461 1.00 0.00 C ATOM 244 C ASP A 45 2.651 5.802 -16.567 1.00 0.00 C ATOM 245 O ASP A 45 1.943 6.224 -17.458 1.00 0.00 O ATOM 246 CB ASP A 45 4.627 7.049 -15.672 1.00 0.00 C ATOM 247 CG ASP A 45 5.043 8.206 -14.760 1.00 0.00 C ATOM 248 OD1 ASP A 45 4.217 9.070 -14.516 1.00 0.00 O ATOM 249 OD2 ASP A 45 6.182 8.209 -14.323 1.00 0.00 O ATOM 0 H ASP A 45 3.816 5.817 -13.666 1.00 0.00 H new ATOM 0 HA ASP A 45 2.581 7.667 -15.487 1.00 0.00 H new ATOM 0 HB2 ASP A 45 5.230 6.167 -15.455 1.00 0.00 H new ATOM 0 HB3 ASP A 45 4.808 7.311 -16.714 1.00 0.00 H new ATOM 254 N ILE A 46 3.000 4.532 -16.515 1.00 0.00 N ATOM 255 CA ILE A 46 2.521 3.583 -17.569 1.00 0.00 C ATOM 256 C ILE A 46 0.985 3.552 -17.547 1.00 0.00 C ATOM 257 O ILE A 46 0.345 3.349 -18.562 1.00 0.00 O ATOM 258 CB ILE A 46 3.125 2.176 -17.345 1.00 0.00 C ATOM 259 CG1 ILE A 46 2.859 1.320 -18.588 1.00 0.00 C ATOM 260 CG2 ILE A 46 2.534 1.481 -16.107 1.00 0.00 C ATOM 261 CD1 ILE A 46 3.605 -0.010 -18.470 1.00 0.00 C ATOM 0 H ILE A 46 3.591 4.119 -15.793 1.00 0.00 H new ATOM 0 HA ILE A 46 2.851 3.919 -18.552 1.00 0.00 H new ATOM 0 HB ILE A 46 4.196 2.290 -17.175 1.00 0.00 H new ATOM 0 HG12 ILE A 46 1.789 1.139 -18.694 1.00 0.00 H new ATOM 0 HG13 ILE A 46 3.183 1.851 -19.483 1.00 0.00 H new ATOM 0 HG21 ILE A 46 2.988 0.497 -15.991 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.738 2.082 -15.221 1.00 0.00 H new ATOM 0 HG23 ILE A 46 1.457 1.371 -16.231 1.00 0.00 H new ATOM 0 HD11 ILE A 46 3.413 -0.615 -19.356 1.00 0.00 H new ATOM 0 HD12 ILE A 46 4.675 0.179 -18.385 1.00 0.00 H new ATOM 0 HD13 ILE A 46 3.260 -0.544 -17.584 1.00 0.00 H new ATOM 273 N LEU A 47 0.395 3.785 -16.396 1.00 0.00 N ATOM 274 CA LEU A 47 -1.087 3.806 -16.301 1.00 0.00 C ATOM 275 C LEU A 47 -1.592 5.016 -17.083 1.00 0.00 C ATOM 276 O LEU A 47 -2.535 4.930 -17.846 1.00 0.00 O ATOM 277 CB LEU A 47 -1.508 3.933 -14.835 1.00 0.00 C ATOM 278 CG LEU A 47 -1.437 2.569 -14.151 1.00 0.00 C ATOM 279 CD1 LEU A 47 -1.469 2.756 -12.633 1.00 0.00 C ATOM 280 CD2 LEU A 47 -2.636 1.723 -14.584 1.00 0.00 C ATOM 0 H LEU A 47 0.886 3.961 -15.519 1.00 0.00 H new ATOM 0 HA LEU A 47 -1.506 2.886 -16.709 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -0.858 4.641 -14.321 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.522 4.328 -14.772 1.00 0.00 H new ATOM 0 HG LEU A 47 -0.512 2.067 -14.435 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.418 1.782 -12.145 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -0.618 3.362 -12.323 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.394 3.257 -12.348 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.588 0.749 -14.098 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.559 2.227 -14.298 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.616 1.590 -15.666 1.00 0.00 H new ATOM 292 N GLU A 48 -0.943 6.141 -16.909 1.00 0.00 N ATOM 293 CA GLU A 48 -1.353 7.369 -17.650 1.00 0.00 C ATOM 294 C GLU A 48 -0.983 7.164 -19.112 1.00 0.00 C ATOM 295 O GLU A 48 -1.702 7.555 -20.010 1.00 0.00 O ATOM 296 CB GLU A 48 -0.619 8.620 -17.128 1.00 0.00 C ATOM 297 CG GLU A 48 -0.355 8.519 -15.620 1.00 0.00 C ATOM 298 CD GLU A 48 -0.671 9.855 -14.942 1.00 0.00 C ATOM 299 OE1 GLU A 48 -1.670 10.457 -15.301 1.00 0.00 O ATOM 300 OE2 GLU A 48 0.090 10.252 -14.076 1.00 0.00 O ATOM 0 H GLU A 48 -0.146 6.260 -16.284 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.423 7.527 -17.515 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.326 8.738 -17.658 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -1.215 9.508 -17.337 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -0.968 7.728 -15.187 1.00 0.00 H new ATOM 0 HG3 GLU A 48 0.686 8.249 -15.442 1.00 0.00 H new ATOM 307 N VAL A 49 0.139 6.531 -19.349 1.00 0.00 N ATOM 308 CA VAL A 49 0.580 6.266 -20.745 1.00 0.00 C ATOM 309 C VAL A 49 -0.479 5.397 -21.425 1.00 0.00 C ATOM 310 O VAL A 49 -1.054 5.780 -22.421 1.00 0.00 O ATOM 311 CB VAL A 49 1.934 5.547 -20.726 1.00 0.00 C ATOM 312 CG1 VAL A 49 2.408 5.284 -22.161 1.00 0.00 C ATOM 313 CG2 VAL A 49 2.966 6.421 -19.996 1.00 0.00 C ATOM 0 H VAL A 49 0.771 6.185 -18.626 1.00 0.00 H new ATOM 0 HA VAL A 49 0.695 7.200 -21.295 1.00 0.00 H new ATOM 0 HB VAL A 49 1.827 4.595 -20.206 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.371 4.773 -22.138 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.678 4.660 -22.677 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.513 6.232 -22.689 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.929 5.911 -19.982 1.00 0.00 H new ATOM 0 HG22 VAL A 49 3.068 7.374 -20.515 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.634 6.598 -18.973 1.00 0.00 H new ATOM 323 N ILE A 50 -0.780 4.246 -20.866 1.00 0.00 N ATOM 324 CA ILE A 50 -1.845 3.380 -21.465 1.00 0.00 C ATOM 325 C ILE A 50 -3.157 4.178 -21.536 1.00 0.00 C ATOM 326 O ILE A 50 -4.030 3.879 -22.326 1.00 0.00 O ATOM 327 CB ILE A 50 -2.038 2.123 -20.609 1.00 0.00 C ATOM 328 CG1 ILE A 50 -0.705 1.379 -20.486 1.00 0.00 C ATOM 329 CG2 ILE A 50 -3.068 1.204 -21.271 1.00 0.00 C ATOM 330 CD1 ILE A 50 -0.671 0.607 -19.166 1.00 0.00 C ATOM 0 H ILE A 50 -0.337 3.872 -20.027 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.550 3.075 -22.469 1.00 0.00 H new ATOM 0 HB ILE A 50 -2.390 2.412 -19.619 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.581 0.693 -21.324 1.00 0.00 H new ATOM 0 HG13 ILE A 50 0.123 2.086 -20.527 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.204 0.311 -20.661 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.019 1.729 -21.362 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.716 0.917 -22.262 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.278 0.077 -19.079 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -0.776 1.304 -18.334 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.491 -0.111 -19.143 1.00 0.00 H new ATOM 342 N CYS A 51 -3.287 5.202 -20.723 1.00 0.00 N ATOM 343 CA CYS A 51 -4.514 6.034 -20.747 1.00 0.00 C ATOM 344 C CYS A 51 -4.478 6.950 -21.976 1.00 0.00 C ATOM 345 O CYS A 51 -5.447 7.077 -22.694 1.00 0.00 O ATOM 346 CB CYS A 51 -4.574 6.882 -19.472 1.00 0.00 C ATOM 347 SG CYS A 51 -6.257 7.509 -19.244 1.00 0.00 S ATOM 0 H CYS A 51 -2.585 5.492 -20.042 1.00 0.00 H new ATOM 0 HA CYS A 51 -5.395 5.394 -20.798 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -4.277 6.284 -18.610 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -3.871 7.712 -19.541 1.00 0.00 H new ATOM 0 HG CYS A 51 -6.310 8.227 -18.162 1.00 0.00 H new ATOM 353 N LYS A 52 -3.361 7.586 -22.227 1.00 0.00 N ATOM 354 CA LYS A 52 -3.256 8.498 -23.411 1.00 0.00 C ATOM 355 C LYS A 52 -3.546 7.720 -24.697 1.00 0.00 C ATOM 356 O LYS A 52 -4.046 8.264 -25.664 1.00 0.00 O ATOM 357 CB LYS A 52 -1.843 9.082 -23.513 1.00 0.00 C ATOM 358 CG LYS A 52 -1.441 9.752 -22.197 1.00 0.00 C ATOM 359 CD LYS A 52 0.066 9.564 -21.978 1.00 0.00 C ATOM 360 CE LYS A 52 0.810 10.827 -22.418 1.00 0.00 C ATOM 361 NZ LYS A 52 0.688 11.869 -21.359 1.00 0.00 N ATOM 0 H LYS A 52 -2.515 7.514 -21.663 1.00 0.00 H new ATOM 0 HA LYS A 52 -3.980 9.302 -23.284 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.133 8.291 -23.756 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -1.802 9.808 -24.325 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.687 10.813 -22.225 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.999 9.317 -21.368 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.268 9.358 -20.927 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.422 8.704 -22.545 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.860 10.599 -22.600 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.397 11.197 -23.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 0.864 12.807 -21.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.270 11.843 -20.955 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.385 11.685 -20.609 1.00 0.00 H new ATOM 375 N TYR A 53 -3.214 6.458 -24.716 1.00 0.00 N ATOM 376 CA TYR A 53 -3.438 5.632 -25.928 1.00 0.00 C ATOM 377 C TYR A 53 -4.691 4.755 -25.746 1.00 0.00 C ATOM 378 O TYR A 53 -5.208 4.207 -26.701 1.00 0.00 O ATOM 379 CB TYR A 53 -2.224 4.720 -26.140 1.00 0.00 C ATOM 380 CG TYR A 53 -0.955 5.523 -26.376 1.00 0.00 C ATOM 381 CD1 TYR A 53 -0.444 6.362 -25.375 1.00 0.00 C ATOM 382 CD2 TYR A 53 -0.268 5.398 -27.590 1.00 0.00 C ATOM 383 CE1 TYR A 53 0.742 7.069 -25.583 1.00 0.00 C ATOM 384 CE2 TYR A 53 0.921 6.113 -27.799 1.00 0.00 C ATOM 385 CZ TYR A 53 1.426 6.946 -26.791 1.00 0.00 C ATOM 386 OH TYR A 53 2.598 7.644 -26.996 1.00 0.00 O ATOM 0 H TYR A 53 -2.792 5.961 -23.931 1.00 0.00 H new ATOM 0 HA TYR A 53 -3.577 6.287 -26.788 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -2.093 4.079 -25.268 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.405 4.065 -26.992 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -0.971 6.462 -24.438 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -0.653 4.752 -28.365 1.00 0.00 H new ATOM 0 HE1 TYR A 53 1.130 7.712 -24.807 1.00 0.00 H new ATOM 0 HE2 TYR A 53 1.448 6.021 -28.737 1.00 0.00 H new ATOM 0 HH TYR A 53 2.946 7.444 -27.890 1.00 0.00 H new ATOM 396 N VAL A 54 -5.172 4.601 -24.530 1.00 0.00 N ATOM 397 CA VAL A 54 -6.379 3.739 -24.290 1.00 0.00 C ATOM 398 C VAL A 54 -7.129 4.293 -23.055 1.00 0.00 C ATOM 399 O VAL A 54 -7.267 5.492 -22.921 1.00 0.00 O ATOM 400 CB VAL A 54 -5.952 2.267 -24.068 1.00 0.00 C ATOM 401 CG1 VAL A 54 -7.130 1.346 -24.400 1.00 0.00 C ATOM 402 CG2 VAL A 54 -4.772 1.892 -24.974 1.00 0.00 C ATOM 0 H VAL A 54 -4.780 5.035 -23.694 1.00 0.00 H new ATOM 0 HA VAL A 54 -7.039 3.760 -25.157 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.650 2.152 -23.027 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -6.835 0.308 -24.246 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -7.972 1.584 -23.751 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -7.422 1.489 -25.440 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -4.493 0.853 -24.797 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.060 2.018 -26.018 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -3.923 2.538 -24.752 1.00 0.00 H new ATOM 412 N GLN A 55 -7.619 3.459 -22.155 1.00 0.00 N ATOM 413 CA GLN A 55 -8.339 3.994 -20.961 1.00 0.00 C ATOM 414 C GLN A 55 -8.660 2.851 -19.995 1.00 0.00 C ATOM 415 O GLN A 55 -9.513 2.023 -20.251 1.00 0.00 O ATOM 416 CB GLN A 55 -9.634 4.680 -21.405 1.00 0.00 C ATOM 417 CG GLN A 55 -9.531 6.189 -21.166 1.00 0.00 C ATOM 418 CD GLN A 55 -10.506 6.922 -22.090 1.00 0.00 C ATOM 419 OE1 GLN A 55 -10.236 7.099 -23.260 1.00 0.00 O ATOM 420 NE2 GLN A 55 -11.639 7.356 -21.608 1.00 0.00 N ATOM 0 H GLN A 55 -7.548 2.443 -22.202 1.00 0.00 H new ATOM 0 HA GLN A 55 -7.705 4.721 -20.454 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -9.818 4.482 -22.461 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -10.480 4.272 -20.852 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -9.758 6.419 -20.125 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -8.512 6.528 -21.353 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -11.865 7.207 -20.625 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -12.298 7.844 -22.215 1.00 0.00 H new ATOM 429 N ILE A 56 -7.977 2.815 -18.884 1.00 0.00 N ATOM 430 CA ILE A 56 -8.217 1.743 -17.871 1.00 0.00 C ATOM 431 C ILE A 56 -8.135 2.354 -16.474 1.00 0.00 C ATOM 432 O ILE A 56 -7.692 3.475 -16.306 1.00 0.00 O ATOM 433 CB ILE A 56 -7.159 0.639 -17.999 1.00 0.00 C ATOM 434 CG1 ILE A 56 -5.781 1.254 -18.288 1.00 0.00 C ATOM 435 CG2 ILE A 56 -7.545 -0.306 -19.135 1.00 0.00 C ATOM 436 CD1 ILE A 56 -4.709 0.508 -17.492 1.00 0.00 C ATOM 0 H ILE A 56 -7.255 3.489 -18.630 1.00 0.00 H new ATOM 0 HA ILE A 56 -9.203 1.309 -18.038 1.00 0.00 H new ATOM 0 HB ILE A 56 -7.109 0.085 -17.061 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.562 1.197 -19.354 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -5.779 2.310 -18.019 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.794 -1.091 -19.227 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -8.515 -0.755 -18.921 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -7.602 0.252 -20.069 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -3.732 0.946 -17.698 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -4.925 0.588 -16.427 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -4.705 -0.542 -17.783 1.00 0.00 H new ATOM 448 N ASP A 57 -8.550 1.624 -15.473 1.00 0.00 N ATOM 449 CA ASP A 57 -8.488 2.155 -14.081 1.00 0.00 C ATOM 450 C ASP A 57 -7.255 1.568 -13.380 1.00 0.00 C ATOM 451 O ASP A 57 -6.707 0.587 -13.841 1.00 0.00 O ATOM 452 CB ASP A 57 -9.753 1.749 -13.322 1.00 0.00 C ATOM 453 CG ASP A 57 -10.861 2.769 -13.592 1.00 0.00 C ATOM 454 OD1 ASP A 57 -11.375 2.778 -14.698 1.00 0.00 O ATOM 455 OD2 ASP A 57 -11.176 3.525 -12.688 1.00 0.00 O ATOM 0 H ASP A 57 -8.930 0.681 -15.560 1.00 0.00 H new ATOM 0 HA ASP A 57 -8.417 3.243 -14.102 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -10.075 0.756 -13.635 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -9.547 1.695 -12.253 1.00 0.00 H new ATOM 460 N PRO A 58 -6.847 2.170 -12.280 1.00 0.00 N ATOM 461 CA PRO A 58 -5.662 1.699 -11.495 1.00 0.00 C ATOM 462 C PRO A 58 -6.024 0.426 -10.735 1.00 0.00 C ATOM 463 O PRO A 58 -5.190 -0.431 -10.512 1.00 0.00 O ATOM 464 CB PRO A 58 -5.357 2.856 -10.557 1.00 0.00 C ATOM 465 CG PRO A 58 -6.641 3.648 -10.402 1.00 0.00 C ATOM 466 CD PRO A 58 -7.489 3.381 -11.647 1.00 0.00 C ATOM 0 HA PRO A 58 -4.799 1.447 -12.111 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -5.011 2.489 -9.591 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -4.563 3.483 -10.963 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -7.174 3.345 -9.501 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -6.427 4.712 -10.303 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -8.530 3.189 -11.386 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -7.482 4.235 -12.324 1.00 0.00 H new ATOM 474 N GLU A 59 -7.272 0.282 -10.374 1.00 0.00 N ATOM 475 CA GLU A 59 -7.709 -0.955 -9.668 1.00 0.00 C ATOM 476 C GLU A 59 -7.666 -2.139 -10.652 1.00 0.00 C ATOM 477 O GLU A 59 -7.766 -3.283 -10.252 1.00 0.00 O ATOM 478 CB GLU A 59 -9.136 -0.769 -9.149 1.00 0.00 C ATOM 479 CG GLU A 59 -9.174 0.403 -8.168 1.00 0.00 C ATOM 480 CD GLU A 59 -8.847 -0.097 -6.760 1.00 0.00 C ATOM 481 OE1 GLU A 59 -7.803 -0.707 -6.597 1.00 0.00 O ATOM 482 OE2 GLU A 59 -9.646 0.139 -5.869 1.00 0.00 O ATOM 0 H GLU A 59 -8.007 0.969 -10.539 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.044 -1.154 -8.827 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -9.815 -0.583 -9.981 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.477 -1.680 -8.657 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.457 1.166 -8.470 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -10.159 0.869 -8.180 1.00 0.00 H new ATOM 489 N MET A 60 -7.514 -1.873 -11.935 1.00 0.00 N ATOM 490 CA MET A 60 -7.459 -2.974 -12.934 1.00 0.00 C ATOM 491 C MET A 60 -6.005 -3.428 -13.118 1.00 0.00 C ATOM 492 O MET A 60 -5.745 -4.530 -13.564 1.00 0.00 O ATOM 493 CB MET A 60 -8.004 -2.461 -14.272 1.00 0.00 C ATOM 494 CG MET A 60 -9.539 -2.467 -14.244 1.00 0.00 C ATOM 495 SD MET A 60 -10.171 -3.891 -15.171 1.00 0.00 S ATOM 496 CE MET A 60 -10.072 -3.146 -16.817 1.00 0.00 C ATOM 0 H MET A 60 -7.426 -0.934 -12.324 1.00 0.00 H new ATOM 0 HA MET A 60 -8.059 -3.815 -12.587 1.00 0.00 H new ATOM 0 HB2 MET A 60 -7.638 -1.452 -14.461 1.00 0.00 H new ATOM 0 HB3 MET A 60 -7.643 -3.089 -15.087 1.00 0.00 H new ATOM 0 HG2 MET A 60 -9.892 -2.508 -13.214 1.00 0.00 H new ATOM 0 HG3 MET A 60 -9.922 -1.542 -14.676 1.00 0.00 H new ATOM 0 HE1 MET A 60 -10.052 -3.932 -17.572 1.00 0.00 H new ATOM 0 HE2 MET A 60 -10.940 -2.508 -16.980 1.00 0.00 H new ATOM 0 HE3 MET A 60 -9.163 -2.548 -16.892 1.00 0.00 H new ATOM 506 N VAL A 61 -5.055 -2.584 -12.783 1.00 0.00 N ATOM 507 CA VAL A 61 -3.622 -2.958 -12.944 1.00 0.00 C ATOM 508 C VAL A 61 -3.059 -3.448 -11.604 1.00 0.00 C ATOM 509 O VAL A 61 -3.293 -2.852 -10.570 1.00 0.00 O ATOM 510 CB VAL A 61 -2.837 -1.730 -13.417 1.00 0.00 C ATOM 511 CG1 VAL A 61 -1.377 -2.108 -13.681 1.00 0.00 C ATOM 512 CG2 VAL A 61 -3.466 -1.197 -14.709 1.00 0.00 C ATOM 0 H VAL A 61 -5.217 -1.651 -12.404 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.532 -3.758 -13.679 1.00 0.00 H new ATOM 0 HB VAL A 61 -2.871 -0.963 -12.643 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -0.828 -1.228 -14.017 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -0.928 -2.488 -12.763 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -1.334 -2.878 -14.451 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -2.911 -0.323 -15.050 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.432 -1.970 -15.476 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.503 -0.918 -14.521 1.00 0.00 H new ATOM 522 N THR A 62 -2.315 -4.527 -11.621 1.00 0.00 N ATOM 523 CA THR A 62 -1.728 -5.061 -10.363 1.00 0.00 C ATOM 524 C THR A 62 -0.239 -4.711 -10.310 1.00 0.00 C ATOM 525 O THR A 62 0.379 -4.452 -11.325 1.00 0.00 O ATOM 526 CB THR A 62 -1.890 -6.584 -10.319 1.00 0.00 C ATOM 527 OG1 THR A 62 -3.164 -6.938 -10.837 1.00 0.00 O ATOM 528 CG2 THR A 62 -1.777 -7.066 -8.871 1.00 0.00 C ATOM 0 H THR A 62 -2.090 -5.061 -12.461 1.00 0.00 H new ATOM 0 HA THR A 62 -2.243 -4.618 -9.510 1.00 0.00 H new ATOM 0 HB THR A 62 -1.110 -7.051 -10.920 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.268 -7.912 -10.811 1.00 0.00 H new ATOM 0 HG21 THR A 62 -1.892 -8.149 -8.838 1.00 0.00 H new ATOM 0 HG22 THR A 62 -0.800 -6.793 -8.472 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.558 -6.600 -8.270 1.00 0.00 H new ATOM 536 N VAL A 63 0.338 -4.706 -9.136 1.00 0.00 N ATOM 537 CA VAL A 63 1.787 -4.378 -9.008 1.00 0.00 C ATOM 538 C VAL A 63 2.404 -5.258 -7.921 1.00 0.00 C ATOM 539 O VAL A 63 2.020 -5.192 -6.768 1.00 0.00 O ATOM 540 CB VAL A 63 1.944 -2.909 -8.621 1.00 0.00 C ATOM 541 CG1 VAL A 63 3.424 -2.523 -8.650 1.00 0.00 C ATOM 542 CG2 VAL A 63 1.176 -2.039 -9.614 1.00 0.00 C ATOM 0 H VAL A 63 -0.136 -4.916 -8.257 1.00 0.00 H new ATOM 0 HA VAL A 63 2.290 -4.558 -9.958 1.00 0.00 H new ATOM 0 HB VAL A 63 1.550 -2.757 -7.616 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.532 -1.474 -8.373 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.976 -3.143 -7.944 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.820 -2.676 -9.654 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.286 -0.990 -9.340 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.572 -2.196 -10.617 1.00 0.00 H new ATOM 0 HG23 VAL A 63 0.120 -2.310 -9.594 1.00 0.00 H new ATOM 552 N GLN A 64 3.352 -6.085 -8.281 1.00 0.00 N ATOM 553 CA GLN A 64 3.991 -6.976 -7.273 1.00 0.00 C ATOM 554 C GLN A 64 5.514 -6.901 -7.417 1.00 0.00 C ATOM 555 O GLN A 64 6.036 -6.832 -8.512 1.00 0.00 O ATOM 556 CB GLN A 64 3.517 -8.416 -7.501 1.00 0.00 C ATOM 557 CG GLN A 64 3.769 -8.826 -8.959 1.00 0.00 C ATOM 558 CD GLN A 64 2.454 -8.777 -9.741 1.00 0.00 C ATOM 559 OE1 GLN A 64 1.956 -7.714 -10.051 1.00 0.00 O ATOM 560 NE2 GLN A 64 1.864 -9.894 -10.072 1.00 0.00 N ATOM 0 H GLN A 64 3.710 -6.180 -9.231 1.00 0.00 H new ATOM 0 HA GLN A 64 3.711 -6.657 -6.269 1.00 0.00 H new ATOM 0 HB2 GLN A 64 4.044 -9.092 -6.828 1.00 0.00 H new ATOM 0 HB3 GLN A 64 2.455 -8.499 -7.269 1.00 0.00 H new ATOM 0 HG2 GLN A 64 4.500 -8.157 -9.414 1.00 0.00 H new ATOM 0 HG3 GLN A 64 4.189 -9.831 -8.997 1.00 0.00 H new ATOM 0 HE21 GLN A 64 2.281 -10.788 -9.812 1.00 0.00 H new ATOM 0 HE22 GLN A 64 0.986 -9.873 -10.590 1.00 0.00 H new ATOM 569 N LEU A 65 6.231 -6.903 -6.319 1.00 0.00 N ATOM 570 CA LEU A 65 7.713 -6.823 -6.389 1.00 0.00 C ATOM 571 C LEU A 65 8.334 -8.131 -5.897 1.00 0.00 C ATOM 572 O LEU A 65 7.764 -8.836 -5.088 1.00 0.00 O ATOM 573 CB LEU A 65 8.198 -5.671 -5.511 1.00 0.00 C ATOM 574 CG LEU A 65 7.599 -5.795 -4.105 1.00 0.00 C ATOM 575 CD1 LEU A 65 8.660 -5.429 -3.064 1.00 0.00 C ATOM 576 CD2 LEU A 65 6.408 -4.842 -3.971 1.00 0.00 C ATOM 0 H LEU A 65 5.846 -6.957 -5.376 1.00 0.00 H new ATOM 0 HA LEU A 65 8.013 -6.653 -7.423 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.286 -5.680 -5.454 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.910 -4.718 -5.955 1.00 0.00 H new ATOM 0 HG LEU A 65 7.266 -6.820 -3.942 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.235 -5.517 -2.064 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.510 -6.105 -3.157 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.992 -4.404 -3.228 1.00 0.00 H new ATOM 0 HD21 LEU A 65 5.982 -4.930 -2.972 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.742 -3.817 -4.134 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.651 -5.099 -4.712 1.00 0.00 H new ATOM 588 N GLU A 66 9.507 -8.449 -6.382 1.00 0.00 N ATOM 589 CA GLU A 66 10.190 -9.703 -5.954 1.00 0.00 C ATOM 590 C GLU A 66 11.692 -9.442 -5.837 1.00 0.00 C ATOM 591 O GLU A 66 12.166 -8.370 -6.159 1.00 0.00 O ATOM 592 CB GLU A 66 9.936 -10.808 -6.988 1.00 0.00 C ATOM 593 CG GLU A 66 8.470 -11.237 -6.941 1.00 0.00 C ATOM 594 CD GLU A 66 8.156 -11.863 -5.580 1.00 0.00 C ATOM 595 OE1 GLU A 66 8.709 -12.911 -5.290 1.00 0.00 O ATOM 596 OE2 GLU A 66 7.368 -11.283 -4.851 1.00 0.00 O ATOM 0 H GLU A 66 10.023 -7.889 -7.061 1.00 0.00 H new ATOM 0 HA GLU A 66 9.798 -10.022 -4.988 1.00 0.00 H new ATOM 0 HB2 GLU A 66 10.187 -10.449 -7.986 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.581 -11.663 -6.785 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.824 -10.376 -7.113 1.00 0.00 H new ATOM 0 HG3 GLU A 66 8.266 -11.953 -7.737 1.00 0.00 H new ATOM 603 N GLN A 67 12.440 -10.408 -5.371 1.00 0.00 N ATOM 604 CA GLN A 67 13.913 -10.218 -5.225 1.00 0.00 C ATOM 605 C GLN A 67 14.630 -11.534 -5.537 1.00 0.00 C ATOM 606 O GLN A 67 14.045 -12.598 -5.465 1.00 0.00 O ATOM 607 CB GLN A 67 14.233 -9.794 -3.789 1.00 0.00 C ATOM 608 CG GLN A 67 14.157 -8.271 -3.673 1.00 0.00 C ATOM 609 CD GLN A 67 13.665 -7.889 -2.276 1.00 0.00 C ATOM 610 OE1 GLN A 67 14.272 -8.247 -1.285 1.00 0.00 O ATOM 611 NE2 GLN A 67 12.582 -7.172 -2.152 1.00 0.00 N ATOM 0 H GLN A 67 12.092 -11.323 -5.084 1.00 0.00 H new ATOM 0 HA GLN A 67 14.250 -9.446 -5.917 1.00 0.00 H new ATOM 0 HB2 GLN A 67 13.529 -10.257 -3.097 1.00 0.00 H new ATOM 0 HB3 GLN A 67 15.228 -10.141 -3.510 1.00 0.00 H new ATOM 0 HG2 GLN A 67 15.138 -7.832 -3.857 1.00 0.00 H new ATOM 0 HG3 GLN A 67 13.482 -7.871 -4.430 1.00 0.00 H new ATOM 0 HE21 GLN A 67 12.072 -6.871 -2.982 1.00 0.00 H new ATOM 0 HE22 GLN A 67 12.246 -6.912 -1.225 1.00 0.00 H new ATOM 620 N LYS A 68 15.893 -11.467 -5.876 1.00 0.00 N ATOM 621 CA LYS A 68 16.654 -12.712 -6.190 1.00 0.00 C ATOM 622 C LYS A 68 17.808 -12.871 -5.196 1.00 0.00 C ATOM 623 O LYS A 68 18.141 -11.955 -4.469 1.00 0.00 O ATOM 624 CB LYS A 68 17.208 -12.629 -7.614 1.00 0.00 C ATOM 625 CG LYS A 68 16.048 -12.617 -8.622 1.00 0.00 C ATOM 626 CD LYS A 68 16.245 -11.480 -9.629 1.00 0.00 C ATOM 627 CE LYS A 68 17.496 -11.751 -10.466 1.00 0.00 C ATOM 628 NZ LYS A 68 17.168 -12.720 -11.550 1.00 0.00 N ATOM 0 H LYS A 68 16.429 -10.602 -5.949 1.00 0.00 H new ATOM 0 HA LYS A 68 15.990 -13.573 -6.112 1.00 0.00 H new ATOM 0 HB2 LYS A 68 17.811 -11.728 -7.728 1.00 0.00 H new ATOM 0 HB3 LYS A 68 17.863 -13.478 -7.809 1.00 0.00 H new ATOM 0 HG2 LYS A 68 15.998 -13.573 -9.144 1.00 0.00 H new ATOM 0 HG3 LYS A 68 15.101 -12.491 -8.098 1.00 0.00 H new ATOM 0 HD2 LYS A 68 15.372 -11.398 -10.276 1.00 0.00 H new ATOM 0 HD3 LYS A 68 16.344 -10.529 -9.105 1.00 0.00 H new ATOM 0 HE2 LYS A 68 17.868 -10.821 -10.895 1.00 0.00 H new ATOM 0 HE3 LYS A 68 18.290 -12.150 -9.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 18.018 -12.905 -12.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 16.833 -13.610 -11.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 16.424 -12.322 -12.158 1.00 0.00 H new ATOM 642 N ASP A 69 18.411 -14.032 -5.156 1.00 0.00 N ATOM 643 CA ASP A 69 19.536 -14.269 -4.208 1.00 0.00 C ATOM 644 C ASP A 69 20.822 -13.584 -4.700 1.00 0.00 C ATOM 645 O ASP A 69 21.831 -13.606 -4.020 1.00 0.00 O ATOM 646 CB ASP A 69 19.782 -15.773 -4.080 1.00 0.00 C ATOM 647 CG ASP A 69 18.512 -16.455 -3.567 1.00 0.00 C ATOM 648 OD1 ASP A 69 17.856 -15.879 -2.716 1.00 0.00 O ATOM 649 OD2 ASP A 69 18.216 -17.542 -4.036 1.00 0.00 O ATOM 0 H ASP A 69 18.169 -14.830 -5.744 1.00 0.00 H new ATOM 0 HA ASP A 69 19.267 -13.848 -3.239 1.00 0.00 H new ATOM 0 HB2 ASP A 69 20.066 -16.189 -5.046 1.00 0.00 H new ATOM 0 HB3 ASP A 69 20.610 -15.960 -3.396 1.00 0.00 H new ATOM 654 N GLY A 70 20.804 -12.981 -5.867 1.00 0.00 N ATOM 655 CA GLY A 70 22.034 -12.307 -6.383 1.00 0.00 C ATOM 656 C GLY A 70 21.965 -10.806 -6.093 1.00 0.00 C ATOM 657 O GLY A 70 22.466 -9.997 -6.850 1.00 0.00 O ATOM 0 H GLY A 70 19.991 -12.928 -6.481 1.00 0.00 H new ATOM 0 HA2 GLY A 70 22.919 -12.737 -5.914 1.00 0.00 H new ATOM 0 HA3 GLY A 70 22.129 -12.475 -7.456 1.00 0.00 H new ATOM 661 N ASP A 71 21.337 -10.431 -5.004 1.00 0.00 N ATOM 662 CA ASP A 71 21.219 -8.982 -4.650 1.00 0.00 C ATOM 663 C ASP A 71 20.498 -8.246 -5.780 1.00 0.00 C ATOM 664 O ASP A 71 20.926 -7.201 -6.235 1.00 0.00 O ATOM 665 CB ASP A 71 22.614 -8.382 -4.444 1.00 0.00 C ATOM 666 CG ASP A 71 23.127 -8.749 -3.050 1.00 0.00 C ATOM 667 OD1 ASP A 71 22.631 -8.184 -2.090 1.00 0.00 O ATOM 668 OD2 ASP A 71 24.007 -9.590 -2.967 1.00 0.00 O ATOM 0 H ASP A 71 20.899 -11.071 -4.342 1.00 0.00 H new ATOM 0 HA ASP A 71 20.650 -8.877 -3.726 1.00 0.00 H new ATOM 0 HB2 ASP A 71 23.298 -8.756 -5.205 1.00 0.00 H new ATOM 0 HB3 ASP A 71 22.575 -7.298 -4.555 1.00 0.00 H new ATOM 673 N ILE A 72 19.412 -8.803 -6.244 1.00 0.00 N ATOM 674 CA ILE A 72 18.655 -8.167 -7.359 1.00 0.00 C ATOM 675 C ILE A 72 17.189 -7.996 -6.954 1.00 0.00 C ATOM 676 O ILE A 72 16.706 -8.647 -6.048 1.00 0.00 O ATOM 677 CB ILE A 72 18.747 -9.059 -8.600 1.00 0.00 C ATOM 678 CG1 ILE A 72 20.224 -9.455 -8.825 1.00 0.00 C ATOM 679 CG2 ILE A 72 18.197 -8.284 -9.803 1.00 0.00 C ATOM 680 CD1 ILE A 72 20.417 -10.140 -10.186 1.00 0.00 C ATOM 0 H ILE A 72 19.015 -9.676 -5.896 1.00 0.00 H new ATOM 0 HA ILE A 72 19.080 -7.188 -7.580 1.00 0.00 H new ATOM 0 HB ILE A 72 18.160 -9.968 -8.469 1.00 0.00 H new ATOM 0 HG12 ILE A 72 20.853 -8.567 -8.770 1.00 0.00 H new ATOM 0 HG13 ILE A 72 20.548 -10.125 -8.029 1.00 0.00 H new ATOM 0 HG21 ILE A 72 18.256 -8.907 -10.695 1.00 0.00 H new ATOM 0 HG22 ILE A 72 17.157 -8.014 -9.617 1.00 0.00 H new ATOM 0 HG23 ILE A 72 18.786 -7.379 -9.953 1.00 0.00 H new ATOM 0 HD11 ILE A 72 21.466 -10.406 -10.314 1.00 0.00 H new ATOM 0 HD12 ILE A 72 19.806 -11.042 -10.229 1.00 0.00 H new ATOM 0 HD13 ILE A 72 20.116 -9.459 -10.982 1.00 0.00 H new ATOM 692 N SER A 73 16.484 -7.121 -7.624 1.00 0.00 N ATOM 693 CA SER A 73 15.048 -6.893 -7.291 1.00 0.00 C ATOM 694 C SER A 73 14.203 -7.053 -8.552 1.00 0.00 C ATOM 695 O SER A 73 14.712 -7.082 -9.655 1.00 0.00 O ATOM 696 CB SER A 73 14.870 -5.482 -6.730 1.00 0.00 C ATOM 697 OG SER A 73 15.841 -5.253 -5.718 1.00 0.00 O ATOM 0 H SER A 73 16.844 -6.553 -8.391 1.00 0.00 H new ATOM 0 HA SER A 73 14.728 -7.620 -6.545 1.00 0.00 H new ATOM 0 HB2 SER A 73 14.977 -4.745 -7.526 1.00 0.00 H new ATOM 0 HB3 SER A 73 13.867 -5.365 -6.321 1.00 0.00 H new ATOM 0 HG SER A 73 15.731 -4.348 -5.357 1.00 0.00 H new ATOM 703 N ILE A 74 12.915 -7.168 -8.385 1.00 0.00 N ATOM 704 CA ILE A 74 12.010 -7.344 -9.552 1.00 0.00 C ATOM 705 C ILE A 74 10.706 -6.586 -9.286 1.00 0.00 C ATOM 706 O ILE A 74 10.407 -6.230 -8.162 1.00 0.00 O ATOM 707 CB ILE A 74 11.710 -8.838 -9.718 1.00 0.00 C ATOM 708 CG1 ILE A 74 13.020 -9.605 -9.941 1.00 0.00 C ATOM 709 CG2 ILE A 74 10.768 -9.065 -10.907 1.00 0.00 C ATOM 710 CD1 ILE A 74 12.736 -11.109 -10.013 1.00 0.00 C ATOM 0 H ILE A 74 12.447 -7.147 -7.479 1.00 0.00 H new ATOM 0 HA ILE A 74 12.478 -6.959 -10.458 1.00 0.00 H new ATOM 0 HB ILE A 74 11.225 -9.202 -8.813 1.00 0.00 H new ATOM 0 HG12 ILE A 74 13.495 -9.271 -10.863 1.00 0.00 H new ATOM 0 HG13 ILE A 74 13.717 -9.396 -9.130 1.00 0.00 H new ATOM 0 HG21 ILE A 74 10.565 -10.131 -11.012 1.00 0.00 H new ATOM 0 HG22 ILE A 74 9.833 -8.532 -10.737 1.00 0.00 H new ATOM 0 HG23 ILE A 74 11.237 -8.694 -11.818 1.00 0.00 H new ATOM 0 HD11 ILE A 74 13.670 -11.648 -10.171 1.00 0.00 H new ATOM 0 HD12 ILE A 74 12.281 -11.438 -9.079 1.00 0.00 H new ATOM 0 HD13 ILE A 74 12.055 -11.312 -10.840 1.00 0.00 H new ATOM 722 N LEU A 75 9.927 -6.353 -10.309 1.00 0.00 N ATOM 723 CA LEU A 75 8.639 -5.638 -10.123 1.00 0.00 C ATOM 724 C LEU A 75 7.697 -5.983 -11.274 1.00 0.00 C ATOM 725 O LEU A 75 7.770 -5.413 -12.344 1.00 0.00 O ATOM 726 CB LEU A 75 8.880 -4.127 -10.075 1.00 0.00 C ATOM 727 CG LEU A 75 7.564 -3.403 -9.739 1.00 0.00 C ATOM 728 CD1 LEU A 75 7.805 -2.384 -8.620 1.00 0.00 C ATOM 729 CD2 LEU A 75 7.041 -2.678 -10.984 1.00 0.00 C ATOM 0 H LEU A 75 10.132 -6.630 -11.269 1.00 0.00 H new ATOM 0 HA LEU A 75 8.186 -5.948 -9.181 1.00 0.00 H new ATOM 0 HB2 LEU A 75 9.637 -3.893 -9.326 1.00 0.00 H new ATOM 0 HB3 LEU A 75 9.263 -3.779 -11.034 1.00 0.00 H new ATOM 0 HG LEU A 75 6.827 -4.136 -9.409 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.871 -1.874 -8.385 1.00 0.00 H new ATOM 0 HD12 LEU A 75 8.170 -2.899 -7.732 1.00 0.00 H new ATOM 0 HD13 LEU A 75 8.545 -1.654 -8.946 1.00 0.00 H new ATOM 0 HD21 LEU A 75 6.109 -2.167 -10.743 1.00 0.00 H new ATOM 0 HD22 LEU A 75 7.779 -1.949 -11.317 1.00 0.00 H new ATOM 0 HD23 LEU A 75 6.862 -3.402 -11.779 1.00 0.00 H new ATOM 741 N GLU A 76 6.814 -6.919 -11.051 1.00 0.00 N ATOM 742 CA GLU A 76 5.854 -7.325 -12.115 1.00 0.00 C ATOM 743 C GLU A 76 4.539 -6.572 -11.917 1.00 0.00 C ATOM 744 O GLU A 76 4.002 -6.533 -10.829 1.00 0.00 O ATOM 745 CB GLU A 76 5.582 -8.831 -12.013 1.00 0.00 C ATOM 746 CG GLU A 76 6.904 -9.602 -11.940 1.00 0.00 C ATOM 747 CD GLU A 76 6.619 -11.102 -11.863 1.00 0.00 C ATOM 748 OE1 GLU A 76 5.655 -11.469 -11.211 1.00 0.00 O ATOM 749 OE2 GLU A 76 7.369 -11.859 -12.457 1.00 0.00 O ATOM 0 H GLU A 76 6.717 -7.423 -10.170 1.00 0.00 H new ATOM 0 HA GLU A 76 6.276 -7.092 -13.093 1.00 0.00 H new ATOM 0 HB2 GLU A 76 4.981 -9.041 -11.128 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.006 -9.163 -12.876 1.00 0.00 H new ATOM 0 HG2 GLU A 76 7.514 -9.382 -12.816 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.474 -9.285 -11.067 1.00 0.00 H new ATOM 756 N LEU A 77 4.007 -5.991 -12.959 1.00 0.00 N ATOM 757 CA LEU A 77 2.714 -5.264 -12.823 1.00 0.00 C ATOM 758 C LEU A 77 1.712 -5.858 -13.811 1.00 0.00 C ATOM 759 O LEU A 77 1.980 -5.975 -14.992 1.00 0.00 O ATOM 760 CB LEU A 77 2.904 -3.765 -13.094 1.00 0.00 C ATOM 761 CG LEU A 77 3.664 -3.550 -14.404 1.00 0.00 C ATOM 762 CD1 LEU A 77 3.251 -2.208 -15.014 1.00 0.00 C ATOM 763 CD2 LEU A 77 5.173 -3.542 -14.128 1.00 0.00 C ATOM 0 H LEU A 77 4.411 -5.989 -13.895 1.00 0.00 H new ATOM 0 HA LEU A 77 2.340 -5.375 -11.805 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.933 -3.273 -13.145 1.00 0.00 H new ATOM 0 HB3 LEU A 77 3.451 -3.307 -12.270 1.00 0.00 H new ATOM 0 HG LEU A 77 3.428 -4.357 -15.098 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.791 -2.051 -15.948 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.179 -2.212 -15.211 1.00 0.00 H new ATOM 0 HD13 LEU A 77 3.489 -1.403 -14.318 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.713 -3.389 -15.062 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.412 -2.736 -13.434 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.468 -4.496 -13.691 1.00 0.00 H new ATOM 775 N ASN A 78 0.565 -6.252 -13.333 1.00 0.00 N ATOM 776 CA ASN A 78 -0.455 -6.852 -14.228 1.00 0.00 C ATOM 777 C ASN A 78 -1.328 -5.741 -14.796 1.00 0.00 C ATOM 778 O ASN A 78 -1.651 -4.794 -14.109 1.00 0.00 O ATOM 779 CB ASN A 78 -1.334 -7.804 -13.423 1.00 0.00 C ATOM 780 CG ASN A 78 -0.473 -8.775 -12.602 1.00 0.00 C ATOM 781 OD1 ASN A 78 -0.868 -9.194 -11.532 1.00 0.00 O ATOM 782 ND2 ASN A 78 0.691 -9.156 -13.057 1.00 0.00 N ATOM 0 H ASN A 78 0.291 -6.182 -12.353 1.00 0.00 H new ATOM 0 HA ASN A 78 0.037 -7.395 -15.035 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -1.982 -7.234 -12.758 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -1.982 -8.365 -14.096 1.00 0.00 H new ATOM 0 HD21 ASN A 78 1.264 -9.802 -12.515 1.00 0.00 H new ATOM 0 HD22 ASN A 78 1.027 -8.807 -13.955 1.00 0.00 H new ATOM 789 N VAL A 79 -1.709 -5.850 -16.039 1.00 0.00 N ATOM 790 CA VAL A 79 -2.567 -4.794 -16.648 1.00 0.00 C ATOM 791 C VAL A 79 -3.817 -5.434 -17.252 1.00 0.00 C ATOM 792 O VAL A 79 -3.832 -5.826 -18.404 1.00 0.00 O ATOM 793 CB VAL A 79 -1.784 -4.059 -17.735 1.00 0.00 C ATOM 794 CG1 VAL A 79 -2.588 -2.843 -18.192 1.00 0.00 C ATOM 795 CG2 VAL A 79 -0.430 -3.599 -17.172 1.00 0.00 C ATOM 0 H VAL A 79 -1.464 -6.623 -16.658 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.865 -4.082 -15.879 1.00 0.00 H new ATOM 0 HB VAL A 79 -1.613 -4.726 -18.580 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -2.036 -2.313 -18.968 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.549 -3.170 -18.589 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -2.754 -2.177 -17.345 1.00 0.00 H new ATOM 0 HG21 VAL A 79 0.128 -3.075 -17.948 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.595 -2.929 -16.329 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.139 -4.467 -16.839 1.00 0.00 H new ATOM 805 N THR A 80 -4.867 -5.542 -16.476 1.00 0.00 N ATOM 806 CA THR A 80 -6.129 -6.155 -16.986 1.00 0.00 C ATOM 807 C THR A 80 -6.903 -5.124 -17.808 1.00 0.00 C ATOM 808 O THR A 80 -7.630 -4.309 -17.269 1.00 0.00 O ATOM 809 CB THR A 80 -6.987 -6.612 -15.798 1.00 0.00 C ATOM 810 OG1 THR A 80 -6.245 -7.532 -15.009 1.00 0.00 O ATOM 811 CG2 THR A 80 -8.268 -7.288 -16.303 1.00 0.00 C ATOM 0 H THR A 80 -4.903 -5.230 -15.506 1.00 0.00 H new ATOM 0 HA THR A 80 -5.890 -7.012 -17.615 1.00 0.00 H new ATOM 0 HB THR A 80 -7.257 -5.744 -15.196 1.00 0.00 H new ATOM 0 HG1 THR A 80 -6.790 -7.824 -14.249 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.870 -7.609 -15.453 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.839 -6.582 -16.906 1.00 0.00 H new ATOM 0 HG23 THR A 80 -8.007 -8.155 -16.910 1.00 0.00 H new ATOM 819 N LEU A 81 -6.763 -5.162 -19.107 1.00 0.00 N ATOM 820 CA LEU A 81 -7.498 -4.202 -19.971 1.00 0.00 C ATOM 821 C LEU A 81 -8.919 -4.744 -20.208 1.00 0.00 C ATOM 822 O LEU A 81 -9.089 -5.936 -20.372 1.00 0.00 O ATOM 823 CB LEU A 81 -6.768 -4.077 -21.307 1.00 0.00 C ATOM 824 CG LEU A 81 -5.394 -3.441 -21.086 1.00 0.00 C ATOM 825 CD1 LEU A 81 -4.413 -3.973 -22.131 1.00 0.00 C ATOM 826 CD2 LEU A 81 -5.506 -1.920 -21.219 1.00 0.00 C ATOM 0 H LEU A 81 -6.167 -5.822 -19.606 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.551 -3.224 -19.494 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.655 -5.060 -21.764 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.354 -3.470 -21.997 1.00 0.00 H new ATOM 0 HG LEU A 81 -5.035 -3.692 -20.088 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.434 -3.520 -21.974 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.332 -5.056 -22.036 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.773 -3.723 -23.129 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.527 -1.468 -21.061 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.866 -1.668 -22.216 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.205 -1.540 -20.474 1.00 0.00 H new ATOM 838 N PRO A 82 -9.909 -3.871 -20.220 1.00 0.00 N ATOM 839 CA PRO A 82 -11.338 -4.261 -20.434 1.00 0.00 C ATOM 840 C PRO A 82 -11.643 -4.409 -21.927 1.00 0.00 C ATOM 841 O PRO A 82 -10.750 -4.411 -22.755 1.00 0.00 O ATOM 842 CB PRO A 82 -12.117 -3.106 -19.822 1.00 0.00 C ATOM 843 CG PRO A 82 -11.207 -1.891 -19.834 1.00 0.00 C ATOM 844 CD PRO A 82 -9.772 -2.384 -20.026 1.00 0.00 C ATOM 0 HA PRO A 82 -11.592 -5.222 -19.986 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -13.026 -2.911 -20.391 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -12.424 -3.346 -18.804 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -11.488 -1.211 -20.638 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -11.299 -1.336 -18.900 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -9.302 -1.912 -20.889 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -9.153 -2.152 -19.159 1.00 0.00 H new ATOM 976 N SER B 32 2.414 -10.551 -31.931 1.00 0.00 N ATOM 977 CA SER B 32 0.958 -10.482 -31.622 1.00 0.00 C ATOM 978 C SER B 32 0.614 -9.127 -30.992 1.00 0.00 C ATOM 979 O SER B 32 -0.542 -8.756 -30.915 1.00 0.00 O ATOM 980 CB SER B 32 0.592 -11.603 -30.649 1.00 0.00 C ATOM 981 OG SER B 32 1.001 -12.850 -31.195 1.00 0.00 O ATOM 0 HA SER B 32 0.393 -10.597 -32.547 1.00 0.00 H new ATOM 0 HB2 SER B 32 1.076 -11.438 -29.687 1.00 0.00 H new ATOM 0 HB3 SER B 32 -0.483 -11.607 -30.468 1.00 0.00 H new ATOM 0 HG SER B 32 1.778 -12.713 -31.777 1.00 0.00 H new ATOM 987 N ASP B 33 1.602 -8.383 -30.539 1.00 0.00 N ATOM 988 CA ASP B 33 1.314 -7.060 -29.919 1.00 0.00 C ATOM 989 C ASP B 33 1.235 -5.964 -30.993 1.00 0.00 C ATOM 990 O ASP B 33 1.247 -4.791 -30.680 1.00 0.00 O ATOM 991 CB ASP B 33 2.418 -6.703 -28.920 1.00 0.00 C ATOM 992 CG ASP B 33 2.636 -7.866 -27.950 1.00 0.00 C ATOM 993 OD1 ASP B 33 1.712 -8.183 -27.219 1.00 0.00 O ATOM 994 OD2 ASP B 33 3.724 -8.420 -27.956 1.00 0.00 O ATOM 0 H ASP B 33 2.588 -8.640 -30.575 1.00 0.00 H new ATOM 0 HA ASP B 33 0.355 -7.125 -29.405 1.00 0.00 H new ATOM 0 HB2 ASP B 33 3.344 -6.482 -29.451 1.00 0.00 H new ATOM 0 HB3 ASP B 33 2.145 -5.804 -28.368 1.00 0.00 H new ATOM 999 N ALA B 34 1.147 -6.329 -32.252 1.00 0.00 N ATOM 1000 CA ALA B 34 1.055 -5.305 -33.326 1.00 0.00 C ATOM 1001 C ALA B 34 -0.422 -4.987 -33.614 1.00 0.00 C ATOM 1002 O ALA B 34 -0.735 -3.995 -34.246 1.00 0.00 O ATOM 1003 CB ALA B 34 1.718 -5.839 -34.597 1.00 0.00 C ATOM 0 H ALA B 34 1.135 -7.296 -32.576 1.00 0.00 H new ATOM 0 HA ALA B 34 1.563 -4.397 -33.003 1.00 0.00 H new ATOM 0 HB1 ALA B 34 1.651 -5.089 -35.385 1.00 0.00 H new ATOM 0 HB2 ALA B 34 2.766 -6.061 -34.395 1.00 0.00 H new ATOM 0 HB3 ALA B 34 1.210 -6.749 -34.918 1.00 0.00 H new ATOM 1009 N GLU B 35 -1.330 -5.823 -33.160 1.00 0.00 N ATOM 1010 CA GLU B 35 -2.780 -5.577 -33.409 1.00 0.00 C ATOM 1011 C GLU B 35 -3.216 -4.208 -32.840 1.00 0.00 C ATOM 1012 O GLU B 35 -3.924 -3.486 -33.511 1.00 0.00 O ATOM 1013 CB GLU B 35 -3.621 -6.696 -32.774 1.00 0.00 C ATOM 1014 CG GLU B 35 -3.079 -8.069 -33.200 1.00 0.00 C ATOM 1015 CD GLU B 35 -4.048 -8.727 -34.187 1.00 0.00 C ATOM 1016 OE1 GLU B 35 -4.943 -9.421 -33.735 1.00 0.00 O ATOM 1017 OE2 GLU B 35 -3.876 -8.526 -35.378 1.00 0.00 O ATOM 0 H GLU B 35 -1.123 -6.667 -32.626 1.00 0.00 H new ATOM 0 HA GLU B 35 -2.942 -5.569 -34.487 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -3.597 -6.608 -31.688 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -4.663 -6.597 -33.079 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -2.098 -7.956 -33.661 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -2.949 -8.706 -32.325 1.00 0.00 H new ATOM 1024 N PRO B 36 -2.801 -3.869 -31.627 1.00 0.00 N ATOM 1025 CA PRO B 36 -3.169 -2.569 -30.980 1.00 0.00 C ATOM 1026 C PRO B 36 -2.203 -1.456 -31.402 1.00 0.00 C ATOM 1027 O PRO B 36 -2.612 -0.354 -31.708 1.00 0.00 O ATOM 1028 CB PRO B 36 -3.042 -2.867 -29.492 1.00 0.00 C ATOM 1029 CG PRO B 36 -2.078 -4.030 -29.342 1.00 0.00 C ATOM 1030 CD PRO B 36 -1.922 -4.688 -30.715 1.00 0.00 C ATOM 0 HA PRO B 36 -4.163 -2.219 -31.260 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -2.674 -1.992 -28.956 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -4.014 -3.117 -29.066 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -1.113 -3.681 -28.974 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -2.456 -4.748 -28.615 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -0.884 -4.674 -31.046 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -2.236 -5.732 -30.693 1.00 0.00 H new ATOM 1038 N HIS B 37 -0.918 -1.738 -31.409 1.00 0.00 N ATOM 1039 CA HIS B 37 0.114 -0.716 -31.798 1.00 0.00 C ATOM 1040 C HIS B 37 0.338 0.300 -30.662 1.00 0.00 C ATOM 1041 O HIS B 37 1.169 1.182 -30.778 1.00 0.00 O ATOM 1042 CB HIS B 37 -0.304 0.026 -33.077 1.00 0.00 C ATOM 1043 CG HIS B 37 0.922 0.424 -33.851 1.00 0.00 C ATOM 1044 ND1 HIS B 37 1.382 -0.309 -34.935 1.00 0.00 N ATOM 1045 CD2 HIS B 37 1.794 1.475 -33.714 1.00 0.00 C ATOM 1046 CE1 HIS B 37 2.484 0.305 -35.401 1.00 0.00 C ATOM 1047 NE2 HIS B 37 2.780 1.398 -34.693 1.00 0.00 N ATOM 0 H HIS B 37 -0.534 -2.649 -31.157 1.00 0.00 H new ATOM 0 HA HIS B 37 1.047 -1.247 -31.986 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -0.941 -0.613 -33.689 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -0.889 0.910 -32.822 1.00 0.00 H new ATOM 0 HD2 HIS B 37 1.725 2.245 -32.960 1.00 0.00 H new ATOM 0 HE1 HIS B 37 3.060 -0.044 -36.246 1.00 0.00 H new ATOM 0 HE2 HIS B 37 3.561 2.038 -34.838 1.00 0.00 H new ATOM 1055 N TYR B 38 -0.375 0.182 -29.566 1.00 0.00 N ATOM 1056 CA TYR B 38 -0.179 1.133 -28.431 1.00 0.00 C ATOM 1057 C TYR B 38 0.246 0.344 -27.190 1.00 0.00 C ATOM 1058 O TYR B 38 1.051 0.797 -26.401 1.00 0.00 O ATOM 1059 CB TYR B 38 -1.480 1.891 -28.139 1.00 0.00 C ATOM 1060 CG TYR B 38 -2.641 0.927 -28.062 1.00 0.00 C ATOM 1061 CD1 TYR B 38 -2.959 0.305 -26.849 1.00 0.00 C ATOM 1062 CD2 TYR B 38 -3.404 0.661 -29.205 1.00 0.00 C ATOM 1063 CE1 TYR B 38 -4.038 -0.585 -26.780 1.00 0.00 C ATOM 1064 CE2 TYR B 38 -4.481 -0.229 -29.138 1.00 0.00 C ATOM 1065 CZ TYR B 38 -4.798 -0.853 -27.925 1.00 0.00 C ATOM 1066 OH TYR B 38 -5.862 -1.730 -27.857 1.00 0.00 O ATOM 0 H TYR B 38 -1.085 -0.534 -29.411 1.00 0.00 H new ATOM 0 HA TYR B 38 0.592 1.856 -28.696 1.00 0.00 H new ATOM 0 HB2 TYR B 38 -1.388 2.437 -27.200 1.00 0.00 H new ATOM 0 HB3 TYR B 38 -1.662 2.629 -28.920 1.00 0.00 H new ATOM 0 HD1 TYR B 38 -2.372 0.512 -25.966 1.00 0.00 H new ATOM 0 HD2 TYR B 38 -3.161 1.144 -30.140 1.00 0.00 H new ATOM 0 HE1 TYR B 38 -4.284 -1.064 -25.844 1.00 0.00 H new ATOM 0 HE2 TYR B 38 -5.068 -0.435 -30.021 1.00 0.00 H new ATOM 0 HH TYR B 38 -6.283 -1.803 -28.739 1.00 0.00 H new ATOM 1076 N LEU B 39 -0.285 -0.843 -27.022 1.00 0.00 N ATOM 1077 CA LEU B 39 0.077 -1.692 -25.847 1.00 0.00 C ATOM 1078 C LEU B 39 1.612 -1.795 -25.693 1.00 0.00 C ATOM 1079 O LEU B 39 2.130 -1.543 -24.621 1.00 0.00 O ATOM 1080 CB LEU B 39 -0.520 -3.096 -26.046 1.00 0.00 C ATOM 1081 CG LEU B 39 -1.390 -3.487 -24.836 1.00 0.00 C ATOM 1082 CD1 LEU B 39 -0.588 -3.368 -23.533 1.00 0.00 C ATOM 1083 CD2 LEU B 39 -2.603 -2.557 -24.767 1.00 0.00 C ATOM 0 H LEU B 39 -0.962 -1.264 -27.658 1.00 0.00 H new ATOM 0 HA LEU B 39 -0.325 -1.236 -24.942 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -1.120 -3.117 -26.955 1.00 0.00 H new ATOM 0 HB3 LEU B 39 0.281 -3.824 -26.176 1.00 0.00 H new ATOM 0 HG LEU B 39 -1.714 -4.521 -24.956 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -1.220 -3.648 -22.690 1.00 0.00 H new ATOM 0 HD12 LEU B 39 0.276 -4.031 -23.576 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -0.250 -2.340 -23.407 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -3.222 -2.829 -23.912 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -2.266 -1.526 -24.657 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -3.187 -2.652 -25.683 1.00 0.00 H new ATOM 1095 N PRO B 40 2.309 -2.151 -26.759 1.00 0.00 N ATOM 1096 CA PRO B 40 3.803 -2.279 -26.740 1.00 0.00 C ATOM 1097 C PRO B 40 4.460 -0.892 -26.722 1.00 0.00 C ATOM 1098 O PRO B 40 5.621 -0.750 -26.382 1.00 0.00 O ATOM 1099 CB PRO B 40 4.124 -3.043 -28.016 1.00 0.00 C ATOM 1100 CG PRO B 40 2.969 -2.823 -28.968 1.00 0.00 C ATOM 1101 CD PRO B 40 1.745 -2.466 -28.126 1.00 0.00 C ATOM 0 HA PRO B 40 4.180 -2.792 -25.855 1.00 0.00 H new ATOM 0 HB2 PRO B 40 5.057 -2.688 -28.453 1.00 0.00 H new ATOM 0 HB3 PRO B 40 4.254 -4.105 -27.807 1.00 0.00 H new ATOM 0 HG2 PRO B 40 3.198 -2.022 -29.671 1.00 0.00 H new ATOM 0 HG3 PRO B 40 2.781 -3.720 -29.557 1.00 0.00 H new ATOM 0 HD2 PRO B 40 1.212 -1.612 -28.542 1.00 0.00 H new ATOM 0 HD3 PRO B 40 1.037 -3.294 -28.083 1.00 0.00 H new ATOM 1109 N GLN B 41 3.719 0.133 -27.066 1.00 0.00 N ATOM 1110 CA GLN B 41 4.280 1.511 -27.045 1.00 0.00 C ATOM 1111 C GLN B 41 4.329 1.986 -25.589 1.00 0.00 C ATOM 1112 O GLN B 41 5.221 2.714 -25.188 1.00 0.00 O ATOM 1113 CB GLN B 41 3.366 2.431 -27.872 1.00 0.00 C ATOM 1114 CG GLN B 41 3.846 3.884 -27.788 1.00 0.00 C ATOM 1115 CD GLN B 41 5.226 4.008 -28.435 1.00 0.00 C ATOM 1116 OE1 GLN B 41 5.481 3.417 -29.466 1.00 0.00 O ATOM 1117 NE2 GLN B 41 6.134 4.756 -27.871 1.00 0.00 N ATOM 0 H GLN B 41 2.745 0.069 -27.361 1.00 0.00 H new ATOM 0 HA GLN B 41 5.283 1.530 -27.471 1.00 0.00 H new ATOM 0 HB2 GLN B 41 3.357 2.105 -28.912 1.00 0.00 H new ATOM 0 HB3 GLN B 41 2.342 2.359 -27.507 1.00 0.00 H new ATOM 0 HG2 GLN B 41 3.137 4.541 -28.292 1.00 0.00 H new ATOM 0 HG3 GLN B 41 3.892 4.203 -26.747 1.00 0.00 H new ATOM 0 HE21 GLN B 41 5.921 5.252 -27.006 1.00 0.00 H new ATOM 0 HE22 GLN B 41 7.057 4.845 -28.295 1.00 0.00 H new ATOM 1126 N LEU B 42 3.368 1.579 -24.803 1.00 0.00 N ATOM 1127 CA LEU B 42 3.329 2.000 -23.384 1.00 0.00 C ATOM 1128 C LEU B 42 4.371 1.217 -22.585 1.00 0.00 C ATOM 1129 O LEU B 42 5.077 1.773 -21.764 1.00 0.00 O ATOM 1130 CB LEU B 42 1.936 1.719 -22.798 1.00 0.00 C ATOM 1131 CG LEU B 42 0.791 2.544 -23.469 1.00 0.00 C ATOM 1132 CD1 LEU B 42 1.260 3.417 -24.650 1.00 0.00 C ATOM 1133 CD2 LEU B 42 -0.289 1.580 -23.975 1.00 0.00 C ATOM 0 H LEU B 42 2.604 0.968 -25.092 1.00 0.00 H new ATOM 0 HA LEU B 42 3.545 3.067 -23.325 1.00 0.00 H new ATOM 0 HB2 LEU B 42 1.715 0.657 -22.903 1.00 0.00 H new ATOM 0 HB3 LEU B 42 1.951 1.937 -21.730 1.00 0.00 H new ATOM 0 HG LEU B 42 0.409 3.221 -22.705 1.00 0.00 H new ATOM 0 HD11 LEU B 42 0.409 3.959 -25.063 1.00 0.00 H new ATOM 0 HD12 LEU B 42 2.009 4.129 -24.302 1.00 0.00 H new ATOM 0 HD13 LEU B 42 1.695 2.782 -25.422 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -1.092 2.148 -24.445 1.00 0.00 H new ATOM 0 HD22 LEU B 42 0.146 0.896 -24.704 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -0.690 1.010 -23.137 1.00 0.00 H new ATOM 1145 N ARG B 43 4.472 -0.073 -22.809 1.00 0.00 N ATOM 1146 CA ARG B 43 5.469 -0.886 -22.054 1.00 0.00 C ATOM 1147 C ARG B 43 6.872 -0.341 -22.327 1.00 0.00 C ATOM 1148 O ARG B 43 7.675 -0.189 -21.424 1.00 0.00 O ATOM 1149 CB ARG B 43 5.372 -2.361 -22.471 1.00 0.00 C ATOM 1150 CG ARG B 43 5.823 -2.557 -23.921 1.00 0.00 C ATOM 1151 CD ARG B 43 5.639 -4.023 -24.317 1.00 0.00 C ATOM 1152 NE ARG B 43 6.297 -4.270 -25.637 1.00 0.00 N ATOM 1153 CZ ARG B 43 7.611 -4.286 -25.758 1.00 0.00 C ATOM 1154 NH1 ARG B 43 8.399 -4.087 -24.727 1.00 0.00 N ATOM 1155 NH2 ARG B 43 8.138 -4.505 -26.931 1.00 0.00 N ATOM 0 H ARG B 43 3.907 -0.593 -23.481 1.00 0.00 H new ATOM 0 HA ARG B 43 5.262 -0.820 -20.986 1.00 0.00 H new ATOM 0 HB2 ARG B 43 5.989 -2.970 -21.810 1.00 0.00 H new ATOM 0 HB3 ARG B 43 4.345 -2.707 -22.357 1.00 0.00 H new ATOM 0 HG2 ARG B 43 5.243 -1.914 -24.584 1.00 0.00 H new ATOM 0 HG3 ARG B 43 6.868 -2.268 -24.031 1.00 0.00 H new ATOM 0 HD2 ARG B 43 6.071 -4.673 -23.556 1.00 0.00 H new ATOM 0 HD3 ARG B 43 4.578 -4.264 -24.377 1.00 0.00 H new ATOM 0 HE ARG B 43 5.718 -4.429 -26.461 1.00 0.00 H new ATOM 0 HH11 ARG B 43 7.999 -3.915 -23.805 1.00 0.00 H new ATOM 0 HH12 ARG B 43 9.412 -4.105 -24.848 1.00 0.00 H new ATOM 0 HH21 ARG B 43 7.536 -4.661 -27.739 1.00 0.00 H new ATOM 0 HH22 ARG B 43 9.152 -4.520 -27.040 1.00 0.00 H new ATOM 1169 N LYS B 44 7.165 -0.029 -23.567 1.00 0.00 N ATOM 1170 CA LYS B 44 8.499 0.520 -23.887 1.00 0.00 C ATOM 1171 C LYS B 44 8.632 1.891 -23.214 1.00 0.00 C ATOM 1172 O LYS B 44 9.711 2.305 -22.833 1.00 0.00 O ATOM 1173 CB LYS B 44 8.665 0.644 -25.407 1.00 0.00 C ATOM 1174 CG LYS B 44 7.637 1.623 -25.981 1.00 0.00 C ATOM 1175 CD LYS B 44 7.996 1.944 -27.432 1.00 0.00 C ATOM 1176 CE LYS B 44 7.674 0.739 -28.318 1.00 0.00 C ATOM 1177 NZ LYS B 44 8.655 0.669 -29.437 1.00 0.00 N ATOM 0 H LYS B 44 6.534 -0.134 -24.361 1.00 0.00 H new ATOM 0 HA LYS B 44 9.279 -0.145 -23.517 1.00 0.00 H new ATOM 0 HB2 LYS B 44 9.673 0.987 -25.642 1.00 0.00 H new ATOM 0 HB3 LYS B 44 8.544 -0.334 -25.873 1.00 0.00 H new ATOM 0 HG2 LYS B 44 6.638 1.190 -25.929 1.00 0.00 H new ATOM 0 HG3 LYS B 44 7.619 2.538 -25.388 1.00 0.00 H new ATOM 0 HD2 LYS B 44 7.438 2.817 -27.771 1.00 0.00 H new ATOM 0 HD3 LYS B 44 9.054 2.193 -27.509 1.00 0.00 H new ATOM 0 HE2 LYS B 44 7.711 -0.178 -27.730 1.00 0.00 H new ATOM 0 HE3 LYS B 44 6.662 0.824 -28.713 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 8.436 -0.150 -30.040 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 8.599 1.540 -30.003 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 9.615 0.568 -29.051 1.00 0.00 H new ATOM 1191 N ASP B 45 7.530 2.590 -23.059 1.00 0.00 N ATOM 1192 CA ASP B 45 7.577 3.918 -22.404 1.00 0.00 C ATOM 1193 C ASP B 45 7.940 3.734 -20.930 1.00 0.00 C ATOM 1194 O ASP B 45 8.781 4.437 -20.409 1.00 0.00 O ATOM 1195 CB ASP B 45 6.214 4.601 -22.522 1.00 0.00 C ATOM 1196 CG ASP B 45 5.990 5.058 -23.966 1.00 0.00 C ATOM 1197 OD1 ASP B 45 6.962 5.414 -24.612 1.00 0.00 O ATOM 1198 OD2 ASP B 45 4.850 5.045 -24.400 1.00 0.00 O ATOM 0 H ASP B 45 6.604 2.289 -23.362 1.00 0.00 H new ATOM 0 HA ASP B 45 8.327 4.542 -22.890 1.00 0.00 H new ATOM 0 HB2 ASP B 45 5.424 3.913 -22.221 1.00 0.00 H new ATOM 0 HB3 ASP B 45 6.165 5.456 -21.848 1.00 0.00 H new ATOM 1203 N ILE B 46 7.326 2.785 -20.250 1.00 0.00 N ATOM 1204 CA ILE B 46 7.665 2.562 -18.810 1.00 0.00 C ATOM 1205 C ILE B 46 9.155 2.199 -18.702 1.00 0.00 C ATOM 1206 O ILE B 46 9.805 2.501 -17.719 1.00 0.00 O ATOM 1207 CB ILE B 46 6.762 1.459 -18.207 1.00 0.00 C ATOM 1208 CG1 ILE B 46 6.927 1.464 -16.682 1.00 0.00 C ATOM 1209 CG2 ILE B 46 7.104 0.063 -18.756 1.00 0.00 C ATOM 1210 CD1 ILE B 46 5.911 0.513 -16.049 1.00 0.00 C ATOM 0 H ILE B 46 6.612 2.164 -20.630 1.00 0.00 H new ATOM 0 HA ILE B 46 7.484 3.472 -18.238 1.00 0.00 H new ATOM 0 HB ILE B 46 5.731 1.675 -18.487 1.00 0.00 H new ATOM 0 HG12 ILE B 46 7.939 1.160 -16.415 1.00 0.00 H new ATOM 0 HG13 ILE B 46 6.785 2.473 -16.295 1.00 0.00 H new ATOM 0 HG21 ILE B 46 6.444 -0.677 -18.304 1.00 0.00 H new ATOM 0 HG22 ILE B 46 6.971 0.055 -19.838 1.00 0.00 H new ATOM 0 HG23 ILE B 46 8.139 -0.179 -18.516 1.00 0.00 H new ATOM 0 HD11 ILE B 46 6.032 0.520 -14.966 1.00 0.00 H new ATOM 0 HD12 ILE B 46 4.902 0.837 -16.303 1.00 0.00 H new ATOM 0 HD13 ILE B 46 6.074 -0.497 -16.426 1.00 0.00 H new ATOM 1222 N LEU B 47 9.699 1.579 -19.726 1.00 0.00 N ATOM 1223 CA LEU B 47 11.141 1.226 -19.711 1.00 0.00 C ATOM 1224 C LEU B 47 11.943 2.524 -19.755 1.00 0.00 C ATOM 1225 O LEU B 47 12.899 2.704 -19.024 1.00 0.00 O ATOM 1226 CB LEU B 47 11.476 0.376 -20.939 1.00 0.00 C ATOM 1227 CG LEU B 47 11.069 -1.077 -20.694 1.00 0.00 C ATOM 1228 CD1 LEU B 47 11.034 -1.828 -22.025 1.00 0.00 C ATOM 1229 CD2 LEU B 47 12.089 -1.739 -19.764 1.00 0.00 C ATOM 0 H LEU B 47 9.197 1.305 -20.571 1.00 0.00 H new ATOM 0 HA LEU B 47 11.383 0.657 -18.813 1.00 0.00 H new ATOM 0 HB2 LEU B 47 10.956 0.766 -21.814 1.00 0.00 H new ATOM 0 HB3 LEU B 47 12.544 0.433 -21.151 1.00 0.00 H new ATOM 0 HG LEU B 47 10.081 -1.106 -20.234 1.00 0.00 H new ATOM 0 HD11 LEU B 47 10.744 -2.864 -21.851 1.00 0.00 H new ATOM 0 HD12 LEU B 47 10.311 -1.356 -22.690 1.00 0.00 H new ATOM 0 HD13 LEU B 47 12.022 -1.800 -22.484 1.00 0.00 H new ATOM 0 HD21 LEU B 47 11.801 -2.775 -19.587 1.00 0.00 H new ATOM 0 HD22 LEU B 47 13.076 -1.710 -20.226 1.00 0.00 H new ATOM 0 HD23 LEU B 47 12.117 -1.204 -18.815 1.00 0.00 H new ATOM 1241 N GLU B 48 11.539 3.437 -20.603 1.00 0.00 N ATOM 1242 CA GLU B 48 12.249 4.745 -20.697 1.00 0.00 C ATOM 1243 C GLU B 48 11.948 5.522 -19.424 1.00 0.00 C ATOM 1244 O GLU B 48 12.794 6.203 -18.879 1.00 0.00 O ATOM 1245 CB GLU B 48 11.764 5.572 -21.904 1.00 0.00 C ATOM 1246 CG GLU B 48 11.379 4.664 -23.079 1.00 0.00 C ATOM 1247 CD GLU B 48 11.922 5.242 -24.388 1.00 0.00 C ATOM 1248 OE1 GLU B 48 13.048 5.712 -24.382 1.00 0.00 O ATOM 1249 OE2 GLU B 48 11.204 5.205 -25.372 1.00 0.00 O ATOM 0 H GLU B 48 10.746 3.330 -21.235 1.00 0.00 H new ATOM 0 HA GLU B 48 13.316 4.561 -20.823 1.00 0.00 H new ATOM 0 HB2 GLU B 48 10.906 6.177 -21.612 1.00 0.00 H new ATOM 0 HB3 GLU B 48 12.549 6.261 -22.215 1.00 0.00 H new ATOM 0 HG2 GLU B 48 11.778 3.662 -22.921 1.00 0.00 H new ATOM 0 HG3 GLU B 48 10.295 4.569 -23.136 1.00 0.00 H new ATOM 1256 N VAL B 49 10.736 5.405 -18.940 1.00 0.00 N ATOM 1257 CA VAL B 49 10.348 6.111 -17.688 1.00 0.00 C ATOM 1258 C VAL B 49 11.244 5.607 -16.555 1.00 0.00 C ATOM 1259 O VAL B 49 11.955 6.369 -15.937 1.00 0.00 O ATOM 1260 CB VAL B 49 8.874 5.825 -17.376 1.00 0.00 C ATOM 1261 CG1 VAL B 49 8.456 6.563 -16.097 1.00 0.00 C ATOM 1262 CG2 VAL B 49 8.003 6.299 -18.549 1.00 0.00 C ATOM 0 H VAL B 49 9.996 4.846 -19.365 1.00 0.00 H new ATOM 0 HA VAL B 49 10.473 7.188 -17.800 1.00 0.00 H new ATOM 0 HB VAL B 49 8.740 4.753 -17.229 1.00 0.00 H new ATOM 0 HG11 VAL B 49 7.408 6.354 -15.883 1.00 0.00 H new ATOM 0 HG12 VAL B 49 9.071 6.224 -15.264 1.00 0.00 H new ATOM 0 HG13 VAL B 49 8.592 7.636 -16.235 1.00 0.00 H new ATOM 0 HG21 VAL B 49 6.955 6.096 -18.329 1.00 0.00 H new ATOM 0 HG22 VAL B 49 8.143 7.370 -18.696 1.00 0.00 H new ATOM 0 HG23 VAL B 49 8.293 5.767 -19.455 1.00 0.00 H new ATOM 1272 N ILE B 50 11.254 4.316 -16.310 1.00 0.00 N ATOM 1273 CA ILE B 50 12.150 3.764 -15.243 1.00 0.00 C ATOM 1274 C ILE B 50 13.603 4.152 -15.563 1.00 0.00 C ATOM 1275 O ILE B 50 14.447 4.198 -14.689 1.00 0.00 O ATOM 1276 CB ILE B 50 12.012 2.239 -15.182 1.00 0.00 C ATOM 1277 CG1 ILE B 50 10.546 1.869 -14.938 1.00 0.00 C ATOM 1278 CG2 ILE B 50 12.868 1.692 -14.037 1.00 0.00 C ATOM 1279 CD1 ILE B 50 10.257 0.498 -15.552 1.00 0.00 C ATOM 0 H ILE B 50 10.684 3.626 -16.799 1.00 0.00 H new ATOM 0 HA ILE B 50 11.867 4.176 -14.274 1.00 0.00 H new ATOM 0 HB ILE B 50 12.347 1.808 -16.126 1.00 0.00 H new ATOM 0 HG12 ILE B 50 10.337 1.852 -13.868 1.00 0.00 H new ATOM 0 HG13 ILE B 50 9.892 2.622 -15.378 1.00 0.00 H new ATOM 0 HG21 ILE B 50 12.769 0.607 -13.995 1.00 0.00 H new ATOM 0 HG22 ILE B 50 13.912 1.955 -14.206 1.00 0.00 H new ATOM 0 HG23 ILE B 50 12.533 2.124 -13.094 1.00 0.00 H new ATOM 0 HD11 ILE B 50 9.214 0.234 -15.379 1.00 0.00 H new ATOM 0 HD12 ILE B 50 10.449 0.532 -16.624 1.00 0.00 H new ATOM 0 HD13 ILE B 50 10.902 -0.250 -15.091 1.00 0.00 H new ATOM 1291 N CYS B 51 13.890 4.447 -16.812 1.00 0.00 N ATOM 1292 CA CYS B 51 15.264 4.852 -17.195 1.00 0.00 C ATOM 1293 C CYS B 51 15.509 6.297 -16.743 1.00 0.00 C ATOM 1294 O CYS B 51 16.531 6.612 -16.171 1.00 0.00 O ATOM 1295 CB CYS B 51 15.414 4.752 -18.717 1.00 0.00 C ATOM 1296 SG CYS B 51 17.171 4.752 -19.152 1.00 0.00 S ATOM 0 H CYS B 51 13.220 4.421 -17.580 1.00 0.00 H new ATOM 0 HA CYS B 51 15.991 4.196 -16.717 1.00 0.00 H new ATOM 0 HB2 CYS B 51 14.938 3.841 -19.081 1.00 0.00 H new ATOM 0 HB3 CYS B 51 14.909 5.589 -19.199 1.00 0.00 H new ATOM 0 HG CYS B 51 17.298 4.665 -20.443 1.00 0.00 H new ATOM 1302 N LYS B 52 14.572 7.177 -16.993 1.00 0.00 N ATOM 1303 CA LYS B 52 14.747 8.608 -16.581 1.00 0.00 C ATOM 1304 C LYS B 52 14.954 8.693 -15.068 1.00 0.00 C ATOM 1305 O LYS B 52 15.624 9.580 -14.572 1.00 0.00 O ATOM 1306 CB LYS B 52 13.501 9.423 -16.941 1.00 0.00 C ATOM 1307 CG LYS B 52 13.157 9.258 -18.423 1.00 0.00 C ATOM 1308 CD LYS B 52 11.634 9.303 -18.595 1.00 0.00 C ATOM 1309 CE LYS B 52 11.207 10.706 -19.034 1.00 0.00 C ATOM 1310 NZ LYS B 52 11.472 10.872 -20.491 1.00 0.00 N ATOM 0 H LYS B 52 13.692 6.968 -17.465 1.00 0.00 H new ATOM 0 HA LYS B 52 15.615 9.009 -17.105 1.00 0.00 H new ATOM 0 HB2 LYS B 52 12.659 9.099 -16.329 1.00 0.00 H new ATOM 0 HB3 LYS B 52 13.672 10.476 -16.717 1.00 0.00 H new ATOM 0 HG2 LYS B 52 13.625 10.050 -19.008 1.00 0.00 H new ATOM 0 HG3 LYS B 52 13.549 8.312 -18.797 1.00 0.00 H new ATOM 0 HD2 LYS B 52 11.320 8.568 -19.336 1.00 0.00 H new ATOM 0 HD3 LYS B 52 11.144 9.040 -17.657 1.00 0.00 H new ATOM 0 HE2 LYS B 52 10.148 10.857 -18.827 1.00 0.00 H new ATOM 0 HE3 LYS B 52 11.754 11.459 -18.466 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 11.460 11.883 -20.733 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 12.403 10.471 -20.722 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 10.737 10.377 -21.036 1.00 0.00 H new ATOM 1324 N TYR B 53 14.364 7.788 -14.334 1.00 0.00 N ATOM 1325 CA TYR B 53 14.493 7.807 -12.856 1.00 0.00 C ATOM 1326 C TYR B 53 15.515 6.750 -12.400 1.00 0.00 C ATOM 1327 O TYR B 53 15.970 6.773 -11.272 1.00 0.00 O ATOM 1328 CB TYR B 53 13.130 7.477 -12.234 1.00 0.00 C ATOM 1329 CG TYR B 53 12.079 8.512 -12.603 1.00 0.00 C ATOM 1330 CD1 TYR B 53 11.690 8.687 -13.939 1.00 0.00 C ATOM 1331 CD2 TYR B 53 11.468 9.272 -11.600 1.00 0.00 C ATOM 1332 CE1 TYR B 53 10.698 9.613 -14.270 1.00 0.00 C ATOM 1333 CE2 TYR B 53 10.476 10.205 -11.933 1.00 0.00 C ATOM 1334 CZ TYR B 53 10.090 10.372 -13.270 1.00 0.00 C ATOM 1335 OH TYR B 53 9.109 11.286 -13.598 1.00 0.00 O ATOM 0 H TYR B 53 13.792 7.029 -14.704 1.00 0.00 H new ATOM 0 HA TYR B 53 14.829 8.794 -12.538 1.00 0.00 H new ATOM 0 HB2 TYR B 53 12.805 6.492 -12.570 1.00 0.00 H new ATOM 0 HB3 TYR B 53 13.227 7.427 -11.149 1.00 0.00 H new ATOM 0 HD1 TYR B 53 12.160 8.103 -14.716 1.00 0.00 H new ATOM 0 HD2 TYR B 53 11.761 9.140 -10.569 1.00 0.00 H new ATOM 0 HE1 TYR B 53 10.402 9.741 -15.301 1.00 0.00 H new ATOM 0 HE2 TYR B 53 10.009 10.796 -11.159 1.00 0.00 H new ATOM 0 HH TYR B 53 8.790 11.729 -12.784 1.00 0.00 H new ATOM 1345 N VAL B 54 15.866 5.814 -13.257 1.00 0.00 N ATOM 1346 CA VAL B 54 16.843 4.744 -12.860 1.00 0.00 C ATOM 1347 C VAL B 54 17.605 4.293 -14.129 1.00 0.00 C ATOM 1348 O VAL B 54 17.985 5.121 -14.931 1.00 0.00 O ATOM 1349 CB VAL B 54 16.100 3.553 -12.203 1.00 0.00 C ATOM 1350 CG1 VAL B 54 17.075 2.779 -11.314 1.00 0.00 C ATOM 1351 CG2 VAL B 54 14.933 4.043 -11.335 1.00 0.00 C ATOM 0 H VAL B 54 15.518 5.746 -14.213 1.00 0.00 H new ATOM 0 HA VAL B 54 17.551 5.130 -12.126 1.00 0.00 H new ATOM 0 HB VAL B 54 15.709 2.915 -12.996 1.00 0.00 H new ATOM 0 HG11 VAL B 54 16.557 1.940 -10.850 1.00 0.00 H new ATOM 0 HG12 VAL B 54 17.901 2.405 -11.919 1.00 0.00 H new ATOM 0 HG13 VAL B 54 17.463 3.440 -10.539 1.00 0.00 H new ATOM 0 HG21 VAL B 54 14.429 3.187 -10.886 1.00 0.00 H new ATOM 0 HG22 VAL B 54 15.313 4.694 -10.548 1.00 0.00 H new ATOM 0 HG23 VAL B 54 14.227 4.596 -11.954 1.00 0.00 H new ATOM 1361 N GLN B 55 17.845 3.008 -14.330 1.00 0.00 N ATOM 1362 CA GLN B 55 18.575 2.573 -15.557 1.00 0.00 C ATOM 1363 C GLN B 55 18.579 1.045 -15.644 1.00 0.00 C ATOM 1364 O GLN B 55 19.253 0.368 -14.891 1.00 0.00 O ATOM 1365 CB GLN B 55 20.014 3.095 -15.511 1.00 0.00 C ATOM 1366 CG GLN B 55 20.217 4.155 -16.597 1.00 0.00 C ATOM 1367 CD GLN B 55 21.388 5.063 -16.215 1.00 0.00 C ATOM 1368 OE1 GLN B 55 21.244 5.946 -15.393 1.00 0.00 O ATOM 1369 NE2 GLN B 55 22.550 4.880 -16.779 1.00 0.00 N ATOM 0 H GLN B 55 17.566 2.256 -13.699 1.00 0.00 H new ATOM 0 HA GLN B 55 18.074 2.978 -16.436 1.00 0.00 H new ATOM 0 HB2 GLN B 55 20.225 3.521 -14.530 1.00 0.00 H new ATOM 0 HB3 GLN B 55 20.714 2.272 -15.658 1.00 0.00 H new ATOM 0 HG2 GLN B 55 20.413 3.675 -17.556 1.00 0.00 H new ATOM 0 HG3 GLN B 55 19.309 4.746 -16.717 1.00 0.00 H new ATOM 0 HE21 GLN B 55 22.671 4.139 -17.469 1.00 0.00 H new ATOM 0 HE22 GLN B 55 23.338 5.478 -16.530 1.00 0.00 H new ATOM 1378 N ILE B 56 17.828 0.509 -16.565 1.00 0.00 N ATOM 1379 CA ILE B 56 17.763 -0.974 -16.736 1.00 0.00 C ATOM 1380 C ILE B 56 17.715 -1.300 -18.227 1.00 0.00 C ATOM 1381 O ILE B 56 17.510 -0.430 -19.053 1.00 0.00 O ATOM 1382 CB ILE B 56 16.507 -1.537 -16.058 1.00 0.00 C ATOM 1383 CG1 ILE B 56 15.315 -0.595 -16.283 1.00 0.00 C ATOM 1384 CG2 ILE B 56 16.763 -1.691 -14.560 1.00 0.00 C ATOM 1385 CD1 ILE B 56 14.056 -1.419 -16.561 1.00 0.00 C ATOM 0 H ILE B 56 17.249 1.040 -17.215 1.00 0.00 H new ATOM 0 HA ILE B 56 18.644 -1.424 -16.277 1.00 0.00 H new ATOM 0 HB ILE B 56 16.275 -2.510 -16.492 1.00 0.00 H new ATOM 0 HG12 ILE B 56 15.164 0.033 -15.405 1.00 0.00 H new ATOM 0 HG13 ILE B 56 15.518 0.072 -17.121 1.00 0.00 H new ATOM 0 HG21 ILE B 56 15.871 -2.091 -14.078 1.00 0.00 H new ATOM 0 HG22 ILE B 56 17.598 -2.374 -14.402 1.00 0.00 H new ATOM 0 HG23 ILE B 56 17.003 -0.719 -14.130 1.00 0.00 H new ATOM 0 HD11 ILE B 56 13.211 -0.749 -16.720 1.00 0.00 H new ATOM 0 HD12 ILE B 56 14.209 -2.028 -17.452 1.00 0.00 H new ATOM 0 HD13 ILE B 56 13.850 -2.067 -15.709 1.00 0.00 H new ATOM 1397 N ASP B 57 17.895 -2.545 -18.577 1.00 0.00 N ATOM 1398 CA ASP B 57 17.850 -2.934 -20.014 1.00 0.00 C ATOM 1399 C ASP B 57 16.476 -3.544 -20.323 1.00 0.00 C ATOM 1400 O ASP B 57 15.766 -3.925 -19.413 1.00 0.00 O ATOM 1401 CB ASP B 57 18.944 -3.966 -20.300 1.00 0.00 C ATOM 1402 CG ASP B 57 20.260 -3.245 -20.604 1.00 0.00 C ATOM 1403 OD1 ASP B 57 20.839 -2.699 -19.682 1.00 0.00 O ATOM 1404 OD2 ASP B 57 20.663 -3.253 -21.756 1.00 0.00 O ATOM 0 H ASP B 57 18.072 -3.311 -17.927 1.00 0.00 H new ATOM 0 HA ASP B 57 18.013 -2.056 -20.639 1.00 0.00 H new ATOM 0 HB2 ASP B 57 19.069 -4.627 -19.442 1.00 0.00 H new ATOM 0 HB3 ASP B 57 18.656 -4.592 -21.145 1.00 0.00 H new ATOM 1409 N PRO B 58 16.129 -3.634 -21.590 1.00 0.00 N ATOM 1410 CA PRO B 58 14.819 -4.211 -22.030 1.00 0.00 C ATOM 1411 C PRO B 58 14.848 -5.728 -21.870 1.00 0.00 C ATOM 1412 O PRO B 58 13.837 -6.353 -21.605 1.00 0.00 O ATOM 1413 CB PRO B 58 14.701 -3.793 -23.488 1.00 0.00 C ATOM 1414 CG PRO B 58 16.109 -3.538 -23.987 1.00 0.00 C ATOM 1415 CD PRO B 58 16.967 -3.195 -22.767 1.00 0.00 C ATOM 0 HA PRO B 58 13.967 -3.862 -21.446 1.00 0.00 H new ATOM 0 HB2 PRO B 58 14.218 -4.574 -24.076 1.00 0.00 H new ATOM 0 HB3 PRO B 58 14.089 -2.897 -23.585 1.00 0.00 H new ATOM 0 HG2 PRO B 58 16.501 -4.417 -24.498 1.00 0.00 H new ATOM 0 HG3 PRO B 58 16.120 -2.720 -24.707 1.00 0.00 H new ATOM 0 HD2 PRO B 58 17.923 -3.718 -22.793 1.00 0.00 H new ATOM 0 HD3 PRO B 58 17.188 -2.129 -22.723 1.00 0.00 H new ATOM 1423 N GLU B 59 16.010 -6.318 -21.990 1.00 0.00 N ATOM 1424 CA GLU B 59 16.124 -7.790 -21.802 1.00 0.00 C ATOM 1425 C GLU B 59 15.900 -8.129 -20.317 1.00 0.00 C ATOM 1426 O GLU B 59 15.727 -9.279 -19.960 1.00 0.00 O ATOM 1427 CB GLU B 59 17.518 -8.254 -22.229 1.00 0.00 C ATOM 1428 CG GLU B 59 17.735 -7.920 -23.707 1.00 0.00 C ATOM 1429 CD GLU B 59 17.211 -9.069 -24.572 1.00 0.00 C ATOM 1430 OE1 GLU B 59 16.053 -9.420 -24.417 1.00 0.00 O ATOM 1431 OE2 GLU B 59 17.978 -9.577 -25.374 1.00 0.00 O ATOM 0 H GLU B 59 16.884 -5.841 -22.210 1.00 0.00 H new ATOM 0 HA GLU B 59 15.375 -8.296 -22.410 1.00 0.00 H new ATOM 0 HB2 GLU B 59 18.278 -7.766 -21.619 1.00 0.00 H new ATOM 0 HB3 GLU B 59 17.621 -9.327 -22.068 1.00 0.00 H new ATOM 0 HG2 GLU B 59 17.219 -6.994 -23.961 1.00 0.00 H new ATOM 0 HG3 GLU B 59 18.795 -7.758 -23.902 1.00 0.00 H new ATOM 1438 N MET B 60 15.898 -7.135 -19.449 1.00 0.00 N ATOM 1439 CA MET B 60 15.680 -7.397 -18.000 1.00 0.00 C ATOM 1440 C MET B 60 14.179 -7.336 -17.687 1.00 0.00 C ATOM 1441 O MET B 60 13.724 -7.880 -16.698 1.00 0.00 O ATOM 1442 CB MET B 60 16.414 -6.326 -17.185 1.00 0.00 C ATOM 1443 CG MET B 60 17.907 -6.673 -17.096 1.00 0.00 C ATOM 1444 SD MET B 60 18.285 -7.375 -15.469 1.00 0.00 S ATOM 1445 CE MET B 60 18.462 -5.806 -14.585 1.00 0.00 C ATOM 0 H MET B 60 16.039 -6.155 -19.692 1.00 0.00 H new ATOM 0 HA MET B 60 16.061 -8.385 -17.743 1.00 0.00 H new ATOM 0 HB2 MET B 60 16.285 -5.349 -17.651 1.00 0.00 H new ATOM 0 HB3 MET B 60 15.986 -6.260 -16.185 1.00 0.00 H new ATOM 0 HG2 MET B 60 18.170 -7.385 -17.878 1.00 0.00 H new ATOM 0 HG3 MET B 60 18.507 -5.779 -17.264 1.00 0.00 H new ATOM 0 HE1 MET B 60 18.276 -5.964 -13.523 1.00 0.00 H new ATOM 0 HE2 MET B 60 19.473 -5.423 -14.723 1.00 0.00 H new ATOM 0 HE3 MET B 60 17.744 -5.085 -14.976 1.00 0.00 H new ATOM 1455 N VAL B 61 13.410 -6.672 -18.519 1.00 0.00 N ATOM 1456 CA VAL B 61 11.944 -6.567 -18.269 1.00 0.00 C ATOM 1457 C VAL B 61 11.198 -7.616 -19.102 1.00 0.00 C ATOM 1458 O VAL B 61 11.480 -7.808 -20.270 1.00 0.00 O ATOM 1459 CB VAL B 61 11.473 -5.162 -18.664 1.00 0.00 C ATOM 1460 CG1 VAL B 61 9.987 -4.994 -18.333 1.00 0.00 C ATOM 1461 CG2 VAL B 61 12.288 -4.121 -17.892 1.00 0.00 C ATOM 0 H VAL B 61 13.739 -6.199 -19.361 1.00 0.00 H new ATOM 0 HA VAL B 61 11.737 -6.743 -17.213 1.00 0.00 H new ATOM 0 HB VAL B 61 11.616 -5.023 -19.736 1.00 0.00 H new ATOM 0 HG11 VAL B 61 9.662 -3.993 -18.617 1.00 0.00 H new ATOM 0 HG12 VAL B 61 9.406 -5.734 -18.883 1.00 0.00 H new ATOM 0 HG13 VAL B 61 9.834 -5.135 -17.263 1.00 0.00 H new ATOM 0 HG21 VAL B 61 11.957 -3.120 -18.170 1.00 0.00 H new ATOM 0 HG22 VAL B 61 12.144 -4.267 -16.821 1.00 0.00 H new ATOM 0 HG23 VAL B 61 13.345 -4.233 -18.134 1.00 0.00 H new ATOM 1471 N THR B 62 10.245 -8.292 -18.507 1.00 0.00 N ATOM 1472 CA THR B 62 9.471 -9.323 -19.249 1.00 0.00 C ATOM 1473 C THR B 62 8.091 -8.766 -19.600 1.00 0.00 C ATOM 1474 O THR B 62 7.614 -7.836 -18.977 1.00 0.00 O ATOM 1475 CB THR B 62 9.304 -10.573 -18.379 1.00 0.00 C ATOM 1476 OG1 THR B 62 10.507 -10.816 -17.663 1.00 0.00 O ATOM 1477 CG2 THR B 62 8.990 -11.776 -19.271 1.00 0.00 C ATOM 0 H THR B 62 9.972 -8.169 -17.532 1.00 0.00 H new ATOM 0 HA THR B 62 10.006 -9.586 -20.161 1.00 0.00 H new ATOM 0 HB THR B 62 8.487 -10.419 -17.674 1.00 0.00 H new ATOM 0 HG1 THR B 62 10.400 -11.615 -17.105 1.00 0.00 H new ATOM 0 HG21 THR B 62 8.871 -12.666 -18.653 1.00 0.00 H new ATOM 0 HG22 THR B 62 8.068 -11.590 -19.821 1.00 0.00 H new ATOM 0 HG23 THR B 62 9.808 -11.930 -19.975 1.00 0.00 H new ATOM 1485 N VAL B 63 7.448 -9.328 -20.591 1.00 0.00 N ATOM 1486 CA VAL B 63 6.095 -8.841 -20.987 1.00 0.00 C ATOM 1487 C VAL B 63 5.232 -10.035 -21.391 1.00 0.00 C ATOM 1488 O VAL B 63 5.539 -10.742 -22.333 1.00 0.00 O ATOM 1489 CB VAL B 63 6.226 -7.887 -22.173 1.00 0.00 C ATOM 1490 CG1 VAL B 63 4.868 -7.254 -22.479 1.00 0.00 C ATOM 1491 CG2 VAL B 63 7.229 -6.787 -21.830 1.00 0.00 C ATOM 0 H VAL B 63 7.805 -10.107 -21.145 1.00 0.00 H new ATOM 0 HA VAL B 63 5.633 -8.319 -20.149 1.00 0.00 H new ATOM 0 HB VAL B 63 6.572 -8.442 -23.045 1.00 0.00 H new ATOM 0 HG11 VAL B 63 4.966 -6.574 -23.325 1.00 0.00 H new ATOM 0 HG12 VAL B 63 4.149 -8.036 -22.723 1.00 0.00 H new ATOM 0 HG13 VAL B 63 4.520 -6.700 -21.607 1.00 0.00 H new ATOM 0 HG21 VAL B 63 7.324 -6.105 -22.675 1.00 0.00 H new ATOM 0 HG22 VAL B 63 6.880 -6.236 -20.956 1.00 0.00 H new ATOM 0 HG23 VAL B 63 8.199 -7.234 -21.613 1.00 0.00 H new ATOM 1501 N GLN B 64 4.158 -10.268 -20.681 1.00 0.00 N ATOM 1502 CA GLN B 64 3.276 -11.421 -21.014 1.00 0.00 C ATOM 1503 C GLN B 64 1.816 -10.957 -21.049 1.00 0.00 C ATOM 1504 O GLN B 64 1.399 -10.149 -20.243 1.00 0.00 O ATOM 1505 CB GLN B 64 3.448 -12.514 -19.952 1.00 0.00 C ATOM 1506 CG GLN B 64 3.218 -11.925 -18.554 1.00 0.00 C ATOM 1507 CD GLN B 64 4.565 -11.706 -17.860 1.00 0.00 C ATOM 1508 OE1 GLN B 64 5.297 -10.798 -18.200 1.00 0.00 O ATOM 1509 NE2 GLN B 64 4.925 -12.508 -16.896 1.00 0.00 N ATOM 0 H GLN B 64 3.855 -9.707 -19.884 1.00 0.00 H new ATOM 0 HA GLN B 64 3.548 -11.820 -21.991 1.00 0.00 H new ATOM 0 HB2 GLN B 64 2.743 -13.325 -20.135 1.00 0.00 H new ATOM 0 HB3 GLN B 64 4.449 -12.941 -20.016 1.00 0.00 H new ATOM 0 HG2 GLN B 64 2.679 -10.981 -18.631 1.00 0.00 H new ATOM 0 HG3 GLN B 64 2.598 -12.598 -17.962 1.00 0.00 H new ATOM 0 HE21 GLN B 64 4.310 -13.270 -16.611 1.00 0.00 H new ATOM 0 HE22 GLN B 64 5.821 -12.373 -16.428 1.00 0.00 H new ATOM 1518 N LEU B 65 1.042 -11.450 -21.983 1.00 0.00 N ATOM 1519 CA LEU B 65 -0.382 -11.033 -22.078 1.00 0.00 C ATOM 1520 C LEU B 65 -1.300 -12.211 -21.750 1.00 0.00 C ATOM 1521 O LEU B 65 -0.949 -13.359 -21.949 1.00 0.00 O ATOM 1522 CB LEU B 65 -0.671 -10.545 -23.496 1.00 0.00 C ATOM 1523 CG LEU B 65 -0.212 -11.594 -24.517 1.00 0.00 C ATOM 1524 CD1 LEU B 65 -1.243 -11.695 -25.644 1.00 0.00 C ATOM 1525 CD2 LEU B 65 1.141 -11.182 -25.101 1.00 0.00 C ATOM 0 H LEU B 65 1.341 -12.127 -22.685 1.00 0.00 H new ATOM 0 HA LEU B 65 -0.567 -10.230 -21.364 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -1.738 -10.354 -23.613 1.00 0.00 H new ATOM 0 HB3 LEU B 65 -0.157 -9.601 -23.676 1.00 0.00 H new ATOM 0 HG LEU B 65 -0.116 -12.561 -24.024 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -0.917 -12.440 -26.370 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -2.207 -11.989 -25.230 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -1.340 -10.727 -26.136 1.00 0.00 H new ATOM 0 HD21 LEU B 65 1.467 -11.928 -25.826 1.00 0.00 H new ATOM 0 HD22 LEU B 65 1.045 -10.214 -25.594 1.00 0.00 H new ATOM 0 HD23 LEU B 65 1.876 -11.110 -24.300 1.00 0.00 H new ATOM 1537 N GLU B 66 -2.476 -11.926 -21.253 1.00 0.00 N ATOM 1538 CA GLU B 66 -3.439 -13.012 -20.910 1.00 0.00 C ATOM 1539 C GLU B 66 -4.854 -12.558 -21.263 1.00 0.00 C ATOM 1540 O GLU B 66 -5.067 -11.432 -21.667 1.00 0.00 O ATOM 1541 CB GLU B 66 -3.352 -13.323 -19.411 1.00 0.00 C ATOM 1542 CG GLU B 66 -2.017 -13.996 -19.094 1.00 0.00 C ATOM 1543 CD GLU B 66 -1.938 -15.351 -19.802 1.00 0.00 C ATOM 1544 OE1 GLU B 66 -2.720 -16.222 -19.459 1.00 0.00 O ATOM 1545 OE2 GLU B 66 -1.098 -15.493 -20.675 1.00 0.00 O ATOM 0 H GLU B 66 -2.812 -10.980 -21.069 1.00 0.00 H new ATOM 0 HA GLU B 66 -3.194 -13.912 -21.475 1.00 0.00 H new ATOM 0 HB2 GLU B 66 -3.451 -12.404 -18.834 1.00 0.00 H new ATOM 0 HB3 GLU B 66 -4.176 -13.974 -19.118 1.00 0.00 H new ATOM 0 HG2 GLU B 66 -1.193 -13.359 -19.415 1.00 0.00 H new ATOM 0 HG3 GLU B 66 -1.914 -14.131 -18.017 1.00 0.00 H new ATOM 1552 N GLN B 67 -5.821 -13.429 -21.123 1.00 0.00 N ATOM 1553 CA GLN B 67 -7.227 -13.055 -21.455 1.00 0.00 C ATOM 1554 C GLN B 67 -8.183 -13.748 -20.483 1.00 0.00 C ATOM 1555 O GLN B 67 -7.843 -14.745 -19.874 1.00 0.00 O ATOM 1556 CB GLN B 67 -7.549 -13.499 -22.885 1.00 0.00 C ATOM 1557 CG GLN B 67 -7.160 -12.392 -23.869 1.00 0.00 C ATOM 1558 CD GLN B 67 -6.698 -13.020 -25.185 1.00 0.00 C ATOM 1559 OE1 GLN B 67 -7.434 -13.752 -25.815 1.00 0.00 O ATOM 1560 NE2 GLN B 67 -5.498 -12.761 -25.631 1.00 0.00 N ATOM 0 H GLN B 67 -5.696 -14.386 -20.792 1.00 0.00 H new ATOM 0 HA GLN B 67 -7.343 -11.974 -21.373 1.00 0.00 H new ATOM 0 HB2 GLN B 67 -7.009 -14.416 -23.122 1.00 0.00 H new ATOM 0 HB3 GLN B 67 -8.612 -13.723 -22.976 1.00 0.00 H new ATOM 0 HG2 GLN B 67 -8.010 -11.733 -24.047 1.00 0.00 H new ATOM 0 HG3 GLN B 67 -6.364 -11.779 -23.447 1.00 0.00 H new ATOM 0 HE21 GLN B 67 -4.879 -12.146 -25.102 1.00 0.00 H new ATOM 0 HE22 GLN B 67 -5.180 -13.174 -26.508 1.00 0.00 H new ATOM 1569 N LYS B 68 -9.376 -13.228 -20.335 1.00 0.00 N ATOM 1570 CA LYS B 68 -10.360 -13.855 -19.404 1.00 0.00 C ATOM 1571 C LYS B 68 -11.588 -14.319 -20.194 1.00 0.00 C ATOM 1572 O LYS B 68 -11.768 -13.958 -21.341 1.00 0.00 O ATOM 1573 CB LYS B 68 -10.783 -12.837 -18.344 1.00 0.00 C ATOM 1574 CG LYS B 68 -9.579 -12.481 -17.458 1.00 0.00 C ATOM 1575 CD LYS B 68 -9.460 -10.960 -17.327 1.00 0.00 C ATOM 1576 CE LYS B 68 -10.679 -10.416 -16.580 1.00 0.00 C ATOM 1577 NZ LYS B 68 -10.488 -10.605 -15.114 1.00 0.00 N ATOM 0 H LYS B 68 -9.710 -12.395 -20.820 1.00 0.00 H new ATOM 0 HA LYS B 68 -9.901 -14.714 -18.915 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -11.172 -11.939 -18.823 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -11.588 -13.246 -17.733 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -9.696 -12.932 -16.472 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -8.665 -12.890 -17.889 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -8.547 -10.701 -16.792 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -9.391 -10.503 -18.314 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -10.816 -9.359 -16.806 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -11.581 -10.932 -16.910 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -11.404 -10.815 -14.669 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -9.833 -11.396 -14.948 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -10.093 -9.736 -14.700 1.00 0.00 H new ATOM 1591 N ASP B 69 -12.424 -15.121 -19.587 1.00 0.00 N ATOM 1592 CA ASP B 69 -13.638 -15.625 -20.292 1.00 0.00 C ATOM 1593 C ASP B 69 -14.711 -14.529 -20.386 1.00 0.00 C ATOM 1594 O ASP B 69 -15.747 -14.731 -20.991 1.00 0.00 O ATOM 1595 CB ASP B 69 -14.204 -16.823 -19.527 1.00 0.00 C ATOM 1596 CG ASP B 69 -13.147 -17.926 -19.452 1.00 0.00 C ATOM 1597 OD1 ASP B 69 -12.445 -18.115 -20.432 1.00 0.00 O ATOM 1598 OD2 ASP B 69 -13.056 -18.563 -18.415 1.00 0.00 O ATOM 0 H ASP B 69 -12.316 -15.450 -18.627 1.00 0.00 H new ATOM 0 HA ASP B 69 -13.356 -15.922 -21.302 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -14.500 -16.520 -18.523 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -15.099 -17.196 -20.025 1.00 0.00 H new ATOM 1603 N GLY B 70 -14.484 -13.375 -19.797 1.00 0.00 N ATOM 1604 CA GLY B 70 -15.505 -12.286 -19.863 1.00 0.00 C ATOM 1605 C GLY B 70 -15.139 -11.299 -20.973 1.00 0.00 C ATOM 1606 O GLY B 70 -15.403 -10.115 -20.873 1.00 0.00 O ATOM 0 H GLY B 70 -13.638 -13.145 -19.276 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -16.491 -12.710 -20.052 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -15.559 -11.767 -18.906 1.00 0.00 H new ATOM 1610 N ASP B 71 -14.524 -11.778 -22.027 1.00 0.00 N ATOM 1611 CA ASP B 71 -14.126 -10.878 -23.155 1.00 0.00 C ATOM 1612 C ASP B 71 -13.189 -9.792 -22.626 1.00 0.00 C ATOM 1613 O ASP B 71 -13.354 -8.619 -22.903 1.00 0.00 O ATOM 1614 CB ASP B 71 -15.374 -10.235 -23.773 1.00 0.00 C ATOM 1615 CG ASP B 71 -16.049 -11.231 -24.716 1.00 0.00 C ATOM 1616 OD1 ASP B 71 -15.513 -11.458 -25.788 1.00 0.00 O ATOM 1617 OD2 ASP B 71 -17.090 -11.750 -24.351 1.00 0.00 O ATOM 0 H ASP B 71 -14.279 -12.760 -22.155 1.00 0.00 H new ATOM 0 HA ASP B 71 -13.613 -11.459 -23.921 1.00 0.00 H new ATOM 0 HB2 ASP B 71 -16.068 -9.935 -22.988 1.00 0.00 H new ATOM 0 HB3 ASP B 71 -15.099 -9.332 -24.318 1.00 0.00 H new ATOM 1622 N ILE B 72 -12.216 -10.185 -21.849 1.00 0.00 N ATOM 1623 CA ILE B 72 -11.266 -9.196 -21.270 1.00 0.00 C ATOM 1624 C ILE B 72 -9.828 -9.608 -21.595 1.00 0.00 C ATOM 1625 O ILE B 72 -9.559 -10.752 -21.911 1.00 0.00 O ATOM 1626 CB ILE B 72 -11.457 -9.142 -19.753 1.00 0.00 C ATOM 1627 CG1 ILE B 72 -12.965 -9.008 -19.442 1.00 0.00 C ATOM 1628 CG2 ILE B 72 -10.673 -7.948 -19.199 1.00 0.00 C ATOM 1629 CD1 ILE B 72 -13.203 -8.702 -17.956 1.00 0.00 C ATOM 0 H ILE B 72 -12.039 -11.155 -21.590 1.00 0.00 H new ATOM 0 HA ILE B 72 -11.459 -8.212 -21.697 1.00 0.00 H new ATOM 0 HB ILE B 72 -11.085 -10.053 -19.283 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -13.395 -8.214 -20.052 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -13.478 -9.931 -19.712 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -10.801 -7.899 -18.118 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -9.615 -8.067 -19.434 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -11.044 -7.028 -19.651 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -14.273 -8.614 -17.770 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -12.794 -9.509 -17.348 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -12.711 -7.766 -17.694 1.00 0.00 H new ATOM 1641 N SER B 73 -8.908 -8.682 -21.520 1.00 0.00 N ATOM 1642 CA SER B 73 -7.483 -9.004 -21.822 1.00 0.00 C ATOM 1643 C SER B 73 -6.605 -8.567 -20.653 1.00 0.00 C ATOM 1644 O SER B 73 -7.032 -7.834 -19.781 1.00 0.00 O ATOM 1645 CB SER B 73 -7.051 -8.269 -23.089 1.00 0.00 C ATOM 1646 OG SER B 73 -8.019 -8.478 -24.108 1.00 0.00 O ATOM 0 H SER B 73 -9.084 -7.711 -21.261 1.00 0.00 H new ATOM 0 HA SER B 73 -7.377 -10.078 -21.974 1.00 0.00 H new ATOM 0 HB2 SER B 73 -6.944 -7.203 -22.886 1.00 0.00 H new ATOM 0 HB3 SER B 73 -6.077 -8.630 -23.418 1.00 0.00 H new ATOM 0 HG SER B 73 -7.745 -8.006 -24.922 1.00 0.00 H new ATOM 1652 N ILE B 74 -5.386 -9.028 -20.628 1.00 0.00 N ATOM 1653 CA ILE B 74 -4.460 -8.671 -19.521 1.00 0.00 C ATOM 1654 C ILE B 74 -3.047 -8.512 -20.090 1.00 0.00 C ATOM 1655 O ILE B 74 -2.758 -8.958 -21.185 1.00 0.00 O ATOM 1656 CB ILE B 74 -4.473 -9.804 -18.489 1.00 0.00 C ATOM 1657 CG1 ILE B 74 -5.897 -9.996 -17.951 1.00 0.00 C ATOM 1658 CG2 ILE B 74 -3.519 -9.483 -17.331 1.00 0.00 C ATOM 1659 CD1 ILE B 74 -5.934 -11.189 -16.989 1.00 0.00 C ATOM 0 H ILE B 74 -4.988 -9.644 -21.337 1.00 0.00 H new ATOM 0 HA ILE B 74 -4.770 -7.739 -19.049 1.00 0.00 H new ATOM 0 HB ILE B 74 -4.140 -10.723 -18.971 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -6.226 -9.093 -17.437 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -6.588 -10.162 -18.777 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -3.539 -10.297 -16.606 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -2.506 -9.365 -17.716 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -3.833 -8.558 -16.847 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -6.948 -11.320 -16.611 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -5.624 -12.091 -17.516 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -5.256 -11.005 -16.155 1.00 0.00 H new ATOM 1671 N LEU B 75 -2.167 -7.894 -19.347 1.00 0.00 N ATOM 1672 CA LEU B 75 -0.773 -7.718 -19.828 1.00 0.00 C ATOM 1673 C LEU B 75 0.152 -7.511 -18.632 1.00 0.00 C ATOM 1674 O LEU B 75 0.277 -6.421 -18.108 1.00 0.00 O ATOM 1675 CB LEU B 75 -0.691 -6.514 -20.770 1.00 0.00 C ATOM 1676 CG LEU B 75 0.722 -6.426 -21.375 1.00 0.00 C ATOM 1677 CD1 LEU B 75 0.625 -6.234 -22.891 1.00 0.00 C ATOM 1678 CD2 LEU B 75 1.472 -5.238 -20.759 1.00 0.00 C ATOM 0 H LEU B 75 -2.359 -7.503 -18.424 1.00 0.00 H new ATOM 0 HA LEU B 75 -0.464 -8.609 -20.374 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -1.432 -6.610 -21.564 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -0.922 -5.598 -20.226 1.00 0.00 H new ATOM 0 HG LEU B 75 1.261 -7.349 -21.161 1.00 0.00 H new ATOM 0 HD11 LEU B 75 1.627 -6.172 -23.315 1.00 0.00 H new ATOM 0 HD12 LEU B 75 0.096 -7.079 -23.332 1.00 0.00 H new ATOM 0 HD13 LEU B 75 0.082 -5.314 -23.107 1.00 0.00 H new ATOM 0 HD21 LEU B 75 2.472 -5.177 -21.188 1.00 0.00 H new ATOM 0 HD22 LEU B 75 0.930 -4.316 -20.970 1.00 0.00 H new ATOM 0 HD23 LEU B 75 1.548 -5.375 -19.680 1.00 0.00 H new ATOM 1690 N GLU B 76 0.800 -8.560 -18.199 1.00 0.00 N ATOM 1691 CA GLU B 76 1.724 -8.457 -17.036 1.00 0.00 C ATOM 1692 C GLU B 76 3.151 -8.263 -17.546 1.00 0.00 C ATOM 1693 O GLU B 76 3.608 -8.985 -18.408 1.00 0.00 O ATOM 1694 CB GLU B 76 1.662 -9.750 -16.214 1.00 0.00 C ATOM 1695 CG GLU B 76 0.205 -10.115 -15.913 1.00 0.00 C ATOM 1696 CD GLU B 76 0.160 -11.393 -15.075 1.00 0.00 C ATOM 1697 OE1 GLU B 76 0.976 -12.267 -15.318 1.00 0.00 O ATOM 1698 OE2 GLU B 76 -0.690 -11.478 -14.204 1.00 0.00 O ATOM 0 H GLU B 76 0.726 -9.492 -18.607 1.00 0.00 H new ATOM 0 HA GLU B 76 1.430 -7.612 -16.413 1.00 0.00 H new ATOM 0 HB2 GLU B 76 2.142 -10.561 -16.761 1.00 0.00 H new ATOM 0 HB3 GLU B 76 2.213 -9.624 -15.282 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -0.282 -9.300 -15.378 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -0.344 -10.258 -16.843 1.00 0.00 H new ATOM 1705 N LEU B 77 3.866 -7.310 -17.009 1.00 0.00 N ATOM 1706 CA LEU B 77 5.271 -7.095 -17.456 1.00 0.00 C ATOM 1707 C LEU B 77 6.191 -7.192 -16.239 1.00 0.00 C ATOM 1708 O LEU B 77 5.987 -6.534 -15.238 1.00 0.00 O ATOM 1709 CB LEU B 77 5.422 -5.725 -18.131 1.00 0.00 C ATOM 1710 CG LEU B 77 4.819 -4.627 -17.253 1.00 0.00 C ATOM 1711 CD1 LEU B 77 5.548 -3.308 -17.521 1.00 0.00 C ATOM 1712 CD2 LEU B 77 3.330 -4.463 -17.586 1.00 0.00 C ATOM 0 H LEU B 77 3.538 -6.674 -16.282 1.00 0.00 H new ATOM 0 HA LEU B 77 5.541 -7.857 -18.187 1.00 0.00 H new ATOM 0 HB2 LEU B 77 6.476 -5.516 -18.312 1.00 0.00 H new ATOM 0 HB3 LEU B 77 4.928 -5.735 -19.102 1.00 0.00 H new ATOM 0 HG LEU B 77 4.928 -4.900 -16.203 1.00 0.00 H new ATOM 0 HD11 LEU B 77 5.121 -2.523 -16.897 1.00 0.00 H new ATOM 0 HD12 LEU B 77 6.606 -3.423 -17.286 1.00 0.00 H new ATOM 0 HD13 LEU B 77 5.437 -3.038 -18.571 1.00 0.00 H new ATOM 0 HD21 LEU B 77 2.901 -3.681 -16.960 1.00 0.00 H new ATOM 0 HD22 LEU B 77 3.220 -4.189 -18.635 1.00 0.00 H new ATOM 0 HD23 LEU B 77 2.810 -5.403 -17.400 1.00 0.00 H new ATOM 1724 N ASN B 78 7.193 -8.023 -16.315 1.00 0.00 N ATOM 1725 CA ASN B 78 8.121 -8.182 -15.169 1.00 0.00 C ATOM 1726 C ASN B 78 9.247 -7.168 -15.303 1.00 0.00 C ATOM 1727 O ASN B 78 9.715 -6.899 -16.390 1.00 0.00 O ATOM 1728 CB ASN B 78 8.721 -9.585 -15.198 1.00 0.00 C ATOM 1729 CG ASN B 78 7.618 -10.645 -15.350 1.00 0.00 C ATOM 1730 OD1 ASN B 78 7.840 -11.684 -15.939 1.00 0.00 O ATOM 1731 ND2 ASN B 78 6.434 -10.429 -14.840 1.00 0.00 N ATOM 0 H ASN B 78 7.407 -8.601 -17.128 1.00 0.00 H new ATOM 0 HA ASN B 78 7.582 -8.027 -14.234 1.00 0.00 H new ATOM 0 HB2 ASN B 78 9.427 -9.667 -16.024 1.00 0.00 H new ATOM 0 HB3 ASN B 78 9.281 -9.765 -14.281 1.00 0.00 H new ATOM 0 HD21 ASN B 78 5.701 -11.131 -14.937 1.00 0.00 H new ATOM 0 HD22 ASN B 78 6.243 -9.558 -14.345 1.00 0.00 H new ATOM 1738 N VAL B 79 9.683 -6.602 -14.210 1.00 0.00 N ATOM 1739 CA VAL B 79 10.786 -5.602 -14.278 1.00 0.00 C ATOM 1740 C VAL B 79 11.911 -6.012 -13.328 1.00 0.00 C ATOM 1741 O VAL B 79 11.923 -5.645 -12.169 1.00 0.00 O ATOM 1742 CB VAL B 79 10.253 -4.223 -13.888 1.00 0.00 C ATOM 1743 CG1 VAL B 79 11.327 -3.176 -14.177 1.00 0.00 C ATOM 1744 CG2 VAL B 79 8.992 -3.908 -14.706 1.00 0.00 C ATOM 0 H VAL B 79 9.323 -6.789 -13.274 1.00 0.00 H new ATOM 0 HA VAL B 79 11.175 -5.561 -15.295 1.00 0.00 H new ATOM 0 HB VAL B 79 10.003 -4.211 -12.827 1.00 0.00 H new ATOM 0 HG11 VAL B 79 10.956 -2.189 -13.902 1.00 0.00 H new ATOM 0 HG12 VAL B 79 12.221 -3.402 -13.596 1.00 0.00 H new ATOM 0 HG13 VAL B 79 11.571 -3.189 -15.239 1.00 0.00 H new ATOM 0 HG21 VAL B 79 8.613 -2.925 -14.427 1.00 0.00 H new ATOM 0 HG22 VAL B 79 9.236 -3.915 -15.768 1.00 0.00 H new ATOM 0 HG23 VAL B 79 8.230 -4.661 -14.504 1.00 0.00 H new ATOM 1754 N THR B 80 12.857 -6.775 -13.817 1.00 0.00 N ATOM 1755 CA THR B 80 13.992 -7.222 -12.959 1.00 0.00 C ATOM 1756 C THR B 80 15.024 -6.097 -12.847 1.00 0.00 C ATOM 1757 O THR B 80 15.867 -5.932 -13.709 1.00 0.00 O ATOM 1758 CB THR B 80 14.649 -8.458 -13.587 1.00 0.00 C ATOM 1759 OG1 THR B 80 13.676 -9.482 -13.735 1.00 0.00 O ATOM 1760 CG2 THR B 80 15.790 -8.962 -12.693 1.00 0.00 C ATOM 0 H THR B 80 12.890 -7.108 -14.780 1.00 0.00 H new ATOM 0 HA THR B 80 13.620 -7.472 -11.965 1.00 0.00 H new ATOM 0 HB THR B 80 15.055 -8.190 -14.562 1.00 0.00 H new ATOM 0 HG1 THR B 80 14.092 -10.273 -14.138 1.00 0.00 H new ATOM 0 HG21 THR B 80 16.249 -9.839 -13.149 1.00 0.00 H new ATOM 0 HG22 THR B 80 16.539 -8.178 -12.582 1.00 0.00 H new ATOM 0 HG23 THR B 80 15.394 -9.227 -11.713 1.00 0.00 H new ATOM 1768 N LEU B 81 14.970 -5.334 -11.785 1.00 0.00 N ATOM 1769 CA LEU B 81 15.950 -4.233 -11.602 1.00 0.00 C ATOM 1770 C LEU B 81 17.237 -4.819 -10.993 1.00 0.00 C ATOM 1771 O LEU B 81 17.161 -5.689 -10.149 1.00 0.00 O ATOM 1772 CB LEU B 81 15.358 -3.196 -10.649 1.00 0.00 C ATOM 1773 CG LEU B 81 14.138 -2.538 -11.296 1.00 0.00 C ATOM 1774 CD1 LEU B 81 13.141 -2.131 -10.210 1.00 0.00 C ATOM 1775 CD2 LEU B 81 14.579 -1.295 -12.074 1.00 0.00 C ATOM 0 H LEU B 81 14.284 -5.431 -11.036 1.00 0.00 H new ATOM 0 HA LEU B 81 16.176 -3.760 -12.558 1.00 0.00 H new ATOM 0 HB2 LEU B 81 15.072 -3.672 -9.711 1.00 0.00 H new ATOM 0 HB3 LEU B 81 16.106 -2.440 -10.408 1.00 0.00 H new ATOM 0 HG LEU B 81 13.665 -3.245 -11.978 1.00 0.00 H new ATOM 0 HD11 LEU B 81 12.272 -1.662 -10.671 1.00 0.00 H new ATOM 0 HD12 LEU B 81 12.825 -3.015 -9.656 1.00 0.00 H new ATOM 0 HD13 LEU B 81 13.614 -1.425 -9.527 1.00 0.00 H new ATOM 0 HD21 LEU B 81 13.709 -0.827 -12.535 1.00 0.00 H new ATOM 0 HD22 LEU B 81 15.053 -0.589 -11.393 1.00 0.00 H new ATOM 0 HD23 LEU B 81 15.289 -1.584 -12.849 1.00 0.00 H new ATOM 1787 N PRO B 82 18.387 -4.340 -11.428 1.00 0.00 N ATOM 1788 CA PRO B 82 19.713 -4.821 -10.925 1.00 0.00 C ATOM 1789 C PRO B 82 20.082 -4.124 -9.613 1.00 0.00 C ATOM 1790 O PRO B 82 19.270 -3.451 -9.007 1.00 0.00 O ATOM 1791 CB PRO B 82 20.675 -4.444 -12.043 1.00 0.00 C ATOM 1792 CG PRO B 82 20.045 -3.294 -12.810 1.00 0.00 C ATOM 1793 CD PRO B 82 18.557 -3.262 -12.466 1.00 0.00 C ATOM 0 HA PRO B 82 19.726 -5.888 -10.703 1.00 0.00 H new ATOM 0 HB2 PRO B 82 21.642 -4.150 -11.635 1.00 0.00 H new ATOM 0 HB3 PRO B 82 20.852 -5.294 -12.701 1.00 0.00 H new ATOM 0 HG2 PRO B 82 20.519 -2.350 -12.541 1.00 0.00 H new ATOM 0 HG3 PRO B 82 20.186 -3.428 -13.883 1.00 0.00 H new ATOM 0 HD2 PRO B 82 18.260 -2.287 -12.079 1.00 0.00 H new ATOM 0 HD3 PRO B 82 17.942 -3.457 -13.345 1.00 0.00 H new