USER MOD reduce.3.24.130724 H: found=0, std=0, add=832, rem=0, adj=22 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 64 GLN : amide:sc= -2.73 K(o=-7.2,f=-13!) USER MOD Set 1.2: B 78 ASN : amide:sc= -4.48 K(o=-7.2,f=-28!) USER MOD Set 2.1: B 41 GLN : amide:sc= -1.29 K(o=-0.97,f=-1.6) USER MOD Set 2.2: B 44 LYS NZ :NH3+ -156:sc= 0.322 (180deg=0) USER MOD Set 3.1: A 64 GLN : amide:sc= -2.74 K(o=-7.1,f=-13!) USER MOD Set 3.2: A 78 ASN : amide:sc= -4.38 K(o=-7.1,f=-28!) USER MOD Set 4.1: A 41 GLN : amide:sc= -1.28 K(o=-0.97,f=-1.5) USER MOD Set 4.2: A 44 LYS NZ :NH3+ -158:sc= 0.309 (180deg=0) USER MOD Single : A 32 SER OG : rot 28:sc= 0.535 USER MOD Single : A 37 HIS : no HD1:sc= -0.172 X(o=-0.17,f=0) USER MOD Single : A 38 TYR OH : rot 180:sc= -0.0289 USER MOD Single : A 51 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 152:sc= -0.0881 (180deg=-0.577) 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 153:sc= -1.91 (180deg=-3.7!) USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.23 USER MOD Single : A 67 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 68 LYS NZ :NH3+ 160:sc= -0.103 (180deg=-0.653) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 95:sc= 0.0206 USER MOD Single : B 32 SER OG : rot 26:sc= 0.513 USER MOD Single : B 37 HIS : no HD1:sc= -0.163 X(o=-0.16,f=0) USER MOD Single : B 38 TYR OH : rot 180:sc= -0.0232 USER MOD Single : B 51 CYS SG : rot 180:sc= 0 USER MOD Single : B 52 LYS NZ :NH3+ -124:sc= -0.0929 (180deg=-0.572) 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 146:sc= -1.92 (180deg=-3.79!) USER MOD Single : B 62 THR OG1 : rot 180:sc= -0.202 USER MOD Single : B 67 GLN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : B 68 LYS NZ :NH3+ 132:sc= -0.0925 (180deg=-0.638) USER MOD Single : B 73 SER OG : rot 180:sc= 0 USER MOD Single : B 80 THR OG1 : rot 96:sc= 0.0246 USER MOD ----------------------------------------------------------------- ATOM 27 N SER A 32 6.703 -0.302 1.106 1.00 0.00 N ATOM 28 CA SER A 32 8.090 -0.753 0.790 1.00 0.00 C ATOM 29 C SER A 32 8.591 -0.057 -0.480 1.00 0.00 C ATOM 30 O SER A 32 9.783 0.057 -0.699 1.00 0.00 O ATOM 31 CB SER A 32 8.099 -2.265 0.572 1.00 0.00 C ATOM 32 OG SER A 32 7.243 -2.882 1.524 1.00 0.00 O ATOM 0 HA SER A 32 8.744 -0.497 1.623 1.00 0.00 H new ATOM 0 HB2 SER A 32 7.767 -2.500 -0.439 1.00 0.00 H new ATOM 0 HB3 SER A 32 9.113 -2.652 0.673 1.00 0.00 H new ATOM 0 HG SER A 32 6.539 -2.253 1.787 1.00 0.00 H new ATOM 38 N ASP A 33 7.694 0.408 -1.318 1.00 0.00 N ATOM 39 CA ASP A 33 8.122 1.092 -2.570 1.00 0.00 C ATOM 40 C ASP A 33 8.390 2.583 -2.309 1.00 0.00 C ATOM 41 O ASP A 33 8.555 3.350 -3.237 1.00 0.00 O ATOM 42 CB ASP A 33 7.030 0.954 -3.631 1.00 0.00 C ATOM 43 CG ASP A 33 5.700 1.464 -3.071 1.00 0.00 C ATOM 44 OD1 ASP A 33 5.243 0.905 -2.087 1.00 0.00 O ATOM 45 OD2 ASP A 33 5.164 2.401 -3.635 1.00 0.00 O ATOM 0 H ASP A 33 6.685 0.341 -1.185 1.00 0.00 H new ATOM 0 HA ASP A 33 9.042 0.625 -2.922 1.00 0.00 H new ATOM 0 HB2 ASP A 33 7.302 1.520 -4.522 1.00 0.00 H new ATOM 0 HB3 ASP A 33 6.933 -0.089 -3.933 1.00 0.00 H new ATOM 50 N ALA A 34 8.442 3.000 -1.066 1.00 0.00 N ATOM 51 CA ALA A 34 8.712 4.430 -0.763 1.00 0.00 C ATOM 52 C ALA A 34 10.224 4.656 -0.587 1.00 0.00 C ATOM 53 O ALA A 34 10.682 5.780 -0.510 1.00 0.00 O ATOM 54 CB ALA A 34 7.987 4.817 0.526 1.00 0.00 C ATOM 0 H ALA A 34 8.308 2.404 -0.249 1.00 0.00 H new ATOM 0 HA ALA A 34 8.354 5.045 -1.588 1.00 0.00 H new ATOM 0 HB1 ALA A 34 8.182 5.865 0.752 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.915 4.666 0.400 1.00 0.00 H new ATOM 0 HB3 ALA A 34 8.346 4.196 1.346 1.00 0.00 H new ATOM 60 N GLU A 35 11.001 3.598 -0.513 1.00 0.00 N ATOM 61 CA GLU A 35 12.475 3.746 -0.333 1.00 0.00 C ATOM 62 C GLU A 35 13.126 4.436 -1.552 1.00 0.00 C ATOM 63 O GLU A 35 13.965 5.297 -1.368 1.00 0.00 O ATOM 64 CB GLU A 35 13.116 2.366 -0.121 1.00 0.00 C ATOM 65 CG GLU A 35 12.392 1.620 1.006 1.00 0.00 C ATOM 66 CD GLU A 35 13.181 1.763 2.310 1.00 0.00 C ATOM 67 OE1 GLU A 35 13.087 2.813 2.924 1.00 0.00 O ATOM 68 OE2 GLU A 35 13.868 0.822 2.670 1.00 0.00 O ATOM 0 H GLU A 35 10.671 2.635 -0.570 1.00 0.00 H new ATOM 0 HA GLU A 35 12.644 4.371 0.544 1.00 0.00 H new ATOM 0 HB2 GLU A 35 13.065 1.787 -1.043 1.00 0.00 H new ATOM 0 HB3 GLU A 35 14.171 2.480 0.126 1.00 0.00 H new ATOM 0 HG2 GLU A 35 11.386 2.020 1.133 1.00 0.00 H new ATOM 0 HG3 GLU A 35 12.285 0.566 0.748 1.00 0.00 H new ATOM 75 N PRO A 36 12.754 4.056 -2.765 1.00 0.00 N ATOM 76 CA PRO A 36 13.331 4.651 -4.014 1.00 0.00 C ATOM 77 C PRO A 36 12.591 5.935 -4.407 1.00 0.00 C ATOM 78 O PRO A 36 13.195 6.909 -4.809 1.00 0.00 O ATOM 79 CB PRO A 36 13.117 3.559 -5.054 1.00 0.00 C ATOM 80 CG PRO A 36 11.958 2.702 -4.582 1.00 0.00 C ATOM 81 CD PRO A 36 11.723 3.007 -3.102 1.00 0.00 C ATOM 0 HA PRO A 36 14.377 4.938 -3.904 1.00 0.00 H new ATOM 0 HB2 PRO A 36 12.899 3.995 -6.029 1.00 0.00 H new ATOM 0 HB3 PRO A 36 14.018 2.956 -5.168 1.00 0.00 H new ATOM 0 HG2 PRO A 36 11.062 2.918 -5.163 1.00 0.00 H new ATOM 0 HG3 PRO A 36 12.182 1.645 -4.723 1.00 0.00 H new ATOM 0 HD2 PRO A 36 10.712 3.374 -2.928 1.00 0.00 H new ATOM 0 HD3 PRO A 36 11.849 2.115 -2.488 1.00 0.00 H new ATOM 89 N HIS A 37 11.282 5.935 -4.302 1.00 0.00 N ATOM 90 CA HIS A 37 10.467 7.142 -4.671 1.00 0.00 C ATOM 91 C HIS A 37 10.401 7.315 -6.200 1.00 0.00 C ATOM 92 O HIS A 37 9.793 8.248 -6.691 1.00 0.00 O ATOM 93 CB HIS A 37 11.058 8.410 -4.035 1.00 0.00 C ATOM 94 CG HIS A 37 9.950 9.377 -3.717 1.00 0.00 C ATOM 95 ND1 HIS A 37 9.949 10.680 -4.188 1.00 0.00 N ATOM 96 CD2 HIS A 37 8.801 9.245 -2.977 1.00 0.00 C ATOM 97 CE1 HIS A 37 8.834 11.276 -3.730 1.00 0.00 C ATOM 98 NE2 HIS A 37 8.098 10.446 -2.987 1.00 0.00 N ATOM 0 H HIS A 37 10.735 5.140 -3.972 1.00 0.00 H new ATOM 0 HA HIS A 37 9.457 6.989 -4.290 1.00 0.00 H new ATOM 0 HB2 HIS A 37 11.603 8.154 -3.126 1.00 0.00 H new ATOM 0 HB3 HIS A 37 11.773 8.871 -4.716 1.00 0.00 H new ATOM 0 HD2 HIS A 37 8.490 8.346 -2.465 1.00 0.00 H new ATOM 0 HE1 HIS A 37 8.566 12.301 -3.938 1.00 0.00 H new ATOM 0 HE2 HIS A 37 7.211 10.649 -2.526 1.00 0.00 H new ATOM 106 N TYR A 38 11.001 6.425 -6.958 1.00 0.00 N ATOM 107 CA TYR A 38 10.946 6.539 -8.447 1.00 0.00 C ATOM 108 C TYR A 38 10.304 5.272 -9.018 1.00 0.00 C ATOM 109 O TYR A 38 9.559 5.321 -9.977 1.00 0.00 O ATOM 110 CB TYR A 38 12.358 6.714 -9.024 1.00 0.00 C ATOM 111 CG TYR A 38 13.307 5.708 -8.414 1.00 0.00 C ATOM 112 CD1 TYR A 38 13.390 4.413 -8.939 1.00 0.00 C ATOM 113 CD2 TYR A 38 14.111 6.075 -7.329 1.00 0.00 C ATOM 114 CE1 TYR A 38 14.277 3.485 -8.378 1.00 0.00 C ATOM 115 CE2 TYR A 38 14.998 5.148 -6.768 1.00 0.00 C ATOM 116 CZ TYR A 38 15.081 3.853 -7.293 1.00 0.00 C ATOM 117 OH TYR A 38 15.955 2.940 -6.741 1.00 0.00 O ATOM 0 H TYR A 38 11.526 5.625 -6.606 1.00 0.00 H new ATOM 0 HA TYR A 38 10.353 7.412 -8.720 1.00 0.00 H new ATOM 0 HB2 TYR A 38 12.333 6.589 -10.107 1.00 0.00 H new ATOM 0 HB3 TYR A 38 12.715 7.725 -8.828 1.00 0.00 H new ATOM 0 HD1 TYR A 38 12.770 4.129 -9.777 1.00 0.00 H new ATOM 0 HD2 TYR A 38 14.047 7.074 -6.924 1.00 0.00 H new ATOM 0 HE1 TYR A 38 14.340 2.486 -8.783 1.00 0.00 H new ATOM 0 HE2 TYR A 38 15.618 5.432 -5.930 1.00 0.00 H new ATOM 0 HH TYR A 38 16.438 3.358 -5.997 1.00 0.00 H new ATOM 127 N LEU A 39 10.577 4.139 -8.419 1.00 0.00 N ATOM 128 CA LEU A 39 9.981 2.853 -8.894 1.00 0.00 C ATOM 129 C LEU A 39 8.447 2.980 -9.037 1.00 0.00 C ATOM 130 O LEU A 39 7.907 2.638 -10.073 1.00 0.00 O ATOM 131 CB LEU A 39 10.318 1.745 -7.881 1.00 0.00 C ATOM 132 CG LEU A 39 11.009 0.566 -8.587 1.00 0.00 C ATOM 133 CD1 LEU A 39 10.126 0.029 -9.722 1.00 0.00 C ATOM 134 CD2 LEU A 39 12.349 1.034 -9.166 1.00 0.00 C ATOM 0 H LEU A 39 11.195 4.050 -7.612 1.00 0.00 H new ATOM 0 HA LEU A 39 10.395 2.607 -9.872 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.968 2.142 -7.101 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.407 1.401 -7.392 1.00 0.00 H new ATOM 0 HG LEU A 39 11.175 -0.230 -7.861 1.00 0.00 H new ATOM 0 HD11 LEU A 39 10.629 -0.805 -10.211 1.00 0.00 H new ATOM 0 HD12 LEU A 39 9.175 -0.311 -9.313 1.00 0.00 H new ATOM 0 HD13 LEU A 39 9.946 0.821 -10.449 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.840 0.200 -9.667 1.00 0.00 H new ATOM 0 HD22 LEU A 39 12.175 1.836 -9.883 1.00 0.00 H new ATOM 0 HD23 LEU A 39 12.986 1.399 -8.360 1.00 0.00 H new ATOM 146 N PRO A 40 7.775 3.473 -8.008 1.00 0.00 N ATOM 147 CA PRO A 40 6.287 3.650 -8.028 1.00 0.00 C ATOM 148 C PRO A 40 5.902 4.844 -8.911 1.00 0.00 C ATOM 149 O PRO A 40 4.780 4.947 -9.377 1.00 0.00 O ATOM 150 CB PRO A 40 5.921 3.877 -6.569 1.00 0.00 C ATOM 151 CG PRO A 40 7.163 4.388 -5.872 1.00 0.00 C ATOM 152 CD PRO A 40 8.367 3.932 -6.694 1.00 0.00 C ATOM 0 HA PRO A 40 5.757 2.795 -8.447 1.00 0.00 H new ATOM 0 HB2 PRO A 40 5.108 4.598 -6.484 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.576 2.951 -6.110 1.00 0.00 H new ATOM 0 HG2 PRO A 40 7.140 5.475 -5.795 1.00 0.00 H new ATOM 0 HG3 PRO A 40 7.221 3.997 -4.856 1.00 0.00 H new ATOM 0 HD2 PRO A 40 9.078 4.745 -6.841 1.00 0.00 H new ATOM 0 HD3 PRO A 40 8.904 3.124 -6.197 1.00 0.00 H new ATOM 160 N GLN A 41 6.830 5.731 -9.171 1.00 0.00 N ATOM 161 CA GLN A 41 6.531 6.891 -10.053 1.00 0.00 C ATOM 162 C GLN A 41 6.431 6.371 -11.489 1.00 0.00 C ATOM 163 O GLN A 41 5.644 6.846 -12.291 1.00 0.00 O ATOM 164 CB GLN A 41 7.668 7.917 -9.941 1.00 0.00 C ATOM 165 CG GLN A 41 7.405 9.102 -10.875 1.00 0.00 C ATOM 166 CD GLN A 41 6.161 9.859 -10.404 1.00 0.00 C ATOM 167 OE1 GLN A 41 5.975 10.068 -9.221 1.00 0.00 O ATOM 168 NE2 GLN A 41 5.297 10.281 -11.284 1.00 0.00 N ATOM 0 H GLN A 41 7.783 5.698 -8.808 1.00 0.00 H new ATOM 0 HA GLN A 41 5.597 7.372 -9.763 1.00 0.00 H new ATOM 0 HB2 GLN A 41 7.752 8.267 -8.912 1.00 0.00 H new ATOM 0 HB3 GLN A 41 8.618 7.447 -10.196 1.00 0.00 H new ATOM 0 HG2 GLN A 41 8.267 9.769 -10.885 1.00 0.00 H new ATOM 0 HG3 GLN A 41 7.263 8.749 -11.896 1.00 0.00 H new ATOM 0 HE21 GLN A 41 5.453 10.106 -12.277 1.00 0.00 H new ATOM 0 HE22 GLN A 41 4.465 10.787 -10.980 1.00 0.00 H new ATOM 177 N LEU A 42 7.230 5.388 -11.814 1.00 0.00 N ATOM 178 CA LEU A 42 7.203 4.823 -13.180 1.00 0.00 C ATOM 179 C LEU A 42 5.927 4.004 -13.363 1.00 0.00 C ATOM 180 O LEU A 42 5.159 4.250 -14.263 1.00 0.00 O ATOM 181 CB LEU A 42 8.426 3.912 -13.394 1.00 0.00 C ATOM 182 CG LEU A 42 9.791 4.675 -13.376 1.00 0.00 C ATOM 183 CD1 LEU A 42 9.659 6.169 -13.026 1.00 0.00 C ATOM 184 CD2 LEU A 42 10.721 4.017 -12.353 1.00 0.00 C ATOM 0 H LEU A 42 7.902 4.955 -11.181 1.00 0.00 H new ATOM 0 HA LEU A 42 7.228 5.636 -13.905 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.438 3.147 -12.618 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.321 3.396 -14.349 1.00 0.00 H new ATOM 0 HG LEU A 42 10.193 4.615 -14.387 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.645 6.633 -13.033 1.00 0.00 H new ATOM 0 HD12 LEU A 42 9.022 6.660 -13.762 1.00 0.00 H new ATOM 0 HD13 LEU A 42 9.216 6.273 -12.036 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.675 4.545 -12.336 1.00 0.00 H new ATOM 0 HD22 LEU A 42 10.264 4.061 -11.364 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.887 2.976 -12.629 1.00 0.00 H new ATOM 196 N ARG A 43 5.693 3.026 -12.515 1.00 0.00 N ATOM 197 CA ARG A 43 4.463 2.175 -12.650 1.00 0.00 C ATOM 198 C ARG A 43 3.214 3.050 -12.834 1.00 0.00 C ATOM 199 O ARG A 43 2.377 2.775 -13.679 1.00 0.00 O ATOM 200 CB ARG A 43 4.310 1.281 -11.408 1.00 0.00 C ATOM 201 CG ARG A 43 3.966 2.112 -10.166 1.00 0.00 C ATOM 202 CD ARG A 43 3.885 1.196 -8.943 1.00 0.00 C ATOM 203 NE ARG A 43 2.489 0.683 -8.796 1.00 0.00 N ATOM 204 CZ ARG A 43 2.060 0.168 -7.659 1.00 0.00 C ATOM 205 NH1 ARG A 43 2.843 0.072 -6.609 1.00 0.00 N ATOM 206 NH2 ARG A 43 0.831 -0.262 -7.577 1.00 0.00 N ATOM 0 H ARG A 43 6.302 2.780 -11.734 1.00 0.00 H new ATOM 0 HA ARG A 43 4.569 1.545 -13.533 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.528 0.542 -11.583 1.00 0.00 H new ATOM 0 HB3 ARG A 43 5.235 0.731 -11.236 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.723 2.880 -10.008 1.00 0.00 H new ATOM 0 HG3 ARG A 43 3.016 2.626 -10.312 1.00 0.00 H new ATOM 0 HD2 ARG A 43 4.580 0.364 -9.052 1.00 0.00 H new ATOM 0 HD3 ARG A 43 4.180 1.742 -8.047 1.00 0.00 H new ATOM 0 HE ARG A 43 1.853 0.732 -9.592 1.00 0.00 H new ATOM 0 HH11 ARG A 43 3.808 0.400 -6.660 1.00 0.00 H new ATOM 0 HH12 ARG A 43 2.487 -0.330 -5.742 1.00 0.00 H new ATOM 0 HH21 ARG A 43 0.213 -0.198 -8.386 1.00 0.00 H new ATOM 0 HH22 ARG A 43 0.488 -0.662 -6.704 1.00 0.00 H new ATOM 220 N LYS A 44 3.090 4.107 -12.070 1.00 0.00 N ATOM 221 CA LYS A 44 1.909 4.979 -12.230 1.00 0.00 C ATOM 222 C LYS A 44 1.983 5.650 -13.605 1.00 0.00 C ATOM 223 O LYS A 44 0.971 5.943 -14.208 1.00 0.00 O ATOM 224 CB LYS A 44 1.860 6.029 -11.112 1.00 0.00 C ATOM 225 CG LYS A 44 3.063 6.969 -11.203 1.00 0.00 C ATOM 226 CD LYS A 44 2.893 8.122 -10.210 1.00 0.00 C ATOM 227 CE LYS A 44 2.914 7.579 -8.779 1.00 0.00 C ATOM 228 NZ LYS A 44 3.601 8.555 -7.886 1.00 0.00 N ATOM 0 H LYS A 44 3.754 4.394 -11.351 1.00 0.00 H new ATOM 0 HA LYS A 44 0.998 4.385 -12.162 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.937 6.603 -11.185 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.851 5.534 -10.141 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.981 6.422 -10.987 1.00 0.00 H new ATOM 0 HG3 LYS A 44 3.156 7.360 -12.216 1.00 0.00 H new ATOM 0 HD2 LYS A 44 3.692 8.851 -10.344 1.00 0.00 H new ATOM 0 HD3 LYS A 44 1.953 8.641 -10.398 1.00 0.00 H new ATOM 0 HE2 LYS A 44 1.896 7.405 -8.430 1.00 0.00 H new ATOM 0 HE3 LYS A 44 3.429 6.619 -8.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 3.947 8.065 -7.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 4.404 8.982 -8.391 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 2.932 9.301 -7.607 1.00 0.00 H new ATOM 242 N ASP A 45 3.179 5.878 -14.115 1.00 0.00 N ATOM 243 CA ASP A 45 3.304 6.511 -15.454 1.00 0.00 C ATOM 244 C ASP A 45 2.671 5.595 -16.505 1.00 0.00 C ATOM 245 O ASP A 45 1.891 6.042 -17.317 1.00 0.00 O ATOM 246 CB ASP A 45 4.777 6.751 -15.795 1.00 0.00 C ATOM 247 CG ASP A 45 5.365 7.789 -14.838 1.00 0.00 C ATOM 248 OD1 ASP A 45 4.635 8.685 -14.444 1.00 0.00 O ATOM 249 OD2 ASP A 45 6.536 7.673 -14.515 1.00 0.00 O ATOM 0 H ASP A 45 4.061 5.651 -13.657 1.00 0.00 H new ATOM 0 HA ASP A 45 2.789 7.472 -15.445 1.00 0.00 H new ATOM 0 HB2 ASP A 45 5.334 5.817 -15.721 1.00 0.00 H new ATOM 0 HB3 ASP A 45 4.870 7.097 -16.824 1.00 0.00 H new ATOM 254 N ILE A 46 2.986 4.314 -16.492 1.00 0.00 N ATOM 255 CA ILE A 46 2.379 3.384 -17.498 1.00 0.00 C ATOM 256 C ILE A 46 0.847 3.432 -17.377 1.00 0.00 C ATOM 257 O ILE A 46 0.138 3.353 -18.362 1.00 0.00 O ATOM 258 CB ILE A 46 2.931 1.948 -17.306 1.00 0.00 C ATOM 259 CG1 ILE A 46 2.871 1.221 -18.652 1.00 0.00 C ATOM 260 CG2 ILE A 46 2.141 1.143 -16.261 1.00 0.00 C ATOM 261 CD1 ILE A 46 3.822 1.887 -19.646 1.00 0.00 C ATOM 0 H ILE A 46 3.632 3.880 -15.833 1.00 0.00 H new ATOM 0 HA ILE A 46 2.650 3.700 -18.505 1.00 0.00 H new ATOM 0 HB ILE A 46 3.955 2.029 -16.942 1.00 0.00 H new ATOM 0 HG12 ILE A 46 3.142 0.173 -18.522 1.00 0.00 H new ATOM 0 HG13 ILE A 46 1.853 1.240 -19.041 1.00 0.00 H new ATOM 0 HG21 ILE A 46 2.572 0.146 -16.168 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.190 1.651 -15.298 1.00 0.00 H new ATOM 0 HG23 ILE A 46 1.101 1.061 -16.575 1.00 0.00 H new ATOM 0 HD11 ILE A 46 3.774 1.364 -20.601 1.00 0.00 H new ATOM 0 HD12 ILE A 46 3.531 2.928 -19.787 1.00 0.00 H new ATOM 0 HD13 ILE A 46 4.840 1.844 -19.260 1.00 0.00 H new ATOM 273 N LEU A 47 0.336 3.579 -16.174 1.00 0.00 N ATOM 274 CA LEU A 47 -1.141 3.658 -15.990 1.00 0.00 C ATOM 275 C LEU A 47 -1.670 4.866 -16.771 1.00 0.00 C ATOM 276 O LEU A 47 -2.616 4.766 -17.534 1.00 0.00 O ATOM 277 CB LEU A 47 -1.461 3.830 -14.504 1.00 0.00 C ATOM 278 CG LEU A 47 -1.392 2.474 -13.799 1.00 0.00 C ATOM 279 CD1 LEU A 47 -1.087 2.684 -12.315 1.00 0.00 C ATOM 280 CD2 LEU A 47 -2.737 1.759 -13.945 1.00 0.00 C ATOM 0 H LEU A 47 0.883 3.647 -15.316 1.00 0.00 H new ATOM 0 HA LEU A 47 -1.611 2.745 -16.355 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -0.754 4.524 -14.048 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.454 4.262 -14.384 1.00 0.00 H new ATOM 0 HG LEU A 47 -0.605 1.869 -14.249 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.038 1.718 -11.813 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -0.131 3.197 -12.209 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -1.874 3.288 -11.864 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.691 0.792 -13.444 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.522 2.365 -13.493 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.957 1.610 -15.002 1.00 0.00 H new ATOM 292 N GLU A 48 -1.039 5.998 -16.601 1.00 0.00 N ATOM 293 CA GLU A 48 -1.469 7.217 -17.340 1.00 0.00 C ATOM 294 C GLU A 48 -1.150 7.016 -18.808 1.00 0.00 C ATOM 295 O GLU A 48 -1.906 7.397 -19.681 1.00 0.00 O ATOM 296 CB GLU A 48 -0.707 8.449 -16.849 1.00 0.00 C ATOM 297 CG GLU A 48 -0.712 8.512 -15.325 1.00 0.00 C ATOM 298 CD GLU A 48 -2.147 8.659 -14.813 1.00 0.00 C ATOM 299 OE1 GLU A 48 -2.849 7.661 -14.784 1.00 0.00 O ATOM 300 OE2 GLU A 48 -2.518 9.766 -14.461 1.00 0.00 O ATOM 0 H GLU A 48 -0.241 6.129 -15.979 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.536 7.373 -17.178 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.320 8.417 -17.214 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -1.162 9.351 -17.257 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -0.261 7.609 -14.914 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -0.108 9.353 -14.985 1.00 0.00 H new ATOM 307 N VAL A 49 -0.019 6.413 -19.086 1.00 0.00 N ATOM 308 CA VAL A 49 0.378 6.175 -20.498 1.00 0.00 C ATOM 309 C VAL A 49 -0.711 5.341 -21.177 1.00 0.00 C ATOM 310 O VAL A 49 -1.301 5.761 -22.148 1.00 0.00 O ATOM 311 CB VAL A 49 1.728 5.443 -20.549 1.00 0.00 C ATOM 312 CG1 VAL A 49 2.127 5.171 -22.008 1.00 0.00 C ATOM 313 CG2 VAL A 49 2.803 6.310 -19.878 1.00 0.00 C ATOM 0 H VAL A 49 0.645 6.076 -18.389 1.00 0.00 H new ATOM 0 HA VAL A 49 0.488 7.125 -21.020 1.00 0.00 H new ATOM 0 HB VAL A 49 1.639 4.493 -20.022 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.085 4.652 -22.032 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.367 4.552 -22.484 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.213 6.116 -22.544 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.762 5.793 -19.913 1.00 0.00 H new ATOM 0 HG22 VAL A 49 2.884 7.261 -20.405 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.527 6.493 -18.839 1.00 0.00 H new ATOM 323 N ILE A 50 -1.019 4.179 -20.645 1.00 0.00 N ATOM 324 CA ILE A 50 -2.108 3.344 -21.246 1.00 0.00 C ATOM 325 C ILE A 50 -3.389 4.191 -21.329 1.00 0.00 C ATOM 326 O ILE A 50 -4.244 3.959 -22.161 1.00 0.00 O ATOM 327 CB ILE A 50 -2.351 2.101 -20.380 1.00 0.00 C ATOM 328 CG1 ILE A 50 -1.055 1.293 -20.278 1.00 0.00 C ATOM 329 CG2 ILE A 50 -3.438 1.230 -21.017 1.00 0.00 C ATOM 330 CD1 ILE A 50 -1.052 0.494 -18.974 1.00 0.00 C ATOM 0 H ILE A 50 -0.565 3.776 -19.825 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.818 3.018 -22.245 1.00 0.00 H new ATOM 0 HB ILE A 50 -2.672 2.413 -19.386 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.966 0.619 -21.130 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.194 1.961 -20.309 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.607 0.349 -20.398 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.363 1.801 -21.095 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.119 0.919 -22.012 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -0.129 -0.081 -18.902 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.120 1.178 -18.128 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.905 -0.185 -18.961 1.00 0.00 H new ATOM 342 N CYS A 51 -3.506 5.187 -20.479 1.00 0.00 N ATOM 343 CA CYS A 51 -4.699 6.069 -20.512 1.00 0.00 C ATOM 344 C CYS A 51 -4.592 7.023 -21.708 1.00 0.00 C ATOM 345 O CYS A 51 -5.532 7.210 -22.451 1.00 0.00 O ATOM 346 CB CYS A 51 -4.765 6.880 -19.212 1.00 0.00 C ATOM 347 SG CYS A 51 -6.472 7.405 -18.916 1.00 0.00 S ATOM 0 H CYS A 51 -2.818 5.421 -19.763 1.00 0.00 H new ATOM 0 HA CYS A 51 -5.601 5.465 -20.610 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -4.408 6.278 -18.376 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -4.112 7.750 -19.280 1.00 0.00 H new ATOM 0 HG CYS A 51 -6.530 8.091 -17.813 1.00 0.00 H new ATOM 353 N LYS A 52 -3.446 7.628 -21.899 1.00 0.00 N ATOM 354 CA LYS A 52 -3.268 8.580 -23.045 1.00 0.00 C ATOM 355 C LYS A 52 -3.586 7.882 -24.369 1.00 0.00 C ATOM 356 O LYS A 52 -4.072 8.493 -25.303 1.00 0.00 O ATOM 357 CB LYS A 52 -1.818 9.069 -23.100 1.00 0.00 C ATOM 358 CG LYS A 52 -1.437 9.763 -21.794 1.00 0.00 C ATOM 359 CD LYS A 52 0.089 9.778 -21.664 1.00 0.00 C ATOM 360 CE LYS A 52 0.635 11.105 -22.195 1.00 0.00 C ATOM 361 NZ LYS A 52 0.236 12.209 -21.277 1.00 0.00 N ATOM 0 H LYS A 52 -2.622 7.505 -21.310 1.00 0.00 H new ATOM 0 HA LYS A 52 -3.945 9.421 -22.895 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.150 8.226 -23.279 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -1.692 9.758 -23.935 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.826 10.781 -21.781 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.882 9.241 -20.947 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.377 9.646 -20.621 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.520 8.946 -22.221 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.721 11.058 -22.274 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.250 11.294 -23.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 0.939 12.974 -21.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.696 12.575 -21.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 0.186 11.849 -20.303 1.00 0.00 H new ATOM 375 N TYR A 53 -3.294 6.614 -24.456 1.00 0.00 N ATOM 376 CA TYR A 53 -3.546 5.862 -25.710 1.00 0.00 C ATOM 377 C TYR A 53 -4.813 5.000 -25.568 1.00 0.00 C ATOM 378 O TYR A 53 -5.339 4.506 -26.547 1.00 0.00 O ATOM 379 CB TYR A 53 -2.349 4.944 -25.979 1.00 0.00 C ATOM 380 CG TYR A 53 -1.072 5.744 -26.167 1.00 0.00 C ATOM 381 CD1 TYR A 53 -0.523 6.464 -25.097 1.00 0.00 C ATOM 382 CD2 TYR A 53 -0.418 5.740 -27.405 1.00 0.00 C ATOM 383 CE1 TYR A 53 0.669 7.175 -25.259 1.00 0.00 C ATOM 384 CE2 TYR A 53 0.776 6.456 -27.569 1.00 0.00 C ATOM 385 CZ TYR A 53 1.319 7.173 -26.493 1.00 0.00 C ATOM 386 OH TYR A 53 2.496 7.874 -26.655 1.00 0.00 O ATOM 0 H TYR A 53 -2.887 6.063 -23.700 1.00 0.00 H new ATOM 0 HA TYR A 53 -3.684 6.565 -26.531 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -2.227 4.249 -25.148 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.540 4.345 -26.869 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -1.025 6.469 -24.141 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -0.833 5.185 -28.233 1.00 0.00 H new ATOM 0 HE1 TYR A 53 1.087 7.726 -24.429 1.00 0.00 H new ATOM 0 HE2 TYR A 53 1.278 6.455 -28.525 1.00 0.00 H new ATOM 0 HH TYR A 53 2.817 7.766 -27.575 1.00 0.00 H new ATOM 396 N VAL A 54 -5.296 4.797 -24.361 1.00 0.00 N ATOM 397 CA VAL A 54 -6.519 3.947 -24.162 1.00 0.00 C ATOM 398 C VAL A 54 -7.255 4.445 -22.896 1.00 0.00 C ATOM 399 O VAL A 54 -7.367 5.635 -22.690 1.00 0.00 O ATOM 400 CB VAL A 54 -6.121 2.455 -24.024 1.00 0.00 C ATOM 401 CG1 VAL A 54 -7.313 1.578 -24.414 1.00 0.00 C ATOM 402 CG2 VAL A 54 -4.942 2.108 -24.943 1.00 0.00 C ATOM 0 H VAL A 54 -4.896 5.183 -23.506 1.00 0.00 H new ATOM 0 HA VAL A 54 -7.181 4.030 -25.024 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.828 2.276 -22.990 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -7.038 0.527 -24.319 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -8.155 1.794 -23.756 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -7.596 1.787 -25.446 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -4.686 1.055 -24.824 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.220 2.299 -25.979 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.082 2.723 -24.679 1.00 0.00 H new ATOM 412 N GLN A 55 -7.762 3.569 -22.045 1.00 0.00 N ATOM 413 CA GLN A 55 -8.469 4.046 -20.819 1.00 0.00 C ATOM 414 C GLN A 55 -8.729 2.862 -19.884 1.00 0.00 C ATOM 415 O GLN A 55 -9.547 2.004 -20.159 1.00 0.00 O ATOM 416 CB GLN A 55 -9.798 4.700 -21.211 1.00 0.00 C ATOM 417 CG GLN A 55 -9.749 6.200 -20.904 1.00 0.00 C ATOM 418 CD GLN A 55 -10.996 6.879 -21.474 1.00 0.00 C ATOM 419 OE1 GLN A 55 -10.893 7.823 -22.233 1.00 0.00 O ATOM 420 NE2 GLN A 55 -12.176 6.438 -21.138 1.00 0.00 N ATOM 0 H GLN A 55 -7.713 2.556 -22.153 1.00 0.00 H new ATOM 0 HA GLN A 55 -7.848 4.780 -20.306 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -9.992 4.543 -22.272 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -10.618 4.234 -20.665 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -9.695 6.360 -19.827 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -8.851 6.641 -21.337 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -12.262 5.646 -20.501 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -13.013 6.885 -21.512 1.00 0.00 H new ATOM 429 N ILE A 56 -8.034 2.820 -18.782 1.00 0.00 N ATOM 430 CA ILE A 56 -8.217 1.707 -17.803 1.00 0.00 C ATOM 431 C ILE A 56 -8.156 2.274 -16.386 1.00 0.00 C ATOM 432 O ILE A 56 -7.758 3.406 -16.179 1.00 0.00 O ATOM 433 CB ILE A 56 -7.111 0.657 -17.975 1.00 0.00 C ATOM 434 CG1 ILE A 56 -5.766 1.344 -18.250 1.00 0.00 C ATOM 435 CG2 ILE A 56 -7.461 -0.267 -19.141 1.00 0.00 C ATOM 436 CD1 ILE A 56 -4.655 0.608 -17.501 1.00 0.00 C ATOM 0 H ILE A 56 -7.339 3.516 -18.513 1.00 0.00 H new ATOM 0 HA ILE A 56 -9.183 1.234 -17.978 1.00 0.00 H new ATOM 0 HB ILE A 56 -7.030 0.074 -17.057 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.558 1.346 -19.320 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -5.806 2.386 -17.931 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.675 -1.013 -19.263 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -8.408 -0.767 -18.937 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -7.550 0.319 -20.056 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -3.700 1.096 -17.696 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -4.862 0.629 -16.431 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -4.610 -0.427 -17.841 1.00 0.00 H new ATOM 448 N ASP A 57 -8.538 1.494 -15.410 1.00 0.00 N ATOM 449 CA ASP A 57 -8.496 1.976 -14.001 1.00 0.00 C ATOM 450 C ASP A 57 -7.286 1.351 -13.295 1.00 0.00 C ATOM 451 O ASP A 57 -6.733 0.386 -13.785 1.00 0.00 O ATOM 452 CB ASP A 57 -9.780 1.560 -13.281 1.00 0.00 C ATOM 453 CG ASP A 57 -10.862 2.618 -13.511 1.00 0.00 C ATOM 454 OD1 ASP A 57 -10.519 3.788 -13.549 1.00 0.00 O ATOM 455 OD2 ASP A 57 -12.014 2.239 -13.645 1.00 0.00 O ATOM 0 H ASP A 57 -8.879 0.540 -15.530 1.00 0.00 H new ATOM 0 HA ASP A 57 -8.411 3.063 -13.985 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -10.119 0.592 -13.650 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -9.590 1.445 -12.214 1.00 0.00 H new ATOM 460 N PRO A 58 -6.900 1.902 -12.162 1.00 0.00 N ATOM 461 CA PRO A 58 -5.737 1.389 -11.370 1.00 0.00 C ATOM 462 C PRO A 58 -6.121 0.084 -10.680 1.00 0.00 C ATOM 463 O PRO A 58 -5.296 -0.788 -10.481 1.00 0.00 O ATOM 464 CB PRO A 58 -5.452 2.501 -10.372 1.00 0.00 C ATOM 465 CG PRO A 58 -6.735 3.291 -10.212 1.00 0.00 C ATOM 466 CD PRO A 58 -7.550 3.090 -11.492 1.00 0.00 C ATOM 0 HA PRO A 58 -4.859 1.161 -11.975 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -5.131 2.088 -9.416 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -4.646 3.142 -10.729 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -7.294 2.946 -9.342 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -6.520 4.348 -10.055 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -8.600 2.897 -11.270 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -7.516 3.974 -12.129 1.00 0.00 H new ATOM 474 N GLU A 59 -7.378 -0.069 -10.349 1.00 0.00 N ATOM 475 CA GLU A 59 -7.831 -1.335 -9.713 1.00 0.00 C ATOM 476 C GLU A 59 -7.729 -2.478 -10.738 1.00 0.00 C ATOM 477 O GLU A 59 -7.800 -3.640 -10.384 1.00 0.00 O ATOM 478 CB GLU A 59 -9.286 -1.187 -9.257 1.00 0.00 C ATOM 479 CG GLU A 59 -9.331 -0.415 -7.937 1.00 0.00 C ATOM 480 CD GLU A 59 -8.860 -1.322 -6.799 1.00 0.00 C ATOM 481 OE1 GLU A 59 -9.625 -2.186 -6.402 1.00 0.00 O ATOM 482 OE2 GLU A 59 -7.744 -1.137 -6.343 1.00 0.00 O ATOM 0 H GLU A 59 -8.107 0.630 -10.493 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.203 -1.557 -8.850 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -9.865 -0.663 -10.017 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.741 -2.170 -9.132 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.696 0.469 -7.998 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -10.345 -0.066 -7.742 1.00 0.00 H new ATOM 489 N MET A 60 -7.558 -2.158 -12.007 1.00 0.00 N ATOM 490 CA MET A 60 -7.447 -3.216 -13.046 1.00 0.00 C ATOM 491 C MET A 60 -5.976 -3.608 -13.224 1.00 0.00 C ATOM 492 O MET A 60 -5.668 -4.694 -13.679 1.00 0.00 O ATOM 493 CB MET A 60 -7.994 -2.671 -14.370 1.00 0.00 C ATOM 494 CG MET A 60 -9.531 -2.688 -14.346 1.00 0.00 C ATOM 495 SD MET A 60 -10.155 -4.030 -15.393 1.00 0.00 S ATOM 496 CE MET A 60 -9.983 -3.175 -16.979 1.00 0.00 C ATOM 0 H MET A 60 -7.492 -1.203 -12.358 1.00 0.00 H new ATOM 0 HA MET A 60 -8.018 -4.093 -12.742 1.00 0.00 H new ATOM 0 HB2 MET A 60 -7.635 -1.654 -14.531 1.00 0.00 H new ATOM 0 HB3 MET A 60 -7.628 -3.274 -15.201 1.00 0.00 H new ATOM 0 HG2 MET A 60 -9.885 -2.819 -13.324 1.00 0.00 H new ATOM 0 HG3 MET A 60 -9.919 -1.732 -14.697 1.00 0.00 H new ATOM 0 HE1 MET A 60 -9.844 -3.908 -17.774 1.00 0.00 H new ATOM 0 HE2 MET A 60 -10.882 -2.591 -17.177 1.00 0.00 H new ATOM 0 HE3 MET A 60 -9.120 -2.511 -16.942 1.00 0.00 H new ATOM 506 N VAL A 61 -5.065 -2.729 -12.875 1.00 0.00 N ATOM 507 CA VAL A 61 -3.616 -3.042 -13.030 1.00 0.00 C ATOM 508 C VAL A 61 -3.040 -3.520 -11.692 1.00 0.00 C ATOM 509 O VAL A 61 -3.095 -2.818 -10.700 1.00 0.00 O ATOM 510 CB VAL A 61 -2.877 -1.780 -13.484 1.00 0.00 C ATOM 511 CG1 VAL A 61 -1.411 -2.111 -13.769 1.00 0.00 C ATOM 512 CG2 VAL A 61 -3.531 -1.238 -14.757 1.00 0.00 C ATOM 0 H VAL A 61 -5.268 -1.807 -12.489 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.492 -3.830 -13.772 1.00 0.00 H new ATOM 0 HB VAL A 61 -2.930 -1.030 -12.695 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -0.890 -1.209 -14.092 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -0.942 -2.496 -12.863 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -1.354 -2.864 -14.555 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.006 -0.340 -15.082 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.479 -1.992 -15.542 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.574 -0.996 -14.555 1.00 0.00 H new ATOM 522 N THR A 62 -2.482 -4.707 -11.661 1.00 0.00 N ATOM 523 CA THR A 62 -1.896 -5.233 -10.396 1.00 0.00 C ATOM 524 C THR A 62 -0.413 -4.861 -10.334 1.00 0.00 C ATOM 525 O THR A 62 0.200 -4.559 -11.339 1.00 0.00 O ATOM 526 CB THR A 62 -2.034 -6.757 -10.350 1.00 0.00 C ATOM 527 OG1 THR A 62 -3.297 -7.135 -10.878 1.00 0.00 O ATOM 528 CG2 THR A 62 -1.923 -7.234 -8.901 1.00 0.00 C ATOM 0 H THR A 62 -2.409 -5.333 -12.463 1.00 0.00 H new ATOM 0 HA THR A 62 -2.425 -4.798 -9.548 1.00 0.00 H new ATOM 0 HB THR A 62 -1.242 -7.212 -10.945 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.384 -8.111 -10.850 1.00 0.00 H new ATOM 0 HG21 THR A 62 -2.021 -8.319 -8.867 1.00 0.00 H new ATOM 0 HG22 THR A 62 -0.953 -6.944 -8.496 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.715 -6.779 -8.306 1.00 0.00 H new ATOM 536 N VAL A 63 0.163 -4.886 -9.159 1.00 0.00 N ATOM 537 CA VAL A 63 1.606 -4.539 -9.023 1.00 0.00 C ATOM 538 C VAL A 63 2.235 -5.410 -7.937 1.00 0.00 C ATOM 539 O VAL A 63 1.952 -5.254 -6.764 1.00 0.00 O ATOM 540 CB VAL A 63 1.735 -3.069 -8.629 1.00 0.00 C ATOM 541 CG1 VAL A 63 3.212 -2.667 -8.595 1.00 0.00 C ATOM 542 CG2 VAL A 63 0.997 -2.211 -9.654 1.00 0.00 C ATOM 0 H VAL A 63 -0.306 -5.132 -8.288 1.00 0.00 H new ATOM 0 HA VAL A 63 2.116 -4.711 -9.971 1.00 0.00 H new ATOM 0 HB VAL A 63 1.302 -2.919 -7.640 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.297 -1.617 -8.313 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.740 -3.282 -7.866 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.652 -2.815 -9.581 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.085 -1.160 -9.379 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.434 -2.366 -10.640 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -0.055 -2.494 -9.675 1.00 0.00 H new ATOM 552 N GLN A 64 3.088 -6.325 -8.320 1.00 0.00 N ATOM 553 CA GLN A 64 3.741 -7.204 -7.311 1.00 0.00 C ATOM 554 C GLN A 64 5.261 -7.051 -7.412 1.00 0.00 C ATOM 555 O GLN A 64 5.823 -7.061 -8.489 1.00 0.00 O ATOM 556 CB GLN A 64 3.337 -8.663 -7.561 1.00 0.00 C ATOM 557 CG GLN A 64 3.619 -9.047 -9.019 1.00 0.00 C ATOM 558 CD GLN A 64 2.329 -8.957 -9.837 1.00 0.00 C ATOM 559 OE1 GLN A 64 1.635 -7.961 -9.792 1.00 0.00 O ATOM 560 NE2 GLN A 64 1.976 -9.965 -10.588 1.00 0.00 N ATOM 0 H GLN A 64 3.359 -6.499 -9.288 1.00 0.00 H new ATOM 0 HA GLN A 64 3.420 -6.916 -6.310 1.00 0.00 H new ATOM 0 HB2 GLN A 64 3.889 -9.321 -6.890 1.00 0.00 H new ATOM 0 HB3 GLN A 64 2.278 -8.798 -7.340 1.00 0.00 H new ATOM 0 HG2 GLN A 64 4.374 -8.384 -9.440 1.00 0.00 H new ATOM 0 HG3 GLN A 64 4.021 -10.059 -9.067 1.00 0.00 H new ATOM 0 HE21 GLN A 64 2.559 -10.801 -10.626 1.00 0.00 H new ATOM 0 HE22 GLN A 64 1.118 -9.916 -11.137 1.00 0.00 H new ATOM 569 N LEU A 65 5.931 -6.889 -6.297 1.00 0.00 N ATOM 570 CA LEU A 65 7.405 -6.719 -6.331 1.00 0.00 C ATOM 571 C LEU A 65 8.093 -7.955 -5.754 1.00 0.00 C ATOM 572 O LEU A 65 7.718 -8.461 -4.713 1.00 0.00 O ATOM 573 CB LEU A 65 7.789 -5.494 -5.505 1.00 0.00 C ATOM 574 CG LEU A 65 7.175 -5.592 -4.099 1.00 0.00 C ATOM 575 CD1 LEU A 65 8.254 -5.331 -3.046 1.00 0.00 C ATOM 576 CD2 LEU A 65 6.061 -4.553 -3.952 1.00 0.00 C ATOM 0 H LEU A 65 5.514 -6.868 -5.366 1.00 0.00 H new ATOM 0 HA LEU A 65 7.725 -6.586 -7.365 1.00 0.00 H new ATOM 0 HB2 LEU A 65 8.874 -5.420 -5.432 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.440 -4.588 -6.000 1.00 0.00 H new ATOM 0 HG LEU A 65 6.763 -6.591 -3.956 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.815 -5.401 -2.051 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.047 -6.072 -3.146 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.669 -4.334 -3.190 1.00 0.00 H new ATOM 0 HD21 LEU A 65 5.627 -4.624 -2.955 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.473 -3.555 -4.098 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.289 -4.740 -4.698 1.00 0.00 H new ATOM 588 N GLU A 66 9.106 -8.433 -6.425 1.00 0.00 N ATOM 589 CA GLU A 66 9.846 -9.627 -5.933 1.00 0.00 C ATOM 590 C GLU A 66 11.331 -9.273 -5.830 1.00 0.00 C ATOM 591 O GLU A 66 11.740 -8.189 -6.199 1.00 0.00 O ATOM 592 CB GLU A 66 9.659 -10.793 -6.915 1.00 0.00 C ATOM 593 CG GLU A 66 8.274 -11.422 -6.737 1.00 0.00 C ATOM 594 CD GLU A 66 8.112 -11.953 -5.309 1.00 0.00 C ATOM 595 OE1 GLU A 66 9.048 -12.558 -4.813 1.00 0.00 O ATOM 596 OE2 GLU A 66 7.054 -11.745 -4.736 1.00 0.00 O ATOM 0 H GLU A 66 9.454 -8.043 -7.301 1.00 0.00 H new ATOM 0 HA GLU A 66 9.465 -9.924 -4.956 1.00 0.00 H new ATOM 0 HB2 GLU A 66 9.775 -10.437 -7.939 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.431 -11.544 -6.749 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.501 -10.683 -6.947 1.00 0.00 H new ATOM 0 HG3 GLU A 66 8.141 -12.234 -7.452 1.00 0.00 H new ATOM 603 N GLN A 67 12.136 -10.172 -5.329 1.00 0.00 N ATOM 604 CA GLN A 67 13.596 -9.883 -5.202 1.00 0.00 C ATOM 605 C GLN A 67 14.388 -11.186 -5.323 1.00 0.00 C ATOM 606 O GLN A 67 13.919 -12.244 -4.950 1.00 0.00 O ATOM 607 CB GLN A 67 13.872 -9.243 -3.840 1.00 0.00 C ATOM 608 CG GLN A 67 13.369 -7.799 -3.841 1.00 0.00 C ATOM 609 CD GLN A 67 13.685 -7.145 -2.495 1.00 0.00 C ATOM 610 OE1 GLN A 67 14.757 -7.332 -1.953 1.00 0.00 O ATOM 611 NE2 GLN A 67 12.791 -6.382 -1.928 1.00 0.00 N ATOM 0 H GLN A 67 11.847 -11.094 -5.002 1.00 0.00 H new ATOM 0 HA GLN A 67 13.901 -9.199 -5.994 1.00 0.00 H new ATOM 0 HB2 GLN A 67 13.376 -9.811 -3.053 1.00 0.00 H new ATOM 0 HB3 GLN A 67 14.940 -9.267 -3.626 1.00 0.00 H new ATOM 0 HG2 GLN A 67 13.841 -7.239 -4.648 1.00 0.00 H new ATOM 0 HG3 GLN A 67 12.295 -7.778 -4.024 1.00 0.00 H new ATOM 0 HE21 GLN A 67 11.892 -6.225 -2.383 1.00 0.00 H new ATOM 0 HE22 GLN A 67 12.992 -5.942 -1.030 1.00 0.00 H new ATOM 620 N LYS A 68 15.589 -11.112 -5.841 1.00 0.00 N ATOM 621 CA LYS A 68 16.421 -12.341 -5.988 1.00 0.00 C ATOM 622 C LYS A 68 17.481 -12.376 -4.885 1.00 0.00 C ATOM 623 O LYS A 68 17.694 -11.402 -4.188 1.00 0.00 O ATOM 624 CB LYS A 68 17.107 -12.338 -7.356 1.00 0.00 C ATOM 625 CG LYS A 68 16.061 -12.531 -8.464 1.00 0.00 C ATOM 626 CD LYS A 68 16.272 -11.491 -9.568 1.00 0.00 C ATOM 627 CE LYS A 68 17.624 -11.726 -10.243 1.00 0.00 C ATOM 628 NZ LYS A 68 17.626 -13.064 -10.898 1.00 0.00 N ATOM 0 H LYS A 68 16.028 -10.251 -6.168 1.00 0.00 H new ATOM 0 HA LYS A 68 15.782 -13.221 -5.906 1.00 0.00 H new ATOM 0 HB2 LYS A 68 17.638 -11.398 -7.505 1.00 0.00 H new ATOM 0 HB3 LYS A 68 17.850 -13.134 -7.402 1.00 0.00 H new ATOM 0 HG2 LYS A 68 16.140 -13.536 -8.879 1.00 0.00 H new ATOM 0 HG3 LYS A 68 15.058 -12.435 -8.049 1.00 0.00 H new ATOM 0 HD2 LYS A 68 15.470 -11.559 -10.303 1.00 0.00 H new ATOM 0 HD3 LYS A 68 16.234 -10.486 -9.147 1.00 0.00 H new ATOM 0 HE2 LYS A 68 17.814 -10.947 -10.982 1.00 0.00 H new ATOM 0 HE3 LYS A 68 18.425 -11.669 -9.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 18.373 -13.095 -11.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 17.804 -13.800 -10.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 16.703 -13.232 -11.346 1.00 0.00 H new ATOM 642 N ASP A 69 18.143 -13.493 -4.722 1.00 0.00 N ATOM 643 CA ASP A 69 19.189 -13.606 -3.666 1.00 0.00 C ATOM 644 C ASP A 69 20.454 -12.829 -4.066 1.00 0.00 C ATOM 645 O ASP A 69 21.378 -12.709 -3.283 1.00 0.00 O ATOM 646 CB ASP A 69 19.544 -15.080 -3.463 1.00 0.00 C ATOM 647 CG ASP A 69 18.622 -15.687 -2.404 1.00 0.00 C ATOM 648 OD1 ASP A 69 17.450 -15.351 -2.406 1.00 0.00 O ATOM 649 OD2 ASP A 69 19.105 -16.477 -1.610 1.00 0.00 O ATOM 0 H ASP A 69 18.002 -14.335 -5.279 1.00 0.00 H new ATOM 0 HA ASP A 69 18.798 -13.183 -2.741 1.00 0.00 H new ATOM 0 HB2 ASP A 69 19.442 -15.622 -4.403 1.00 0.00 H new ATOM 0 HB3 ASP A 69 20.584 -15.175 -3.152 1.00 0.00 H new ATOM 654 N GLY A 70 20.510 -12.304 -5.271 1.00 0.00 N ATOM 655 CA GLY A 70 21.723 -11.544 -5.702 1.00 0.00 C ATOM 656 C GLY A 70 21.495 -10.043 -5.509 1.00 0.00 C ATOM 657 O GLY A 70 22.012 -9.230 -6.250 1.00 0.00 O ATOM 0 H GLY A 70 19.769 -12.371 -5.969 1.00 0.00 H new ATOM 0 HA2 GLY A 70 22.589 -11.866 -5.124 1.00 0.00 H new ATOM 0 HA3 GLY A 70 21.942 -11.755 -6.749 1.00 0.00 H new ATOM 661 N ASP A 71 20.717 -9.671 -4.521 1.00 0.00 N ATOM 662 CA ASP A 71 20.441 -8.224 -4.267 1.00 0.00 C ATOM 663 C ASP A 71 19.789 -7.606 -5.506 1.00 0.00 C ATOM 664 O ASP A 71 20.198 -6.568 -5.990 1.00 0.00 O ATOM 665 CB ASP A 71 21.751 -7.495 -3.948 1.00 0.00 C ATOM 666 CG ASP A 71 22.127 -7.738 -2.485 1.00 0.00 C ATOM 667 OD1 ASP A 71 22.384 -8.881 -2.144 1.00 0.00 O ATOM 668 OD2 ASP A 71 22.151 -6.779 -1.732 1.00 0.00 O ATOM 0 H ASP A 71 20.258 -10.314 -3.875 1.00 0.00 H new ATOM 0 HA ASP A 71 19.765 -8.126 -3.417 1.00 0.00 H new ATOM 0 HB2 ASP A 71 22.546 -7.851 -4.603 1.00 0.00 H new ATOM 0 HB3 ASP A 71 21.640 -6.427 -4.133 1.00 0.00 H new ATOM 673 N ILE A 72 18.782 -8.255 -6.025 1.00 0.00 N ATOM 674 CA ILE A 72 18.096 -7.738 -7.242 1.00 0.00 C ATOM 675 C ILE A 72 16.591 -7.647 -6.975 1.00 0.00 C ATOM 676 O ILE A 72 16.071 -8.303 -6.091 1.00 0.00 O ATOM 677 CB ILE A 72 18.367 -8.686 -8.414 1.00 0.00 C ATOM 678 CG1 ILE A 72 19.879 -9.005 -8.463 1.00 0.00 C ATOM 679 CG2 ILE A 72 17.916 -8.012 -9.713 1.00 0.00 C ATOM 680 CD1 ILE A 72 20.247 -9.767 -9.745 1.00 0.00 C ATOM 0 H ILE A 72 18.403 -9.127 -5.655 1.00 0.00 H new ATOM 0 HA ILE A 72 18.474 -6.746 -7.489 1.00 0.00 H new ATOM 0 HB ILE A 72 17.814 -9.617 -8.289 1.00 0.00 H new ATOM 0 HG12 ILE A 72 20.450 -8.078 -8.412 1.00 0.00 H new ATOM 0 HG13 ILE A 72 20.156 -9.599 -7.592 1.00 0.00 H new ATOM 0 HG21 ILE A 72 18.105 -8.679 -10.554 1.00 0.00 H new ATOM 0 HG22 ILE A 72 16.850 -7.791 -9.657 1.00 0.00 H new ATOM 0 HG23 ILE A 72 18.472 -7.085 -9.854 1.00 0.00 H new ATOM 0 HD11 ILE A 72 21.317 -9.976 -9.749 1.00 0.00 H new ATOM 0 HD12 ILE A 72 19.693 -10.705 -9.782 1.00 0.00 H new ATOM 0 HD13 ILE A 72 19.992 -9.161 -10.614 1.00 0.00 H new ATOM 692 N SER A 73 15.889 -6.834 -7.726 1.00 0.00 N ATOM 693 CA SER A 73 14.419 -6.691 -7.513 1.00 0.00 C ATOM 694 C SER A 73 13.668 -7.161 -8.758 1.00 0.00 C ATOM 695 O SER A 73 14.245 -7.339 -9.814 1.00 0.00 O ATOM 696 CB SER A 73 14.082 -5.226 -7.238 1.00 0.00 C ATOM 697 OG SER A 73 15.081 -4.664 -6.397 1.00 0.00 O ATOM 0 H SER A 73 16.274 -6.263 -8.479 1.00 0.00 H new ATOM 0 HA SER A 73 14.119 -7.300 -6.660 1.00 0.00 H new ATOM 0 HB2 SER A 73 14.025 -4.672 -8.175 1.00 0.00 H new ATOM 0 HB3 SER A 73 13.104 -5.149 -6.762 1.00 0.00 H new ATOM 0 HG SER A 73 14.869 -3.724 -6.220 1.00 0.00 H new ATOM 703 N ILE A 74 12.386 -7.373 -8.631 1.00 0.00 N ATOM 704 CA ILE A 74 11.572 -7.846 -9.787 1.00 0.00 C ATOM 705 C ILE A 74 10.142 -7.302 -9.642 1.00 0.00 C ATOM 706 O ILE A 74 9.286 -7.941 -9.059 1.00 0.00 O ATOM 707 CB ILE A 74 11.563 -9.385 -9.780 1.00 0.00 C ATOM 708 CG1 ILE A 74 12.989 -9.903 -10.040 1.00 0.00 C ATOM 709 CG2 ILE A 74 10.600 -9.921 -10.854 1.00 0.00 C ATOM 710 CD1 ILE A 74 13.003 -11.438 -10.104 1.00 0.00 C ATOM 0 H ILE A 74 11.863 -7.237 -7.766 1.00 0.00 H new ATOM 0 HA ILE A 74 11.992 -7.492 -10.728 1.00 0.00 H new ATOM 0 HB ILE A 74 11.221 -9.737 -8.807 1.00 0.00 H new ATOM 0 HG12 ILE A 74 13.366 -9.491 -10.976 1.00 0.00 H new ATOM 0 HG13 ILE A 74 13.656 -9.560 -9.249 1.00 0.00 H new ATOM 0 HG21 ILE A 74 10.605 -11.011 -10.836 1.00 0.00 H new ATOM 0 HG22 ILE A 74 9.592 -9.560 -10.652 1.00 0.00 H new ATOM 0 HG23 ILE A 74 10.920 -9.573 -11.836 1.00 0.00 H new ATOM 0 HD11 ILE A 74 14.020 -11.785 -10.288 1.00 0.00 H new ATOM 0 HD12 ILE A 74 12.647 -11.845 -9.158 1.00 0.00 H new ATOM 0 HD13 ILE A 74 12.353 -11.774 -10.911 1.00 0.00 H new ATOM 722 N LEU A 75 9.883 -6.130 -10.165 1.00 0.00 N ATOM 723 CA LEU A 75 8.518 -5.542 -10.056 1.00 0.00 C ATOM 724 C LEU A 75 7.653 -5.997 -11.235 1.00 0.00 C ATOM 725 O LEU A 75 7.824 -5.549 -12.353 1.00 0.00 O ATOM 726 CB LEU A 75 8.618 -4.015 -10.050 1.00 0.00 C ATOM 727 CG LEU A 75 7.252 -3.415 -9.713 1.00 0.00 C ATOM 728 CD1 LEU A 75 7.443 -2.130 -8.905 1.00 0.00 C ATOM 729 CD2 LEU A 75 6.502 -3.096 -11.008 1.00 0.00 C ATOM 0 H LEU A 75 10.562 -5.555 -10.664 1.00 0.00 H new ATOM 0 HA LEU A 75 8.057 -5.881 -9.128 1.00 0.00 H new ATOM 0 HB2 LEU A 75 9.359 -3.691 -9.319 1.00 0.00 H new ATOM 0 HB3 LEU A 75 8.953 -3.658 -11.024 1.00 0.00 H new ATOM 0 HG LEU A 75 6.676 -4.131 -9.126 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.469 -1.703 -8.665 1.00 0.00 H new ATOM 0 HD12 LEU A 75 7.977 -2.356 -7.982 1.00 0.00 H new ATOM 0 HD13 LEU A 75 8.019 -1.414 -9.491 1.00 0.00 H new ATOM 0 HD21 LEU A 75 5.528 -2.668 -10.769 1.00 0.00 H new ATOM 0 HD22 LEU A 75 7.078 -2.381 -11.595 1.00 0.00 H new ATOM 0 HD23 LEU A 75 6.365 -4.011 -11.584 1.00 0.00 H new ATOM 741 N GLU A 76 6.721 -6.881 -10.983 1.00 0.00 N ATOM 742 CA GLU A 76 5.827 -7.377 -12.072 1.00 0.00 C ATOM 743 C GLU A 76 4.457 -6.712 -11.932 1.00 0.00 C ATOM 744 O GLU A 76 3.768 -6.903 -10.948 1.00 0.00 O ATOM 745 CB GLU A 76 5.664 -8.900 -11.962 1.00 0.00 C ATOM 746 CG GLU A 76 7.033 -9.568 -11.798 1.00 0.00 C ATOM 747 CD GLU A 76 6.845 -11.000 -11.290 1.00 0.00 C ATOM 748 OE1 GLU A 76 5.919 -11.220 -10.527 1.00 0.00 O ATOM 749 OE2 GLU A 76 7.632 -11.850 -11.671 1.00 0.00 O ATOM 0 H GLU A 76 6.540 -7.283 -10.063 1.00 0.00 H new ATOM 0 HA GLU A 76 6.265 -7.133 -13.040 1.00 0.00 H new ATOM 0 HB2 GLU A 76 5.028 -9.144 -11.111 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.168 -9.285 -12.853 1.00 0.00 H new ATOM 0 HG2 GLU A 76 7.562 -9.575 -12.751 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.645 -9.000 -11.098 1.00 0.00 H new ATOM 756 N LEU A 77 4.050 -5.933 -12.902 1.00 0.00 N ATOM 757 CA LEU A 77 2.720 -5.266 -12.808 1.00 0.00 C ATOM 758 C LEU A 77 1.762 -5.882 -13.829 1.00 0.00 C ATOM 759 O LEU A 77 2.075 -6.016 -14.996 1.00 0.00 O ATOM 760 CB LEU A 77 2.862 -3.759 -13.062 1.00 0.00 C ATOM 761 CG LEU A 77 3.624 -3.512 -14.363 1.00 0.00 C ATOM 762 CD1 LEU A 77 3.120 -2.221 -15.010 1.00 0.00 C ATOM 763 CD2 LEU A 77 5.120 -3.375 -14.059 1.00 0.00 C ATOM 0 H LEU A 77 4.579 -5.732 -13.750 1.00 0.00 H new ATOM 0 HA LEU A 77 2.319 -5.413 -11.805 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.876 -3.298 -13.117 1.00 0.00 H new ATOM 0 HB3 LEU A 77 3.388 -3.291 -12.230 1.00 0.00 H new ATOM 0 HG LEU A 77 3.464 -4.349 -15.043 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.663 -2.043 -15.938 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.055 -2.313 -15.224 1.00 0.00 H new ATOM 0 HD13 LEU A 77 3.282 -1.385 -14.329 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.665 -3.199 -14.986 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.278 -2.537 -13.380 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.482 -4.292 -13.594 1.00 0.00 H new ATOM 775 N ASN A 78 0.593 -6.261 -13.388 1.00 0.00 N ATOM 776 CA ASN A 78 -0.403 -6.867 -14.306 1.00 0.00 C ATOM 777 C ASN A 78 -1.255 -5.757 -14.898 1.00 0.00 C ATOM 778 O ASN A 78 -1.580 -4.799 -14.225 1.00 0.00 O ATOM 779 CB ASN A 78 -1.295 -7.810 -13.515 1.00 0.00 C ATOM 780 CG ASN A 78 -0.423 -8.815 -12.762 1.00 0.00 C ATOM 781 OD1 ASN A 78 0.355 -8.442 -11.909 1.00 0.00 O ATOM 782 ND2 ASN A 78 -0.521 -10.083 -13.046 1.00 0.00 N ATOM 0 H ASN A 78 0.286 -6.174 -12.419 1.00 0.00 H new ATOM 0 HA ASN A 78 0.102 -7.417 -15.100 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -1.909 -7.246 -12.813 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -1.977 -8.333 -14.186 1.00 0.00 H new ATOM 0 HD21 ASN A 78 0.057 -10.763 -12.551 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -1.175 -10.396 -13.763 1.00 0.00 H new ATOM 789 N VAL A 79 -1.614 -5.868 -16.146 1.00 0.00 N ATOM 790 CA VAL A 79 -2.446 -4.805 -16.776 1.00 0.00 C ATOM 791 C VAL A 79 -3.714 -5.425 -17.364 1.00 0.00 C ATOM 792 O VAL A 79 -3.745 -5.832 -18.511 1.00 0.00 O ATOM 793 CB VAL A 79 -1.647 -4.113 -17.881 1.00 0.00 C ATOM 794 CG1 VAL A 79 -2.401 -2.866 -18.336 1.00 0.00 C ATOM 795 CG2 VAL A 79 -0.272 -3.708 -17.340 1.00 0.00 C ATOM 0 H VAL A 79 -1.368 -6.647 -16.756 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.724 -4.070 -16.021 1.00 0.00 H new ATOM 0 HB VAL A 79 -1.518 -4.793 -18.723 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.837 -2.367 -19.124 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.381 -3.152 -18.717 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -2.524 -2.187 -17.492 1.00 0.00 H new ATOM 0 HG21 VAL A 79 0.298 -3.215 -18.127 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.398 -3.024 -16.501 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.264 -4.597 -17.007 1.00 0.00 H new ATOM 805 N THR A 80 -4.759 -5.497 -16.581 1.00 0.00 N ATOM 806 CA THR A 80 -6.036 -6.086 -17.076 1.00 0.00 C ATOM 807 C THR A 80 -6.774 -5.052 -17.927 1.00 0.00 C ATOM 808 O THR A 80 -7.484 -4.208 -17.413 1.00 0.00 O ATOM 809 CB THR A 80 -6.910 -6.485 -15.880 1.00 0.00 C ATOM 810 OG1 THR A 80 -6.197 -7.403 -15.063 1.00 0.00 O ATOM 811 CG2 THR A 80 -8.203 -7.138 -16.374 1.00 0.00 C ATOM 0 H THR A 80 -4.781 -5.171 -15.615 1.00 0.00 H new ATOM 0 HA THR A 80 -5.823 -6.968 -17.680 1.00 0.00 H new ATOM 0 HB THR A 80 -7.158 -5.595 -15.302 1.00 0.00 H new ATOM 0 HG1 THR A 80 -5.750 -6.917 -14.339 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.818 -7.419 -15.519 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.751 -6.433 -17.000 1.00 0.00 H new ATOM 0 HG23 THR A 80 -7.962 -8.028 -16.955 1.00 0.00 H new ATOM 819 N LEU A 81 -6.616 -5.116 -19.224 1.00 0.00 N ATOM 820 CA LEU A 81 -7.310 -4.149 -20.114 1.00 0.00 C ATOM 821 C LEU A 81 -8.722 -4.684 -20.417 1.00 0.00 C ATOM 822 O LEU A 81 -8.883 -5.869 -20.628 1.00 0.00 O ATOM 823 CB LEU A 81 -6.523 -4.021 -21.417 1.00 0.00 C ATOM 824 CG LEU A 81 -5.187 -3.328 -21.144 1.00 0.00 C ATOM 825 CD1 LEU A 81 -4.149 -3.802 -22.163 1.00 0.00 C ATOM 826 CD2 LEU A 81 -5.365 -1.812 -21.263 1.00 0.00 C ATOM 0 H LEU A 81 -6.032 -5.801 -19.703 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.380 -3.173 -19.633 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.351 -5.007 -21.848 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.098 -3.450 -22.146 1.00 0.00 H new ATOM 0 HG LEU A 81 -4.848 -3.576 -20.138 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.197 -3.308 -21.969 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.022 -4.881 -22.078 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.487 -3.555 -23.169 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.413 -1.318 -21.069 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.704 -1.563 -22.269 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.104 -1.474 -20.537 1.00 0.00 H new ATOM 838 N PRO A 82 -9.712 -3.811 -20.431 1.00 0.00 N ATOM 839 CA PRO A 82 -11.134 -4.194 -20.705 1.00 0.00 C ATOM 840 C PRO A 82 -11.373 -4.345 -22.209 1.00 0.00 C ATOM 841 O PRO A 82 -10.454 -4.270 -23.003 1.00 0.00 O ATOM 842 CB PRO A 82 -11.936 -3.035 -20.131 1.00 0.00 C ATOM 843 CG PRO A 82 -11.022 -1.825 -20.106 1.00 0.00 C ATOM 844 CD PRO A 82 -9.582 -2.329 -20.184 1.00 0.00 C ATOM 0 HA PRO A 82 -11.411 -5.152 -20.264 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -12.818 -2.838 -20.741 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -12.289 -3.271 -19.127 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -11.241 -1.163 -20.943 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -11.176 -1.248 -19.194 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -9.033 -1.839 -20.989 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -9.040 -2.127 -19.260 1.00 0.00 H new ATOM 976 N SER B 32 1.461 -10.554 -31.880 1.00 0.00 N ATOM 977 CA SER B 32 0.036 -10.426 -31.458 1.00 0.00 C ATOM 978 C SER B 32 -0.217 -9.031 -30.877 1.00 0.00 C ATOM 979 O SER B 32 -1.340 -8.561 -30.851 1.00 0.00 O ATOM 980 CB SER B 32 -0.278 -11.477 -30.395 1.00 0.00 C ATOM 981 OG SER B 32 0.358 -12.700 -30.740 1.00 0.00 O ATOM 0 HA SER B 32 -0.605 -10.576 -32.327 1.00 0.00 H new ATOM 0 HB2 SER B 32 0.067 -11.137 -29.419 1.00 0.00 H new ATOM 0 HB3 SER B 32 -1.355 -11.623 -30.319 1.00 0.00 H new ATOM 0 HG SER B 32 1.141 -12.515 -31.299 1.00 0.00 H new ATOM 987 N ASP B 33 0.814 -8.365 -30.412 1.00 0.00 N ATOM 988 CA ASP B 33 0.630 -7.005 -29.835 1.00 0.00 C ATOM 989 C ASP B 33 0.666 -5.936 -30.938 1.00 0.00 C ATOM 990 O ASP B 33 0.734 -4.758 -30.652 1.00 0.00 O ATOM 991 CB ASP B 33 1.739 -6.721 -28.821 1.00 0.00 C ATOM 992 CG ASP B 33 3.104 -6.934 -29.479 1.00 0.00 C ATOM 993 OD1 ASP B 33 3.363 -8.045 -29.913 1.00 0.00 O ATOM 994 OD2 ASP B 33 3.866 -5.983 -29.538 1.00 0.00 O ATOM 0 H ASP B 33 1.774 -8.709 -30.409 1.00 0.00 H new ATOM 0 HA ASP B 33 -0.342 -6.969 -29.342 1.00 0.00 H new ATOM 0 HB2 ASP B 33 1.657 -5.698 -28.454 1.00 0.00 H new ATOM 0 HB3 ASP B 33 1.634 -7.379 -27.958 1.00 0.00 H new ATOM 999 N ALA B 34 0.617 -6.330 -32.189 1.00 0.00 N ATOM 1000 CA ALA B 34 0.636 -5.333 -33.293 1.00 0.00 C ATOM 1001 C ALA B 34 -0.802 -4.940 -33.673 1.00 0.00 C ATOM 1002 O ALA B 34 -1.016 -4.010 -34.427 1.00 0.00 O ATOM 1003 CB ALA B 34 1.334 -5.942 -34.508 1.00 0.00 C ATOM 0 H ALA B 34 0.565 -7.304 -32.488 1.00 0.00 H new ATOM 0 HA ALA B 34 1.173 -4.443 -32.965 1.00 0.00 H new ATOM 0 HB1 ALA B 34 1.351 -5.215 -35.320 1.00 0.00 H new ATOM 0 HB2 ALA B 34 2.356 -6.213 -34.243 1.00 0.00 H new ATOM 0 HB3 ALA B 34 0.794 -6.833 -34.829 1.00 0.00 H new ATOM 1009 N GLU B 35 -1.790 -5.645 -33.166 1.00 0.00 N ATOM 1010 CA GLU B 35 -3.208 -5.323 -33.501 1.00 0.00 C ATOM 1011 C GLU B 35 -3.611 -3.930 -32.969 1.00 0.00 C ATOM 1012 O GLU B 35 -4.258 -3.189 -33.681 1.00 0.00 O ATOM 1013 CB GLU B 35 -4.140 -6.389 -32.907 1.00 0.00 C ATOM 1014 CG GLU B 35 -3.670 -7.788 -33.327 1.00 0.00 C ATOM 1015 CD GLU B 35 -4.501 -8.274 -34.517 1.00 0.00 C ATOM 1016 OE1 GLU B 35 -4.229 -7.835 -35.623 1.00 0.00 O ATOM 1017 OE2 GLU B 35 -5.395 -9.076 -34.302 1.00 0.00 O ATOM 0 H GLU B 35 -1.668 -6.434 -32.531 1.00 0.00 H new ATOM 0 HA GLU B 35 -3.302 -5.314 -34.587 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -4.150 -6.311 -31.820 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -5.162 -6.222 -33.248 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -2.614 -7.762 -33.595 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -3.771 -8.482 -32.493 1.00 0.00 H new ATOM 1024 N PRO B 36 -3.244 -3.593 -31.741 1.00 0.00 N ATOM 1025 CA PRO B 36 -3.593 -2.273 -31.123 1.00 0.00 C ATOM 1026 C PRO B 36 -2.572 -1.197 -31.509 1.00 0.00 C ATOM 1027 O PRO B 36 -2.927 -0.071 -31.799 1.00 0.00 O ATOM 1028 CB PRO B 36 -3.544 -2.560 -29.628 1.00 0.00 C ATOM 1029 CG PRO B 36 -2.627 -3.752 -29.425 1.00 0.00 C ATOM 1030 CD PRO B 36 -2.437 -4.434 -30.781 1.00 0.00 C ATOM 0 HA PRO B 36 -4.560 -1.892 -31.452 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -3.172 -1.693 -29.083 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -4.542 -2.774 -29.245 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -1.667 -3.431 -29.022 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -3.059 -4.447 -28.705 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -1.386 -4.464 -31.067 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -2.792 -5.464 -30.761 1.00 0.00 H new ATOM 1038 N HIS B 37 -1.303 -1.535 -31.503 1.00 0.00 N ATOM 1039 CA HIS B 37 -0.227 -0.548 -31.856 1.00 0.00 C ATOM 1040 C HIS B 37 -0.020 0.472 -30.720 1.00 0.00 C ATOM 1041 O HIS B 37 0.805 1.359 -30.829 1.00 0.00 O ATOM 1042 CB HIS B 37 -0.578 0.194 -33.155 1.00 0.00 C ATOM 1043 CG HIS B 37 0.684 0.528 -33.901 1.00 0.00 C ATOM 1044 ND1 HIS B 37 0.993 1.823 -34.287 1.00 0.00 N ATOM 1045 CD2 HIS B 37 1.724 -0.253 -34.341 1.00 0.00 C ATOM 1046 CE1 HIS B 37 2.175 1.783 -34.928 1.00 0.00 C ATOM 1047 NE2 HIS B 37 2.665 0.542 -34.989 1.00 0.00 N ATOM 0 H HIS B 37 -0.961 -2.466 -31.265 1.00 0.00 H new ATOM 0 HA HIS B 37 0.699 -1.105 -32.001 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -1.226 -0.425 -33.775 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -1.130 1.106 -32.927 1.00 0.00 H new ATOM 0 HD2 HIS B 37 1.800 -1.322 -34.205 1.00 0.00 H new ATOM 0 HE1 HIS B 37 2.668 2.650 -35.343 1.00 0.00 H new ATOM 0 HE2 HIS B 37 3.540 0.242 -35.418 1.00 0.00 H new ATOM 1055 N TYR B 38 -0.740 0.348 -29.628 1.00 0.00 N ATOM 1056 CA TYR B 38 -0.559 1.301 -28.491 1.00 0.00 C ATOM 1057 C TYR B 38 -0.162 0.510 -27.242 1.00 0.00 C ATOM 1058 O TYR B 38 0.643 0.952 -26.444 1.00 0.00 O ATOM 1059 CB TYR B 38 -1.857 2.075 -28.227 1.00 0.00 C ATOM 1060 CG TYR B 38 -3.038 1.132 -28.194 1.00 0.00 C ATOM 1061 CD1 TYR B 38 -3.356 0.446 -27.015 1.00 0.00 C ATOM 1062 CD2 TYR B 38 -3.820 0.952 -29.341 1.00 0.00 C ATOM 1063 CE1 TYR B 38 -4.456 -0.420 -26.986 1.00 0.00 C ATOM 1064 CE2 TYR B 38 -4.920 0.086 -29.311 1.00 0.00 C ATOM 1065 CZ TYR B 38 -5.239 -0.600 -28.133 1.00 0.00 C ATOM 1066 OH TYR B 38 -6.323 -1.452 -28.103 1.00 0.00 O ATOM 0 H TYR B 38 -1.445 -0.374 -29.478 1.00 0.00 H new ATOM 0 HA TYR B 38 0.222 2.018 -28.742 1.00 0.00 H new ATOM 0 HB2 TYR B 38 -1.783 2.608 -27.279 1.00 0.00 H new ATOM 0 HB3 TYR B 38 -2.005 2.825 -29.004 1.00 0.00 H new ATOM 0 HD1 TYR B 38 -2.754 0.585 -26.129 1.00 0.00 H new ATOM 0 HD2 TYR B 38 -3.575 1.481 -30.250 1.00 0.00 H new ATOM 0 HE1 TYR B 38 -4.701 -0.950 -26.077 1.00 0.00 H new ATOM 0 HE2 TYR B 38 -5.522 -0.053 -30.197 1.00 0.00 H new ATOM 0 HH TYR B 38 -6.757 -1.460 -28.982 1.00 0.00 H new ATOM 1076 N LEU B 39 -0.710 -0.669 -27.077 1.00 0.00 N ATOM 1077 CA LEU B 39 -0.368 -1.521 -25.898 1.00 0.00 C ATOM 1078 C LEU B 39 1.165 -1.664 -25.751 1.00 0.00 C ATOM 1079 O LEU B 39 1.691 -1.437 -24.676 1.00 0.00 O ATOM 1080 CB LEU B 39 -1.001 -2.910 -26.087 1.00 0.00 C ATOM 1081 CG LEU B 39 -1.876 -3.271 -24.874 1.00 0.00 C ATOM 1082 CD1 LEU B 39 -1.049 -3.211 -23.583 1.00 0.00 C ATOM 1083 CD2 LEU B 39 -3.043 -2.281 -24.776 1.00 0.00 C ATOM 0 H LEU B 39 -1.388 -1.081 -27.718 1.00 0.00 H new ATOM 0 HA LEU B 39 -0.756 -1.051 -24.995 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -1.604 -2.921 -26.995 1.00 0.00 H new ATOM 0 HB3 LEU B 39 -0.219 -3.659 -26.215 1.00 0.00 H new ATOM 0 HG LEU B 39 -2.258 -4.284 -25.003 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -1.681 -3.469 -22.733 1.00 0.00 H new ATOM 0 HD12 LEU B 39 -0.222 -3.918 -23.647 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -0.655 -2.203 -23.450 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -3.664 -2.535 -23.917 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -2.653 -1.270 -24.656 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -3.642 -2.333 -25.685 1.00 0.00 H new ATOM 1095 N PRO B 40 1.853 -2.025 -26.823 1.00 0.00 N ATOM 1096 CA PRO B 40 3.342 -2.190 -26.807 1.00 0.00 C ATOM 1097 C PRO B 40 4.032 -0.820 -26.769 1.00 0.00 C ATOM 1098 O PRO B 40 5.180 -0.705 -26.375 1.00 0.00 O ATOM 1099 CB PRO B 40 3.645 -2.948 -28.091 1.00 0.00 C ATOM 1100 CG PRO B 40 2.495 -2.694 -29.040 1.00 0.00 C ATOM 1101 CD PRO B 40 1.280 -2.313 -28.193 1.00 0.00 C ATOM 0 HA PRO B 40 3.707 -2.724 -25.929 1.00 0.00 H new ATOM 0 HB2 PRO B 40 4.585 -2.609 -28.526 1.00 0.00 H new ATOM 0 HB3 PRO B 40 3.752 -4.014 -27.893 1.00 0.00 H new ATOM 0 HG2 PRO B 40 2.743 -1.894 -29.738 1.00 0.00 H new ATOM 0 HG3 PRO B 40 2.285 -3.583 -29.635 1.00 0.00 H new ATOM 0 HD2 PRO B 40 0.768 -1.441 -28.601 1.00 0.00 H new ATOM 0 HD3 PRO B 40 0.551 -3.123 -28.157 1.00 0.00 H new ATOM 1109 N GLN B 41 3.333 0.222 -27.145 1.00 0.00 N ATOM 1110 CA GLN B 41 3.932 1.583 -27.094 1.00 0.00 C ATOM 1111 C GLN B 41 4.019 1.999 -25.623 1.00 0.00 C ATOM 1112 O GLN B 41 4.944 2.674 -25.201 1.00 0.00 O ATOM 1113 CB GLN B 41 3.034 2.559 -27.866 1.00 0.00 C ATOM 1114 CG GLN B 41 3.606 3.978 -27.791 1.00 0.00 C ATOM 1115 CD GLN B 41 4.946 4.028 -28.528 1.00 0.00 C ATOM 1116 OE1 GLN B 41 5.089 3.458 -29.591 1.00 0.00 O ATOM 1117 NE2 GLN B 41 5.940 4.692 -28.005 1.00 0.00 N ATOM 0 H GLN B 41 2.372 0.185 -27.485 1.00 0.00 H new ATOM 0 HA GLN B 41 4.924 1.591 -27.545 1.00 0.00 H new ATOM 0 HB2 GLN B 41 2.955 2.246 -28.907 1.00 0.00 H new ATOM 0 HB3 GLN B 41 2.026 2.543 -27.451 1.00 0.00 H new ATOM 0 HG2 GLN B 41 2.908 4.687 -28.236 1.00 0.00 H new ATOM 0 HG3 GLN B 41 3.740 4.273 -26.750 1.00 0.00 H new ATOM 0 HE21 GLN B 41 5.820 5.171 -27.112 1.00 0.00 H new ATOM 0 HE22 GLN B 41 6.837 4.732 -28.489 1.00 0.00 H new ATOM 1126 N LEU B 42 3.056 1.590 -24.840 1.00 0.00 N ATOM 1127 CA LEU B 42 3.058 1.944 -23.405 1.00 0.00 C ATOM 1128 C LEU B 42 4.141 1.143 -22.688 1.00 0.00 C ATOM 1129 O LEU B 42 5.005 1.700 -22.053 1.00 0.00 O ATOM 1130 CB LEU B 42 1.688 1.619 -22.783 1.00 0.00 C ATOM 1131 CG LEU B 42 0.517 2.494 -23.340 1.00 0.00 C ATOM 1132 CD1 LEU B 42 0.938 3.427 -24.492 1.00 0.00 C ATOM 1133 CD2 LEU B 42 -0.600 1.575 -23.843 1.00 0.00 C ATOM 0 H LEU B 42 2.265 1.022 -25.143 1.00 0.00 H new ATOM 0 HA LEU B 42 3.257 3.011 -23.299 1.00 0.00 H new ATOM 0 HB2 LEU B 42 1.459 0.568 -22.960 1.00 0.00 H new ATOM 0 HB3 LEU B 42 1.748 1.755 -21.703 1.00 0.00 H new ATOM 0 HG LEU B 42 0.183 3.127 -22.518 1.00 0.00 H new ATOM 0 HD11 LEU B 42 0.075 4.003 -24.828 1.00 0.00 H new ATOM 0 HD12 LEU B 42 1.715 4.107 -24.144 1.00 0.00 H new ATOM 0 HD13 LEU B 42 1.322 2.832 -25.321 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -1.420 2.178 -24.233 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -0.214 0.933 -24.635 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -0.962 0.959 -23.020 1.00 0.00 H new ATOM 1145 N ARG B 43 4.102 -0.169 -22.781 1.00 0.00 N ATOM 1146 CA ARG B 43 5.131 -1.016 -22.087 1.00 0.00 C ATOM 1147 C ARG B 43 6.546 -0.488 -22.363 1.00 0.00 C ATOM 1148 O ARG B 43 7.363 -0.384 -21.461 1.00 0.00 O ATOM 1149 CB ARG B 43 5.003 -2.475 -22.552 1.00 0.00 C ATOM 1150 CG ARG B 43 5.428 -2.629 -24.016 1.00 0.00 C ATOM 1151 CD ARG B 43 5.227 -4.080 -24.460 1.00 0.00 C ATOM 1152 NE ARG B 43 6.469 -4.863 -24.179 1.00 0.00 N ATOM 1153 CZ ARG B 43 6.698 -6.023 -24.763 1.00 0.00 C ATOM 1154 NH1 ARG B 43 5.841 -6.549 -25.610 1.00 0.00 N ATOM 1155 NH2 ARG B 43 7.800 -6.667 -24.491 1.00 0.00 N ATOM 0 H ARG B 43 3.401 -0.690 -23.308 1.00 0.00 H new ATOM 0 HA ARG B 43 4.956 -0.968 -21.012 1.00 0.00 H new ATOM 0 HB2 ARG B 43 5.620 -3.116 -21.922 1.00 0.00 H new ATOM 0 HB3 ARG B 43 3.972 -2.808 -22.433 1.00 0.00 H new ATOM 0 HG2 ARG B 43 4.842 -1.961 -24.647 1.00 0.00 H new ATOM 0 HG3 ARG B 43 6.473 -2.344 -24.133 1.00 0.00 H new ATOM 0 HD2 ARG B 43 4.380 -4.519 -23.933 1.00 0.00 H new ATOM 0 HD3 ARG B 43 4.994 -4.117 -25.524 1.00 0.00 H new ATOM 0 HE ARG B 43 7.154 -4.492 -23.521 1.00 0.00 H new ATOM 0 HH11 ARG B 43 4.974 -6.058 -25.829 1.00 0.00 H new ATOM 0 HH12 ARG B 43 6.043 -7.448 -26.048 1.00 0.00 H new ATOM 0 HH21 ARG B 43 8.472 -6.272 -23.833 1.00 0.00 H new ATOM 0 HH22 ARG B 43 7.989 -7.565 -24.936 1.00 0.00 H new ATOM 1169 N LYS B 44 6.838 -0.138 -23.593 1.00 0.00 N ATOM 1170 CA LYS B 44 8.184 0.388 -23.892 1.00 0.00 C ATOM 1171 C LYS B 44 8.351 1.735 -23.183 1.00 0.00 C ATOM 1172 O LYS B 44 9.441 2.104 -22.798 1.00 0.00 O ATOM 1173 CB LYS B 44 8.377 0.540 -25.407 1.00 0.00 C ATOM 1174 CG LYS B 44 7.410 1.584 -25.970 1.00 0.00 C ATOM 1175 CD LYS B 44 7.750 1.865 -27.437 1.00 0.00 C ATOM 1176 CE LYS B 44 7.515 0.604 -28.272 1.00 0.00 C ATOM 1177 NZ LYS B 44 6.990 0.988 -29.614 1.00 0.00 N ATOM 0 H LYS B 44 6.202 -0.197 -24.388 1.00 0.00 H new ATOM 0 HA LYS B 44 8.942 -0.308 -23.532 1.00 0.00 H new ATOM 0 HB2 LYS B 44 9.404 0.835 -25.621 1.00 0.00 H new ATOM 0 HB3 LYS B 44 8.212 -0.419 -25.898 1.00 0.00 H new ATOM 0 HG2 LYS B 44 6.384 1.226 -25.887 1.00 0.00 H new ATOM 0 HG3 LYS B 44 7.474 2.504 -25.389 1.00 0.00 H new ATOM 0 HD2 LYS B 44 7.134 2.682 -27.813 1.00 0.00 H new ATOM 0 HD3 LYS B 44 8.789 2.183 -27.525 1.00 0.00 H new ATOM 0 HE2 LYS B 44 8.446 0.047 -28.379 1.00 0.00 H new ATOM 0 HE3 LYS B 44 6.807 -0.053 -27.767 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 6.460 0.191 -30.021 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 6.360 1.810 -29.518 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 7.784 1.232 -30.240 1.00 0.00 H new ATOM 1191 N ASP B 45 7.269 2.465 -22.989 1.00 0.00 N ATOM 1192 CA ASP B 45 7.374 3.773 -22.290 1.00 0.00 C ATOM 1193 C ASP B 45 7.872 3.540 -20.860 1.00 0.00 C ATOM 1194 O ASP B 45 8.783 4.201 -20.413 1.00 0.00 O ATOM 1195 CB ASP B 45 6.013 4.472 -22.259 1.00 0.00 C ATOM 1196 CG ASP B 45 5.594 4.847 -23.682 1.00 0.00 C ATOM 1197 OD1 ASP B 45 6.468 5.160 -24.473 1.00 0.00 O ATOM 1198 OD2 ASP B 45 4.405 4.814 -23.956 1.00 0.00 O ATOM 0 H ASP B 45 6.329 2.205 -23.286 1.00 0.00 H new ATOM 0 HA ASP B 45 8.078 4.410 -22.826 1.00 0.00 H new ATOM 0 HB2 ASP B 45 5.267 3.816 -21.811 1.00 0.00 H new ATOM 0 HB3 ASP B 45 6.066 5.366 -21.638 1.00 0.00 H new ATOM 1203 N ILE B 46 7.292 2.599 -20.140 1.00 0.00 N ATOM 1204 CA ILE B 46 7.757 2.334 -18.741 1.00 0.00 C ATOM 1205 C ILE B 46 9.252 1.976 -18.759 1.00 0.00 C ATOM 1206 O ILE B 46 9.995 2.344 -17.870 1.00 0.00 O ATOM 1207 CB ILE B 46 6.901 1.217 -18.091 1.00 0.00 C ATOM 1208 CG1 ILE B 46 6.900 1.427 -16.575 1.00 0.00 C ATOM 1209 CG2 ILE B 46 7.427 -0.193 -18.406 1.00 0.00 C ATOM 1210 CD1 ILE B 46 6.182 2.732 -16.230 1.00 0.00 C ATOM 0 H ILE B 46 6.524 2.010 -20.461 1.00 0.00 H new ATOM 0 HA ILE B 46 7.630 3.230 -18.134 1.00 0.00 H new ATOM 0 HB ILE B 46 5.894 1.284 -18.504 1.00 0.00 H new ATOM 0 HG12 ILE B 46 6.406 0.589 -16.084 1.00 0.00 H new ATOM 0 HG13 ILE B 46 7.924 1.456 -16.203 1.00 0.00 H new ATOM 0 HG21 ILE B 46 6.789 -0.935 -17.925 1.00 0.00 H new ATOM 0 HG22 ILE B 46 7.419 -0.352 -19.484 1.00 0.00 H new ATOM 0 HG23 ILE B 46 8.446 -0.293 -18.032 1.00 0.00 H new ATOM 0 HD11 ILE B 46 6.185 2.874 -15.149 1.00 0.00 H new ATOM 0 HD12 ILE B 46 6.695 3.567 -16.708 1.00 0.00 H new ATOM 0 HD13 ILE B 46 5.153 2.686 -16.587 1.00 0.00 H new ATOM 1222 N LEU B 47 9.697 1.277 -19.780 1.00 0.00 N ATOM 1223 CA LEU B 47 11.141 0.917 -19.871 1.00 0.00 C ATOM 1224 C LEU B 47 11.967 2.207 -19.913 1.00 0.00 C ATOM 1225 O LEU B 47 12.921 2.376 -19.173 1.00 0.00 O ATOM 1226 CB LEU B 47 11.384 0.112 -21.149 1.00 0.00 C ATOM 1227 CG LEU B 47 10.982 -1.347 -20.925 1.00 0.00 C ATOM 1228 CD1 LEU B 47 10.625 -1.990 -22.267 1.00 0.00 C ATOM 1229 CD2 LEU B 47 12.151 -2.106 -20.293 1.00 0.00 C ATOM 0 H LEU B 47 9.119 0.943 -20.551 1.00 0.00 H new ATOM 0 HA LEU B 47 11.432 0.318 -19.008 1.00 0.00 H new ATOM 0 HB2 LEU B 47 10.808 0.536 -21.972 1.00 0.00 H new ATOM 0 HB3 LEU B 47 12.435 0.170 -21.432 1.00 0.00 H new ATOM 0 HG LEU B 47 10.119 -1.388 -20.261 1.00 0.00 H new ATOM 0 HD11 LEU B 47 10.339 -3.030 -22.108 1.00 0.00 H new ATOM 0 HD12 LEU B 47 9.793 -1.450 -22.720 1.00 0.00 H new ATOM 0 HD13 LEU B 47 11.488 -1.949 -22.931 1.00 0.00 H new ATOM 0 HD21 LEU B 47 11.866 -3.146 -20.133 1.00 0.00 H new ATOM 0 HD22 LEU B 47 13.014 -2.065 -20.958 1.00 0.00 H new ATOM 0 HD23 LEU B 47 12.407 -1.649 -19.337 1.00 0.00 H new ATOM 1241 N GLU B 48 11.580 3.126 -20.761 1.00 0.00 N ATOM 1242 CA GLU B 48 12.309 4.420 -20.849 1.00 0.00 C ATOM 1243 C GLU B 48 12.058 5.193 -19.570 1.00 0.00 C ATOM 1244 O GLU B 48 12.936 5.843 -19.038 1.00 0.00 O ATOM 1245 CB GLU B 48 11.793 5.257 -22.023 1.00 0.00 C ATOM 1246 CG GLU B 48 11.704 4.409 -23.287 1.00 0.00 C ATOM 1247 CD GLU B 48 13.098 3.920 -23.686 1.00 0.00 C ATOM 1248 OE1 GLU B 48 13.569 2.975 -23.076 1.00 0.00 O ATOM 1249 OE2 GLU B 48 13.670 4.499 -24.595 1.00 0.00 O ATOM 0 H GLU B 48 10.788 3.032 -21.397 1.00 0.00 H new ATOM 0 HA GLU B 48 13.371 4.220 -20.995 1.00 0.00 H new ATOM 0 HB2 GLU B 48 10.811 5.665 -21.782 1.00 0.00 H new ATOM 0 HB3 GLU B 48 12.457 6.104 -22.193 1.00 0.00 H new ATOM 0 HG2 GLU B 48 11.045 3.557 -23.118 1.00 0.00 H new ATOM 0 HG3 GLU B 48 11.268 4.993 -24.097 1.00 0.00 H new ATOM 1256 N VAL B 49 10.848 5.125 -19.071 1.00 0.00 N ATOM 1257 CA VAL B 49 10.509 5.853 -17.821 1.00 0.00 C ATOM 1258 C VAL B 49 11.441 5.369 -16.707 1.00 0.00 C ATOM 1259 O VAL B 49 12.171 6.142 -16.130 1.00 0.00 O ATOM 1260 CB VAL B 49 9.041 5.596 -17.444 1.00 0.00 C ATOM 1261 CG1 VAL B 49 8.697 6.326 -16.135 1.00 0.00 C ATOM 1262 CG2 VAL B 49 8.130 6.107 -18.569 1.00 0.00 C ATOM 0 H VAL B 49 10.081 4.593 -19.482 1.00 0.00 H new ATOM 0 HA VAL B 49 10.639 6.925 -17.966 1.00 0.00 H new ATOM 0 HB VAL B 49 8.890 4.526 -17.305 1.00 0.00 H new ATOM 0 HG11 VAL B 49 7.655 6.138 -15.876 1.00 0.00 H new ATOM 0 HG12 VAL B 49 9.341 5.961 -15.335 1.00 0.00 H new ATOM 0 HG13 VAL B 49 8.851 7.397 -16.265 1.00 0.00 H new ATOM 0 HG21 VAL B 49 7.088 5.926 -18.304 1.00 0.00 H new ATOM 0 HG22 VAL B 49 8.288 7.176 -18.708 1.00 0.00 H new ATOM 0 HG23 VAL B 49 8.366 5.582 -19.495 1.00 0.00 H new ATOM 1272 N ILE B 50 11.456 4.083 -16.432 1.00 0.00 N ATOM 1273 CA ILE B 50 12.384 3.553 -15.381 1.00 0.00 C ATOM 1274 C ILE B 50 13.818 3.992 -15.721 1.00 0.00 C ATOM 1275 O ILE B 50 14.660 4.117 -14.855 1.00 0.00 O ATOM 1276 CB ILE B 50 12.297 2.022 -15.333 1.00 0.00 C ATOM 1277 CG1 ILE B 50 10.855 1.606 -15.031 1.00 0.00 C ATOM 1278 CG2 ILE B 50 13.216 1.486 -14.232 1.00 0.00 C ATOM 1279 CD1 ILE B 50 10.592 0.217 -15.614 1.00 0.00 C ATOM 0 H ILE B 50 10.870 3.383 -16.887 1.00 0.00 H new ATOM 0 HA ILE B 50 12.103 3.946 -14.404 1.00 0.00 H new ATOM 0 HB ILE B 50 12.607 1.613 -16.295 1.00 0.00 H new ATOM 0 HG12 ILE B 50 10.685 1.598 -13.954 1.00 0.00 H new ATOM 0 HG13 ILE B 50 10.160 2.329 -15.458 1.00 0.00 H new ATOM 0 HG21 ILE B 50 13.151 0.398 -14.201 1.00 0.00 H new ATOM 0 HG22 ILE B 50 14.244 1.782 -14.440 1.00 0.00 H new ATOM 0 HG23 ILE B 50 12.908 1.895 -13.270 1.00 0.00 H new ATOM 0 HD11 ILE B 50 9.565 -0.079 -15.399 1.00 0.00 H new ATOM 0 HD12 ILE B 50 10.745 0.240 -16.693 1.00 0.00 H new ATOM 0 HD13 ILE B 50 11.278 -0.502 -15.166 1.00 0.00 H new ATOM 1291 N CYS B 51 14.084 4.246 -16.984 1.00 0.00 N ATOM 1292 CA CYS B 51 15.436 4.701 -17.393 1.00 0.00 C ATOM 1293 C CYS B 51 15.617 6.173 -16.995 1.00 0.00 C ATOM 1294 O CYS B 51 16.625 6.555 -16.440 1.00 0.00 O ATOM 1295 CB CYS B 51 15.582 4.559 -18.911 1.00 0.00 C ATOM 1296 SG CYS B 51 17.336 4.433 -19.340 1.00 0.00 S ATOM 0 H CYS B 51 13.412 4.154 -17.746 1.00 0.00 H new ATOM 0 HA CYS B 51 16.194 4.094 -16.898 1.00 0.00 H new ATOM 0 HB2 CYS B 51 15.048 3.674 -19.257 1.00 0.00 H new ATOM 0 HB3 CYS B 51 15.135 5.418 -19.412 1.00 0.00 H new ATOM 0 HG CYS B 51 17.460 4.310 -20.628 1.00 0.00 H new ATOM 1302 N LYS B 52 14.641 7.000 -17.277 1.00 0.00 N ATOM 1303 CA LYS B 52 14.749 8.455 -16.924 1.00 0.00 C ATOM 1304 C LYS B 52 15.005 8.619 -15.425 1.00 0.00 C ATOM 1305 O LYS B 52 15.673 9.541 -14.996 1.00 0.00 O ATOM 1306 CB LYS B 52 13.443 9.175 -17.268 1.00 0.00 C ATOM 1307 CG LYS B 52 13.128 9.031 -18.756 1.00 0.00 C ATOM 1308 CD LYS B 52 11.635 9.290 -18.976 1.00 0.00 C ATOM 1309 CE LYS B 52 11.421 10.754 -19.365 1.00 0.00 C ATOM 1310 NZ LYS B 52 11.980 10.993 -20.725 1.00 0.00 N ATOM 0 H LYS B 52 13.771 6.732 -17.737 1.00 0.00 H new ATOM 0 HA LYS B 52 15.576 8.882 -17.491 1.00 0.00 H new ATOM 0 HB2 LYS B 52 12.626 8.762 -16.676 1.00 0.00 H new ATOM 0 HB3 LYS B 52 13.523 10.230 -17.008 1.00 0.00 H new ATOM 0 HG2 LYS B 52 13.722 9.737 -19.337 1.00 0.00 H new ATOM 0 HG3 LYS B 52 13.392 8.032 -19.102 1.00 0.00 H new ATOM 0 HD2 LYS B 52 11.253 8.635 -19.760 1.00 0.00 H new ATOM 0 HD3 LYS B 52 11.078 9.059 -18.068 1.00 0.00 H new ATOM 0 HE2 LYS B 52 10.358 10.994 -19.350 1.00 0.00 H new ATOM 0 HE3 LYS B 52 11.906 11.409 -18.641 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 12.674 11.766 -20.684 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 12.445 10.128 -21.066 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 11.211 11.252 -21.376 1.00 0.00 H new ATOM 1324 N TYR B 53 14.458 7.742 -14.630 1.00 0.00 N ATOM 1325 CA TYR B 53 14.630 7.838 -13.160 1.00 0.00 C ATOM 1326 C TYR B 53 15.673 6.812 -12.679 1.00 0.00 C ATOM 1327 O TYR B 53 16.151 6.890 -11.563 1.00 0.00 O ATOM 1328 CB TYR B 53 13.288 7.531 -12.487 1.00 0.00 C ATOM 1329 CG TYR B 53 12.225 8.537 -12.894 1.00 0.00 C ATOM 1330 CD1 TYR B 53 11.769 8.588 -14.219 1.00 0.00 C ATOM 1331 CD2 TYR B 53 11.674 9.398 -11.940 1.00 0.00 C ATOM 1332 CE1 TYR B 53 10.769 9.492 -14.588 1.00 0.00 C ATOM 1333 CE2 TYR B 53 10.675 10.309 -12.312 1.00 0.00 C ATOM 1334 CZ TYR B 53 10.221 10.352 -13.637 1.00 0.00 C ATOM 1335 OH TYR B 53 9.235 11.244 -14.001 1.00 0.00 O ATOM 0 H TYR B 53 13.892 6.954 -14.944 1.00 0.00 H new ATOM 0 HA TYR B 53 14.969 8.841 -12.902 1.00 0.00 H new ATOM 0 HB2 TYR B 53 12.964 6.526 -12.758 1.00 0.00 H new ATOM 0 HB3 TYR B 53 13.410 7.545 -11.404 1.00 0.00 H new ATOM 0 HD1 TYR B 53 12.193 7.925 -14.959 1.00 0.00 H new ATOM 0 HD2 TYR B 53 12.018 9.361 -10.917 1.00 0.00 H new ATOM 0 HE1 TYR B 53 10.421 9.524 -15.610 1.00 0.00 H new ATOM 0 HE2 TYR B 53 10.255 10.979 -11.576 1.00 0.00 H new ATOM 0 HH TYR B 53 8.963 11.768 -13.219 1.00 0.00 H new ATOM 1345 N VAL B 54 16.018 5.841 -13.500 1.00 0.00 N ATOM 1346 CA VAL B 54 17.015 4.802 -13.075 1.00 0.00 C ATOM 1347 C VAL B 54 17.749 4.291 -14.338 1.00 0.00 C ATOM 1348 O VAL B 54 18.096 5.077 -15.195 1.00 0.00 O ATOM 1349 CB VAL B 54 16.301 3.640 -12.339 1.00 0.00 C ATOM 1350 CG1 VAL B 54 17.304 2.930 -11.426 1.00 0.00 C ATOM 1351 CG2 VAL B 54 15.142 4.158 -11.476 1.00 0.00 C ATOM 0 H VAL B 54 15.652 5.725 -14.445 1.00 0.00 H new ATOM 0 HA VAL B 54 17.737 5.233 -12.382 1.00 0.00 H new ATOM 0 HB VAL B 54 15.905 2.956 -13.089 1.00 0.00 H new ATOM 0 HG11 VAL B 54 16.806 2.112 -10.906 1.00 0.00 H new ATOM 0 HG12 VAL B 54 18.124 2.534 -12.025 1.00 0.00 H new ATOM 0 HG13 VAL B 54 17.697 3.638 -10.696 1.00 0.00 H new ATOM 0 HG21 VAL B 54 14.661 3.320 -10.972 1.00 0.00 H new ATOM 0 HG22 VAL B 54 15.526 4.856 -10.732 1.00 0.00 H new ATOM 0 HG23 VAL B 54 14.415 4.666 -12.110 1.00 0.00 H new ATOM 1361 N GLN B 55 18.000 3.001 -14.474 1.00 0.00 N ATOM 1362 CA GLN B 55 18.703 2.503 -15.694 1.00 0.00 C ATOM 1363 C GLN B 55 18.640 0.974 -15.733 1.00 0.00 C ATOM 1364 O GLN B 55 19.275 0.292 -14.952 1.00 0.00 O ATOM 1365 CB GLN B 55 20.165 2.962 -15.669 1.00 0.00 C ATOM 1366 CG GLN B 55 20.414 3.964 -16.800 1.00 0.00 C ATOM 1367 CD GLN B 55 21.813 4.566 -16.652 1.00 0.00 C ATOM 1368 OE1 GLN B 55 21.966 5.770 -16.602 1.00 0.00 O ATOM 1369 NE2 GLN B 55 22.846 3.773 -16.581 1.00 0.00 N ATOM 0 H GLN B 55 17.748 2.284 -13.794 1.00 0.00 H new ATOM 0 HA GLN B 55 18.217 2.906 -16.583 1.00 0.00 H new ATOM 0 HB2 GLN B 55 20.395 3.421 -14.707 1.00 0.00 H new ATOM 0 HB3 GLN B 55 20.827 2.103 -15.779 1.00 0.00 H new ATOM 0 HG2 GLN B 55 20.321 3.468 -17.766 1.00 0.00 H new ATOM 0 HG3 GLN B 55 19.663 4.753 -16.773 1.00 0.00 H new ATOM 0 HE21 GLN B 55 22.717 2.762 -16.623 1.00 0.00 H new ATOM 0 HE22 GLN B 55 23.783 4.164 -16.483 1.00 0.00 H new ATOM 1378 N ILE B 56 17.878 0.441 -16.648 1.00 0.00 N ATOM 1379 CA ILE B 56 17.752 -1.042 -16.770 1.00 0.00 C ATOM 1380 C ILE B 56 17.712 -1.418 -18.250 1.00 0.00 C ATOM 1381 O ILE B 56 17.550 -0.572 -19.108 1.00 0.00 O ATOM 1382 CB ILE B 56 16.463 -1.527 -16.091 1.00 0.00 C ATOM 1383 CG1 ILE B 56 15.316 -0.543 -16.367 1.00 0.00 C ATOM 1384 CG2 ILE B 56 16.690 -1.638 -14.584 1.00 0.00 C ATOM 1385 CD1 ILE B 56 14.025 -1.323 -16.617 1.00 0.00 C ATOM 0 H ILE B 56 17.331 0.974 -17.324 1.00 0.00 H new ATOM 0 HA ILE B 56 18.606 -1.513 -16.284 1.00 0.00 H new ATOM 0 HB ILE B 56 16.196 -2.504 -16.494 1.00 0.00 H new ATOM 0 HG12 ILE B 56 15.188 0.130 -15.519 1.00 0.00 H new ATOM 0 HG13 ILE B 56 15.553 0.075 -17.233 1.00 0.00 H new ATOM 0 HG21 ILE B 56 15.775 -1.982 -14.103 1.00 0.00 H new ATOM 0 HG22 ILE B 56 17.493 -2.349 -14.388 1.00 0.00 H new ATOM 0 HG23 ILE B 56 16.965 -0.662 -14.185 1.00 0.00 H new ATOM 0 HD11 ILE B 56 13.211 -0.625 -16.813 1.00 0.00 H new ATOM 0 HD12 ILE B 56 14.157 -1.978 -17.478 1.00 0.00 H new ATOM 0 HD13 ILE B 56 13.786 -1.922 -15.738 1.00 0.00 H new ATOM 1397 N ASP B 57 17.851 -2.681 -18.551 1.00 0.00 N ATOM 1398 CA ASP B 57 17.815 -3.123 -19.975 1.00 0.00 C ATOM 1399 C ASP B 57 16.453 -3.769 -20.261 1.00 0.00 C ATOM 1400 O ASP B 57 15.744 -4.120 -19.338 1.00 0.00 O ATOM 1401 CB ASP B 57 18.928 -4.143 -20.220 1.00 0.00 C ATOM 1402 CG ASP B 57 20.222 -3.411 -20.580 1.00 0.00 C ATOM 1403 OD1 ASP B 57 20.140 -2.402 -21.261 1.00 0.00 O ATOM 1404 OD2 ASP B 57 21.274 -3.872 -20.170 1.00 0.00 O ATOM 0 H ASP B 57 17.988 -3.428 -17.870 1.00 0.00 H new ATOM 0 HA ASP B 57 17.962 -2.267 -20.633 1.00 0.00 H new ATOM 0 HB2 ASP B 57 19.079 -4.753 -19.330 1.00 0.00 H new ATOM 0 HB3 ASP B 57 18.644 -4.820 -21.026 1.00 0.00 H new ATOM 1409 N PRO B 58 16.115 -3.923 -21.525 1.00 0.00 N ATOM 1410 CA PRO B 58 14.817 -4.542 -21.943 1.00 0.00 C ATOM 1411 C PRO B 58 14.868 -6.049 -21.708 1.00 0.00 C ATOM 1412 O PRO B 58 13.864 -6.672 -21.413 1.00 0.00 O ATOM 1413 CB PRO B 58 14.704 -4.200 -23.421 1.00 0.00 C ATOM 1414 CG PRO B 58 16.112 -3.949 -23.924 1.00 0.00 C ATOM 1415 CD PRO B 58 16.953 -3.525 -22.717 1.00 0.00 C ATOM 0 HA PRO B 58 13.956 -4.178 -21.382 1.00 0.00 H new ATOM 0 HB2 PRO B 58 14.237 -5.017 -23.972 1.00 0.00 H new ATOM 0 HB3 PRO B 58 14.079 -3.319 -23.567 1.00 0.00 H new ATOM 0 HG2 PRO B 58 16.523 -4.848 -24.383 1.00 0.00 H new ATOM 0 HG3 PRO B 58 16.115 -3.171 -24.688 1.00 0.00 H new ATOM 0 HD2 PRO B 58 17.921 -4.027 -22.709 1.00 0.00 H new ATOM 0 HD3 PRO B 58 17.150 -2.453 -22.725 1.00 0.00 H new ATOM 1423 N GLU B 59 16.036 -6.628 -21.796 1.00 0.00 N ATOM 1424 CA GLU B 59 16.166 -8.088 -21.535 1.00 0.00 C ATOM 1425 C GLU B 59 15.895 -8.357 -20.043 1.00 0.00 C ATOM 1426 O GLU B 59 15.693 -9.487 -19.641 1.00 0.00 O ATOM 1427 CB GLU B 59 17.582 -8.547 -21.887 1.00 0.00 C ATOM 1428 CG GLU B 59 17.698 -8.729 -23.402 1.00 0.00 C ATOM 1429 CD GLU B 59 16.968 -10.006 -23.821 1.00 0.00 C ATOM 1430 OE1 GLU B 59 17.501 -11.077 -23.579 1.00 0.00 O ATOM 1431 OE2 GLU B 59 15.886 -9.892 -24.375 1.00 0.00 O ATOM 0 H GLU B 59 16.905 -6.151 -22.038 1.00 0.00 H new ATOM 0 HA GLU B 59 15.448 -8.636 -22.145 1.00 0.00 H new ATOM 0 HB2 GLU B 59 18.310 -7.813 -21.541 1.00 0.00 H new ATOM 0 HB3 GLU B 59 17.809 -9.484 -21.379 1.00 0.00 H new ATOM 0 HG2 GLU B 59 17.271 -7.868 -23.916 1.00 0.00 H new ATOM 0 HG3 GLU B 59 18.747 -8.785 -23.693 1.00 0.00 H new ATOM 1438 N MET B 60 15.886 -7.326 -19.220 1.00 0.00 N ATOM 1439 CA MET B 60 15.626 -7.518 -17.769 1.00 0.00 C ATOM 1440 C MET B 60 14.120 -7.408 -17.498 1.00 0.00 C ATOM 1441 O MET B 60 13.622 -7.924 -16.514 1.00 0.00 O ATOM 1442 CB MET B 60 16.367 -6.431 -16.983 1.00 0.00 C ATOM 1443 CG MET B 60 17.858 -6.783 -16.884 1.00 0.00 C ATOM 1444 SD MET B 60 18.256 -7.350 -15.208 1.00 0.00 S ATOM 1445 CE MET B 60 18.380 -5.714 -14.443 1.00 0.00 C ATOM 0 H MET B 60 16.050 -6.360 -19.503 1.00 0.00 H new ATOM 0 HA MET B 60 15.976 -8.503 -17.459 1.00 0.00 H new ATOM 0 HB2 MET B 60 16.244 -5.466 -17.475 1.00 0.00 H new ATOM 0 HB3 MET B 60 15.940 -6.336 -15.985 1.00 0.00 H new ATOM 0 HG2 MET B 60 18.105 -7.560 -17.607 1.00 0.00 H new ATOM 0 HG3 MET B 60 18.463 -5.911 -17.134 1.00 0.00 H new ATOM 0 HE1 MET B 60 18.026 -5.766 -13.413 1.00 0.00 H new ATOM 0 HE2 MET B 60 19.419 -5.385 -14.453 1.00 0.00 H new ATOM 0 HE3 MET B 60 17.769 -5.004 -15.001 1.00 0.00 H new ATOM 1455 N VAL B 61 13.396 -6.734 -18.358 1.00 0.00 N ATOM 1456 CA VAL B 61 11.927 -6.579 -18.151 1.00 0.00 C ATOM 1457 C VAL B 61 11.170 -7.616 -18.990 1.00 0.00 C ATOM 1458 O VAL B 61 11.304 -7.663 -20.198 1.00 0.00 O ATOM 1459 CB VAL B 61 11.505 -5.171 -18.578 1.00 0.00 C ATOM 1460 CG1 VAL B 61 10.025 -4.951 -18.257 1.00 0.00 C ATOM 1461 CG2 VAL B 61 12.347 -4.139 -17.823 1.00 0.00 C ATOM 0 H VAL B 61 13.763 -6.284 -19.197 1.00 0.00 H new ATOM 0 HA VAL B 61 11.692 -6.732 -17.098 1.00 0.00 H new ATOM 0 HB VAL B 61 11.660 -5.059 -19.651 1.00 0.00 H new ATOM 0 HG11 VAL B 61 9.732 -3.947 -18.564 1.00 0.00 H new ATOM 0 HG12 VAL B 61 9.423 -5.685 -18.794 1.00 0.00 H new ATOM 0 HG13 VAL B 61 9.864 -5.064 -17.185 1.00 0.00 H new ATOM 0 HG21 VAL B 61 12.049 -3.135 -18.125 1.00 0.00 H new ATOM 0 HG22 VAL B 61 12.191 -4.257 -16.751 1.00 0.00 H new ATOM 0 HG23 VAL B 61 13.401 -4.290 -18.055 1.00 0.00 H new ATOM 1471 N THR B 62 10.373 -8.443 -18.357 1.00 0.00 N ATOM 1472 CA THR B 62 9.601 -9.473 -19.109 1.00 0.00 C ATOM 1473 C THR B 62 8.231 -8.906 -19.481 1.00 0.00 C ATOM 1474 O THR B 62 7.767 -7.949 -18.891 1.00 0.00 O ATOM 1475 CB THR B 62 9.409 -10.720 -18.242 1.00 0.00 C ATOM 1476 OG1 THR B 62 10.598 -10.974 -17.506 1.00 0.00 O ATOM 1477 CG2 THR B 62 9.099 -11.921 -19.138 1.00 0.00 C ATOM 0 H THR B 62 10.226 -8.446 -17.348 1.00 0.00 H new ATOM 0 HA THR B 62 10.150 -9.743 -20.011 1.00 0.00 H new ATOM 0 HB THR B 62 8.582 -10.558 -17.551 1.00 0.00 H new ATOM 0 HG1 THR B 62 10.474 -11.771 -16.950 1.00 0.00 H new ATOM 0 HG21 THR B 62 8.962 -12.809 -18.521 1.00 0.00 H new ATOM 0 HG22 THR B 62 8.187 -11.728 -19.703 1.00 0.00 H new ATOM 0 HG23 THR B 62 9.927 -12.083 -19.829 1.00 0.00 H new ATOM 1485 N VAL B 63 7.581 -9.492 -20.454 1.00 0.00 N ATOM 1486 CA VAL B 63 6.239 -8.996 -20.869 1.00 0.00 C ATOM 1487 C VAL B 63 5.366 -10.181 -21.275 1.00 0.00 C ATOM 1488 O VAL B 63 5.593 -10.807 -22.295 1.00 0.00 O ATOM 1489 CB VAL B 63 6.398 -8.051 -22.058 1.00 0.00 C ATOM 1490 CG1 VAL B 63 5.040 -7.444 -22.425 1.00 0.00 C ATOM 1491 CG2 VAL B 63 7.369 -6.935 -21.684 1.00 0.00 C ATOM 0 H VAL B 63 7.925 -10.296 -20.979 1.00 0.00 H new ATOM 0 HA VAL B 63 5.770 -8.465 -20.040 1.00 0.00 H new ATOM 0 HB VAL B 63 6.784 -8.606 -22.913 1.00 0.00 H new ATOM 0 HG11 VAL B 63 5.160 -6.771 -23.274 1.00 0.00 H new ATOM 0 HG12 VAL B 63 4.345 -8.241 -22.689 1.00 0.00 H new ATOM 0 HG13 VAL B 63 4.648 -6.888 -21.573 1.00 0.00 H new ATOM 0 HG21 VAL B 63 7.487 -6.257 -22.529 1.00 0.00 H new ATOM 0 HG22 VAL B 63 6.978 -6.384 -20.828 1.00 0.00 H new ATOM 0 HG23 VAL B 63 8.337 -7.366 -21.427 1.00 0.00 H new ATOM 1501 N GLN B 64 4.366 -10.490 -20.490 1.00 0.00 N ATOM 1502 CA GLN B 64 3.474 -11.630 -20.833 1.00 0.00 C ATOM 1503 C GLN B 64 2.031 -11.130 -20.948 1.00 0.00 C ATOM 1504 O GLN B 64 1.556 -10.386 -20.113 1.00 0.00 O ATOM 1505 CB GLN B 64 3.575 -12.710 -19.746 1.00 0.00 C ATOM 1506 CG GLN B 64 3.321 -12.092 -18.365 1.00 0.00 C ATOM 1507 CD GLN B 64 4.654 -11.817 -17.668 1.00 0.00 C ATOM 1508 OE1 GLN B 64 5.539 -11.211 -18.241 1.00 0.00 O ATOM 1509 NE2 GLN B 64 4.838 -12.237 -16.446 1.00 0.00 N ATOM 0 H GLN B 64 4.131 -10.000 -19.627 1.00 0.00 H new ATOM 0 HA GLN B 64 3.780 -12.060 -21.787 1.00 0.00 H new ATOM 0 HB2 GLN B 64 2.849 -13.500 -19.939 1.00 0.00 H new ATOM 0 HB3 GLN B 64 4.562 -13.171 -19.771 1.00 0.00 H new ATOM 0 HG2 GLN B 64 2.757 -11.165 -18.469 1.00 0.00 H new ATOM 0 HG3 GLN B 64 2.716 -12.767 -17.760 1.00 0.00 H new ATOM 0 HE21 GLN B 64 4.096 -12.745 -15.964 1.00 0.00 H new ATOM 0 HE22 GLN B 64 5.723 -12.057 -15.973 1.00 0.00 H new ATOM 1518 N LEU B 65 1.335 -11.516 -21.988 1.00 0.00 N ATOM 1519 CA LEU B 65 -0.064 -11.051 -22.164 1.00 0.00 C ATOM 1520 C LEU B 65 -1.037 -12.209 -21.952 1.00 0.00 C ATOM 1521 O LEU B 65 -0.852 -13.295 -22.468 1.00 0.00 O ATOM 1522 CB LEU B 65 -0.237 -10.497 -23.576 1.00 0.00 C ATOM 1523 CG LEU B 65 0.243 -11.530 -24.609 1.00 0.00 C ATOM 1524 CD1 LEU B 65 -0.828 -11.715 -25.688 1.00 0.00 C ATOM 1525 CD2 LEU B 65 1.539 -11.040 -25.261 1.00 0.00 C ATOM 0 H LEU B 65 1.681 -12.135 -22.721 1.00 0.00 H new ATOM 0 HA LEU B 65 -0.275 -10.273 -21.431 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -1.284 -10.252 -23.754 1.00 0.00 H new ATOM 0 HB3 LEU B 65 0.329 -9.572 -23.684 1.00 0.00 H new ATOM 0 HG LEU B 65 0.423 -12.481 -24.108 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -0.485 -12.448 -26.419 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -1.751 -12.066 -25.228 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -1.010 -10.763 -26.187 1.00 0.00 H new ATOM 0 HD21 LEU B 65 1.878 -11.773 -25.993 1.00 0.00 H new ATOM 0 HD22 LEU B 65 1.358 -10.087 -25.759 1.00 0.00 H new ATOM 0 HD23 LEU B 65 2.305 -10.910 -24.496 1.00 0.00 H new ATOM 1537 N GLU B 66 -2.079 -11.973 -21.201 1.00 0.00 N ATOM 1538 CA GLU B 66 -3.089 -13.037 -20.949 1.00 0.00 C ATOM 1539 C GLU B 66 -4.467 -12.506 -21.343 1.00 0.00 C ATOM 1540 O GLU B 66 -4.611 -11.357 -21.711 1.00 0.00 O ATOM 1541 CB GLU B 66 -3.083 -13.413 -19.459 1.00 0.00 C ATOM 1542 CG GLU B 66 -1.879 -14.301 -19.135 1.00 0.00 C ATOM 1543 CD GLU B 66 -1.934 -15.590 -19.965 1.00 0.00 C ATOM 1544 OE1 GLU B 66 -3.009 -16.155 -20.074 1.00 0.00 O ATOM 1545 OE2 GLU B 66 -0.899 -15.987 -20.475 1.00 0.00 O ATOM 0 H GLU B 66 -2.274 -11.080 -20.748 1.00 0.00 H new ATOM 0 HA GLU B 66 -2.851 -13.923 -21.537 1.00 0.00 H new ATOM 0 HB2 GLU B 66 -3.050 -12.510 -18.850 1.00 0.00 H new ATOM 0 HB3 GLU B 66 -4.006 -13.935 -19.206 1.00 0.00 H new ATOM 0 HG2 GLU B 66 -0.954 -13.764 -19.345 1.00 0.00 H new ATOM 0 HG3 GLU B 66 -1.872 -14.544 -18.072 1.00 0.00 H new ATOM 1552 N GLN B 67 -5.477 -13.332 -21.275 1.00 0.00 N ATOM 1553 CA GLN B 67 -6.848 -12.873 -21.650 1.00 0.00 C ATOM 1554 C GLN B 67 -7.888 -13.651 -20.842 1.00 0.00 C ATOM 1555 O GLN B 67 -7.680 -14.796 -20.488 1.00 0.00 O ATOM 1556 CB GLN B 67 -7.076 -13.115 -23.143 1.00 0.00 C ATOM 1557 CG GLN B 67 -6.280 -12.091 -23.954 1.00 0.00 C ATOM 1558 CD GLN B 67 -6.544 -12.305 -25.446 1.00 0.00 C ATOM 1559 OE1 GLN B 67 -7.666 -12.543 -25.849 1.00 0.00 O ATOM 1560 NE2 GLN B 67 -5.551 -12.231 -26.289 1.00 0.00 N ATOM 0 H GLN B 67 -5.413 -14.305 -20.976 1.00 0.00 H new ATOM 0 HA GLN B 67 -6.945 -11.809 -21.435 1.00 0.00 H new ATOM 0 HB2 GLN B 67 -6.767 -14.126 -23.410 1.00 0.00 H new ATOM 0 HB3 GLN B 67 -8.137 -13.034 -23.377 1.00 0.00 H new ATOM 0 HG2 GLN B 67 -6.567 -11.080 -23.664 1.00 0.00 H new ATOM 0 HG3 GLN B 67 -5.215 -12.193 -23.744 1.00 0.00 H new ATOM 0 HE21 GLN B 67 -4.609 -12.031 -25.952 1.00 0.00 H new ATOM 0 HE22 GLN B 67 -5.716 -12.373 -27.285 1.00 0.00 H new ATOM 1569 N LYS B 68 -9.007 -13.036 -20.551 1.00 0.00 N ATOM 1570 CA LYS B 68 -10.068 -13.733 -19.769 1.00 0.00 C ATOM 1571 C LYS B 68 -11.186 -14.183 -20.713 1.00 0.00 C ATOM 1572 O LYS B 68 -11.237 -13.787 -21.862 1.00 0.00 O ATOM 1573 CB LYS B 68 -10.641 -12.781 -18.716 1.00 0.00 C ATOM 1574 CG LYS B 68 -9.584 -12.505 -17.636 1.00 0.00 C ATOM 1575 CD LYS B 68 -9.493 -10.998 -17.371 1.00 0.00 C ATOM 1576 CE LYS B 68 -10.814 -10.499 -16.784 1.00 0.00 C ATOM 1577 NZ LYS B 68 -11.054 -11.159 -15.470 1.00 0.00 N ATOM 0 H LYS B 68 -9.230 -12.079 -20.823 1.00 0.00 H new ATOM 0 HA LYS B 68 -9.638 -14.603 -19.273 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -10.947 -11.846 -19.186 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -11.531 -13.217 -18.264 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -9.844 -13.030 -16.717 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -8.615 -12.886 -17.957 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -8.675 -10.789 -16.682 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -9.272 -10.468 -18.298 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -10.783 -9.417 -16.659 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -11.634 -10.718 -17.468 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -11.320 -10.442 -14.765 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -11.823 -11.853 -15.565 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -10.187 -11.643 -15.161 1.00 0.00 H new ATOM 1591 N ASP B 69 -12.079 -15.012 -20.234 1.00 0.00 N ATOM 1592 CA ASP B 69 -13.196 -15.498 -21.092 1.00 0.00 C ATOM 1593 C ASP B 69 -14.236 -14.388 -21.315 1.00 0.00 C ATOM 1594 O ASP B 69 -15.166 -14.558 -22.080 1.00 0.00 O ATOM 1595 CB ASP B 69 -13.870 -16.693 -20.416 1.00 0.00 C ATOM 1596 CG ASP B 69 -13.173 -17.984 -20.848 1.00 0.00 C ATOM 1597 OD1 ASP B 69 -11.959 -17.970 -20.962 1.00 0.00 O ATOM 1598 OD2 ASP B 69 -13.866 -18.967 -21.058 1.00 0.00 O ATOM 0 H ASP B 69 -12.080 -15.373 -19.280 1.00 0.00 H new ATOM 0 HA ASP B 69 -12.789 -15.794 -22.059 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -13.822 -16.586 -19.332 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -14.925 -16.729 -20.686 1.00 0.00 H new ATOM 1603 N GLY B 70 -14.097 -13.258 -20.655 1.00 0.00 N ATOM 1604 CA GLY B 70 -15.087 -12.155 -20.838 1.00 0.00 C ATOM 1605 C GLY B 70 -14.560 -11.144 -21.860 1.00 0.00 C ATOM 1606 O GLY B 70 -14.841 -9.964 -21.775 1.00 0.00 O ATOM 0 H GLY B 70 -13.341 -13.057 -20.000 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -16.040 -12.563 -21.175 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -15.272 -11.659 -19.885 1.00 0.00 H new ATOM 1610 N ASP B 71 -13.792 -11.599 -22.820 1.00 0.00 N ATOM 1611 CA ASP B 71 -13.234 -10.674 -23.856 1.00 0.00 C ATOM 1612 C ASP B 71 -12.381 -9.604 -23.173 1.00 0.00 C ATOM 1613 O ASP B 71 -12.527 -8.421 -23.422 1.00 0.00 O ATOM 1614 CB ASP B 71 -14.379 -10.015 -24.633 1.00 0.00 C ATOM 1615 CG ASP B 71 -14.899 -10.985 -25.695 1.00 0.00 C ATOM 1616 OD1 ASP B 71 -15.416 -12.024 -25.318 1.00 0.00 O ATOM 1617 OD2 ASP B 71 -14.772 -10.673 -26.868 1.00 0.00 O ATOM 0 H ASP B 71 -13.526 -12.577 -22.931 1.00 0.00 H new ATOM 0 HA ASP B 71 -12.614 -11.238 -24.553 1.00 0.00 H new ATOM 0 HB2 ASP B 71 -15.184 -9.739 -23.952 1.00 0.00 H new ATOM 0 HB3 ASP B 71 -14.031 -9.096 -25.104 1.00 0.00 H new ATOM 1622 N ILE B 72 -11.501 -10.020 -22.304 1.00 0.00 N ATOM 1623 CA ILE B 72 -10.638 -9.046 -21.579 1.00 0.00 C ATOM 1624 C ILE B 72 -9.169 -9.452 -21.742 1.00 0.00 C ATOM 1625 O ILE B 72 -8.864 -10.593 -22.034 1.00 0.00 O ATOM 1626 CB ILE B 72 -11.021 -9.041 -20.095 1.00 0.00 C ATOM 1627 CG1 ILE B 72 -12.558 -8.941 -19.974 1.00 0.00 C ATOM 1628 CG2 ILE B 72 -10.347 -7.847 -19.412 1.00 0.00 C ATOM 1629 CD1 ILE B 72 -12.989 -8.705 -18.517 1.00 0.00 C ATOM 0 H ILE B 72 -11.342 -10.999 -22.064 1.00 0.00 H new ATOM 0 HA ILE B 72 -10.779 -8.046 -21.989 1.00 0.00 H new ATOM 0 HB ILE B 72 -10.688 -9.959 -19.610 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -12.922 -8.126 -20.600 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -13.015 -9.858 -20.347 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -10.613 -7.834 -18.355 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -9.265 -7.933 -19.513 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -10.682 -6.922 -19.882 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -14.076 -8.639 -18.465 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -12.646 -9.533 -17.897 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -12.552 -7.775 -18.154 1.00 0.00 H new ATOM 1641 N SER B 73 -8.260 -8.524 -21.564 1.00 0.00 N ATOM 1642 CA SER B 73 -6.811 -8.850 -21.718 1.00 0.00 C ATOM 1643 C SER B 73 -6.093 -8.643 -20.385 1.00 0.00 C ATOM 1644 O SER B 73 -6.620 -8.039 -19.469 1.00 0.00 O ATOM 1645 CB SER B 73 -6.193 -7.937 -22.776 1.00 0.00 C ATOM 1646 OG SER B 73 -7.106 -7.780 -23.854 1.00 0.00 O ATOM 0 H SER B 73 -8.461 -7.555 -21.319 1.00 0.00 H new ATOM 0 HA SER B 73 -6.706 -9.890 -22.027 1.00 0.00 H new ATOM 0 HB2 SER B 73 -5.956 -6.966 -22.341 1.00 0.00 H new ATOM 0 HB3 SER B 73 -5.256 -8.362 -23.137 1.00 0.00 H new ATOM 0 HG SER B 73 -6.712 -7.193 -24.533 1.00 0.00 H new ATOM 1652 N ILE B 74 -4.897 -9.155 -20.273 1.00 0.00 N ATOM 1653 CA ILE B 74 -4.123 -9.019 -19.007 1.00 0.00 C ATOM 1654 C ILE B 74 -2.624 -8.982 -19.342 1.00 0.00 C ATOM 1655 O ILE B 74 -1.966 -10.004 -19.378 1.00 0.00 O ATOM 1656 CB ILE B 74 -4.441 -10.227 -18.108 1.00 0.00 C ATOM 1657 CG1 ILE B 74 -5.923 -10.176 -17.694 1.00 0.00 C ATOM 1658 CG2 ILE B 74 -3.541 -10.219 -16.861 1.00 0.00 C ATOM 1659 CD1 ILE B 74 -6.257 -11.334 -16.741 1.00 0.00 C ATOM 0 H ILE B 74 -4.419 -9.667 -21.014 1.00 0.00 H new ATOM 0 HA ILE B 74 -4.392 -8.100 -18.486 1.00 0.00 H new ATOM 0 HB ILE B 74 -4.250 -11.146 -18.662 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -6.138 -9.224 -17.208 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -6.556 -10.232 -18.580 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -3.778 -11.080 -16.236 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -2.496 -10.269 -17.166 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -3.710 -9.302 -16.296 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -7.309 -11.282 -16.459 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -6.062 -12.283 -17.240 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -5.638 -11.260 -15.847 1.00 0.00 H new ATOM 1671 N LEU B 75 -2.085 -7.814 -19.591 1.00 0.00 N ATOM 1672 CA LEU B 75 -0.639 -7.708 -19.930 1.00 0.00 C ATOM 1673 C LEU B 75 0.190 -7.554 -18.651 1.00 0.00 C ATOM 1674 O LEU B 75 0.197 -6.511 -18.025 1.00 0.00 O ATOM 1675 CB LEU B 75 -0.414 -6.497 -20.838 1.00 0.00 C ATOM 1676 CG LEU B 75 1.022 -6.517 -21.367 1.00 0.00 C ATOM 1677 CD1 LEU B 75 1.052 -5.946 -22.786 1.00 0.00 C ATOM 1678 CD2 LEU B 75 1.911 -5.665 -20.457 1.00 0.00 C ATOM 0 H LEU B 75 -2.590 -6.928 -19.573 1.00 0.00 H new ATOM 0 HA LEU B 75 -0.326 -8.615 -20.448 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -1.119 -6.516 -21.669 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -0.597 -5.575 -20.285 1.00 0.00 H new ATOM 0 HG LEU B 75 1.390 -7.543 -21.381 1.00 0.00 H new ATOM 0 HD11 LEU B 75 2.075 -5.960 -23.162 1.00 0.00 H new ATOM 0 HD12 LEU B 75 0.418 -6.550 -23.435 1.00 0.00 H new ATOM 0 HD13 LEU B 75 0.685 -4.920 -22.773 1.00 0.00 H new ATOM 0 HD21 LEU B 75 2.934 -5.678 -20.832 1.00 0.00 H new ATOM 0 HD22 LEU B 75 1.542 -4.639 -20.445 1.00 0.00 H new ATOM 0 HD23 LEU B 75 1.890 -6.070 -19.445 1.00 0.00 H new ATOM 1690 N GLU B 76 0.893 -8.589 -18.270 1.00 0.00 N ATOM 1691 CA GLU B 76 1.736 -8.527 -17.037 1.00 0.00 C ATOM 1692 C GLU B 76 3.203 -8.381 -17.446 1.00 0.00 C ATOM 1693 O GLU B 76 3.765 -9.253 -18.078 1.00 0.00 O ATOM 1694 CB GLU B 76 1.565 -9.816 -16.221 1.00 0.00 C ATOM 1695 CG GLU B 76 0.077 -10.145 -16.056 1.00 0.00 C ATOM 1696 CD GLU B 76 -0.079 -11.601 -15.612 1.00 0.00 C ATOM 1697 OE1 GLU B 76 0.724 -12.418 -16.033 1.00 0.00 O ATOM 1698 OE2 GLU B 76 -0.999 -11.875 -14.860 1.00 0.00 O ATOM 0 H GLU B 76 0.920 -9.481 -18.763 1.00 0.00 H new ATOM 0 HA GLU B 76 1.429 -7.676 -16.430 1.00 0.00 H new ATOM 0 HB2 GLU B 76 2.074 -10.641 -16.720 1.00 0.00 H new ATOM 0 HB3 GLU B 76 2.030 -9.700 -15.242 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -0.374 -9.479 -15.320 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -0.449 -9.983 -16.997 1.00 0.00 H new ATOM 1705 N LEU B 77 3.832 -7.289 -17.092 1.00 0.00 N ATOM 1706 CA LEU B 77 5.264 -7.105 -17.467 1.00 0.00 C ATOM 1707 C LEU B 77 6.139 -7.190 -16.215 1.00 0.00 C ATOM 1708 O LEU B 77 5.886 -6.542 -15.217 1.00 0.00 O ATOM 1709 CB LEU B 77 5.462 -5.749 -18.158 1.00 0.00 C ATOM 1710 CG LEU B 77 4.861 -4.629 -17.307 1.00 0.00 C ATOM 1711 CD1 LEU B 77 5.672 -3.348 -17.507 1.00 0.00 C ATOM 1712 CD2 LEU B 77 3.413 -4.384 -17.736 1.00 0.00 C ATOM 0 H LEU B 77 3.418 -6.522 -16.563 1.00 0.00 H new ATOM 0 HA LEU B 77 5.554 -7.894 -18.161 1.00 0.00 H new ATOM 0 HB2 LEU B 77 6.525 -5.565 -18.316 1.00 0.00 H new ATOM 0 HB3 LEU B 77 4.991 -5.761 -19.141 1.00 0.00 H new ATOM 0 HG LEU B 77 4.886 -4.917 -16.256 1.00 0.00 H new ATOM 0 HD11 LEU B 77 5.245 -2.549 -16.901 1.00 0.00 H new ATOM 0 HD12 LEU B 77 6.705 -3.520 -17.205 1.00 0.00 H new ATOM 0 HD13 LEU B 77 5.645 -3.061 -18.558 1.00 0.00 H new ATOM 0 HD21 LEU B 77 2.984 -3.586 -17.130 1.00 0.00 H new ATOM 0 HD22 LEU B 77 3.389 -4.095 -18.787 1.00 0.00 H new ATOM 0 HD23 LEU B 77 2.833 -5.296 -17.597 1.00 0.00 H new ATOM 1724 N ASN B 78 7.166 -7.991 -16.268 1.00 0.00 N ATOM 1725 CA ASN B 78 8.072 -8.137 -15.100 1.00 0.00 C ATOM 1726 C ASN B 78 9.180 -7.103 -15.215 1.00 0.00 C ATOM 1727 O ASN B 78 9.653 -6.820 -16.298 1.00 0.00 O ATOM 1728 CB ASN B 78 8.687 -9.528 -15.122 1.00 0.00 C ATOM 1729 CG ASN B 78 7.572 -10.571 -15.200 1.00 0.00 C ATOM 1730 OD1 ASN B 78 6.833 -10.616 -16.163 1.00 0.00 O ATOM 1731 ND2 ASN B 78 7.418 -11.414 -14.221 1.00 0.00 N ATOM 0 H ASN B 78 7.417 -8.555 -17.080 1.00 0.00 H new ATOM 0 HA ASN B 78 7.518 -7.993 -14.172 1.00 0.00 H new ATOM 0 HB2 ASN B 78 9.356 -9.629 -15.977 1.00 0.00 H new ATOM 0 HB3 ASN B 78 9.288 -9.687 -14.226 1.00 0.00 H new ATOM 0 HD21 ASN B 78 6.676 -12.113 -14.262 1.00 0.00 H new ATOM 0 HD22 ASN B 78 8.039 -11.376 -13.413 1.00 0.00 H new ATOM 1738 N VAL B 79 9.593 -6.533 -14.119 1.00 0.00 N ATOM 1739 CA VAL B 79 10.674 -5.509 -14.176 1.00 0.00 C ATOM 1740 C VAL B 79 11.819 -5.917 -13.250 1.00 0.00 C ATOM 1741 O VAL B 79 11.844 -5.569 -12.084 1.00 0.00 O ATOM 1742 CB VAL B 79 10.119 -4.151 -13.747 1.00 0.00 C ATOM 1743 CG1 VAL B 79 11.151 -3.069 -14.061 1.00 0.00 C ATOM 1744 CG2 VAL B 79 8.826 -3.861 -14.518 1.00 0.00 C ATOM 0 H VAL B 79 9.230 -6.731 -13.187 1.00 0.00 H new ATOM 0 HA VAL B 79 11.049 -5.436 -15.197 1.00 0.00 H new ATOM 0 HB VAL B 79 9.908 -4.161 -12.678 1.00 0.00 H new ATOM 0 HG11 VAL B 79 10.763 -2.097 -13.758 1.00 0.00 H new ATOM 0 HG12 VAL B 79 12.073 -3.277 -13.518 1.00 0.00 H new ATOM 0 HG13 VAL B 79 11.355 -3.060 -15.132 1.00 0.00 H new ATOM 0 HG21 VAL B 79 8.430 -2.893 -14.213 1.00 0.00 H new ATOM 0 HG22 VAL B 79 9.036 -3.846 -15.588 1.00 0.00 H new ATOM 0 HG23 VAL B 79 8.092 -4.638 -14.303 1.00 0.00 H new ATOM 1754 N THR B 80 12.768 -6.655 -13.766 1.00 0.00 N ATOM 1755 CA THR B 80 13.923 -7.095 -12.932 1.00 0.00 C ATOM 1756 C THR B 80 14.921 -5.943 -12.801 1.00 0.00 C ATOM 1757 O THR B 80 15.756 -5.737 -13.661 1.00 0.00 O ATOM 1758 CB THR B 80 14.607 -8.294 -13.601 1.00 0.00 C ATOM 1759 OG1 THR B 80 13.660 -9.340 -13.771 1.00 0.00 O ATOM 1760 CG2 THR B 80 15.764 -8.788 -12.728 1.00 0.00 C ATOM 0 H THR B 80 12.791 -6.973 -14.735 1.00 0.00 H new ATOM 0 HA THR B 80 13.571 -7.385 -11.942 1.00 0.00 H new ATOM 0 HB THR B 80 14.998 -7.991 -14.572 1.00 0.00 H new ATOM 0 HG1 THR B 80 13.288 -9.301 -14.677 1.00 0.00 H new ATOM 0 HG21 THR B 80 16.245 -9.640 -13.209 1.00 0.00 H new ATOM 0 HG22 THR B 80 16.491 -7.986 -12.599 1.00 0.00 H new ATOM 0 HG23 THR B 80 15.381 -9.091 -11.753 1.00 0.00 H new ATOM 1768 N LEU B 81 14.844 -5.199 -11.728 1.00 0.00 N ATOM 1769 CA LEU B 81 15.787 -4.068 -11.529 1.00 0.00 C ATOM 1770 C LEU B 81 17.072 -4.606 -10.873 1.00 0.00 C ATOM 1771 O LEU B 81 16.992 -5.442 -9.996 1.00 0.00 O ATOM 1772 CB LEU B 81 15.138 -3.036 -10.609 1.00 0.00 C ATOM 1773 CG LEU B 81 13.964 -2.372 -11.330 1.00 0.00 C ATOM 1774 CD1 LEU B 81 12.924 -1.923 -10.302 1.00 0.00 C ATOM 1775 CD2 LEU B 81 14.467 -1.155 -12.113 1.00 0.00 C ATOM 0 H LEU B 81 14.164 -5.330 -10.980 1.00 0.00 H new ATOM 0 HA LEU B 81 16.028 -3.603 -12.485 1.00 0.00 H new ATOM 0 HB2 LEU B 81 14.791 -3.517 -9.694 1.00 0.00 H new ATOM 0 HB3 LEU B 81 15.870 -2.284 -10.316 1.00 0.00 H new ATOM 0 HG LEU B 81 13.511 -3.084 -12.019 1.00 0.00 H new ATOM 0 HD11 LEU B 81 12.087 -1.450 -10.815 1.00 0.00 H new ATOM 0 HD12 LEU B 81 12.566 -2.789 -9.745 1.00 0.00 H new ATOM 0 HD13 LEU B 81 13.377 -1.210 -9.613 1.00 0.00 H new ATOM 0 HD21 LEU B 81 13.630 -0.682 -12.627 1.00 0.00 H new ATOM 0 HD22 LEU B 81 14.921 -0.442 -11.425 1.00 0.00 H new ATOM 0 HD23 LEU B 81 15.209 -1.475 -12.845 1.00 0.00 H new ATOM 1787 N PRO B 82 18.223 -4.126 -11.305 1.00 0.00 N ATOM 1788 CA PRO B 82 19.548 -4.566 -10.760 1.00 0.00 C ATOM 1789 C PRO B 82 19.853 -3.851 -9.443 1.00 0.00 C ATOM 1790 O PRO B 82 19.029 -3.131 -8.911 1.00 0.00 O ATOM 1791 CB PRO B 82 20.534 -4.168 -11.848 1.00 0.00 C ATOM 1792 CG PRO B 82 19.898 -3.044 -12.643 1.00 0.00 C ATOM 1793 CD PRO B 82 18.392 -3.086 -12.383 1.00 0.00 C ATOM 0 HA PRO B 82 19.586 -5.631 -10.533 1.00 0.00 H new ATOM 0 HB2 PRO B 82 21.478 -3.843 -11.411 1.00 0.00 H new ATOM 0 HB3 PRO B 82 20.757 -5.017 -12.494 1.00 0.00 H new ATOM 0 HG2 PRO B 82 20.311 -2.081 -12.342 1.00 0.00 H new ATOM 0 HG3 PRO B 82 20.106 -3.162 -13.706 1.00 0.00 H new ATOM 0 HD2 PRO B 82 18.018 -2.115 -12.059 1.00 0.00 H new ATOM 0 HD3 PRO B 82 17.841 -3.355 -13.284 1.00 0.00 H new