USER MOD reduce.3.24.130724 H: found=0, std=0, add=952, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 956 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 62 THR OG1 : rot 180:sc= -0.324 USER MOD Set 1.2: B 64 GLN : amide:sc= -0.948 K(o=-4.9,f=-5.8!) USER MOD Set 1.3: B 78 ASN : amide:sc= -3.59 K(o=-4.9,f=-5.8!) USER MOD Set 2.1: B 41 GLN : amide:sc= -1.69 X(o=-1.6,f=-2) USER MOD Set 2.2: B 44 LYS NZ :NH3+ -176:sc= 0.138 (180deg=0) USER MOD Set 3.1: A 62 THR OG1 : rot 180:sc= -0.335 USER MOD Set 3.2: A 64 GLN : amide:sc= -0.941 K(o=-4.9,f=-5.7!) USER MOD Set 3.3: A 78 ASN : amide:sc= -3.58 K(o=-4.9,f=-5.7!) USER MOD Set 4.1: A 41 GLN : amide:sc= -1.72 X(o=-1.6,f=-2.1) USER MOD Set 4.2: A 44 LYS NZ :NH3+ -176:sc= 0.135 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 37 HIS : no HD1:sc= -4.3! C(o=-4.3!,f=-3.8!) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.0116) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 60 MET CE :methyl 160:sc= -5.09 (180deg=-6.45!) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00093) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 95:sc= 0.172 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 180:sc= 0.00102 USER MOD Single : B 37 HIS : no HD1:sc= -4.23 X(o=-4.2,f=-3.8!) USER MOD Single : B 38 TYR OH : rot 180:sc= 0 USER MOD Single : B 51 CYS SG : rot 180:sc= 0 USER MOD Single : B 52 LYS NZ :NH3+ -161:sc= 0 (180deg=-0.012) USER MOD Single : B 53 TYR OH : rot 180:sc= 0 USER MOD Single : B 55 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : B 60 MET CE :methyl 159:sc= -5.07 (180deg=-6.4!) USER MOD Single : B 67 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 68 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00719) USER MOD Single : B 73 SER OG : rot 180:sc= 0 USER MOD Single : B 80 THR OG1 : rot 94:sc= 0.168 USER MOD Single : B 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 31 4.040 1.547 2.718 1.00 0.00 N ATOM 2 CA ARG A 31 4.268 0.998 1.350 1.00 0.00 C ATOM 3 C ARG A 31 5.758 0.715 1.150 1.00 0.00 C ATOM 4 O ARG A 31 6.581 1.610 1.189 1.00 0.00 O ATOM 5 CB ARG A 31 3.790 2.009 0.302 1.00 0.00 C ATOM 6 CG ARG A 31 4.499 3.354 0.509 1.00 0.00 C ATOM 7 CD ARG A 31 3.480 4.496 0.430 1.00 0.00 C ATOM 8 NE ARG A 31 4.146 5.722 -0.107 1.00 0.00 N ATOM 9 CZ ARG A 31 3.446 6.771 -0.494 1.00 0.00 C ATOM 10 NH1 ARG A 31 2.135 6.786 -0.426 1.00 0.00 N ATOM 11 NH2 ARG A 31 4.073 7.820 -0.955 1.00 0.00 N ATOM 0 HA ARG A 31 3.707 0.070 1.237 1.00 0.00 H new ATOM 0 HB2 ARG A 31 3.995 1.631 -0.700 1.00 0.00 H new ATOM 0 HB3 ARG A 31 2.711 2.142 0.378 1.00 0.00 H new ATOM 0 HG2 ARG A 31 4.999 3.367 1.478 1.00 0.00 H new ATOM 0 HG3 ARG A 31 5.270 3.489 -0.249 1.00 0.00 H new ATOM 0 HD2 ARG A 31 2.647 4.211 -0.213 1.00 0.00 H new ATOM 0 HD3 ARG A 31 3.066 4.697 1.418 1.00 0.00 H new ATOM 0 HE ARG A 31 5.163 5.748 -0.176 1.00 0.00 H new ATOM 0 HH11 ARG A 31 1.634 5.973 -0.067 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.618 7.610 -0.732 1.00 0.00 H new ATOM 0 HH21 ARG A 31 5.091 7.821 -1.012 1.00 0.00 H new ATOM 0 HH22 ARG A 31 3.544 8.638 -1.258 1.00 0.00 H new ATOM 27 N SER A 32 6.106 -0.529 0.935 1.00 0.00 N ATOM 28 CA SER A 32 7.537 -0.890 0.728 1.00 0.00 C ATOM 29 C SER A 32 8.082 -0.202 -0.530 1.00 0.00 C ATOM 30 O SER A 32 9.281 -0.126 -0.724 1.00 0.00 O ATOM 31 CB SER A 32 7.661 -2.405 0.569 1.00 0.00 C ATOM 32 OG SER A 32 6.896 -3.048 1.581 1.00 0.00 O ATOM 0 H SER A 32 5.454 -1.313 0.894 1.00 0.00 H new ATOM 0 HA SER A 32 8.113 -0.559 1.592 1.00 0.00 H new ATOM 0 HB2 SER A 32 7.309 -2.709 -0.417 1.00 0.00 H new ATOM 0 HB3 SER A 32 8.706 -2.705 0.641 1.00 0.00 H new ATOM 0 HG SER A 32 6.972 -4.020 1.481 1.00 0.00 H new ATOM 38 N ASP A 33 7.220 0.297 -1.388 1.00 0.00 N ATOM 39 CA ASP A 33 7.701 0.972 -2.625 1.00 0.00 C ATOM 40 C ASP A 33 7.995 2.456 -2.357 1.00 0.00 C ATOM 41 O ASP A 33 8.159 3.229 -3.279 1.00 0.00 O ATOM 42 CB ASP A 33 6.641 0.860 -3.723 1.00 0.00 C ATOM 43 CG ASP A 33 6.222 -0.603 -3.888 1.00 0.00 C ATOM 44 OD1 ASP A 33 5.368 -1.043 -3.136 1.00 0.00 O ATOM 45 OD2 ASP A 33 6.762 -1.258 -4.764 1.00 0.00 O ATOM 0 H ASP A 33 6.206 0.263 -1.280 1.00 0.00 H new ATOM 0 HA ASP A 33 8.620 0.482 -2.946 1.00 0.00 H new ATOM 0 HB2 ASP A 33 5.774 1.470 -3.469 1.00 0.00 H new ATOM 0 HB3 ASP A 33 7.036 1.244 -4.664 1.00 0.00 H new ATOM 50 N ALA A 34 8.071 2.863 -1.111 1.00 0.00 N ATOM 51 CA ALA A 34 8.369 4.286 -0.800 1.00 0.00 C ATOM 52 C ALA A 34 9.888 4.477 -0.648 1.00 0.00 C ATOM 53 O ALA A 34 10.385 5.587 -0.674 1.00 0.00 O ATOM 54 CB ALA A 34 7.670 4.679 0.506 1.00 0.00 C ATOM 0 H ALA A 34 7.938 2.263 -0.297 1.00 0.00 H new ATOM 0 HA ALA A 34 8.007 4.917 -1.612 1.00 0.00 H new ATOM 0 HB1 ALA A 34 7.888 5.722 0.735 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.593 4.548 0.396 1.00 0.00 H new ATOM 0 HB3 ALA A 34 8.031 4.046 1.317 1.00 0.00 H new ATOM 60 N GLU A 35 10.625 3.402 -0.484 1.00 0.00 N ATOM 61 CA GLU A 35 12.105 3.510 -0.321 1.00 0.00 C ATOM 62 C GLU A 35 12.755 4.205 -1.537 1.00 0.00 C ATOM 63 O GLU A 35 13.615 5.042 -1.351 1.00 0.00 O ATOM 64 CB GLU A 35 12.714 2.111 -0.143 1.00 0.00 C ATOM 65 CG GLU A 35 11.959 1.341 0.953 1.00 0.00 C ATOM 66 CD GLU A 35 12.836 1.221 2.203 1.00 0.00 C ATOM 67 OE1 GLU A 35 13.621 0.290 2.265 1.00 0.00 O ATOM 68 OE2 GLU A 35 12.707 2.064 3.075 1.00 0.00 O ATOM 0 H GLU A 35 10.259 2.450 -0.456 1.00 0.00 H new ATOM 0 HA GLU A 35 12.302 4.114 0.564 1.00 0.00 H new ATOM 0 HB2 GLU A 35 12.665 1.562 -1.083 1.00 0.00 H new ATOM 0 HB3 GLU A 35 13.768 2.196 0.122 1.00 0.00 H new ATOM 0 HG2 GLU A 35 11.030 1.856 1.198 1.00 0.00 H new ATOM 0 HG3 GLU A 35 11.688 0.349 0.592 1.00 0.00 H new ATOM 75 N PRO A 36 12.356 3.854 -2.751 1.00 0.00 N ATOM 76 CA PRO A 36 12.930 4.456 -3.995 1.00 0.00 C ATOM 77 C PRO A 36 12.213 5.762 -4.356 1.00 0.00 C ATOM 78 O PRO A 36 12.840 6.737 -4.707 1.00 0.00 O ATOM 79 CB PRO A 36 12.682 3.388 -5.052 1.00 0.00 C ATOM 80 CG PRO A 36 11.512 2.545 -4.578 1.00 0.00 C ATOM 81 CD PRO A 36 11.296 2.836 -3.092 1.00 0.00 C ATOM 0 HA PRO A 36 13.983 4.717 -3.893 1.00 0.00 H new ATOM 0 HB2 PRO A 36 12.460 3.846 -6.016 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.570 2.770 -5.190 1.00 0.00 H new ATOM 0 HG2 PRO A 36 10.614 2.783 -5.148 1.00 0.00 H new ATOM 0 HG3 PRO A 36 11.717 1.486 -4.734 1.00 0.00 H new ATOM 0 HD2 PRO A 36 10.296 3.226 -2.905 1.00 0.00 H new ATOM 0 HD3 PRO A 36 11.404 1.933 -2.491 1.00 0.00 H new ATOM 89 N HIS A 37 10.903 5.778 -4.282 1.00 0.00 N ATOM 90 CA HIS A 37 10.106 7.007 -4.624 1.00 0.00 C ATOM 91 C HIS A 37 9.990 7.180 -6.158 1.00 0.00 C ATOM 92 O HIS A 37 9.275 8.045 -6.628 1.00 0.00 O ATOM 93 CB HIS A 37 10.703 8.265 -3.913 1.00 0.00 C ATOM 94 CG HIS A 37 11.559 9.127 -4.825 1.00 0.00 C ATOM 95 ND1 HIS A 37 12.922 9.291 -4.621 1.00 0.00 N ATOM 96 CD2 HIS A 37 11.254 9.887 -5.929 1.00 0.00 C ATOM 97 CE1 HIS A 37 13.380 10.116 -5.579 1.00 0.00 C ATOM 98 NE2 HIS A 37 12.406 10.509 -6.403 1.00 0.00 N ATOM 0 H HIS A 37 10.340 4.978 -3.994 1.00 0.00 H new ATOM 0 HA HIS A 37 9.090 6.886 -4.249 1.00 0.00 H new ATOM 0 HB2 HIS A 37 9.887 8.869 -3.515 1.00 0.00 H new ATOM 0 HB3 HIS A 37 11.304 7.941 -3.063 1.00 0.00 H new ATOM 0 HD2 HIS A 37 10.270 9.987 -6.363 1.00 0.00 H new ATOM 0 HE1 HIS A 37 14.411 10.424 -5.671 1.00 0.00 H new ATOM 0 HE2 HIS A 37 12.488 11.131 -7.207 1.00 0.00 H new ATOM 106 N TYR A 38 10.663 6.362 -6.937 1.00 0.00 N ATOM 107 CA TYR A 38 10.567 6.485 -8.422 1.00 0.00 C ATOM 108 C TYR A 38 9.928 5.217 -8.994 1.00 0.00 C ATOM 109 O TYR A 38 9.188 5.266 -9.957 1.00 0.00 O ATOM 110 CB TYR A 38 11.964 6.673 -9.026 1.00 0.00 C ATOM 111 CG TYR A 38 12.912 5.629 -8.478 1.00 0.00 C ATOM 112 CD1 TYR A 38 13.041 4.393 -9.121 1.00 0.00 C ATOM 113 CD2 TYR A 38 13.662 5.903 -7.328 1.00 0.00 C ATOM 114 CE1 TYR A 38 13.922 3.430 -8.614 1.00 0.00 C ATOM 115 CE2 TYR A 38 14.542 4.940 -6.820 1.00 0.00 C ATOM 116 CZ TYR A 38 14.672 3.703 -7.464 1.00 0.00 C ATOM 117 OH TYR A 38 15.539 2.754 -6.964 1.00 0.00 O ATOM 0 H TYR A 38 11.274 5.616 -6.604 1.00 0.00 H new ATOM 0 HA TYR A 38 9.954 7.351 -8.671 1.00 0.00 H new ATOM 0 HB2 TYR A 38 11.913 6.595 -10.112 1.00 0.00 H new ATOM 0 HB3 TYR A 38 12.337 7.671 -8.796 1.00 0.00 H new ATOM 0 HD1 TYR A 38 12.462 4.182 -10.008 1.00 0.00 H new ATOM 0 HD2 TYR A 38 13.562 6.857 -6.833 1.00 0.00 H new ATOM 0 HE1 TYR A 38 14.023 2.476 -9.110 1.00 0.00 H new ATOM 0 HE2 TYR A 38 15.120 5.151 -5.932 1.00 0.00 H new ATOM 0 HH TYR A 38 15.981 3.105 -6.163 1.00 0.00 H new ATOM 127 N LEU A 39 10.200 4.081 -8.398 1.00 0.00 N ATOM 128 CA LEU A 39 9.610 2.794 -8.885 1.00 0.00 C ATOM 129 C LEU A 39 8.078 2.925 -9.054 1.00 0.00 C ATOM 130 O LEU A 39 7.557 2.617 -10.111 1.00 0.00 O ATOM 131 CB LEU A 39 9.929 1.679 -7.872 1.00 0.00 C ATOM 132 CG LEU A 39 10.656 0.515 -8.566 1.00 0.00 C ATOM 133 CD1 LEU A 39 9.820 -0.018 -9.737 1.00 0.00 C ATOM 134 CD2 LEU A 39 12.009 1.000 -9.091 1.00 0.00 C ATOM 0 H LEU A 39 10.812 3.990 -7.587 1.00 0.00 H new ATOM 0 HA LEU A 39 10.042 2.549 -9.855 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.549 2.076 -7.068 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.007 1.319 -7.415 1.00 0.00 H new ATOM 0 HG LEU A 39 10.803 -0.287 -7.843 1.00 0.00 H new ATOM 0 HD11 LEU A 39 10.349 -0.841 -10.217 1.00 0.00 H new ATOM 0 HD12 LEU A 39 8.858 -0.372 -9.366 1.00 0.00 H new ATOM 0 HD13 LEU A 39 9.658 0.780 -10.461 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.525 0.176 -9.583 1.00 0.00 H new ATOM 0 HD22 LEU A 39 11.854 1.809 -9.805 1.00 0.00 H new ATOM 0 HD23 LEU A 39 12.614 1.362 -8.259 1.00 0.00 H new ATOM 146 N PRO A 40 7.391 3.389 -8.025 1.00 0.00 N ATOM 147 CA PRO A 40 5.904 3.573 -8.064 1.00 0.00 C ATOM 148 C PRO A 40 5.538 4.792 -8.922 1.00 0.00 C ATOM 149 O PRO A 40 4.408 4.945 -9.352 1.00 0.00 O ATOM 150 CB PRO A 40 5.517 3.765 -6.605 1.00 0.00 C ATOM 151 CG PRO A 40 6.750 4.257 -5.879 1.00 0.00 C ATOM 152 CD PRO A 40 7.965 3.805 -6.689 1.00 0.00 C ATOM 0 HA PRO A 40 5.377 2.731 -8.513 1.00 0.00 H new ATOM 0 HB2 PRO A 40 4.703 4.485 -6.514 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.164 2.828 -6.174 1.00 0.00 H new ATOM 0 HG2 PRO A 40 6.733 5.343 -5.785 1.00 0.00 H new ATOM 0 HG3 PRO A 40 6.789 3.850 -4.868 1.00 0.00 H new ATOM 0 HD2 PRO A 40 8.690 4.611 -6.801 1.00 0.00 H new ATOM 0 HD3 PRO A 40 8.481 2.977 -6.203 1.00 0.00 H new ATOM 160 N GLN A 41 6.491 5.650 -9.193 1.00 0.00 N ATOM 161 CA GLN A 41 6.218 6.840 -10.042 1.00 0.00 C ATOM 162 C GLN A 41 6.162 6.381 -11.502 1.00 0.00 C ATOM 163 O GLN A 41 5.408 6.904 -12.305 1.00 0.00 O ATOM 164 CB GLN A 41 7.352 7.859 -9.849 1.00 0.00 C ATOM 165 CG GLN A 41 7.170 9.055 -10.791 1.00 0.00 C ATOM 166 CD GLN A 41 5.886 9.804 -10.427 1.00 0.00 C ATOM 167 OE1 GLN A 41 5.568 9.958 -9.265 1.00 0.00 O ATOM 168 NE2 GLN A 41 5.129 10.279 -11.378 1.00 0.00 N ATOM 0 H GLN A 41 7.451 5.572 -8.858 1.00 0.00 H new ATOM 0 HA GLN A 41 5.272 7.307 -9.767 1.00 0.00 H new ATOM 0 HB2 GLN A 41 7.367 8.203 -8.815 1.00 0.00 H new ATOM 0 HB3 GLN A 41 8.313 7.382 -10.040 1.00 0.00 H new ATOM 0 HG2 GLN A 41 8.027 9.724 -10.716 1.00 0.00 H new ATOM 0 HG3 GLN A 41 7.123 8.713 -11.825 1.00 0.00 H new ATOM 0 HE21 GLN A 41 5.395 10.150 -12.354 1.00 0.00 H new ATOM 0 HE22 GLN A 41 4.271 10.779 -11.145 1.00 0.00 H new ATOM 177 N LEU A 42 6.966 5.409 -11.848 1.00 0.00 N ATOM 178 CA LEU A 42 6.988 4.912 -13.242 1.00 0.00 C ATOM 179 C LEU A 42 5.756 4.048 -13.502 1.00 0.00 C ATOM 180 O LEU A 42 5.124 4.155 -14.536 1.00 0.00 O ATOM 181 CB LEU A 42 8.249 4.064 -13.473 1.00 0.00 C ATOM 182 CG LEU A 42 9.582 4.867 -13.343 1.00 0.00 C ATOM 183 CD1 LEU A 42 9.386 6.336 -12.921 1.00 0.00 C ATOM 184 CD2 LEU A 42 10.482 4.181 -12.308 1.00 0.00 C ATOM 0 H LEU A 42 7.611 4.939 -11.213 1.00 0.00 H new ATOM 0 HA LEU A 42 6.989 5.765 -13.920 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.259 3.243 -12.756 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.199 3.619 -14.467 1.00 0.00 H new ATOM 0 HG LEU A 42 10.034 4.876 -14.335 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.357 6.827 -12.852 1.00 0.00 H new ATOM 0 HD12 LEU A 42 8.771 6.848 -13.661 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.891 6.373 -11.951 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.415 4.736 -12.212 1.00 0.00 H new ATOM 0 HD22 LEU A 42 9.974 4.156 -11.344 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.698 3.163 -12.631 1.00 0.00 H new ATOM 196 N ARG A 43 5.406 3.184 -12.575 1.00 0.00 N ATOM 197 CA ARG A 43 4.213 2.314 -12.782 1.00 0.00 C ATOM 198 C ARG A 43 2.974 3.192 -12.961 1.00 0.00 C ATOM 199 O ARG A 43 2.156 2.958 -13.833 1.00 0.00 O ATOM 200 CB ARG A 43 4.036 1.369 -11.585 1.00 0.00 C ATOM 201 CG ARG A 43 3.670 2.148 -10.318 1.00 0.00 C ATOM 202 CD ARG A 43 3.582 1.184 -9.134 1.00 0.00 C ATOM 203 NE ARG A 43 2.927 1.873 -7.978 1.00 0.00 N ATOM 204 CZ ARG A 43 3.043 1.415 -6.746 1.00 0.00 C ATOM 205 NH1 ARG A 43 3.735 0.333 -6.476 1.00 0.00 N ATOM 206 NH2 ARG A 43 2.455 2.055 -5.773 1.00 0.00 N ATOM 0 H ARG A 43 5.895 3.048 -11.690 1.00 0.00 H new ATOM 0 HA ARG A 43 4.353 1.708 -13.677 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.256 0.640 -11.805 1.00 0.00 H new ATOM 0 HB3 ARG A 43 4.957 0.810 -11.419 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.419 2.915 -10.121 1.00 0.00 H new ATOM 0 HG3 ARG A 43 2.718 2.660 -10.455 1.00 0.00 H new ATOM 0 HD2 ARG A 43 3.012 0.298 -9.414 1.00 0.00 H new ATOM 0 HD3 ARG A 43 4.579 0.845 -8.852 1.00 0.00 H new ATOM 0 HE ARG A 43 2.378 2.716 -8.146 1.00 0.00 H new ATOM 0 HH11 ARG A 43 4.200 -0.176 -7.228 1.00 0.00 H new ATOM 0 HH12 ARG A 43 3.808 0.001 -5.514 1.00 0.00 H new ATOM 0 HH21 ARG A 43 1.915 2.897 -5.970 1.00 0.00 H new ATOM 0 HH22 ARG A 43 2.536 1.713 -4.815 1.00 0.00 H new ATOM 220 N LYS A 44 2.839 4.217 -12.154 1.00 0.00 N ATOM 221 CA LYS A 44 1.670 5.110 -12.298 1.00 0.00 C ATOM 222 C LYS A 44 1.771 5.824 -13.651 1.00 0.00 C ATOM 223 O LYS A 44 0.774 6.151 -14.266 1.00 0.00 O ATOM 224 CB LYS A 44 1.641 6.127 -11.149 1.00 0.00 C ATOM 225 CG LYS A 44 2.889 7.014 -11.187 1.00 0.00 C ATOM 226 CD LYS A 44 2.702 8.193 -10.231 1.00 0.00 C ATOM 227 CE LYS A 44 2.771 7.695 -8.786 1.00 0.00 C ATOM 228 NZ LYS A 44 2.921 8.860 -7.867 1.00 0.00 N ATOM 0 H LYS A 44 3.490 4.465 -11.409 1.00 0.00 H new ATOM 0 HA LYS A 44 0.747 4.532 -12.258 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.746 6.745 -11.225 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.588 5.604 -10.194 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.768 6.436 -10.902 1.00 0.00 H new ATOM 0 HG3 LYS A 44 3.060 7.377 -12.200 1.00 0.00 H new ATOM 0 HD2 LYS A 44 3.474 8.942 -10.406 1.00 0.00 H new ATOM 0 HD3 LYS A 44 1.742 8.675 -10.415 1.00 0.00 H new ATOM 0 HE2 LYS A 44 1.868 7.137 -8.539 1.00 0.00 H new ATOM 0 HE3 LYS A 44 3.612 7.012 -8.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 3.036 8.520 -6.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 3.758 9.413 -8.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 2.074 9.460 -7.927 1.00 0.00 H new ATOM 242 N ASP A 45 2.978 6.055 -14.117 1.00 0.00 N ATOM 243 CA ASP A 45 3.157 6.726 -15.425 1.00 0.00 C ATOM 244 C ASP A 45 2.655 5.801 -16.534 1.00 0.00 C ATOM 245 O ASP A 45 1.938 6.227 -17.415 1.00 0.00 O ATOM 246 CB ASP A 45 4.636 7.047 -15.644 1.00 0.00 C ATOM 247 CG ASP A 45 5.060 8.185 -14.714 1.00 0.00 C ATOM 248 OD1 ASP A 45 4.237 9.044 -14.443 1.00 0.00 O ATOM 249 OD2 ASP A 45 6.204 8.180 -14.288 1.00 0.00 O ATOM 0 H ASP A 45 3.843 5.803 -13.638 1.00 0.00 H new ATOM 0 HA ASP A 45 2.589 7.656 -15.441 1.00 0.00 H new ATOM 0 HB2 ASP A 45 5.242 6.162 -15.451 1.00 0.00 H new ATOM 0 HB3 ASP A 45 4.807 7.331 -16.683 1.00 0.00 H new ATOM 254 N ILE A 46 3.011 4.531 -16.496 1.00 0.00 N ATOM 255 CA ILE A 46 2.529 3.591 -17.557 1.00 0.00 C ATOM 256 C ILE A 46 0.994 3.562 -17.535 1.00 0.00 C ATOM 257 O ILE A 46 0.354 3.371 -18.552 1.00 0.00 O ATOM 258 CB ILE A 46 3.127 2.179 -17.345 1.00 0.00 C ATOM 259 CG1 ILE A 46 2.840 1.329 -18.588 1.00 0.00 C ATOM 260 CG2 ILE A 46 2.546 1.484 -16.102 1.00 0.00 C ATOM 261 CD1 ILE A 46 3.573 -0.011 -18.483 1.00 0.00 C ATOM 0 H ILE A 46 3.608 4.113 -15.782 1.00 0.00 H new ATOM 0 HA ILE A 46 2.861 3.936 -18.536 1.00 0.00 H new ATOM 0 HB ILE A 46 4.200 2.285 -17.187 1.00 0.00 H new ATOM 0 HG12 ILE A 46 1.767 1.160 -18.684 1.00 0.00 H new ATOM 0 HG13 ILE A 46 3.161 1.860 -19.484 1.00 0.00 H new ATOM 0 HG21 ILE A 46 2.995 0.497 -15.994 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.764 2.081 -15.216 1.00 0.00 H new ATOM 0 HG23 ILE A 46 1.467 1.381 -16.214 1.00 0.00 H new ATOM 0 HD11 ILE A 46 3.365 -0.610 -19.369 1.00 0.00 H new ATOM 0 HD12 ILE A 46 4.646 0.166 -18.409 1.00 0.00 H new ATOM 0 HD13 ILE A 46 3.231 -0.544 -17.596 1.00 0.00 H new ATOM 273 N LEU A 47 0.404 3.782 -16.381 1.00 0.00 N ATOM 274 CA LEU A 47 -1.077 3.805 -16.287 1.00 0.00 C ATOM 275 C LEU A 47 -1.580 5.023 -17.055 1.00 0.00 C ATOM 276 O LEU A 47 -2.526 4.948 -17.817 1.00 0.00 O ATOM 277 CB LEU A 47 -1.496 3.915 -14.819 1.00 0.00 C ATOM 278 CG LEU A 47 -1.424 2.540 -14.155 1.00 0.00 C ATOM 279 CD1 LEU A 47 -1.491 2.702 -12.635 1.00 0.00 C ATOM 280 CD2 LEU A 47 -2.600 1.684 -14.627 1.00 0.00 C ATOM 0 H LEU A 47 0.894 3.946 -15.502 1.00 0.00 H new ATOM 0 HA LEU A 47 -1.498 2.891 -16.706 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -0.844 4.616 -14.297 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.510 4.310 -14.749 1.00 0.00 H new ATOM 0 HG LEU A 47 -0.487 2.054 -14.428 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.440 1.721 -12.162 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -0.654 3.312 -12.297 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.428 3.188 -12.362 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.549 0.703 -14.154 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.537 2.170 -14.354 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.554 1.567 -15.710 1.00 0.00 H new ATOM 292 N GLU A 48 -0.928 6.145 -16.871 1.00 0.00 N ATOM 293 CA GLU A 48 -1.336 7.381 -17.601 1.00 0.00 C ATOM 294 C GLU A 48 -0.973 7.190 -19.065 1.00 0.00 C ATOM 295 O GLU A 48 -1.688 7.606 -19.957 1.00 0.00 O ATOM 296 CB GLU A 48 -0.601 8.626 -17.068 1.00 0.00 C ATOM 297 CG GLU A 48 -0.335 8.510 -15.562 1.00 0.00 C ATOM 298 CD GLU A 48 -0.633 9.844 -14.874 1.00 0.00 C ATOM 299 OE1 GLU A 48 0.263 10.669 -14.811 1.00 0.00 O ATOM 300 OE2 GLU A 48 -1.752 10.017 -14.421 1.00 0.00 O ATOM 0 H GLU A 48 -0.130 6.256 -16.245 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.406 7.539 -17.463 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.343 8.749 -17.598 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -1.197 9.517 -17.267 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -0.957 7.724 -15.134 1.00 0.00 H new ATOM 0 HG3 GLU A 48 0.703 8.226 -15.388 1.00 0.00 H new ATOM 307 N VAL A 49 0.139 6.543 -19.317 1.00 0.00 N ATOM 308 CA VAL A 49 0.569 6.294 -20.720 1.00 0.00 C ATOM 309 C VAL A 49 -0.498 5.437 -21.400 1.00 0.00 C ATOM 310 O VAL A 49 -1.070 5.826 -22.395 1.00 0.00 O ATOM 311 CB VAL A 49 1.916 5.566 -20.729 1.00 0.00 C ATOM 312 CG1 VAL A 49 2.385 5.382 -22.173 1.00 0.00 C ATOM 313 CG2 VAL A 49 2.955 6.393 -19.955 1.00 0.00 C ATOM 0 H VAL A 49 0.768 6.176 -18.603 1.00 0.00 H new ATOM 0 HA VAL A 49 0.686 7.237 -21.254 1.00 0.00 H new ATOM 0 HB VAL A 49 1.804 4.591 -20.255 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.344 4.864 -22.181 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.650 4.793 -22.722 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.496 6.357 -22.647 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.913 5.873 -19.963 1.00 0.00 H new ATOM 0 HG22 VAL A 49 3.068 7.369 -20.427 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.622 6.524 -18.926 1.00 0.00 H new ATOM 323 N ILE A 50 -0.809 4.289 -20.841 1.00 0.00 N ATOM 324 CA ILE A 50 -1.881 3.431 -21.437 1.00 0.00 C ATOM 325 C ILE A 50 -3.184 4.243 -21.516 1.00 0.00 C ATOM 326 O ILE A 50 -4.055 3.956 -22.313 1.00 0.00 O ATOM 327 CB ILE A 50 -2.093 2.181 -20.574 1.00 0.00 C ATOM 328 CG1 ILE A 50 -0.771 1.419 -20.447 1.00 0.00 C ATOM 329 CG2 ILE A 50 -3.136 1.273 -21.231 1.00 0.00 C ATOM 330 CD1 ILE A 50 -0.760 0.633 -19.135 1.00 0.00 C ATOM 0 H ILE A 50 -0.368 3.912 -20.002 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.584 3.116 -22.437 1.00 0.00 H new ATOM 0 HB ILE A 50 -2.441 2.481 -19.586 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.647 0.740 -21.291 1.00 0.00 H new ATOM 0 HG13 ILE A 50 0.067 2.116 -20.473 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.285 0.386 -20.616 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.079 1.811 -21.326 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.788 0.975 -22.220 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.181 0.090 -19.044 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -0.864 1.322 -18.297 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.589 -0.074 -19.128 1.00 0.00 H new ATOM 342 N CYS A 51 -3.307 5.265 -20.700 1.00 0.00 N ATOM 343 CA CYS A 51 -4.524 6.112 -20.729 1.00 0.00 C ATOM 344 C CYS A 51 -4.476 7.025 -21.960 1.00 0.00 C ATOM 345 O CYS A 51 -5.443 7.161 -22.679 1.00 0.00 O ATOM 346 CB CYS A 51 -4.576 6.964 -19.455 1.00 0.00 C ATOM 347 SG CYS A 51 -6.250 7.614 -19.231 1.00 0.00 S ATOM 0 H CYS A 51 -2.606 5.543 -20.013 1.00 0.00 H new ATOM 0 HA CYS A 51 -5.412 5.482 -20.781 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -4.289 6.364 -18.592 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -3.862 7.785 -19.524 1.00 0.00 H new ATOM 0 HG CYS A 51 -6.295 8.335 -18.150 1.00 0.00 H new ATOM 353 N LYS A 52 -3.350 7.647 -22.209 1.00 0.00 N ATOM 354 CA LYS A 52 -3.233 8.557 -23.396 1.00 0.00 C ATOM 355 C LYS A 52 -3.535 7.784 -24.681 1.00 0.00 C ATOM 356 O LYS A 52 -4.045 8.331 -25.641 1.00 0.00 O ATOM 357 CB LYS A 52 -1.810 9.117 -23.498 1.00 0.00 C ATOM 358 CG LYS A 52 -1.398 9.790 -22.187 1.00 0.00 C ATOM 359 CD LYS A 52 0.112 9.620 -21.988 1.00 0.00 C ATOM 360 CE LYS A 52 0.837 10.886 -22.451 1.00 0.00 C ATOM 361 NZ LYS A 52 0.722 11.937 -21.400 1.00 0.00 N ATOM 0 H LYS A 52 -2.505 7.565 -21.643 1.00 0.00 H new ATOM 0 HA LYS A 52 -3.946 9.372 -23.270 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.113 8.313 -23.734 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -1.755 9.837 -24.315 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.657 10.848 -22.210 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.939 9.347 -21.351 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.331 9.427 -20.938 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.468 8.758 -22.552 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.886 10.666 -22.647 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.406 11.243 -23.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 0.866 12.874 -21.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.224 11.895 -20.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.443 11.776 -20.668 1.00 0.00 H new ATOM 375 N TYR A 53 -3.205 6.520 -24.708 1.00 0.00 N ATOM 376 CA TYR A 53 -3.442 5.699 -25.921 1.00 0.00 C ATOM 377 C TYR A 53 -4.696 4.826 -25.734 1.00 0.00 C ATOM 378 O TYR A 53 -5.213 4.271 -26.685 1.00 0.00 O ATOM 379 CB TYR A 53 -2.235 4.780 -26.145 1.00 0.00 C ATOM 380 CG TYR A 53 -0.962 5.575 -26.382 1.00 0.00 C ATOM 381 CD1 TYR A 53 -0.434 6.393 -25.373 1.00 0.00 C ATOM 382 CD2 TYR A 53 -0.289 5.463 -27.605 1.00 0.00 C ATOM 383 CE1 TYR A 53 0.754 7.098 -25.584 1.00 0.00 C ATOM 384 CE2 TYR A 53 0.905 6.166 -27.813 1.00 0.00 C ATOM 385 CZ TYR A 53 1.425 6.984 -26.801 1.00 0.00 C ATOM 386 OH TYR A 53 2.601 7.676 -27.009 1.00 0.00 O ATOM 0 H TYR A 53 -2.776 6.020 -23.929 1.00 0.00 H new ATOM 0 HA TYR A 53 -3.585 6.360 -26.776 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -2.104 4.133 -25.278 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.424 4.132 -27.001 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -0.948 6.479 -24.427 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -0.690 4.835 -28.387 1.00 0.00 H new ATOM 0 HE1 TYR A 53 1.152 7.731 -24.805 1.00 0.00 H new ATOM 0 HE2 TYR A 53 1.426 6.077 -28.755 1.00 0.00 H new ATOM 0 HH TYR A 53 2.939 7.484 -27.909 1.00 0.00 H new ATOM 396 N VAL A 54 -5.178 4.683 -24.518 1.00 0.00 N ATOM 397 CA VAL A 54 -6.385 3.824 -24.274 1.00 0.00 C ATOM 398 C VAL A 54 -7.142 4.391 -23.049 1.00 0.00 C ATOM 399 O VAL A 54 -7.281 5.591 -22.926 1.00 0.00 O ATOM 400 CB VAL A 54 -5.957 2.355 -24.030 1.00 0.00 C ATOM 401 CG1 VAL A 54 -7.125 1.426 -24.368 1.00 0.00 C ATOM 402 CG2 VAL A 54 -4.761 1.974 -24.914 1.00 0.00 C ATOM 0 H VAL A 54 -4.788 5.124 -23.685 1.00 0.00 H new ATOM 0 HA VAL A 54 -7.040 3.835 -25.145 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.671 2.253 -22.983 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -6.828 0.391 -24.198 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -7.978 1.668 -23.734 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -7.403 1.556 -25.414 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -4.482 0.938 -24.722 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.033 2.088 -25.963 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -3.917 2.625 -24.685 1.00 0.00 H new ATOM 412 N GLN A 55 -7.639 3.564 -22.146 1.00 0.00 N ATOM 413 CA GLN A 55 -8.366 4.107 -20.960 1.00 0.00 C ATOM 414 C GLN A 55 -8.709 2.967 -20.000 1.00 0.00 C ATOM 415 O GLN A 55 -9.590 2.168 -20.254 1.00 0.00 O ATOM 416 CB GLN A 55 -9.648 4.805 -21.422 1.00 0.00 C ATOM 417 CG GLN A 55 -9.556 6.306 -21.133 1.00 0.00 C ATOM 418 CD GLN A 55 -10.628 7.048 -21.933 1.00 0.00 C ATOM 419 OE1 GLN A 55 -11.669 6.497 -22.231 1.00 0.00 O ATOM 420 NE2 GLN A 55 -10.418 8.284 -22.293 1.00 0.00 N ATOM 0 H GLN A 55 -7.569 2.547 -22.186 1.00 0.00 H new ATOM 0 HA GLN A 55 -7.732 4.828 -20.443 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -9.799 4.640 -22.489 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -10.510 4.379 -20.909 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -9.690 6.490 -20.067 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -8.567 6.678 -21.399 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -9.544 8.747 -22.043 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -11.128 8.788 -22.825 1.00 0.00 H new ATOM 429 N ILE A 56 -8.013 2.897 -18.900 1.00 0.00 N ATOM 430 CA ILE A 56 -8.272 1.822 -17.898 1.00 0.00 C ATOM 431 C ILE A 56 -8.159 2.413 -16.493 1.00 0.00 C ATOM 432 O ILE A 56 -7.691 3.523 -16.317 1.00 0.00 O ATOM 433 CB ILE A 56 -7.250 0.687 -18.053 1.00 0.00 C ATOM 434 CG1 ILE A 56 -5.858 1.264 -18.356 1.00 0.00 C ATOM 435 CG2 ILE A 56 -7.683 -0.231 -19.194 1.00 0.00 C ATOM 436 CD1 ILE A 56 -4.798 0.490 -17.568 1.00 0.00 C ATOM 0 H ILE A 56 -7.267 3.546 -18.648 1.00 0.00 H new ATOM 0 HA ILE A 56 -9.272 1.419 -18.059 1.00 0.00 H new ATOM 0 HB ILE A 56 -7.202 0.121 -17.123 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.651 1.199 -19.424 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -5.825 2.320 -18.089 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.959 -1.038 -19.306 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -8.663 -0.652 -18.971 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -7.736 0.341 -20.121 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -3.812 0.901 -17.784 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -5.002 0.578 -16.501 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -4.825 -0.561 -17.857 1.00 0.00 H new ATOM 448 N ASP A 57 -8.580 1.681 -15.497 1.00 0.00 N ATOM 449 CA ASP A 57 -8.493 2.193 -14.101 1.00 0.00 C ATOM 450 C ASP A 57 -7.258 1.589 -13.420 1.00 0.00 C ATOM 451 O ASP A 57 -6.714 0.616 -13.905 1.00 0.00 O ATOM 452 CB ASP A 57 -9.751 1.784 -13.330 1.00 0.00 C ATOM 453 CG ASP A 57 -10.843 2.834 -13.540 1.00 0.00 C ATOM 454 OD1 ASP A 57 -10.526 4.012 -13.478 1.00 0.00 O ATOM 455 OD2 ASP A 57 -11.978 2.445 -13.758 1.00 0.00 O ATOM 0 H ASP A 57 -8.981 0.748 -15.591 1.00 0.00 H new ATOM 0 HA ASP A 57 -8.412 3.280 -14.112 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -10.099 0.809 -13.672 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -9.524 1.687 -12.268 1.00 0.00 H new ATOM 460 N PRO A 58 -6.843 2.166 -12.310 1.00 0.00 N ATOM 461 CA PRO A 58 -5.656 1.675 -11.542 1.00 0.00 C ATOM 462 C PRO A 58 -6.017 0.386 -10.810 1.00 0.00 C ATOM 463 O PRO A 58 -5.188 -0.484 -10.620 1.00 0.00 O ATOM 464 CB PRO A 58 -5.347 2.810 -10.576 1.00 0.00 C ATOM 465 CG PRO A 58 -6.629 3.597 -10.397 1.00 0.00 C ATOM 466 CD PRO A 58 -7.479 3.365 -11.647 1.00 0.00 C ATOM 0 HA PRO A 58 -4.796 1.437 -12.168 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -4.997 2.419 -9.620 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -4.555 3.447 -10.969 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -7.161 3.269 -9.504 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -6.415 4.658 -10.269 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -8.521 3.172 -11.390 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -7.468 4.235 -12.303 1.00 0.00 H new ATOM 474 N GLU A 59 -7.263 0.244 -10.437 1.00 0.00 N ATOM 475 CA GLU A 59 -7.702 -1.006 -9.757 1.00 0.00 C ATOM 476 C GLU A 59 -7.666 -2.168 -10.764 1.00 0.00 C ATOM 477 O GLU A 59 -7.764 -3.321 -10.387 1.00 0.00 O ATOM 478 CB GLU A 59 -9.128 -0.827 -9.233 1.00 0.00 C ATOM 479 CG GLU A 59 -9.176 0.369 -8.280 1.00 0.00 C ATOM 480 CD GLU A 59 -8.780 -0.082 -6.874 1.00 0.00 C ATOM 481 OE1 GLU A 59 -9.558 -0.793 -6.260 1.00 0.00 O ATOM 482 OE2 GLU A 59 -7.705 0.291 -6.435 1.00 0.00 O ATOM 0 H GLU A 59 -7.994 0.942 -10.575 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.036 -1.224 -8.922 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -9.815 -0.671 -10.064 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.453 -1.730 -8.717 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.500 1.151 -8.626 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -10.178 0.797 -8.267 1.00 0.00 H new ATOM 489 N MET A 60 -7.521 -1.877 -12.043 1.00 0.00 N ATOM 490 CA MET A 60 -7.472 -2.958 -13.063 1.00 0.00 C ATOM 491 C MET A 60 -6.020 -3.406 -13.260 1.00 0.00 C ATOM 492 O MET A 60 -5.759 -4.516 -13.685 1.00 0.00 O ATOM 493 CB MET A 60 -8.024 -2.417 -14.386 1.00 0.00 C ATOM 494 CG MET A 60 -9.558 -2.426 -14.351 1.00 0.00 C ATOM 495 SD MET A 60 -10.191 -3.859 -15.261 1.00 0.00 S ATOM 496 CE MET A 60 -10.200 -3.097 -16.902 1.00 0.00 C ATOM 0 H MET A 60 -7.435 -0.931 -12.414 1.00 0.00 H new ATOM 0 HA MET A 60 -8.070 -3.807 -12.733 1.00 0.00 H new ATOM 0 HB2 MET A 60 -7.661 -1.403 -14.555 1.00 0.00 H new ATOM 0 HB3 MET A 60 -7.666 -3.026 -15.216 1.00 0.00 H new ATOM 0 HG2 MET A 60 -9.906 -2.458 -13.319 1.00 0.00 H new ATOM 0 HG3 MET A 60 -9.945 -1.506 -14.790 1.00 0.00 H new ATOM 0 HE1 MET A 60 -10.212 -3.876 -17.665 1.00 0.00 H new ATOM 0 HE2 MET A 60 -11.086 -2.471 -17.008 1.00 0.00 H new ATOM 0 HE3 MET A 60 -9.307 -2.484 -17.023 1.00 0.00 H new ATOM 506 N VAL A 61 -5.072 -2.550 -12.954 1.00 0.00 N ATOM 507 CA VAL A 61 -3.638 -2.923 -13.123 1.00 0.00 C ATOM 508 C VAL A 61 -3.063 -3.381 -11.780 1.00 0.00 C ATOM 509 O VAL A 61 -3.186 -2.699 -10.780 1.00 0.00 O ATOM 510 CB VAL A 61 -2.856 -1.707 -13.628 1.00 0.00 C ATOM 511 CG1 VAL A 61 -1.417 -2.117 -13.948 1.00 0.00 C ATOM 512 CG2 VAL A 61 -3.526 -1.157 -14.892 1.00 0.00 C ATOM 0 H VAL A 61 -5.234 -1.609 -12.594 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.556 -3.736 -13.844 1.00 0.00 H new ATOM 0 HB VAL A 61 -2.848 -0.937 -12.857 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -0.863 -1.250 -14.307 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -0.940 -2.505 -13.048 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -1.421 -2.889 -14.717 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -2.970 -0.291 -15.252 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.536 -1.928 -15.663 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.549 -0.860 -14.662 1.00 0.00 H new ATOM 522 N THR A 62 -2.440 -4.534 -11.751 1.00 0.00 N ATOM 523 CA THR A 62 -1.859 -5.044 -10.481 1.00 0.00 C ATOM 524 C THR A 62 -0.371 -4.695 -10.418 1.00 0.00 C ATOM 525 O THR A 62 0.266 -4.465 -11.429 1.00 0.00 O ATOM 526 CB THR A 62 -2.023 -6.565 -10.412 1.00 0.00 C ATOM 527 OG1 THR A 62 -3.297 -6.926 -10.929 1.00 0.00 O ATOM 528 CG2 THR A 62 -1.912 -7.024 -8.958 1.00 0.00 C ATOM 0 H THR A 62 -2.311 -5.143 -12.559 1.00 0.00 H new ATOM 0 HA THR A 62 -2.378 -4.582 -9.641 1.00 0.00 H new ATOM 0 HB THR A 62 -1.242 -7.043 -11.003 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.403 -7.899 -10.887 1.00 0.00 H new ATOM 0 HG21 THR A 62 -2.029 -8.107 -8.908 1.00 0.00 H new ATOM 0 HG22 THR A 62 -0.935 -6.746 -8.562 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.693 -6.547 -8.365 1.00 0.00 H new ATOM 536 N VAL A 63 0.185 -4.660 -9.235 1.00 0.00 N ATOM 537 CA VAL A 63 1.633 -4.334 -9.089 1.00 0.00 C ATOM 538 C VAL A 63 2.231 -5.207 -7.988 1.00 0.00 C ATOM 539 O VAL A 63 1.835 -5.128 -6.840 1.00 0.00 O ATOM 540 CB VAL A 63 1.788 -2.863 -8.710 1.00 0.00 C ATOM 541 CG1 VAL A 63 3.271 -2.488 -8.698 1.00 0.00 C ATOM 542 CG2 VAL A 63 1.054 -1.998 -9.732 1.00 0.00 C ATOM 0 H VAL A 63 -0.305 -4.844 -8.360 1.00 0.00 H new ATOM 0 HA VAL A 63 2.149 -4.521 -10.031 1.00 0.00 H new ATOM 0 HB VAL A 63 1.366 -2.698 -7.719 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.379 -1.438 -8.427 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.797 -3.106 -7.970 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.696 -2.653 -9.688 1.00 0.00 H new ATOM 0 HG21 VAL A 63 1.163 -0.947 -9.464 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.478 -2.166 -10.722 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -0.003 -2.263 -9.740 1.00 0.00 H new ATOM 552 N GLN A 64 3.177 -6.040 -8.331 1.00 0.00 N ATOM 553 CA GLN A 64 3.800 -6.925 -7.309 1.00 0.00 C ATOM 554 C GLN A 64 5.325 -6.816 -7.391 1.00 0.00 C ATOM 555 O GLN A 64 5.902 -6.855 -8.460 1.00 0.00 O ATOM 556 CB GLN A 64 3.361 -8.375 -7.558 1.00 0.00 C ATOM 557 CG GLN A 64 3.628 -8.764 -9.018 1.00 0.00 C ATOM 558 CD GLN A 64 2.329 -8.671 -9.822 1.00 0.00 C ATOM 559 OE1 GLN A 64 2.002 -7.629 -10.353 1.00 0.00 O ATOM 560 NE2 GLN A 64 1.570 -9.727 -9.935 1.00 0.00 N ATOM 0 H GLN A 64 3.545 -6.145 -9.277 1.00 0.00 H new ATOM 0 HA GLN A 64 3.478 -6.618 -6.314 1.00 0.00 H new ATOM 0 HB2 GLN A 64 3.901 -9.046 -6.890 1.00 0.00 H new ATOM 0 HB3 GLN A 64 2.300 -8.486 -7.332 1.00 0.00 H new ATOM 0 HG2 GLN A 64 4.381 -8.104 -9.448 1.00 0.00 H new ATOM 0 HG3 GLN A 64 4.026 -9.778 -9.068 1.00 0.00 H new ATOM 0 HE21 GLN A 64 1.844 -10.602 -9.489 1.00 0.00 H new ATOM 0 HE22 GLN A 64 0.703 -9.677 -10.469 1.00 0.00 H new ATOM 569 N LEU A 65 5.980 -6.668 -6.266 1.00 0.00 N ATOM 570 CA LEU A 65 7.461 -6.546 -6.272 1.00 0.00 C ATOM 571 C LEU A 65 8.094 -7.866 -5.833 1.00 0.00 C ATOM 572 O LEU A 65 7.645 -8.503 -4.899 1.00 0.00 O ATOM 573 CB LEU A 65 7.882 -5.436 -5.313 1.00 0.00 C ATOM 574 CG LEU A 65 7.257 -5.670 -3.930 1.00 0.00 C ATOM 575 CD1 LEU A 65 8.326 -5.502 -2.848 1.00 0.00 C ATOM 576 CD2 LEU A 65 6.135 -4.654 -3.698 1.00 0.00 C ATOM 0 H LEU A 65 5.547 -6.627 -5.344 1.00 0.00 H new ATOM 0 HA LEU A 65 7.797 -6.306 -7.281 1.00 0.00 H new ATOM 0 HB2 LEU A 65 8.968 -5.409 -5.230 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.568 -4.468 -5.704 1.00 0.00 H new ATOM 0 HG LEU A 65 6.850 -6.680 -3.884 1.00 0.00 H new ATOM 0 HD11 LEU A 65 7.880 -5.668 -1.867 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.125 -6.225 -3.011 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.735 -4.493 -2.894 1.00 0.00 H new ATOM 0 HD21 LEU A 65 5.691 -4.820 -2.716 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.543 -3.644 -3.746 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.371 -4.774 -4.466 1.00 0.00 H new ATOM 588 N GLU A 66 9.141 -8.273 -6.501 1.00 0.00 N ATOM 589 CA GLU A 66 9.824 -9.544 -6.135 1.00 0.00 C ATOM 590 C GLU A 66 11.329 -9.289 -6.031 1.00 0.00 C ATOM 591 O GLU A 66 11.802 -8.212 -6.336 1.00 0.00 O ATOM 592 CB GLU A 66 9.553 -10.604 -7.212 1.00 0.00 C ATOM 593 CG GLU A 66 8.110 -11.109 -7.110 1.00 0.00 C ATOM 594 CD GLU A 66 7.860 -11.726 -5.730 1.00 0.00 C ATOM 595 OE1 GLU A 66 8.157 -12.897 -5.563 1.00 0.00 O ATOM 596 OE2 GLU A 66 7.378 -11.014 -4.864 1.00 0.00 O ATOM 0 H GLU A 66 9.553 -7.774 -7.290 1.00 0.00 H new ATOM 0 HA GLU A 66 9.445 -9.903 -5.178 1.00 0.00 H new ATOM 0 HB2 GLU A 66 9.728 -10.180 -8.201 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.246 -11.437 -7.095 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.416 -10.285 -7.279 1.00 0.00 H new ATOM 0 HG3 GLU A 66 7.921 -11.850 -7.887 1.00 0.00 H new ATOM 603 N GLN A 67 12.080 -10.266 -5.594 1.00 0.00 N ATOM 604 CA GLN A 67 13.557 -10.081 -5.464 1.00 0.00 C ATOM 605 C GLN A 67 14.266 -11.422 -5.665 1.00 0.00 C ATOM 606 O GLN A 67 13.672 -12.474 -5.525 1.00 0.00 O ATOM 607 CB GLN A 67 13.881 -9.538 -4.069 1.00 0.00 C ATOM 608 CG GLN A 67 13.442 -8.076 -3.969 1.00 0.00 C ATOM 609 CD GLN A 67 13.713 -7.556 -2.556 1.00 0.00 C ATOM 610 OE1 GLN A 67 14.850 -7.358 -2.176 1.00 0.00 O ATOM 611 NE2 GLN A 67 12.708 -7.324 -1.757 1.00 0.00 N ATOM 0 H GLN A 67 11.734 -11.186 -5.321 1.00 0.00 H new ATOM 0 HA GLN A 67 13.900 -9.375 -6.221 1.00 0.00 H new ATOM 0 HB2 GLN A 67 13.373 -10.133 -3.310 1.00 0.00 H new ATOM 0 HB3 GLN A 67 14.951 -9.620 -3.876 1.00 0.00 H new ATOM 0 HG2 GLN A 67 13.981 -7.473 -4.699 1.00 0.00 H new ATOM 0 HG3 GLN A 67 12.381 -7.987 -4.203 1.00 0.00 H new ATOM 0 HE21 GLN A 67 11.754 -7.490 -2.076 1.00 0.00 H new ATOM 0 HE22 GLN A 67 12.877 -6.976 -0.813 1.00 0.00 H new ATOM 620 N LYS A 68 15.536 -11.388 -5.987 1.00 0.00 N ATOM 621 CA LYS A 68 16.295 -12.657 -6.192 1.00 0.00 C ATOM 622 C LYS A 68 17.360 -12.794 -5.103 1.00 0.00 C ATOM 623 O LYS A 68 17.566 -11.895 -4.309 1.00 0.00 O ATOM 624 CB LYS A 68 16.982 -12.633 -7.557 1.00 0.00 C ATOM 625 CG LYS A 68 16.015 -13.127 -8.640 1.00 0.00 C ATOM 626 CD LYS A 68 16.149 -12.254 -9.893 1.00 0.00 C ATOM 627 CE LYS A 68 17.559 -12.385 -10.472 1.00 0.00 C ATOM 628 NZ LYS A 68 17.664 -13.659 -11.241 1.00 0.00 N ATOM 0 H LYS A 68 16.079 -10.534 -6.116 1.00 0.00 H new ATOM 0 HA LYS A 68 15.604 -13.499 -6.145 1.00 0.00 H new ATOM 0 HB2 LYS A 68 17.314 -11.621 -7.788 1.00 0.00 H new ATOM 0 HB3 LYS A 68 17.871 -13.263 -7.537 1.00 0.00 H new ATOM 0 HG2 LYS A 68 16.230 -14.167 -8.885 1.00 0.00 H new ATOM 0 HG3 LYS A 68 14.991 -13.092 -8.269 1.00 0.00 H new ATOM 0 HD2 LYS A 68 15.412 -12.555 -10.637 1.00 0.00 H new ATOM 0 HD3 LYS A 68 15.944 -11.213 -9.645 1.00 0.00 H new ATOM 0 HE2 LYS A 68 17.778 -11.537 -11.121 1.00 0.00 H new ATOM 0 HE3 LYS A 68 18.296 -12.370 -9.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 18.617 -13.741 -11.649 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 17.489 -14.464 -10.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 16.959 -13.662 -12.005 1.00 0.00 H new ATOM 642 N ASP A 69 18.039 -13.911 -5.067 1.00 0.00 N ATOM 643 CA ASP A 69 19.098 -14.118 -4.040 1.00 0.00 C ATOM 644 C ASP A 69 20.398 -13.412 -4.459 1.00 0.00 C ATOM 645 O ASP A 69 21.344 -13.355 -3.696 1.00 0.00 O ATOM 646 CB ASP A 69 19.362 -15.617 -3.880 1.00 0.00 C ATOM 647 CG ASP A 69 19.709 -16.224 -5.241 1.00 0.00 C ATOM 648 OD1 ASP A 69 20.698 -15.804 -5.819 1.00 0.00 O ATOM 649 OD2 ASP A 69 18.981 -17.097 -5.682 1.00 0.00 O ATOM 0 H ASP A 69 17.903 -14.692 -5.709 1.00 0.00 H new ATOM 0 HA ASP A 69 18.759 -13.697 -3.093 1.00 0.00 H new ATOM 0 HB2 ASP A 69 20.180 -15.780 -3.178 1.00 0.00 H new ATOM 0 HB3 ASP A 69 18.483 -16.109 -3.464 1.00 0.00 H new ATOM 654 N GLY A 70 20.461 -12.881 -5.662 1.00 0.00 N ATOM 655 CA GLY A 70 21.706 -12.192 -6.116 1.00 0.00 C ATOM 656 C GLY A 70 21.566 -10.680 -5.923 1.00 0.00 C ATOM 657 O GLY A 70 22.118 -9.899 -6.674 1.00 0.00 O ATOM 0 H GLY A 70 19.703 -12.898 -6.344 1.00 0.00 H new ATOM 0 HA2 GLY A 70 22.562 -12.561 -5.552 1.00 0.00 H new ATOM 0 HA3 GLY A 70 21.894 -12.417 -7.166 1.00 0.00 H new ATOM 661 N ASP A 71 20.827 -10.266 -4.924 1.00 0.00 N ATOM 662 CA ASP A 71 20.636 -8.805 -4.666 1.00 0.00 C ATOM 663 C ASP A 71 19.988 -8.150 -5.886 1.00 0.00 C ATOM 664 O ASP A 71 20.429 -7.121 -6.365 1.00 0.00 O ATOM 665 CB ASP A 71 21.991 -8.146 -4.376 1.00 0.00 C ATOM 666 CG ASP A 71 22.385 -8.410 -2.922 1.00 0.00 C ATOM 667 OD1 ASP A 71 21.787 -7.804 -2.048 1.00 0.00 O ATOM 668 OD2 ASP A 71 23.279 -9.212 -2.708 1.00 0.00 O ATOM 0 H ASP A 71 20.344 -10.883 -4.271 1.00 0.00 H new ATOM 0 HA ASP A 71 19.986 -8.673 -3.801 1.00 0.00 H new ATOM 0 HB2 ASP A 71 22.752 -8.543 -5.048 1.00 0.00 H new ATOM 0 HB3 ASP A 71 21.932 -7.073 -4.559 1.00 0.00 H new ATOM 673 N ILE A 72 18.945 -8.750 -6.392 1.00 0.00 N ATOM 674 CA ILE A 72 18.255 -8.189 -7.587 1.00 0.00 C ATOM 675 C ILE A 72 16.762 -8.037 -7.282 1.00 0.00 C ATOM 676 O ILE A 72 16.228 -8.710 -6.420 1.00 0.00 O ATOM 677 CB ILE A 72 18.453 -9.131 -8.778 1.00 0.00 C ATOM 678 CG1 ILE A 72 19.948 -9.508 -8.876 1.00 0.00 C ATOM 679 CG2 ILE A 72 17.983 -8.427 -10.055 1.00 0.00 C ATOM 680 CD1 ILE A 72 20.253 -10.240 -10.193 1.00 0.00 C ATOM 0 H ILE A 72 18.539 -9.611 -6.026 1.00 0.00 H new ATOM 0 HA ILE A 72 18.673 -7.213 -7.832 1.00 0.00 H new ATOM 0 HB ILE A 72 17.870 -10.042 -8.647 1.00 0.00 H new ATOM 0 HG12 ILE A 72 20.558 -8.607 -8.808 1.00 0.00 H new ATOM 0 HG13 ILE A 72 20.222 -10.142 -8.033 1.00 0.00 H new ATOM 0 HG21 ILE A 72 18.121 -9.091 -10.908 1.00 0.00 H new ATOM 0 HG22 ILE A 72 16.928 -8.170 -9.962 1.00 0.00 H new ATOM 0 HG23 ILE A 72 18.566 -7.518 -10.205 1.00 0.00 H new ATOM 0 HD11 ILE A 72 21.313 -10.492 -10.232 1.00 0.00 H new ATOM 0 HD12 ILE A 72 19.661 -11.153 -10.247 1.00 0.00 H new ATOM 0 HD13 ILE A 72 20.002 -9.594 -11.035 1.00 0.00 H new ATOM 692 N SER A 73 16.090 -7.157 -7.979 1.00 0.00 N ATOM 693 CA SER A 73 14.633 -6.952 -7.730 1.00 0.00 C ATOM 694 C SER A 73 13.843 -7.389 -8.962 1.00 0.00 C ATOM 695 O SER A 73 14.381 -7.513 -10.044 1.00 0.00 O ATOM 696 CB SER A 73 14.363 -5.474 -7.450 1.00 0.00 C ATOM 697 OG SER A 73 14.699 -5.184 -6.099 1.00 0.00 O ATOM 0 H SER A 73 16.489 -6.570 -8.712 1.00 0.00 H new ATOM 0 HA SER A 73 14.325 -7.545 -6.869 1.00 0.00 H new ATOM 0 HB2 SER A 73 14.950 -4.851 -8.125 1.00 0.00 H new ATOM 0 HB3 SER A 73 13.314 -5.243 -7.634 1.00 0.00 H new ATOM 0 HG SER A 73 14.529 -4.236 -5.916 1.00 0.00 H new ATOM 703 N ILE A 74 12.570 -7.630 -8.796 1.00 0.00 N ATOM 704 CA ILE A 74 11.723 -8.069 -9.939 1.00 0.00 C ATOM 705 C ILE A 74 10.303 -7.518 -9.739 1.00 0.00 C ATOM 706 O ILE A 74 9.438 -8.193 -9.211 1.00 0.00 O ATOM 707 CB ILE A 74 11.703 -9.606 -9.980 1.00 0.00 C ATOM 708 CG1 ILE A 74 13.121 -10.121 -10.275 1.00 0.00 C ATOM 709 CG2 ILE A 74 10.728 -10.096 -11.063 1.00 0.00 C ATOM 710 CD1 ILE A 74 13.129 -11.654 -10.353 1.00 0.00 C ATOM 0 H ILE A 74 12.077 -7.540 -7.907 1.00 0.00 H new ATOM 0 HA ILE A 74 12.122 -7.695 -10.882 1.00 0.00 H new ATOM 0 HB ILE A 74 11.369 -9.989 -9.016 1.00 0.00 H new ATOM 0 HG12 ILE A 74 13.479 -9.701 -11.215 1.00 0.00 H new ATOM 0 HG13 ILE A 74 13.806 -9.787 -9.495 1.00 0.00 H new ATOM 0 HG21 ILE A 74 10.723 -11.186 -11.082 1.00 0.00 H new ATOM 0 HG22 ILE A 74 9.725 -9.732 -10.841 1.00 0.00 H new ATOM 0 HG23 ILE A 74 11.044 -9.718 -12.035 1.00 0.00 H new ATOM 0 HD11 ILE A 74 14.140 -12.002 -10.562 1.00 0.00 H new ATOM 0 HD12 ILE A 74 12.792 -12.068 -9.403 1.00 0.00 H new ATOM 0 HD13 ILE A 74 12.460 -11.981 -11.149 1.00 0.00 H new ATOM 722 N LEU A 75 10.064 -6.296 -10.148 1.00 0.00 N ATOM 723 CA LEU A 75 8.714 -5.695 -9.975 1.00 0.00 C ATOM 724 C LEU A 75 7.831 -6.024 -11.177 1.00 0.00 C ATOM 725 O LEU A 75 8.042 -5.534 -12.269 1.00 0.00 O ATOM 726 CB LEU A 75 8.841 -4.179 -9.831 1.00 0.00 C ATOM 727 CG LEU A 75 7.498 -3.595 -9.386 1.00 0.00 C ATOM 728 CD1 LEU A 75 7.739 -2.418 -8.439 1.00 0.00 C ATOM 729 CD2 LEU A 75 6.721 -3.110 -10.613 1.00 0.00 C ATOM 0 H LEU A 75 10.752 -5.690 -10.596 1.00 0.00 H new ATOM 0 HA LEU A 75 8.256 -6.109 -9.077 1.00 0.00 H new ATOM 0 HB2 LEU A 75 9.615 -3.936 -9.103 1.00 0.00 H new ATOM 0 HB3 LEU A 75 9.146 -3.737 -10.780 1.00 0.00 H new ATOM 0 HG LEU A 75 6.923 -4.364 -8.870 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.782 -2.003 -8.123 1.00 0.00 H new ATOM 0 HD12 LEU A 75 8.292 -2.762 -7.565 1.00 0.00 H new ATOM 0 HD13 LEU A 75 8.315 -1.649 -8.954 1.00 0.00 H new ATOM 0 HD21 LEU A 75 5.764 -2.694 -10.297 1.00 0.00 H new ATOM 0 HD22 LEU A 75 7.298 -2.342 -11.129 1.00 0.00 H new ATOM 0 HD23 LEU A 75 6.547 -3.948 -11.288 1.00 0.00 H new ATOM 741 N GLU A 76 6.838 -6.848 -10.971 1.00 0.00 N ATOM 742 CA GLU A 76 5.920 -7.221 -12.084 1.00 0.00 C ATOM 743 C GLU A 76 4.591 -6.486 -11.898 1.00 0.00 C ATOM 744 O GLU A 76 4.099 -6.361 -10.797 1.00 0.00 O ATOM 745 CB GLU A 76 5.662 -8.733 -12.055 1.00 0.00 C ATOM 746 CG GLU A 76 6.989 -9.498 -11.981 1.00 0.00 C ATOM 747 CD GLU A 76 6.733 -10.906 -11.440 1.00 0.00 C ATOM 748 OE1 GLU A 76 6.022 -11.022 -10.457 1.00 0.00 O ATOM 749 OE2 GLU A 76 7.254 -11.845 -12.021 1.00 0.00 O ATOM 0 H GLU A 76 6.623 -7.281 -10.073 1.00 0.00 H new ATOM 0 HA GLU A 76 6.372 -6.947 -13.037 1.00 0.00 H new ATOM 0 HB2 GLU A 76 5.040 -8.986 -11.196 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.111 -9.032 -12.947 1.00 0.00 H new ATOM 0 HG2 GLU A 76 7.445 -9.553 -12.969 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.691 -8.970 -11.335 1.00 0.00 H new ATOM 756 N LEU A 77 3.999 -6.012 -12.965 1.00 0.00 N ATOM 757 CA LEU A 77 2.692 -5.304 -12.839 1.00 0.00 C ATOM 758 C LEU A 77 1.706 -5.899 -13.844 1.00 0.00 C ATOM 759 O LEU A 77 1.998 -6.022 -15.018 1.00 0.00 O ATOM 760 CB LEU A 77 2.870 -3.802 -13.099 1.00 0.00 C ATOM 761 CG LEU A 77 3.643 -3.576 -14.399 1.00 0.00 C ATOM 762 CD1 LEU A 77 3.237 -2.230 -15.004 1.00 0.00 C ATOM 763 CD2 LEU A 77 5.146 -3.568 -14.105 1.00 0.00 C ATOM 0 H LEU A 77 4.364 -6.085 -13.915 1.00 0.00 H new ATOM 0 HA LEU A 77 2.307 -5.431 -11.827 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.895 -3.318 -13.159 1.00 0.00 H new ATOM 0 HB3 LEU A 77 3.403 -3.343 -12.267 1.00 0.00 H new ATOM 0 HG LEU A 77 3.414 -4.377 -15.102 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.787 -2.067 -15.931 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.167 -2.233 -15.213 1.00 0.00 H new ATOM 0 HD13 LEU A 77 3.467 -1.430 -14.300 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.697 -3.407 -15.032 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.375 -2.767 -13.403 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.437 -4.525 -13.671 1.00 0.00 H new ATOM 775 N ASN A 78 0.545 -6.283 -13.389 1.00 0.00 N ATOM 776 CA ASN A 78 -0.460 -6.881 -14.303 1.00 0.00 C ATOM 777 C ASN A 78 -1.328 -5.774 -14.886 1.00 0.00 C ATOM 778 O ASN A 78 -1.668 -4.827 -14.206 1.00 0.00 O ATOM 779 CB ASN A 78 -1.357 -7.835 -13.519 1.00 0.00 C ATOM 780 CG ASN A 78 -0.523 -8.768 -12.622 1.00 0.00 C ATOM 781 OD1 ASN A 78 -0.995 -9.213 -11.595 1.00 0.00 O ATOM 782 ND2 ASN A 78 0.699 -9.087 -12.963 1.00 0.00 N ATOM 0 H ASN A 78 0.250 -6.206 -12.415 1.00 0.00 H new ATOM 0 HA ASN A 78 0.053 -7.420 -15.100 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.054 -7.263 -12.906 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -1.954 -8.429 -14.211 1.00 0.00 H new ATOM 0 HD21 ASN A 78 1.249 -9.706 -12.368 1.00 0.00 H new ATOM 0 HD22 ASN A 78 1.101 -8.717 -13.824 1.00 0.00 H new ATOM 789 N VAL A 79 -1.691 -5.885 -16.135 1.00 0.00 N ATOM 790 CA VAL A 79 -2.544 -4.834 -16.759 1.00 0.00 C ATOM 791 C VAL A 79 -3.848 -5.461 -17.251 1.00 0.00 C ATOM 792 O VAL A 79 -3.915 -6.002 -18.338 1.00 0.00 O ATOM 793 CB VAL A 79 -1.799 -4.202 -17.933 1.00 0.00 C ATOM 794 CG1 VAL A 79 -2.583 -2.987 -18.422 1.00 0.00 C ATOM 795 CG2 VAL A 79 -0.406 -3.763 -17.474 1.00 0.00 C ATOM 0 H VAL A 79 -1.434 -6.657 -16.750 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.771 -4.064 -16.022 1.00 0.00 H new ATOM 0 HB VAL A 79 -1.700 -4.926 -18.742 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -2.058 -2.529 -19.261 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.577 -3.300 -18.743 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -2.675 -2.263 -17.612 1.00 0.00 H new ATOM 0 HG21 VAL A 79 0.127 -3.312 -18.311 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.501 -3.034 -16.669 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.149 -4.630 -17.115 1.00 0.00 H new ATOM 805 N THR A 80 -4.882 -5.395 -16.451 1.00 0.00 N ATOM 806 CA THR A 80 -6.189 -5.989 -16.856 1.00 0.00 C ATOM 807 C THR A 80 -6.982 -4.984 -17.696 1.00 0.00 C ATOM 808 O THR A 80 -7.680 -4.141 -17.168 1.00 0.00 O ATOM 809 CB THR A 80 -6.993 -6.353 -15.604 1.00 0.00 C ATOM 810 OG1 THR A 80 -6.210 -7.195 -14.769 1.00 0.00 O ATOM 811 CG2 THR A 80 -8.276 -7.083 -16.008 1.00 0.00 C ATOM 0 H THR A 80 -4.876 -4.953 -15.532 1.00 0.00 H new ATOM 0 HA THR A 80 -6.006 -6.885 -17.449 1.00 0.00 H new ATOM 0 HB THR A 80 -7.253 -5.443 -15.064 1.00 0.00 H new ATOM 0 HG1 THR A 80 -5.756 -6.652 -14.091 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.845 -7.340 -15.115 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.877 -6.436 -16.647 1.00 0.00 H new ATOM 0 HG23 THR A 80 -8.021 -7.993 -16.550 1.00 0.00 H new ATOM 819 N LEU A 81 -6.885 -5.076 -18.998 1.00 0.00 N ATOM 820 CA LEU A 81 -7.634 -4.142 -19.879 1.00 0.00 C ATOM 821 C LEU A 81 -9.057 -4.696 -20.087 1.00 0.00 C ATOM 822 O LEU A 81 -9.219 -5.890 -20.239 1.00 0.00 O ATOM 823 CB LEU A 81 -6.922 -4.053 -21.227 1.00 0.00 C ATOM 824 CG LEU A 81 -5.471 -3.612 -21.017 1.00 0.00 C ATOM 825 CD1 LEU A 81 -4.581 -4.270 -22.073 1.00 0.00 C ATOM 826 CD2 LEU A 81 -5.377 -2.091 -21.151 1.00 0.00 C ATOM 0 H LEU A 81 -6.314 -5.765 -19.488 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.684 -3.152 -19.426 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.949 -5.021 -21.728 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.437 -3.344 -21.875 1.00 0.00 H new ATOM 0 HG LEU A 81 -5.140 -3.912 -20.023 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.548 -3.957 -21.924 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.648 -5.354 -21.981 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.912 -3.969 -23.067 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.344 -1.776 -21.002 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.707 -1.792 -22.146 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.012 -1.620 -20.401 1.00 0.00 H new ATOM 838 N PRO A 82 -10.055 -3.832 -20.087 1.00 0.00 N ATOM 839 CA PRO A 82 -11.486 -4.236 -20.272 1.00 0.00 C ATOM 840 C PRO A 82 -11.829 -4.355 -21.760 1.00 0.00 C ATOM 841 O PRO A 82 -10.988 -4.166 -22.619 1.00 0.00 O ATOM 842 CB PRO A 82 -12.262 -3.099 -19.624 1.00 0.00 C ATOM 843 CG PRO A 82 -11.368 -1.871 -19.650 1.00 0.00 C ATOM 844 CD PRO A 82 -9.933 -2.340 -19.906 1.00 0.00 C ATOM 0 HA PRO A 82 -11.715 -5.208 -19.835 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -13.190 -2.910 -20.164 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -12.535 -3.354 -18.600 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -11.689 -1.182 -20.431 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -11.431 -1.333 -18.704 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -9.511 -1.865 -20.792 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -9.279 -2.093 -19.070 1.00 0.00 H new ATOM 852 N GLU A 83 -13.063 -4.670 -22.065 1.00 0.00 N ATOM 853 CA GLU A 83 -13.482 -4.810 -23.489 1.00 0.00 C ATOM 854 C GLU A 83 -13.291 -3.478 -24.218 1.00 0.00 C ATOM 855 O GLU A 83 -12.694 -2.554 -23.700 1.00 0.00 O ATOM 856 CB GLU A 83 -14.962 -5.217 -23.545 1.00 0.00 C ATOM 857 CG GLU A 83 -15.079 -6.694 -23.924 1.00 0.00 C ATOM 858 CD GLU A 83 -16.554 -7.065 -24.090 1.00 0.00 C ATOM 859 OE1 GLU A 83 -17.225 -7.208 -23.080 1.00 0.00 O ATOM 860 OE2 GLU A 83 -16.988 -7.199 -25.222 1.00 0.00 O ATOM 0 H GLU A 83 -13.802 -4.837 -21.382 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.873 -5.574 -23.972 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -15.434 -5.042 -22.578 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -15.490 -4.602 -24.274 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -14.539 -6.886 -24.851 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -14.622 -7.315 -23.154 1.00 0.00 H new ATOM 867 N ALA A 84 -13.804 -3.379 -25.418 1.00 0.00 N ATOM 868 CA ALA A 84 -13.670 -2.116 -26.196 1.00 0.00 C ATOM 869 C ALA A 84 -14.409 -2.262 -27.528 1.00 0.00 C ATOM 870 O ALA A 84 -15.032 -3.274 -27.793 1.00 0.00 O ATOM 871 CB ALA A 84 -12.191 -1.826 -26.459 1.00 0.00 C ATOM 0 H ALA A 84 -14.313 -4.125 -25.893 1.00 0.00 H new ATOM 0 HA ALA A 84 -14.101 -1.292 -25.627 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -12.097 -0.901 -27.028 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -11.666 -1.722 -25.509 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.755 -2.648 -27.027 1.00 0.00 H new ATOM 877 N GLU A 85 -14.343 -1.260 -28.369 1.00 0.00 N ATOM 878 CA GLU A 85 -15.038 -1.334 -29.687 1.00 0.00 C ATOM 879 C GLU A 85 -14.749 -0.064 -30.490 1.00 0.00 C ATOM 880 O GLU A 85 -14.341 -0.124 -31.634 1.00 0.00 O ATOM 881 CB GLU A 85 -16.547 -1.463 -29.465 1.00 0.00 C ATOM 882 CG GLU A 85 -17.155 -2.321 -30.576 1.00 0.00 C ATOM 883 CD GLU A 85 -17.267 -1.493 -31.857 1.00 0.00 C ATOM 884 OE1 GLU A 85 -17.548 -0.310 -31.752 1.00 0.00 O ATOM 885 OE2 GLU A 85 -17.068 -2.055 -32.921 1.00 0.00 O ATOM 0 H GLU A 85 -13.836 -0.392 -28.197 1.00 0.00 H new ATOM 0 HA GLU A 85 -14.676 -2.203 -30.237 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -16.745 -1.914 -28.493 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -17.010 -0.476 -29.458 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -16.535 -3.200 -30.752 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -18.139 -2.680 -30.275 1.00 0.00 H new ATOM 892 N GLU A 86 -14.959 1.084 -29.896 1.00 0.00 N ATOM 893 CA GLU A 86 -14.704 2.363 -30.612 1.00 0.00 C ATOM 894 C GLU A 86 -13.218 2.727 -30.503 1.00 0.00 C ATOM 895 O GLU A 86 -12.861 3.790 -30.027 1.00 0.00 O ATOM 896 CB GLU A 86 -15.562 3.475 -29.993 1.00 0.00 C ATOM 897 CG GLU A 86 -15.262 3.590 -28.493 1.00 0.00 C ATOM 898 CD GLU A 86 -16.382 2.928 -27.687 1.00 0.00 C ATOM 899 OE1 GLU A 86 -17.536 3.191 -27.987 1.00 0.00 O ATOM 900 OE2 GLU A 86 -16.068 2.170 -26.785 1.00 0.00 O ATOM 0 H GLU A 86 -15.298 1.187 -28.940 1.00 0.00 H new ATOM 0 HA GLU A 86 -14.966 2.251 -31.664 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -15.356 4.424 -30.488 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -16.619 3.259 -30.146 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -14.308 3.114 -28.266 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -15.170 4.639 -28.211 1.00 0.00 H new ATOM 907 N LEU A 87 -12.352 1.850 -30.943 1.00 0.00 N ATOM 908 CA LEU A 87 -10.889 2.132 -30.871 1.00 0.00 C ATOM 909 C LEU A 87 -10.335 2.303 -32.288 1.00 0.00 C ATOM 910 O LEU A 87 -10.797 1.675 -33.223 1.00 0.00 O ATOM 911 CB LEU A 87 -10.176 0.963 -30.174 1.00 0.00 C ATOM 912 CG LEU A 87 -9.887 1.310 -28.704 1.00 0.00 C ATOM 913 CD1 LEU A 87 -8.972 2.535 -28.626 1.00 0.00 C ATOM 914 CD2 LEU A 87 -11.200 1.604 -27.970 1.00 0.00 C ATOM 0 H LEU A 87 -12.598 0.948 -31.350 1.00 0.00 H new ATOM 0 HA LEU A 87 -10.720 3.047 -30.303 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -10.795 0.067 -30.228 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -9.243 0.737 -30.691 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.392 0.461 -28.232 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -8.772 2.774 -27.581 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -8.032 2.320 -29.135 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -9.459 3.384 -29.106 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.988 1.849 -26.929 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -11.702 2.446 -28.446 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -11.845 0.726 -28.012 1.00 0.00 H new ATOM 926 N LYS A 88 -9.351 3.149 -32.451 1.00 0.00 N ATOM 927 CA LYS A 88 -8.759 3.369 -33.803 1.00 0.00 C ATOM 928 C LYS A 88 -7.301 2.906 -33.804 1.00 0.00 C ATOM 929 O LYS A 88 -6.903 2.268 -34.765 1.00 0.00 O ATOM 930 CB LYS A 88 -8.823 4.858 -34.151 1.00 0.00 C ATOM 931 CG LYS A 88 -10.203 5.192 -34.719 1.00 0.00 C ATOM 932 CD LYS A 88 -10.578 6.626 -34.342 1.00 0.00 C ATOM 933 CE LYS A 88 -9.961 7.597 -35.350 1.00 0.00 C ATOM 934 NZ LYS A 88 -10.854 7.714 -36.538 1.00 0.00 N ATOM 935 OXT LYS A 88 -6.607 3.197 -32.844 1.00 0.00 O ATOM 0 H LYS A 88 -8.931 3.699 -31.702 1.00 0.00 H new ATOM 0 HA LYS A 88 -9.320 2.798 -34.543 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -8.629 5.458 -33.262 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -8.049 5.106 -34.878 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -10.198 5.079 -35.803 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -10.946 4.496 -34.329 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -11.662 6.738 -34.330 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -10.222 6.854 -33.337 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -9.820 8.575 -34.890 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -8.976 7.244 -35.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -10.435 8.374 -37.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -10.967 6.780 -36.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -11.784 8.070 -36.239 1.00 0.00 H new TER 949 LYS A 88 ATOM 950 N ARG B 31 4.327 -10.615 -34.083 1.00 0.00 N ATOM 951 CA ARG B 31 4.085 -10.192 -32.672 1.00 0.00 C ATOM 952 C ARG B 31 2.586 -9.980 -32.448 1.00 0.00 C ATOM 953 O ARG B 31 1.972 -9.129 -33.061 1.00 0.00 O ATOM 954 CB ARG B 31 4.838 -8.889 -32.387 1.00 0.00 C ATOM 955 CG ARG B 31 4.418 -7.807 -33.393 1.00 0.00 C ATOM 956 CD ARG B 31 5.658 -7.086 -33.929 1.00 0.00 C ATOM 957 NE ARG B 31 5.305 -5.671 -34.263 1.00 0.00 N ATOM 958 CZ ARG B 31 6.237 -4.773 -34.517 1.00 0.00 C ATOM 959 NH1 ARG B 31 7.514 -5.079 -34.491 1.00 0.00 N ATOM 960 NH2 ARG B 31 5.880 -3.550 -34.804 1.00 0.00 N ATOM 0 HA ARG B 31 4.444 -10.969 -31.997 1.00 0.00 H new ATOM 0 HB2 ARG B 31 4.629 -8.553 -31.371 1.00 0.00 H new ATOM 0 HB3 ARG B 31 5.913 -9.059 -32.451 1.00 0.00 H new ATOM 0 HG2 ARG B 31 3.865 -8.259 -34.216 1.00 0.00 H new ATOM 0 HG3 ARG B 31 3.749 -7.092 -32.914 1.00 0.00 H new ATOM 0 HD2 ARG B 31 6.455 -7.108 -33.185 1.00 0.00 H new ATOM 0 HD3 ARG B 31 6.035 -7.597 -34.815 1.00 0.00 H new ATOM 0 HE ARG B 31 4.324 -5.395 -34.295 1.00 0.00 H new ATOM 0 HH11 ARG B 31 7.806 -6.031 -34.270 1.00 0.00 H new ATOM 0 HH12 ARG B 31 8.214 -4.365 -34.692 1.00 0.00 H new ATOM 0 HH21 ARG B 31 4.891 -3.300 -34.829 1.00 0.00 H new ATOM 0 HH22 ARG B 31 6.590 -2.845 -35.003 1.00 0.00 H new ATOM 976 N SER B 32 1.999 -10.753 -31.568 1.00 0.00 N ATOM 977 CA SER B 32 0.542 -10.610 -31.289 1.00 0.00 C ATOM 978 C SER B 32 0.245 -9.219 -30.716 1.00 0.00 C ATOM 979 O SER B 32 -0.893 -8.791 -30.686 1.00 0.00 O ATOM 980 CB SER B 32 0.113 -11.674 -30.280 1.00 0.00 C ATOM 981 OG SER B 32 0.651 -12.932 -30.666 1.00 0.00 O ATOM 0 H SER B 32 2.471 -11.480 -31.030 1.00 0.00 H new ATOM 0 HA SER B 32 -0.011 -10.736 -32.220 1.00 0.00 H new ATOM 0 HB2 SER B 32 0.462 -11.407 -29.282 1.00 0.00 H new ATOM 0 HB3 SER B 32 -0.975 -11.730 -30.233 1.00 0.00 H new ATOM 0 HG SER B 32 0.379 -13.616 -30.020 1.00 0.00 H new ATOM 987 N ASP B 33 1.252 -8.507 -30.257 1.00 0.00 N ATOM 988 CA ASP B 33 1.013 -7.152 -29.688 1.00 0.00 C ATOM 989 C ASP B 33 1.021 -6.088 -30.796 1.00 0.00 C ATOM 990 O ASP B 33 1.089 -4.908 -30.516 1.00 0.00 O ATOM 991 CB ASP B 33 2.099 -6.820 -28.663 1.00 0.00 C ATOM 992 CG ASP B 33 2.210 -7.955 -27.643 1.00 0.00 C ATOM 993 OD1 ASP B 33 2.896 -8.921 -27.932 1.00 0.00 O ATOM 994 OD2 ASP B 33 1.606 -7.838 -26.589 1.00 0.00 O ATOM 0 H ASP B 33 2.225 -8.812 -30.255 1.00 0.00 H new ATOM 0 HA ASP B 33 0.036 -7.152 -29.204 1.00 0.00 H new ATOM 0 HB2 ASP B 33 3.055 -6.675 -29.166 1.00 0.00 H new ATOM 0 HB3 ASP B 33 1.861 -5.885 -28.156 1.00 0.00 H new ATOM 999 N ALA B 34 0.946 -6.485 -32.045 1.00 0.00 N ATOM 1000 CA ALA B 34 0.934 -5.491 -33.153 1.00 0.00 C ATOM 1001 C ALA B 34 -0.517 -5.109 -33.491 1.00 0.00 C ATOM 1002 O ALA B 34 -0.765 -4.122 -34.157 1.00 0.00 O ATOM 1003 CB ALA B 34 1.606 -6.100 -34.387 1.00 0.00 C ATOM 0 H ALA B 34 0.893 -7.460 -32.340 1.00 0.00 H new ATOM 0 HA ALA B 34 1.477 -4.597 -32.845 1.00 0.00 H new ATOM 0 HB1 ALA B 34 1.599 -5.375 -35.200 1.00 0.00 H new ATOM 0 HB2 ALA B 34 2.635 -6.366 -34.147 1.00 0.00 H new ATOM 0 HB3 ALA B 34 1.063 -6.994 -34.693 1.00 0.00 H new ATOM 1009 N GLU B 35 -1.474 -5.890 -33.044 1.00 0.00 N ATOM 1010 CA GLU B 35 -2.905 -5.587 -33.341 1.00 0.00 C ATOM 1011 C GLU B 35 -3.307 -4.193 -32.812 1.00 0.00 C ATOM 1012 O GLU B 35 -3.981 -3.466 -33.514 1.00 0.00 O ATOM 1013 CB GLU B 35 -3.808 -6.656 -32.706 1.00 0.00 C ATOM 1014 CG GLU B 35 -3.312 -8.061 -33.086 1.00 0.00 C ATOM 1015 CD GLU B 35 -4.280 -8.701 -34.084 1.00 0.00 C ATOM 1016 OE1 GLU B 35 -5.247 -9.300 -33.641 1.00 0.00 O ATOM 1017 OE2 GLU B 35 -4.038 -8.582 -35.274 1.00 0.00 O ATOM 0 H GLU B 35 -1.320 -6.728 -32.483 1.00 0.00 H new ATOM 0 HA GLU B 35 -3.031 -5.592 -34.424 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -3.810 -6.544 -31.622 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -4.836 -6.521 -33.043 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -2.315 -7.999 -33.522 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -3.232 -8.682 -32.194 1.00 0.00 H new ATOM 1024 N PRO B 36 -2.907 -3.839 -31.600 1.00 0.00 N ATOM 1025 CA PRO B 36 -3.251 -2.517 -30.989 1.00 0.00 C ATOM 1026 C PRO B 36 -2.251 -1.436 -31.417 1.00 0.00 C ATOM 1027 O PRO B 36 -2.631 -0.337 -31.748 1.00 0.00 O ATOM 1028 CB PRO B 36 -3.161 -2.785 -29.492 1.00 0.00 C ATOM 1029 CG PRO B 36 -2.232 -3.969 -29.299 1.00 0.00 C ATOM 1030 CD PRO B 36 -2.065 -4.660 -30.654 1.00 0.00 C ATOM 0 HA PRO B 36 -4.230 -2.148 -31.296 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -2.780 -1.909 -28.967 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -4.147 -3.000 -29.080 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -1.266 -3.638 -28.918 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -2.644 -4.662 -28.565 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -1.020 -4.678 -30.965 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -2.404 -5.695 -30.617 1.00 0.00 H new ATOM 1038 N HIS B 37 -0.975 -1.745 -31.395 1.00 0.00 N ATOM 1039 CA HIS B 37 0.086 -0.754 -31.785 1.00 0.00 C ATOM 1040 C HIS B 37 0.344 0.258 -30.640 1.00 0.00 C ATOM 1041 O HIS B 37 1.256 1.058 -30.719 1.00 0.00 O ATOM 1042 CB HIS B 37 -0.280 -0.061 -33.138 1.00 0.00 C ATOM 1043 CG HIS B 37 -0.868 1.330 -32.967 1.00 0.00 C ATOM 1044 ND1 HIS B 37 -2.176 1.627 -33.322 1.00 0.00 N ATOM 1045 CD2 HIS B 37 -0.332 2.507 -32.502 1.00 0.00 C ATOM 1046 CE1 HIS B 37 -2.381 2.931 -33.066 1.00 0.00 C ATOM 1047 NE2 HIS B 37 -1.290 3.515 -32.564 1.00 0.00 N ATOM 0 H HIS B 37 -0.616 -2.659 -31.118 1.00 0.00 H new ATOM 0 HA HIS B 37 1.025 -1.284 -31.946 1.00 0.00 H new ATOM 0 HB2 HIS B 37 0.615 0.005 -33.757 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -0.994 -0.685 -33.675 1.00 0.00 H new ATOM 0 HD2 HIS B 37 0.679 2.631 -32.143 1.00 0.00 H new ATOM 0 HE1 HIS B 37 -3.315 3.444 -33.245 1.00 0.00 H new ATOM 0 HE2 HIS B 37 -1.182 4.490 -32.286 1.00 0.00 H new ATOM 1055 N TYR B 38 -0.431 0.219 -29.579 1.00 0.00 N ATOM 1056 CA TYR B 38 -0.207 1.166 -28.446 1.00 0.00 C ATOM 1057 C TYR B 38 0.189 0.374 -27.197 1.00 0.00 C ATOM 1058 O TYR B 38 0.988 0.821 -26.398 1.00 0.00 O ATOM 1059 CB TYR B 38 -1.486 1.963 -28.167 1.00 0.00 C ATOM 1060 CG TYR B 38 -2.668 1.026 -28.062 1.00 0.00 C ATOM 1061 CD1 TYR B 38 -3.012 0.464 -26.827 1.00 0.00 C ATOM 1062 CD2 TYR B 38 -3.424 0.724 -29.201 1.00 0.00 C ATOM 1063 CE1 TYR B 38 -4.110 -0.399 -26.731 1.00 0.00 C ATOM 1064 CE2 TYR B 38 -4.521 -0.140 -29.106 1.00 0.00 C ATOM 1065 CZ TYR B 38 -4.864 -0.702 -27.871 1.00 0.00 C ATOM 1066 OH TYR B 38 -5.946 -1.553 -27.777 1.00 0.00 O ATOM 0 H TYR B 38 -1.208 -0.429 -29.452 1.00 0.00 H new ATOM 0 HA TYR B 38 0.591 1.860 -28.709 1.00 0.00 H new ATOM 0 HB2 TYR B 38 -1.377 2.529 -27.242 1.00 0.00 H new ATOM 0 HB3 TYR B 38 -1.655 2.686 -28.965 1.00 0.00 H new ATOM 0 HD1 TYR B 38 -2.430 0.696 -25.948 1.00 0.00 H new ATOM 0 HD2 TYR B 38 -3.160 1.158 -30.154 1.00 0.00 H new ATOM 0 HE1 TYR B 38 -4.375 -0.831 -25.777 1.00 0.00 H new ATOM 0 HE2 TYR B 38 -5.103 -0.373 -29.986 1.00 0.00 H new ATOM 0 HH TYR B 38 -6.359 -1.656 -28.660 1.00 0.00 H new ATOM 1076 N LEU B 39 -0.360 -0.805 -27.030 1.00 0.00 N ATOM 1077 CA LEU B 39 -0.023 -1.650 -25.840 1.00 0.00 C ATOM 1078 C LEU B 39 1.510 -1.773 -25.675 1.00 0.00 C ATOM 1079 O LEU B 39 2.028 -1.505 -24.605 1.00 0.00 O ATOM 1080 CB LEU B 39 -0.639 -3.048 -26.025 1.00 0.00 C ATOM 1081 CG LEU B 39 -1.547 -3.397 -24.832 1.00 0.00 C ATOM 1082 CD1 LEU B 39 -0.762 -3.302 -23.517 1.00 0.00 C ATOM 1083 CD2 LEU B 39 -2.726 -2.422 -24.787 1.00 0.00 C ATOM 0 H LEU B 39 -1.033 -1.222 -27.673 1.00 0.00 H new ATOM 0 HA LEU B 39 -0.429 -1.180 -24.944 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -1.215 -3.079 -26.950 1.00 0.00 H new ATOM 0 HB3 LEU B 39 0.152 -3.792 -26.117 1.00 0.00 H new ATOM 0 HG LEU B 39 -1.912 -4.417 -24.955 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -1.418 -3.552 -22.683 1.00 0.00 H new ATOM 0 HD12 LEU B 39 0.075 -4.000 -23.542 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -0.385 -2.287 -23.391 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -3.370 -2.668 -23.943 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -2.352 -1.404 -24.674 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -3.297 -2.498 -25.713 1.00 0.00 H new ATOM 1095 N PRO B 40 2.206 -2.162 -26.730 1.00 0.00 N ATOM 1096 CA PRO B 40 3.698 -2.309 -26.703 1.00 0.00 C ATOM 1097 C PRO B 40 4.373 -0.930 -26.702 1.00 0.00 C ATOM 1098 O PRO B 40 5.537 -0.799 -26.366 1.00 0.00 O ATOM 1099 CB PRO B 40 4.013 -3.096 -27.967 1.00 0.00 C ATOM 1100 CG PRO B 40 2.863 -2.877 -28.926 1.00 0.00 C ATOM 1101 CD PRO B 40 1.641 -2.498 -28.091 1.00 0.00 C ATOM 0 HA PRO B 40 4.065 -2.814 -25.809 1.00 0.00 H new ATOM 0 HB2 PRO B 40 4.951 -2.758 -28.407 1.00 0.00 H new ATOM 0 HB3 PRO B 40 4.130 -4.156 -27.742 1.00 0.00 H new ATOM 0 HG2 PRO B 40 3.102 -2.087 -29.638 1.00 0.00 H new ATOM 0 HG3 PRO B 40 2.668 -3.780 -29.505 1.00 0.00 H new ATOM 0 HD2 PRO B 40 1.113 -1.648 -28.523 1.00 0.00 H new ATOM 0 HD3 PRO B 40 0.928 -3.321 -28.033 1.00 0.00 H new ATOM 1109 N GLN B 41 3.643 0.102 -27.052 1.00 0.00 N ATOM 1110 CA GLN B 41 4.223 1.471 -27.048 1.00 0.00 C ATOM 1111 C GLN B 41 4.283 1.958 -25.596 1.00 0.00 C ATOM 1112 O GLN B 41 5.184 2.679 -25.204 1.00 0.00 O ATOM 1113 CB GLN B 41 3.318 2.396 -27.880 1.00 0.00 C ATOM 1114 CG GLN B 41 3.817 3.844 -27.809 1.00 0.00 C ATOM 1115 CD GLN B 41 5.200 3.943 -28.454 1.00 0.00 C ATOM 1116 OE1 GLN B 41 5.461 3.314 -29.460 1.00 0.00 O ATOM 1117 NE2 GLN B 41 6.105 4.713 -27.912 1.00 0.00 N ATOM 0 H GLN B 41 2.666 0.049 -27.341 1.00 0.00 H new ATOM 0 HA GLN B 41 5.224 1.473 -27.479 1.00 0.00 H new ATOM 0 HB2 GLN B 41 3.302 2.061 -28.917 1.00 0.00 H new ATOM 0 HB3 GLN B 41 2.294 2.340 -27.511 1.00 0.00 H new ATOM 0 HG2 GLN B 41 3.118 4.506 -28.321 1.00 0.00 H new ATOM 0 HG3 GLN B 41 3.865 4.172 -26.771 1.00 0.00 H new ATOM 0 HE21 GLN B 41 5.886 5.241 -27.067 1.00 0.00 H new ATOM 0 HE22 GLN B 41 7.031 4.786 -28.333 1.00 0.00 H new ATOM 1126 N LEU B 42 3.318 1.571 -24.803 1.00 0.00 N ATOM 1127 CA LEU B 42 3.289 2.006 -23.388 1.00 0.00 C ATOM 1128 C LEU B 42 4.327 1.222 -22.586 1.00 0.00 C ATOM 1129 O LEU B 42 5.036 1.779 -21.771 1.00 0.00 O ATOM 1130 CB LEU B 42 1.896 1.746 -22.791 1.00 0.00 C ATOM 1131 CG LEU B 42 0.757 2.580 -23.460 1.00 0.00 C ATOM 1132 CD1 LEU B 42 1.231 3.439 -24.648 1.00 0.00 C ATOM 1133 CD2 LEU B 42 -0.337 1.627 -23.954 1.00 0.00 C ATOM 0 H LEU B 42 2.545 0.967 -25.084 1.00 0.00 H new ATOM 0 HA LEU B 42 3.515 3.071 -23.341 1.00 0.00 H new ATOM 0 HB2 LEU B 42 1.662 0.686 -22.888 1.00 0.00 H new ATOM 0 HB3 LEU B 42 1.920 1.971 -21.725 1.00 0.00 H new ATOM 0 HG LEU B 42 0.387 3.266 -22.698 1.00 0.00 H new ATOM 0 HD11 LEU B 42 0.385 3.989 -25.060 1.00 0.00 H new ATOM 0 HD12 LEU B 42 1.990 4.143 -24.308 1.00 0.00 H new ATOM 0 HD13 LEU B 42 1.654 2.794 -25.418 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -1.136 2.202 -24.422 1.00 0.00 H new ATOM 0 HD22 LEU B 42 0.086 0.934 -24.681 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -0.740 1.067 -23.110 1.00 0.00 H new ATOM 1145 N ARG B 43 4.419 -0.070 -22.802 1.00 0.00 N ATOM 1146 CA ARG B 43 5.412 -0.882 -22.041 1.00 0.00 C ATOM 1147 C ARG B 43 6.817 -0.353 -22.327 1.00 0.00 C ATOM 1148 O ARG B 43 7.628 -0.199 -21.429 1.00 0.00 O ATOM 1149 CB ARG B 43 5.300 -2.361 -22.441 1.00 0.00 C ATOM 1150 CG ARG B 43 5.732 -2.573 -23.894 1.00 0.00 C ATOM 1151 CD ARG B 43 5.531 -4.041 -24.278 1.00 0.00 C ATOM 1152 NE ARG B 43 6.234 -4.318 -25.569 1.00 0.00 N ATOM 1153 CZ ARG B 43 5.937 -5.374 -26.301 1.00 0.00 C ATOM 1154 NH1 ARG B 43 5.014 -6.232 -25.932 1.00 0.00 N ATOM 1155 NH2 ARG B 43 6.577 -5.571 -27.422 1.00 0.00 N ATOM 0 H ARG B 43 3.851 -0.591 -23.470 1.00 0.00 H new ATOM 0 HA ARG B 43 5.211 -0.801 -20.973 1.00 0.00 H new ATOM 0 HB2 ARG B 43 5.921 -2.967 -21.782 1.00 0.00 H new ATOM 0 HB3 ARG B 43 4.272 -2.699 -22.311 1.00 0.00 H new ATOM 0 HG2 ARG B 43 5.150 -1.930 -24.555 1.00 0.00 H new ATOM 0 HG3 ARG B 43 6.778 -2.294 -24.018 1.00 0.00 H new ATOM 0 HD2 ARG B 43 5.920 -4.690 -23.493 1.00 0.00 H new ATOM 0 HD3 ARG B 43 4.468 -4.260 -24.376 1.00 0.00 H new ATOM 0 HE ARG B 43 6.959 -3.676 -25.890 1.00 0.00 H new ATOM 0 HH11 ARG B 43 4.506 -6.090 -25.059 1.00 0.00 H new ATOM 0 HH12 ARG B 43 4.805 -7.040 -26.518 1.00 0.00 H new ATOM 0 HH21 ARG B 43 7.296 -4.912 -27.721 1.00 0.00 H new ATOM 0 HH22 ARG B 43 6.358 -6.383 -27.998 1.00 0.00 H new ATOM 1169 N LYS B 44 7.110 -0.055 -23.570 1.00 0.00 N ATOM 1170 CA LYS B 44 8.448 0.480 -23.898 1.00 0.00 C ATOM 1171 C LYS B 44 8.596 1.853 -23.233 1.00 0.00 C ATOM 1172 O LYS B 44 9.681 2.258 -22.859 1.00 0.00 O ATOM 1173 CB LYS B 44 8.610 0.594 -25.418 1.00 0.00 C ATOM 1174 CG LYS B 44 7.584 1.574 -25.996 1.00 0.00 C ATOM 1175 CD LYS B 44 7.948 1.894 -27.446 1.00 0.00 C ATOM 1176 CE LYS B 44 7.674 0.673 -28.324 1.00 0.00 C ATOM 1177 NZ LYS B 44 7.710 1.075 -29.759 1.00 0.00 N ATOM 0 H LYS B 44 6.476 -0.162 -24.362 1.00 0.00 H new ATOM 0 HA LYS B 44 9.223 -0.191 -23.528 1.00 0.00 H new ATOM 0 HB2 LYS B 44 9.618 0.931 -25.658 1.00 0.00 H new ATOM 0 HB3 LYS B 44 8.484 -0.386 -25.877 1.00 0.00 H new ATOM 0 HG2 LYS B 44 6.584 1.142 -25.947 1.00 0.00 H new ATOM 0 HG3 LYS B 44 7.565 2.489 -25.404 1.00 0.00 H new ATOM 0 HD2 LYS B 44 7.366 2.746 -27.798 1.00 0.00 H new ATOM 0 HD3 LYS B 44 8.999 2.175 -27.514 1.00 0.00 H new ATOM 0 HE2 LYS B 44 8.418 -0.100 -28.133 1.00 0.00 H new ATOM 0 HE3 LYS B 44 6.701 0.246 -28.079 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 7.457 0.261 -30.354 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 7.031 1.846 -29.921 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 8.667 1.399 -30.005 1.00 0.00 H new ATOM 1191 N ASP B 45 7.501 2.563 -23.075 1.00 0.00 N ATOM 1192 CA ASP B 45 7.561 3.893 -22.427 1.00 0.00 C ATOM 1193 C ASP B 45 7.932 3.715 -20.954 1.00 0.00 C ATOM 1194 O ASP B 45 8.783 4.412 -20.445 1.00 0.00 O ATOM 1195 CB ASP B 45 6.202 4.586 -22.540 1.00 0.00 C ATOM 1196 CG ASP B 45 5.963 5.019 -23.989 1.00 0.00 C ATOM 1197 OD1 ASP B 45 6.929 5.356 -24.654 1.00 0.00 O ATOM 1198 OD2 ASP B 45 4.818 5.008 -24.408 1.00 0.00 O ATOM 0 H ASP B 45 6.571 2.268 -23.372 1.00 0.00 H new ATOM 0 HA ASP B 45 8.313 4.508 -22.922 1.00 0.00 H new ATOM 0 HB2 ASP B 45 5.410 3.910 -22.217 1.00 0.00 H new ATOM 0 HB3 ASP B 45 6.169 5.453 -21.881 1.00 0.00 H new ATOM 1203 N ILE B 46 7.314 2.775 -20.264 1.00 0.00 N ATOM 1204 CA ILE B 46 7.660 2.560 -18.823 1.00 0.00 C ATOM 1205 C ILE B 46 9.149 2.200 -18.718 1.00 0.00 C ATOM 1206 O ILE B 46 9.805 2.512 -17.742 1.00 0.00 O ATOM 1207 CB ILE B 46 6.764 1.460 -18.207 1.00 0.00 C ATOM 1208 CG1 ILE B 46 6.950 1.465 -16.685 1.00 0.00 C ATOM 1209 CG2 ILE B 46 7.095 0.065 -18.761 1.00 0.00 C ATOM 1210 CD1 ILE B 46 5.945 0.511 -16.034 1.00 0.00 C ATOM 0 H ILE B 46 6.593 2.156 -20.636 1.00 0.00 H new ATOM 0 HA ILE B 46 7.478 3.474 -18.258 1.00 0.00 H new ATOM 0 HB ILE B 46 5.729 1.678 -18.471 1.00 0.00 H new ATOM 0 HG12 ILE B 46 7.967 1.163 -16.433 1.00 0.00 H new ATOM 0 HG13 ILE B 46 6.811 2.474 -16.296 1.00 0.00 H new ATOM 0 HG21 ILE B 46 6.441 -0.674 -18.299 1.00 0.00 H new ATOM 0 HG22 ILE B 46 6.946 0.058 -19.841 1.00 0.00 H new ATOM 0 HG23 ILE B 46 8.133 -0.179 -18.536 1.00 0.00 H new ATOM 0 HD11 ILE B 46 6.083 0.520 -14.953 1.00 0.00 H new ATOM 0 HD12 ILE B 46 4.931 0.832 -16.273 1.00 0.00 H new ATOM 0 HD13 ILE B 46 6.104 -0.499 -16.412 1.00 0.00 H new ATOM 1222 N LEU B 47 9.689 1.569 -19.737 1.00 0.00 N ATOM 1223 CA LEU B 47 11.131 1.218 -19.724 1.00 0.00 C ATOM 1224 C LEU B 47 11.933 2.515 -19.784 1.00 0.00 C ATOM 1225 O LEU B 47 12.893 2.702 -19.060 1.00 0.00 O ATOM 1226 CB LEU B 47 11.460 0.354 -20.944 1.00 0.00 C ATOM 1227 CG LEU B 47 11.051 -1.095 -20.677 1.00 0.00 C ATOM 1228 CD1 LEU B 47 11.044 -1.874 -21.994 1.00 0.00 C ATOM 1229 CD2 LEU B 47 12.050 -1.736 -19.713 1.00 0.00 C ATOM 0 H LEU B 47 9.184 1.285 -20.576 1.00 0.00 H new ATOM 0 HA LEU B 47 11.378 0.660 -18.821 1.00 0.00 H new ATOM 0 HB2 LEU B 47 10.937 0.733 -21.822 1.00 0.00 H new ATOM 0 HB3 LEU B 47 12.527 0.406 -21.161 1.00 0.00 H new ATOM 0 HG LEU B 47 10.054 -1.116 -20.237 1.00 0.00 H new ATOM 0 HD11 LEU B 47 10.753 -2.907 -21.804 1.00 0.00 H new ATOM 0 HD12 LEU B 47 10.334 -1.417 -22.683 1.00 0.00 H new ATOM 0 HD13 LEU B 47 12.041 -1.853 -22.434 1.00 0.00 H new ATOM 0 HD21 LEU B 47 11.760 -2.769 -19.522 1.00 0.00 H new ATOM 0 HD22 LEU B 47 13.046 -1.715 -20.154 1.00 0.00 H new ATOM 0 HD23 LEU B 47 12.057 -1.182 -18.775 1.00 0.00 H new ATOM 1241 N GLU B 48 11.523 3.421 -20.637 1.00 0.00 N ATOM 1242 CA GLU B 48 12.232 4.728 -20.746 1.00 0.00 C ATOM 1243 C GLU B 48 11.941 5.516 -19.476 1.00 0.00 C ATOM 1244 O GLU B 48 12.788 6.213 -18.953 1.00 0.00 O ATOM 1245 CB GLU B 48 11.742 5.545 -21.957 1.00 0.00 C ATOM 1246 CG GLU B 48 11.352 4.627 -23.122 1.00 0.00 C ATOM 1247 CD GLU B 48 11.876 5.202 -24.440 1.00 0.00 C ATOM 1248 OE1 GLU B 48 11.173 6.000 -25.036 1.00 0.00 O ATOM 1249 OE2 GLU B 48 12.972 4.834 -24.829 1.00 0.00 O ATOM 0 H GLU B 48 10.726 3.309 -21.263 1.00 0.00 H new ATOM 0 HA GLU B 48 13.298 4.543 -20.877 1.00 0.00 H new ATOM 0 HB2 GLU B 48 10.885 6.153 -21.667 1.00 0.00 H new ATOM 0 HB3 GLU B 48 12.526 6.231 -22.278 1.00 0.00 H new ATOM 0 HG2 GLU B 48 11.762 3.630 -22.963 1.00 0.00 H new ATOM 0 HG3 GLU B 48 10.268 4.523 -23.167 1.00 0.00 H new ATOM 1256 N VAL B 49 10.737 5.394 -18.971 1.00 0.00 N ATOM 1257 CA VAL B 49 10.366 6.114 -17.723 1.00 0.00 C ATOM 1258 C VAL B 49 11.272 5.617 -16.597 1.00 0.00 C ATOM 1259 O VAL B 49 11.981 6.384 -15.983 1.00 0.00 O ATOM 1260 CB VAL B 49 8.899 5.836 -17.382 1.00 0.00 C ATOM 1261 CG1 VAL B 49 8.503 6.639 -16.141 1.00 0.00 C ATOM 1262 CG2 VAL B 49 8.006 6.248 -18.563 1.00 0.00 C ATOM 0 H VAL B 49 9.995 4.823 -19.375 1.00 0.00 H new ATOM 0 HA VAL B 49 10.492 7.189 -17.854 1.00 0.00 H new ATOM 0 HB VAL B 49 8.770 4.772 -17.185 1.00 0.00 H new ATOM 0 HG11 VAL B 49 7.459 6.442 -15.898 1.00 0.00 H new ATOM 0 HG12 VAL B 49 9.133 6.345 -15.301 1.00 0.00 H new ATOM 0 HG13 VAL B 49 8.635 7.703 -16.339 1.00 0.00 H new ATOM 0 HG21 VAL B 49 6.963 6.049 -18.317 1.00 0.00 H new ATOM 0 HG22 VAL B 49 8.135 7.312 -18.763 1.00 0.00 H new ATOM 0 HG23 VAL B 49 8.286 5.676 -19.448 1.00 0.00 H new ATOM 1272 N ILE B 50 11.292 4.325 -16.353 1.00 0.00 N ATOM 1273 CA ILE B 50 12.198 3.778 -15.293 1.00 0.00 C ATOM 1274 C ILE B 50 13.645 4.183 -15.617 1.00 0.00 C ATOM 1275 O ILE B 50 14.490 4.242 -14.746 1.00 0.00 O ATOM 1276 CB ILE B 50 12.079 2.250 -15.241 1.00 0.00 C ATOM 1277 CG1 ILE B 50 10.620 1.860 -14.989 1.00 0.00 C ATOM 1278 CG2 ILE B 50 12.950 1.705 -14.107 1.00 0.00 C ATOM 1279 CD1 ILE B 50 10.350 0.478 -15.587 1.00 0.00 C ATOM 0 H ILE B 50 10.724 3.631 -16.839 1.00 0.00 H new ATOM 0 HA ILE B 50 11.914 4.182 -14.321 1.00 0.00 H new ATOM 0 HB ILE B 50 12.412 1.830 -16.190 1.00 0.00 H new ATOM 0 HG12 ILE B 50 10.415 1.851 -13.919 1.00 0.00 H new ATOM 0 HG13 ILE B 50 9.953 2.598 -15.435 1.00 0.00 H new ATOM 0 HG21 ILE B 50 12.864 0.619 -14.072 1.00 0.00 H new ATOM 0 HG22 ILE B 50 13.990 1.981 -14.282 1.00 0.00 H new ATOM 0 HG23 ILE B 50 12.618 2.126 -13.158 1.00 0.00 H new ATOM 0 HD11 ILE B 50 9.311 0.200 -15.407 1.00 0.00 H new ATOM 0 HD12 ILE B 50 10.539 0.503 -16.660 1.00 0.00 H new ATOM 0 HD13 ILE B 50 11.007 -0.255 -15.120 1.00 0.00 H new ATOM 1291 N CYS B 51 13.925 4.477 -16.867 1.00 0.00 N ATOM 1292 CA CYS B 51 15.291 4.897 -17.257 1.00 0.00 C ATOM 1293 C CYS B 51 15.524 6.343 -16.803 1.00 0.00 C ATOM 1294 O CYS B 51 16.546 6.667 -16.236 1.00 0.00 O ATOM 1295 CB CYS B 51 15.433 4.804 -18.781 1.00 0.00 C ATOM 1296 SG CYS B 51 17.187 4.826 -19.227 1.00 0.00 S ATOM 0 H CYS B 51 13.252 4.440 -17.633 1.00 0.00 H new ATOM 0 HA CYS B 51 16.027 4.246 -16.785 1.00 0.00 H new ATOM 0 HB2 CYS B 51 14.966 3.889 -19.145 1.00 0.00 H new ATOM 0 HB3 CYS B 51 14.916 5.637 -19.257 1.00 0.00 H new ATOM 0 HG CYS B 51 17.307 4.745 -20.519 1.00 0.00 H new ATOM 1302 N LYS B 52 14.576 7.214 -17.045 1.00 0.00 N ATOM 1303 CA LYS B 52 14.738 8.646 -16.630 1.00 0.00 C ATOM 1304 C LYS B 52 14.960 8.732 -15.118 1.00 0.00 C ATOM 1305 O LYS B 52 15.640 9.615 -14.630 1.00 0.00 O ATOM 1306 CB LYS B 52 13.476 9.446 -16.975 1.00 0.00 C ATOM 1307 CG LYS B 52 13.126 9.290 -18.455 1.00 0.00 C ATOM 1308 CD LYS B 52 11.603 9.360 -18.621 1.00 0.00 C ATOM 1309 CE LYS B 52 11.196 10.774 -19.041 1.00 0.00 C ATOM 1310 NZ LYS B 52 11.458 10.955 -20.497 1.00 0.00 N ATOM 0 H LYS B 52 13.696 6.997 -17.512 1.00 0.00 H new ATOM 0 HA LYS B 52 15.596 9.058 -17.161 1.00 0.00 H new ATOM 0 HB2 LYS B 52 12.643 9.104 -16.361 1.00 0.00 H new ATOM 0 HB3 LYS B 52 13.632 10.499 -16.742 1.00 0.00 H new ATOM 0 HG2 LYS B 52 13.604 10.076 -19.039 1.00 0.00 H new ATOM 0 HG3 LYS B 52 13.502 8.339 -18.832 1.00 0.00 H new ATOM 0 HD2 LYS B 52 11.275 8.639 -19.370 1.00 0.00 H new ATOM 0 HD3 LYS B 52 11.113 9.093 -17.685 1.00 0.00 H new ATOM 0 HE2 LYS B 52 10.140 10.938 -18.828 1.00 0.00 H new ATOM 0 HE3 LYS B 52 11.756 11.511 -18.466 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 11.494 11.970 -20.720 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 12.367 10.514 -20.744 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 10.696 10.507 -21.045 1.00 0.00 H new ATOM 1324 N TYR B 53 14.373 7.830 -14.377 1.00 0.00 N ATOM 1325 CA TYR B 53 14.515 7.851 -12.901 1.00 0.00 C ATOM 1326 C TYR B 53 15.539 6.793 -12.453 1.00 0.00 C ATOM 1327 O TYR B 53 15.992 6.807 -11.324 1.00 0.00 O ATOM 1328 CB TYR B 53 13.160 7.520 -12.265 1.00 0.00 C ATOM 1329 CG TYR B 53 12.104 8.550 -12.627 1.00 0.00 C ATOM 1330 CD1 TYR B 53 11.692 8.710 -13.958 1.00 0.00 C ATOM 1331 CD2 TYR B 53 11.510 9.323 -11.622 1.00 0.00 C ATOM 1332 CE1 TYR B 53 10.698 9.635 -14.283 1.00 0.00 C ATOM 1333 CE2 TYR B 53 10.510 10.249 -11.950 1.00 0.00 C ATOM 1334 CZ TYR B 53 10.105 10.404 -13.282 1.00 0.00 C ATOM 1335 OH TYR B 53 9.120 11.315 -13.602 1.00 0.00 O ATOM 0 H TYR B 53 13.795 7.072 -14.741 1.00 0.00 H new ATOM 0 HA TYR B 53 14.853 8.839 -12.589 1.00 0.00 H new ATOM 0 HB2 TYR B 53 12.834 6.533 -12.595 1.00 0.00 H new ATOM 0 HB3 TYR B 53 13.268 7.474 -11.181 1.00 0.00 H new ATOM 0 HD1 TYR B 53 12.146 8.114 -14.736 1.00 0.00 H new ATOM 0 HD2 TYR B 53 11.822 9.206 -10.595 1.00 0.00 H new ATOM 0 HE1 TYR B 53 10.388 9.755 -15.311 1.00 0.00 H new ATOM 0 HE2 TYR B 53 10.051 10.844 -11.174 1.00 0.00 H new ATOM 0 HH TYR B 53 8.814 11.765 -12.787 1.00 0.00 H new ATOM 1345 N VAL B 54 15.894 5.865 -13.316 1.00 0.00 N ATOM 1346 CA VAL B 54 16.871 4.795 -12.926 1.00 0.00 C ATOM 1347 C VAL B 54 17.643 4.359 -14.194 1.00 0.00 C ATOM 1348 O VAL B 54 18.024 5.195 -14.988 1.00 0.00 O ATOM 1349 CB VAL B 54 16.125 3.595 -12.289 1.00 0.00 C ATOM 1350 CG1 VAL B 54 17.092 2.819 -11.391 1.00 0.00 C ATOM 1351 CG2 VAL B 54 14.942 4.070 -11.434 1.00 0.00 C ATOM 0 H VAL B 54 15.548 5.804 -14.274 1.00 0.00 H new ATOM 0 HA VAL B 54 17.574 5.175 -12.185 1.00 0.00 H new ATOM 0 HB VAL B 54 15.749 2.962 -13.093 1.00 0.00 H new ATOM 0 HG11 VAL B 54 16.572 1.974 -10.941 1.00 0.00 H new ATOM 0 HG12 VAL B 54 17.929 2.454 -11.987 1.00 0.00 H new ATOM 0 HG13 VAL B 54 17.465 3.476 -10.605 1.00 0.00 H new ATOM 0 HG21 VAL B 54 14.437 3.207 -11.000 1.00 0.00 H new ATOM 0 HG22 VAL B 54 15.306 4.717 -10.636 1.00 0.00 H new ATOM 0 HG23 VAL B 54 14.241 4.624 -12.058 1.00 0.00 H new ATOM 1361 N GLN B 55 17.889 3.078 -14.403 1.00 0.00 N ATOM 1362 CA GLN B 55 18.629 2.652 -15.628 1.00 0.00 C ATOM 1363 C GLN B 55 18.655 1.125 -15.709 1.00 0.00 C ATOM 1364 O GLN B 55 19.362 0.462 -14.974 1.00 0.00 O ATOM 1365 CB GLN B 55 20.060 3.197 -15.577 1.00 0.00 C ATOM 1366 CG GLN B 55 20.267 4.219 -16.698 1.00 0.00 C ATOM 1367 CD GLN B 55 21.525 5.041 -16.414 1.00 0.00 C ATOM 1368 OE1 GLN B 55 22.444 4.564 -15.776 1.00 0.00 O ATOM 1369 NE2 GLN B 55 21.607 6.263 -16.862 1.00 0.00 N ATOM 0 H GLN B 55 17.609 2.321 -13.779 1.00 0.00 H new ATOM 0 HA GLN B 55 18.127 3.046 -16.511 1.00 0.00 H new ATOM 0 HB2 GLN B 55 20.247 3.662 -14.609 1.00 0.00 H new ATOM 0 HB3 GLN B 55 20.774 2.380 -15.681 1.00 0.00 H new ATOM 0 HG2 GLN B 55 20.362 3.709 -17.657 1.00 0.00 H new ATOM 0 HG3 GLN B 55 19.400 4.875 -16.771 1.00 0.00 H new ATOM 0 HE21 GLN B 55 20.836 6.663 -17.397 1.00 0.00 H new ATOM 0 HE22 GLN B 55 22.442 6.819 -16.677 1.00 0.00 H new ATOM 1378 N ILE B 56 17.884 0.572 -16.603 1.00 0.00 N ATOM 1379 CA ILE B 56 17.838 -0.912 -16.764 1.00 0.00 C ATOM 1380 C ILE B 56 17.755 -1.249 -18.250 1.00 0.00 C ATOM 1381 O ILE B 56 17.520 -0.387 -19.077 1.00 0.00 O ATOM 1382 CB ILE B 56 16.613 -1.490 -16.043 1.00 0.00 C ATOM 1383 CG1 ILE B 56 15.399 -0.567 -16.233 1.00 0.00 C ATOM 1384 CG2 ILE B 56 16.923 -1.630 -14.553 1.00 0.00 C ATOM 1385 CD1 ILE B 56 14.147 -1.410 -16.488 1.00 0.00 C ATOM 0 H ILE B 56 17.276 1.090 -17.237 1.00 0.00 H new ATOM 0 HA ILE B 56 18.739 -1.346 -16.330 1.00 0.00 H new ATOM 0 HB ILE B 56 16.380 -2.468 -16.464 1.00 0.00 H new ATOM 0 HG12 ILE B 56 15.258 0.052 -15.347 1.00 0.00 H new ATOM 0 HG13 ILE B 56 15.571 0.109 -17.071 1.00 0.00 H new ATOM 0 HG21 ILE B 56 16.055 -2.040 -14.038 1.00 0.00 H new ATOM 0 HG22 ILE B 56 17.774 -2.298 -14.420 1.00 0.00 H new ATOM 0 HG23 ILE B 56 17.162 -0.651 -14.138 1.00 0.00 H new ATOM 0 HD11 ILE B 56 13.287 -0.753 -16.622 1.00 0.00 H new ATOM 0 HD12 ILE B 56 14.289 -2.010 -17.387 1.00 0.00 H new ATOM 0 HD13 ILE B 56 13.972 -2.068 -15.637 1.00 0.00 H new ATOM 1397 N ASP B 57 17.939 -2.495 -18.595 1.00 0.00 N ATOM 1398 CA ASP B 57 17.866 -2.897 -20.028 1.00 0.00 C ATOM 1399 C ASP B 57 16.485 -3.506 -20.308 1.00 0.00 C ATOM 1400 O ASP B 57 15.784 -3.867 -19.384 1.00 0.00 O ATOM 1401 CB ASP B 57 18.951 -3.934 -20.323 1.00 0.00 C ATOM 1402 CG ASP B 57 20.253 -3.223 -20.696 1.00 0.00 C ATOM 1403 OD1 ASP B 57 20.187 -2.271 -21.458 1.00 0.00 O ATOM 1404 OD2 ASP B 57 21.292 -3.640 -20.213 1.00 0.00 O ATOM 0 H ASP B 57 18.137 -3.254 -17.943 1.00 0.00 H new ATOM 0 HA ASP B 57 18.019 -2.025 -20.663 1.00 0.00 H new ATOM 0 HB2 ASP B 57 19.108 -4.569 -19.451 1.00 0.00 H new ATOM 0 HB3 ASP B 57 18.634 -4.585 -21.138 1.00 0.00 H new ATOM 1409 N PRO B 58 16.125 -3.619 -21.571 1.00 0.00 N ATOM 1410 CA PRO B 58 14.809 -4.201 -21.985 1.00 0.00 C ATOM 1411 C PRO B 58 14.839 -5.714 -21.794 1.00 0.00 C ATOM 1412 O PRO B 58 13.832 -6.331 -21.493 1.00 0.00 O ATOM 1413 CB PRO B 58 14.680 -3.816 -23.452 1.00 0.00 C ATOM 1414 CG PRO B 58 16.084 -3.578 -23.969 1.00 0.00 C ATOM 1415 CD PRO B 58 16.952 -3.205 -22.766 1.00 0.00 C ATOM 0 HA PRO B 58 13.964 -3.837 -21.401 1.00 0.00 H new ATOM 0 HB2 PRO B 58 14.189 -4.608 -24.018 1.00 0.00 H new ATOM 0 HB3 PRO B 58 14.070 -2.920 -23.564 1.00 0.00 H new ATOM 0 HG2 PRO B 58 16.470 -4.472 -24.460 1.00 0.00 H new ATOM 0 HG3 PRO B 58 16.091 -2.779 -24.711 1.00 0.00 H new ATOM 0 HD2 PRO B 58 17.909 -3.726 -22.788 1.00 0.00 H new ATOM 0 HD3 PRO B 58 17.171 -2.137 -22.748 1.00 0.00 H new ATOM 1423 N GLU B 59 15.995 -6.309 -21.925 1.00 0.00 N ATOM 1424 CA GLU B 59 16.112 -7.777 -21.709 1.00 0.00 C ATOM 1425 C GLU B 59 15.901 -8.087 -20.217 1.00 0.00 C ATOM 1426 O GLU B 59 15.726 -9.230 -19.838 1.00 0.00 O ATOM 1427 CB GLU B 59 17.503 -8.248 -22.139 1.00 0.00 C ATOM 1428 CG GLU B 59 17.735 -7.882 -23.606 1.00 0.00 C ATOM 1429 CD GLU B 59 17.154 -8.976 -24.503 1.00 0.00 C ATOM 1430 OE1 GLU B 59 17.720 -10.056 -24.527 1.00 0.00 O ATOM 1431 OE2 GLU B 59 16.154 -8.714 -25.150 1.00 0.00 O ATOM 0 H GLU B 59 16.865 -5.838 -22.173 1.00 0.00 H new ATOM 0 HA GLU B 59 15.358 -8.296 -22.301 1.00 0.00 H new ATOM 0 HB2 GLU B 59 18.265 -7.785 -21.513 1.00 0.00 H new ATOM 0 HB3 GLU B 59 17.591 -9.326 -22.004 1.00 0.00 H new ATOM 0 HG2 GLU B 59 17.265 -6.925 -23.832 1.00 0.00 H new ATOM 0 HG3 GLU B 59 18.802 -7.767 -23.799 1.00 0.00 H new ATOM 1438 N MET B 60 15.912 -7.079 -19.367 1.00 0.00 N ATOM 1439 CA MET B 60 15.707 -7.314 -17.913 1.00 0.00 C ATOM 1440 C MET B 60 14.210 -7.241 -17.592 1.00 0.00 C ATOM 1441 O MET B 60 13.751 -7.803 -16.615 1.00 0.00 O ATOM 1442 CB MET B 60 16.453 -6.231 -17.125 1.00 0.00 C ATOM 1443 CG MET B 60 17.944 -6.584 -17.042 1.00 0.00 C ATOM 1444 SD MET B 60 18.321 -7.304 -15.423 1.00 0.00 S ATOM 1445 CE MET B 60 18.608 -5.748 -14.546 1.00 0.00 C ATOM 0 H MET B 60 16.056 -6.104 -19.629 1.00 0.00 H new ATOM 0 HA MET B 60 16.087 -8.298 -17.639 1.00 0.00 H new ATOM 0 HB2 MET B 60 16.325 -5.263 -17.609 1.00 0.00 H new ATOM 0 HB3 MET B 60 16.034 -6.144 -16.123 1.00 0.00 H new ATOM 0 HG2 MET B 60 18.204 -7.289 -17.832 1.00 0.00 H new ATOM 0 HG3 MET B 60 18.547 -5.690 -17.201 1.00 0.00 H new ATOM 0 HE1 MET B 60 18.491 -5.908 -13.474 1.00 0.00 H new ATOM 0 HE2 MET B 60 19.618 -5.395 -14.752 1.00 0.00 H new ATOM 0 HE3 MET B 60 17.888 -5.002 -14.883 1.00 0.00 H new ATOM 1455 N VAL B 61 13.445 -6.551 -18.406 1.00 0.00 N ATOM 1456 CA VAL B 61 11.981 -6.438 -18.149 1.00 0.00 C ATOM 1457 C VAL B 61 11.230 -7.463 -19.004 1.00 0.00 C ATOM 1458 O VAL B 61 11.424 -7.542 -20.203 1.00 0.00 O ATOM 1459 CB VAL B 61 11.511 -5.027 -18.511 1.00 0.00 C ATOM 1460 CG1 VAL B 61 10.044 -4.855 -18.110 1.00 0.00 C ATOM 1461 CG2 VAL B 61 12.370 -3.997 -17.767 1.00 0.00 C ATOM 0 H VAL B 61 13.776 -6.062 -19.238 1.00 0.00 H new ATOM 0 HA VAL B 61 11.780 -6.631 -17.095 1.00 0.00 H new ATOM 0 HB VAL B 61 11.611 -4.876 -19.586 1.00 0.00 H new ATOM 0 HG11 VAL B 61 9.712 -3.850 -18.369 1.00 0.00 H new ATOM 0 HG12 VAL B 61 9.434 -5.587 -18.640 1.00 0.00 H new ATOM 0 HG13 VAL B 61 9.940 -5.006 -17.036 1.00 0.00 H new ATOM 0 HG21 VAL B 61 12.036 -2.992 -18.024 1.00 0.00 H new ATOM 0 HG22 VAL B 61 12.271 -4.149 -16.692 1.00 0.00 H new ATOM 0 HG23 VAL B 61 13.414 -4.118 -18.056 1.00 0.00 H new ATOM 1471 N THR B 62 10.376 -8.249 -18.394 1.00 0.00 N ATOM 1472 CA THR B 62 9.611 -9.270 -19.159 1.00 0.00 C ATOM 1473 C THR B 62 8.231 -8.718 -19.518 1.00 0.00 C ATOM 1474 O THR B 62 7.730 -7.810 -18.881 1.00 0.00 O ATOM 1475 CB THR B 62 9.445 -10.533 -18.310 1.00 0.00 C ATOM 1476 OG1 THR B 62 10.647 -10.783 -17.594 1.00 0.00 O ATOM 1477 CG2 THR B 62 9.137 -11.722 -19.221 1.00 0.00 C ATOM 0 H THR B 62 10.178 -8.223 -17.394 1.00 0.00 H new ATOM 0 HA THR B 62 10.155 -9.513 -20.072 1.00 0.00 H new ATOM 0 HB THR B 62 8.625 -10.393 -17.606 1.00 0.00 H new ATOM 0 HG1 THR B 62 10.541 -11.590 -17.049 1.00 0.00 H new ATOM 0 HG21 THR B 62 9.019 -12.622 -18.617 1.00 0.00 H new ATOM 0 HG22 THR B 62 8.216 -11.530 -19.771 1.00 0.00 H new ATOM 0 HG23 THR B 62 9.957 -11.863 -19.925 1.00 0.00 H new ATOM 1485 N VAL B 63 7.612 -9.268 -20.532 1.00 0.00 N ATOM 1486 CA VAL B 63 6.261 -8.792 -20.941 1.00 0.00 C ATOM 1487 C VAL B 63 5.416 -9.993 -21.357 1.00 0.00 C ATOM 1488 O VAL B 63 5.738 -10.689 -22.302 1.00 0.00 O ATOM 1489 CB VAL B 63 6.394 -7.832 -22.120 1.00 0.00 C ATOM 1490 CG1 VAL B 63 5.027 -7.232 -22.453 1.00 0.00 C ATOM 1491 CG2 VAL B 63 7.364 -6.711 -21.753 1.00 0.00 C ATOM 0 H VAL B 63 7.989 -10.030 -21.095 1.00 0.00 H new ATOM 0 HA VAL B 63 5.785 -8.276 -20.108 1.00 0.00 H new ATOM 0 HB VAL B 63 6.771 -8.374 -22.987 1.00 0.00 H new ATOM 0 HG11 VAL B 63 5.126 -6.547 -23.295 1.00 0.00 H new ATOM 0 HG12 VAL B 63 4.333 -8.031 -22.714 1.00 0.00 H new ATOM 0 HG13 VAL B 63 4.647 -6.690 -21.587 1.00 0.00 H new ATOM 0 HG21 VAL B 63 7.461 -6.024 -22.594 1.00 0.00 H new ATOM 0 HG22 VAL B 63 6.985 -6.171 -20.885 1.00 0.00 H new ATOM 0 HG23 VAL B 63 8.340 -7.136 -21.518 1.00 0.00 H new ATOM 1501 N GLN B 64 4.341 -10.243 -20.657 1.00 0.00 N ATOM 1502 CA GLN B 64 3.474 -11.402 -21.004 1.00 0.00 C ATOM 1503 C GLN B 64 2.017 -10.945 -21.108 1.00 0.00 C ATOM 1504 O GLN B 64 1.521 -10.226 -20.262 1.00 0.00 O ATOM 1505 CB GLN B 64 3.613 -12.481 -19.923 1.00 0.00 C ATOM 1506 CG GLN B 64 3.373 -11.872 -18.535 1.00 0.00 C ATOM 1507 CD GLN B 64 4.716 -11.603 -17.850 1.00 0.00 C ATOM 1508 OE1 GLN B 64 5.293 -10.547 -18.011 1.00 0.00 O ATOM 1509 NE2 GLN B 64 5.240 -12.523 -17.087 1.00 0.00 N ATOM 0 H GLN B 64 4.027 -9.692 -19.858 1.00 0.00 H new ATOM 0 HA GLN B 64 3.782 -11.815 -21.965 1.00 0.00 H new ATOM 0 HB2 GLN B 64 2.898 -13.283 -20.105 1.00 0.00 H new ATOM 0 HB3 GLN B 64 4.608 -12.925 -19.967 1.00 0.00 H new ATOM 0 HG2 GLN B 64 2.809 -10.944 -18.627 1.00 0.00 H new ATOM 0 HG3 GLN B 64 2.774 -12.551 -17.928 1.00 0.00 H new ATOM 0 HE21 GLN B 64 4.755 -13.410 -16.952 1.00 0.00 H new ATOM 0 HE22 GLN B 64 6.134 -12.355 -16.626 1.00 0.00 H new ATOM 1518 N LEU B 65 1.330 -11.351 -22.148 1.00 0.00 N ATOM 1519 CA LEU B 65 -0.087 -10.938 -22.317 1.00 0.00 C ATOM 1520 C LEU B 65 -1.016 -12.091 -21.940 1.00 0.00 C ATOM 1521 O LEU B 65 -0.780 -13.233 -22.287 1.00 0.00 O ATOM 1522 CB LEU B 65 -0.330 -10.544 -23.771 1.00 0.00 C ATOM 1523 CG LEU B 65 0.133 -11.671 -24.706 1.00 0.00 C ATOM 1524 CD1 LEU B 65 -0.951 -11.948 -25.752 1.00 0.00 C ATOM 1525 CD2 LEU B 65 1.424 -11.251 -25.412 1.00 0.00 C ATOM 0 H LEU B 65 1.696 -11.952 -22.886 1.00 0.00 H new ATOM 0 HA LEU B 65 -0.292 -10.088 -21.667 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -1.389 -10.341 -23.929 1.00 0.00 H new ATOM 0 HB3 LEU B 65 0.208 -9.625 -24.002 1.00 0.00 H new ATOM 0 HG LEU B 65 0.314 -12.573 -24.122 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -0.621 -12.748 -26.415 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -1.872 -12.248 -25.251 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -1.133 -11.045 -26.335 1.00 0.00 H new ATOM 0 HD21 LEU B 65 1.753 -12.051 -26.076 1.00 0.00 H new ATOM 0 HD22 LEU B 65 1.243 -10.348 -25.995 1.00 0.00 H new ATOM 0 HD23 LEU B 65 2.197 -11.055 -24.669 1.00 0.00 H new ATOM 1537 N GLU B 66 -2.076 -11.793 -21.235 1.00 0.00 N ATOM 1538 CA GLU B 66 -3.039 -12.856 -20.830 1.00 0.00 C ATOM 1539 C GLU B 66 -4.458 -12.398 -21.167 1.00 0.00 C ATOM 1540 O GLU B 66 -4.671 -11.278 -21.586 1.00 0.00 O ATOM 1541 CB GLU B 66 -2.920 -13.112 -19.321 1.00 0.00 C ATOM 1542 CG GLU B 66 -1.628 -13.873 -19.008 1.00 0.00 C ATOM 1543 CD GLU B 66 -1.612 -15.217 -19.744 1.00 0.00 C ATOM 1544 OE1 GLU B 66 -2.160 -16.168 -19.210 1.00 0.00 O ATOM 1545 OE2 GLU B 66 -1.052 -15.271 -20.826 1.00 0.00 O ATOM 0 H GLU B 66 -2.316 -10.853 -20.921 1.00 0.00 H new ATOM 0 HA GLU B 66 -2.816 -13.779 -21.365 1.00 0.00 H new ATOM 0 HB2 GLU B 66 -2.930 -12.164 -18.783 1.00 0.00 H new ATOM 0 HB3 GLU B 66 -3.780 -13.685 -18.974 1.00 0.00 H new ATOM 0 HG2 GLU B 66 -0.765 -13.277 -19.306 1.00 0.00 H new ATOM 0 HG3 GLU B 66 -1.546 -14.038 -17.934 1.00 0.00 H new ATOM 1552 N GLN B 67 -5.427 -13.262 -20.998 1.00 0.00 N ATOM 1553 CA GLN B 67 -6.836 -12.881 -21.315 1.00 0.00 C ATOM 1554 C GLN B 67 -7.795 -13.662 -20.415 1.00 0.00 C ATOM 1555 O GLN B 67 -7.448 -14.692 -19.869 1.00 0.00 O ATOM 1556 CB GLN B 67 -7.135 -13.208 -22.781 1.00 0.00 C ATOM 1557 CG GLN B 67 -6.404 -12.217 -23.689 1.00 0.00 C ATOM 1558 CD GLN B 67 -6.657 -12.582 -25.153 1.00 0.00 C ATOM 1559 OE1 GLN B 67 -7.750 -12.409 -25.655 1.00 0.00 O ATOM 1560 NE2 GLN B 67 -5.685 -13.083 -25.864 1.00 0.00 N ATOM 0 H GLN B 67 -5.303 -14.214 -20.654 1.00 0.00 H new ATOM 0 HA GLN B 67 -6.968 -11.813 -21.144 1.00 0.00 H new ATOM 0 HB2 GLN B 67 -6.819 -14.226 -23.008 1.00 0.00 H new ATOM 0 HB3 GLN B 67 -8.209 -13.159 -22.963 1.00 0.00 H new ATOM 0 HG2 GLN B 67 -6.751 -11.203 -23.491 1.00 0.00 H new ATOM 0 HG3 GLN B 67 -5.335 -12.235 -23.478 1.00 0.00 H new ATOM 0 HE21 GLN B 67 -4.767 -13.228 -25.443 1.00 0.00 H new ATOM 0 HE22 GLN B 67 -5.842 -13.329 -26.841 1.00 0.00 H new ATOM 1569 N LYS B 68 -9.003 -13.178 -20.263 1.00 0.00 N ATOM 1570 CA LYS B 68 -9.997 -13.887 -19.405 1.00 0.00 C ATOM 1571 C LYS B 68 -11.141 -14.408 -20.277 1.00 0.00 C ATOM 1572 O LYS B 68 -11.209 -14.127 -21.459 1.00 0.00 O ATOM 1573 CB LYS B 68 -10.566 -12.922 -18.365 1.00 0.00 C ATOM 1574 CG LYS B 68 -9.652 -12.878 -17.135 1.00 0.00 C ATOM 1575 CD LYS B 68 -9.508 -11.432 -16.647 1.00 0.00 C ATOM 1576 CE LYS B 68 -10.871 -10.896 -16.199 1.00 0.00 C ATOM 1577 NZ LYS B 68 -11.189 -11.418 -14.839 1.00 0.00 N ATOM 0 H LYS B 68 -9.343 -12.320 -20.698 1.00 0.00 H new ATOM 0 HA LYS B 68 -9.504 -14.718 -18.901 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -10.659 -11.925 -18.795 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -11.567 -13.238 -18.073 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -10.065 -13.500 -16.341 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -8.673 -13.287 -17.383 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -8.800 -11.387 -15.820 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -9.106 -10.808 -17.445 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -10.859 -9.806 -16.188 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -11.643 -11.199 -16.906 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -12.082 -11.001 -14.507 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -11.284 -12.453 -14.878 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -10.423 -11.165 -14.182 1.00 0.00 H new ATOM 1591 N ASP B 69 -12.043 -15.159 -19.697 1.00 0.00 N ATOM 1592 CA ASP B 69 -13.190 -15.698 -20.476 1.00 0.00 C ATOM 1593 C ASP B 69 -14.279 -14.625 -20.643 1.00 0.00 C ATOM 1594 O ASP B 69 -15.243 -14.828 -21.358 1.00 0.00 O ATOM 1595 CB ASP B 69 -13.776 -16.907 -19.744 1.00 0.00 C ATOM 1596 CG ASP B 69 -14.147 -16.509 -18.315 1.00 0.00 C ATOM 1597 OD1 ASP B 69 -14.982 -15.632 -18.163 1.00 0.00 O ATOM 1598 OD2 ASP B 69 -13.592 -17.088 -17.396 1.00 0.00 O ATOM 0 H ASP B 69 -12.031 -15.421 -18.711 1.00 0.00 H new ATOM 0 HA ASP B 69 -12.836 -15.996 -21.463 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -14.657 -17.272 -20.271 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -13.053 -17.722 -19.729 1.00 0.00 H new ATOM 1603 N GLY B 70 -14.143 -13.491 -19.989 1.00 0.00 N ATOM 1604 CA GLY B 70 -15.180 -12.422 -20.113 1.00 0.00 C ATOM 1605 C GLY B 70 -14.736 -11.383 -21.147 1.00 0.00 C ATOM 1606 O GLY B 70 -15.056 -10.215 -21.037 1.00 0.00 O ATOM 0 H GLY B 70 -13.359 -13.264 -19.377 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -16.133 -12.860 -20.411 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -15.338 -11.942 -19.147 1.00 0.00 H new ATOM 1610 N ASP B 71 -13.998 -11.803 -22.145 1.00 0.00 N ATOM 1611 CA ASP B 71 -13.521 -10.853 -23.197 1.00 0.00 C ATOM 1612 C ASP B 71 -12.664 -9.762 -22.553 1.00 0.00 C ATOM 1613 O ASP B 71 -12.842 -8.584 -22.801 1.00 0.00 O ATOM 1614 CB ASP B 71 -14.723 -10.220 -23.912 1.00 0.00 C ATOM 1615 CG ASP B 71 -15.266 -11.196 -24.957 1.00 0.00 C ATOM 1616 OD1 ASP B 71 -14.616 -11.363 -25.976 1.00 0.00 O ATOM 1617 OD2 ASP B 71 -16.321 -11.760 -24.720 1.00 0.00 O ATOM 0 H ASP B 71 -13.704 -12.771 -22.277 1.00 0.00 H new ATOM 0 HA ASP B 71 -12.921 -11.396 -23.927 1.00 0.00 H new ATOM 0 HB2 ASP B 71 -15.501 -9.974 -23.190 1.00 0.00 H new ATOM 0 HB3 ASP B 71 -14.425 -9.287 -24.390 1.00 0.00 H new ATOM 1622 N ILE B 72 -11.739 -10.157 -21.721 1.00 0.00 N ATOM 1623 CA ILE B 72 -10.863 -9.163 -21.039 1.00 0.00 C ATOM 1624 C ILE B 72 -9.397 -9.543 -21.270 1.00 0.00 C ATOM 1625 O ILE B 72 -9.081 -10.687 -21.533 1.00 0.00 O ATOM 1626 CB ILE B 72 -11.173 -9.157 -19.539 1.00 0.00 C ATOM 1627 CG1 ILE B 72 -12.704 -9.078 -19.341 1.00 0.00 C ATOM 1628 CG2 ILE B 72 -10.475 -7.957 -18.890 1.00 0.00 C ATOM 1629 CD1 ILE B 72 -13.063 -8.812 -17.871 1.00 0.00 C ATOM 0 H ILE B 72 -11.552 -11.131 -21.483 1.00 0.00 H new ATOM 0 HA ILE B 72 -11.045 -8.168 -21.444 1.00 0.00 H new ATOM 0 HB ILE B 72 -10.807 -10.070 -19.069 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -13.113 -8.285 -19.967 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -13.164 -10.011 -19.667 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -10.690 -7.945 -17.822 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -9.399 -8.036 -19.042 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -10.839 -7.035 -19.344 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -14.147 -8.762 -17.764 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -12.674 -9.619 -17.250 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -12.623 -7.866 -17.554 1.00 0.00 H new ATOM 1641 N SER B 73 -8.505 -8.589 -21.179 1.00 0.00 N ATOM 1642 CA SER B 73 -7.057 -8.884 -21.398 1.00 0.00 C ATOM 1643 C SER B 73 -6.296 -8.667 -20.094 1.00 0.00 C ATOM 1644 O SER B 73 -6.773 -8.015 -19.187 1.00 0.00 O ATOM 1645 CB SER B 73 -6.504 -7.948 -22.473 1.00 0.00 C ATOM 1646 OG SER B 73 -6.866 -8.442 -23.756 1.00 0.00 O ATOM 0 H SER B 73 -8.719 -7.616 -20.962 1.00 0.00 H new ATOM 0 HA SER B 73 -6.939 -9.918 -21.722 1.00 0.00 H new ATOM 0 HB2 SER B 73 -6.898 -6.942 -22.333 1.00 0.00 H new ATOM 0 HB3 SER B 73 -5.419 -7.880 -22.389 1.00 0.00 H new ATOM 0 HG SER B 73 -6.515 -7.844 -24.448 1.00 0.00 H new ATOM 1652 N ILE B 74 -5.118 -9.221 -19.997 1.00 0.00 N ATOM 1653 CA ILE B 74 -4.305 -9.072 -18.759 1.00 0.00 C ATOM 1654 C ILE B 74 -2.818 -9.061 -19.145 1.00 0.00 C ATOM 1655 O ILE B 74 -2.155 -10.080 -19.116 1.00 0.00 O ATOM 1656 CB ILE B 74 -4.608 -10.254 -17.822 1.00 0.00 C ATOM 1657 CG1 ILE B 74 -6.080 -10.182 -17.381 1.00 0.00 C ATOM 1658 CG2 ILE B 74 -3.686 -10.207 -16.594 1.00 0.00 C ATOM 1659 CD1 ILE B 74 -6.406 -11.333 -16.418 1.00 0.00 C ATOM 0 H ILE B 74 -4.681 -9.777 -20.732 1.00 0.00 H new ATOM 0 HA ILE B 74 -4.548 -8.141 -18.247 1.00 0.00 H new ATOM 0 HB ILE B 74 -4.431 -11.191 -18.350 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -6.274 -9.226 -16.895 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -6.731 -10.234 -18.254 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -3.910 -11.048 -15.938 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -2.647 -10.265 -16.917 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -3.846 -9.274 -16.054 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -7.451 -11.269 -16.115 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -6.231 -12.286 -16.917 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -5.768 -11.262 -15.537 1.00 0.00 H new ATOM 1671 N LEU B 75 -2.300 -7.916 -19.517 1.00 0.00 N ATOM 1672 CA LEU B 75 -0.867 -7.834 -19.916 1.00 0.00 C ATOM 1673 C LEU B 75 0.008 -7.573 -18.693 1.00 0.00 C ATOM 1674 O LEU B 75 -0.015 -6.504 -18.114 1.00 0.00 O ATOM 1675 CB LEU B 75 -0.681 -6.708 -20.931 1.00 0.00 C ATOM 1676 CG LEU B 75 0.720 -6.797 -21.540 1.00 0.00 C ATOM 1677 CD1 LEU B 75 0.669 -6.382 -23.011 1.00 0.00 C ATOM 1678 CD2 LEU B 75 1.667 -5.863 -20.781 1.00 0.00 C ATOM 0 H LEU B 75 -2.812 -7.035 -19.560 1.00 0.00 H new ATOM 0 HA LEU B 75 -0.571 -8.782 -20.365 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -1.435 -6.782 -21.714 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -0.818 -5.741 -20.447 1.00 0.00 H new ATOM 0 HG LEU B 75 1.081 -7.823 -21.465 1.00 0.00 H new ATOM 0 HD11 LEU B 75 1.668 -6.446 -23.442 1.00 0.00 H new ATOM 0 HD12 LEU B 75 -0.004 -7.046 -23.553 1.00 0.00 H new ATOM 0 HD13 LEU B 75 0.306 -5.357 -23.088 1.00 0.00 H new ATOM 0 HD21 LEU B 75 2.665 -5.926 -21.215 1.00 0.00 H new ATOM 0 HD22 LEU B 75 1.304 -4.838 -20.855 1.00 0.00 H new ATOM 0 HD23 LEU B 75 1.707 -6.159 -19.733 1.00 0.00 H new ATOM 1690 N GLU B 76 0.788 -8.547 -18.306 1.00 0.00 N ATOM 1691 CA GLU B 76 1.682 -8.381 -17.127 1.00 0.00 C ATOM 1692 C GLU B 76 3.120 -8.198 -17.614 1.00 0.00 C ATOM 1693 O GLU B 76 3.548 -8.850 -18.543 1.00 0.00 O ATOM 1694 CB GLU B 76 1.611 -9.634 -16.244 1.00 0.00 C ATOM 1695 CG GLU B 76 0.150 -9.994 -15.946 1.00 0.00 C ATOM 1696 CD GLU B 76 0.063 -11.466 -15.538 1.00 0.00 C ATOM 1697 OE1 GLU B 76 0.663 -12.285 -16.215 1.00 0.00 O ATOM 1698 OE2 GLU B 76 -0.602 -11.749 -14.556 1.00 0.00 O ATOM 0 H GLU B 76 0.843 -9.458 -18.762 1.00 0.00 H new ATOM 0 HA GLU B 76 1.366 -7.511 -16.551 1.00 0.00 H new ATOM 0 HB2 GLU B 76 2.103 -10.468 -16.744 1.00 0.00 H new ATOM 0 HB3 GLU B 76 2.147 -9.460 -15.311 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -0.237 -9.360 -15.148 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -0.468 -9.812 -16.825 1.00 0.00 H new ATOM 1705 N LEU B 77 3.871 -7.327 -16.993 1.00 0.00 N ATOM 1706 CA LEU B 77 5.287 -7.124 -17.419 1.00 0.00 C ATOM 1707 C LEU B 77 6.193 -7.208 -16.191 1.00 0.00 C ATOM 1708 O LEU B 77 5.964 -6.553 -15.192 1.00 0.00 O ATOM 1709 CB LEU B 77 5.449 -5.759 -18.103 1.00 0.00 C ATOM 1710 CG LEU B 77 4.836 -4.657 -17.240 1.00 0.00 C ATOM 1711 CD1 LEU B 77 5.558 -3.336 -17.515 1.00 0.00 C ATOM 1712 CD2 LEU B 77 3.352 -4.505 -17.587 1.00 0.00 C ATOM 0 H LEU B 77 3.566 -6.748 -16.211 1.00 0.00 H new ATOM 0 HA LEU B 77 5.565 -7.899 -18.133 1.00 0.00 H new ATOM 0 HB2 LEU B 77 6.506 -5.552 -18.272 1.00 0.00 H new ATOM 0 HB3 LEU B 77 4.967 -5.775 -19.081 1.00 0.00 H new ATOM 0 HG LEU B 77 4.940 -4.919 -16.187 1.00 0.00 H new ATOM 0 HD11 LEU B 77 5.122 -2.548 -16.900 1.00 0.00 H new ATOM 0 HD12 LEU B 77 6.615 -3.442 -17.273 1.00 0.00 H new ATOM 0 HD13 LEU B 77 5.451 -3.075 -18.568 1.00 0.00 H new ATOM 0 HD21 LEU B 77 2.913 -3.719 -16.972 1.00 0.00 H new ATOM 0 HD22 LEU B 77 3.250 -4.242 -18.640 1.00 0.00 H new ATOM 0 HD23 LEU B 77 2.836 -5.446 -17.396 1.00 0.00 H new ATOM 1724 N ASN B 78 7.211 -8.022 -16.253 1.00 0.00 N ATOM 1725 CA ASN B 78 8.129 -8.166 -15.093 1.00 0.00 C ATOM 1726 C ASN B 78 9.250 -7.142 -15.213 1.00 0.00 C ATOM 1727 O ASN B 78 9.734 -6.874 -16.294 1.00 0.00 O ATOM 1728 CB ASN B 78 8.745 -9.562 -15.104 1.00 0.00 C ATOM 1729 CG ASN B 78 7.673 -10.640 -15.338 1.00 0.00 C ATOM 1730 OD1 ASN B 78 7.967 -11.690 -15.873 1.00 0.00 O ATOM 1731 ND2 ASN B 78 6.438 -10.430 -14.960 1.00 0.00 N ATOM 0 H ASN B 78 7.446 -8.596 -17.063 1.00 0.00 H new ATOM 0 HA ASN B 78 7.572 -8.011 -14.169 1.00 0.00 H new ATOM 0 HB2 ASN B 78 9.502 -9.622 -15.886 1.00 0.00 H new ATOM 0 HB3 ASN B 78 9.250 -9.747 -14.156 1.00 0.00 H new ATOM 0 HD21 ASN B 78 5.728 -11.146 -15.115 1.00 0.00 H new ATOM 0 HD22 ASN B 78 6.185 -9.550 -14.510 1.00 0.00 H new ATOM 1738 N VAL B 79 9.669 -6.572 -14.115 1.00 0.00 N ATOM 1739 CA VAL B 79 10.766 -5.566 -14.171 1.00 0.00 C ATOM 1740 C VAL B 79 11.940 -6.044 -13.316 1.00 0.00 C ATOM 1741 O VAL B 79 11.967 -5.843 -12.116 1.00 0.00 O ATOM 1742 CB VAL B 79 10.257 -4.226 -13.646 1.00 0.00 C ATOM 1743 CG1 VAL B 79 11.312 -3.156 -13.911 1.00 0.00 C ATOM 1744 CG2 VAL B 79 8.958 -3.857 -14.370 1.00 0.00 C ATOM 0 H VAL B 79 9.299 -6.760 -13.183 1.00 0.00 H new ATOM 0 HA VAL B 79 11.097 -5.445 -15.202 1.00 0.00 H new ATOM 0 HB VAL B 79 10.065 -4.296 -12.575 1.00 0.00 H new ATOM 0 HG11 VAL B 79 10.957 -2.195 -13.539 1.00 0.00 H new ATOM 0 HG12 VAL B 79 12.237 -3.423 -13.401 1.00 0.00 H new ATOM 0 HG13 VAL B 79 11.497 -3.085 -14.983 1.00 0.00 H new ATOM 0 HG21 VAL B 79 8.593 -2.900 -13.997 1.00 0.00 H new ATOM 0 HG22 VAL B 79 9.147 -3.780 -15.441 1.00 0.00 H new ATOM 0 HG23 VAL B 79 8.209 -4.627 -14.188 1.00 0.00 H new ATOM 1754 N THR B 80 12.905 -6.681 -13.928 1.00 0.00 N ATOM 1755 CA THR B 80 14.082 -7.185 -13.161 1.00 0.00 C ATOM 1756 C THR B 80 15.126 -6.075 -13.020 1.00 0.00 C ATOM 1757 O THR B 80 15.950 -5.874 -13.892 1.00 0.00 O ATOM 1758 CB THR B 80 14.701 -8.375 -13.904 1.00 0.00 C ATOM 1759 OG1 THR B 80 13.701 -9.356 -14.136 1.00 0.00 O ATOM 1760 CG2 THR B 80 15.826 -8.980 -13.060 1.00 0.00 C ATOM 0 H THR B 80 12.928 -6.874 -14.929 1.00 0.00 H new ATOM 0 HA THR B 80 13.757 -7.499 -12.169 1.00 0.00 H new ATOM 0 HB THR B 80 15.108 -8.037 -14.857 1.00 0.00 H new ATOM 0 HG1 THR B 80 13.313 -9.224 -15.026 1.00 0.00 H new ATOM 0 HG21 THR B 80 16.264 -9.826 -13.590 1.00 0.00 H new ATOM 0 HG22 THR B 80 16.593 -8.226 -12.882 1.00 0.00 H new ATOM 0 HG23 THR B 80 15.423 -9.320 -12.106 1.00 0.00 H new ATOM 1768 N LEU B 81 15.104 -5.362 -11.922 1.00 0.00 N ATOM 1769 CA LEU B 81 16.095 -4.275 -11.708 1.00 0.00 C ATOM 1770 C LEU B 81 17.378 -4.886 -11.117 1.00 0.00 C ATOM 1771 O LEU B 81 17.294 -5.763 -10.281 1.00 0.00 O ATOM 1772 CB LEU B 81 15.513 -3.263 -10.722 1.00 0.00 C ATOM 1773 CG LEU B 81 14.178 -2.733 -11.250 1.00 0.00 C ATOM 1774 CD1 LEU B 81 13.245 -2.439 -10.074 1.00 0.00 C ATOM 1775 CD2 LEU B 81 14.417 -1.446 -12.042 1.00 0.00 C ATOM 0 H LEU B 81 14.436 -5.491 -11.162 1.00 0.00 H new ATOM 0 HA LEU B 81 16.323 -3.778 -12.651 1.00 0.00 H new ATOM 0 HB2 LEU B 81 15.369 -3.732 -9.748 1.00 0.00 H new ATOM 0 HB3 LEU B 81 16.211 -2.438 -10.579 1.00 0.00 H new ATOM 0 HG LEU B 81 13.722 -3.481 -11.899 1.00 0.00 H new ATOM 0 HD11 LEU B 81 12.294 -2.061 -10.450 1.00 0.00 H new ATOM 0 HD12 LEU B 81 13.074 -3.354 -9.508 1.00 0.00 H new ATOM 0 HD13 LEU B 81 13.702 -1.691 -9.425 1.00 0.00 H new ATOM 0 HD21 LEU B 81 13.466 -1.068 -12.418 1.00 0.00 H new ATOM 0 HD22 LEU B 81 14.873 -0.699 -11.393 1.00 0.00 H new ATOM 0 HD23 LEU B 81 15.082 -1.653 -12.880 1.00 0.00 H new ATOM 1787 N PRO B 82 18.535 -4.423 -11.556 1.00 0.00 N ATOM 1788 CA PRO B 82 19.857 -4.933 -11.069 1.00 0.00 C ATOM 1789 C PRO B 82 20.272 -4.225 -9.776 1.00 0.00 C ATOM 1790 O PRO B 82 19.552 -3.395 -9.252 1.00 0.00 O ATOM 1791 CB PRO B 82 20.808 -4.590 -12.206 1.00 0.00 C ATOM 1792 CG PRO B 82 20.198 -3.425 -12.968 1.00 0.00 C ATOM 1793 CD PRO B 82 18.719 -3.337 -12.586 1.00 0.00 C ATOM 0 HA PRO B 82 19.843 -5.997 -10.833 1.00 0.00 H new ATOM 0 HB2 PRO B 82 21.791 -4.323 -11.818 1.00 0.00 H new ATOM 0 HB3 PRO B 82 20.947 -5.448 -12.863 1.00 0.00 H new ATOM 0 HG2 PRO B 82 20.712 -2.496 -12.721 1.00 0.00 H new ATOM 0 HG3 PRO B 82 20.307 -3.573 -14.042 1.00 0.00 H new ATOM 0 HD2 PRO B 82 18.471 -2.357 -12.179 1.00 0.00 H new ATOM 0 HD3 PRO B 82 18.075 -3.496 -13.451 1.00 0.00 H new ATOM 1801 N GLU B 83 21.428 -4.554 -9.260 1.00 0.00 N ATOM 1802 CA GLU B 83 21.908 -3.917 -7.999 1.00 0.00 C ATOM 1803 C GLU B 83 22.056 -2.408 -8.207 1.00 0.00 C ATOM 1804 O GLU B 83 21.632 -1.864 -9.208 1.00 0.00 O ATOM 1805 CB GLU B 83 23.268 -4.516 -7.613 1.00 0.00 C ATOM 1806 CG GLU B 83 23.096 -5.473 -6.431 1.00 0.00 C ATOM 1807 CD GLU B 83 24.468 -5.978 -5.980 1.00 0.00 C ATOM 1808 OE1 GLU B 83 25.020 -6.824 -6.664 1.00 0.00 O ATOM 1809 OE2 GLU B 83 24.942 -5.511 -4.957 1.00 0.00 O ATOM 0 H GLU B 83 22.064 -5.242 -9.662 1.00 0.00 H new ATOM 0 HA GLU B 83 21.187 -4.101 -7.203 1.00 0.00 H new ATOM 0 HB2 GLU B 83 23.696 -5.047 -8.463 1.00 0.00 H new ATOM 0 HB3 GLU B 83 23.965 -3.720 -7.350 1.00 0.00 H new ATOM 0 HG2 GLU B 83 22.595 -4.964 -5.607 1.00 0.00 H new ATOM 0 HG3 GLU B 83 22.464 -6.313 -6.718 1.00 0.00 H new ATOM 1816 N ALA B 84 22.661 -1.735 -7.261 1.00 0.00 N ATOM 1817 CA ALA B 84 22.852 -0.263 -7.385 1.00 0.00 C ATOM 1818 C ALA B 84 23.635 0.248 -6.173 1.00 0.00 C ATOM 1819 O ALA B 84 24.047 -0.519 -5.324 1.00 0.00 O ATOM 1820 CB ALA B 84 21.490 0.431 -7.445 1.00 0.00 C ATOM 0 H ALA B 84 23.032 -2.147 -6.405 1.00 0.00 H new ATOM 0 HA ALA B 84 23.406 -0.044 -8.298 1.00 0.00 H new ATOM 0 HB1 ALA B 84 21.634 1.508 -7.536 1.00 0.00 H new ATOM 0 HB2 ALA B 84 20.933 0.065 -8.308 1.00 0.00 H new ATOM 0 HB3 ALA B 84 20.931 0.215 -6.534 1.00 0.00 H new ATOM 1826 N GLU B 85 23.842 1.538 -6.088 1.00 0.00 N ATOM 1827 CA GLU B 85 24.596 2.107 -4.934 1.00 0.00 C ATOM 1828 C GLU B 85 24.640 3.631 -5.051 1.00 0.00 C ATOM 1829 O GLU B 85 24.311 4.343 -4.121 1.00 0.00 O ATOM 1830 CB GLU B 85 26.024 1.556 -4.933 1.00 0.00 C ATOM 1831 CG GLU B 85 26.514 1.408 -3.491 1.00 0.00 C ATOM 1832 CD GLU B 85 26.888 2.784 -2.936 1.00 0.00 C ATOM 1833 OE1 GLU B 85 27.406 3.586 -3.695 1.00 0.00 O ATOM 1834 OE2 GLU B 85 26.651 3.011 -1.761 1.00 0.00 O ATOM 0 H GLU B 85 23.519 2.223 -6.772 1.00 0.00 H new ATOM 0 HA GLU B 85 24.098 1.828 -4.006 1.00 0.00 H new ATOM 0 HB2 GLU B 85 26.053 0.591 -5.439 1.00 0.00 H new ATOM 0 HB3 GLU B 85 26.684 2.225 -5.485 1.00 0.00 H new ATOM 0 HG2 GLU B 85 25.736 0.955 -2.876 1.00 0.00 H new ATOM 0 HG3 GLU B 85 27.377 0.743 -3.455 1.00 0.00 H new ATOM 1841 N GLU B 86 25.047 4.135 -6.189 1.00 0.00 N ATOM 1842 CA GLU B 86 25.119 5.610 -6.380 1.00 0.00 C ATOM 1843 C GLU B 86 23.739 6.145 -6.784 1.00 0.00 C ATOM 1844 O GLU B 86 23.582 6.772 -7.816 1.00 0.00 O ATOM 1845 CB GLU B 86 26.146 5.934 -7.473 1.00 0.00 C ATOM 1846 CG GLU B 86 25.772 5.206 -8.772 1.00 0.00 C ATOM 1847 CD GLU B 86 26.668 3.978 -8.956 1.00 0.00 C ATOM 1848 OE1 GLU B 86 27.869 4.116 -8.788 1.00 0.00 O ATOM 1849 OE2 GLU B 86 26.137 2.923 -9.260 1.00 0.00 O ATOM 0 H GLU B 86 25.333 3.582 -6.997 1.00 0.00 H new ATOM 0 HA GLU B 86 25.425 6.084 -5.448 1.00 0.00 H new ATOM 0 HB2 GLU B 86 26.180 7.010 -7.645 1.00 0.00 H new ATOM 0 HB3 GLU B 86 27.142 5.631 -7.150 1.00 0.00 H new ATOM 0 HG2 GLU B 86 24.726 4.902 -8.741 1.00 0.00 H new ATOM 0 HG3 GLU B 86 25.884 5.879 -9.622 1.00 0.00 H new ATOM 1856 N LEU B 87 22.741 5.901 -5.975 1.00 0.00 N ATOM 1857 CA LEU B 87 21.369 6.391 -6.300 1.00 0.00 C ATOM 1858 C LEU B 87 20.966 7.472 -5.295 1.00 0.00 C ATOM 1859 O LEU B 87 21.348 7.433 -4.141 1.00 0.00 O ATOM 1860 CB LEU B 87 20.377 5.218 -6.225 1.00 0.00 C ATOM 1861 CG LEU B 87 20.065 4.687 -7.633 1.00 0.00 C ATOM 1862 CD1 LEU B 87 19.427 5.793 -8.480 1.00 0.00 C ATOM 1863 CD2 LEU B 87 21.356 4.209 -8.308 1.00 0.00 C ATOM 0 H LEU B 87 22.818 5.382 -5.100 1.00 0.00 H new ATOM 0 HA LEU B 87 21.357 6.810 -7.306 1.00 0.00 H new ATOM 0 HB2 LEU B 87 20.795 4.419 -5.613 1.00 0.00 H new ATOM 0 HB3 LEU B 87 19.456 5.543 -5.740 1.00 0.00 H new ATOM 0 HG LEU B 87 19.370 3.852 -7.548 1.00 0.00 H new ATOM 0 HD11 LEU B 87 19.209 5.408 -9.476 1.00 0.00 H new ATOM 0 HD12 LEU B 87 18.502 6.124 -8.009 1.00 0.00 H new ATOM 0 HD13 LEU B 87 20.116 6.634 -8.559 1.00 0.00 H new ATOM 0 HD21 LEU B 87 21.128 3.834 -9.306 1.00 0.00 H new ATOM 0 HD22 LEU B 87 22.056 5.041 -8.385 1.00 0.00 H new ATOM 0 HD23 LEU B 87 21.803 3.412 -7.714 1.00 0.00 H new ATOM 1875 N LYS B 88 20.195 8.438 -5.729 1.00 0.00 N ATOM 1876 CA LYS B 88 19.761 9.528 -4.808 1.00 0.00 C ATOM 1877 C LYS B 88 18.241 9.476 -4.637 1.00 0.00 C ATOM 1878 O LYS B 88 17.786 9.626 -3.514 1.00 0.00 O ATOM 1879 CB LYS B 88 20.162 10.882 -5.398 1.00 0.00 C ATOM 1880 CG LYS B 88 21.618 11.184 -5.038 1.00 0.00 C ATOM 1881 CD LYS B 88 22.261 12.004 -6.159 1.00 0.00 C ATOM 1882 CE LYS B 88 21.937 13.486 -5.959 1.00 0.00 C ATOM 1883 NZ LYS B 88 22.915 14.084 -5.007 1.00 0.00 N ATOM 1884 OXT LYS B 88 17.558 9.287 -5.630 1.00 0.00 O ATOM 0 H LYS B 88 19.848 8.517 -6.685 1.00 0.00 H new ATOM 0 HA LYS B 88 20.240 9.397 -3.838 1.00 0.00 H new ATOM 0 HB2 LYS B 88 20.039 10.870 -6.481 1.00 0.00 H new ATOM 0 HB3 LYS B 88 19.511 11.666 -5.012 1.00 0.00 H new ATOM 0 HG2 LYS B 88 21.665 11.734 -4.098 1.00 0.00 H new ATOM 0 HG3 LYS B 88 22.168 10.254 -4.891 1.00 0.00 H new ATOM 0 HD2 LYS B 88 23.341 11.854 -6.160 1.00 0.00 H new ATOM 0 HD3 LYS B 88 21.891 11.668 -7.128 1.00 0.00 H new ATOM 0 HE2 LYS B 88 21.976 14.010 -6.914 1.00 0.00 H new ATOM 0 HE3 LYS B 88 20.923 13.599 -5.575 1.00 0.00 H new ATOM 0 HZ1 LYS B 88 22.695 15.091 -4.871 1.00 0.00 H new ATOM 0 HZ2 LYS B 88 22.857 13.590 -4.094 1.00 0.00 H new ATOM 0 HZ3 LYS B 88 23.877 13.988 -5.391 1.00 0.00 H new TER 1898 LYS B 88