USER MOD reduce.3.24.130724 H: found=0, std=0, add=692, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 691 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 129 TYR OH : rot 165:sc= 0.612 USER MOD Set 1.2: A 133 LYS NZ :NH3+ 145:sc= 0.682 (180deg=0) USER MOD Set 2.1: A 61 MET CE :methyl 156:sc= -0.155 (180deg=-0.93) USER MOD Set 2.2: A 65 GLN : amide:sc= -0.0944 X(o=-0.25,f=-0.032) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 180:sc=-0.00309 USER MOD Single : A 66 MET CE :methyl 158:sc= -2.73 (180deg=-3.91) USER MOD Single : A 68 LYS NZ :NH3+ 149:sc= -0.164 (180deg=-0.937) USER MOD Single : A 70 MET CE :methyl 147:sc= -0.754 (180deg=-1.33) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 TYR OH : rot 28:sc= -2.1! USER MOD Single : A 95 SER OG : rot -7:sc= 0.727! USER MOD Single : A 96 LYS NZ :NH3+ -160:sc= -0.0214 (180deg=-0.494) USER MOD Single : A 98 LYS NZ :NH3+ 160:sc= -0.0176 (180deg=-0.251) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 THR OG1 : rot 88:sc= 0.688 USER MOD Single : A 107 ASN : amide:sc= -2.8! C(o=-2.8!,f=-4.1!) USER MOD Single : A 108 THR OG1 : rot -56:sc= 1.2 USER MOD Single : A 109 SER OG : rot 180:sc= -0.383 USER MOD Single : A 110 CYS SG : rot -52:sc= -0.227 USER MOD Single : A 118 CYS SG : rot 180:sc= -0.0681 USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 127 LYS NZ :NH3+ 164:sc=-0.00385 (180deg=-0.115) USER MOD Single : A 130 HIS : no HD1:sc= -0.019 X(o=-0.019,f=0.0011) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 135 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.167) USER MOD Single : A 136 ASN : amide:sc= -0.695 X(o=-0.7,f=-0.5) USER MOD Single : A 137 LYS NZ :NH3+ -162:sc= 0 (180deg=-0.392) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 58 -10.954 4.513 -14.046 1.00 0.00 N ATOM 2 CA ARG A 58 -10.872 3.121 -13.619 1.00 0.00 C ATOM 3 C ARG A 58 -12.181 2.687 -12.960 1.00 0.00 C ATOM 4 O ARG A 58 -12.898 3.508 -12.388 1.00 0.00 O ATOM 5 CB ARG A 58 -9.716 2.947 -12.630 1.00 0.00 C ATOM 6 CG ARG A 58 -8.386 2.983 -13.387 1.00 0.00 C ATOM 7 CD ARG A 58 -7.232 2.788 -12.401 1.00 0.00 C ATOM 8 NE ARG A 58 -5.968 3.169 -13.021 1.00 0.00 N ATOM 9 CZ ARG A 58 -5.418 2.424 -13.976 1.00 0.00 C ATOM 10 NH1 ARG A 58 -6.009 1.330 -14.372 1.00 0.00 N ATOM 11 NH2 ARG A 58 -4.287 2.787 -14.516 1.00 0.00 N ATOM 0 HA ARG A 58 -10.696 2.498 -14.496 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -9.742 3.739 -11.881 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -9.818 2.001 -12.098 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -8.366 2.201 -14.146 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -8.277 3.935 -13.907 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -7.402 3.389 -11.508 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -7.189 1.747 -12.082 1.00 0.00 H new ATOM 0 HE ARG A 58 -5.498 4.021 -12.717 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -6.893 1.046 -13.949 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -5.587 0.759 -15.104 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -3.825 3.642 -14.206 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -3.865 2.216 -15.248 1.00 0.00 H new ATOM 25 N PRO A 59 -12.500 1.421 -13.027 1.00 0.00 N ATOM 26 CA PRO A 59 -13.751 0.871 -12.422 1.00 0.00 C ATOM 27 C PRO A 59 -13.727 0.941 -10.896 1.00 0.00 C ATOM 28 O PRO A 59 -12.773 1.444 -10.304 1.00 0.00 O ATOM 29 CB PRO A 59 -13.785 -0.585 -12.907 1.00 0.00 C ATOM 30 CG PRO A 59 -12.367 -0.927 -13.225 1.00 0.00 C ATOM 31 CD PRO A 59 -11.707 0.371 -13.687 1.00 0.00 C ATOM 0 HA PRO A 59 -14.633 1.439 -12.717 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -14.186 -1.246 -12.139 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -14.422 -0.692 -13.785 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -11.859 -1.332 -12.350 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -12.316 -1.688 -14.004 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -10.659 0.415 -13.390 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -11.736 0.470 -14.772 1.00 0.00 H new ATOM 39 N LYS A 60 -14.783 0.433 -10.270 1.00 0.00 N ATOM 40 CA LYS A 60 -14.879 0.442 -8.821 1.00 0.00 C ATOM 41 C LYS A 60 -13.684 -0.275 -8.195 1.00 0.00 C ATOM 42 O LYS A 60 -13.264 -1.331 -8.669 1.00 0.00 O ATOM 43 CB LYS A 60 -16.182 -0.240 -8.400 1.00 0.00 C ATOM 44 CG LYS A 60 -16.022 -1.762 -8.465 1.00 0.00 C ATOM 45 CD LYS A 60 -17.401 -2.423 -8.437 1.00 0.00 C ATOM 46 CE LYS A 60 -17.246 -3.915 -8.137 1.00 0.00 C ATOM 47 NZ LYS A 60 -18.575 -4.584 -8.239 1.00 0.00 N ATOM 0 H LYS A 60 -15.581 0.011 -10.745 1.00 0.00 H new ATOM 0 HA LYS A 60 -14.875 1.474 -8.471 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -16.450 0.063 -7.388 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -16.995 0.077 -9.053 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -15.491 -2.044 -9.374 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -15.423 -2.111 -7.624 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -18.026 -1.952 -7.679 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -17.902 -2.284 -9.395 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -16.545 -4.367 -8.839 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -16.832 -4.055 -7.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -18.470 -5.598 -8.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -19.231 -4.159 -7.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -18.952 -4.462 -9.200 1.00 0.00 H new ATOM 61 N MET A 61 -13.144 0.306 -7.129 1.00 0.00 N ATOM 62 CA MET A 61 -11.999 -0.283 -6.441 1.00 0.00 C ATOM 63 C MET A 61 -12.455 -1.043 -5.199 1.00 0.00 C ATOM 64 O MET A 61 -13.171 -0.504 -4.355 1.00 0.00 O ATOM 65 CB MET A 61 -11.007 0.820 -6.050 1.00 0.00 C ATOM 66 CG MET A 61 -10.034 0.310 -4.979 1.00 0.00 C ATOM 67 SD MET A 61 -9.538 -1.395 -5.343 1.00 0.00 S ATOM 68 CE MET A 61 -8.349 -1.038 -6.659 1.00 0.00 C ATOM 0 H MET A 61 -13.478 1.180 -6.723 1.00 0.00 H new ATOM 0 HA MET A 61 -11.508 -0.986 -7.114 1.00 0.00 H new ATOM 0 HB2 MET A 61 -10.451 1.146 -6.929 1.00 0.00 H new ATOM 0 HB3 MET A 61 -11.548 1.688 -5.675 1.00 0.00 H new ATOM 0 HG2 MET A 61 -9.154 0.952 -4.942 1.00 0.00 H new ATOM 0 HG3 MET A 61 -10.505 0.357 -3.997 1.00 0.00 H new ATOM 0 HE1 MET A 61 -7.632 -1.856 -6.734 1.00 0.00 H new ATOM 0 HE2 MET A 61 -8.877 -0.930 -7.607 1.00 0.00 H new ATOM 0 HE3 MET A 61 -7.821 -0.112 -6.431 1.00 0.00 H new ATOM 78 N THR A 62 -12.028 -2.298 -5.098 1.00 0.00 N ATOM 79 CA THR A 62 -12.385 -3.140 -3.959 1.00 0.00 C ATOM 80 C THR A 62 -11.147 -3.414 -3.105 1.00 0.00 C ATOM 81 O THR A 62 -10.031 -3.456 -3.623 1.00 0.00 O ATOM 82 CB THR A 62 -12.965 -4.464 -4.466 1.00 0.00 C ATOM 83 OG1 THR A 62 -11.925 -5.248 -5.033 1.00 0.00 O ATOM 84 CG2 THR A 62 -14.028 -4.182 -5.530 1.00 0.00 C ATOM 0 H THR A 62 -11.435 -2.755 -5.790 1.00 0.00 H new ATOM 0 HA THR A 62 -13.129 -2.625 -3.351 1.00 0.00 H new ATOM 0 HB THR A 62 -13.418 -5.005 -3.635 1.00 0.00 H new ATOM 0 HG1 THR A 62 -12.294 -6.096 -5.356 1.00 0.00 H new ATOM 0 HG21 THR A 62 -14.441 -5.124 -5.891 1.00 0.00 H new ATOM 0 HG22 THR A 62 -14.826 -3.579 -5.096 1.00 0.00 H new ATOM 0 HG23 THR A 62 -13.576 -3.642 -6.362 1.00 0.00 H new ATOM 92 N PRO A 63 -11.309 -3.598 -1.815 1.00 0.00 N ATOM 93 CA PRO A 63 -10.164 -3.870 -0.897 1.00 0.00 C ATOM 94 C PRO A 63 -9.343 -5.075 -1.357 1.00 0.00 C ATOM 95 O PRO A 63 -8.115 -5.082 -1.250 1.00 0.00 O ATOM 96 CB PRO A 63 -10.820 -4.129 0.471 1.00 0.00 C ATOM 97 CG PRO A 63 -12.278 -4.327 0.198 1.00 0.00 C ATOM 98 CD PRO A 63 -12.589 -3.574 -1.092 1.00 0.00 C ATOM 0 HA PRO A 63 -9.459 -3.039 -0.868 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -10.390 -5.009 0.950 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -10.660 -3.288 1.146 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -12.512 -5.387 0.094 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -12.881 -3.947 1.023 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -13.381 -4.061 -1.661 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -12.919 -2.555 -0.893 1.00 0.00 H new ATOM 106 N GLU A 64 -10.028 -6.091 -1.870 1.00 0.00 N ATOM 107 CA GLU A 64 -9.352 -7.291 -2.347 1.00 0.00 C ATOM 108 C GLU A 64 -8.545 -6.983 -3.603 1.00 0.00 C ATOM 109 O GLU A 64 -7.425 -7.468 -3.769 1.00 0.00 O ATOM 110 CB GLU A 64 -10.379 -8.384 -2.652 1.00 0.00 C ATOM 111 CG GLU A 64 -9.663 -9.620 -3.196 1.00 0.00 C ATOM 112 CD GLU A 64 -10.625 -10.801 -3.246 1.00 0.00 C ATOM 113 OE1 GLU A 64 -11.521 -10.777 -4.074 1.00 0.00 O ATOM 114 OE2 GLU A 64 -10.453 -11.714 -2.455 1.00 0.00 O ATOM 0 H GLU A 64 -11.043 -6.108 -1.966 1.00 0.00 H new ATOM 0 HA GLU A 64 -8.674 -7.639 -1.568 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -10.933 -8.640 -1.749 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -11.106 -8.022 -3.379 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -9.274 -9.415 -4.193 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -8.809 -9.863 -2.564 1.00 0.00 H new ATOM 121 N GLN A 65 -9.120 -6.171 -4.484 1.00 0.00 N ATOM 122 CA GLN A 65 -8.445 -5.802 -5.722 1.00 0.00 C ATOM 123 C GLN A 65 -7.148 -5.060 -5.421 1.00 0.00 C ATOM 124 O GLN A 65 -6.072 -5.466 -5.863 1.00 0.00 O ATOM 125 CB GLN A 65 -9.358 -4.915 -6.572 1.00 0.00 C ATOM 126 CG GLN A 65 -8.659 -4.575 -7.889 1.00 0.00 C ATOM 127 CD GLN A 65 -9.654 -3.955 -8.863 1.00 0.00 C ATOM 128 OE1 GLN A 65 -9.762 -4.396 -10.007 1.00 0.00 O ATOM 129 NE2 GLN A 65 -10.393 -2.952 -8.474 1.00 0.00 N ATOM 0 H GLN A 65 -10.045 -5.759 -4.365 1.00 0.00 H new ATOM 0 HA GLN A 65 -8.211 -6.713 -6.273 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -10.299 -5.428 -6.770 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -9.601 -4.001 -6.031 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -7.837 -3.883 -7.706 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -8.226 -5.476 -8.323 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -10.301 -2.589 -7.525 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -11.062 -2.531 -9.119 1.00 0.00 H new ATOM 138 N MET A 66 -7.256 -3.972 -4.666 1.00 0.00 N ATOM 139 CA MET A 66 -6.082 -3.183 -4.311 1.00 0.00 C ATOM 140 C MET A 66 -5.060 -4.052 -3.585 1.00 0.00 C ATOM 141 O MET A 66 -3.853 -3.898 -3.775 1.00 0.00 O ATOM 142 CB MET A 66 -6.488 -2.007 -3.416 1.00 0.00 C ATOM 143 CG MET A 66 -7.173 -2.533 -2.155 1.00 0.00 C ATOM 144 SD MET A 66 -7.624 -1.142 -1.085 1.00 0.00 S ATOM 145 CE MET A 66 -8.921 -0.444 -2.137 1.00 0.00 C ATOM 0 H MET A 66 -8.136 -3.619 -4.291 1.00 0.00 H new ATOM 0 HA MET A 66 -5.633 -2.798 -5.227 1.00 0.00 H new ATOM 0 HB2 MET A 66 -5.609 -1.422 -3.147 1.00 0.00 H new ATOM 0 HB3 MET A 66 -7.161 -1.341 -3.956 1.00 0.00 H new ATOM 0 HG2 MET A 66 -8.063 -3.103 -2.423 1.00 0.00 H new ATOM 0 HG3 MET A 66 -6.507 -3.213 -1.624 1.00 0.00 H new ATOM 0 HE1 MET A 66 -9.592 0.165 -1.531 1.00 0.00 H new ATOM 0 HE2 MET A 66 -8.468 0.176 -2.911 1.00 0.00 H new ATOM 0 HE3 MET A 66 -9.485 -1.252 -2.603 1.00 0.00 H new ATOM 155 N ALA A 67 -5.551 -4.966 -2.756 1.00 0.00 N ATOM 156 CA ALA A 67 -4.670 -5.857 -2.006 1.00 0.00 C ATOM 157 C ALA A 67 -3.856 -6.723 -2.959 1.00 0.00 C ATOM 158 O ALA A 67 -2.675 -6.980 -2.725 1.00 0.00 O ATOM 159 CB ALA A 67 -5.495 -6.750 -1.080 1.00 0.00 C ATOM 0 H ALA A 67 -6.546 -5.110 -2.586 1.00 0.00 H new ATOM 0 HA ALA A 67 -3.989 -5.250 -1.409 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -4.830 -7.411 -0.525 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -6.056 -6.130 -0.381 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -6.188 -7.347 -1.673 1.00 0.00 H new ATOM 165 N LYS A 68 -4.496 -7.168 -4.033 1.00 0.00 N ATOM 166 CA LYS A 68 -3.825 -8.005 -5.020 1.00 0.00 C ATOM 167 C LYS A 68 -2.748 -7.210 -5.752 1.00 0.00 C ATOM 168 O LYS A 68 -1.613 -7.666 -5.891 1.00 0.00 O ATOM 169 CB LYS A 68 -4.847 -8.534 -6.029 1.00 0.00 C ATOM 170 CG LYS A 68 -5.646 -9.678 -5.397 1.00 0.00 C ATOM 171 CD LYS A 68 -6.797 -10.089 -6.325 1.00 0.00 C ATOM 172 CE LYS A 68 -6.287 -11.083 -7.373 1.00 0.00 C ATOM 173 NZ LYS A 68 -5.877 -12.346 -6.700 1.00 0.00 N ATOM 0 H LYS A 68 -5.473 -6.965 -4.242 1.00 0.00 H new ATOM 0 HA LYS A 68 -3.354 -8.842 -4.504 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -5.519 -7.733 -6.335 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -4.339 -8.884 -6.927 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -4.993 -10.531 -5.214 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -6.041 -9.366 -4.430 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -7.602 -10.539 -5.744 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -7.212 -9.209 -6.816 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -7.067 -11.286 -8.107 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -5.443 -10.656 -7.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -6.034 -13.149 -7.342 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -4.869 -12.295 -6.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -6.441 -12.478 -5.836 1.00 0.00 H new ATOM 187 N GLU A 69 -3.113 -6.018 -6.218 1.00 0.00 N ATOM 188 CA GLU A 69 -2.174 -5.165 -6.938 1.00 0.00 C ATOM 189 C GLU A 69 -1.027 -4.732 -6.030 1.00 0.00 C ATOM 190 O GLU A 69 0.123 -4.652 -6.461 1.00 0.00 O ATOM 191 CB GLU A 69 -2.897 -3.928 -7.472 1.00 0.00 C ATOM 192 CG GLU A 69 -4.014 -4.360 -8.424 1.00 0.00 C ATOM 193 CD GLU A 69 -3.416 -4.875 -9.730 1.00 0.00 C ATOM 194 OE1 GLU A 69 -2.237 -4.645 -9.949 1.00 0.00 O ATOM 195 OE2 GLU A 69 -4.144 -5.488 -10.492 1.00 0.00 O ATOM 0 H GLU A 69 -4.047 -5.623 -6.110 1.00 0.00 H new ATOM 0 HA GLU A 69 -1.763 -5.737 -7.770 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -3.312 -3.351 -6.645 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -2.193 -3.278 -7.992 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -4.618 -5.139 -7.959 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -4.678 -3.519 -8.625 1.00 0.00 H new ATOM 202 N MET A 70 -1.345 -4.452 -4.772 1.00 0.00 N ATOM 203 CA MET A 70 -0.326 -4.030 -3.819 1.00 0.00 C ATOM 204 C MET A 70 0.601 -5.195 -3.481 1.00 0.00 C ATOM 205 O MET A 70 1.812 -5.122 -3.690 1.00 0.00 O ATOM 206 CB MET A 70 -0.990 -3.519 -2.536 1.00 0.00 C ATOM 207 CG MET A 70 -1.520 -2.099 -2.753 1.00 0.00 C ATOM 208 SD MET A 70 -1.947 -1.366 -1.152 1.00 0.00 S ATOM 209 CE MET A 70 -3.584 -2.116 -0.964 1.00 0.00 C ATOM 0 H MET A 70 -2.289 -4.508 -4.391 1.00 0.00 H new ATOM 0 HA MET A 70 0.259 -3.229 -4.270 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.807 -4.182 -2.250 1.00 0.00 H new ATOM 0 HB3 MET A 70 -0.272 -3.527 -1.716 1.00 0.00 H new ATOM 0 HG2 MET A 70 -0.768 -1.491 -3.255 1.00 0.00 H new ATOM 0 HG3 MET A 70 -2.396 -2.121 -3.401 1.00 0.00 H new ATOM 0 HE1 MET A 70 -3.780 -2.303 0.092 1.00 0.00 H new ATOM 0 HE2 MET A 70 -4.342 -1.439 -1.359 1.00 0.00 H new ATOM 0 HE3 MET A 70 -3.618 -3.058 -1.511 1.00 0.00 H new ATOM 219 N SER A 71 0.020 -6.266 -2.954 1.00 0.00 N ATOM 220 CA SER A 71 0.798 -7.442 -2.580 1.00 0.00 C ATOM 221 C SER A 71 1.778 -7.829 -3.685 1.00 0.00 C ATOM 222 O SER A 71 2.973 -7.985 -3.434 1.00 0.00 O ATOM 223 CB SER A 71 -0.140 -8.613 -2.287 1.00 0.00 C ATOM 224 OG SER A 71 0.588 -9.833 -2.383 1.00 0.00 O ATOM 0 H SER A 71 -0.981 -6.345 -2.776 1.00 0.00 H new ATOM 0 HA SER A 71 1.371 -7.200 -1.685 1.00 0.00 H new ATOM 0 HB2 SER A 71 -0.569 -8.510 -1.291 1.00 0.00 H new ATOM 0 HB3 SER A 71 -0.970 -8.615 -2.993 1.00 0.00 H new ATOM 0 HG SER A 71 -0.010 -10.586 -2.194 1.00 0.00 H new ATOM 230 N GLU A 72 1.274 -7.988 -4.907 1.00 0.00 N ATOM 231 CA GLU A 72 2.137 -8.364 -6.022 1.00 0.00 C ATOM 232 C GLU A 72 3.186 -7.284 -6.276 1.00 0.00 C ATOM 233 O GLU A 72 4.358 -7.591 -6.495 1.00 0.00 O ATOM 234 CB GLU A 72 1.310 -8.605 -7.289 1.00 0.00 C ATOM 235 CG GLU A 72 0.722 -7.285 -7.784 1.00 0.00 C ATOM 236 CD GLU A 72 -0.287 -7.549 -8.897 1.00 0.00 C ATOM 237 OE1 GLU A 72 -0.934 -8.584 -8.850 1.00 0.00 O ATOM 238 OE2 GLU A 72 -0.400 -6.713 -9.778 1.00 0.00 O ATOM 0 H GLU A 72 0.290 -7.865 -5.147 1.00 0.00 H new ATOM 0 HA GLU A 72 2.647 -9.291 -5.759 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.936 -9.048 -8.064 1.00 0.00 H new ATOM 0 HB3 GLU A 72 0.509 -9.315 -7.082 1.00 0.00 H new ATOM 0 HG2 GLU A 72 0.238 -6.761 -6.960 1.00 0.00 H new ATOM 0 HG3 GLU A 72 1.518 -6.637 -8.150 1.00 0.00 H new ATOM 245 N PHE A 73 2.769 -6.019 -6.240 1.00 0.00 N ATOM 246 CA PHE A 73 3.704 -4.922 -6.464 1.00 0.00 C ATOM 247 C PHE A 73 4.970 -5.141 -5.640 1.00 0.00 C ATOM 248 O PHE A 73 6.084 -5.050 -6.159 1.00 0.00 O ATOM 249 CB PHE A 73 3.054 -3.581 -6.078 1.00 0.00 C ATOM 250 CG PHE A 73 2.777 -2.758 -7.318 1.00 0.00 C ATOM 251 CD1 PHE A 73 3.811 -2.470 -8.218 1.00 0.00 C ATOM 252 CD2 PHE A 73 1.481 -2.286 -7.570 1.00 0.00 C ATOM 253 CE1 PHE A 73 3.551 -1.713 -9.366 1.00 0.00 C ATOM 254 CE2 PHE A 73 1.222 -1.530 -8.717 1.00 0.00 C ATOM 255 CZ PHE A 73 2.256 -1.243 -9.616 1.00 0.00 C ATOM 0 H PHE A 73 1.806 -5.733 -6.061 1.00 0.00 H new ATOM 0 HA PHE A 73 3.966 -4.895 -7.522 1.00 0.00 H new ATOM 0 HB2 PHE A 73 2.125 -3.761 -5.537 1.00 0.00 H new ATOM 0 HB3 PHE A 73 3.712 -3.030 -5.406 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.810 -2.833 -8.026 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.682 -2.507 -6.877 1.00 0.00 H new ATOM 0 HE1 PHE A 73 4.349 -1.491 -10.059 1.00 0.00 H new ATOM 0 HE2 PHE A 73 0.223 -1.167 -8.910 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.055 -0.659 -10.502 1.00 0.00 H new ATOM 265 N LEU A 74 4.791 -5.432 -4.355 1.00 0.00 N ATOM 266 CA LEU A 74 5.928 -5.667 -3.471 1.00 0.00 C ATOM 267 C LEU A 74 6.697 -6.910 -3.910 1.00 0.00 C ATOM 268 O LEU A 74 7.921 -6.881 -4.038 1.00 0.00 O ATOM 269 CB LEU A 74 5.449 -5.849 -2.030 1.00 0.00 C ATOM 270 CG LEU A 74 4.469 -4.732 -1.664 1.00 0.00 C ATOM 271 CD1 LEU A 74 4.102 -4.841 -0.182 1.00 0.00 C ATOM 272 CD2 LEU A 74 5.120 -3.371 -1.930 1.00 0.00 C ATOM 0 H LEU A 74 3.879 -5.510 -3.906 1.00 0.00 H new ATOM 0 HA LEU A 74 6.588 -4.801 -3.526 1.00 0.00 H new ATOM 0 HB2 LEU A 74 4.966 -6.820 -1.917 1.00 0.00 H new ATOM 0 HB3 LEU A 74 6.301 -5.836 -1.350 1.00 0.00 H new ATOM 0 HG LEU A 74 3.568 -4.827 -2.270 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.404 -4.046 0.079 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.637 -5.809 0.008 1.00 0.00 H new ATOM 0 HD13 LEU A 74 5.003 -4.747 0.424 1.00 0.00 H new ATOM 0 HD21 LEU A 74 4.421 -2.576 -1.669 1.00 0.00 H new ATOM 0 HD22 LEU A 74 6.022 -3.275 -1.325 1.00 0.00 H new ATOM 0 HD23 LEU A 74 5.381 -3.293 -2.985 1.00 0.00 H new ATOM 284 N SER A 75 5.969 -7.998 -4.138 1.00 0.00 N ATOM 285 CA SER A 75 6.594 -9.247 -4.559 1.00 0.00 C ATOM 286 C SER A 75 7.423 -9.034 -5.823 1.00 0.00 C ATOM 287 O SER A 75 8.349 -9.796 -6.103 1.00 0.00 O ATOM 288 CB SER A 75 5.520 -10.303 -4.825 1.00 0.00 C ATOM 289 OG SER A 75 6.144 -11.553 -5.081 1.00 0.00 O ATOM 0 H SER A 75 4.955 -8.041 -4.040 1.00 0.00 H new ATOM 0 HA SER A 75 7.252 -9.589 -3.760 1.00 0.00 H new ATOM 0 HB2 SER A 75 4.854 -10.385 -3.966 1.00 0.00 H new ATOM 0 HB3 SER A 75 4.907 -10.008 -5.677 1.00 0.00 H new ATOM 0 HG SER A 75 5.458 -12.232 -5.250 1.00 0.00 H new ATOM 295 N ARG A 76 7.086 -7.994 -6.579 1.00 0.00 N ATOM 296 CA ARG A 76 7.807 -7.692 -7.811 1.00 0.00 C ATOM 297 C ARG A 76 9.055 -6.867 -7.515 1.00 0.00 C ATOM 298 O ARG A 76 10.116 -7.103 -8.093 1.00 0.00 O ATOM 299 CB ARG A 76 6.898 -6.917 -8.770 1.00 0.00 C ATOM 300 CG ARG A 76 5.812 -7.848 -9.320 1.00 0.00 C ATOM 301 CD ARG A 76 6.435 -8.889 -10.262 1.00 0.00 C ATOM 302 NE ARG A 76 6.742 -10.112 -9.530 1.00 0.00 N ATOM 303 CZ ARG A 76 7.232 -11.181 -10.151 1.00 0.00 C ATOM 304 NH1 ARG A 76 7.443 -11.146 -11.439 1.00 0.00 N ATOM 305 NH2 ARG A 76 7.500 -12.263 -9.474 1.00 0.00 N ATOM 0 H ARG A 76 6.325 -7.351 -6.363 1.00 0.00 H new ATOM 0 HA ARG A 76 8.108 -8.632 -8.273 1.00 0.00 H new ATOM 0 HB2 ARG A 76 6.440 -6.075 -8.251 1.00 0.00 H new ATOM 0 HB3 ARG A 76 7.486 -6.504 -9.590 1.00 0.00 H new ATOM 0 HG2 ARG A 76 5.302 -8.350 -8.498 1.00 0.00 H new ATOM 0 HG3 ARG A 76 5.060 -7.267 -9.854 1.00 0.00 H new ATOM 0 HD2 ARG A 76 5.747 -9.108 -11.079 1.00 0.00 H new ATOM 0 HD3 ARG A 76 7.344 -8.487 -10.710 1.00 0.00 H new ATOM 0 HE ARG A 76 6.578 -10.148 -8.524 1.00 0.00 H new ATOM 0 HH11 ARG A 76 7.232 -10.299 -11.968 1.00 0.00 H new ATOM 0 HH12 ARG A 76 7.819 -11.965 -11.917 1.00 0.00 H new ATOM 0 HH21 ARG A 76 7.334 -12.289 -8.468 1.00 0.00 H new ATOM 0 HH22 ARG A 76 7.876 -13.083 -9.951 1.00 0.00 H new ATOM 319 N GLY A 77 8.922 -5.899 -6.614 1.00 0.00 N ATOM 320 CA GLY A 77 10.049 -5.047 -6.254 1.00 0.00 C ATOM 321 C GLY A 77 11.117 -5.838 -5.504 1.00 0.00 C ATOM 322 O GLY A 77 10.911 -7.001 -5.158 1.00 0.00 O ATOM 0 H GLY A 77 8.053 -5.686 -6.124 1.00 0.00 H new ATOM 0 HA2 GLY A 77 10.481 -4.610 -7.154 1.00 0.00 H new ATOM 0 HA3 GLY A 77 9.701 -4.221 -5.634 1.00 0.00 H new ATOM 326 N PRO A 78 12.244 -5.229 -5.247 1.00 0.00 N ATOM 327 CA PRO A 78 13.370 -5.885 -4.520 1.00 0.00 C ATOM 328 C PRO A 78 12.893 -6.650 -3.287 1.00 0.00 C ATOM 329 O PRO A 78 11.706 -6.635 -2.956 1.00 0.00 O ATOM 330 CB PRO A 78 14.272 -4.713 -4.124 1.00 0.00 C ATOM 331 CG PRO A 78 14.015 -3.655 -5.148 1.00 0.00 C ATOM 332 CD PRO A 78 12.570 -3.842 -5.623 1.00 0.00 C ATOM 0 HA PRO A 78 13.876 -6.631 -5.133 1.00 0.00 H new ATOM 0 HB2 PRO A 78 14.036 -4.356 -3.122 1.00 0.00 H new ATOM 0 HB3 PRO A 78 15.321 -5.008 -4.118 1.00 0.00 H new ATOM 0 HG2 PRO A 78 14.157 -2.662 -4.722 1.00 0.00 H new ATOM 0 HG3 PRO A 78 14.711 -3.746 -5.982 1.00 0.00 H new ATOM 0 HD2 PRO A 78 11.898 -3.131 -5.143 1.00 0.00 H new ATOM 0 HD3 PRO A 78 12.481 -3.689 -6.699 1.00 0.00 H new ATOM 340 N ALA A 79 13.824 -7.316 -2.613 1.00 0.00 N ATOM 341 CA ALA A 79 13.492 -8.083 -1.417 1.00 0.00 C ATOM 342 C ALA A 79 13.579 -7.203 -0.176 1.00 0.00 C ATOM 343 O ALA A 79 13.900 -7.677 0.913 1.00 0.00 O ATOM 344 CB ALA A 79 14.449 -9.268 -1.273 1.00 0.00 C ATOM 0 H ALA A 79 14.810 -7.341 -2.872 1.00 0.00 H new ATOM 0 HA ALA A 79 12.471 -8.452 -1.517 1.00 0.00 H new ATOM 0 HB1 ALA A 79 14.194 -9.835 -0.378 1.00 0.00 H new ATOM 0 HB2 ALA A 79 14.364 -9.913 -2.148 1.00 0.00 H new ATOM 0 HB3 ALA A 79 15.472 -8.901 -1.191 1.00 0.00 H new ATOM 350 N VAL A 80 13.294 -5.916 -0.350 1.00 0.00 N ATOM 351 CA VAL A 80 13.342 -4.972 0.763 1.00 0.00 C ATOM 352 C VAL A 80 14.553 -5.244 1.649 1.00 0.00 C ATOM 353 O VAL A 80 14.497 -6.077 2.555 1.00 0.00 O ATOM 354 CB VAL A 80 12.066 -5.081 1.593 1.00 0.00 C ATOM 355 CG1 VAL A 80 12.130 -4.095 2.762 1.00 0.00 C ATOM 356 CG2 VAL A 80 10.857 -4.752 0.716 1.00 0.00 C ATOM 0 H VAL A 80 13.029 -5.504 -1.245 1.00 0.00 H new ATOM 0 HA VAL A 80 13.426 -3.965 0.355 1.00 0.00 H new ATOM 0 HB VAL A 80 11.971 -6.096 1.979 1.00 0.00 H new ATOM 0 HG11 VAL A 80 11.218 -4.173 3.354 1.00 0.00 H new ATOM 0 HG12 VAL A 80 12.991 -4.329 3.388 1.00 0.00 H new ATOM 0 HG13 VAL A 80 12.226 -3.080 2.377 1.00 0.00 H new ATOM 0 HG21 VAL A 80 9.946 -4.830 1.309 1.00 0.00 H new ATOM 0 HG22 VAL A 80 10.953 -3.737 0.330 1.00 0.00 H new ATOM 0 HG23 VAL A 80 10.809 -5.454 -0.116 1.00 0.00 H new ATOM 366 N LEU A 81 15.645 -4.535 1.384 1.00 0.00 N ATOM 367 CA LEU A 81 16.868 -4.703 2.164 1.00 0.00 C ATOM 368 C LEU A 81 16.938 -3.664 3.278 1.00 0.00 C ATOM 369 O LEU A 81 16.505 -2.524 3.104 1.00 0.00 O ATOM 370 CB LEU A 81 18.092 -4.561 1.254 1.00 0.00 C ATOM 371 CG LEU A 81 18.020 -5.591 0.120 1.00 0.00 C ATOM 372 CD1 LEU A 81 18.936 -5.153 -1.025 1.00 0.00 C ATOM 373 CD2 LEU A 81 18.474 -6.961 0.633 1.00 0.00 C ATOM 0 H LEU A 81 15.710 -3.841 0.639 1.00 0.00 H new ATOM 0 HA LEU A 81 16.860 -5.698 2.609 1.00 0.00 H new ATOM 0 HB2 LEU A 81 18.134 -3.553 0.840 1.00 0.00 H new ATOM 0 HB3 LEU A 81 19.005 -4.706 1.832 1.00 0.00 H new ATOM 0 HG LEU A 81 16.992 -5.660 -0.236 1.00 0.00 H new ATOM 0 HD11 LEU A 81 18.886 -5.885 -1.832 1.00 0.00 H new ATOM 0 HD12 LEU A 81 18.614 -4.180 -1.397 1.00 0.00 H new ATOM 0 HD13 LEU A 81 19.962 -5.082 -0.663 1.00 0.00 H new ATOM 0 HD21 LEU A 81 18.421 -7.689 -0.177 1.00 0.00 H new ATOM 0 HD22 LEU A 81 19.501 -6.893 0.993 1.00 0.00 H new ATOM 0 HD23 LEU A 81 17.824 -7.278 1.449 1.00 0.00 H new ATOM 385 N ALA A 82 17.484 -4.064 4.421 1.00 0.00 N ATOM 386 CA ALA A 82 17.604 -3.156 5.556 1.00 0.00 C ATOM 387 C ALA A 82 18.450 -3.786 6.659 1.00 0.00 C ATOM 388 O ALA A 82 18.063 -3.785 7.828 1.00 0.00 O ATOM 389 CB ALA A 82 16.217 -2.818 6.104 1.00 0.00 C ATOM 0 H ALA A 82 17.848 -5.003 4.586 1.00 0.00 H new ATOM 0 HA ALA A 82 18.092 -2.242 5.216 1.00 0.00 H new ATOM 0 HB1 ALA A 82 16.316 -2.140 6.951 1.00 0.00 H new ATOM 0 HB2 ALA A 82 15.624 -2.340 5.324 1.00 0.00 H new ATOM 0 HB3 ALA A 82 15.721 -3.733 6.428 1.00 0.00 H new ATOM 395 N THR A 83 19.605 -4.323 6.278 1.00 0.00 N ATOM 396 CA THR A 83 20.499 -4.954 7.244 1.00 0.00 C ATOM 397 C THR A 83 21.317 -3.899 7.982 1.00 0.00 C ATOM 398 O THR A 83 21.749 -4.115 9.114 1.00 0.00 O ATOM 399 CB THR A 83 21.441 -5.924 6.527 1.00 0.00 C ATOM 400 OG1 THR A 83 20.676 -6.905 5.843 1.00 0.00 O ATOM 401 CG2 THR A 83 22.350 -6.605 7.550 1.00 0.00 C ATOM 0 H THR A 83 19.942 -4.334 5.315 1.00 0.00 H new ATOM 0 HA THR A 83 19.896 -5.502 7.967 1.00 0.00 H new ATOM 0 HB THR A 83 22.052 -5.375 5.811 1.00 0.00 H new ATOM 0 HG1 THR A 83 21.278 -7.526 5.382 1.00 0.00 H new ATOM 0 HG21 THR A 83 23.020 -7.296 7.038 1.00 0.00 H new ATOM 0 HG22 THR A 83 22.937 -5.851 8.074 1.00 0.00 H new ATOM 0 HG23 THR A 83 21.742 -7.155 8.268 1.00 0.00 H new ATOM 409 N LYS A 84 21.525 -2.760 7.332 1.00 0.00 N ATOM 410 CA LYS A 84 22.293 -1.674 7.932 1.00 0.00 C ATOM 411 C LYS A 84 21.383 -0.756 8.742 1.00 0.00 C ATOM 412 O LYS A 84 21.763 0.361 9.093 1.00 0.00 O ATOM 413 CB LYS A 84 22.997 -0.866 6.838 1.00 0.00 C ATOM 414 CG LYS A 84 23.545 -1.817 5.771 1.00 0.00 C ATOM 415 CD LYS A 84 24.311 -1.018 4.707 1.00 0.00 C ATOM 416 CE LYS A 84 25.760 -0.812 5.156 1.00 0.00 C ATOM 417 NZ LYS A 84 26.517 -0.108 4.083 1.00 0.00 N ATOM 0 H LYS A 84 21.175 -2.564 6.394 1.00 0.00 H new ATOM 0 HA LYS A 84 23.038 -2.107 8.600 1.00 0.00 H new ATOM 0 HB2 LYS A 84 22.299 -0.160 6.387 1.00 0.00 H new ATOM 0 HB3 LYS A 84 23.809 -0.280 7.269 1.00 0.00 H new ATOM 0 HG2 LYS A 84 24.204 -2.553 6.231 1.00 0.00 H new ATOM 0 HG3 LYS A 84 22.727 -2.368 5.307 1.00 0.00 H new ATOM 0 HD2 LYS A 84 24.288 -1.548 3.755 1.00 0.00 H new ATOM 0 HD3 LYS A 84 23.830 -0.053 4.547 1.00 0.00 H new ATOM 0 HE2 LYS A 84 25.787 -0.230 6.077 1.00 0.00 H new ATOM 0 HE3 LYS A 84 26.225 -1.774 5.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 27.501 0.032 4.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 26.501 -0.680 3.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 26.077 0.816 3.897 1.00 0.00 H new ATOM 431 N ALA A 85 20.177 -1.235 9.033 1.00 0.00 N ATOM 432 CA ALA A 85 19.218 -0.446 9.801 1.00 0.00 C ATOM 433 C ALA A 85 19.497 -0.568 11.295 1.00 0.00 C ATOM 434 O ALA A 85 19.278 -1.621 11.894 1.00 0.00 O ATOM 435 CB ALA A 85 17.794 -0.927 9.505 1.00 0.00 C ATOM 0 H ALA A 85 19.842 -2.157 8.752 1.00 0.00 H new ATOM 0 HA ALA A 85 19.318 0.599 9.509 1.00 0.00 H new ATOM 0 HB1 ALA A 85 17.083 -0.335 10.081 1.00 0.00 H new ATOM 0 HB2 ALA A 85 17.585 -0.812 8.441 1.00 0.00 H new ATOM 0 HB3 ALA A 85 17.700 -1.977 9.782 1.00 0.00 H new ATOM 441 N ALA A 86 19.980 0.518 11.892 1.00 0.00 N ATOM 442 CA ALA A 86 20.285 0.525 13.318 1.00 0.00 C ATOM 443 C ALA A 86 19.048 0.901 14.129 1.00 0.00 C ATOM 444 O ALA A 86 18.640 0.171 15.032 1.00 0.00 O ATOM 445 CB ALA A 86 21.408 1.523 13.607 1.00 0.00 C ATOM 0 H ALA A 86 20.167 1.399 11.413 1.00 0.00 H new ATOM 0 HA ALA A 86 20.605 -0.476 13.607 1.00 0.00 H new ATOM 0 HB1 ALA A 86 21.630 1.522 14.674 1.00 0.00 H new ATOM 0 HB2 ALA A 86 22.301 1.237 13.051 1.00 0.00 H new ATOM 0 HB3 ALA A 86 21.095 2.522 13.302 1.00 0.00 H new ATOM 451 N ALA A 87 18.457 2.045 13.798 1.00 0.00 N ATOM 452 CA ALA A 87 17.267 2.510 14.502 1.00 0.00 C ATOM 453 C ALA A 87 16.621 3.670 13.751 1.00 0.00 C ATOM 454 O ALA A 87 17.273 4.672 13.459 1.00 0.00 O ATOM 455 CB ALA A 87 17.638 2.959 15.916 1.00 0.00 C ATOM 0 H ALA A 87 18.779 2.663 13.053 1.00 0.00 H new ATOM 0 HA ALA A 87 16.556 1.686 14.558 1.00 0.00 H new ATOM 0 HB1 ALA A 87 16.744 3.305 16.434 1.00 0.00 H new ATOM 0 HB2 ALA A 87 18.073 2.121 16.461 1.00 0.00 H new ATOM 0 HB3 ALA A 87 18.362 3.772 15.861 1.00 0.00 H new ATOM 461 N GLY A 88 15.337 3.526 13.441 1.00 0.00 N ATOM 462 CA GLY A 88 14.613 4.568 12.723 1.00 0.00 C ATOM 463 C GLY A 88 14.883 4.483 11.225 1.00 0.00 C ATOM 464 O GLY A 88 16.001 4.724 10.771 1.00 0.00 O ATOM 0 H GLY A 88 14.780 2.704 13.674 1.00 0.00 H new ATOM 0 HA2 GLY A 88 13.544 4.469 12.910 1.00 0.00 H new ATOM 0 HA3 GLY A 88 14.912 5.548 13.096 1.00 0.00 H new ATOM 468 N THR A 89 13.849 4.139 10.460 1.00 0.00 N ATOM 469 CA THR A 89 13.980 4.022 9.010 1.00 0.00 C ATOM 470 C THR A 89 12.856 4.778 8.308 1.00 0.00 C ATOM 471 O THR A 89 12.940 5.065 7.114 1.00 0.00 O ATOM 472 CB THR A 89 13.941 2.549 8.601 1.00 0.00 C ATOM 473 OG1 THR A 89 13.978 2.453 7.183 1.00 0.00 O ATOM 474 CG2 THR A 89 12.656 1.906 9.124 1.00 0.00 C ATOM 0 H THR A 89 12.916 3.937 10.818 1.00 0.00 H new ATOM 0 HA THR A 89 14.935 4.456 8.713 1.00 0.00 H new ATOM 0 HB THR A 89 14.801 2.031 9.024 1.00 0.00 H new ATOM 0 HG1 THR A 89 13.955 1.510 6.918 1.00 0.00 H new ATOM 0 HG21 THR A 89 12.629 0.856 8.832 1.00 0.00 H new ATOM 0 HG22 THR A 89 12.628 1.981 10.211 1.00 0.00 H new ATOM 0 HG23 THR A 89 11.793 2.422 8.702 1.00 0.00 H new ATOM 482 N LYS A 90 11.806 5.096 9.056 1.00 0.00 N ATOM 483 CA LYS A 90 10.670 5.819 8.494 1.00 0.00 C ATOM 484 C LYS A 90 11.006 7.298 8.328 1.00 0.00 C ATOM 485 O LYS A 90 10.536 8.141 9.092 1.00 0.00 O ATOM 486 CB LYS A 90 9.451 5.669 9.406 1.00 0.00 C ATOM 487 CG LYS A 90 9.327 4.213 9.856 1.00 0.00 C ATOM 488 CD LYS A 90 8.074 4.050 10.719 1.00 0.00 C ATOM 489 CE LYS A 90 8.085 2.669 11.380 1.00 0.00 C ATOM 490 NZ LYS A 90 6.874 2.519 12.235 1.00 0.00 N ATOM 0 H LYS A 90 11.717 4.867 10.046 1.00 0.00 H new ATOM 0 HA LYS A 90 10.443 5.397 7.515 1.00 0.00 H new ATOM 0 HB2 LYS A 90 9.550 6.322 10.273 1.00 0.00 H new ATOM 0 HB3 LYS A 90 8.548 5.976 8.878 1.00 0.00 H new ATOM 0 HG2 LYS A 90 9.271 3.556 8.988 1.00 0.00 H new ATOM 0 HG3 LYS A 90 10.211 3.919 10.421 1.00 0.00 H new ATOM 0 HD2 LYS A 90 8.040 4.829 11.481 1.00 0.00 H new ATOM 0 HD3 LYS A 90 7.180 4.164 10.106 1.00 0.00 H new ATOM 0 HE2 LYS A 90 8.105 1.889 10.618 1.00 0.00 H new ATOM 0 HE3 LYS A 90 8.986 2.549 11.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 6.880 1.581 12.685 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 6.874 3.255 12.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 6.021 2.616 11.648 1.00 0.00 H new ATOM 504 N LYS A 91 11.827 7.604 7.327 1.00 0.00 N ATOM 505 CA LYS A 91 12.224 8.985 7.070 1.00 0.00 C ATOM 506 C LYS A 91 11.204 9.683 6.175 1.00 0.00 C ATOM 507 O LYS A 91 11.006 10.895 6.274 1.00 0.00 O ATOM 508 CB LYS A 91 13.601 9.013 6.398 1.00 0.00 C ATOM 509 CG LYS A 91 13.584 8.143 5.126 1.00 0.00 C ATOM 510 CD LYS A 91 14.693 7.089 5.200 1.00 0.00 C ATOM 511 CE LYS A 91 14.680 6.246 3.922 1.00 0.00 C ATOM 512 NZ LYS A 91 15.796 5.260 3.967 1.00 0.00 N ATOM 0 H LYS A 91 12.228 6.920 6.685 1.00 0.00 H new ATOM 0 HA LYS A 91 12.271 9.513 8.023 1.00 0.00 H new ATOM 0 HB2 LYS A 91 13.870 10.038 6.144 1.00 0.00 H new ATOM 0 HB3 LYS A 91 14.360 8.646 7.089 1.00 0.00 H new ATOM 0 HG2 LYS A 91 12.614 7.656 5.021 1.00 0.00 H new ATOM 0 HG3 LYS A 91 13.724 8.769 4.245 1.00 0.00 H new ATOM 0 HD2 LYS A 91 15.662 7.573 5.320 1.00 0.00 H new ATOM 0 HD3 LYS A 91 14.546 6.451 6.071 1.00 0.00 H new ATOM 0 HE2 LYS A 91 13.726 5.728 3.825 1.00 0.00 H new ATOM 0 HE3 LYS A 91 14.784 6.889 3.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 15.788 4.687 3.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 16.702 5.765 4.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 15.678 4.639 4.793 1.00 0.00 H new ATOM 526 N TYR A 92 10.561 8.913 5.302 1.00 0.00 N ATOM 527 CA TYR A 92 9.563 9.465 4.389 1.00 0.00 C ATOM 528 C TYR A 92 8.158 9.255 4.950 1.00 0.00 C ATOM 529 O TYR A 92 7.722 8.121 5.146 1.00 0.00 O ATOM 530 CB TYR A 92 9.677 8.778 3.023 1.00 0.00 C ATOM 531 CG TYR A 92 10.681 9.499 2.146 1.00 0.00 C ATOM 532 CD1 TYR A 92 11.800 10.128 2.711 1.00 0.00 C ATOM 533 CD2 TYR A 92 10.490 9.529 0.760 1.00 0.00 C ATOM 534 CE1 TYR A 92 12.723 10.785 1.887 1.00 0.00 C ATOM 535 CE2 TYR A 92 11.415 10.186 -0.062 1.00 0.00 C ATOM 536 CZ TYR A 92 12.530 10.814 0.502 1.00 0.00 C ATOM 537 OH TYR A 92 13.439 11.461 -0.308 1.00 0.00 O ATOM 0 H TYR A 92 10.712 7.909 5.207 1.00 0.00 H new ATOM 0 HA TYR A 92 9.743 10.534 4.277 1.00 0.00 H new ATOM 0 HB2 TYR A 92 9.982 7.740 3.156 1.00 0.00 H new ATOM 0 HB3 TYR A 92 8.703 8.764 2.534 1.00 0.00 H new ATOM 0 HD1 TYR A 92 11.950 10.106 3.780 1.00 0.00 H new ATOM 0 HD2 TYR A 92 9.629 9.045 0.324 1.00 0.00 H new ATOM 0 HE1 TYR A 92 13.585 11.270 2.322 1.00 0.00 H new ATOM 0 HE2 TYR A 92 11.267 10.207 -1.132 1.00 0.00 H new ATOM 0 HH TYR A 92 14.322 11.450 0.117 1.00 0.00 H new ATOM 547 N ASP A 93 7.455 10.354 5.203 1.00 0.00 N ATOM 548 CA ASP A 93 6.099 10.280 5.740 1.00 0.00 C ATOM 549 C ASP A 93 5.073 10.474 4.627 1.00 0.00 C ATOM 550 O ASP A 93 4.734 11.603 4.275 1.00 0.00 O ATOM 551 CB ASP A 93 5.903 11.354 6.810 1.00 0.00 C ATOM 552 CG ASP A 93 6.809 11.074 8.002 1.00 0.00 C ATOM 553 OD1 ASP A 93 7.968 11.454 7.944 1.00 0.00 O ATOM 554 OD2 ASP A 93 6.333 10.485 8.958 1.00 0.00 O ATOM 0 H ASP A 93 7.798 11.302 5.046 1.00 0.00 H new ATOM 0 HA ASP A 93 5.956 9.295 6.184 1.00 0.00 H new ATOM 0 HB2 ASP A 93 6.127 12.337 6.396 1.00 0.00 H new ATOM 0 HB3 ASP A 93 4.862 11.373 7.131 1.00 0.00 H new ATOM 559 N LEU A 94 4.582 9.365 4.079 1.00 0.00 N ATOM 560 CA LEU A 94 3.591 9.424 3.008 1.00 0.00 C ATOM 561 C LEU A 94 2.196 9.123 3.550 1.00 0.00 C ATOM 562 O LEU A 94 1.318 8.675 2.813 1.00 0.00 O ATOM 563 CB LEU A 94 3.939 8.411 1.915 1.00 0.00 C ATOM 564 CG LEU A 94 5.437 8.470 1.606 1.00 0.00 C ATOM 565 CD1 LEU A 94 5.754 7.547 0.425 1.00 0.00 C ATOM 566 CD2 LEU A 94 5.828 9.906 1.248 1.00 0.00 C ATOM 0 H LEU A 94 4.852 8.421 4.356 1.00 0.00 H new ATOM 0 HA LEU A 94 3.600 10.430 2.589 1.00 0.00 H new ATOM 0 HB2 LEU A 94 3.665 7.407 2.238 1.00 0.00 H new ATOM 0 HB3 LEU A 94 3.364 8.624 1.014 1.00 0.00 H new ATOM 0 HG LEU A 94 6.000 8.146 2.481 1.00 0.00 H new ATOM 0 HD11 LEU A 94 6.821 7.590 0.206 1.00 0.00 H new ATOM 0 HD12 LEU A 94 5.476 6.524 0.678 1.00 0.00 H new ATOM 0 HD13 LEU A 94 5.191 7.870 -0.450 1.00 0.00 H new ATOM 0 HD21 LEU A 94 6.895 9.949 1.028 1.00 0.00 H new ATOM 0 HD22 LEU A 94 5.264 10.229 0.373 1.00 0.00 H new ATOM 0 HD23 LEU A 94 5.604 10.564 2.088 1.00 0.00 H new ATOM 578 N SER A 95 2.002 9.370 4.841 1.00 0.00 N ATOM 579 CA SER A 95 0.710 9.119 5.471 1.00 0.00 C ATOM 580 C SER A 95 -0.349 10.081 4.943 1.00 0.00 C ATOM 581 O SER A 95 -1.519 9.998 5.318 1.00 0.00 O ATOM 582 CB SER A 95 0.831 9.275 6.986 1.00 0.00 C ATOM 583 OG SER A 95 -0.467 9.245 7.566 1.00 0.00 O ATOM 0 H SER A 95 2.716 9.741 5.468 1.00 0.00 H new ATOM 0 HA SER A 95 0.406 8.100 5.231 1.00 0.00 H new ATOM 0 HB2 SER A 95 1.445 8.474 7.398 1.00 0.00 H new ATOM 0 HB3 SER A 95 1.329 10.214 7.228 1.00 0.00 H new ATOM 0 HG SER A 95 -1.142 9.238 6.856 1.00 0.00 H new ATOM 589 N LYS A 96 0.068 10.996 4.071 1.00 0.00 N ATOM 590 CA LYS A 96 -0.855 11.975 3.498 1.00 0.00 C ATOM 591 C LYS A 96 -1.155 11.641 2.042 1.00 0.00 C ATOM 592 O LYS A 96 -1.871 12.375 1.361 1.00 0.00 O ATOM 593 CB LYS A 96 -0.246 13.376 3.584 1.00 0.00 C ATOM 594 CG LYS A 96 0.383 13.577 4.963 1.00 0.00 C ATOM 595 CD LYS A 96 0.943 14.998 5.067 1.00 0.00 C ATOM 596 CE LYS A 96 1.867 15.095 6.282 1.00 0.00 C ATOM 597 NZ LYS A 96 1.167 14.556 7.483 1.00 0.00 N ATOM 0 H LYS A 96 1.031 11.081 3.747 1.00 0.00 H new ATOM 0 HA LYS A 96 -1.785 11.945 4.065 1.00 0.00 H new ATOM 0 HB2 LYS A 96 0.508 13.504 2.807 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -1.015 14.129 3.410 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -0.361 13.410 5.742 1.00 0.00 H new ATOM 0 HG3 LYS A 96 1.178 12.849 5.121 1.00 0.00 H new ATOM 0 HD2 LYS A 96 1.491 15.252 4.159 1.00 0.00 H new ATOM 0 HD3 LYS A 96 0.128 15.716 5.159 1.00 0.00 H new ATOM 0 HE2 LYS A 96 2.784 14.535 6.100 1.00 0.00 H new ATOM 0 HE3 LYS A 96 2.155 16.132 6.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 1.627 14.916 8.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 0.172 14.858 7.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 1.213 13.517 7.475 1.00 0.00 H new ATOM 611 N TRP A 97 -0.601 10.530 1.565 1.00 0.00 N ATOM 612 CA TRP A 97 -0.813 10.110 0.183 1.00 0.00 C ATOM 613 C TRP A 97 -1.964 9.113 0.095 1.00 0.00 C ATOM 614 O TRP A 97 -2.375 8.536 1.102 1.00 0.00 O ATOM 615 CB TRP A 97 0.460 9.466 -0.365 1.00 0.00 C ATOM 616 CG TRP A 97 1.558 10.482 -0.417 1.00 0.00 C ATOM 617 CD1 TRP A 97 2.005 11.201 0.639 1.00 0.00 C ATOM 618 CD2 TRP A 97 2.356 10.899 -1.562 1.00 0.00 C ATOM 619 NE1 TRP A 97 3.025 12.032 0.215 1.00 0.00 N ATOM 620 CE2 TRP A 97 3.277 11.884 -1.134 1.00 0.00 C ATOM 621 CE3 TRP A 97 2.368 10.524 -2.917 1.00 0.00 C ATOM 622 CZ2 TRP A 97 4.181 12.474 -2.018 1.00 0.00 C ATOM 623 CZ3 TRP A 97 3.276 11.117 -3.812 1.00 0.00 C ATOM 624 CH2 TRP A 97 4.180 12.089 -3.362 1.00 0.00 C ATOM 0 H TRP A 97 -0.005 9.907 2.111 1.00 0.00 H new ATOM 0 HA TRP A 97 -1.063 10.990 -0.410 1.00 0.00 H new ATOM 0 HB2 TRP A 97 0.756 8.629 0.267 1.00 0.00 H new ATOM 0 HB3 TRP A 97 0.276 9.064 -1.361 1.00 0.00 H new ATOM 0 HD1 TRP A 97 1.626 11.136 1.648 1.00 0.00 H new ATOM 0 HE1 TRP A 97 3.530 12.676 0.824 1.00 0.00 H new ATOM 0 HE3 TRP A 97 1.675 9.776 -3.273 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 4.876 13.222 -1.667 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 3.277 10.822 -4.851 1.00 0.00 H new ATOM 0 HH2 TRP A 97 4.876 12.541 -4.054 1.00 0.00 H new ATOM 635 N LYS A 98 -2.477 8.911 -1.117 1.00 0.00 N ATOM 636 CA LYS A 98 -3.580 7.977 -1.330 1.00 0.00 C ATOM 637 C LYS A 98 -3.122 6.798 -2.185 1.00 0.00 C ATOM 638 O LYS A 98 -2.081 6.860 -2.838 1.00 0.00 O ATOM 639 CB LYS A 98 -4.748 8.686 -2.021 1.00 0.00 C ATOM 640 CG LYS A 98 -4.968 10.060 -1.382 1.00 0.00 C ATOM 641 CD LYS A 98 -5.337 9.886 0.093 1.00 0.00 C ATOM 642 CE LYS A 98 -5.925 11.192 0.631 1.00 0.00 C ATOM 643 NZ LYS A 98 -7.315 11.359 0.118 1.00 0.00 N ATOM 0 H LYS A 98 -2.149 9.379 -1.962 1.00 0.00 H new ATOM 0 HA LYS A 98 -3.908 7.607 -0.359 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -4.540 8.798 -3.085 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -5.653 8.085 -1.935 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -4.065 10.663 -1.473 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -5.762 10.593 -1.906 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -6.059 9.077 0.205 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -4.454 9.608 0.669 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -5.927 11.181 1.721 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -5.308 12.036 0.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -7.829 12.032 0.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -7.284 11.721 -0.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -7.802 10.440 0.130 1.00 0.00 H new ATOM 657 N TYR A 99 -3.907 5.729 -2.172 1.00 0.00 N ATOM 658 CA TYR A 99 -3.579 4.536 -2.945 1.00 0.00 C ATOM 659 C TYR A 99 -3.255 4.894 -4.395 1.00 0.00 C ATOM 660 O TYR A 99 -2.316 4.351 -4.982 1.00 0.00 O ATOM 661 CB TYR A 99 -4.762 3.561 -2.901 1.00 0.00 C ATOM 662 CG TYR A 99 -4.535 2.421 -3.869 1.00 0.00 C ATOM 663 CD1 TYR A 99 -3.407 1.602 -3.737 1.00 0.00 C ATOM 664 CD2 TYR A 99 -5.457 2.179 -4.896 1.00 0.00 C ATOM 665 CE1 TYR A 99 -3.200 0.544 -4.630 1.00 0.00 C ATOM 666 CE2 TYR A 99 -5.251 1.121 -5.789 1.00 0.00 C ATOM 667 CZ TYR A 99 -4.122 0.303 -5.656 1.00 0.00 C ATOM 668 OH TYR A 99 -3.919 -0.740 -6.537 1.00 0.00 O ATOM 0 H TYR A 99 -4.773 5.662 -1.637 1.00 0.00 H new ATOM 0 HA TYR A 99 -2.698 4.068 -2.506 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -4.884 3.171 -1.891 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -5.684 4.085 -3.154 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -2.696 1.787 -2.945 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -6.328 2.810 -4.999 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -2.329 -0.086 -4.528 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -5.962 0.936 -6.580 1.00 0.00 H new ATOM 0 HH TYR A 99 -4.653 -0.768 -7.186 1.00 0.00 H new ATOM 678 N ALA A 100 -4.040 5.801 -4.967 1.00 0.00 N ATOM 679 CA ALA A 100 -3.837 6.216 -6.353 1.00 0.00 C ATOM 680 C ALA A 100 -2.545 7.016 -6.512 1.00 0.00 C ATOM 681 O ALA A 100 -1.816 6.846 -7.490 1.00 0.00 O ATOM 682 CB ALA A 100 -5.020 7.066 -6.819 1.00 0.00 C ATOM 0 H ALA A 100 -4.819 6.261 -4.496 1.00 0.00 H new ATOM 0 HA ALA A 100 -3.761 5.316 -6.964 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -4.863 7.372 -7.853 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -5.938 6.482 -6.749 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -5.104 7.950 -6.187 1.00 0.00 H new ATOM 688 N GLU A 101 -2.270 7.892 -5.553 1.00 0.00 N ATOM 689 CA GLU A 101 -1.065 8.712 -5.611 1.00 0.00 C ATOM 690 C GLU A 101 0.181 7.848 -5.455 1.00 0.00 C ATOM 691 O GLU A 101 1.141 7.981 -6.213 1.00 0.00 O ATOM 692 CB GLU A 101 -1.096 9.774 -4.509 1.00 0.00 C ATOM 693 CG GLU A 101 -2.311 10.687 -4.710 1.00 0.00 C ATOM 694 CD GLU A 101 -2.073 12.032 -4.032 1.00 0.00 C ATOM 695 OE1 GLU A 101 -1.349 12.836 -4.595 1.00 0.00 O ATOM 696 OE2 GLU A 101 -2.620 12.239 -2.961 1.00 0.00 O ATOM 0 H GLU A 101 -2.857 8.052 -4.734 1.00 0.00 H new ATOM 0 HA GLU A 101 -1.032 9.203 -6.584 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -1.145 9.296 -3.531 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -0.179 10.362 -4.531 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -2.493 10.835 -5.775 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -3.203 10.215 -4.297 1.00 0.00 H new ATOM 703 N LEU A 102 0.160 6.962 -4.466 1.00 0.00 N ATOM 704 CA LEU A 102 1.294 6.082 -4.216 1.00 0.00 C ATOM 705 C LEU A 102 1.574 5.203 -5.435 1.00 0.00 C ATOM 706 O LEU A 102 2.636 5.304 -6.052 1.00 0.00 O ATOM 707 CB LEU A 102 1.007 5.202 -2.998 1.00 0.00 C ATOM 708 CG LEU A 102 0.840 6.083 -1.753 1.00 0.00 C ATOM 709 CD1 LEU A 102 0.379 5.221 -0.578 1.00 0.00 C ATOM 710 CD2 LEU A 102 2.176 6.752 -1.403 1.00 0.00 C ATOM 0 H LEU A 102 -0.625 6.835 -3.828 1.00 0.00 H new ATOM 0 HA LEU A 102 2.174 6.696 -4.022 1.00 0.00 H new ATOM 0 HB2 LEU A 102 0.103 4.616 -3.165 1.00 0.00 H new ATOM 0 HB3 LEU A 102 1.822 4.494 -2.848 1.00 0.00 H new ATOM 0 HG LEU A 102 0.096 6.853 -1.956 1.00 0.00 H new ATOM 0 HD11 LEU A 102 0.260 5.846 0.307 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -0.574 4.753 -0.822 1.00 0.00 H new ATOM 0 HD13 LEU A 102 1.122 4.449 -0.380 1.00 0.00 H new ATOM 0 HD21 LEU A 102 2.050 7.376 -0.518 1.00 0.00 H new ATOM 0 HD22 LEU A 102 2.925 5.986 -1.203 1.00 0.00 H new ATOM 0 HD23 LEU A 102 2.503 7.370 -2.239 1.00 0.00 H new ATOM 722 N ARG A 103 0.619 4.341 -5.776 1.00 0.00 N ATOM 723 CA ARG A 103 0.781 3.453 -6.920 1.00 0.00 C ATOM 724 C ARG A 103 1.227 4.237 -8.154 1.00 0.00 C ATOM 725 O ARG A 103 2.075 3.781 -8.923 1.00 0.00 O ATOM 726 CB ARG A 103 -0.539 2.732 -7.215 1.00 0.00 C ATOM 727 CG ARG A 103 -1.545 3.720 -7.807 1.00 0.00 C ATOM 728 CD ARG A 103 -2.922 3.059 -7.908 1.00 0.00 C ATOM 729 NE ARG A 103 -3.770 3.810 -8.827 1.00 0.00 N ATOM 730 CZ ARG A 103 -5.053 3.502 -8.986 1.00 0.00 C ATOM 731 NH1 ARG A 103 -5.575 2.512 -8.317 1.00 0.00 N ATOM 732 NH2 ARG A 103 -5.792 4.192 -9.812 1.00 0.00 N ATOM 0 H ARG A 103 -0.267 4.240 -5.280 1.00 0.00 H new ATOM 0 HA ARG A 103 1.548 2.718 -6.678 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -0.368 1.911 -7.911 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -0.939 2.296 -6.300 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -1.604 4.611 -7.182 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -1.213 4.044 -8.794 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -2.816 2.031 -8.255 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -3.387 3.017 -6.923 1.00 0.00 H new ATOM 0 HE ARG A 103 -3.371 4.585 -9.357 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -4.999 1.973 -7.671 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -6.560 2.277 -8.440 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -5.385 4.967 -10.335 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -6.777 3.956 -9.934 1.00 0.00 H new ATOM 746 N ASP A 104 0.644 5.417 -8.339 1.00 0.00 N ATOM 747 CA ASP A 104 0.980 6.254 -9.485 1.00 0.00 C ATOM 748 C ASP A 104 2.437 6.702 -9.429 1.00 0.00 C ATOM 749 O ASP A 104 3.193 6.501 -10.379 1.00 0.00 O ATOM 750 CB ASP A 104 0.071 7.479 -9.514 1.00 0.00 C ATOM 751 CG ASP A 104 0.482 8.409 -10.650 1.00 0.00 C ATOM 752 OD1 ASP A 104 0.481 7.963 -11.786 1.00 0.00 O ATOM 753 OD2 ASP A 104 0.791 9.555 -10.369 1.00 0.00 O ATOM 0 H ASP A 104 -0.059 5.813 -7.715 1.00 0.00 H new ATOM 0 HA ASP A 104 0.835 5.665 -10.391 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -0.966 7.169 -9.644 1.00 0.00 H new ATOM 0 HB3 ASP A 104 0.129 8.007 -8.562 1.00 0.00 H new ATOM 758 N THR A 105 2.821 7.317 -8.317 1.00 0.00 N ATOM 759 CA THR A 105 4.188 7.796 -8.158 1.00 0.00 C ATOM 760 C THR A 105 5.187 6.703 -8.516 1.00 0.00 C ATOM 761 O THR A 105 5.986 6.857 -9.439 1.00 0.00 O ATOM 762 CB THR A 105 4.420 8.255 -6.715 1.00 0.00 C ATOM 763 OG1 THR A 105 3.271 8.950 -6.254 1.00 0.00 O ATOM 764 CG2 THR A 105 5.635 9.184 -6.661 1.00 0.00 C ATOM 0 H THR A 105 2.211 7.495 -7.519 1.00 0.00 H new ATOM 0 HA THR A 105 4.336 8.639 -8.833 1.00 0.00 H new ATOM 0 HB THR A 105 4.602 7.387 -6.081 1.00 0.00 H new ATOM 0 HG1 THR A 105 2.634 8.311 -5.871 1.00 0.00 H new ATOM 0 HG21 THR A 105 5.799 9.510 -5.634 1.00 0.00 H new ATOM 0 HG22 THR A 105 6.517 8.651 -7.018 1.00 0.00 H new ATOM 0 HG23 THR A 105 5.456 10.054 -7.293 1.00 0.00 H new ATOM 772 N ILE A 106 5.138 5.597 -7.782 1.00 0.00 N ATOM 773 CA ILE A 106 6.046 4.488 -8.034 1.00 0.00 C ATOM 774 C ILE A 106 5.915 4.002 -9.475 1.00 0.00 C ATOM 775 O ILE A 106 6.880 3.514 -10.062 1.00 0.00 O ATOM 776 CB ILE A 106 5.759 3.342 -7.062 1.00 0.00 C ATOM 777 CG1 ILE A 106 4.415 2.689 -7.397 1.00 0.00 C ATOM 778 CG2 ILE A 106 5.704 3.899 -5.640 1.00 0.00 C ATOM 779 CD1 ILE A 106 4.169 1.510 -6.451 1.00 0.00 C ATOM 0 H ILE A 106 4.484 5.446 -7.014 1.00 0.00 H new ATOM 0 HA ILE A 106 7.067 4.836 -7.880 1.00 0.00 H new ATOM 0 HB ILE A 106 6.548 2.595 -7.145 1.00 0.00 H new ATOM 0 HG12 ILE A 106 3.611 3.419 -7.302 1.00 0.00 H new ATOM 0 HG13 ILE A 106 4.414 2.345 -8.431 1.00 0.00 H new ATOM 0 HG21 ILE A 106 5.500 3.089 -4.940 1.00 0.00 H new ATOM 0 HG22 ILE A 106 6.660 4.360 -5.393 1.00 0.00 H new ATOM 0 HG23 ILE A 106 4.913 4.646 -5.572 1.00 0.00 H new ATOM 0 HD11 ILE A 106 3.212 1.045 -6.690 1.00 0.00 H new ATOM 0 HD12 ILE A 106 4.967 0.777 -6.568 1.00 0.00 H new ATOM 0 HD13 ILE A 106 4.152 1.867 -5.421 1.00 0.00 H new ATOM 791 N ASN A 107 4.719 4.138 -10.043 1.00 0.00 N ATOM 792 CA ASN A 107 4.493 3.707 -11.417 1.00 0.00 C ATOM 793 C ASN A 107 5.134 4.685 -12.398 1.00 0.00 C ATOM 794 O ASN A 107 5.447 4.325 -13.533 1.00 0.00 O ATOM 795 CB ASN A 107 2.992 3.607 -11.692 1.00 0.00 C ATOM 796 CG ASN A 107 2.459 2.255 -11.228 1.00 0.00 C ATOM 797 OD1 ASN A 107 3.111 1.229 -11.422 1.00 0.00 O ATOM 798 ND2 ASN A 107 1.305 2.192 -10.622 1.00 0.00 N ATOM 0 H ASN A 107 3.903 4.538 -9.580 1.00 0.00 H new ATOM 0 HA ASN A 107 4.950 2.727 -11.552 1.00 0.00 H new ATOM 0 HB2 ASN A 107 2.466 4.410 -11.175 1.00 0.00 H new ATOM 0 HB3 ASN A 107 2.801 3.735 -12.757 1.00 0.00 H new ATOM 0 HD21 ASN A 107 0.942 1.292 -10.308 1.00 0.00 H new ATOM 0 HD22 ASN A 107 0.766 3.043 -10.462 1.00 0.00 H new ATOM 805 N THR A 108 5.325 5.925 -11.954 1.00 0.00 N ATOM 806 CA THR A 108 5.929 6.952 -12.802 1.00 0.00 C ATOM 807 C THR A 108 7.051 7.670 -12.058 1.00 0.00 C ATOM 808 O THR A 108 7.231 8.879 -12.204 1.00 0.00 O ATOM 809 CB THR A 108 4.867 7.969 -13.232 1.00 0.00 C ATOM 810 OG1 THR A 108 5.487 9.007 -13.978 1.00 0.00 O ATOM 811 CG2 THR A 108 4.181 8.568 -11.997 1.00 0.00 C ATOM 0 H THR A 108 5.072 6.243 -11.018 1.00 0.00 H new ATOM 0 HA THR A 108 6.345 6.467 -13.685 1.00 0.00 H new ATOM 0 HB THR A 108 4.119 7.468 -13.846 1.00 0.00 H new ATOM 0 HG1 THR A 108 6.202 9.412 -13.444 1.00 0.00 H new ATOM 0 HG21 THR A 108 3.428 9.290 -12.313 1.00 0.00 H new ATOM 0 HG22 THR A 108 3.704 7.773 -11.424 1.00 0.00 H new ATOM 0 HG23 THR A 108 4.924 9.068 -11.375 1.00 0.00 H new ATOM 819 N SER A 109 7.805 6.916 -11.263 1.00 0.00 N ATOM 820 CA SER A 109 8.912 7.489 -10.499 1.00 0.00 C ATOM 821 C SER A 109 10.167 6.640 -10.653 1.00 0.00 C ATOM 822 O SER A 109 10.140 5.573 -11.265 1.00 0.00 O ATOM 823 CB SER A 109 8.538 7.581 -9.021 1.00 0.00 C ATOM 824 OG SER A 109 9.675 7.994 -8.274 1.00 0.00 O ATOM 0 H SER A 109 7.672 5.913 -11.131 1.00 0.00 H new ATOM 0 HA SER A 109 9.112 8.488 -10.886 1.00 0.00 H new ATOM 0 HB2 SER A 109 7.721 8.290 -8.884 1.00 0.00 H new ATOM 0 HB3 SER A 109 8.184 6.614 -8.663 1.00 0.00 H new ATOM 0 HG SER A 109 9.438 8.056 -7.325 1.00 0.00 H new ATOM 830 N CYS A 110 11.269 7.126 -10.092 1.00 0.00 N ATOM 831 CA CYS A 110 12.536 6.412 -10.166 1.00 0.00 C ATOM 832 C CYS A 110 13.403 6.751 -8.959 1.00 0.00 C ATOM 833 O CYS A 110 14.632 6.724 -9.037 1.00 0.00 O ATOM 834 CB CYS A 110 13.274 6.788 -11.451 1.00 0.00 C ATOM 835 SG CYS A 110 14.604 5.597 -11.754 1.00 0.00 S ATOM 0 H CYS A 110 11.310 8.009 -9.583 1.00 0.00 H new ATOM 0 HA CYS A 110 12.333 5.341 -10.168 1.00 0.00 H new ATOM 0 HB2 CYS A 110 12.581 6.797 -12.292 1.00 0.00 H new ATOM 0 HB3 CYS A 110 13.685 7.794 -11.366 1.00 0.00 H new ATOM 0 HG CYS A 110 15.341 5.489 -10.689 1.00 0.00 H new ATOM 841 N ASP A 111 12.753 7.072 -7.844 1.00 0.00 N ATOM 842 CA ASP A 111 13.471 7.415 -6.619 1.00 0.00 C ATOM 843 C ASP A 111 13.455 6.229 -5.659 1.00 0.00 C ATOM 844 O ASP A 111 12.395 5.763 -5.252 1.00 0.00 O ATOM 845 CB ASP A 111 12.824 8.640 -5.960 1.00 0.00 C ATOM 846 CG ASP A 111 13.564 9.912 -6.368 1.00 0.00 C ATOM 847 OD1 ASP A 111 13.637 10.175 -7.556 1.00 0.00 O ATOM 848 OD2 ASP A 111 14.045 10.603 -5.486 1.00 0.00 O ATOM 0 H ASP A 111 11.737 7.102 -7.763 1.00 0.00 H new ATOM 0 HA ASP A 111 14.505 7.654 -6.865 1.00 0.00 H new ATOM 0 HB2 ASP A 111 11.777 8.710 -6.255 1.00 0.00 H new ATOM 0 HB3 ASP A 111 12.844 8.531 -4.876 1.00 0.00 H new ATOM 853 N ILE A 112 14.638 5.740 -5.315 1.00 0.00 N ATOM 854 CA ILE A 112 14.748 4.599 -4.415 1.00 0.00 C ATOM 855 C ILE A 112 14.046 4.864 -3.088 1.00 0.00 C ATOM 856 O ILE A 112 13.119 4.149 -2.717 1.00 0.00 O ATOM 857 CB ILE A 112 16.219 4.281 -4.153 1.00 0.00 C ATOM 858 CG1 ILE A 112 16.948 4.056 -5.489 1.00 0.00 C ATOM 859 CG2 ILE A 112 16.317 3.026 -3.282 1.00 0.00 C ATOM 860 CD1 ILE A 112 16.805 2.596 -5.934 1.00 0.00 C ATOM 0 H ILE A 112 15.530 6.112 -5.642 1.00 0.00 H new ATOM 0 HA ILE A 112 14.264 3.750 -4.897 1.00 0.00 H new ATOM 0 HB ILE A 112 16.688 5.117 -3.634 1.00 0.00 H new ATOM 0 HG12 ILE A 112 16.537 4.718 -6.251 1.00 0.00 H new ATOM 0 HG13 ILE A 112 18.003 4.309 -5.383 1.00 0.00 H new ATOM 0 HG21 ILE A 112 17.365 2.795 -3.093 1.00 0.00 H new ATOM 0 HG22 ILE A 112 15.807 3.200 -2.335 1.00 0.00 H new ATOM 0 HG23 ILE A 112 15.849 2.188 -3.798 1.00 0.00 H new ATOM 0 HD11 ILE A 112 17.326 2.451 -6.881 1.00 0.00 H new ATOM 0 HD12 ILE A 112 17.238 1.941 -5.178 1.00 0.00 H new ATOM 0 HD13 ILE A 112 15.749 2.356 -6.060 1.00 0.00 H new ATOM 872 N GLU A 113 14.501 5.883 -2.369 1.00 0.00 N ATOM 873 CA GLU A 113 13.910 6.215 -1.078 1.00 0.00 C ATOM 874 C GLU A 113 12.399 6.395 -1.199 1.00 0.00 C ATOM 875 O GLU A 113 11.636 5.881 -0.380 1.00 0.00 O ATOM 876 CB GLU A 113 14.537 7.496 -0.524 1.00 0.00 C ATOM 877 CG GLU A 113 14.709 8.519 -1.651 1.00 0.00 C ATOM 878 CD GLU A 113 15.300 9.810 -1.096 1.00 0.00 C ATOM 879 OE1 GLU A 113 15.436 9.906 0.113 1.00 0.00 O ATOM 880 OE2 GLU A 113 15.611 10.684 -1.889 1.00 0.00 O ATOM 0 H GLU A 113 15.270 6.489 -2.654 1.00 0.00 H new ATOM 0 HA GLU A 113 14.108 5.390 -0.394 1.00 0.00 H new ATOM 0 HB2 GLU A 113 13.906 7.910 0.262 1.00 0.00 H new ATOM 0 HB3 GLU A 113 15.504 7.273 -0.072 1.00 0.00 H new ATOM 0 HG2 GLU A 113 15.361 8.114 -2.425 1.00 0.00 H new ATOM 0 HG3 GLU A 113 13.746 8.722 -2.120 1.00 0.00 H new ATOM 887 N LEU A 114 11.975 7.129 -2.219 1.00 0.00 N ATOM 888 CA LEU A 114 10.555 7.378 -2.436 1.00 0.00 C ATOM 889 C LEU A 114 9.807 6.068 -2.651 1.00 0.00 C ATOM 890 O LEU A 114 8.879 5.741 -1.911 1.00 0.00 O ATOM 891 CB LEU A 114 10.380 8.290 -3.659 1.00 0.00 C ATOM 892 CG LEU A 114 8.913 8.728 -3.835 1.00 0.00 C ATOM 893 CD1 LEU A 114 8.047 7.540 -4.275 1.00 0.00 C ATOM 894 CD2 LEU A 114 8.366 9.306 -2.523 1.00 0.00 C ATOM 0 H LEU A 114 12.591 7.561 -2.907 1.00 0.00 H new ATOM 0 HA LEU A 114 10.142 7.867 -1.554 1.00 0.00 H new ATOM 0 HB2 LEU A 114 11.013 9.171 -3.550 1.00 0.00 H new ATOM 0 HB3 LEU A 114 10.714 7.766 -4.555 1.00 0.00 H new ATOM 0 HG LEU A 114 8.878 9.498 -4.606 1.00 0.00 H new ATOM 0 HD11 LEU A 114 7.014 7.867 -4.395 1.00 0.00 H new ATOM 0 HD12 LEU A 114 8.417 7.152 -5.224 1.00 0.00 H new ATOM 0 HD13 LEU A 114 8.094 6.756 -3.519 1.00 0.00 H new ATOM 0 HD21 LEU A 114 7.329 9.611 -2.664 1.00 0.00 H new ATOM 0 HD22 LEU A 114 8.418 8.548 -1.742 1.00 0.00 H new ATOM 0 HD23 LEU A 114 8.962 10.171 -2.230 1.00 0.00 H new ATOM 906 N LEU A 115 10.210 5.325 -3.676 1.00 0.00 N ATOM 907 CA LEU A 115 9.568 4.058 -3.990 1.00 0.00 C ATOM 908 C LEU A 115 9.592 3.122 -2.785 1.00 0.00 C ATOM 909 O LEU A 115 8.608 2.440 -2.497 1.00 0.00 O ATOM 910 CB LEU A 115 10.281 3.401 -5.176 1.00 0.00 C ATOM 911 CG LEU A 115 9.641 3.870 -6.499 1.00 0.00 C ATOM 912 CD1 LEU A 115 10.571 4.840 -7.222 1.00 0.00 C ATOM 913 CD2 LEU A 115 9.375 2.659 -7.386 1.00 0.00 C ATOM 0 H LEU A 115 10.976 5.579 -4.300 1.00 0.00 H new ATOM 0 HA LEU A 115 8.527 4.251 -4.251 1.00 0.00 H new ATOM 0 HB2 LEU A 115 11.340 3.659 -5.163 1.00 0.00 H new ATOM 0 HB3 LEU A 115 10.216 2.316 -5.095 1.00 0.00 H new ATOM 0 HG LEU A 115 8.703 4.381 -6.280 1.00 0.00 H new ATOM 0 HD11 LEU A 115 10.107 5.163 -8.154 1.00 0.00 H new ATOM 0 HD12 LEU A 115 10.755 5.708 -6.589 1.00 0.00 H new ATOM 0 HD13 LEU A 115 11.516 4.343 -7.441 1.00 0.00 H new ATOM 0 HD21 LEU A 115 8.923 2.986 -8.322 1.00 0.00 H new ATOM 0 HD22 LEU A 115 10.315 2.148 -7.596 1.00 0.00 H new ATOM 0 HD23 LEU A 115 8.697 1.975 -6.875 1.00 0.00 H new ATOM 925 N ALA A 116 10.718 3.097 -2.085 1.00 0.00 N ATOM 926 CA ALA A 116 10.857 2.239 -0.915 1.00 0.00 C ATOM 927 C ALA A 116 9.777 2.564 0.111 1.00 0.00 C ATOM 928 O ALA A 116 9.130 1.667 0.651 1.00 0.00 O ATOM 929 CB ALA A 116 12.236 2.433 -0.283 1.00 0.00 C ATOM 0 H ALA A 116 11.543 3.656 -2.304 1.00 0.00 H new ATOM 0 HA ALA A 116 10.748 1.202 -1.232 1.00 0.00 H new ATOM 0 HB1 ALA A 116 12.330 1.788 0.590 1.00 0.00 H new ATOM 0 HB2 ALA A 116 13.008 2.177 -1.008 1.00 0.00 H new ATOM 0 HB3 ALA A 116 12.354 3.473 0.020 1.00 0.00 H new ATOM 935 N ALA A 117 9.586 3.851 0.369 1.00 0.00 N ATOM 936 CA ALA A 117 8.577 4.284 1.327 1.00 0.00 C ATOM 937 C ALA A 117 7.198 3.796 0.895 1.00 0.00 C ATOM 938 O ALA A 117 6.499 3.126 1.654 1.00 0.00 O ATOM 939 CB ALA A 117 8.577 5.808 1.428 1.00 0.00 C ATOM 0 H ALA A 117 10.112 4.608 -0.068 1.00 0.00 H new ATOM 0 HA ALA A 117 8.813 3.859 2.303 1.00 0.00 H new ATOM 0 HB1 ALA A 117 7.820 6.125 2.146 1.00 0.00 H new ATOM 0 HB2 ALA A 117 9.557 6.151 1.759 1.00 0.00 H new ATOM 0 HB3 ALA A 117 8.353 6.237 0.451 1.00 0.00 H new ATOM 945 N CYS A 118 6.821 4.133 -0.331 1.00 0.00 N ATOM 946 CA CYS A 118 5.528 3.721 -0.865 1.00 0.00 C ATOM 947 C CYS A 118 5.304 2.230 -0.627 1.00 0.00 C ATOM 948 O CYS A 118 4.299 1.824 -0.038 1.00 0.00 O ATOM 949 CB CYS A 118 5.476 4.008 -2.366 1.00 0.00 C ATOM 950 SG CYS A 118 5.427 5.796 -2.637 1.00 0.00 S ATOM 0 H CYS A 118 7.388 4.688 -0.972 1.00 0.00 H new ATOM 0 HA CYS A 118 4.745 4.283 -0.355 1.00 0.00 H new ATOM 0 HB2 CYS A 118 6.348 3.578 -2.860 1.00 0.00 H new ATOM 0 HB3 CYS A 118 4.597 3.538 -2.807 1.00 0.00 H new ATOM 0 HG CYS A 118 5.385 6.040 -3.913 1.00 0.00 H new ATOM 956 N ARG A 119 6.249 1.421 -1.089 1.00 0.00 N ATOM 957 CA ARG A 119 6.154 -0.024 -0.926 1.00 0.00 C ATOM 958 C ARG A 119 5.881 -0.381 0.532 1.00 0.00 C ATOM 959 O ARG A 119 5.016 -1.207 0.826 1.00 0.00 O ATOM 960 CB ARG A 119 7.457 -0.684 -1.384 1.00 0.00 C ATOM 961 CG ARG A 119 7.463 -0.808 -2.911 1.00 0.00 C ATOM 962 CD ARG A 119 8.777 -1.446 -3.371 1.00 0.00 C ATOM 963 NE ARG A 119 9.069 -1.060 -4.747 1.00 0.00 N ATOM 964 CZ ARG A 119 8.308 -1.474 -5.754 1.00 0.00 C ATOM 965 NH1 ARG A 119 7.279 -2.244 -5.522 1.00 0.00 N ATOM 966 NH2 ARG A 119 8.589 -1.112 -6.977 1.00 0.00 N ATOM 0 H ARG A 119 7.086 1.739 -1.577 1.00 0.00 H new ATOM 0 HA ARG A 119 5.328 -0.390 -1.536 1.00 0.00 H new ATOM 0 HB2 ARG A 119 8.311 -0.093 -1.054 1.00 0.00 H new ATOM 0 HB3 ARG A 119 7.557 -1.669 -0.929 1.00 0.00 H new ATOM 0 HG2 ARG A 119 6.619 -1.414 -3.240 1.00 0.00 H new ATOM 0 HG3 ARG A 119 7.346 0.176 -3.366 1.00 0.00 H new ATOM 0 HD2 ARG A 119 9.591 -1.132 -2.717 1.00 0.00 H new ATOM 0 HD3 ARG A 119 8.709 -2.531 -3.297 1.00 0.00 H new ATOM 0 HE ARG A 119 9.872 -0.461 -4.939 1.00 0.00 H new ATOM 0 HH11 ARG A 119 7.059 -2.528 -4.567 1.00 0.00 H new ATOM 0 HH12 ARG A 119 6.695 -2.562 -6.296 1.00 0.00 H new ATOM 0 HH21 ARG A 119 9.393 -0.511 -7.159 1.00 0.00 H new ATOM 0 HH22 ARG A 119 8.005 -1.430 -7.750 1.00 0.00 H new ATOM 980 N GLU A 120 6.622 0.243 1.442 1.00 0.00 N ATOM 981 CA GLU A 120 6.447 -0.024 2.864 1.00 0.00 C ATOM 982 C GLU A 120 5.022 0.302 3.301 1.00 0.00 C ATOM 983 O GLU A 120 4.388 -0.478 4.013 1.00 0.00 O ATOM 984 CB GLU A 120 7.438 0.806 3.681 1.00 0.00 C ATOM 985 CG GLU A 120 8.859 0.286 3.448 1.00 0.00 C ATOM 986 CD GLU A 120 9.073 -1.009 4.226 1.00 0.00 C ATOM 987 OE1 GLU A 120 8.787 -2.059 3.677 1.00 0.00 O ATOM 988 OE2 GLU A 120 9.521 -0.930 5.357 1.00 0.00 O ATOM 0 H GLU A 120 7.343 0.931 1.223 1.00 0.00 H new ATOM 0 HA GLU A 120 6.634 -1.084 3.039 1.00 0.00 H new ATOM 0 HB2 GLU A 120 7.372 1.855 3.394 1.00 0.00 H new ATOM 0 HB3 GLU A 120 7.188 0.749 4.741 1.00 0.00 H new ATOM 0 HG2 GLU A 120 9.022 0.112 2.384 1.00 0.00 H new ATOM 0 HG3 GLU A 120 9.586 1.034 3.764 1.00 0.00 H new ATOM 995 N GLU A 121 4.519 1.455 2.869 1.00 0.00 N ATOM 996 CA GLU A 121 3.167 1.860 3.225 1.00 0.00 C ATOM 997 C GLU A 121 2.176 0.756 2.866 1.00 0.00 C ATOM 998 O GLU A 121 1.322 0.393 3.674 1.00 0.00 O ATOM 999 CB GLU A 121 2.796 3.157 2.496 1.00 0.00 C ATOM 1000 CG GLU A 121 3.297 4.363 3.292 1.00 0.00 C ATOM 1001 CD GLU A 121 4.819 4.323 3.398 1.00 0.00 C ATOM 1002 OE1 GLU A 121 5.316 3.569 4.218 1.00 0.00 O ATOM 1003 OE2 GLU A 121 5.462 5.048 2.657 1.00 0.00 O ATOM 0 H GLU A 121 5.022 2.117 2.279 1.00 0.00 H new ATOM 0 HA GLU A 121 3.125 2.035 4.300 1.00 0.00 H new ATOM 0 HB2 GLU A 121 3.234 3.162 1.498 1.00 0.00 H new ATOM 0 HB3 GLU A 121 1.715 3.217 2.370 1.00 0.00 H new ATOM 0 HG2 GLU A 121 2.982 5.286 2.806 1.00 0.00 H new ATOM 0 HG3 GLU A 121 2.855 4.361 4.288 1.00 0.00 H new ATOM 1010 N PHE A 122 2.300 0.221 1.654 1.00 0.00 N ATOM 1011 CA PHE A 122 1.408 -0.849 1.219 1.00 0.00 C ATOM 1012 C PHE A 122 1.521 -2.043 2.162 1.00 0.00 C ATOM 1013 O PHE A 122 0.538 -2.455 2.776 1.00 0.00 O ATOM 1014 CB PHE A 122 1.757 -1.303 -0.204 1.00 0.00 C ATOM 1015 CG PHE A 122 1.490 -0.202 -1.214 1.00 0.00 C ATOM 1016 CD1 PHE A 122 0.376 0.644 -1.087 1.00 0.00 C ATOM 1017 CD2 PHE A 122 2.363 -0.038 -2.295 1.00 0.00 C ATOM 1018 CE1 PHE A 122 0.143 1.644 -2.038 1.00 0.00 C ATOM 1019 CE2 PHE A 122 2.129 0.963 -3.245 1.00 0.00 C ATOM 1020 CZ PHE A 122 1.020 1.803 -3.118 1.00 0.00 C ATOM 0 H PHE A 122 2.997 0.505 0.966 1.00 0.00 H new ATOM 0 HA PHE A 122 0.389 -0.463 1.232 1.00 0.00 H new ATOM 0 HB2 PHE A 122 2.807 -1.594 -0.248 1.00 0.00 H new ATOM 0 HB3 PHE A 122 1.171 -2.185 -0.461 1.00 0.00 H new ATOM 0 HD1 PHE A 122 -0.301 0.523 -0.255 1.00 0.00 H new ATOM 0 HD2 PHE A 122 3.221 -0.686 -2.397 1.00 0.00 H new ATOM 0 HE1 PHE A 122 -0.714 2.294 -1.939 1.00 0.00 H new ATOM 0 HE2 PHE A 122 2.806 1.086 -4.077 1.00 0.00 H new ATOM 0 HZ PHE A 122 0.839 2.574 -3.852 1.00 0.00 H new ATOM 1030 N HIS A 123 2.728 -2.589 2.273 1.00 0.00 N ATOM 1031 CA HIS A 123 2.964 -3.736 3.144 1.00 0.00 C ATOM 1032 C HIS A 123 2.187 -3.588 4.447 1.00 0.00 C ATOM 1033 O HIS A 123 1.560 -4.536 4.920 1.00 0.00 O ATOM 1034 CB HIS A 123 4.457 -3.860 3.450 1.00 0.00 C ATOM 1035 CG HIS A 123 4.682 -4.987 4.419 1.00 0.00 C ATOM 1036 ND1 HIS A 123 4.220 -6.271 4.180 1.00 0.00 N ATOM 1037 CD2 HIS A 123 5.318 -5.037 5.635 1.00 0.00 C ATOM 1038 CE1 HIS A 123 4.580 -7.035 5.228 1.00 0.00 C ATOM 1039 NE2 HIS A 123 5.253 -6.332 6.143 1.00 0.00 N ATOM 0 H HIS A 123 3.554 -2.258 1.774 1.00 0.00 H new ATOM 0 HA HIS A 123 2.622 -4.635 2.631 1.00 0.00 H new ATOM 0 HB2 HIS A 123 5.013 -4.042 2.530 1.00 0.00 H new ATOM 0 HB3 HIS A 123 4.831 -2.926 3.870 1.00 0.00 H new ATOM 0 HD2 HIS A 123 5.796 -4.200 6.123 1.00 0.00 H new ATOM 0 HE1 HIS A 123 4.353 -8.087 5.318 1.00 0.00 H new ATOM 0 HE2 HIS A 123 5.637 -6.671 7.025 1.00 0.00 H new ATOM 1047 N ARG A 124 2.233 -2.391 5.020 1.00 0.00 N ATOM 1048 CA ARG A 124 1.530 -2.128 6.269 1.00 0.00 C ATOM 1049 C ARG A 124 0.022 -2.257 6.076 1.00 0.00 C ATOM 1050 O ARG A 124 -0.626 -3.079 6.722 1.00 0.00 O ATOM 1051 CB ARG A 124 1.864 -0.723 6.773 1.00 0.00 C ATOM 1052 CG ARG A 124 3.320 -0.680 7.241 1.00 0.00 C ATOM 1053 CD ARG A 124 3.763 0.775 7.400 1.00 0.00 C ATOM 1054 NE ARG A 124 2.698 1.564 8.007 1.00 0.00 N ATOM 1055 CZ ARG A 124 2.901 2.825 8.378 1.00 0.00 C ATOM 1056 NH1 ARG A 124 4.071 3.377 8.201 1.00 0.00 N ATOM 1057 NH2 ARG A 124 1.932 3.510 8.920 1.00 0.00 N ATOM 0 H ARG A 124 2.745 -1.593 4.643 1.00 0.00 H new ATOM 0 HA ARG A 124 1.854 -2.864 7.005 1.00 0.00 H new ATOM 0 HB2 ARG A 124 1.705 0.007 5.979 1.00 0.00 H new ATOM 0 HB3 ARG A 124 1.199 -0.452 7.593 1.00 0.00 H new ATOM 0 HG2 ARG A 124 3.424 -1.208 8.189 1.00 0.00 H new ATOM 0 HG3 ARG A 124 3.960 -1.189 6.520 1.00 0.00 H new ATOM 0 HD2 ARG A 124 4.659 0.824 8.019 1.00 0.00 H new ATOM 0 HD3 ARG A 124 4.024 1.191 6.427 1.00 0.00 H new ATOM 0 HE ARG A 124 1.781 1.141 8.150 1.00 0.00 H new ATOM 0 HH11 ARG A 124 4.829 2.841 7.778 1.00 0.00 H new ATOM 0 HH12 ARG A 124 4.227 4.344 8.485 1.00 0.00 H new ATOM 0 HH21 ARG A 124 1.018 3.079 9.059 1.00 0.00 H new ATOM 0 HH22 ARG A 124 2.088 4.477 9.204 1.00 0.00 H new ATOM 1071 N ARG A 125 -0.530 -1.442 5.187 1.00 0.00 N ATOM 1072 CA ARG A 125 -1.965 -1.476 4.925 1.00 0.00 C ATOM 1073 C ARG A 125 -2.413 -2.886 4.544 1.00 0.00 C ATOM 1074 O ARG A 125 -3.591 -3.223 4.662 1.00 0.00 O ATOM 1075 CB ARG A 125 -2.311 -0.505 3.794 1.00 0.00 C ATOM 1076 CG ARG A 125 -2.237 0.933 4.314 1.00 0.00 C ATOM 1077 CD ARG A 125 -2.331 1.909 3.141 1.00 0.00 C ATOM 1078 NE ARG A 125 -1.054 1.980 2.441 1.00 0.00 N ATOM 1079 CZ ARG A 125 -0.950 2.585 1.262 1.00 0.00 C ATOM 1080 NH1 ARG A 125 -2.003 3.124 0.711 1.00 0.00 N ATOM 1081 NH2 ARG A 125 0.203 2.638 0.657 1.00 0.00 N ATOM 0 H ARG A 125 -0.013 -0.755 4.639 1.00 0.00 H new ATOM 0 HA ARG A 125 -2.487 -1.178 5.834 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -1.619 -0.638 2.962 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -3.311 -0.714 3.414 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -3.047 1.117 5.019 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -1.303 1.087 4.854 1.00 0.00 H new ATOM 0 HD2 ARG A 125 -3.113 1.588 2.453 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -2.611 2.898 3.503 1.00 0.00 H new ATOM 0 HE ARG A 125 -0.227 1.558 2.863 1.00 0.00 H new ATOM 0 HH11 ARG A 125 -2.905 3.081 1.185 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -1.924 3.588 -0.194 1.00 0.00 H new ATOM 0 HH21 ARG A 125 1.025 2.215 1.088 1.00 0.00 H new ATOM 0 HH22 ARG A 125 0.283 3.102 -0.248 1.00 0.00 H new ATOM 1095 N LEU A 126 -1.470 -3.702 4.084 1.00 0.00 N ATOM 1096 CA LEU A 126 -1.789 -5.069 3.686 1.00 0.00 C ATOM 1097 C LEU A 126 -1.965 -5.960 4.914 1.00 0.00 C ATOM 1098 O LEU A 126 -3.079 -6.386 5.224 1.00 0.00 O ATOM 1099 CB LEU A 126 -0.672 -5.632 2.787 1.00 0.00 C ATOM 1100 CG LEU A 126 -1.034 -5.476 1.298 1.00 0.00 C ATOM 1101 CD1 LEU A 126 -2.322 -6.250 0.978 1.00 0.00 C ATOM 1102 CD2 LEU A 126 -1.221 -3.990 0.956 1.00 0.00 C ATOM 0 H LEU A 126 -0.489 -3.445 3.978 1.00 0.00 H new ATOM 0 HA LEU A 126 -2.726 -5.056 3.129 1.00 0.00 H new ATOM 0 HB2 LEU A 126 0.264 -5.113 2.994 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -0.510 -6.685 3.018 1.00 0.00 H new ATOM 0 HG LEU A 126 -0.221 -5.882 0.697 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -2.565 -6.131 -0.078 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -2.176 -7.307 1.199 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -3.140 -5.862 1.585 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -1.477 -3.889 -0.099 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -2.024 -3.575 1.565 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -0.296 -3.451 1.158 1.00 0.00 H new ATOM 1114 N LYS A 127 -0.867 -6.246 5.608 1.00 0.00 N ATOM 1115 CA LYS A 127 -0.934 -7.096 6.792 1.00 0.00 C ATOM 1116 C LYS A 127 -2.070 -6.645 7.709 1.00 0.00 C ATOM 1117 O LYS A 127 -2.686 -7.461 8.396 1.00 0.00 O ATOM 1118 CB LYS A 127 0.404 -7.069 7.546 1.00 0.00 C ATOM 1119 CG LYS A 127 0.572 -5.737 8.298 1.00 0.00 C ATOM 1120 CD LYS A 127 0.182 -5.912 9.773 1.00 0.00 C ATOM 1121 CE LYS A 127 1.371 -6.474 10.557 1.00 0.00 C ATOM 1122 NZ LYS A 127 2.353 -5.382 10.818 1.00 0.00 N ATOM 0 H LYS A 127 0.067 -5.907 5.376 1.00 0.00 H new ATOM 0 HA LYS A 127 -1.132 -8.119 6.473 1.00 0.00 H new ATOM 0 HB2 LYS A 127 0.448 -7.899 8.251 1.00 0.00 H new ATOM 0 HB3 LYS A 127 1.227 -7.203 6.844 1.00 0.00 H new ATOM 0 HG2 LYS A 127 1.605 -5.397 8.225 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -0.050 -4.969 7.838 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -0.124 -4.955 10.194 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -0.672 -6.585 9.856 1.00 0.00 H new ATOM 0 HE2 LYS A 127 1.029 -6.904 11.499 1.00 0.00 H new ATOM 0 HE3 LYS A 127 1.845 -7.278 9.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 3.013 -5.680 11.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 2.884 -5.177 9.948 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 1.847 -4.526 11.124 1.00 0.00 H new ATOM 1136 N VAL A 128 -2.350 -5.346 7.706 1.00 0.00 N ATOM 1137 CA VAL A 128 -3.422 -4.804 8.533 1.00 0.00 C ATOM 1138 C VAL A 128 -4.777 -5.161 7.934 1.00 0.00 C ATOM 1139 O VAL A 128 -5.690 -5.583 8.642 1.00 0.00 O ATOM 1140 CB VAL A 128 -3.288 -3.283 8.639 1.00 0.00 C ATOM 1141 CG1 VAL A 128 -4.538 -2.700 9.303 1.00 0.00 C ATOM 1142 CG2 VAL A 128 -2.060 -2.939 9.483 1.00 0.00 C ATOM 0 H VAL A 128 -1.854 -4.654 7.145 1.00 0.00 H new ATOM 0 HA VAL A 128 -3.348 -5.238 9.530 1.00 0.00 H new ATOM 0 HB VAL A 128 -3.178 -2.860 7.640 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -4.439 -1.617 9.377 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -5.416 -2.944 8.704 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -4.651 -3.123 10.301 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -1.963 -1.856 9.560 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -2.173 -3.365 10.480 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -1.168 -3.351 9.012 1.00 0.00 H new ATOM 1152 N TYR A 129 -4.898 -4.990 6.621 1.00 0.00 N ATOM 1153 CA TYR A 129 -6.143 -5.300 5.931 1.00 0.00 C ATOM 1154 C TYR A 129 -6.471 -6.785 6.071 1.00 0.00 C ATOM 1155 O TYR A 129 -7.630 -7.162 6.249 1.00 0.00 O ATOM 1156 CB TYR A 129 -6.015 -4.926 4.449 1.00 0.00 C ATOM 1157 CG TYR A 129 -7.055 -5.661 3.633 1.00 0.00 C ATOM 1158 CD1 TYR A 129 -8.414 -5.529 3.945 1.00 0.00 C ATOM 1159 CD2 TYR A 129 -6.661 -6.475 2.563 1.00 0.00 C ATOM 1160 CE1 TYR A 129 -9.376 -6.209 3.189 1.00 0.00 C ATOM 1161 CE2 TYR A 129 -7.621 -7.155 1.807 1.00 0.00 C ATOM 1162 CZ TYR A 129 -8.980 -7.021 2.118 1.00 0.00 C ATOM 1163 OH TYR A 129 -9.928 -7.691 1.373 1.00 0.00 O ATOM 0 H TYR A 129 -4.153 -4.641 6.018 1.00 0.00 H new ATOM 0 HA TYR A 129 -6.952 -4.723 6.379 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -6.139 -3.850 4.326 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -5.017 -5.175 4.089 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -8.720 -4.902 4.769 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -5.613 -6.578 2.321 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -10.424 -6.108 3.431 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -7.315 -7.783 0.984 1.00 0.00 H new ATOM 0 HH TYR A 129 -9.523 -8.011 0.540 1.00 0.00 H new ATOM 1173 N HIS A 130 -5.442 -7.623 5.995 1.00 0.00 N ATOM 1174 CA HIS A 130 -5.632 -9.063 6.118 1.00 0.00 C ATOM 1175 C HIS A 130 -5.944 -9.439 7.563 1.00 0.00 C ATOM 1176 O HIS A 130 -6.729 -10.351 7.821 1.00 0.00 O ATOM 1177 CB HIS A 130 -4.370 -9.800 5.656 1.00 0.00 C ATOM 1178 CG HIS A 130 -4.309 -9.802 4.153 1.00 0.00 C ATOM 1179 ND1 HIS A 130 -4.545 -10.945 3.405 1.00 0.00 N ATOM 1180 CD2 HIS A 130 -4.042 -8.808 3.244 1.00 0.00 C ATOM 1181 CE1 HIS A 130 -4.416 -10.615 2.108 1.00 0.00 C ATOM 1182 NE2 HIS A 130 -4.109 -9.324 1.953 1.00 0.00 N ATOM 0 H HIS A 130 -4.475 -7.332 5.850 1.00 0.00 H new ATOM 0 HA HIS A 130 -6.472 -9.355 5.488 1.00 0.00 H new ATOM 0 HB2 HIS A 130 -3.483 -9.316 6.065 1.00 0.00 H new ATOM 0 HB3 HIS A 130 -4.376 -10.823 6.031 1.00 0.00 H new ATOM 0 HD2 HIS A 130 -3.815 -7.782 3.493 1.00 0.00 H new ATOM 0 HE1 HIS A 130 -4.545 -11.309 1.291 1.00 0.00 H new ATOM 0 HE2 HIS A 130 -3.957 -8.824 1.077 1.00 0.00 H new ATOM 1190 N ALA A 131 -5.328 -8.727 8.500 1.00 0.00 N ATOM 1191 CA ALA A 131 -5.551 -8.995 9.917 1.00 0.00 C ATOM 1192 C ALA A 131 -6.964 -8.585 10.314 1.00 0.00 C ATOM 1193 O ALA A 131 -7.738 -9.395 10.825 1.00 0.00 O ATOM 1194 CB ALA A 131 -4.537 -8.223 10.763 1.00 0.00 C ATOM 0 H ALA A 131 -4.676 -7.967 8.308 1.00 0.00 H new ATOM 0 HA ALA A 131 -5.427 -10.064 10.093 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -4.712 -8.430 11.819 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -3.527 -8.534 10.495 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.648 -7.154 10.579 1.00 0.00 H new ATOM 1200 N TRP A 132 -7.296 -7.322 10.071 1.00 0.00 N ATOM 1201 CA TRP A 132 -8.619 -6.811 10.401 1.00 0.00 C ATOM 1202 C TRP A 132 -9.691 -7.597 9.649 1.00 0.00 C ATOM 1203 O TRP A 132 -10.786 -7.820 10.164 1.00 0.00 O ATOM 1204 CB TRP A 132 -8.702 -5.322 10.042 1.00 0.00 C ATOM 1205 CG TRP A 132 -10.130 -4.919 9.853 1.00 0.00 C ATOM 1206 CD1 TRP A 132 -10.902 -4.321 10.787 1.00 0.00 C ATOM 1207 CD2 TRP A 132 -10.964 -5.075 8.669 1.00 0.00 C ATOM 1208 NE1 TRP A 132 -12.160 -4.101 10.254 1.00 0.00 N ATOM 1209 CE2 TRP A 132 -12.247 -4.549 8.951 1.00 0.00 C ATOM 1210 CE3 TRP A 132 -10.733 -5.618 7.393 1.00 0.00 C ATOM 1211 CZ2 TRP A 132 -13.266 -4.560 7.997 1.00 0.00 C ATOM 1212 CZ3 TRP A 132 -11.757 -5.631 6.432 1.00 0.00 C ATOM 1213 CH2 TRP A 132 -13.021 -5.103 6.733 1.00 0.00 C ATOM 0 H TRP A 132 -6.670 -6.637 9.649 1.00 0.00 H new ATOM 0 HA TRP A 132 -8.790 -6.929 11.471 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -8.248 -4.723 10.832 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -8.137 -5.127 9.130 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -10.588 -4.058 11.786 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -12.928 -3.662 10.761 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -9.763 -6.027 7.151 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -14.237 -4.152 8.234 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -11.570 -6.050 5.455 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -13.804 -5.116 5.989 1.00 0.00 H new ATOM 1224 N LYS A 133 -9.368 -8.015 8.428 1.00 0.00 N ATOM 1225 CA LYS A 133 -10.309 -8.775 7.619 1.00 0.00 C ATOM 1226 C LYS A 133 -10.507 -10.173 8.197 1.00 0.00 C ATOM 1227 O LYS A 133 -11.602 -10.731 8.139 1.00 0.00 O ATOM 1228 CB LYS A 133 -9.790 -8.878 6.188 1.00 0.00 C ATOM 1229 CG LYS A 133 -10.691 -9.821 5.383 1.00 0.00 C ATOM 1230 CD LYS A 133 -10.553 -9.514 3.885 1.00 0.00 C ATOM 1231 CE LYS A 133 -10.488 -10.821 3.097 1.00 0.00 C ATOM 1232 NZ LYS A 133 -10.725 -10.546 1.652 1.00 0.00 N ATOM 0 H LYS A 133 -8.468 -7.841 7.982 1.00 0.00 H new ATOM 0 HA LYS A 133 -11.269 -8.258 7.623 1.00 0.00 H new ATOM 0 HB2 LYS A 133 -9.772 -7.892 5.725 1.00 0.00 H new ATOM 0 HB3 LYS A 133 -8.765 -9.249 6.188 1.00 0.00 H new ATOM 0 HG2 LYS A 133 -10.416 -10.857 5.579 1.00 0.00 H new ATOM 0 HG3 LYS A 133 -11.729 -9.702 5.694 1.00 0.00 H new ATOM 0 HD2 LYS A 133 -11.399 -8.916 3.547 1.00 0.00 H new ATOM 0 HD3 LYS A 133 -9.654 -8.925 3.706 1.00 0.00 H new ATOM 0 HE2 LYS A 133 -9.514 -11.291 3.233 1.00 0.00 H new ATOM 0 HE3 LYS A 133 -11.235 -11.521 3.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 -10.146 -11.191 1.076 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 -11.731 -10.693 1.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 -10.464 -9.562 1.438 1.00 0.00 H new ATOM 1246 N SER A 134 -9.438 -10.732 8.756 1.00 0.00 N ATOM 1247 CA SER A 134 -9.506 -12.064 9.346 1.00 0.00 C ATOM 1248 C SER A 134 -10.348 -12.038 10.615 1.00 0.00 C ATOM 1249 O SER A 134 -11.074 -12.986 10.913 1.00 0.00 O ATOM 1250 CB SER A 134 -8.099 -12.559 9.677 1.00 0.00 C ATOM 1251 OG SER A 134 -8.140 -13.959 9.920 1.00 0.00 O ATOM 0 H SER A 134 -8.522 -10.288 8.813 1.00 0.00 H new ATOM 0 HA SER A 134 -9.968 -12.740 8.627 1.00 0.00 H new ATOM 0 HB2 SER A 134 -7.421 -12.341 8.852 1.00 0.00 H new ATOM 0 HB3 SER A 134 -7.714 -12.037 10.553 1.00 0.00 H new ATOM 0 HG SER A 134 -7.239 -14.281 10.131 1.00 0.00 H new ATOM 1257 N LYS A 135 -10.242 -10.944 11.359 1.00 0.00 N ATOM 1258 CA LYS A 135 -10.993 -10.794 12.599 1.00 0.00 C ATOM 1259 C LYS A 135 -12.425 -10.354 12.307 1.00 0.00 C ATOM 1260 O LYS A 135 -13.337 -10.621 13.090 1.00 0.00 O ATOM 1261 CB LYS A 135 -10.309 -9.760 13.493 1.00 0.00 C ATOM 1262 CG LYS A 135 -9.010 -10.348 14.050 1.00 0.00 C ATOM 1263 CD LYS A 135 -8.216 -9.255 14.770 1.00 0.00 C ATOM 1264 CE LYS A 135 -6.773 -9.721 14.970 1.00 0.00 C ATOM 1265 NZ LYS A 135 -6.759 -10.961 15.796 1.00 0.00 N ATOM 0 H LYS A 135 -9.645 -10.150 11.126 1.00 0.00 H new ATOM 0 HA LYS A 135 -11.020 -11.757 13.110 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -10.097 -8.855 12.924 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -10.972 -9.475 14.310 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -9.234 -11.162 14.739 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -8.414 -10.770 13.241 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -8.235 -8.334 14.188 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -8.674 -9.032 15.734 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -6.304 -9.910 14.004 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -6.192 -8.939 15.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -5.798 -11.126 16.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -7.416 -10.853 16.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -7.053 -11.770 15.212 1.00 0.00 H new ATOM 1279 N ASN A 136 -12.613 -9.679 11.176 1.00 0.00 N ATOM 1280 CA ASN A 136 -13.939 -9.204 10.784 1.00 0.00 C ATOM 1281 C ASN A 136 -14.431 -9.952 9.551 1.00 0.00 C ATOM 1282 O ASN A 136 -15.077 -9.373 8.678 1.00 0.00 O ATOM 1283 CB ASN A 136 -13.887 -7.703 10.485 1.00 0.00 C ATOM 1284 CG ASN A 136 -13.643 -6.924 11.773 1.00 0.00 C ATOM 1285 OD1 ASN A 136 -14.570 -6.709 12.555 1.00 0.00 O ATOM 1286 ND2 ASN A 136 -12.444 -6.483 12.041 1.00 0.00 N ATOM 0 H ASN A 136 -11.869 -9.449 10.517 1.00 0.00 H new ATOM 0 HA ASN A 136 -14.630 -9.388 11.607 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -13.093 -7.494 9.768 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -14.823 -7.382 10.028 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -12.273 -5.959 12.899 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -11.678 -6.662 11.392 1.00 0.00 H new ATOM 1293 N LYS A 137 -14.124 -11.243 9.486 1.00 0.00 N ATOM 1294 CA LYS A 137 -14.540 -12.062 8.352 1.00 0.00 C ATOM 1295 C LYS A 137 -16.006 -12.462 8.489 1.00 0.00 C ATOM 1296 O LYS A 137 -16.734 -12.539 7.499 1.00 0.00 O ATOM 1297 CB LYS A 137 -13.672 -13.318 8.268 1.00 0.00 C ATOM 1298 CG LYS A 137 -13.890 -14.173 9.519 1.00 0.00 C ATOM 1299 CD LYS A 137 -12.865 -15.308 9.548 1.00 0.00 C ATOM 1300 CE LYS A 137 -13.282 -16.348 10.588 1.00 0.00 C ATOM 1301 NZ LYS A 137 -13.464 -15.683 11.911 1.00 0.00 N ATOM 0 H LYS A 137 -13.593 -11.743 10.199 1.00 0.00 H new ATOM 0 HA LYS A 137 -14.419 -11.476 7.441 1.00 0.00 H new ATOM 0 HB2 LYS A 137 -13.926 -13.889 7.375 1.00 0.00 H new ATOM 0 HB3 LYS A 137 -12.621 -13.042 8.182 1.00 0.00 H new ATOM 0 HG2 LYS A 137 -13.793 -13.558 10.414 1.00 0.00 H new ATOM 0 HG3 LYS A 137 -14.901 -14.582 9.521 1.00 0.00 H new ATOM 0 HD2 LYS A 137 -12.792 -15.771 8.564 1.00 0.00 H new ATOM 0 HD3 LYS A 137 -11.878 -14.914 9.788 1.00 0.00 H new ATOM 0 HE2 LYS A 137 -14.209 -16.833 10.282 1.00 0.00 H new ATOM 0 HE3 LYS A 137 -12.524 -17.128 10.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 -13.445 -16.399 12.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 -12.696 -14.998 12.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 -14.378 -15.188 11.928 1.00 0.00 H new ATOM 1315 N LYS A 138 -16.431 -12.715 9.723 1.00 0.00 N ATOM 1316 CA LYS A 138 -17.813 -13.107 9.977 1.00 0.00 C ATOM 1317 C LYS A 138 -18.774 -12.024 9.501 1.00 0.00 C ATOM 1318 O LYS A 138 -18.379 -10.878 9.287 1.00 0.00 O ATOM 1319 CB LYS A 138 -18.018 -13.353 11.474 1.00 0.00 C ATOM 1320 CG LYS A 138 -19.452 -13.833 11.723 1.00 0.00 C ATOM 1321 CD LYS A 138 -19.543 -14.475 13.108 1.00 0.00 C ATOM 1322 CE LYS A 138 -19.205 -13.434 14.178 1.00 0.00 C ATOM 1323 NZ LYS A 138 -19.648 -13.929 15.512 1.00 0.00 N ATOM 0 H LYS A 138 -15.845 -12.656 10.556 1.00 0.00 H new ATOM 0 HA LYS A 138 -18.018 -14.025 9.426 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -17.307 -14.098 11.831 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -17.828 -12.437 12.033 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -20.145 -12.994 11.653 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -19.744 -14.552 10.958 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -20.546 -14.868 13.273 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -18.855 -15.318 13.176 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -18.132 -13.242 14.188 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -19.696 -12.488 13.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -19.418 -13.221 16.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -20.675 -14.091 15.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -19.160 -14.821 15.731 1.00 0.00 H new ATOM 1337 N ARG A 139 -20.041 -12.396 9.334 1.00 0.00 N ATOM 1338 CA ARG A 139 -21.052 -11.447 8.880 1.00 0.00 C ATOM 1339 C ARG A 139 -20.923 -10.125 9.630 1.00 0.00 C ATOM 1340 O ARG A 139 -20.895 -10.158 10.848 1.00 0.00 O ATOM 1341 CB ARG A 139 -22.449 -12.032 9.102 1.00 0.00 C ATOM 1342 CG ARG A 139 -22.442 -13.522 8.755 1.00 0.00 C ATOM 1343 CD ARG A 139 -23.882 -14.025 8.624 1.00 0.00 C ATOM 1344 NE ARG A 139 -23.923 -15.477 8.759 1.00 0.00 N ATOM 1345 CZ ARG A 139 -23.393 -16.269 7.832 1.00 0.00 C ATOM 1346 NH1 ARG A 139 -22.825 -15.751 6.777 1.00 0.00 N ATOM 1347 NH2 ARG A 139 -23.441 -17.566 7.977 1.00 0.00 N ATOM 1348 OXT ARG A 139 -20.854 -9.099 8.973 1.00 0.00 O ATOM 0 H ARG A 139 -20.389 -13.339 9.505 1.00 0.00 H new ATOM 0 HA ARG A 139 -20.900 -11.261 7.817 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -22.753 -11.891 10.139 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -23.177 -11.507 8.483 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -21.902 -13.686 7.822 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -21.919 -14.084 9.529 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -24.507 -13.564 9.389 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -24.291 -13.731 7.658 1.00 0.00 H new ATOM 0 HE ARG A 139 -24.366 -15.892 9.579 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -22.788 -14.738 6.663 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -22.419 -16.359 6.066 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -23.885 -17.971 8.801 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -23.035 -18.174 7.266 1.00 0.00 H new TER 1362 ARG A 139