USER MOD reduce.3.24.130724 H: found=0, std=0, add=797, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 794 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 41:sc= 0.32 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= -0.533 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl -115:sc= -2.8 (180deg=-4.81!) USER MOD Single : A 16 LYS NZ :NH3+ 143:sc= -0.712 (180deg=-2.24!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ -147:sc= 0.299 (180deg=-0.952) USER MOD Single : A 26 ASN : amide:sc= -0.599 X(o=-0.6,f=-0.99) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc=-0.00871 K(o=-0.0087,f=-1) USER MOD Single : A 36 HIS : no HD1:sc= -0.365 X(o=-0.36,f=-0.66) USER MOD Single : A 37 CYS SG : rot -10:sc= -4.2! USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 SER OG : rot 180:sc= -0.808! USER MOD Single : A 49 SER OG : rot 160:sc= -2.36 USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -4.55! C(o=-4.6!,f=-8.9!) USER MOD Single : A 57 GLN : amide:sc= -1.22 K(o=-1.2,f=-4.3!) USER MOD Single : A 61 MET CE :methyl -155:sc= -1.25 (180deg=-2.71) USER MOD Single : A 63 SER OG : rot -145:sc= -0.0935 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= -0.0625 K(o=-0.063,f=-0.72) USER MOD Single : A 79 SER OG : rot -150:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= 0.00346 X(o=0.0035,f=0) USER MOD Single : A 89 ASN : amide:sc= -1.09 K(o=-1.1,f=-5.5!) USER MOD Single : A 94 SER OG : rot 180:sc= -0.26 USER MOD Single : A 99 TYR OH : rot 180:sc=-0.00677 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.722 -7.157 -1.996 1.00 0.00 N ATOM 2 CA GLY A 1 -17.188 -6.333 -0.893 1.00 0.00 C ATOM 3 C GLY A 1 -16.063 -6.072 0.110 1.00 0.00 C ATOM 4 O GLY A 1 -15.702 -6.955 0.886 1.00 0.00 O ATOM 0 H1 GLY A 1 -17.504 -7.320 -2.662 1.00 0.00 H new ATOM 0 H2 GLY A 1 -15.944 -6.672 -2.487 1.00 0.00 H new ATOM 0 H3 GLY A 1 -16.385 -8.070 -1.629 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -17.565 -5.385 -1.277 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -18.020 -6.827 -0.391 1.00 0.00 H new ATOM 8 N SER A 2 -15.540 -4.855 0.062 1.00 0.00 N ATOM 9 CA SER A 2 -14.464 -4.467 0.957 1.00 0.00 C ATOM 10 C SER A 2 -14.969 -4.438 2.401 1.00 0.00 C ATOM 11 O SER A 2 -15.530 -3.438 2.846 1.00 0.00 O ATOM 12 CB SER A 2 -13.889 -3.104 0.568 1.00 0.00 C ATOM 13 OG SER A 2 -14.863 -2.068 0.658 1.00 0.00 O ATOM 0 H SER A 2 -15.842 -4.125 -0.583 1.00 0.00 H new ATOM 0 HA SER A 2 -13.666 -5.205 0.873 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.047 -2.867 1.218 1.00 0.00 H new ATOM 0 HB3 SER A 2 -13.503 -3.151 -0.450 1.00 0.00 H new ATOM 0 HG SER A 2 -15.407 -2.200 1.462 1.00 0.00 H new ATOM 19 N SER A 3 -14.751 -5.547 3.093 1.00 0.00 N ATOM 20 CA SER A 3 -15.177 -5.661 4.477 1.00 0.00 C ATOM 21 C SER A 3 -14.008 -6.126 5.348 1.00 0.00 C ATOM 22 O SER A 3 -13.589 -7.280 5.266 1.00 0.00 O ATOM 23 CB SER A 3 -16.357 -6.625 4.613 1.00 0.00 C ATOM 24 OG SER A 3 -16.600 -6.983 5.971 1.00 0.00 O ATOM 0 H SER A 3 -14.285 -6.374 2.721 1.00 0.00 H new ATOM 0 HA SER A 3 -15.505 -4.678 4.815 1.00 0.00 H new ATOM 0 HB2 SER A 3 -17.252 -6.164 4.194 1.00 0.00 H new ATOM 0 HB3 SER A 3 -16.159 -7.525 4.031 1.00 0.00 H new ATOM 0 HG SER A 3 -17.362 -7.598 6.016 1.00 0.00 H new ATOM 30 N GLY A 4 -13.515 -5.204 6.162 1.00 0.00 N ATOM 31 CA GLY A 4 -12.403 -5.506 7.047 1.00 0.00 C ATOM 32 C GLY A 4 -11.699 -4.225 7.499 1.00 0.00 C ATOM 33 O GLY A 4 -12.335 -3.183 7.650 1.00 0.00 O ATOM 0 H GLY A 4 -13.865 -4.248 6.227 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -12.765 -6.053 7.918 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.692 -6.155 6.535 1.00 0.00 H new ATOM 37 N SER A 5 -10.395 -4.344 7.701 1.00 0.00 N ATOM 38 CA SER A 5 -9.597 -3.209 8.132 1.00 0.00 C ATOM 39 C SER A 5 -9.950 -1.975 7.299 1.00 0.00 C ATOM 40 O SER A 5 -9.967 -2.035 6.070 1.00 0.00 O ATOM 41 CB SER A 5 -8.102 -3.513 8.023 1.00 0.00 C ATOM 42 OG SER A 5 -7.407 -3.217 9.232 1.00 0.00 O ATOM 0 H SER A 5 -9.871 -5.210 7.574 1.00 0.00 H new ATOM 0 HA SER A 5 -9.824 -3.010 9.179 1.00 0.00 H new ATOM 0 HB2 SER A 5 -7.963 -4.565 7.773 1.00 0.00 H new ATOM 0 HB3 SER A 5 -7.673 -2.932 7.207 1.00 0.00 H new ATOM 0 HG SER A 5 -6.456 -3.426 9.122 1.00 0.00 H new ATOM 48 N SER A 6 -10.222 -0.884 8.001 1.00 0.00 N ATOM 49 CA SER A 6 -10.574 0.362 7.341 1.00 0.00 C ATOM 50 C SER A 6 -9.419 0.826 6.451 1.00 0.00 C ATOM 51 O SER A 6 -9.575 0.943 5.236 1.00 0.00 O ATOM 52 CB SER A 6 -10.925 1.445 8.362 1.00 0.00 C ATOM 53 OG SER A 6 -12.086 2.179 7.983 1.00 0.00 O ATOM 0 H SER A 6 -10.206 -0.837 9.020 1.00 0.00 H new ATOM 0 HA SER A 6 -11.454 0.185 6.722 1.00 0.00 H new ATOM 0 HB2 SER A 6 -11.089 0.985 9.337 1.00 0.00 H new ATOM 0 HB3 SER A 6 -10.083 2.129 8.470 1.00 0.00 H new ATOM 0 HG SER A 6 -12.278 2.860 8.661 1.00 0.00 H new ATOM 59 N GLY A 7 -8.286 1.078 7.089 1.00 0.00 N ATOM 60 CA GLY A 7 -7.106 1.527 6.370 1.00 0.00 C ATOM 61 C GLY A 7 -6.854 0.661 5.134 1.00 0.00 C ATOM 62 O GLY A 7 -6.912 1.149 4.007 1.00 0.00 O ATOM 0 H GLY A 7 -8.160 0.980 8.096 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -7.233 2.567 6.070 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -6.238 1.489 7.028 1.00 0.00 H new ATOM 66 N LEU A 8 -6.579 -0.610 5.388 1.00 0.00 N ATOM 67 CA LEU A 8 -6.318 -1.549 4.310 1.00 0.00 C ATOM 68 C LEU A 8 -7.456 -1.476 3.290 1.00 0.00 C ATOM 69 O LEU A 8 -7.224 -1.190 2.116 1.00 0.00 O ATOM 70 CB LEU A 8 -6.082 -2.954 4.869 1.00 0.00 C ATOM 71 CG LEU A 8 -4.936 -3.093 5.873 1.00 0.00 C ATOM 72 CD1 LEU A 8 -5.011 -4.433 6.608 1.00 0.00 C ATOM 73 CD2 LEU A 8 -3.582 -2.888 5.191 1.00 0.00 C ATOM 0 H LEU A 8 -6.531 -1.012 6.324 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.401 -1.282 3.785 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -7.001 -3.292 5.348 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -5.891 -3.628 4.034 1.00 0.00 H new ATOM 0 HG LEU A 8 -5.041 -2.308 6.622 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -4.185 -4.507 7.316 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -5.957 -4.501 7.146 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -4.945 -5.248 5.887 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -2.785 -2.992 5.927 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -3.453 -3.635 4.407 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.543 -1.891 4.752 1.00 0.00 H new ATOM 85 N GLY A 9 -8.661 -1.739 3.774 1.00 0.00 N ATOM 86 CA GLY A 9 -9.835 -1.707 2.919 1.00 0.00 C ATOM 87 C GLY A 9 -9.729 -0.584 1.885 1.00 0.00 C ATOM 88 O GLY A 9 -9.526 -0.844 0.700 1.00 0.00 O ATOM 0 H GLY A 9 -8.850 -1.975 4.748 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -9.946 -2.665 2.411 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -10.728 -1.564 3.527 1.00 0.00 H new ATOM 92 N ALA A 10 -9.871 0.640 2.371 1.00 0.00 N ATOM 93 CA ALA A 10 -9.794 1.803 1.504 1.00 0.00 C ATOM 94 C ALA A 10 -8.616 1.640 0.542 1.00 0.00 C ATOM 95 O ALA A 10 -8.740 1.916 -0.650 1.00 0.00 O ATOM 96 CB ALA A 10 -9.679 3.069 2.356 1.00 0.00 C ATOM 0 H ALA A 10 -10.039 0.852 3.355 1.00 0.00 H new ATOM 0 HA ALA A 10 -10.700 1.894 0.904 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -9.621 3.942 1.705 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -10.554 3.154 3.001 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -8.780 3.014 2.970 1.00 0.00 H new ATOM 102 N LEU A 11 -7.499 1.191 1.095 1.00 0.00 N ATOM 103 CA LEU A 11 -6.299 0.988 0.301 1.00 0.00 C ATOM 104 C LEU A 11 -6.587 -0.041 -0.795 1.00 0.00 C ATOM 105 O LEU A 11 -6.379 0.232 -1.976 1.00 0.00 O ATOM 106 CB LEU A 11 -5.118 0.615 1.200 1.00 0.00 C ATOM 107 CG LEU A 11 -4.243 -0.541 0.712 1.00 0.00 C ATOM 108 CD1 LEU A 11 -3.394 -0.117 -0.488 1.00 0.00 C ATOM 109 CD2 LEU A 11 -3.387 -1.100 1.850 1.00 0.00 C ATOM 0 H LEU A 11 -7.400 0.962 2.084 1.00 0.00 H new ATOM 0 HA LEU A 11 -6.010 1.914 -0.197 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -4.487 1.496 1.322 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.504 0.361 2.187 1.00 0.00 H new ATOM 0 HG LEU A 11 -4.897 -1.346 0.376 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.781 -0.957 -0.815 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -4.047 0.195 -1.303 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -2.748 0.713 -0.202 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -2.775 -1.920 1.476 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -2.741 -0.313 2.239 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -4.035 -1.465 2.647 1.00 0.00 H new ATOM 121 N TYR A 12 -7.060 -1.201 -0.364 1.00 0.00 N ATOM 122 CA TYR A 12 -7.378 -2.271 -1.293 1.00 0.00 C ATOM 123 C TYR A 12 -8.303 -1.774 -2.406 1.00 0.00 C ATOM 124 O TYR A 12 -8.083 -2.069 -3.579 1.00 0.00 O ATOM 125 CB TYR A 12 -8.110 -3.337 -0.475 1.00 0.00 C ATOM 126 CG TYR A 12 -8.691 -4.476 -1.315 1.00 0.00 C ATOM 127 CD1 TYR A 12 -7.902 -5.117 -2.248 1.00 0.00 C ATOM 128 CD2 TYR A 12 -10.004 -4.862 -1.140 1.00 0.00 C ATOM 129 CE1 TYR A 12 -8.448 -6.190 -3.039 1.00 0.00 C ATOM 130 CE2 TYR A 12 -10.551 -5.934 -1.930 1.00 0.00 C ATOM 131 CZ TYR A 12 -9.746 -6.545 -2.841 1.00 0.00 C ATOM 132 OH TYR A 12 -10.263 -7.558 -3.587 1.00 0.00 O ATOM 0 H TYR A 12 -7.231 -1.423 0.617 1.00 0.00 H new ATOM 0 HA TYR A 12 -6.472 -2.654 -1.762 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -7.420 -3.755 0.258 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -8.917 -2.862 0.082 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -6.874 -4.814 -2.385 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -10.622 -4.360 -0.410 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -7.841 -6.701 -3.772 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -11.577 -6.246 -1.802 1.00 0.00 H new ATOM 0 HH TYR A 12 -11.199 -7.703 -3.337 1.00 0.00 H new ATOM 142 N LEU A 13 -9.320 -1.029 -1.997 1.00 0.00 N ATOM 143 CA LEU A 13 -10.280 -0.488 -2.944 1.00 0.00 C ATOM 144 C LEU A 13 -9.533 0.266 -4.047 1.00 0.00 C ATOM 145 O LEU A 13 -9.917 0.207 -5.214 1.00 0.00 O ATOM 146 CB LEU A 13 -11.327 0.360 -2.221 1.00 0.00 C ATOM 147 CG LEU A 13 -12.443 -0.412 -1.514 1.00 0.00 C ATOM 148 CD1 LEU A 13 -13.305 0.525 -0.664 1.00 0.00 C ATOM 149 CD2 LEU A 13 -13.281 -1.207 -2.517 1.00 0.00 C ATOM 0 H LEU A 13 -9.500 -0.787 -1.022 1.00 0.00 H new ATOM 0 HA LEU A 13 -10.834 -1.293 -3.426 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -10.817 0.980 -1.483 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -11.782 1.036 -2.945 1.00 0.00 H new ATOM 0 HG LEU A 13 -11.983 -1.131 -0.836 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -14.090 -0.049 -0.172 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -12.683 1.008 0.090 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -13.756 1.284 -1.303 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -14.067 -1.746 -1.988 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -13.731 -0.524 -3.237 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -12.643 -1.918 -3.041 1.00 0.00 H new ATOM 161 N SER A 14 -8.479 0.957 -3.637 1.00 0.00 N ATOM 162 CA SER A 14 -7.675 1.721 -4.575 1.00 0.00 C ATOM 163 C SER A 14 -6.885 0.774 -5.480 1.00 0.00 C ATOM 164 O SER A 14 -6.812 0.983 -6.690 1.00 0.00 O ATOM 165 CB SER A 14 -6.725 2.670 -3.841 1.00 0.00 C ATOM 166 OG SER A 14 -7.100 4.035 -4.008 1.00 0.00 O ATOM 0 H SER A 14 -8.164 1.003 -2.668 1.00 0.00 H new ATOM 0 HA SER A 14 -8.345 2.324 -5.188 1.00 0.00 H new ATOM 0 HB2 SER A 14 -6.715 2.424 -2.779 1.00 0.00 H new ATOM 0 HB3 SER A 14 -5.710 2.525 -4.211 1.00 0.00 H new ATOM 0 HG SER A 14 -6.471 4.609 -3.523 1.00 0.00 H new ATOM 172 N MET A 15 -6.313 -0.247 -4.859 1.00 0.00 N ATOM 173 CA MET A 15 -5.530 -1.227 -5.593 1.00 0.00 C ATOM 174 C MET A 15 -6.331 -1.803 -6.762 1.00 0.00 C ATOM 175 O MET A 15 -5.758 -2.363 -7.696 1.00 0.00 O ATOM 176 CB MET A 15 -5.116 -2.359 -4.651 1.00 0.00 C ATOM 177 CG MET A 15 -4.120 -1.861 -3.601 1.00 0.00 C ATOM 178 SD MET A 15 -3.734 -3.175 -2.456 1.00 0.00 S ATOM 179 CE MET A 15 -1.964 -3.265 -2.673 1.00 0.00 C ATOM 0 H MET A 15 -6.376 -0.417 -3.855 1.00 0.00 H new ATOM 0 HA MET A 15 -4.644 -0.732 -5.992 1.00 0.00 H new ATOM 0 HB2 MET A 15 -5.998 -2.767 -4.157 1.00 0.00 H new ATOM 0 HB3 MET A 15 -4.669 -3.170 -5.226 1.00 0.00 H new ATOM 0 HG2 MET A 15 -3.209 -1.512 -4.088 1.00 0.00 H new ATOM 0 HG3 MET A 15 -4.540 -1.011 -3.064 1.00 0.00 H new ATOM 0 HE1 MET A 15 -1.699 -4.230 -3.105 1.00 0.00 H new ATOM 0 HE2 MET A 15 -1.638 -2.467 -3.340 1.00 0.00 H new ATOM 0 HE3 MET A 15 -1.473 -3.153 -1.706 1.00 0.00 H new ATOM 189 N LYS A 16 -7.644 -1.645 -6.674 1.00 0.00 N ATOM 190 CA LYS A 16 -8.529 -2.143 -7.713 1.00 0.00 C ATOM 191 C LYS A 16 -8.393 -1.263 -8.957 1.00 0.00 C ATOM 192 O LYS A 16 -8.399 -1.765 -10.080 1.00 0.00 O ATOM 193 CB LYS A 16 -9.963 -2.250 -7.189 1.00 0.00 C ATOM 194 CG LYS A 16 -10.034 -3.174 -5.971 1.00 0.00 C ATOM 195 CD LYS A 16 -10.154 -4.638 -6.399 1.00 0.00 C ATOM 196 CE LYS A 16 -11.614 -5.013 -6.665 1.00 0.00 C ATOM 197 NZ LYS A 16 -12.003 -4.638 -8.042 1.00 0.00 N ATOM 0 H LYS A 16 -8.116 -1.179 -5.899 1.00 0.00 H new ATOM 0 HA LYS A 16 -8.244 -3.154 -8.004 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -10.331 -1.260 -6.921 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -10.614 -2.629 -7.976 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -9.142 -3.043 -5.358 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -10.889 -2.901 -5.352 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -9.561 -4.808 -7.298 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -9.745 -5.283 -5.621 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -11.752 -6.085 -6.521 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -12.262 -4.509 -5.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -12.643 -5.360 -8.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -12.487 -3.718 -8.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -11.153 -4.573 -8.637 1.00 0.00 H new ATOM 211 N ASP A 17 -8.274 0.034 -8.715 1.00 0.00 N ATOM 212 CA ASP A 17 -8.137 0.989 -9.802 1.00 0.00 C ATOM 213 C ASP A 17 -6.903 0.634 -10.634 1.00 0.00 C ATOM 214 O ASP A 17 -5.775 0.749 -10.157 1.00 0.00 O ATOM 215 CB ASP A 17 -7.954 2.410 -9.267 1.00 0.00 C ATOM 216 CG ASP A 17 -8.541 3.514 -10.149 1.00 0.00 C ATOM 217 OD1 ASP A 17 -8.051 3.647 -11.292 1.00 0.00 O ATOM 218 OD2 ASP A 17 -9.465 4.199 -9.662 1.00 0.00 O ATOM 0 H ASP A 17 -8.270 0.446 -7.782 1.00 0.00 H new ATOM 0 HA ASP A 17 -9.044 0.945 -10.406 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -8.412 2.472 -8.280 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -6.888 2.598 -9.136 1.00 0.00 H new ATOM 223 N PRO A 18 -7.166 0.200 -11.895 1.00 0.00 N ATOM 224 CA PRO A 18 -6.090 -0.172 -12.798 1.00 0.00 C ATOM 225 C PRO A 18 -5.373 1.067 -13.337 1.00 0.00 C ATOM 226 O PRO A 18 -4.430 0.953 -14.119 1.00 0.00 O ATOM 227 CB PRO A 18 -6.757 -0.993 -13.889 1.00 0.00 C ATOM 228 CG PRO A 18 -8.239 -0.662 -13.812 1.00 0.00 C ATOM 229 CD PRO A 18 -8.489 0.052 -12.494 1.00 0.00 C ATOM 0 HA PRO A 18 -5.309 -0.750 -12.304 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -6.351 -0.743 -14.869 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -6.586 -2.059 -13.736 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -8.533 -0.030 -14.650 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -8.837 -1.571 -13.873 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -8.962 1.021 -12.652 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -9.153 -0.526 -11.850 1.00 0.00 H new ATOM 237 N GLU A 19 -5.847 2.224 -12.897 1.00 0.00 N ATOM 238 CA GLU A 19 -5.263 3.483 -13.325 1.00 0.00 C ATOM 239 C GLU A 19 -4.706 4.247 -12.122 1.00 0.00 C ATOM 240 O GLU A 19 -3.534 4.622 -12.109 1.00 0.00 O ATOM 241 CB GLU A 19 -6.285 4.331 -14.087 1.00 0.00 C ATOM 242 CG GLU A 19 -6.224 4.044 -15.588 1.00 0.00 C ATOM 243 CD GLU A 19 -6.584 5.291 -16.399 1.00 0.00 C ATOM 244 OE1 GLU A 19 -5.716 6.187 -16.477 1.00 0.00 O ATOM 245 OE2 GLU A 19 -7.718 5.319 -16.923 1.00 0.00 O ATOM 0 H GLU A 19 -6.629 2.315 -12.248 1.00 0.00 H new ATOM 0 HA GLU A 19 -4.440 3.266 -14.006 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -7.287 4.122 -13.713 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -6.092 5.389 -13.907 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -5.223 3.707 -15.857 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -6.910 3.234 -15.835 1.00 0.00 H new ATOM 252 N LYS A 20 -5.571 4.454 -11.141 1.00 0.00 N ATOM 253 CA LYS A 20 -5.180 5.166 -9.936 1.00 0.00 C ATOM 254 C LYS A 20 -4.851 4.155 -8.836 1.00 0.00 C ATOM 255 O LYS A 20 -4.809 4.505 -7.657 1.00 0.00 O ATOM 256 CB LYS A 20 -6.256 6.178 -9.538 1.00 0.00 C ATOM 257 CG LYS A 20 -6.487 7.199 -10.654 1.00 0.00 C ATOM 258 CD LYS A 20 -7.934 7.154 -11.149 1.00 0.00 C ATOM 259 CE LYS A 20 -8.641 8.488 -10.901 1.00 0.00 C ATOM 260 NZ LYS A 20 -9.974 8.265 -10.299 1.00 0.00 N ATOM 0 H LYS A 20 -6.542 4.141 -11.156 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.277 5.749 -10.115 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.188 5.656 -9.319 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -5.956 6.693 -8.625 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.255 8.200 -10.290 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -5.809 6.996 -11.483 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -7.951 6.922 -12.214 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -8.471 6.354 -10.640 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -8.036 9.109 -10.240 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.746 9.031 -11.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.440 9.181 -10.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -10.554 7.690 -10.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -9.867 7.767 -9.392 1.00 0.00 H new ATOM 274 N GLY A 21 -4.626 2.919 -9.259 1.00 0.00 N ATOM 275 CA GLY A 21 -4.302 1.855 -8.325 1.00 0.00 C ATOM 276 C GLY A 21 -3.182 0.967 -8.872 1.00 0.00 C ATOM 277 O GLY A 21 -2.390 1.404 -9.705 1.00 0.00 O ATOM 0 H GLY A 21 -4.662 2.631 -10.237 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -3.997 2.284 -7.371 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -5.189 1.251 -8.134 1.00 0.00 H new ATOM 281 N ILE A 22 -3.152 -0.263 -8.380 1.00 0.00 N ATOM 282 CA ILE A 22 -2.143 -1.216 -8.809 1.00 0.00 C ATOM 283 C ILE A 22 -2.490 -1.725 -10.210 1.00 0.00 C ATOM 284 O ILE A 22 -3.662 -1.921 -10.529 1.00 0.00 O ATOM 285 CB ILE A 22 -1.982 -2.329 -7.772 1.00 0.00 C ATOM 286 CG1 ILE A 22 -0.587 -2.297 -7.145 1.00 0.00 C ATOM 287 CG2 ILE A 22 -2.306 -3.695 -8.381 1.00 0.00 C ATOM 288 CD1 ILE A 22 -0.491 -3.274 -5.971 1.00 0.00 C ATOM 0 H ILE A 22 -3.810 -0.621 -7.688 1.00 0.00 H new ATOM 0 HA ILE A 22 -1.168 -0.733 -8.878 1.00 0.00 H new ATOM 0 HB ILE A 22 -2.699 -2.155 -6.969 1.00 0.00 H new ATOM 0 HG12 ILE A 22 0.160 -2.552 -7.897 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -0.362 -1.287 -6.802 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -2.184 -4.469 -7.624 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -3.335 -3.698 -8.741 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -1.630 -3.892 -9.213 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.511 -3.232 -5.543 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -1.222 -3.001 -5.210 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -0.693 -4.286 -6.322 1.00 0.00 H new ATOM 300 N LYS A 23 -1.451 -1.923 -11.007 1.00 0.00 N ATOM 301 CA LYS A 23 -1.632 -2.406 -12.366 1.00 0.00 C ATOM 302 C LYS A 23 -1.503 -3.930 -12.383 1.00 0.00 C ATOM 303 O LYS A 23 -0.635 -4.490 -11.715 1.00 0.00 O ATOM 304 CB LYS A 23 -0.668 -1.696 -13.319 1.00 0.00 C ATOM 305 CG LYS A 23 -1.176 -0.296 -13.670 1.00 0.00 C ATOM 306 CD LYS A 23 -1.111 0.632 -12.456 1.00 0.00 C ATOM 307 CE LYS A 23 0.339 0.883 -12.035 1.00 0.00 C ATOM 308 NZ LYS A 23 0.500 0.676 -10.579 1.00 0.00 N ATOM 0 H LYS A 23 -0.481 -1.758 -10.738 1.00 0.00 H new ATOM 0 HA LYS A 23 -2.633 -2.167 -12.725 1.00 0.00 H new ATOM 0 HB2 LYS A 23 0.317 -1.624 -12.859 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -0.552 -2.284 -14.230 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -0.578 0.119 -14.481 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -2.203 -0.358 -14.030 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -1.594 1.580 -12.692 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -1.663 0.191 -11.626 1.00 0.00 H new ATOM 0 HE2 LYS A 23 1.003 0.212 -12.579 1.00 0.00 H new ATOM 0 HE3 LYS A 23 0.629 1.900 -12.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 1.222 1.329 -10.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -0.405 0.857 -10.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 0.797 -0.304 -10.398 1.00 0.00 H new ATOM 322 N GLU A 24 -2.379 -4.558 -13.153 1.00 0.00 N ATOM 323 CA GLU A 24 -2.373 -6.006 -13.266 1.00 0.00 C ATOM 324 C GLU A 24 -1.892 -6.429 -14.656 1.00 0.00 C ATOM 325 O GLU A 24 -2.674 -6.460 -15.604 1.00 0.00 O ATOM 326 CB GLU A 24 -3.757 -6.585 -12.966 1.00 0.00 C ATOM 327 CG GLU A 24 -4.862 -5.642 -13.448 1.00 0.00 C ATOM 328 CD GLU A 24 -6.196 -6.381 -13.574 1.00 0.00 C ATOM 329 OE1 GLU A 24 -6.749 -6.740 -12.512 1.00 0.00 O ATOM 330 OE2 GLU A 24 -6.633 -6.569 -14.730 1.00 0.00 O ATOM 0 H GLU A 24 -3.098 -4.090 -13.705 1.00 0.00 H new ATOM 0 HA GLU A 24 -1.679 -6.405 -12.526 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -3.863 -7.554 -13.453 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -3.860 -6.754 -11.894 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -4.967 -4.811 -12.750 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -4.586 -5.215 -14.412 1.00 0.00 H new ATOM 337 N LEU A 25 -0.607 -6.743 -14.732 1.00 0.00 N ATOM 338 CA LEU A 25 -0.013 -7.162 -15.990 1.00 0.00 C ATOM 339 C LEU A 25 -0.119 -8.683 -16.118 1.00 0.00 C ATOM 340 O LEU A 25 -0.209 -9.389 -15.114 1.00 0.00 O ATOM 341 CB LEU A 25 1.418 -6.634 -16.108 1.00 0.00 C ATOM 342 CG LEU A 25 1.645 -5.199 -15.630 1.00 0.00 C ATOM 343 CD1 LEU A 25 2.986 -5.068 -14.906 1.00 0.00 C ATOM 344 CD2 LEU A 25 1.521 -4.208 -16.790 1.00 0.00 C ATOM 0 H LEU A 25 0.039 -6.716 -13.943 1.00 0.00 H new ATOM 0 HA LEU A 25 -0.558 -6.732 -16.830 1.00 0.00 H new ATOM 0 HB2 LEU A 25 2.075 -7.293 -15.541 1.00 0.00 H new ATOM 0 HB3 LEU A 25 1.724 -6.701 -17.152 1.00 0.00 H new ATOM 0 HG LEU A 25 0.865 -4.952 -14.910 1.00 0.00 H new ATOM 0 HD11 LEU A 25 3.123 -4.038 -14.577 1.00 0.00 H new ATOM 0 HD12 LEU A 25 2.998 -5.730 -14.041 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.794 -5.342 -15.584 1.00 0.00 H new ATOM 0 HD21 LEU A 25 1.687 -3.195 -16.423 1.00 0.00 H new ATOM 0 HD22 LEU A 25 2.264 -4.444 -17.551 1.00 0.00 H new ATOM 0 HD23 LEU A 25 0.523 -4.278 -17.223 1.00 0.00 H new ATOM 356 N ASN A 26 -0.107 -9.143 -17.360 1.00 0.00 N ATOM 357 CA ASN A 26 -0.201 -10.567 -17.632 1.00 0.00 C ATOM 358 C ASN A 26 1.199 -11.183 -17.593 1.00 0.00 C ATOM 359 O ASN A 26 2.123 -10.673 -18.224 1.00 0.00 O ATOM 360 CB ASN A 26 -0.793 -10.825 -19.019 1.00 0.00 C ATOM 361 CG ASN A 26 -0.110 -9.956 -20.077 1.00 0.00 C ATOM 362 OD1 ASN A 26 0.950 -10.275 -20.590 1.00 0.00 O ATOM 363 ND2 ASN A 26 -0.775 -8.843 -20.373 1.00 0.00 N ATOM 0 H ASN A 26 -0.034 -8.554 -18.190 1.00 0.00 H new ATOM 0 HA ASN A 26 -0.847 -11.013 -16.876 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -0.677 -11.878 -19.278 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -1.863 -10.616 -19.006 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -0.402 -8.196 -21.068 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -1.658 -8.637 -19.906 1.00 0.00 H new ATOM 370 N LEU A 27 1.311 -12.272 -16.845 1.00 0.00 N ATOM 371 CA LEU A 27 2.583 -12.962 -16.716 1.00 0.00 C ATOM 372 C LEU A 27 2.398 -14.435 -17.086 1.00 0.00 C ATOM 373 O LEU A 27 1.449 -15.077 -16.639 1.00 0.00 O ATOM 374 CB LEU A 27 3.169 -12.749 -15.319 1.00 0.00 C ATOM 375 CG LEU A 27 3.337 -11.293 -14.878 1.00 0.00 C ATOM 376 CD1 LEU A 27 3.206 -11.162 -13.359 1.00 0.00 C ATOM 377 CD2 LEU A 27 4.657 -10.714 -15.391 1.00 0.00 C ATOM 0 H LEU A 27 0.542 -12.693 -16.323 1.00 0.00 H new ATOM 0 HA LEU A 27 3.314 -12.547 -17.410 1.00 0.00 H new ATOM 0 HB2 LEU A 27 2.529 -13.255 -14.597 1.00 0.00 H new ATOM 0 HB3 LEU A 27 4.143 -13.236 -15.277 1.00 0.00 H new ATOM 0 HG LEU A 27 2.533 -10.706 -15.323 1.00 0.00 H new ATOM 0 HD11 LEU A 27 3.329 -10.118 -13.072 1.00 0.00 H new ATOM 0 HD12 LEU A 27 2.221 -11.510 -13.047 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.974 -11.765 -12.874 1.00 0.00 H new ATOM 0 HD21 LEU A 27 4.752 -9.679 -15.064 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.488 -11.297 -14.995 1.00 0.00 H new ATOM 0 HD23 LEU A 27 4.673 -10.753 -16.480 1.00 0.00 H new ATOM 389 N GLU A 28 3.321 -14.928 -17.900 1.00 0.00 N ATOM 390 CA GLU A 28 3.272 -16.313 -18.336 1.00 0.00 C ATOM 391 C GLU A 28 4.433 -17.103 -17.728 1.00 0.00 C ATOM 392 O GLU A 28 5.533 -17.117 -18.277 1.00 0.00 O ATOM 393 CB GLU A 28 3.284 -16.408 -19.863 1.00 0.00 C ATOM 394 CG GLU A 28 3.575 -17.839 -20.320 1.00 0.00 C ATOM 395 CD GLU A 28 3.082 -18.068 -21.751 1.00 0.00 C ATOM 396 OE1 GLU A 28 3.243 -17.132 -22.563 1.00 0.00 O ATOM 397 OE2 GLU A 28 2.555 -19.174 -21.999 1.00 0.00 O ATOM 0 H GLU A 28 4.107 -14.392 -18.269 1.00 0.00 H new ATOM 0 HA GLU A 28 2.338 -16.751 -17.985 1.00 0.00 H new ATOM 0 HB2 GLU A 28 2.321 -16.084 -20.259 1.00 0.00 H new ATOM 0 HB3 GLU A 28 4.038 -15.733 -20.267 1.00 0.00 H new ATOM 0 HG2 GLU A 28 4.647 -18.031 -20.265 1.00 0.00 H new ATOM 0 HG3 GLU A 28 3.090 -18.546 -19.647 1.00 0.00 H new ATOM 404 N LYS A 29 4.147 -17.740 -16.602 1.00 0.00 N ATOM 405 CA LYS A 29 5.154 -18.530 -15.913 1.00 0.00 C ATOM 406 C LYS A 29 5.260 -19.904 -16.576 1.00 0.00 C ATOM 407 O LYS A 29 4.444 -20.787 -16.318 1.00 0.00 O ATOM 408 CB LYS A 29 4.853 -18.592 -14.414 1.00 0.00 C ATOM 409 CG LYS A 29 5.975 -19.307 -13.659 1.00 0.00 C ATOM 410 CD LYS A 29 5.597 -19.523 -12.192 1.00 0.00 C ATOM 411 CE LYS A 29 6.135 -20.861 -11.679 1.00 0.00 C ATOM 412 NZ LYS A 29 7.503 -20.696 -11.138 1.00 0.00 N ATOM 0 H LYS A 29 3.233 -17.725 -16.150 1.00 0.00 H new ATOM 0 HA LYS A 29 6.133 -18.058 -15.999 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.732 -17.582 -14.022 1.00 0.00 H new ATOM 0 HB3 LYS A 29 3.910 -19.113 -14.250 1.00 0.00 H new ATOM 0 HG2 LYS A 29 6.181 -20.268 -14.131 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.891 -18.719 -13.720 1.00 0.00 H new ATOM 0 HD2 LYS A 29 5.997 -18.710 -11.586 1.00 0.00 H new ATOM 0 HD3 LYS A 29 4.513 -19.498 -12.084 1.00 0.00 H new ATOM 0 HE2 LYS A 29 5.476 -21.252 -10.904 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.143 -21.591 -12.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 7.853 -21.613 -10.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 8.132 -20.344 -11.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 7.486 -20.015 -10.352 1.00 0.00 H new ATOM 426 N ASP A 30 6.273 -20.042 -17.420 1.00 0.00 N ATOM 427 CA ASP A 30 6.496 -21.294 -18.122 1.00 0.00 C ATOM 428 C ASP A 30 5.323 -21.559 -19.068 1.00 0.00 C ATOM 429 O ASP A 30 5.428 -21.332 -20.273 1.00 0.00 O ATOM 430 CB ASP A 30 6.588 -22.466 -17.144 1.00 0.00 C ATOM 431 CG ASP A 30 7.986 -23.067 -16.984 1.00 0.00 C ATOM 432 OD1 ASP A 30 8.478 -23.632 -17.985 1.00 0.00 O ATOM 433 OD2 ASP A 30 8.531 -22.948 -15.865 1.00 0.00 O ATOM 0 H ASP A 30 6.948 -19.307 -17.633 1.00 0.00 H new ATOM 0 HA ASP A 30 7.433 -21.209 -18.672 1.00 0.00 H new ATOM 0 HB2 ASP A 30 6.238 -22.133 -16.167 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.908 -23.250 -17.475 1.00 0.00 H new ATOM 438 N LYS A 31 4.232 -22.036 -18.488 1.00 0.00 N ATOM 439 CA LYS A 31 3.040 -22.335 -19.264 1.00 0.00 C ATOM 440 C LYS A 31 1.801 -21.916 -18.470 1.00 0.00 C ATOM 441 O LYS A 31 0.715 -22.452 -18.680 1.00 0.00 O ATOM 442 CB LYS A 31 3.031 -23.805 -19.688 1.00 0.00 C ATOM 443 CG LYS A 31 4.202 -24.113 -20.623 1.00 0.00 C ATOM 444 CD LYS A 31 3.937 -23.571 -22.029 1.00 0.00 C ATOM 445 CE LYS A 31 5.141 -23.808 -22.944 1.00 0.00 C ATOM 446 NZ LYS A 31 5.165 -25.212 -23.414 1.00 0.00 N ATOM 0 H LYS A 31 4.148 -22.223 -17.489 1.00 0.00 H new ATOM 0 HA LYS A 31 3.035 -21.760 -20.190 1.00 0.00 H new ATOM 0 HB2 LYS A 31 3.088 -24.442 -18.805 1.00 0.00 H new ATOM 0 HB3 LYS A 31 2.091 -24.037 -20.188 1.00 0.00 H new ATOM 0 HG2 LYS A 31 5.116 -23.671 -20.225 1.00 0.00 H new ATOM 0 HG3 LYS A 31 4.362 -25.190 -20.669 1.00 0.00 H new ATOM 0 HD2 LYS A 31 3.055 -24.055 -22.449 1.00 0.00 H new ATOM 0 HD3 LYS A 31 3.720 -22.504 -21.976 1.00 0.00 H new ATOM 0 HE2 LYS A 31 5.095 -23.133 -23.798 1.00 0.00 H new ATOM 0 HE3 LYS A 31 6.063 -23.582 -22.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 5.988 -25.357 -24.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 5.231 -25.851 -22.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 4.293 -25.416 -23.943 1.00 0.00 H new ATOM 460 N LYS A 32 2.007 -20.962 -17.574 1.00 0.00 N ATOM 461 CA LYS A 32 0.920 -20.465 -16.747 1.00 0.00 C ATOM 462 C LYS A 32 0.686 -18.985 -17.056 1.00 0.00 C ATOM 463 O LYS A 32 1.342 -18.116 -16.483 1.00 0.00 O ATOM 464 CB LYS A 32 1.198 -20.748 -15.270 1.00 0.00 C ATOM 465 CG LYS A 32 1.622 -22.203 -15.061 1.00 0.00 C ATOM 466 CD LYS A 32 0.496 -23.016 -14.420 1.00 0.00 C ATOM 467 CE LYS A 32 0.679 -23.106 -12.903 1.00 0.00 C ATOM 468 NZ LYS A 32 0.520 -24.504 -12.444 1.00 0.00 N ATOM 0 H LYS A 32 2.910 -20.520 -17.402 1.00 0.00 H new ATOM 0 HA LYS A 32 -0.006 -20.990 -16.979 1.00 0.00 H new ATOM 0 HB2 LYS A 32 1.982 -20.082 -14.910 1.00 0.00 H new ATOM 0 HB3 LYS A 32 0.305 -20.538 -14.681 1.00 0.00 H new ATOM 0 HG2 LYS A 32 1.896 -22.647 -16.018 1.00 0.00 H new ATOM 0 HG3 LYS A 32 2.508 -22.240 -14.427 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -0.465 -22.555 -14.647 1.00 0.00 H new ATOM 0 HD3 LYS A 32 0.477 -24.018 -14.848 1.00 0.00 H new ATOM 0 HE2 LYS A 32 1.667 -22.737 -12.627 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -0.051 -22.468 -12.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 0.647 -24.547 -11.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -0.432 -24.844 -12.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 1.232 -25.104 -12.906 1.00 0.00 H new ATOM 482 N VAL A 33 -0.251 -18.743 -17.961 1.00 0.00 N ATOM 483 CA VAL A 33 -0.580 -17.383 -18.353 1.00 0.00 C ATOM 484 C VAL A 33 -1.570 -16.792 -17.346 1.00 0.00 C ATOM 485 O VAL A 33 -2.780 -16.838 -17.560 1.00 0.00 O ATOM 486 CB VAL A 33 -1.107 -17.365 -19.789 1.00 0.00 C ATOM 487 CG1 VAL A 33 -1.692 -15.996 -20.142 1.00 0.00 C ATOM 488 CG2 VAL A 33 -0.011 -17.764 -20.779 1.00 0.00 C ATOM 0 H VAL A 33 -0.793 -19.466 -18.434 1.00 0.00 H new ATOM 0 HA VAL A 33 0.311 -16.756 -18.340 1.00 0.00 H new ATOM 0 HB VAL A 33 -1.909 -18.100 -19.861 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -2.059 -16.011 -21.168 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -2.515 -15.767 -19.465 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -0.919 -15.234 -20.044 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -0.411 -17.743 -21.793 1.00 0.00 H new ATOM 0 HG22 VAL A 33 0.821 -17.064 -20.703 1.00 0.00 H new ATOM 0 HG23 VAL A 33 0.340 -18.770 -20.548 1.00 0.00 H new ATOM 498 N PHE A 34 -1.018 -16.251 -16.270 1.00 0.00 N ATOM 499 CA PHE A 34 -1.837 -15.652 -15.230 1.00 0.00 C ATOM 500 C PHE A 34 -2.355 -14.279 -15.663 1.00 0.00 C ATOM 501 O PHE A 34 -1.609 -13.301 -15.663 1.00 0.00 O ATOM 502 CB PHE A 34 -0.943 -15.482 -14.000 1.00 0.00 C ATOM 503 CG PHE A 34 -0.555 -16.799 -13.326 1.00 0.00 C ATOM 504 CD1 PHE A 34 -1.494 -17.527 -12.664 1.00 0.00 C ATOM 505 CD2 PHE A 34 0.729 -17.242 -13.389 1.00 0.00 C ATOM 506 CE1 PHE A 34 -1.133 -18.750 -12.038 1.00 0.00 C ATOM 507 CE2 PHE A 34 1.090 -18.465 -12.763 1.00 0.00 C ATOM 508 CZ PHE A 34 0.151 -19.193 -12.101 1.00 0.00 C ATOM 0 H PHE A 34 -0.014 -16.215 -16.096 1.00 0.00 H new ATOM 0 HA PHE A 34 -2.699 -16.287 -15.023 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -0.035 -14.955 -14.293 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -1.457 -14.852 -13.274 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -2.514 -17.175 -12.614 1.00 0.00 H new ATOM 0 HD2 PHE A 34 1.474 -16.664 -13.915 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -1.878 -19.328 -11.512 1.00 0.00 H new ATOM 0 HE2 PHE A 34 2.110 -18.817 -12.813 1.00 0.00 H new ATOM 0 HZ PHE A 34 0.425 -20.123 -11.625 1.00 0.00 H new ATOM 518 N ASN A 35 -3.630 -14.250 -16.022 1.00 0.00 N ATOM 519 CA ASN A 35 -4.257 -13.013 -16.456 1.00 0.00 C ATOM 520 C ASN A 35 -4.793 -12.262 -15.236 1.00 0.00 C ATOM 521 O ASN A 35 -5.465 -12.848 -14.388 1.00 0.00 O ATOM 522 CB ASN A 35 -5.433 -13.291 -17.395 1.00 0.00 C ATOM 523 CG ASN A 35 -4.946 -13.851 -18.733 1.00 0.00 C ATOM 524 OD1 ASN A 35 -3.870 -13.534 -19.213 1.00 0.00 O ATOM 525 ND2 ASN A 35 -5.795 -14.699 -19.306 1.00 0.00 N ATOM 0 H ASN A 35 -4.246 -15.063 -16.021 1.00 0.00 H new ATOM 0 HA ASN A 35 -3.507 -12.422 -16.982 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -6.117 -14.000 -16.927 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -5.993 -12.371 -17.564 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -5.561 -15.127 -20.202 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -6.680 -14.921 -18.850 1.00 0.00 H new ATOM 532 N HIS A 36 -4.477 -10.976 -15.186 1.00 0.00 N ATOM 533 CA HIS A 36 -4.919 -10.140 -14.083 1.00 0.00 C ATOM 534 C HIS A 36 -4.101 -10.465 -12.832 1.00 0.00 C ATOM 535 O HIS A 36 -4.655 -10.602 -11.742 1.00 0.00 O ATOM 536 CB HIS A 36 -6.426 -10.285 -13.861 1.00 0.00 C ATOM 537 CG HIS A 36 -7.244 -10.206 -15.128 1.00 0.00 C ATOM 538 ND1 HIS A 36 -6.807 -9.544 -16.262 1.00 0.00 N ATOM 539 CD2 HIS A 36 -8.474 -10.713 -15.427 1.00 0.00 C ATOM 540 CE1 HIS A 36 -7.741 -9.653 -17.196 1.00 0.00 C ATOM 541 NE2 HIS A 36 -8.774 -10.377 -16.676 1.00 0.00 N ATOM 0 H HIS A 36 -3.920 -10.493 -15.891 1.00 0.00 H new ATOM 0 HA HIS A 36 -4.746 -9.091 -14.325 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -6.621 -11.240 -13.374 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -6.759 -9.505 -13.177 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -9.098 -11.290 -14.761 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -7.693 -9.241 -18.193 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -9.635 -10.620 -17.166 1.00 0.00 H new ATOM 549 N CYS A 37 -2.796 -10.579 -13.030 1.00 0.00 N ATOM 550 CA CYS A 37 -1.896 -10.886 -11.932 1.00 0.00 C ATOM 551 C CYS A 37 -1.020 -9.659 -11.671 1.00 0.00 C ATOM 552 O CYS A 37 -0.881 -8.797 -12.537 1.00 0.00 O ATOM 553 CB CYS A 37 -1.059 -12.135 -12.218 1.00 0.00 C ATOM 554 SG CYS A 37 0.159 -11.782 -13.537 1.00 0.00 S ATOM 0 H CYS A 37 -2.340 -10.464 -13.935 1.00 0.00 H new ATOM 0 HA CYS A 37 -2.475 -11.114 -11.037 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -0.544 -12.453 -11.312 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -1.708 -12.957 -12.521 1.00 0.00 H new ATOM 0 HG CYS A 37 -0.101 -10.624 -14.069 1.00 0.00 H new ATOM 560 N LEU A 38 -0.453 -9.620 -10.475 1.00 0.00 N ATOM 561 CA LEU A 38 0.406 -8.513 -10.089 1.00 0.00 C ATOM 562 C LEU A 38 1.816 -9.039 -9.812 1.00 0.00 C ATOM 563 O LEU A 38 2.274 -9.973 -10.469 1.00 0.00 O ATOM 564 CB LEU A 38 -0.205 -7.745 -8.916 1.00 0.00 C ATOM 565 CG LEU A 38 -1.727 -7.586 -8.937 1.00 0.00 C ATOM 566 CD1 LEU A 38 -2.224 -6.897 -7.665 1.00 0.00 C ATOM 567 CD2 LEU A 38 -2.184 -6.854 -10.201 1.00 0.00 C ATOM 0 H LEU A 38 -0.571 -10.337 -9.760 1.00 0.00 H new ATOM 0 HA LEU A 38 0.488 -7.793 -10.903 1.00 0.00 H new ATOM 0 HB2 LEU A 38 0.075 -8.250 -7.992 1.00 0.00 H new ATOM 0 HB3 LEU A 38 0.244 -6.752 -8.885 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.174 -8.580 -8.960 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -3.309 -6.796 -7.706 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -1.947 -7.494 -6.796 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.771 -5.909 -7.586 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -3.269 -6.754 -10.191 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.729 -5.864 -10.233 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.880 -7.422 -11.080 1.00 0.00 H new ATOM 579 N THR A 39 2.464 -8.417 -8.839 1.00 0.00 N ATOM 580 CA THR A 39 3.813 -8.810 -8.468 1.00 0.00 C ATOM 581 C THR A 39 4.140 -8.324 -7.055 1.00 0.00 C ATOM 582 O THR A 39 3.873 -7.172 -6.713 1.00 0.00 O ATOM 583 CB THR A 39 4.772 -8.275 -9.532 1.00 0.00 C ATOM 584 OG1 THR A 39 4.246 -6.991 -9.860 1.00 0.00 O ATOM 585 CG2 THR A 39 4.687 -9.058 -10.844 1.00 0.00 C ATOM 0 H THR A 39 2.080 -7.644 -8.296 1.00 0.00 H new ATOM 0 HA THR A 39 3.914 -9.895 -8.436 1.00 0.00 H new ATOM 0 HB THR A 39 5.793 -8.313 -9.152 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.809 -6.572 -10.543 1.00 0.00 H new ATOM 0 HG21 THR A 39 5.388 -8.637 -11.565 1.00 0.00 H new ATOM 0 HG22 THR A 39 4.938 -10.103 -10.661 1.00 0.00 H new ATOM 0 HG23 THR A 39 3.674 -8.992 -11.242 1.00 0.00 H new ATOM 593 N GLY A 40 4.714 -9.225 -6.271 1.00 0.00 N ATOM 594 CA GLY A 40 5.081 -8.901 -4.903 1.00 0.00 C ATOM 595 C GLY A 40 5.796 -7.550 -4.831 1.00 0.00 C ATOM 596 O GLY A 40 5.425 -6.689 -4.035 1.00 0.00 O ATOM 0 H GLY A 40 4.934 -10.179 -6.557 1.00 0.00 H new ATOM 0 HA2 GLY A 40 4.187 -8.877 -4.279 1.00 0.00 H new ATOM 0 HA3 GLY A 40 5.729 -9.681 -4.502 1.00 0.00 H new ATOM 600 N SER A 41 6.808 -7.407 -5.674 1.00 0.00 N ATOM 601 CA SER A 41 7.578 -6.176 -5.716 1.00 0.00 C ATOM 602 C SER A 41 6.690 -5.019 -6.177 1.00 0.00 C ATOM 603 O SER A 41 6.502 -4.047 -5.446 1.00 0.00 O ATOM 604 CB SER A 41 8.790 -6.315 -6.640 1.00 0.00 C ATOM 605 OG SER A 41 8.582 -5.671 -7.894 1.00 0.00 O ATOM 0 H SER A 41 7.112 -8.123 -6.333 1.00 0.00 H new ATOM 0 HA SER A 41 7.944 -5.967 -4.711 1.00 0.00 H new ATOM 0 HB2 SER A 41 9.667 -5.888 -6.154 1.00 0.00 H new ATOM 0 HB3 SER A 41 9.000 -7.372 -6.806 1.00 0.00 H new ATOM 0 HG SER A 41 9.379 -5.781 -8.454 1.00 0.00 H new ATOM 611 N GLY A 42 6.167 -5.161 -7.386 1.00 0.00 N ATOM 612 CA GLY A 42 5.302 -4.140 -7.952 1.00 0.00 C ATOM 613 C GLY A 42 4.233 -3.707 -6.947 1.00 0.00 C ATOM 614 O GLY A 42 3.885 -2.529 -6.874 1.00 0.00 O ATOM 0 H GLY A 42 6.326 -5.968 -7.989 1.00 0.00 H new ATOM 0 HA2 GLY A 42 5.898 -3.277 -8.248 1.00 0.00 H new ATOM 0 HA3 GLY A 42 4.824 -4.522 -8.854 1.00 0.00 H new ATOM 618 N VAL A 43 3.742 -4.682 -6.197 1.00 0.00 N ATOM 619 CA VAL A 43 2.719 -4.417 -5.200 1.00 0.00 C ATOM 620 C VAL A 43 3.251 -3.398 -4.190 1.00 0.00 C ATOM 621 O VAL A 43 2.551 -2.452 -3.830 1.00 0.00 O ATOM 622 CB VAL A 43 2.272 -5.727 -4.548 1.00 0.00 C ATOM 623 CG1 VAL A 43 1.346 -5.459 -3.359 1.00 0.00 C ATOM 624 CG2 VAL A 43 1.600 -6.646 -5.570 1.00 0.00 C ATOM 0 H VAL A 43 4.034 -5.657 -6.260 1.00 0.00 H new ATOM 0 HA VAL A 43 1.834 -3.983 -5.666 1.00 0.00 H new ATOM 0 HB VAL A 43 3.160 -6.236 -4.173 1.00 0.00 H new ATOM 0 HG11 VAL A 43 1.043 -6.406 -2.913 1.00 0.00 H new ATOM 0 HG12 VAL A 43 1.872 -4.860 -2.616 1.00 0.00 H new ATOM 0 HG13 VAL A 43 0.463 -4.919 -3.700 1.00 0.00 H new ATOM 0 HG21 VAL A 43 1.292 -7.570 -5.081 1.00 0.00 H new ATOM 0 HG22 VAL A 43 0.725 -6.147 -5.988 1.00 0.00 H new ATOM 0 HG23 VAL A 43 2.303 -6.876 -6.370 1.00 0.00 H new ATOM 634 N ILE A 44 4.484 -3.625 -3.761 1.00 0.00 N ATOM 635 CA ILE A 44 5.117 -2.738 -2.799 1.00 0.00 C ATOM 636 C ILE A 44 5.564 -1.459 -3.509 1.00 0.00 C ATOM 637 O ILE A 44 5.670 -0.404 -2.886 1.00 0.00 O ATOM 638 CB ILE A 44 6.248 -3.462 -2.067 1.00 0.00 C ATOM 639 CG1 ILE A 44 5.739 -4.742 -1.401 1.00 0.00 C ATOM 640 CG2 ILE A 44 6.938 -2.532 -1.068 1.00 0.00 C ATOM 641 CD1 ILE A 44 6.900 -5.667 -1.031 1.00 0.00 C ATOM 0 H ILE A 44 5.062 -4.410 -4.062 1.00 0.00 H new ATOM 0 HA ILE A 44 4.406 -2.443 -2.027 1.00 0.00 H new ATOM 0 HB ILE A 44 6.997 -3.757 -2.802 1.00 0.00 H new ATOM 0 HG12 ILE A 44 5.171 -4.489 -0.506 1.00 0.00 H new ATOM 0 HG13 ILE A 44 5.057 -5.260 -2.075 1.00 0.00 H new ATOM 0 HG21 ILE A 44 7.738 -3.072 -0.561 1.00 0.00 H new ATOM 0 HG22 ILE A 44 7.356 -1.676 -1.597 1.00 0.00 H new ATOM 0 HG23 ILE A 44 6.212 -2.185 -0.333 1.00 0.00 H new ATOM 0 HD11 ILE A 44 6.510 -6.569 -0.559 1.00 0.00 H new ATOM 0 HD12 ILE A 44 7.451 -5.937 -1.932 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.567 -5.154 -0.338 1.00 0.00 H new ATOM 653 N ASP A 45 5.813 -1.595 -4.804 1.00 0.00 N ATOM 654 CA ASP A 45 6.246 -0.463 -5.605 1.00 0.00 C ATOM 655 C ASP A 45 5.123 0.575 -5.663 1.00 0.00 C ATOM 656 O ASP A 45 5.370 1.770 -5.515 1.00 0.00 O ATOM 657 CB ASP A 45 6.568 -0.893 -7.038 1.00 0.00 C ATOM 658 CG ASP A 45 7.609 -0.030 -7.754 1.00 0.00 C ATOM 659 OD1 ASP A 45 8.728 0.078 -7.208 1.00 0.00 O ATOM 660 OD2 ASP A 45 7.261 0.501 -8.831 1.00 0.00 O ATOM 0 H ASP A 45 5.723 -2.472 -5.318 1.00 0.00 H new ATOM 0 HA ASP A 45 7.142 -0.047 -5.144 1.00 0.00 H new ATOM 0 HB2 ASP A 45 6.922 -1.924 -7.021 1.00 0.00 H new ATOM 0 HB3 ASP A 45 5.647 -0.882 -7.620 1.00 0.00 H new ATOM 665 N TRP A 46 3.914 0.079 -5.880 1.00 0.00 N ATOM 666 CA TRP A 46 2.752 0.948 -5.960 1.00 0.00 C ATOM 667 C TRP A 46 2.584 1.638 -4.605 1.00 0.00 C ATOM 668 O TRP A 46 2.138 2.782 -4.538 1.00 0.00 O ATOM 669 CB TRP A 46 1.510 0.165 -6.390 1.00 0.00 C ATOM 670 CG TRP A 46 0.217 0.982 -6.357 1.00 0.00 C ATOM 671 CD1 TRP A 46 -0.313 1.728 -7.336 1.00 0.00 C ATOM 672 CD2 TRP A 46 -0.694 1.105 -5.244 1.00 0.00 C ATOM 673 NE1 TRP A 46 -1.494 2.321 -6.937 1.00 0.00 N ATOM 674 CE2 TRP A 46 -1.733 1.930 -5.625 1.00 0.00 C ATOM 675 CE3 TRP A 46 -0.642 0.537 -3.959 1.00 0.00 C ATOM 676 CZ2 TRP A 46 -2.797 2.262 -4.779 1.00 0.00 C ATOM 677 CZ3 TRP A 46 -1.714 0.879 -3.125 1.00 0.00 C ATOM 678 CH2 TRP A 46 -2.767 1.708 -3.493 1.00 0.00 C ATOM 0 H TRP A 46 3.714 -0.914 -6.003 1.00 0.00 H new ATOM 0 HA TRP A 46 2.893 1.712 -6.725 1.00 0.00 H new ATOM 0 HB2 TRP A 46 1.663 -0.213 -7.401 1.00 0.00 H new ATOM 0 HB3 TRP A 46 1.396 -0.702 -5.739 1.00 0.00 H new ATOM 0 HD1 TRP A 46 0.128 1.850 -8.314 1.00 0.00 H new ATOM 0 HE1 TRP A 46 -2.083 2.933 -7.501 1.00 0.00 H new ATOM 0 HE3 TRP A 46 0.161 -0.111 -3.640 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 -3.598 2.911 -5.100 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 -1.723 0.470 -2.126 1.00 0.00 H new ATOM 0 HH2 TRP A 46 -3.558 1.924 -2.791 1.00 0.00 H new ATOM 689 N LEU A 47 2.949 0.913 -3.558 1.00 0.00 N ATOM 690 CA LEU A 47 2.844 1.441 -2.208 1.00 0.00 C ATOM 691 C LEU A 47 3.776 2.645 -2.063 1.00 0.00 C ATOM 692 O LEU A 47 3.346 3.722 -1.651 1.00 0.00 O ATOM 693 CB LEU A 47 3.099 0.337 -1.180 1.00 0.00 C ATOM 694 CG LEU A 47 1.971 -0.679 -0.993 1.00 0.00 C ATOM 695 CD1 LEU A 47 2.478 -1.935 -0.280 1.00 0.00 C ATOM 696 CD2 LEU A 47 0.781 -0.050 -0.267 1.00 0.00 C ATOM 0 H LEU A 47 3.318 -0.036 -3.617 1.00 0.00 H new ATOM 0 HA LEU A 47 1.832 1.796 -2.015 1.00 0.00 H new ATOM 0 HB2 LEU A 47 4.001 -0.201 -1.471 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.303 0.805 -0.217 1.00 0.00 H new ATOM 0 HG LEU A 47 1.621 -0.986 -1.979 1.00 0.00 H new ATOM 0 HD11 LEU A 47 1.657 -2.641 -0.159 1.00 0.00 H new ATOM 0 HD12 LEU A 47 3.269 -2.396 -0.872 1.00 0.00 H new ATOM 0 HD13 LEU A 47 2.870 -1.664 0.700 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -0.007 -0.794 -0.147 1.00 0.00 H new ATOM 0 HD22 LEU A 47 1.099 0.303 0.714 1.00 0.00 H new ATOM 0 HD23 LEU A 47 0.402 0.789 -0.850 1.00 0.00 H new ATOM 708 N VAL A 48 5.036 2.423 -2.408 1.00 0.00 N ATOM 709 CA VAL A 48 6.033 3.476 -2.321 1.00 0.00 C ATOM 710 C VAL A 48 5.732 4.546 -3.373 1.00 0.00 C ATOM 711 O VAL A 48 5.784 5.740 -3.082 1.00 0.00 O ATOM 712 CB VAL A 48 7.436 2.882 -2.456 1.00 0.00 C ATOM 713 CG1 VAL A 48 8.475 3.978 -2.700 1.00 0.00 C ATOM 714 CG2 VAL A 48 7.799 2.046 -1.227 1.00 0.00 C ATOM 0 H VAL A 48 5.389 1.529 -2.748 1.00 0.00 H new ATOM 0 HA VAL A 48 5.993 3.960 -1.345 1.00 0.00 H new ATOM 0 HB VAL A 48 7.437 2.221 -3.323 1.00 0.00 H new ATOM 0 HG11 VAL A 48 9.464 3.528 -2.792 1.00 0.00 H new ATOM 0 HG12 VAL A 48 8.232 4.512 -3.619 1.00 0.00 H new ATOM 0 HG13 VAL A 48 8.471 4.676 -1.863 1.00 0.00 H new ATOM 0 HG21 VAL A 48 8.801 1.636 -1.349 1.00 0.00 H new ATOM 0 HG22 VAL A 48 7.771 2.675 -0.338 1.00 0.00 H new ATOM 0 HG23 VAL A 48 7.084 1.231 -1.117 1.00 0.00 H new ATOM 724 N SER A 49 5.425 4.078 -4.574 1.00 0.00 N ATOM 725 CA SER A 49 5.116 4.979 -5.671 1.00 0.00 C ATOM 726 C SER A 49 4.168 6.081 -5.192 1.00 0.00 C ATOM 727 O SER A 49 4.456 7.266 -5.354 1.00 0.00 O ATOM 728 CB SER A 49 4.498 4.222 -6.848 1.00 0.00 C ATOM 729 OG SER A 49 3.135 3.881 -6.607 1.00 0.00 O ATOM 0 H SER A 49 5.384 3.087 -4.811 1.00 0.00 H new ATOM 0 HA SER A 49 6.046 5.432 -6.014 1.00 0.00 H new ATOM 0 HB2 SER A 49 4.565 4.834 -7.748 1.00 0.00 H new ATOM 0 HB3 SER A 49 5.071 3.314 -7.036 1.00 0.00 H new ATOM 0 HG SER A 49 2.688 3.698 -7.460 1.00 0.00 H new ATOM 735 N ASN A 50 3.057 5.651 -4.612 1.00 0.00 N ATOM 736 CA ASN A 50 2.066 6.586 -4.109 1.00 0.00 C ATOM 737 C ASN A 50 2.531 7.140 -2.761 1.00 0.00 C ATOM 738 O ASN A 50 2.079 8.201 -2.332 1.00 0.00 O ATOM 739 CB ASN A 50 0.716 5.897 -3.896 1.00 0.00 C ATOM 740 CG ASN A 50 -0.163 6.017 -5.142 1.00 0.00 C ATOM 741 OD1 ASN A 50 -0.898 6.973 -5.325 1.00 0.00 O ATOM 742 ND2 ASN A 50 -0.047 4.996 -5.986 1.00 0.00 N ATOM 0 H ASN A 50 2.822 4.667 -4.479 1.00 0.00 H new ATOM 0 HA ASN A 50 1.952 7.383 -4.843 1.00 0.00 H new ATOM 0 HB2 ASN A 50 0.874 4.845 -3.658 1.00 0.00 H new ATOM 0 HB3 ASN A 50 0.206 6.344 -3.042 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -0.593 4.982 -6.848 1.00 0.00 H new ATOM 0 HD22 ASN A 50 0.588 4.227 -5.772 1.00 0.00 H new ATOM 749 N LYS A 51 3.430 6.398 -2.131 1.00 0.00 N ATOM 750 CA LYS A 51 3.962 6.802 -0.840 1.00 0.00 C ATOM 751 C LYS A 51 2.990 6.377 0.263 1.00 0.00 C ATOM 752 O LYS A 51 2.471 7.218 0.995 1.00 0.00 O ATOM 753 CB LYS A 51 4.281 8.298 -0.836 1.00 0.00 C ATOM 754 CG LYS A 51 5.020 8.705 -2.113 1.00 0.00 C ATOM 755 CD LYS A 51 6.535 8.684 -1.899 1.00 0.00 C ATOM 756 CE LYS A 51 7.267 8.347 -3.199 1.00 0.00 C ATOM 757 NZ LYS A 51 8.290 9.374 -3.499 1.00 0.00 N ATOM 0 H LYS A 51 3.804 5.519 -2.490 1.00 0.00 H new ATOM 0 HA LYS A 51 4.908 6.298 -0.643 1.00 0.00 H new ATOM 0 HB2 LYS A 51 3.357 8.870 -0.748 1.00 0.00 H new ATOM 0 HB3 LYS A 51 4.891 8.541 0.034 1.00 0.00 H new ATOM 0 HG2 LYS A 51 4.754 8.026 -2.924 1.00 0.00 H new ATOM 0 HG3 LYS A 51 4.706 9.703 -2.417 1.00 0.00 H new ATOM 0 HD2 LYS A 51 6.868 9.655 -1.531 1.00 0.00 H new ATOM 0 HD3 LYS A 51 6.788 7.950 -1.134 1.00 0.00 H new ATOM 0 HE2 LYS A 51 7.740 7.368 -3.114 1.00 0.00 H new ATOM 0 HE3 LYS A 51 6.553 8.286 -4.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 8.778 9.130 -4.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 7.831 10.302 -3.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 8.981 9.413 -2.723 1.00 0.00 H new ATOM 771 N LEU A 52 2.774 5.073 0.347 1.00 0.00 N ATOM 772 CA LEU A 52 1.874 4.526 1.348 1.00 0.00 C ATOM 773 C LEU A 52 2.674 4.153 2.598 1.00 0.00 C ATOM 774 O LEU A 52 2.114 4.036 3.686 1.00 0.00 O ATOM 775 CB LEU A 52 1.066 3.365 0.766 1.00 0.00 C ATOM 776 CG LEU A 52 -0.230 3.744 0.046 1.00 0.00 C ATOM 777 CD1 LEU A 52 -0.973 2.497 -0.437 1.00 0.00 C ATOM 778 CD2 LEU A 52 -1.110 4.629 0.931 1.00 0.00 C ATOM 0 H LEU A 52 3.207 4.379 -0.262 1.00 0.00 H new ATOM 0 HA LEU A 52 1.141 5.274 1.650 1.00 0.00 H new ATOM 0 HB2 LEU A 52 1.701 2.821 0.067 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.821 2.677 1.575 1.00 0.00 H new ATOM 0 HG LEU A 52 0.028 4.328 -0.838 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -1.890 2.794 -0.945 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -0.339 1.941 -1.128 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -1.219 1.867 0.417 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -2.025 4.884 0.396 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -1.363 4.092 1.846 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -0.571 5.542 1.183 1.00 0.00 H new ATOM 790 N VAL A 53 3.972 3.976 2.399 1.00 0.00 N ATOM 791 CA VAL A 53 4.855 3.618 3.496 1.00 0.00 C ATOM 792 C VAL A 53 6.066 4.554 3.497 1.00 0.00 C ATOM 793 O VAL A 53 6.120 5.505 2.719 1.00 0.00 O ATOM 794 CB VAL A 53 5.241 2.141 3.397 1.00 0.00 C ATOM 795 CG1 VAL A 53 4.022 1.241 3.605 1.00 0.00 C ATOM 796 CG2 VAL A 53 5.922 1.841 2.061 1.00 0.00 C ATOM 0 H VAL A 53 4.433 4.074 1.495 1.00 0.00 H new ATOM 0 HA VAL A 53 4.346 3.744 4.452 1.00 0.00 H new ATOM 0 HB VAL A 53 5.955 1.927 4.192 1.00 0.00 H new ATOM 0 HG11 VAL A 53 4.324 0.196 3.530 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.597 1.426 4.592 1.00 0.00 H new ATOM 0 HG13 VAL A 53 3.275 1.459 2.842 1.00 0.00 H new ATOM 0 HG21 VAL A 53 6.186 0.784 2.016 1.00 0.00 H new ATOM 0 HG22 VAL A 53 5.241 2.080 1.244 1.00 0.00 H new ATOM 0 HG23 VAL A 53 6.825 2.445 1.969 1.00 0.00 H new ATOM 806 N ARG A 54 7.007 4.251 4.378 1.00 0.00 N ATOM 807 CA ARG A 54 8.214 5.052 4.490 1.00 0.00 C ATOM 808 C ARG A 54 9.325 4.465 3.618 1.00 0.00 C ATOM 809 O ARG A 54 10.239 5.177 3.207 1.00 0.00 O ATOM 810 CB ARG A 54 8.697 5.122 5.940 1.00 0.00 C ATOM 811 CG ARG A 54 7.885 6.143 6.740 1.00 0.00 C ATOM 812 CD ARG A 54 8.701 6.695 7.911 1.00 0.00 C ATOM 813 NE ARG A 54 7.796 7.113 9.005 1.00 0.00 N ATOM 814 CZ ARG A 54 8.183 7.280 10.277 1.00 0.00 C ATOM 815 NH1 ARG A 54 9.460 7.067 10.623 1.00 0.00 N ATOM 816 NH2 ARG A 54 7.293 7.662 11.204 1.00 0.00 N ATOM 0 H ARG A 54 6.958 3.461 5.022 1.00 0.00 H new ATOM 0 HA ARG A 54 7.975 6.059 4.150 1.00 0.00 H new ATOM 0 HB2 ARG A 54 8.610 4.139 6.404 1.00 0.00 H new ATOM 0 HB3 ARG A 54 9.752 5.393 5.963 1.00 0.00 H new ATOM 0 HG2 ARG A 54 7.579 6.961 6.088 1.00 0.00 H new ATOM 0 HG3 ARG A 54 6.974 5.676 7.115 1.00 0.00 H new ATOM 0 HD2 ARG A 54 9.395 5.936 8.272 1.00 0.00 H new ATOM 0 HD3 ARG A 54 9.301 7.543 7.580 1.00 0.00 H new ATOM 0 HE ARG A 54 6.817 7.285 8.777 1.00 0.00 H new ATOM 0 HH11 ARG A 54 10.138 6.778 9.918 1.00 0.00 H new ATOM 0 HH12 ARG A 54 9.754 7.194 11.591 1.00 0.00 H new ATOM 0 HH21 ARG A 54 6.321 7.826 10.941 1.00 0.00 H new ATOM 0 HH22 ARG A 54 7.588 7.789 12.172 1.00 0.00 H new ATOM 830 N ASN A 55 9.209 3.170 3.360 1.00 0.00 N ATOM 831 CA ASN A 55 10.192 2.478 2.544 1.00 0.00 C ATOM 832 C ASN A 55 9.626 1.125 2.109 1.00 0.00 C ATOM 833 O ASN A 55 8.506 0.770 2.474 1.00 0.00 O ATOM 834 CB ASN A 55 11.479 2.221 3.331 1.00 0.00 C ATOM 835 CG ASN A 55 11.167 1.713 4.740 1.00 0.00 C ATOM 836 OD1 ASN A 55 11.224 0.529 5.027 1.00 0.00 O ATOM 837 ND2 ASN A 55 10.836 2.672 5.600 1.00 0.00 N ATOM 0 H ASN A 55 8.449 2.582 3.702 1.00 0.00 H new ATOM 0 HA ASN A 55 10.416 3.106 1.682 1.00 0.00 H new ATOM 0 HB2 ASN A 55 12.092 1.490 2.804 1.00 0.00 H new ATOM 0 HB3 ASN A 55 12.062 3.140 3.393 1.00 0.00 H new ATOM 0 HD21 ASN A 55 10.611 2.435 6.566 1.00 0.00 H new ATOM 0 HD22 ASN A 55 10.808 3.644 5.293 1.00 0.00 H new ATOM 844 N ARG A 56 10.425 0.407 1.334 1.00 0.00 N ATOM 845 CA ARG A 56 10.018 -0.899 0.845 1.00 0.00 C ATOM 846 C ARG A 56 9.729 -1.839 2.018 1.00 0.00 C ATOM 847 O ARG A 56 8.792 -2.634 1.965 1.00 0.00 O ATOM 848 CB ARG A 56 11.101 -1.518 -0.041 1.00 0.00 C ATOM 849 CG ARG A 56 10.482 -2.255 -1.230 1.00 0.00 C ATOM 850 CD ARG A 56 10.884 -1.599 -2.552 1.00 0.00 C ATOM 851 NE ARG A 56 9.869 -1.888 -3.590 1.00 0.00 N ATOM 852 CZ ARG A 56 9.865 -2.991 -4.350 1.00 0.00 C ATOM 853 NH1 ARG A 56 10.821 -3.917 -4.193 1.00 0.00 N ATOM 854 NH2 ARG A 56 8.904 -3.169 -5.267 1.00 0.00 N ATOM 0 H ARG A 56 11.353 0.705 1.032 1.00 0.00 H new ATOM 0 HA ARG A 56 9.113 -0.764 0.252 1.00 0.00 H new ATOM 0 HB2 ARG A 56 11.771 -0.737 -0.401 1.00 0.00 H new ATOM 0 HB3 ARG A 56 11.705 -2.210 0.546 1.00 0.00 H new ATOM 0 HG2 ARG A 56 10.804 -3.296 -1.224 1.00 0.00 H new ATOM 0 HG3 ARG A 56 9.396 -2.256 -1.136 1.00 0.00 H new ATOM 0 HD2 ARG A 56 10.982 -0.522 -2.418 1.00 0.00 H new ATOM 0 HD3 ARG A 56 11.858 -1.971 -2.871 1.00 0.00 H new ATOM 0 HE ARG A 56 9.126 -1.204 -3.736 1.00 0.00 H new ATOM 0 HH11 ARG A 56 11.552 -3.782 -3.495 1.00 0.00 H new ATOM 0 HH12 ARG A 56 10.818 -4.757 -4.772 1.00 0.00 H new ATOM 0 HH21 ARG A 56 8.176 -2.465 -5.386 1.00 0.00 H new ATOM 0 HH22 ARG A 56 8.901 -4.009 -5.846 1.00 0.00 H new ATOM 868 N GLN A 57 10.553 -1.717 3.048 1.00 0.00 N ATOM 869 CA GLN A 57 10.398 -2.545 4.232 1.00 0.00 C ATOM 870 C GLN A 57 8.947 -2.513 4.717 1.00 0.00 C ATOM 871 O GLN A 57 8.249 -3.524 4.667 1.00 0.00 O ATOM 872 CB GLN A 57 11.356 -2.103 5.340 1.00 0.00 C ATOM 873 CG GLN A 57 11.862 -3.306 6.139 1.00 0.00 C ATOM 874 CD GLN A 57 10.794 -3.806 7.114 1.00 0.00 C ATOM 875 OE1 GLN A 57 9.749 -3.202 7.293 1.00 0.00 O ATOM 876 NE2 GLN A 57 11.114 -4.939 7.732 1.00 0.00 N ATOM 0 H GLN A 57 11.330 -1.057 3.087 1.00 0.00 H new ATOM 0 HA GLN A 57 10.650 -3.572 3.968 1.00 0.00 H new ATOM 0 HB2 GLN A 57 12.201 -1.570 4.904 1.00 0.00 H new ATOM 0 HB3 GLN A 57 10.849 -1.406 6.007 1.00 0.00 H new ATOM 0 HG2 GLN A 57 12.141 -4.109 5.457 1.00 0.00 H new ATOM 0 HG3 GLN A 57 12.761 -3.029 6.690 1.00 0.00 H new ATOM 0 HE21 GLN A 57 12.006 -5.393 7.535 1.00 0.00 H new ATOM 0 HE22 GLN A 57 10.467 -5.354 8.403 1.00 0.00 H new ATOM 885 N GLU A 58 8.535 -1.339 5.174 1.00 0.00 N ATOM 886 CA GLU A 58 7.180 -1.161 5.667 1.00 0.00 C ATOM 887 C GLU A 58 6.185 -1.882 4.755 1.00 0.00 C ATOM 888 O GLU A 58 5.350 -2.652 5.228 1.00 0.00 O ATOM 889 CB GLU A 58 6.833 0.323 5.793 1.00 0.00 C ATOM 890 CG GLU A 58 7.108 0.833 7.209 1.00 0.00 C ATOM 891 CD GLU A 58 8.328 0.136 7.815 1.00 0.00 C ATOM 892 OE1 GLU A 58 9.374 0.125 7.130 1.00 0.00 O ATOM 893 OE2 GLU A 58 8.188 -0.370 8.949 1.00 0.00 O ATOM 0 H GLU A 58 9.116 -0.502 5.213 1.00 0.00 H new ATOM 0 HA GLU A 58 7.115 -1.601 6.662 1.00 0.00 H new ATOM 0 HB2 GLU A 58 7.418 0.899 5.076 1.00 0.00 H new ATOM 0 HB3 GLU A 58 5.783 0.477 5.545 1.00 0.00 H new ATOM 0 HG2 GLU A 58 7.274 1.910 7.186 1.00 0.00 H new ATOM 0 HG3 GLU A 58 6.235 0.659 7.838 1.00 0.00 H new ATOM 900 N GLY A 59 6.306 -1.607 3.465 1.00 0.00 N ATOM 901 CA GLY A 59 5.428 -2.219 2.483 1.00 0.00 C ATOM 902 C GLY A 59 5.463 -3.745 2.592 1.00 0.00 C ATOM 903 O GLY A 59 4.418 -4.388 2.685 1.00 0.00 O ATOM 0 H GLY A 59 7.000 -0.968 3.077 1.00 0.00 H new ATOM 0 HA2 GLY A 59 4.408 -1.864 2.630 1.00 0.00 H new ATOM 0 HA3 GLY A 59 5.730 -1.915 1.481 1.00 0.00 H new ATOM 907 N LEU A 60 6.675 -4.280 2.578 1.00 0.00 N ATOM 908 CA LEU A 60 6.859 -5.718 2.674 1.00 0.00 C ATOM 909 C LEU A 60 5.961 -6.270 3.783 1.00 0.00 C ATOM 910 O LEU A 60 5.282 -7.277 3.593 1.00 0.00 O ATOM 911 CB LEU A 60 8.340 -6.057 2.857 1.00 0.00 C ATOM 912 CG LEU A 60 8.722 -7.525 2.654 1.00 0.00 C ATOM 913 CD1 LEU A 60 8.934 -8.227 3.996 1.00 0.00 C ATOM 914 CD2 LEU A 60 7.687 -8.246 1.787 1.00 0.00 C ATOM 0 H LEU A 60 7.539 -3.743 2.502 1.00 0.00 H new ATOM 0 HA LEU A 60 6.556 -6.204 1.746 1.00 0.00 H new ATOM 0 HB2 LEU A 60 8.920 -5.452 2.160 1.00 0.00 H new ATOM 0 HB3 LEU A 60 8.639 -5.760 3.862 1.00 0.00 H new ATOM 0 HG LEU A 60 9.671 -7.560 2.119 1.00 0.00 H new ATOM 0 HD11 LEU A 60 9.204 -9.269 3.823 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.735 -7.730 4.544 1.00 0.00 H new ATOM 0 HD13 LEU A 60 8.014 -8.183 4.579 1.00 0.00 H new ATOM 0 HD21 LEU A 60 7.982 -9.287 1.658 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.712 -8.203 2.272 1.00 0.00 H new ATOM 0 HD23 LEU A 60 7.629 -7.762 0.812 1.00 0.00 H new ATOM 926 N MET A 61 5.987 -5.586 4.918 1.00 0.00 N ATOM 927 CA MET A 61 5.183 -5.995 6.057 1.00 0.00 C ATOM 928 C MET A 61 3.693 -5.783 5.781 1.00 0.00 C ATOM 929 O MET A 61 2.907 -6.727 5.840 1.00 0.00 O ATOM 930 CB MET A 61 5.595 -5.186 7.289 1.00 0.00 C ATOM 931 CG MET A 61 7.114 -5.200 7.471 1.00 0.00 C ATOM 932 SD MET A 61 7.542 -4.563 9.083 1.00 0.00 S ATOM 933 CE MET A 61 6.448 -3.154 9.160 1.00 0.00 C ATOM 0 H MET A 61 6.552 -4.751 5.073 1.00 0.00 H new ATOM 0 HA MET A 61 5.352 -7.057 6.235 1.00 0.00 H new ATOM 0 HB2 MET A 61 5.247 -4.158 7.187 1.00 0.00 H new ATOM 0 HB3 MET A 61 5.115 -5.598 8.176 1.00 0.00 H new ATOM 0 HG2 MET A 61 7.492 -6.216 7.360 1.00 0.00 H new ATOM 0 HG3 MET A 61 7.587 -4.598 6.696 1.00 0.00 H new ATOM 0 HE1 MET A 61 6.860 -2.411 9.842 1.00 0.00 H new ATOM 0 HE2 MET A 61 6.346 -2.718 8.166 1.00 0.00 H new ATOM 0 HE3 MET A 61 5.469 -3.473 9.518 1.00 0.00 H new ATOM 943 N ILE A 62 3.350 -4.537 5.487 1.00 0.00 N ATOM 944 CA ILE A 62 1.968 -4.190 5.202 1.00 0.00 C ATOM 945 C ILE A 62 1.406 -5.161 4.162 1.00 0.00 C ATOM 946 O ILE A 62 0.354 -5.763 4.375 1.00 0.00 O ATOM 947 CB ILE A 62 1.859 -2.720 4.792 1.00 0.00 C ATOM 948 CG1 ILE A 62 2.392 -1.802 5.895 1.00 0.00 C ATOM 949 CG2 ILE A 62 0.425 -2.366 4.395 1.00 0.00 C ATOM 950 CD1 ILE A 62 1.307 -1.505 6.932 1.00 0.00 C ATOM 0 H ILE A 62 4.005 -3.756 5.440 1.00 0.00 H new ATOM 0 HA ILE A 62 1.357 -4.294 6.099 1.00 0.00 H new ATOM 0 HB ILE A 62 2.484 -2.564 3.913 1.00 0.00 H new ATOM 0 HG12 ILE A 62 3.247 -2.271 6.382 1.00 0.00 H new ATOM 0 HG13 ILE A 62 2.747 -0.869 5.457 1.00 0.00 H new ATOM 0 HG21 ILE A 62 0.376 -1.316 4.108 1.00 0.00 H new ATOM 0 HG22 ILE A 62 0.117 -2.987 3.554 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -0.241 -2.543 5.240 1.00 0.00 H new ATOM 0 HD11 ILE A 62 1.711 -0.851 7.705 1.00 0.00 H new ATOM 0 HD12 ILE A 62 0.464 -1.014 6.446 1.00 0.00 H new ATOM 0 HD13 ILE A 62 0.972 -2.438 7.385 1.00 0.00 H new ATOM 962 N SER A 63 2.132 -5.284 3.061 1.00 0.00 N ATOM 963 CA SER A 63 1.719 -6.173 1.988 1.00 0.00 C ATOM 964 C SER A 63 1.155 -7.470 2.570 1.00 0.00 C ATOM 965 O SER A 63 0.074 -7.910 2.184 1.00 0.00 O ATOM 966 CB SER A 63 2.885 -6.477 1.045 1.00 0.00 C ATOM 967 OG SER A 63 3.067 -5.450 0.074 1.00 0.00 O ATOM 0 H SER A 63 3.004 -4.783 2.888 1.00 0.00 H new ATOM 0 HA SER A 63 0.941 -5.673 1.411 1.00 0.00 H new ATOM 0 HB2 SER A 63 3.800 -6.593 1.626 1.00 0.00 H new ATOM 0 HB3 SER A 63 2.705 -7.426 0.540 1.00 0.00 H new ATOM 0 HG SER A 63 3.355 -5.849 -0.774 1.00 0.00 H new ATOM 973 N ALA A 64 1.914 -8.047 3.491 1.00 0.00 N ATOM 974 CA ALA A 64 1.503 -9.285 4.131 1.00 0.00 C ATOM 975 C ALA A 64 0.103 -9.109 4.722 1.00 0.00 C ATOM 976 O ALA A 64 -0.761 -9.967 4.546 1.00 0.00 O ATOM 977 CB ALA A 64 2.537 -9.681 5.188 1.00 0.00 C ATOM 0 H ALA A 64 2.811 -7.680 3.809 1.00 0.00 H new ATOM 0 HA ALA A 64 1.454 -10.095 3.403 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.229 -10.610 5.668 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.507 -9.823 4.712 1.00 0.00 H new ATOM 0 HB3 ALA A 64 2.612 -8.893 5.937 1.00 0.00 H new ATOM 983 N SER A 65 -0.078 -7.992 5.410 1.00 0.00 N ATOM 984 CA SER A 65 -1.359 -7.692 6.028 1.00 0.00 C ATOM 985 C SER A 65 -2.463 -7.693 4.969 1.00 0.00 C ATOM 986 O SER A 65 -3.588 -8.109 5.241 1.00 0.00 O ATOM 987 CB SER A 65 -1.319 -6.346 6.753 1.00 0.00 C ATOM 988 OG SER A 65 -1.796 -6.446 8.092 1.00 0.00 O ATOM 0 H SER A 65 0.641 -7.283 5.554 1.00 0.00 H new ATOM 0 HA SER A 65 -1.572 -8.465 6.767 1.00 0.00 H new ATOM 0 HB2 SER A 65 -0.297 -5.968 6.760 1.00 0.00 H new ATOM 0 HB3 SER A 65 -1.923 -5.622 6.206 1.00 0.00 H new ATOM 0 HG SER A 65 -1.753 -5.566 8.521 1.00 0.00 H new ATOM 994 N LEU A 66 -2.103 -7.221 3.784 1.00 0.00 N ATOM 995 CA LEU A 66 -3.050 -7.162 2.683 1.00 0.00 C ATOM 996 C LEU A 66 -3.398 -8.584 2.238 1.00 0.00 C ATOM 997 O LEU A 66 -4.567 -8.965 2.223 1.00 0.00 O ATOM 998 CB LEU A 66 -2.507 -6.281 1.557 1.00 0.00 C ATOM 999 CG LEU A 66 -2.516 -4.774 1.820 1.00 0.00 C ATOM 1000 CD1 LEU A 66 -1.519 -4.052 0.911 1.00 0.00 C ATOM 1001 CD2 LEU A 66 -3.930 -4.203 1.688 1.00 0.00 C ATOM 0 H LEU A 66 -1.169 -6.876 3.562 1.00 0.00 H new ATOM 0 HA LEU A 66 -3.979 -6.692 3.005 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -1.482 -6.587 1.346 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -3.090 -6.476 0.657 1.00 0.00 H new ATOM 0 HG LEU A 66 -2.195 -4.605 2.848 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.546 -2.982 1.119 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.515 -4.433 1.097 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.785 -4.226 -0.132 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -3.909 -3.130 1.880 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -4.303 -4.384 0.680 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -4.587 -4.688 2.410 1.00 0.00 H new ATOM 1013 N LEU A 67 -2.361 -9.330 1.887 1.00 0.00 N ATOM 1014 CA LEU A 67 -2.542 -10.702 1.443 1.00 0.00 C ATOM 1015 C LEU A 67 -3.314 -11.481 2.509 1.00 0.00 C ATOM 1016 O LEU A 67 -4.390 -12.012 2.239 1.00 0.00 O ATOM 1017 CB LEU A 67 -1.195 -11.329 1.077 1.00 0.00 C ATOM 1018 CG LEU A 67 -1.186 -12.850 0.913 1.00 0.00 C ATOM 1019 CD1 LEU A 67 -1.001 -13.243 -0.554 1.00 0.00 C ATOM 1020 CD2 LEU A 67 -0.131 -13.492 1.816 1.00 0.00 C ATOM 0 H LEU A 67 -1.392 -9.010 1.901 1.00 0.00 H new ATOM 0 HA LEU A 67 -3.139 -10.732 0.532 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -0.849 -10.881 0.145 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -0.471 -11.062 1.847 1.00 0.00 H new ATOM 0 HG LEU A 67 -2.156 -13.233 1.228 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.998 -14.329 -0.642 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.819 -12.833 -1.146 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.054 -12.847 -0.920 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -0.145 -14.573 1.680 1.00 0.00 H new ATOM 0 HD22 LEU A 67 0.855 -13.107 1.555 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.350 -13.254 2.857 1.00 0.00 H new ATOM 1032 N SER A 68 -2.734 -11.525 3.700 1.00 0.00 N ATOM 1033 CA SER A 68 -3.353 -12.231 4.809 1.00 0.00 C ATOM 1034 C SER A 68 -4.868 -12.017 4.783 1.00 0.00 C ATOM 1035 O SER A 68 -5.628 -12.962 4.578 1.00 0.00 O ATOM 1036 CB SER A 68 -2.775 -11.769 6.148 1.00 0.00 C ATOM 1037 OG SER A 68 -2.034 -12.801 6.794 1.00 0.00 O ATOM 0 H SER A 68 -1.842 -11.083 3.921 1.00 0.00 H new ATOM 0 HA SER A 68 -3.140 -13.294 4.700 1.00 0.00 H new ATOM 0 HB2 SER A 68 -2.129 -10.906 5.986 1.00 0.00 H new ATOM 0 HB3 SER A 68 -3.586 -11.442 6.799 1.00 0.00 H new ATOM 0 HG SER A 68 -1.680 -12.466 7.644 1.00 0.00 H new ATOM 1043 N GLU A 69 -5.262 -10.770 4.994 1.00 0.00 N ATOM 1044 CA GLU A 69 -6.672 -10.421 4.998 1.00 0.00 C ATOM 1045 C GLU A 69 -7.408 -11.171 3.886 1.00 0.00 C ATOM 1046 O GLU A 69 -8.549 -11.592 4.066 1.00 0.00 O ATOM 1047 CB GLU A 69 -6.863 -8.909 4.860 1.00 0.00 C ATOM 1048 CG GLU A 69 -6.469 -8.186 6.149 1.00 0.00 C ATOM 1049 CD GLU A 69 -7.483 -8.458 7.262 1.00 0.00 C ATOM 1050 OE1 GLU A 69 -8.629 -7.982 7.114 1.00 0.00 O ATOM 1051 OE2 GLU A 69 -7.088 -9.136 8.236 1.00 0.00 O ATOM 0 H GLU A 69 -4.629 -9.988 5.164 1.00 0.00 H new ATOM 0 HA GLU A 69 -7.098 -10.722 5.955 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -6.260 -8.537 4.032 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -7.904 -8.691 4.620 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -5.479 -8.514 6.466 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -6.406 -7.114 5.964 1.00 0.00 H new ATOM 1058 N GLY A 70 -6.724 -11.314 2.760 1.00 0.00 N ATOM 1059 CA GLY A 70 -7.298 -12.006 1.619 1.00 0.00 C ATOM 1060 C GLY A 70 -7.525 -11.043 0.451 1.00 0.00 C ATOM 1061 O GLY A 70 -8.287 -11.342 -0.466 1.00 0.00 O ATOM 0 H GLY A 70 -5.778 -10.962 2.614 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -6.634 -12.812 1.307 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.244 -12.465 1.906 1.00 0.00 H new ATOM 1065 N TYR A 71 -6.848 -9.906 0.524 1.00 0.00 N ATOM 1066 CA TYR A 71 -6.966 -8.897 -0.515 1.00 0.00 C ATOM 1067 C TYR A 71 -6.137 -9.276 -1.744 1.00 0.00 C ATOM 1068 O TYR A 71 -6.327 -8.717 -2.823 1.00 0.00 O ATOM 1069 CB TYR A 71 -6.406 -7.606 0.085 1.00 0.00 C ATOM 1070 CG TYR A 71 -7.337 -6.934 1.096 1.00 0.00 C ATOM 1071 CD1 TYR A 71 -8.619 -6.584 0.726 1.00 0.00 C ATOM 1072 CD2 TYR A 71 -6.894 -6.679 2.378 1.00 0.00 C ATOM 1073 CE1 TYR A 71 -9.496 -5.952 1.678 1.00 0.00 C ATOM 1074 CE2 TYR A 71 -7.771 -6.046 3.329 1.00 0.00 C ATOM 1075 CZ TYR A 71 -9.028 -5.714 2.932 1.00 0.00 C ATOM 1076 OH TYR A 71 -9.856 -5.117 3.831 1.00 0.00 O ATOM 0 H TYR A 71 -6.216 -9.661 1.286 1.00 0.00 H new ATOM 0 HA TYR A 71 -8.003 -8.794 -0.834 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -5.456 -7.826 0.572 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -6.195 -6.904 -0.722 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -8.965 -6.784 -0.277 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -5.891 -6.954 2.668 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -10.502 -5.674 1.402 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -7.437 -5.840 4.335 1.00 0.00 H new ATOM 0 HH TYR A 71 -9.389 -5.010 4.686 1.00 0.00 H new ATOM 1086 N LEU A 72 -5.234 -10.225 -1.539 1.00 0.00 N ATOM 1087 CA LEU A 72 -4.376 -10.685 -2.617 1.00 0.00 C ATOM 1088 C LEU A 72 -4.225 -12.206 -2.529 1.00 0.00 C ATOM 1089 O LEU A 72 -3.734 -12.728 -1.530 1.00 0.00 O ATOM 1090 CB LEU A 72 -3.043 -9.934 -2.599 1.00 0.00 C ATOM 1091 CG LEU A 72 -3.134 -8.407 -2.625 1.00 0.00 C ATOM 1092 CD1 LEU A 72 -1.834 -7.771 -2.128 1.00 0.00 C ATOM 1093 CD2 LEU A 72 -3.523 -7.904 -4.017 1.00 0.00 C ATOM 0 H LEU A 72 -5.079 -10.687 -0.643 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.828 -10.463 -3.584 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.494 -10.230 -1.705 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -2.454 -10.258 -3.457 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.924 -8.101 -1.940 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -1.926 -6.685 -2.157 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.640 -8.092 -1.104 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -1.009 -8.082 -2.768 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -3.581 -6.816 -4.008 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -2.773 -8.221 -4.741 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -4.493 -8.316 -4.295 1.00 0.00 H new ATOM 1105 N GLN A 73 -4.657 -12.873 -3.589 1.00 0.00 N ATOM 1106 CA GLN A 73 -4.577 -14.323 -3.645 1.00 0.00 C ATOM 1107 C GLN A 73 -3.257 -14.757 -4.287 1.00 0.00 C ATOM 1108 O GLN A 73 -2.772 -14.111 -5.214 1.00 0.00 O ATOM 1109 CB GLN A 73 -5.772 -14.910 -4.397 1.00 0.00 C ATOM 1110 CG GLN A 73 -7.067 -14.715 -3.606 1.00 0.00 C ATOM 1111 CD GLN A 73 -7.177 -15.738 -2.473 1.00 0.00 C ATOM 1112 OE1 GLN A 73 -6.843 -16.902 -2.619 1.00 0.00 O ATOM 1113 NE2 GLN A 73 -7.662 -15.239 -1.340 1.00 0.00 N ATOM 0 H GLN A 73 -5.064 -12.436 -4.416 1.00 0.00 H new ATOM 0 HA GLN A 73 -4.607 -14.709 -2.626 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -5.862 -14.433 -5.373 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -5.607 -15.973 -4.576 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -7.097 -13.706 -3.194 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -7.923 -14.813 -4.273 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -7.922 -14.254 -1.287 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -7.774 -15.841 -0.524 1.00 0.00 H new ATOM 1122 N PRO A 74 -2.700 -15.877 -3.754 1.00 0.00 N ATOM 1123 CA PRO A 74 -1.447 -16.405 -4.264 1.00 0.00 C ATOM 1124 C PRO A 74 -1.654 -17.107 -5.609 1.00 0.00 C ATOM 1125 O PRO A 74 -2.723 -17.659 -5.866 1.00 0.00 O ATOM 1126 CB PRO A 74 -0.942 -17.341 -3.178 1.00 0.00 C ATOM 1127 CG PRO A 74 -2.148 -17.660 -2.310 1.00 0.00 C ATOM 1128 CD PRO A 74 -3.246 -16.668 -2.654 1.00 0.00 C ATOM 0 HA PRO A 74 -0.715 -15.624 -4.470 1.00 0.00 H new ATOM 0 HB2 PRO A 74 -0.520 -18.249 -3.610 1.00 0.00 H new ATOM 0 HB3 PRO A 74 -0.153 -16.870 -2.592 1.00 0.00 H new ATOM 0 HG2 PRO A 74 -2.487 -18.681 -2.488 1.00 0.00 H new ATOM 0 HG3 PRO A 74 -1.887 -17.590 -1.254 1.00 0.00 H new ATOM 0 HD2 PRO A 74 -4.162 -17.179 -2.950 1.00 0.00 H new ATOM 0 HD3 PRO A 74 -3.494 -16.039 -1.799 1.00 0.00 H new ATOM 1136 N ALA A 75 -0.616 -17.061 -6.430 1.00 0.00 N ATOM 1137 CA ALA A 75 -0.671 -17.685 -7.741 1.00 0.00 C ATOM 1138 C ALA A 75 0.734 -18.136 -8.146 1.00 0.00 C ATOM 1139 O ALA A 75 1.619 -17.308 -8.354 1.00 0.00 O ATOM 1140 CB ALA A 75 -1.282 -16.707 -8.747 1.00 0.00 C ATOM 0 H ALA A 75 0.268 -16.601 -6.213 1.00 0.00 H new ATOM 0 HA ALA A 75 -1.307 -18.570 -7.718 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -1.323 -17.175 -9.731 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -2.290 -16.441 -8.429 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -0.668 -15.808 -8.799 1.00 0.00 H new ATOM 1146 N GLY A 76 0.894 -19.447 -8.246 1.00 0.00 N ATOM 1147 CA GLY A 76 2.176 -20.018 -8.622 1.00 0.00 C ATOM 1148 C GLY A 76 2.613 -21.091 -7.623 1.00 0.00 C ATOM 1149 O GLY A 76 1.942 -22.109 -7.467 1.00 0.00 O ATOM 0 H GLY A 76 0.157 -20.131 -8.073 1.00 0.00 H new ATOM 0 HA2 GLY A 76 2.106 -20.452 -9.620 1.00 0.00 H new ATOM 0 HA3 GLY A 76 2.929 -19.231 -8.668 1.00 0.00 H new ATOM 1153 N ASP A 77 3.737 -20.826 -6.973 1.00 0.00 N ATOM 1154 CA ASP A 77 4.271 -21.756 -5.993 1.00 0.00 C ATOM 1155 C ASP A 77 4.839 -20.972 -4.808 1.00 0.00 C ATOM 1156 O ASP A 77 4.385 -21.134 -3.676 1.00 0.00 O ATOM 1157 CB ASP A 77 5.403 -22.595 -6.590 1.00 0.00 C ATOM 1158 CG ASP A 77 5.442 -24.052 -6.126 1.00 0.00 C ATOM 1159 OD1 ASP A 77 5.524 -24.254 -4.896 1.00 0.00 O ATOM 1160 OD2 ASP A 77 5.388 -24.931 -7.013 1.00 0.00 O ATOM 0 H ASP A 77 4.292 -19.981 -7.106 1.00 0.00 H new ATOM 0 HA ASP A 77 3.462 -22.414 -5.677 1.00 0.00 H new ATOM 0 HB2 ASP A 77 5.314 -22.578 -7.676 1.00 0.00 H new ATOM 0 HB3 ASP A 77 6.354 -22.124 -6.341 1.00 0.00 H new ATOM 1165 N LEU A 78 5.823 -20.137 -5.109 1.00 0.00 N ATOM 1166 CA LEU A 78 6.457 -19.327 -4.082 1.00 0.00 C ATOM 1167 C LEU A 78 5.387 -18.784 -3.134 1.00 0.00 C ATOM 1168 O LEU A 78 5.268 -19.242 -1.999 1.00 0.00 O ATOM 1169 CB LEU A 78 7.325 -18.239 -4.718 1.00 0.00 C ATOM 1170 CG LEU A 78 8.798 -18.594 -4.929 1.00 0.00 C ATOM 1171 CD1 LEU A 78 8.964 -19.588 -6.080 1.00 0.00 C ATOM 1172 CD2 LEU A 78 9.642 -17.334 -5.134 1.00 0.00 C ATOM 0 H LEU A 78 6.197 -20.004 -6.049 1.00 0.00 H new ATOM 0 HA LEU A 78 7.136 -19.934 -3.483 1.00 0.00 H new ATOM 0 HB2 LEU A 78 6.893 -17.976 -5.684 1.00 0.00 H new ATOM 0 HB3 LEU A 78 7.273 -17.348 -4.092 1.00 0.00 H new ATOM 0 HG LEU A 78 9.163 -19.083 -4.026 1.00 0.00 H new ATOM 0 HD11 LEU A 78 10.021 -19.823 -6.208 1.00 0.00 H new ATOM 0 HD12 LEU A 78 8.414 -20.501 -5.854 1.00 0.00 H new ATOM 0 HD13 LEU A 78 8.576 -19.149 -6.999 1.00 0.00 H new ATOM 0 HD21 LEU A 78 10.685 -17.615 -5.282 1.00 0.00 H new ATOM 0 HD22 LEU A 78 9.284 -16.795 -6.011 1.00 0.00 H new ATOM 0 HD23 LEU A 78 9.559 -16.694 -4.256 1.00 0.00 H new ATOM 1184 N SER A 79 4.635 -17.814 -3.634 1.00 0.00 N ATOM 1185 CA SER A 79 3.579 -17.204 -2.846 1.00 0.00 C ATOM 1186 C SER A 79 2.812 -18.280 -2.076 1.00 0.00 C ATOM 1187 O SER A 79 2.640 -18.177 -0.862 1.00 0.00 O ATOM 1188 CB SER A 79 2.623 -16.402 -3.732 1.00 0.00 C ATOM 1189 OG SER A 79 2.395 -17.041 -4.985 1.00 0.00 O ATOM 0 H SER A 79 4.737 -17.436 -4.576 1.00 0.00 H new ATOM 0 HA SER A 79 4.037 -16.515 -2.136 1.00 0.00 H new ATOM 0 HB2 SER A 79 1.673 -16.270 -3.214 1.00 0.00 H new ATOM 0 HB3 SER A 79 3.034 -15.407 -3.902 1.00 0.00 H new ATOM 0 HG SER A 79 2.213 -16.364 -5.669 1.00 0.00 H new ATOM 1195 N LYS A 80 2.371 -19.289 -2.813 1.00 0.00 N ATOM 1196 CA LYS A 80 1.626 -20.384 -2.215 1.00 0.00 C ATOM 1197 C LYS A 80 2.400 -20.924 -1.011 1.00 0.00 C ATOM 1198 O LYS A 80 1.935 -20.833 0.123 1.00 0.00 O ATOM 1199 CB LYS A 80 1.300 -21.447 -3.265 1.00 0.00 C ATOM 1200 CG LYS A 80 0.028 -21.086 -4.035 1.00 0.00 C ATOM 1201 CD LYS A 80 -0.200 -22.051 -5.200 1.00 0.00 C ATOM 1202 CE LYS A 80 -1.682 -22.401 -5.341 1.00 0.00 C ATOM 1203 NZ LYS A 80 -1.874 -23.868 -5.317 1.00 0.00 N ATOM 0 H LYS A 80 2.515 -19.371 -3.819 1.00 0.00 H new ATOM 0 HA LYS A 80 0.664 -20.032 -1.843 1.00 0.00 H new ATOM 0 HB2 LYS A 80 2.134 -21.545 -3.960 1.00 0.00 H new ATOM 0 HB3 LYS A 80 1.173 -22.415 -2.780 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -0.829 -21.114 -3.362 1.00 0.00 H new ATOM 0 HG3 LYS A 80 0.104 -20.066 -4.412 1.00 0.00 H new ATOM 0 HD2 LYS A 80 0.161 -21.601 -6.125 1.00 0.00 H new ATOM 0 HD3 LYS A 80 0.379 -22.961 -5.041 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -2.249 -21.941 -4.531 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -2.071 -21.993 -6.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -2.886 -24.087 -5.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -1.349 -24.300 -6.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -1.522 -24.250 -4.416 1.00 0.00 H new ATOM 1217 N ASN A 81 3.570 -21.476 -1.300 1.00 0.00 N ATOM 1218 CA ASN A 81 4.414 -22.032 -0.256 1.00 0.00 C ATOM 1219 C ASN A 81 4.464 -21.060 0.924 1.00 0.00 C ATOM 1220 O ASN A 81 4.349 -21.472 2.078 1.00 0.00 O ATOM 1221 CB ASN A 81 5.844 -22.241 -0.757 1.00 0.00 C ATOM 1222 CG ASN A 81 6.217 -23.725 -0.744 1.00 0.00 C ATOM 1223 OD1 ASN A 81 6.830 -24.230 0.182 1.00 0.00 O ATOM 1224 ND2 ASN A 81 5.816 -24.393 -1.822 1.00 0.00 N ATOM 0 H ASN A 81 3.953 -21.550 -2.242 1.00 0.00 H new ATOM 0 HA ASN A 81 3.993 -22.992 0.043 1.00 0.00 H new ATOM 0 HB2 ASN A 81 5.940 -21.847 -1.769 1.00 0.00 H new ATOM 0 HB3 ASN A 81 6.538 -21.682 -0.130 1.00 0.00 H new ATOM 0 HD21 ASN A 81 6.018 -25.389 -1.909 1.00 0.00 H new ATOM 0 HD22 ASN A 81 5.306 -23.909 -2.561 1.00 0.00 H new ATOM 1231 N ALA A 82 4.634 -19.788 0.595 1.00 0.00 N ATOM 1232 CA ALA A 82 4.701 -18.754 1.614 1.00 0.00 C ATOM 1233 C ALA A 82 3.488 -18.876 2.538 1.00 0.00 C ATOM 1234 O ALA A 82 3.636 -19.143 3.730 1.00 0.00 O ATOM 1235 CB ALA A 82 4.787 -17.381 0.943 1.00 0.00 C ATOM 0 H ALA A 82 4.727 -19.450 -0.363 1.00 0.00 H new ATOM 0 HA ALA A 82 5.595 -18.875 2.226 1.00 0.00 H new ATOM 0 HB1 ALA A 82 4.837 -16.605 1.707 1.00 0.00 H new ATOM 0 HB2 ALA A 82 5.681 -17.336 0.320 1.00 0.00 H new ATOM 0 HB3 ALA A 82 3.904 -17.223 0.323 1.00 0.00 H new ATOM 1241 N ALA A 83 2.316 -18.674 1.954 1.00 0.00 N ATOM 1242 CA ALA A 83 1.078 -18.758 2.710 1.00 0.00 C ATOM 1243 C ALA A 83 1.136 -19.972 3.641 1.00 0.00 C ATOM 1244 O ALA A 83 0.698 -19.900 4.788 1.00 0.00 O ATOM 1245 CB ALA A 83 -0.107 -18.819 1.745 1.00 0.00 C ATOM 0 H ALA A 83 2.198 -18.452 0.965 1.00 0.00 H new ATOM 0 HA ALA A 83 0.946 -17.872 3.331 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -1.035 -18.882 2.312 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -0.120 -17.921 1.127 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -0.012 -19.697 1.107 1.00 0.00 H new ATOM 1251 N ASP A 84 1.679 -21.058 3.112 1.00 0.00 N ATOM 1252 CA ASP A 84 1.799 -22.285 3.880 1.00 0.00 C ATOM 1253 C ASP A 84 2.404 -21.967 5.249 1.00 0.00 C ATOM 1254 O ASP A 84 1.927 -22.458 6.271 1.00 0.00 O ATOM 1255 CB ASP A 84 2.719 -23.287 3.179 1.00 0.00 C ATOM 1256 CG ASP A 84 2.304 -24.753 3.317 1.00 0.00 C ATOM 1257 OD1 ASP A 84 1.285 -24.992 4.000 1.00 0.00 O ATOM 1258 OD2 ASP A 84 3.015 -25.601 2.737 1.00 0.00 O ATOM 0 H ASP A 84 2.041 -21.114 2.160 1.00 0.00 H new ATOM 0 HA ASP A 84 0.804 -22.718 3.980 1.00 0.00 H new ATOM 0 HB2 ASP A 84 2.764 -23.036 2.119 1.00 0.00 H new ATOM 0 HB3 ASP A 84 3.727 -23.172 3.577 1.00 0.00 H new ATOM 1263 N GLY A 85 3.444 -21.147 5.225 1.00 0.00 N ATOM 1264 CA GLY A 85 4.119 -20.758 6.452 1.00 0.00 C ATOM 1265 C GLY A 85 5.487 -20.141 6.153 1.00 0.00 C ATOM 1266 O GLY A 85 5.612 -18.922 6.045 1.00 0.00 O ATOM 0 H GLY A 85 3.836 -20.741 4.375 1.00 0.00 H new ATOM 0 HA2 GLY A 85 3.505 -20.042 6.998 1.00 0.00 H new ATOM 0 HA3 GLY A 85 4.242 -21.629 7.096 1.00 0.00 H new ATOM 1270 N ILE A 86 6.478 -21.011 6.029 1.00 0.00 N ATOM 1271 CA ILE A 86 7.832 -20.567 5.745 1.00 0.00 C ATOM 1272 C ILE A 86 8.401 -19.858 6.976 1.00 0.00 C ATOM 1273 O ILE A 86 9.480 -20.204 7.453 1.00 0.00 O ATOM 1274 CB ILE A 86 7.861 -19.713 4.476 1.00 0.00 C ATOM 1275 CG1 ILE A 86 7.892 -20.592 3.224 1.00 0.00 C ATOM 1276 CG2 ILE A 86 9.026 -18.721 4.508 1.00 0.00 C ATOM 1277 CD1 ILE A 86 7.927 -19.738 1.955 1.00 0.00 C ATOM 0 H ILE A 86 6.371 -22.021 6.120 1.00 0.00 H new ATOM 0 HA ILE A 86 8.478 -21.421 5.542 1.00 0.00 H new ATOM 0 HB ILE A 86 6.942 -19.129 4.437 1.00 0.00 H new ATOM 0 HG12 ILE A 86 8.766 -21.242 3.253 1.00 0.00 H new ATOM 0 HG13 ILE A 86 7.015 -21.239 3.207 1.00 0.00 H new ATOM 0 HG21 ILE A 86 9.023 -18.127 3.594 1.00 0.00 H new ATOM 0 HG22 ILE A 86 8.919 -18.062 5.370 1.00 0.00 H new ATOM 0 HG23 ILE A 86 9.967 -19.267 4.583 1.00 0.00 H new ATOM 0 HD11 ILE A 86 7.949 -20.387 1.080 1.00 0.00 H new ATOM 0 HD12 ILE A 86 7.039 -19.107 1.917 1.00 0.00 H new ATOM 0 HD13 ILE A 86 8.818 -19.110 1.963 1.00 0.00 H new ATOM 1289 N ALA A 87 7.648 -18.878 7.455 1.00 0.00 N ATOM 1290 CA ALA A 87 8.063 -18.118 8.621 1.00 0.00 C ATOM 1291 C ALA A 87 6.877 -17.303 9.142 1.00 0.00 C ATOM 1292 O ALA A 87 5.777 -17.831 9.296 1.00 0.00 O ATOM 1293 CB ALA A 87 9.260 -17.237 8.257 1.00 0.00 C ATOM 0 H ALA A 87 6.753 -18.593 7.056 1.00 0.00 H new ATOM 0 HA ALA A 87 8.381 -18.786 9.421 1.00 0.00 H new ATOM 0 HB1 ALA A 87 9.571 -16.667 9.132 1.00 0.00 H new ATOM 0 HB2 ALA A 87 10.085 -17.865 7.921 1.00 0.00 H new ATOM 0 HB3 ALA A 87 8.977 -16.551 7.459 1.00 0.00 H new ATOM 1299 N GLU A 88 7.142 -16.031 9.400 1.00 0.00 N ATOM 1300 CA GLU A 88 6.110 -15.138 9.901 1.00 0.00 C ATOM 1301 C GLU A 88 5.770 -14.079 8.851 1.00 0.00 C ATOM 1302 O GLU A 88 5.140 -13.070 9.164 1.00 0.00 O ATOM 1303 CB GLU A 88 6.540 -14.488 11.217 1.00 0.00 C ATOM 1304 CG GLU A 88 5.615 -14.906 12.362 1.00 0.00 C ATOM 1305 CD GLU A 88 4.633 -13.786 12.711 1.00 0.00 C ATOM 1306 OE1 GLU A 88 3.850 -13.417 11.809 1.00 0.00 O ATOM 1307 OE2 GLU A 88 4.687 -13.324 13.871 1.00 0.00 O ATOM 0 H GLU A 88 8.056 -15.597 9.272 1.00 0.00 H new ATOM 0 HA GLU A 88 5.213 -15.725 10.100 1.00 0.00 H new ATOM 0 HB2 GLU A 88 7.566 -14.774 11.450 1.00 0.00 H new ATOM 0 HB3 GLU A 88 6.528 -13.403 11.112 1.00 0.00 H new ATOM 0 HG2 GLU A 88 5.064 -15.803 12.080 1.00 0.00 H new ATOM 0 HG3 GLU A 88 6.209 -15.160 13.240 1.00 0.00 H new ATOM 1314 N ASN A 89 6.202 -14.344 7.627 1.00 0.00 N ATOM 1315 CA ASN A 89 5.951 -13.426 6.529 1.00 0.00 C ATOM 1316 C ASN A 89 5.542 -14.221 5.288 1.00 0.00 C ATOM 1317 O ASN A 89 6.375 -14.878 4.664 1.00 0.00 O ATOM 1318 CB ASN A 89 7.207 -12.624 6.183 1.00 0.00 C ATOM 1319 CG ASN A 89 7.565 -11.653 7.311 1.00 0.00 C ATOM 1320 OD1 ASN A 89 7.600 -12.003 8.479 1.00 0.00 O ATOM 1321 ND2 ASN A 89 7.829 -10.417 6.897 1.00 0.00 N ATOM 0 H ASN A 89 6.725 -15.182 7.371 1.00 0.00 H new ATOM 0 HA ASN A 89 5.160 -12.742 6.836 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.040 -13.304 6.006 1.00 0.00 H new ATOM 0 HB3 ASN A 89 7.046 -12.070 5.258 1.00 0.00 H new ATOM 0 HD21 ASN A 89 8.079 -9.695 7.573 1.00 0.00 H new ATOM 0 HD22 ASN A 89 7.781 -10.191 5.904 1.00 0.00 H new ATOM 1328 N PRO A 90 4.225 -14.135 4.958 1.00 0.00 N ATOM 1329 CA PRO A 90 3.695 -14.838 3.802 1.00 0.00 C ATOM 1330 C PRO A 90 4.103 -14.143 2.502 1.00 0.00 C ATOM 1331 O PRO A 90 4.510 -14.798 1.544 1.00 0.00 O ATOM 1332 CB PRO A 90 2.191 -14.866 4.015 1.00 0.00 C ATOM 1333 CG PRO A 90 1.894 -13.780 5.036 1.00 0.00 C ATOM 1334 CD PRO A 90 3.210 -13.367 5.673 1.00 0.00 C ATOM 0 HA PRO A 90 4.089 -15.850 3.708 1.00 0.00 H new ATOM 0 HB2 PRO A 90 1.661 -14.679 3.081 1.00 0.00 H new ATOM 0 HB3 PRO A 90 1.866 -15.841 4.377 1.00 0.00 H new ATOM 0 HG2 PRO A 90 1.417 -12.925 4.556 1.00 0.00 H new ATOM 0 HG3 PRO A 90 1.202 -14.147 5.794 1.00 0.00 H new ATOM 0 HD2 PRO A 90 3.380 -12.295 5.571 1.00 0.00 H new ATOM 0 HD3 PRO A 90 3.222 -13.592 6.739 1.00 0.00 H new ATOM 1342 N PHE A 91 3.979 -12.823 2.510 1.00 0.00 N ATOM 1343 CA PHE A 91 4.330 -12.031 1.344 1.00 0.00 C ATOM 1344 C PHE A 91 5.834 -12.093 1.071 1.00 0.00 C ATOM 1345 O PHE A 91 6.635 -12.153 2.002 1.00 0.00 O ATOM 1346 CB PHE A 91 3.938 -10.585 1.651 1.00 0.00 C ATOM 1347 CG PHE A 91 3.459 -9.797 0.430 1.00 0.00 C ATOM 1348 CD1 PHE A 91 2.176 -9.928 -0.003 1.00 0.00 C ATOM 1349 CD2 PHE A 91 4.315 -8.965 -0.222 1.00 0.00 C ATOM 1350 CE1 PHE A 91 1.731 -9.197 -1.136 1.00 0.00 C ATOM 1351 CE2 PHE A 91 3.870 -8.234 -1.355 1.00 0.00 C ATOM 1352 CZ PHE A 91 2.588 -8.366 -1.788 1.00 0.00 C ATOM 0 H PHE A 91 3.640 -12.283 3.306 1.00 0.00 H new ATOM 0 HA PHE A 91 3.813 -12.415 0.465 1.00 0.00 H new ATOM 0 HB2 PHE A 91 3.149 -10.585 2.403 1.00 0.00 H new ATOM 0 HB3 PHE A 91 4.795 -10.072 2.088 1.00 0.00 H new ATOM 0 HD1 PHE A 91 1.496 -10.588 0.515 1.00 0.00 H new ATOM 0 HD2 PHE A 91 5.333 -8.860 0.122 1.00 0.00 H new ATOM 0 HE1 PHE A 91 0.713 -9.301 -1.480 1.00 0.00 H new ATOM 0 HE2 PHE A 91 4.550 -7.573 -1.873 1.00 0.00 H new ATOM 0 HZ PHE A 91 2.250 -7.811 -2.650 1.00 0.00 H new ATOM 1362 N LEU A 92 6.172 -12.076 -0.210 1.00 0.00 N ATOM 1363 CA LEU A 92 7.565 -12.129 -0.618 1.00 0.00 C ATOM 1364 C LEU A 92 7.870 -10.942 -1.533 1.00 0.00 C ATOM 1365 O LEU A 92 7.369 -10.873 -2.654 1.00 0.00 O ATOM 1366 CB LEU A 92 7.889 -13.487 -1.244 1.00 0.00 C ATOM 1367 CG LEU A 92 7.801 -14.695 -0.308 1.00 0.00 C ATOM 1368 CD1 LEU A 92 7.747 -16.001 -1.103 1.00 0.00 C ATOM 1369 CD2 LEU A 92 8.946 -14.688 0.706 1.00 0.00 C ATOM 0 H LEU A 92 5.504 -12.026 -0.979 1.00 0.00 H new ATOM 0 HA LEU A 92 8.219 -12.039 0.249 1.00 0.00 H new ATOM 0 HB2 LEU A 92 7.210 -13.650 -2.081 1.00 0.00 H new ATOM 0 HB3 LEU A 92 8.897 -13.444 -1.656 1.00 0.00 H new ATOM 0 HG LEU A 92 6.871 -14.623 0.257 1.00 0.00 H new ATOM 0 HD11 LEU A 92 7.685 -16.844 -0.415 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.871 -15.996 -1.751 1.00 0.00 H new ATOM 0 HD13 LEU A 92 8.647 -16.095 -1.711 1.00 0.00 H new ATOM 0 HD21 LEU A 92 8.859 -15.557 1.359 1.00 0.00 H new ATOM 0 HD22 LEU A 92 9.899 -14.724 0.179 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.896 -13.778 1.305 1.00 0.00 H new ATOM 1381 N ASP A 93 8.691 -10.036 -1.021 1.00 0.00 N ATOM 1382 CA ASP A 93 9.069 -8.855 -1.779 1.00 0.00 C ATOM 1383 C ASP A 93 9.938 -9.273 -2.966 1.00 0.00 C ATOM 1384 O ASP A 93 11.137 -9.000 -2.988 1.00 0.00 O ATOM 1385 CB ASP A 93 9.879 -7.885 -0.917 1.00 0.00 C ATOM 1386 CG ASP A 93 10.544 -6.740 -1.685 1.00 0.00 C ATOM 1387 OD1 ASP A 93 9.819 -6.079 -2.459 1.00 0.00 O ATOM 1388 OD2 ASP A 93 11.763 -6.552 -1.479 1.00 0.00 O ATOM 0 H ASP A 93 9.105 -10.096 -0.091 1.00 0.00 H new ATOM 0 HA ASP A 93 8.157 -8.363 -2.115 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.222 -7.460 -0.158 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.651 -8.447 -0.391 1.00 0.00 H new ATOM 1393 N SER A 94 9.300 -9.928 -3.925 1.00 0.00 N ATOM 1394 CA SER A 94 10.000 -10.386 -5.113 1.00 0.00 C ATOM 1395 C SER A 94 9.072 -10.313 -6.327 1.00 0.00 C ATOM 1396 O SER A 94 7.864 -10.503 -6.202 1.00 0.00 O ATOM 1397 CB SER A 94 10.523 -11.812 -4.929 1.00 0.00 C ATOM 1398 OG SER A 94 11.819 -11.982 -5.494 1.00 0.00 O ATOM 0 H SER A 94 8.305 -10.152 -3.903 1.00 0.00 H new ATOM 0 HA SER A 94 10.857 -9.733 -5.279 1.00 0.00 H new ATOM 0 HB2 SER A 94 10.557 -12.051 -3.866 1.00 0.00 H new ATOM 0 HB3 SER A 94 9.830 -12.515 -5.392 1.00 0.00 H new ATOM 0 HG SER A 94 12.118 -12.905 -5.354 1.00 0.00 H new ATOM 1404 N PRO A 95 9.689 -10.031 -7.506 1.00 0.00 N ATOM 1405 CA PRO A 95 8.932 -9.931 -8.742 1.00 0.00 C ATOM 1406 C PRO A 95 8.524 -11.316 -9.248 1.00 0.00 C ATOM 1407 O PRO A 95 7.723 -11.431 -10.174 1.00 0.00 O ATOM 1408 CB PRO A 95 9.848 -9.192 -9.705 1.00 0.00 C ATOM 1409 CG PRO A 95 11.248 -9.316 -9.127 1.00 0.00 C ATOM 1410 CD PRO A 95 11.119 -9.800 -7.692 1.00 0.00 C ATOM 0 HA PRO A 95 7.991 -9.395 -8.618 1.00 0.00 H new ATOM 0 HB2 PRO A 95 9.798 -9.627 -10.703 1.00 0.00 H new ATOM 0 HB3 PRO A 95 9.555 -8.146 -9.798 1.00 0.00 H new ATOM 0 HG2 PRO A 95 11.843 -10.016 -9.714 1.00 0.00 H new ATOM 0 HG3 PRO A 95 11.761 -8.355 -9.161 1.00 0.00 H new ATOM 0 HD2 PRO A 95 11.692 -10.713 -7.529 1.00 0.00 H new ATOM 0 HD3 PRO A 95 11.495 -9.057 -6.988 1.00 0.00 H new ATOM 1418 N ASP A 96 9.094 -12.333 -8.618 1.00 0.00 N ATOM 1419 CA ASP A 96 8.799 -13.705 -8.993 1.00 0.00 C ATOM 1420 C ASP A 96 7.403 -14.078 -8.491 1.00 0.00 C ATOM 1421 O ASP A 96 6.610 -14.662 -9.228 1.00 0.00 O ATOM 1422 CB ASP A 96 9.802 -14.675 -8.365 1.00 0.00 C ATOM 1423 CG ASP A 96 11.231 -14.562 -8.899 1.00 0.00 C ATOM 1424 OD1 ASP A 96 11.730 -13.417 -8.948 1.00 0.00 O ATOM 1425 OD2 ASP A 96 11.793 -15.624 -9.245 1.00 0.00 O ATOM 0 H ASP A 96 9.758 -12.234 -7.850 1.00 0.00 H new ATOM 0 HA ASP A 96 8.858 -13.778 -10.079 1.00 0.00 H new ATOM 0 HB2 ASP A 96 9.819 -14.510 -7.288 1.00 0.00 H new ATOM 0 HB3 ASP A 96 9.449 -15.694 -8.526 1.00 0.00 H new ATOM 1430 N ALA A 97 7.144 -13.724 -7.241 1.00 0.00 N ATOM 1431 CA ALA A 97 5.857 -14.014 -6.632 1.00 0.00 C ATOM 1432 C ALA A 97 4.777 -13.166 -7.304 1.00 0.00 C ATOM 1433 O ALA A 97 4.933 -11.954 -7.447 1.00 0.00 O ATOM 1434 CB ALA A 97 5.939 -13.767 -5.124 1.00 0.00 C ATOM 0 H ALA A 97 7.804 -13.239 -6.633 1.00 0.00 H new ATOM 0 HA ALA A 97 5.591 -15.061 -6.777 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.974 -13.984 -4.667 1.00 0.00 H new ATOM 0 HB2 ALA A 97 6.700 -14.415 -4.690 1.00 0.00 H new ATOM 0 HB3 ALA A 97 6.201 -12.725 -4.940 1.00 0.00 H new ATOM 1440 N PHE A 98 3.704 -13.835 -7.700 1.00 0.00 N ATOM 1441 CA PHE A 98 2.598 -13.158 -8.354 1.00 0.00 C ATOM 1442 C PHE A 98 1.313 -13.286 -7.533 1.00 0.00 C ATOM 1443 O PHE A 98 1.012 -14.358 -7.009 1.00 0.00 O ATOM 1444 CB PHE A 98 2.394 -13.839 -9.708 1.00 0.00 C ATOM 1445 CG PHE A 98 3.693 -14.123 -10.464 1.00 0.00 C ATOM 1446 CD1 PHE A 98 4.551 -13.107 -10.747 1.00 0.00 C ATOM 1447 CD2 PHE A 98 3.990 -15.392 -10.854 1.00 0.00 C ATOM 1448 CE1 PHE A 98 5.758 -13.370 -11.449 1.00 0.00 C ATOM 1449 CE2 PHE A 98 5.196 -15.656 -11.555 1.00 0.00 C ATOM 1450 CZ PHE A 98 6.054 -14.639 -11.838 1.00 0.00 C ATOM 0 H PHE A 98 3.577 -14.840 -7.580 1.00 0.00 H new ATOM 0 HA PHE A 98 2.824 -12.097 -8.462 1.00 0.00 H new ATOM 0 HB2 PHE A 98 1.862 -14.778 -9.554 1.00 0.00 H new ATOM 0 HB3 PHE A 98 1.756 -13.209 -10.327 1.00 0.00 H new ATOM 0 HD1 PHE A 98 4.315 -12.099 -10.438 1.00 0.00 H new ATOM 0 HD2 PHE A 98 3.308 -16.199 -10.630 1.00 0.00 H new ATOM 0 HE1 PHE A 98 6.440 -12.563 -11.673 1.00 0.00 H new ATOM 0 HE2 PHE A 98 5.432 -16.664 -11.863 1.00 0.00 H new ATOM 0 HZ PHE A 98 6.971 -14.840 -12.372 1.00 0.00 H new ATOM 1460 N TYR A 99 0.591 -12.179 -7.446 1.00 0.00 N ATOM 1461 CA TYR A 99 -0.654 -12.154 -6.697 1.00 0.00 C ATOM 1462 C TYR A 99 -1.754 -11.441 -7.486 1.00 0.00 C ATOM 1463 O TYR A 99 -1.471 -10.551 -8.287 1.00 0.00 O ATOM 1464 CB TYR A 99 -0.363 -11.362 -5.421 1.00 0.00 C ATOM 1465 CG TYR A 99 0.504 -12.111 -4.407 1.00 0.00 C ATOM 1466 CD1 TYR A 99 0.030 -13.263 -3.812 1.00 0.00 C ATOM 1467 CD2 TYR A 99 1.759 -11.636 -4.088 1.00 0.00 C ATOM 1468 CE1 TYR A 99 0.845 -13.968 -2.858 1.00 0.00 C ATOM 1469 CE2 TYR A 99 2.575 -12.341 -3.134 1.00 0.00 C ATOM 1470 CZ TYR A 99 2.078 -13.473 -2.566 1.00 0.00 C ATOM 1471 OH TYR A 99 2.848 -14.139 -1.664 1.00 0.00 O ATOM 0 H TYR A 99 0.844 -11.292 -7.882 1.00 0.00 H new ATOM 0 HA TYR A 99 -0.998 -13.167 -6.490 1.00 0.00 H new ATOM 0 HB2 TYR A 99 0.134 -10.430 -5.690 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -1.308 -11.095 -4.948 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -0.952 -13.635 -4.062 1.00 0.00 H new ATOM 0 HD2 TYR A 99 2.130 -10.735 -4.554 1.00 0.00 H new ATOM 0 HE1 TYR A 99 0.486 -14.870 -2.385 1.00 0.00 H new ATOM 0 HE2 TYR A 99 3.559 -11.979 -2.875 1.00 0.00 H new ATOM 0 HH TYR A 99 3.702 -13.672 -1.555 1.00 0.00 H new ATOM 1481 N TYR A 100 -2.985 -11.859 -7.233 1.00 0.00 N ATOM 1482 CA TYR A 100 -4.129 -11.272 -7.909 1.00 0.00 C ATOM 1483 C TYR A 100 -5.311 -11.113 -6.950 1.00 0.00 C ATOM 1484 O TYR A 100 -5.435 -11.862 -5.983 1.00 0.00 O ATOM 1485 CB TYR A 100 -4.515 -12.255 -9.016 1.00 0.00 C ATOM 1486 CG TYR A 100 -5.114 -13.566 -8.503 1.00 0.00 C ATOM 1487 CD1 TYR A 100 -4.288 -14.559 -8.017 1.00 0.00 C ATOM 1488 CD2 TYR A 100 -6.481 -13.756 -8.527 1.00 0.00 C ATOM 1489 CE1 TYR A 100 -4.852 -15.793 -7.534 1.00 0.00 C ATOM 1490 CE2 TYR A 100 -7.045 -14.990 -8.045 1.00 0.00 C ATOM 1491 CZ TYR A 100 -6.203 -15.947 -7.572 1.00 0.00 C ATOM 1492 OH TYR A 100 -6.735 -17.113 -7.116 1.00 0.00 O ATOM 0 H TYR A 100 -3.215 -12.598 -6.569 1.00 0.00 H new ATOM 0 HA TYR A 100 -3.880 -10.284 -8.295 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -5.233 -11.775 -9.680 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -3.631 -12.480 -9.612 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -3.218 -14.411 -7.999 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -7.128 -12.979 -8.907 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -4.217 -16.578 -7.151 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -8.113 -15.152 -8.059 1.00 0.00 H new ATOM 0 HH TYR A 100 -7.711 -17.083 -7.202 1.00 0.00 H new ATOM 1502 N PHE A 101 -6.149 -10.132 -7.253 1.00 0.00 N ATOM 1503 CA PHE A 101 -7.317 -9.865 -6.430 1.00 0.00 C ATOM 1504 C PHE A 101 -8.372 -10.960 -6.604 1.00 0.00 C ATOM 1505 O PHE A 101 -8.521 -11.516 -7.690 1.00 0.00 O ATOM 1506 CB PHE A 101 -7.900 -8.532 -6.901 1.00 0.00 C ATOM 1507 CG PHE A 101 -6.885 -7.387 -6.937 1.00 0.00 C ATOM 1508 CD1 PHE A 101 -6.217 -7.034 -5.806 1.00 0.00 C ATOM 1509 CD2 PHE A 101 -6.652 -6.722 -8.100 1.00 0.00 C ATOM 1510 CE1 PHE A 101 -5.276 -5.971 -5.840 1.00 0.00 C ATOM 1511 CE2 PHE A 101 -5.710 -5.659 -8.134 1.00 0.00 C ATOM 1512 CZ PHE A 101 -5.042 -5.307 -7.003 1.00 0.00 C ATOM 0 H PHE A 101 -6.043 -9.513 -8.056 1.00 0.00 H new ATOM 0 HA PHE A 101 -7.033 -9.836 -5.378 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -8.320 -8.663 -7.898 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -8.723 -8.254 -6.242 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -6.402 -7.562 -4.882 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -7.183 -7.002 -8.998 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -4.746 -5.690 -4.942 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -5.525 -5.131 -9.058 1.00 0.00 H new ATOM 0 HZ PHE A 101 -4.325 -4.500 -7.029 1.00 0.00 H new ATOM 1522 N PRO A 102 -9.095 -11.243 -5.487 1.00 0.00 N ATOM 1523 CA PRO A 102 -10.132 -12.261 -5.506 1.00 0.00 C ATOM 1524 C PRO A 102 -11.382 -11.757 -6.230 1.00 0.00 C ATOM 1525 O PRO A 102 -12.378 -11.416 -5.593 1.00 0.00 O ATOM 1526 CB PRO A 102 -10.385 -12.591 -4.044 1.00 0.00 C ATOM 1527 CG PRO A 102 -9.821 -11.424 -3.249 1.00 0.00 C ATOM 1528 CD PRO A 102 -8.946 -10.604 -4.183 1.00 0.00 C ATOM 0 HA PRO A 102 -9.836 -13.154 -6.057 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -11.450 -12.717 -3.851 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -9.898 -13.525 -3.765 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -10.627 -10.812 -2.846 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -9.240 -11.785 -2.400 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -9.267 -9.563 -4.213 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -7.906 -10.608 -3.857 1.00 0.00 H new ATOM 1536 N ASP A 103 -11.289 -11.725 -7.551 1.00 0.00 N ATOM 1537 CA ASP A 103 -12.400 -11.268 -8.369 1.00 0.00 C ATOM 1538 C ASP A 103 -11.983 -11.279 -9.841 1.00 0.00 C ATOM 1539 O ASP A 103 -12.769 -11.651 -10.710 1.00 0.00 O ATOM 1540 CB ASP A 103 -12.803 -9.839 -8.002 1.00 0.00 C ATOM 1541 CG ASP A 103 -14.295 -9.637 -7.729 1.00 0.00 C ATOM 1542 OD1 ASP A 103 -15.054 -9.609 -8.722 1.00 0.00 O ATOM 1543 OD2 ASP A 103 -14.642 -9.516 -6.535 1.00 0.00 O ATOM 0 H ASP A 103 -10.461 -12.008 -8.076 1.00 0.00 H new ATOM 0 HA ASP A 103 -13.243 -11.936 -8.195 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -12.243 -9.536 -7.117 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -12.504 -9.174 -8.812 1.00 0.00 H new ATOM 1548 N SER A 104 -10.746 -10.866 -10.075 1.00 0.00 N ATOM 1549 CA SER A 104 -10.214 -10.824 -11.427 1.00 0.00 C ATOM 1550 C SER A 104 -9.420 -12.098 -11.717 1.00 0.00 C ATOM 1551 O SER A 104 -9.904 -12.992 -12.410 1.00 0.00 O ATOM 1552 CB SER A 104 -9.333 -9.590 -11.633 1.00 0.00 C ATOM 1553 OG SER A 104 -9.957 -8.623 -12.473 1.00 0.00 O ATOM 0 H SER A 104 -10.097 -10.557 -9.351 1.00 0.00 H new ATOM 0 HA SER A 104 -11.051 -10.760 -12.122 1.00 0.00 H new ATOM 0 HB2 SER A 104 -9.108 -9.139 -10.666 1.00 0.00 H new ATOM 0 HB3 SER A 104 -8.382 -9.892 -12.072 1.00 0.00 H new ATOM 0 HG SER A 104 -9.364 -7.850 -12.579 1.00 0.00 H new ATOM 1559 N GLY A 105 -8.213 -12.142 -11.172 1.00 0.00 N ATOM 1560 CA GLY A 105 -7.346 -13.293 -11.364 1.00 0.00 C ATOM 1561 C GLY A 105 -7.479 -13.848 -12.784 1.00 0.00 C ATOM 1562 O GLY A 105 -7.859 -13.126 -13.704 1.00 0.00 O ATOM 0 H GLY A 105 -7.815 -11.399 -10.597 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -6.311 -13.008 -11.176 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -7.599 -14.069 -10.641 1.00 0.00 H new ATOM 1566 N PRO A 106 -7.149 -15.160 -12.920 1.00 0.00 N ATOM 1567 CA PRO A 106 -7.227 -15.821 -14.212 1.00 0.00 C ATOM 1568 C PRO A 106 -8.680 -16.111 -14.592 1.00 0.00 C ATOM 1569 O PRO A 106 -9.052 -16.009 -15.760 1.00 0.00 O ATOM 1570 CB PRO A 106 -6.390 -17.081 -14.061 1.00 0.00 C ATOM 1571 CG PRO A 106 -6.257 -17.316 -12.565 1.00 0.00 C ATOM 1572 CD PRO A 106 -6.694 -16.047 -11.853 1.00 0.00 C ATOM 0 HA PRO A 106 -6.847 -15.202 -15.025 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -6.870 -17.930 -14.549 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -5.412 -16.958 -14.526 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -6.874 -18.159 -12.255 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -5.227 -17.563 -12.307 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -7.492 -16.249 -11.139 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -5.870 -15.603 -11.294 1.00 0.00 H new ATOM 1580 N SER A 107 -9.462 -16.467 -13.584 1.00 0.00 N ATOM 1581 CA SER A 107 -10.867 -16.773 -13.798 1.00 0.00 C ATOM 1582 C SER A 107 -11.603 -15.528 -14.297 1.00 0.00 C ATOM 1583 O SER A 107 -12.104 -14.738 -13.499 1.00 0.00 O ATOM 1584 CB SER A 107 -11.518 -17.297 -12.516 1.00 0.00 C ATOM 1585 OG SER A 107 -11.211 -18.669 -12.283 1.00 0.00 O ATOM 0 H SER A 107 -9.150 -16.551 -12.617 1.00 0.00 H new ATOM 0 HA SER A 107 -10.936 -17.555 -14.554 1.00 0.00 H new ATOM 0 HB2 SER A 107 -11.180 -16.701 -11.668 1.00 0.00 H new ATOM 0 HB3 SER A 107 -12.599 -17.174 -12.582 1.00 0.00 H new ATOM 0 HG SER A 107 -11.644 -18.965 -11.455 1.00 0.00 H new ATOM 1591 N SER A 108 -11.645 -15.393 -15.614 1.00 0.00 N ATOM 1592 CA SER A 108 -12.312 -14.258 -16.229 1.00 0.00 C ATOM 1593 C SER A 108 -13.705 -14.078 -15.623 1.00 0.00 C ATOM 1594 O SER A 108 -13.994 -13.047 -15.017 1.00 0.00 O ATOM 1595 CB SER A 108 -12.412 -14.433 -17.746 1.00 0.00 C ATOM 1596 OG SER A 108 -11.531 -13.558 -18.444 1.00 0.00 O ATOM 0 H SER A 108 -11.228 -16.051 -16.273 1.00 0.00 H new ATOM 0 HA SER A 108 -11.719 -13.365 -16.032 1.00 0.00 H new ATOM 0 HB2 SER A 108 -12.180 -15.465 -18.008 1.00 0.00 H new ATOM 0 HB3 SER A 108 -13.437 -14.246 -18.066 1.00 0.00 H new ATOM 0 HG SER A 108 -11.624 -13.702 -19.409 1.00 0.00 H new ATOM 1602 N GLY A 109 -14.532 -15.097 -15.806 1.00 0.00 N ATOM 1603 CA GLY A 109 -15.888 -15.065 -15.285 1.00 0.00 C ATOM 1604 C GLY A 109 -16.905 -14.884 -16.414 1.00 0.00 C ATOM 1605 O GLY A 109 -17.382 -15.863 -16.987 1.00 0.00 O ATOM 0 H GLY A 109 -14.289 -15.951 -16.308 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -16.097 -15.990 -14.747 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -15.987 -14.250 -14.568 1.00 0.00 H new TER 1609 GLY A 109