USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 949 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 80 THR OG1 : rot -160:sc= 0 USER MOD Set 1.2: A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 3 THR OG1 : rot 23:sc= 0.175 USER MOD Set 2.2: A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 CYS SG : rot 93:sc= -0.786 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 ASN : amide:sc= 0.699 K(o=0.7,f=0) USER MOD Single : A 28 THR OG1 : rot -160:sc= -0.691 USER MOD Single : A 30 LYS NZ :NH3+ -165:sc= -0.0659 (180deg=-0.335) USER MOD Single : A 31 TYR OH : rot 165:sc= 0.978 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 43:sc= 0.0952 USER MOD Single : A 41 GLN : amide:sc= -0.518 X(o=-0.52,f=-0.32) USER MOD Single : A 45 TYR OH : rot -93:sc= -0.484 USER MOD Single : A 46 GLN : amide:sc= -0.0871 X(o=-0.087,f=0) USER MOD Single : A 47 HIS : no HD1:sc= -0.153 X(o=-0.15,f=-0.38) USER MOD Single : A 50 GLN : amide:sc= -0.134 X(o=-0.13,f=0) USER MOD Single : A 51 GLN :FLIP amide:sc= -2.9! C(o=-5.4!,f=-2.9!) USER MOD Single : A 52 CYS SG : rot -20:sc= -0.357 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.0307 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot -8:sc= 0.55 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 ASN : amide:sc= 1.16 K(o=1.2,f=-0.067) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -1.17 K(o=-1.2,f=-4.4!) USER MOD Single : A 94 THR OG1 : rot 68:sc= 0.666 USER MOD Single : A 96 THR OG1 : rot 43:sc= 1.09 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 LYS NZ :NH3+ 135:sc= -1.21 (180deg=-2.81) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 13 N THR A 3 -4.138 -17.915 -11.110 1.00 0.00 N ATOM 14 CA THR A 3 -4.451 -16.973 -10.039 1.00 0.00 C ATOM 15 C THR A 3 -5.473 -15.945 -10.514 1.00 0.00 C ATOM 16 O THR A 3 -5.412 -15.475 -11.651 1.00 0.00 O ATOM 17 CB THR A 3 -3.180 -16.269 -9.556 1.00 0.00 C ATOM 18 OG1 THR A 3 -2.164 -17.213 -9.258 1.00 0.00 O ATOM 19 CG2 THR A 3 -3.398 -15.424 -8.319 1.00 0.00 C ATOM 0 HA THR A 3 -4.879 -17.531 -9.206 1.00 0.00 H new ATOM 0 HB THR A 3 -2.883 -15.615 -10.376 1.00 0.00 H new ATOM 0 HG1 THR A 3 -2.340 -18.047 -9.742 1.00 0.00 H new ATOM 0 HG21 THR A 3 -2.458 -14.953 -8.030 1.00 0.00 H new ATOM 0 HG22 THR A 3 -4.140 -14.654 -8.531 1.00 0.00 H new ATOM 0 HG23 THR A 3 -3.753 -16.056 -7.505 1.00 0.00 H new ATOM 27 N LYS A 4 -6.416 -15.604 -9.638 1.00 0.00 N ATOM 28 CA LYS A 4 -7.456 -14.636 -9.971 1.00 0.00 C ATOM 29 C LYS A 4 -7.564 -13.553 -8.900 1.00 0.00 C ATOM 30 O LYS A 4 -6.966 -13.663 -7.829 1.00 0.00 O ATOM 31 CB LYS A 4 -8.807 -15.342 -10.135 1.00 0.00 C ATOM 32 CG LYS A 4 -8.745 -16.601 -10.989 1.00 0.00 C ATOM 33 CD LYS A 4 -8.425 -17.830 -10.151 1.00 0.00 C ATOM 34 CE LYS A 4 -9.111 -19.074 -10.694 1.00 0.00 C ATOM 35 NZ LYS A 4 -10.431 -19.311 -10.045 1.00 0.00 N ATOM 0 H LYS A 4 -6.480 -15.984 -8.694 1.00 0.00 H new ATOM 0 HA LYS A 4 -7.182 -14.161 -10.913 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -9.192 -15.602 -9.149 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -9.518 -14.646 -10.581 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -9.699 -16.744 -11.497 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -7.987 -16.480 -11.763 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -7.347 -17.988 -10.133 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -8.740 -17.661 -9.121 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -9.249 -18.971 -11.770 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -8.469 -19.940 -10.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -10.865 -20.168 -10.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -10.297 -19.435 -9.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -11.054 -18.496 -10.217 1.00 0.00 H new ATOM 49 N ILE A 5 -8.335 -12.509 -9.196 1.00 0.00 N ATOM 50 CA ILE A 5 -8.531 -11.408 -8.260 1.00 0.00 C ATOM 51 C ILE A 5 -10.016 -11.190 -7.988 1.00 0.00 C ATOM 52 O ILE A 5 -10.819 -11.083 -8.918 1.00 0.00 O ATOM 53 CB ILE A 5 -7.901 -10.097 -8.782 1.00 0.00 C ATOM 54 CG1 ILE A 5 -8.011 -8.994 -7.725 1.00 0.00 C ATOM 55 CG2 ILE A 5 -8.560 -9.660 -10.083 1.00 0.00 C ATOM 56 CD1 ILE A 5 -6.856 -8.016 -7.748 1.00 0.00 C ATOM 0 H ILE A 5 -8.835 -12.404 -10.079 1.00 0.00 H new ATOM 0 HA ILE A 5 -8.031 -11.682 -7.331 1.00 0.00 H new ATOM 0 HB ILE A 5 -6.845 -10.281 -8.983 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -8.942 -8.448 -7.877 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -8.068 -9.453 -6.738 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -8.100 -8.735 -10.431 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -8.428 -10.437 -10.836 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.624 -9.495 -9.914 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -7.001 -7.263 -6.973 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.923 -8.550 -7.565 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -6.811 -7.529 -8.722 1.00 0.00 H new ATOM 68 N ASP A 6 -10.378 -11.128 -6.709 1.00 0.00 N ATOM 69 CA ASP A 6 -11.769 -10.926 -6.320 1.00 0.00 C ATOM 70 C ASP A 6 -12.148 -9.451 -6.394 1.00 0.00 C ATOM 71 O ASP A 6 -11.652 -8.630 -5.619 1.00 0.00 O ATOM 72 CB ASP A 6 -12.013 -11.460 -4.908 1.00 0.00 C ATOM 73 CG ASP A 6 -12.302 -12.949 -4.898 1.00 0.00 C ATOM 74 OD1 ASP A 6 -13.407 -13.341 -5.329 1.00 0.00 O ATOM 75 OD2 ASP A 6 -11.424 -13.722 -4.461 1.00 0.00 O ATOM 0 H ASP A 6 -9.729 -11.215 -5.927 1.00 0.00 H new ATOM 0 HA ASP A 6 -12.397 -11.478 -7.020 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -11.139 -11.258 -4.289 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -12.851 -10.926 -4.460 1.00 0.00 H new ATOM 80 N LYS A 7 -13.032 -9.122 -7.334 1.00 0.00 N ATOM 81 CA LYS A 7 -13.486 -7.746 -7.515 1.00 0.00 C ATOM 82 C LYS A 7 -14.338 -7.298 -6.332 1.00 0.00 C ATOM 83 O LYS A 7 -14.213 -6.167 -5.862 1.00 0.00 O ATOM 84 CB LYS A 7 -14.284 -7.612 -8.815 1.00 0.00 C ATOM 85 CG LYS A 7 -13.565 -6.812 -9.890 1.00 0.00 C ATOM 86 CD LYS A 7 -12.435 -7.612 -10.521 1.00 0.00 C ATOM 87 CE LYS A 7 -12.040 -7.043 -11.875 1.00 0.00 C ATOM 88 NZ LYS A 7 -11.317 -8.042 -12.712 1.00 0.00 N ATOM 0 H LYS A 7 -13.448 -9.791 -7.982 1.00 0.00 H new ATOM 0 HA LYS A 7 -12.607 -7.104 -7.573 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -14.504 -8.607 -9.201 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -15.240 -7.136 -8.597 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -14.276 -6.516 -10.661 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -13.165 -5.896 -9.456 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -11.570 -7.609 -9.857 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -12.744 -8.651 -10.637 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -12.933 -6.708 -12.402 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -11.408 -6.167 -11.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -11.066 -7.613 -13.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -10.451 -8.344 -12.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -11.929 -8.867 -12.873 1.00 0.00 H new ATOM 102 N GLU A 8 -15.202 -8.194 -5.854 1.00 0.00 N ATOM 103 CA GLU A 8 -16.076 -7.897 -4.721 1.00 0.00 C ATOM 104 C GLU A 8 -15.266 -7.443 -3.508 1.00 0.00 C ATOM 105 O GLU A 8 -15.598 -6.444 -2.869 1.00 0.00 O ATOM 106 CB GLU A 8 -16.909 -9.129 -4.360 1.00 0.00 C ATOM 107 CG GLU A 8 -18.242 -9.200 -5.091 1.00 0.00 C ATOM 108 CD GLU A 8 -19.417 -8.843 -4.201 1.00 0.00 C ATOM 109 OE1 GLU A 8 -19.962 -9.755 -3.543 1.00 0.00 O ATOM 110 OE2 GLU A 8 -19.792 -7.653 -4.164 1.00 0.00 O ATOM 0 H GLU A 8 -15.315 -9.133 -6.236 1.00 0.00 H new ATOM 0 HA GLU A 8 -16.743 -7.085 -5.012 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -16.332 -10.026 -4.586 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -17.093 -9.131 -3.286 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -18.220 -8.523 -5.945 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -18.383 -10.207 -5.485 1.00 0.00 H new ATOM 117 N ALA A 9 -14.201 -8.184 -3.201 1.00 0.00 N ATOM 118 CA ALA A 9 -13.339 -7.859 -2.069 1.00 0.00 C ATOM 119 C ALA A 9 -12.561 -6.571 -2.318 1.00 0.00 C ATOM 120 O ALA A 9 -12.607 -5.642 -1.510 1.00 0.00 O ATOM 121 CB ALA A 9 -12.385 -9.011 -1.782 1.00 0.00 C ATOM 0 H ALA A 9 -13.916 -9.013 -3.722 1.00 0.00 H new ATOM 0 HA ALA A 9 -13.974 -7.703 -1.197 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -11.749 -8.754 -0.935 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -12.958 -9.908 -1.546 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -11.765 -9.197 -2.659 1.00 0.00 H new ATOM 127 N CYS A 10 -11.847 -6.525 -3.443 1.00 0.00 N ATOM 128 CA CYS A 10 -11.051 -5.356 -3.811 1.00 0.00 C ATOM 129 C CYS A 10 -11.889 -4.077 -3.780 1.00 0.00 C ATOM 130 O CYS A 10 -11.470 -3.066 -3.212 1.00 0.00 O ATOM 131 CB CYS A 10 -10.453 -5.548 -5.206 1.00 0.00 C ATOM 132 SG CYS A 10 -8.850 -6.381 -5.212 1.00 0.00 S ATOM 0 H CYS A 10 -11.804 -7.289 -4.118 1.00 0.00 H new ATOM 0 HA CYS A 10 -10.249 -5.254 -3.080 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -11.152 -6.123 -5.813 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -10.346 -4.573 -5.681 1.00 0.00 H new ATOM 0 HG CYS A 10 -9.026 -7.660 -5.364 1.00 0.00 H new ATOM 138 N ARG A 11 -13.070 -4.127 -4.395 1.00 0.00 N ATOM 139 CA ARG A 11 -13.966 -2.972 -4.439 1.00 0.00 C ATOM 140 C ARG A 11 -14.507 -2.643 -3.048 1.00 0.00 C ATOM 141 O ARG A 11 -14.641 -1.471 -2.691 1.00 0.00 O ATOM 142 CB ARG A 11 -15.123 -3.230 -5.408 1.00 0.00 C ATOM 143 CG ARG A 11 -15.577 -1.992 -6.165 1.00 0.00 C ATOM 144 CD ARG A 11 -16.536 -2.351 -7.291 1.00 0.00 C ATOM 145 NE ARG A 11 -15.826 -2.738 -8.510 1.00 0.00 N ATOM 146 CZ ARG A 11 -15.198 -1.881 -9.316 1.00 0.00 C ATOM 147 NH1 ARG A 11 -15.190 -0.578 -9.043 1.00 0.00 N ATOM 148 NH2 ARG A 11 -14.573 -2.327 -10.401 1.00 0.00 N ATOM 0 H ARG A 11 -13.429 -4.955 -4.870 1.00 0.00 H new ATOM 0 HA ARG A 11 -13.393 -2.115 -4.793 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -14.820 -3.993 -6.126 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -15.968 -3.634 -4.851 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -16.064 -1.301 -5.477 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -14.709 -1.475 -6.575 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -17.181 -3.169 -6.971 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -17.183 -1.499 -7.502 1.00 0.00 H new ATOM 0 HE ARG A 11 -15.810 -3.727 -8.760 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -15.667 -0.228 -8.212 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -14.707 0.070 -9.665 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -14.574 -3.324 -10.617 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -14.092 -1.672 -11.018 1.00 0.00 H new ATOM 162 N ALA A 12 -14.812 -3.682 -2.266 1.00 0.00 N ATOM 163 CA ALA A 12 -15.332 -3.500 -0.912 1.00 0.00 C ATOM 164 C ALA A 12 -14.382 -2.653 -0.070 1.00 0.00 C ATOM 165 O ALA A 12 -14.801 -1.678 0.558 1.00 0.00 O ATOM 166 CB ALA A 12 -15.566 -4.850 -0.247 1.00 0.00 C ATOM 0 H ALA A 12 -14.707 -4.656 -2.549 1.00 0.00 H new ATOM 0 HA ALA A 12 -16.284 -2.974 -0.984 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -15.953 -4.697 0.760 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -16.287 -5.423 -0.830 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.625 -5.398 -0.195 1.00 0.00 H new ATOM 172 N ALA A 13 -13.101 -3.025 -0.068 1.00 0.00 N ATOM 173 CA ALA A 13 -12.091 -2.293 0.691 1.00 0.00 C ATOM 174 C ALA A 13 -11.997 -0.845 0.218 1.00 0.00 C ATOM 175 O ALA A 13 -11.958 0.078 1.033 1.00 0.00 O ATOM 176 CB ALA A 13 -10.737 -2.978 0.574 1.00 0.00 C ATOM 0 H ALA A 13 -12.741 -3.828 -0.583 1.00 0.00 H new ATOM 0 HA ALA A 13 -12.391 -2.290 1.739 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -9.996 -2.419 1.146 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -10.808 -3.993 0.966 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -10.436 -3.013 -0.473 1.00 0.00 H new ATOM 182 N TYR A 14 -11.969 -0.657 -1.103 1.00 0.00 N ATOM 183 CA TYR A 14 -11.887 0.678 -1.693 1.00 0.00 C ATOM 184 C TYR A 14 -13.024 1.567 -1.193 1.00 0.00 C ATOM 185 O TYR A 14 -12.806 2.728 -0.841 1.00 0.00 O ATOM 186 CB TYR A 14 -11.929 0.588 -3.221 1.00 0.00 C ATOM 187 CG TYR A 14 -11.413 1.831 -3.915 1.00 0.00 C ATOM 188 CD1 TYR A 14 -12.123 3.024 -3.861 1.00 0.00 C ATOM 189 CD2 TYR A 14 -10.218 1.809 -4.622 1.00 0.00 C ATOM 190 CE1 TYR A 14 -11.656 4.160 -4.491 1.00 0.00 C ATOM 191 CE2 TYR A 14 -9.744 2.942 -5.256 1.00 0.00 C ATOM 192 CZ TYR A 14 -10.466 4.115 -5.186 1.00 0.00 C ATOM 193 OH TYR A 14 -9.998 5.246 -5.815 1.00 0.00 O ATOM 0 H TYR A 14 -12.002 -1.415 -1.785 1.00 0.00 H new ATOM 0 HA TYR A 14 -10.940 1.124 -1.388 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -11.338 -0.270 -3.543 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -12.956 0.405 -3.538 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -13.055 3.063 -3.317 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -9.650 0.892 -4.677 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -12.220 5.080 -4.440 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -8.813 2.909 -5.803 1.00 0.00 H new ATOM 0 HH TYR A 14 -9.147 5.045 -6.258 1.00 0.00 H new ATOM 203 N ASN A 15 -14.237 1.013 -1.164 1.00 0.00 N ATOM 204 CA ASN A 15 -15.412 1.750 -0.705 1.00 0.00 C ATOM 205 C ASN A 15 -15.212 2.262 0.720 1.00 0.00 C ATOM 206 O ASN A 15 -15.550 3.405 1.032 1.00 0.00 O ATOM 207 CB ASN A 15 -16.658 0.861 -0.766 1.00 0.00 C ATOM 208 CG ASN A 15 -17.378 0.958 -2.099 1.00 0.00 C ATOM 209 OD1 ASN A 15 -18.177 1.868 -2.320 1.00 0.00 O ATOM 210 ND2 ASN A 15 -17.100 0.018 -2.995 1.00 0.00 N ATOM 0 H ASN A 15 -14.430 0.054 -1.454 1.00 0.00 H new ATOM 0 HA ASN A 15 -15.551 2.606 -1.366 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -16.370 -0.175 -0.587 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -17.342 1.145 0.034 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -17.555 0.033 -3.908 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -16.431 -0.719 -2.771 1.00 0.00 H new ATOM 217 N LEU A 16 -14.655 1.408 1.579 1.00 0.00 N ATOM 218 CA LEU A 16 -14.402 1.772 2.972 1.00 0.00 C ATOM 219 C LEU A 16 -13.375 2.900 3.064 1.00 0.00 C ATOM 220 O LEU A 16 -13.512 3.807 3.886 1.00 0.00 O ATOM 221 CB LEU A 16 -13.911 0.551 3.756 1.00 0.00 C ATOM 222 CG LEU A 16 -14.421 0.453 5.198 1.00 0.00 C ATOM 223 CD1 LEU A 16 -15.394 -0.707 5.346 1.00 0.00 C ATOM 224 CD2 LEU A 16 -13.256 0.300 6.165 1.00 0.00 C ATOM 0 H LEU A 16 -14.371 0.460 1.334 1.00 0.00 H new ATOM 0 HA LEU A 16 -15.338 2.124 3.407 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -14.210 -0.350 3.220 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -12.821 0.564 3.773 1.00 0.00 H new ATOM 0 HG LEU A 16 -14.950 1.375 5.438 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -15.744 -0.759 6.377 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -16.244 -0.556 4.681 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -14.892 -1.639 5.086 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -13.636 0.232 7.184 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -12.699 -0.606 5.924 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -12.597 1.164 6.080 1.00 0.00 H new ATOM 236 N VAL A 17 -12.350 2.841 2.210 1.00 0.00 N ATOM 237 CA VAL A 17 -11.302 3.863 2.191 1.00 0.00 C ATOM 238 C VAL A 17 -11.866 5.223 1.780 1.00 0.00 C ATOM 239 O VAL A 17 -11.426 6.260 2.281 1.00 0.00 O ATOM 240 CB VAL A 17 -10.152 3.485 1.230 1.00 0.00 C ATOM 241 CG1 VAL A 17 -8.974 4.436 1.399 1.00 0.00 C ATOM 242 CG2 VAL A 17 -9.712 2.046 1.455 1.00 0.00 C ATOM 0 H VAL A 17 -12.224 2.097 1.524 1.00 0.00 H new ATOM 0 HA VAL A 17 -10.908 3.924 3.205 1.00 0.00 H new ATOM 0 HB VAL A 17 -10.521 3.574 0.208 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -8.176 4.152 0.713 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -9.295 5.455 1.181 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -8.608 4.383 2.424 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -8.902 1.802 0.768 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -9.365 1.928 2.482 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -10.553 1.376 1.277 1.00 0.00 H new ATOM 252 N ARG A 18 -12.846 5.209 0.871 1.00 0.00 N ATOM 253 CA ARG A 18 -13.478 6.440 0.395 1.00 0.00 C ATOM 254 C ARG A 18 -13.992 7.280 1.563 1.00 0.00 C ATOM 255 O ARG A 18 -13.898 8.507 1.540 1.00 0.00 O ATOM 256 CB ARG A 18 -14.631 6.112 -0.560 1.00 0.00 C ATOM 257 CG ARG A 18 -15.169 7.323 -1.308 1.00 0.00 C ATOM 258 CD ARG A 18 -14.703 7.340 -2.757 1.00 0.00 C ATOM 259 NE ARG A 18 -14.252 8.670 -3.170 1.00 0.00 N ATOM 260 CZ ARG A 18 -13.025 9.148 -2.945 1.00 0.00 C ATOM 261 NH1 ARG A 18 -12.119 8.409 -2.312 1.00 0.00 N ATOM 262 NH2 ARG A 18 -12.705 10.370 -3.355 1.00 0.00 N ATOM 0 H ARG A 18 -13.218 4.357 0.451 1.00 0.00 H new ATOM 0 HA ARG A 18 -12.725 7.019 -0.140 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -14.292 5.370 -1.283 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -15.443 5.656 0.007 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -16.259 7.317 -1.276 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -14.841 8.235 -0.809 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -13.890 6.625 -2.885 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -15.518 7.016 -3.404 1.00 0.00 H new ATOM 0 HE ARG A 18 -14.916 9.269 -3.660 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -12.359 7.470 -1.994 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -11.184 8.781 -2.144 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -13.396 10.942 -3.841 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -11.769 10.736 -3.184 1.00 0.00 H new ATOM 276 N ASP A 19 -14.526 6.610 2.585 1.00 0.00 N ATOM 277 CA ASP A 19 -15.041 7.299 3.762 1.00 0.00 C ATOM 278 C ASP A 19 -13.896 7.871 4.591 1.00 0.00 C ATOM 279 O ASP A 19 -13.088 7.125 5.148 1.00 0.00 O ATOM 280 CB ASP A 19 -15.883 6.350 4.619 1.00 0.00 C ATOM 281 CG ASP A 19 -16.918 7.085 5.448 1.00 0.00 C ATOM 282 OD1 ASP A 19 -16.522 7.943 6.266 1.00 0.00 O ATOM 283 OD2 ASP A 19 -18.122 6.803 5.279 1.00 0.00 O ATOM 0 H ASP A 19 -14.612 5.594 2.619 1.00 0.00 H new ATOM 0 HA ASP A 19 -15.674 8.119 3.424 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -16.384 5.629 3.973 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -15.227 5.783 5.280 1.00 0.00 H new ATOM 318 N ALA A 23 -11.839 5.631 11.339 1.00 0.00 N ATOM 319 CA ALA A 23 -10.413 5.462 11.608 1.00 0.00 C ATOM 320 C ALA A 23 -9.791 4.445 10.650 1.00 0.00 C ATOM 321 O ALA A 23 -9.228 3.433 11.076 1.00 0.00 O ATOM 322 CB ALA A 23 -10.195 5.041 13.056 1.00 0.00 C ATOM 0 HA ALA A 23 -9.918 6.420 11.446 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -9.128 4.919 13.243 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -10.594 5.806 13.721 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -10.706 4.096 13.241 1.00 0.00 H new ATOM 328 N VAL A 24 -9.898 4.724 9.352 1.00 0.00 N ATOM 329 CA VAL A 24 -9.352 3.843 8.326 1.00 0.00 C ATOM 330 C VAL A 24 -8.643 4.647 7.236 1.00 0.00 C ATOM 331 O VAL A 24 -9.290 5.309 6.421 1.00 0.00 O ATOM 332 CB VAL A 24 -10.459 2.980 7.681 1.00 0.00 C ATOM 333 CG1 VAL A 24 -9.862 1.990 6.694 1.00 0.00 C ATOM 334 CG2 VAL A 24 -11.266 2.251 8.748 1.00 0.00 C ATOM 0 H VAL A 24 -10.360 5.557 8.987 1.00 0.00 H new ATOM 0 HA VAL A 24 -8.632 3.187 8.816 1.00 0.00 H new ATOM 0 HB VAL A 24 -11.132 3.643 7.137 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -10.659 1.392 6.251 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -9.336 2.532 5.908 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -9.163 1.335 7.214 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -12.040 1.649 8.271 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -10.606 1.603 9.324 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -11.731 2.979 9.413 1.00 0.00 H new ATOM 344 N ILE A 25 -7.311 4.589 7.228 1.00 0.00 N ATOM 345 CA ILE A 25 -6.516 5.316 6.237 1.00 0.00 C ATOM 346 C ILE A 25 -5.798 4.364 5.277 1.00 0.00 C ATOM 347 O ILE A 25 -5.548 4.714 4.122 1.00 0.00 O ATOM 348 CB ILE A 25 -5.469 6.235 6.904 1.00 0.00 C ATOM 349 CG1 ILE A 25 -4.488 5.420 7.750 1.00 0.00 C ATOM 350 CG2 ILE A 25 -6.155 7.295 7.754 1.00 0.00 C ATOM 351 CD1 ILE A 25 -3.054 5.528 7.283 1.00 0.00 C ATOM 0 H ILE A 25 -6.761 4.048 7.895 1.00 0.00 H new ATOM 0 HA ILE A 25 -7.221 5.928 5.674 1.00 0.00 H new ATOM 0 HB ILE A 25 -4.904 6.734 6.117 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -4.550 5.753 8.786 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -4.789 4.373 7.733 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -5.402 7.934 8.216 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -6.807 7.900 7.124 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -6.747 6.811 8.531 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -2.415 4.925 7.928 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -2.977 5.167 6.257 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -2.735 6.569 7.326 1.00 0.00 H new ATOM 363 N TRP A 26 -5.464 3.164 5.757 1.00 0.00 N ATOM 364 CA TRP A 26 -4.771 2.176 4.933 1.00 0.00 C ATOM 365 C TRP A 26 -5.501 0.834 4.940 1.00 0.00 C ATOM 366 O TRP A 26 -6.297 0.549 5.837 1.00 0.00 O ATOM 367 CB TRP A 26 -3.328 1.992 5.421 1.00 0.00 C ATOM 368 CG TRP A 26 -3.228 1.386 6.790 1.00 0.00 C ATOM 369 CD1 TRP A 26 -2.952 2.041 7.954 1.00 0.00 C ATOM 370 CD2 TRP A 26 -3.402 0.006 7.138 1.00 0.00 C ATOM 371 NE1 TRP A 26 -2.949 1.155 9.004 1.00 0.00 N ATOM 372 CE2 TRP A 26 -3.223 -0.098 8.529 1.00 0.00 C ATOM 373 CE3 TRP A 26 -3.695 -1.152 6.410 1.00 0.00 C ATOM 374 CZ2 TRP A 26 -3.327 -1.309 9.205 1.00 0.00 C ATOM 375 CZ3 TRP A 26 -3.799 -2.354 7.083 1.00 0.00 C ATOM 376 CH2 TRP A 26 -3.616 -2.424 8.466 1.00 0.00 C ATOM 0 H TRP A 26 -5.662 2.855 6.709 1.00 0.00 H new ATOM 0 HA TRP A 26 -4.758 2.548 3.909 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -2.792 1.360 4.713 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -2.828 2.961 5.425 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -2.763 3.101 8.038 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -2.771 1.393 9.980 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -3.837 -1.107 5.340 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -3.185 -1.367 10.274 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -4.025 -3.254 6.531 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -3.704 -3.379 8.963 1.00 0.00 H new ATOM 387 N VAL A 27 -5.209 0.011 3.935 1.00 0.00 N ATOM 388 CA VAL A 27 -5.814 -1.312 3.812 1.00 0.00 C ATOM 389 C VAL A 27 -4.775 -2.332 3.356 1.00 0.00 C ATOM 390 O VAL A 27 -3.837 -1.990 2.632 1.00 0.00 O ATOM 391 CB VAL A 27 -6.986 -1.325 2.808 1.00 0.00 C ATOM 392 CG1 VAL A 27 -7.890 -2.525 3.051 1.00 0.00 C ATOM 393 CG2 VAL A 27 -7.780 -0.027 2.876 1.00 0.00 C ATOM 0 H VAL A 27 -4.552 0.240 3.189 1.00 0.00 H new ATOM 0 HA VAL A 27 -6.197 -1.573 4.798 1.00 0.00 H new ATOM 0 HB VAL A 27 -6.568 -1.410 1.805 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -8.709 -2.515 2.332 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -7.315 -3.443 2.933 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -8.294 -2.478 4.062 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -8.599 -0.064 2.158 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -8.183 0.101 3.881 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -7.126 0.812 2.638 1.00 0.00 H new ATOM 403 N THR A 28 -4.947 -3.583 3.771 1.00 0.00 N ATOM 404 CA THR A 28 -4.019 -4.642 3.383 1.00 0.00 C ATOM 405 C THR A 28 -4.471 -5.281 2.071 1.00 0.00 C ATOM 406 O THR A 28 -5.625 -5.131 1.672 1.00 0.00 O ATOM 407 CB THR A 28 -3.916 -5.700 4.491 1.00 0.00 C ATOM 408 OG1 THR A 28 -3.366 -5.142 5.671 1.00 0.00 O ATOM 409 CG2 THR A 28 -3.065 -6.896 4.113 1.00 0.00 C ATOM 0 H THR A 28 -5.713 -3.888 4.371 1.00 0.00 H new ATOM 0 HA THR A 28 -3.031 -4.205 3.236 1.00 0.00 H new ATOM 0 HB THR A 28 -4.939 -6.041 4.651 1.00 0.00 H new ATOM 0 HG1 THR A 28 -3.016 -5.859 6.240 1.00 0.00 H new ATOM 0 HG21 THR A 28 -3.038 -7.601 4.944 1.00 0.00 H new ATOM 0 HG22 THR A 28 -3.492 -7.384 3.237 1.00 0.00 H new ATOM 0 HG23 THR A 28 -2.052 -6.564 3.886 1.00 0.00 H new ATOM 417 N PHE A 29 -3.562 -5.986 1.402 1.00 0.00 N ATOM 418 CA PHE A 29 -3.884 -6.644 0.138 1.00 0.00 C ATOM 419 C PHE A 29 -3.057 -7.914 -0.034 1.00 0.00 C ATOM 420 O PHE A 29 -1.931 -7.872 -0.531 1.00 0.00 O ATOM 421 CB PHE A 29 -3.648 -5.695 -1.041 1.00 0.00 C ATOM 422 CG PHE A 29 -4.844 -4.850 -1.384 1.00 0.00 C ATOM 423 CD1 PHE A 29 -5.070 -3.648 -0.731 1.00 0.00 C ATOM 424 CD2 PHE A 29 -5.742 -5.259 -2.357 1.00 0.00 C ATOM 425 CE1 PHE A 29 -6.168 -2.871 -1.043 1.00 0.00 C ATOM 426 CE2 PHE A 29 -6.841 -4.484 -2.673 1.00 0.00 C ATOM 427 CZ PHE A 29 -7.055 -3.289 -2.014 1.00 0.00 C ATOM 0 H PHE A 29 -2.599 -6.116 1.713 1.00 0.00 H new ATOM 0 HA PHE A 29 -4.939 -6.917 0.158 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -2.807 -5.042 -0.808 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -3.364 -6.280 -1.916 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -4.380 -3.316 0.030 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -5.581 -6.194 -2.874 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -6.333 -1.936 -0.527 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -7.533 -4.812 -3.435 1.00 0.00 H new ATOM 0 HZ PHE A 29 -7.915 -2.683 -2.258 1.00 0.00 H new ATOM 437 N LYS A 30 -3.623 -9.043 0.381 1.00 0.00 N ATOM 438 CA LYS A 30 -2.940 -10.329 0.277 1.00 0.00 C ATOM 439 C LYS A 30 -3.862 -11.388 -0.324 1.00 0.00 C ATOM 440 O LYS A 30 -5.061 -11.408 -0.047 1.00 0.00 O ATOM 441 CB LYS A 30 -2.445 -10.785 1.652 1.00 0.00 C ATOM 442 CG LYS A 30 -3.549 -10.909 2.693 1.00 0.00 C ATOM 443 CD LYS A 30 -3.043 -10.591 4.093 1.00 0.00 C ATOM 444 CE LYS A 30 -2.003 -11.600 4.562 1.00 0.00 C ATOM 445 NZ LYS A 30 -2.509 -13.000 4.505 1.00 0.00 N ATOM 0 H LYS A 30 -4.555 -9.094 0.793 1.00 0.00 H new ATOM 0 HA LYS A 30 -2.082 -10.203 -0.383 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -1.947 -11.749 1.547 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -1.697 -10.078 2.011 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -4.366 -10.233 2.439 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -3.955 -11.920 2.674 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -2.610 -9.591 4.104 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -3.882 -10.583 4.789 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -1.110 -11.513 3.943 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -1.706 -11.364 5.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -1.883 -13.618 5.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -3.471 -13.038 4.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -2.527 -13.323 3.516 1.00 0.00 H new ATOM 459 N TYR A 31 -3.294 -12.263 -1.146 1.00 0.00 N ATOM 460 CA TYR A 31 -4.072 -13.320 -1.783 1.00 0.00 C ATOM 461 C TYR A 31 -4.188 -14.540 -0.873 1.00 0.00 C ATOM 462 O TYR A 31 -3.197 -14.995 -0.296 1.00 0.00 O ATOM 463 CB TYR A 31 -3.452 -13.713 -3.130 1.00 0.00 C ATOM 464 CG TYR A 31 -2.040 -14.251 -3.035 1.00 0.00 C ATOM 465 CD1 TYR A 31 -1.803 -15.586 -2.725 1.00 0.00 C ATOM 466 CD2 TYR A 31 -0.944 -13.427 -3.261 1.00 0.00 C ATOM 467 CE1 TYR A 31 -0.516 -16.080 -2.642 1.00 0.00 C ATOM 468 CE2 TYR A 31 0.344 -13.916 -3.181 1.00 0.00 C ATOM 469 CZ TYR A 31 0.552 -15.243 -2.871 1.00 0.00 C ATOM 470 OH TYR A 31 1.835 -15.733 -2.793 1.00 0.00 O ATOM 0 H TYR A 31 -2.303 -12.262 -1.386 1.00 0.00 H new ATOM 0 HA TYR A 31 -5.076 -12.935 -1.963 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -4.084 -14.466 -3.601 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -3.453 -12.841 -3.785 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -2.638 -16.247 -2.546 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -1.103 -12.387 -3.503 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -0.348 -17.119 -2.398 1.00 0.00 H new ATOM 0 HE2 TYR A 31 1.185 -13.262 -3.360 1.00 0.00 H new ATOM 0 HH TYR A 31 2.454 -15.097 -3.208 1.00 0.00 H new ATOM 480 N ASP A 32 -5.405 -15.066 -0.750 1.00 0.00 N ATOM 481 CA ASP A 32 -5.652 -16.236 0.086 1.00 0.00 C ATOM 482 C ASP A 32 -5.834 -17.474 -0.783 1.00 0.00 C ATOM 483 O ASP A 32 -6.828 -17.600 -1.501 1.00 0.00 O ATOM 484 CB ASP A 32 -6.884 -16.014 0.969 1.00 0.00 C ATOM 485 CG ASP A 32 -6.616 -15.028 2.090 1.00 0.00 C ATOM 486 OD1 ASP A 32 -6.548 -13.811 1.810 1.00 0.00 O ATOM 487 OD2 ASP A 32 -6.467 -15.472 3.249 1.00 0.00 O ATOM 0 H ASP A 32 -6.234 -14.700 -1.219 1.00 0.00 H new ATOM 0 HA ASP A 32 -4.789 -16.389 0.734 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.707 -15.649 0.355 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -7.201 -16.967 1.393 1.00 0.00 H new ATOM 492 N GLY A 33 -4.856 -18.377 -0.730 1.00 0.00 N ATOM 493 CA GLY A 33 -4.917 -19.586 -1.531 1.00 0.00 C ATOM 494 C GLY A 33 -4.502 -19.335 -2.968 1.00 0.00 C ATOM 495 O GLY A 33 -3.429 -19.763 -3.396 1.00 0.00 O ATOM 0 H GLY A 33 -4.024 -18.291 -0.147 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -4.268 -20.344 -1.093 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -5.932 -19.984 -1.511 1.00 0.00 H new ATOM 499 N SER A 34 -5.355 -18.631 -3.711 1.00 0.00 N ATOM 500 CA SER A 34 -5.077 -18.310 -5.110 1.00 0.00 C ATOM 501 C SER A 34 -5.964 -17.160 -5.602 1.00 0.00 C ATOM 502 O SER A 34 -6.309 -17.095 -6.785 1.00 0.00 O ATOM 503 CB SER A 34 -5.285 -19.550 -5.985 1.00 0.00 C ATOM 504 OG SER A 34 -6.636 -19.979 -5.956 1.00 0.00 O ATOM 0 H SER A 34 -6.245 -18.272 -3.367 1.00 0.00 H new ATOM 0 HA SER A 34 -4.038 -17.989 -5.184 1.00 0.00 H new ATOM 0 HB2 SER A 34 -4.994 -19.327 -7.011 1.00 0.00 H new ATOM 0 HB3 SER A 34 -4.638 -20.355 -5.638 1.00 0.00 H new ATOM 0 HG SER A 34 -6.740 -20.771 -6.524 1.00 0.00 H new ATOM 510 N THR A 35 -6.329 -16.255 -4.689 1.00 0.00 N ATOM 511 CA THR A 35 -7.173 -15.115 -5.033 1.00 0.00 C ATOM 512 C THR A 35 -6.770 -13.877 -4.238 1.00 0.00 C ATOM 513 O THR A 35 -6.742 -13.900 -3.006 1.00 0.00 O ATOM 514 CB THR A 35 -8.644 -15.445 -4.780 1.00 0.00 C ATOM 515 OG1 THR A 35 -8.837 -15.920 -3.459 1.00 0.00 O ATOM 516 CG2 THR A 35 -9.186 -16.493 -5.724 1.00 0.00 C ATOM 0 H THR A 35 -6.052 -16.293 -3.708 1.00 0.00 H new ATOM 0 HA THR A 35 -7.035 -14.902 -6.093 1.00 0.00 H new ATOM 0 HB THR A 35 -9.181 -14.511 -4.943 1.00 0.00 H new ATOM 0 HG1 THR A 35 -8.319 -15.370 -2.835 1.00 0.00 H new ATOM 0 HG21 THR A 35 -10.234 -16.683 -5.493 1.00 0.00 H new ATOM 0 HG22 THR A 35 -9.099 -16.138 -6.751 1.00 0.00 H new ATOM 0 HG23 THR A 35 -8.616 -17.415 -5.610 1.00 0.00 H new ATOM 524 N ILE A 36 -6.461 -12.797 -4.953 1.00 0.00 N ATOM 525 CA ILE A 36 -6.059 -11.546 -4.320 1.00 0.00 C ATOM 526 C ILE A 36 -7.252 -10.862 -3.665 1.00 0.00 C ATOM 527 O ILE A 36 -8.302 -10.697 -4.290 1.00 0.00 O ATOM 528 CB ILE A 36 -5.414 -10.580 -5.335 1.00 0.00 C ATOM 529 CG1 ILE A 36 -4.305 -11.289 -6.117 1.00 0.00 C ATOM 530 CG2 ILE A 36 -4.864 -9.350 -4.626 1.00 0.00 C ATOM 531 CD1 ILE A 36 -4.546 -11.326 -7.609 1.00 0.00 C ATOM 0 H ILE A 36 -6.482 -12.765 -5.972 1.00 0.00 H new ATOM 0 HA ILE A 36 -5.321 -11.797 -3.558 1.00 0.00 H new ATOM 0 HB ILE A 36 -6.181 -10.257 -6.039 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -3.357 -10.787 -5.923 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.207 -12.310 -5.748 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -4.413 -8.680 -5.358 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -5.675 -8.833 -4.112 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -4.110 -9.655 -3.900 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.720 -11.843 -8.098 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -5.477 -11.854 -7.814 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -4.614 -10.308 -7.992 1.00 0.00 H new ATOM 543 N VAL A 37 -7.086 -10.472 -2.403 1.00 0.00 N ATOM 544 CA VAL A 37 -8.155 -9.811 -1.659 1.00 0.00 C ATOM 545 C VAL A 37 -7.592 -8.878 -0.586 1.00 0.00 C ATOM 546 O VAL A 37 -6.548 -9.157 0.006 1.00 0.00 O ATOM 547 CB VAL A 37 -9.097 -10.839 -0.992 1.00 0.00 C ATOM 548 CG1 VAL A 37 -9.966 -11.523 -2.036 1.00 0.00 C ATOM 549 CG2 VAL A 37 -8.305 -11.866 -0.195 1.00 0.00 C ATOM 0 H VAL A 37 -6.223 -10.602 -1.875 1.00 0.00 H new ATOM 0 HA VAL A 37 -8.723 -9.224 -2.381 1.00 0.00 H new ATOM 0 HB VAL A 37 -9.747 -10.304 -0.300 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -10.622 -12.243 -1.548 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -10.568 -10.776 -2.554 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -9.331 -12.040 -2.755 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -8.991 -12.578 0.264 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -7.624 -12.396 -0.860 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -7.732 -11.360 0.583 1.00 0.00 H new ATOM 559 N PRO A 38 -8.277 -7.748 -0.325 1.00 0.00 N ATOM 560 CA PRO A 38 -7.838 -6.772 0.680 1.00 0.00 C ATOM 561 C PRO A 38 -7.798 -7.363 2.090 1.00 0.00 C ATOM 562 O PRO A 38 -8.308 -8.459 2.329 1.00 0.00 O ATOM 563 CB PRO A 38 -8.888 -5.657 0.594 1.00 0.00 C ATOM 564 CG PRO A 38 -9.551 -5.851 -0.726 1.00 0.00 C ATOM 565 CD PRO A 38 -9.526 -7.329 -0.981 1.00 0.00 C ATOM 0 HA PRO A 38 -6.822 -6.428 0.488 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -9.607 -5.728 1.411 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -8.425 -4.673 0.662 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -10.574 -5.474 -0.709 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -9.024 -5.309 -1.512 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -10.395 -7.829 -0.554 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -9.520 -7.556 -2.047 1.00 0.00 H new ATOM 573 N GLY A 39 -7.187 -6.628 3.019 1.00 0.00 N ATOM 574 CA GLY A 39 -7.083 -7.087 4.387 1.00 0.00 C ATOM 575 C GLY A 39 -7.286 -5.971 5.393 1.00 0.00 C ATOM 576 O GLY A 39 -8.072 -5.053 5.159 1.00 0.00 O ATOM 0 H GLY A 39 -6.761 -5.718 2.842 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -7.823 -7.868 4.562 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -6.102 -7.537 4.542 1.00 0.00 H new ATOM 580 N GLU A 40 -6.570 -6.064 6.513 1.00 0.00 N ATOM 581 CA GLU A 40 -6.649 -5.088 7.603 1.00 0.00 C ATOM 582 C GLU A 40 -6.891 -3.667 7.101 1.00 0.00 C ATOM 583 O GLU A 40 -6.297 -3.230 6.117 1.00 0.00 O ATOM 584 CB GLU A 40 -5.369 -5.122 8.442 1.00 0.00 C ATOM 585 CG GLU A 40 -5.300 -6.294 9.408 1.00 0.00 C ATOM 586 CD GLU A 40 -4.798 -7.563 8.745 1.00 0.00 C ATOM 587 OE1 GLU A 40 -3.568 -7.779 8.727 1.00 0.00 O ATOM 588 OE2 GLU A 40 -5.637 -8.340 8.240 1.00 0.00 O ATOM 0 H GLU A 40 -5.914 -6.824 6.692 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.504 -5.372 8.216 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -4.509 -5.163 7.774 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -5.291 -4.193 9.006 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.643 -6.038 10.239 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -6.290 -6.474 9.828 1.00 0.00 H new ATOM 595 N GLN A 41 -7.769 -2.956 7.801 1.00 0.00 N ATOM 596 CA GLN A 41 -8.107 -1.577 7.458 1.00 0.00 C ATOM 597 C GLN A 41 -8.119 -0.713 8.718 1.00 0.00 C ATOM 598 O GLN A 41 -9.110 -0.687 9.451 1.00 0.00 O ATOM 599 CB GLN A 41 -9.471 -1.509 6.758 1.00 0.00 C ATOM 600 CG GLN A 41 -9.779 -2.719 5.890 1.00 0.00 C ATOM 601 CD GLN A 41 -11.049 -2.554 5.076 1.00 0.00 C ATOM 602 OE1 GLN A 41 -12.007 -3.308 5.242 1.00 0.00 O ATOM 603 NE2 GLN A 41 -11.062 -1.566 4.186 1.00 0.00 N ATOM 0 H GLN A 41 -8.264 -3.315 8.617 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.350 -1.197 6.772 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -10.251 -1.407 7.513 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.507 -0.612 6.140 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.942 -2.898 5.215 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -9.872 -3.601 6.524 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -10.246 -0.964 4.081 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -11.888 -1.410 3.609 1.00 0.00 H new ATOM 612 N GLY A 42 -7.008 -0.022 8.972 1.00 0.00 N ATOM 613 CA GLY A 42 -6.912 0.817 10.157 1.00 0.00 C ATOM 614 C GLY A 42 -6.290 2.173 9.887 1.00 0.00 C ATOM 615 O GLY A 42 -5.638 2.377 8.862 1.00 0.00 O ATOM 0 H GLY A 42 -6.176 -0.028 8.381 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.909 0.960 10.574 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.322 0.299 10.913 1.00 0.00 H new ATOM 619 N ALA A 43 -6.490 3.098 10.825 1.00 0.00 N ATOM 620 CA ALA A 43 -5.944 4.447 10.715 1.00 0.00 C ATOM 621 C ALA A 43 -4.519 4.506 11.266 1.00 0.00 C ATOM 622 O ALA A 43 -3.743 5.392 10.903 1.00 0.00 O ATOM 623 CB ALA A 43 -6.836 5.442 11.447 1.00 0.00 C ATOM 0 H ALA A 43 -7.030 2.934 11.675 1.00 0.00 H new ATOM 0 HA ALA A 43 -5.912 4.715 9.659 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.415 6.443 11.356 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -7.834 5.426 11.009 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -6.898 5.169 12.500 1.00 0.00 H new ATOM 629 N GLU A 44 -4.179 3.552 12.133 1.00 0.00 N ATOM 630 CA GLU A 44 -2.848 3.488 12.724 1.00 0.00 C ATOM 631 C GLU A 44 -1.962 2.544 11.920 1.00 0.00 C ATOM 632 O GLU A 44 -2.209 1.336 11.879 1.00 0.00 O ATOM 633 CB GLU A 44 -2.931 3.014 14.177 1.00 0.00 C ATOM 634 CG GLU A 44 -3.461 4.067 15.137 1.00 0.00 C ATOM 635 CD GLU A 44 -3.159 3.739 16.586 1.00 0.00 C ATOM 636 OE1 GLU A 44 -1.964 3.612 16.930 1.00 0.00 O ATOM 637 OE2 GLU A 44 -4.117 3.603 17.376 1.00 0.00 O ATOM 0 H GLU A 44 -4.811 2.813 12.440 1.00 0.00 H new ATOM 0 HA GLU A 44 -2.412 4.487 12.706 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -3.573 2.135 14.226 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -1.939 2.703 14.505 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -3.023 5.034 14.888 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -4.539 4.162 15.007 1.00 0.00 H new ATOM 644 N TYR A 45 -0.936 3.094 11.271 1.00 0.00 N ATOM 645 CA TYR A 45 -0.028 2.287 10.462 1.00 0.00 C ATOM 646 C TYR A 45 0.749 1.285 11.315 1.00 0.00 C ATOM 647 O TYR A 45 1.262 0.294 10.792 1.00 0.00 O ATOM 648 CB TYR A 45 0.945 3.171 9.686 1.00 0.00 C ATOM 649 CG TYR A 45 1.547 2.477 8.486 1.00 0.00 C ATOM 650 CD1 TYR A 45 0.803 2.272 7.331 1.00 0.00 C ATOM 651 CD2 TYR A 45 2.857 2.022 8.511 1.00 0.00 C ATOM 652 CE1 TYR A 45 1.348 1.633 6.235 1.00 0.00 C ATOM 653 CE2 TYR A 45 3.412 1.382 7.419 1.00 0.00 C ATOM 654 CZ TYR A 45 2.654 1.190 6.283 1.00 0.00 C ATOM 655 OH TYR A 45 3.203 0.554 5.192 1.00 0.00 O ATOM 0 H TYR A 45 -0.715 4.090 11.290 1.00 0.00 H new ATOM 0 HA TYR A 45 -0.641 1.729 9.754 1.00 0.00 H new ATOM 0 HB2 TYR A 45 0.425 4.070 9.356 1.00 0.00 H new ATOM 0 HB3 TYR A 45 1.746 3.492 10.352 1.00 0.00 H new ATOM 0 HD1 TYR A 45 -0.219 2.618 7.290 1.00 0.00 H new ATOM 0 HD2 TYR A 45 3.454 2.170 9.399 1.00 0.00 H new ATOM 0 HE1 TYR A 45 0.755 1.481 5.345 1.00 0.00 H new ATOM 0 HE2 TYR A 45 4.434 1.034 7.455 1.00 0.00 H new ATOM 0 HH TYR A 45 3.092 -0.415 5.288 1.00 0.00 H new ATOM 665 N GLN A 46 0.831 1.538 12.625 1.00 0.00 N ATOM 666 CA GLN A 46 1.541 0.643 13.539 1.00 0.00 C ATOM 667 C GLN A 46 1.154 -0.812 13.281 1.00 0.00 C ATOM 668 O GLN A 46 2.000 -1.708 13.336 1.00 0.00 O ATOM 669 CB GLN A 46 1.238 1.011 14.994 1.00 0.00 C ATOM 670 CG GLN A 46 2.360 1.774 15.680 1.00 0.00 C ATOM 671 CD GLN A 46 2.406 1.517 17.175 1.00 0.00 C ATOM 672 OE1 GLN A 46 2.229 2.431 17.979 1.00 0.00 O ATOM 673 NE2 GLN A 46 2.646 0.266 17.556 1.00 0.00 N ATOM 0 H GLN A 46 0.415 2.354 13.074 1.00 0.00 H new ATOM 0 HA GLN A 46 2.610 0.758 13.360 1.00 0.00 H new ATOM 0 HB2 GLN A 46 0.330 1.613 15.025 1.00 0.00 H new ATOM 0 HB3 GLN A 46 1.035 0.099 15.555 1.00 0.00 H new ATOM 0 HG2 GLN A 46 3.314 1.489 15.236 1.00 0.00 H new ATOM 0 HG3 GLN A 46 2.232 2.842 15.502 1.00 0.00 H new ATOM 0 HE21 GLN A 46 2.787 -0.462 16.856 1.00 0.00 H new ATOM 0 HE22 GLN A 46 2.689 0.034 18.548 1.00 0.00 H new ATOM 682 N HIS A 47 -0.127 -1.034 12.990 1.00 0.00 N ATOM 683 CA HIS A 47 -0.635 -2.373 12.714 1.00 0.00 C ATOM 684 C HIS A 47 0.052 -2.984 11.495 1.00 0.00 C ATOM 685 O HIS A 47 0.409 -4.162 11.507 1.00 0.00 O ATOM 686 CB HIS A 47 -2.147 -2.330 12.494 1.00 0.00 C ATOM 687 CG HIS A 47 -2.943 -2.558 13.742 1.00 0.00 C ATOM 688 ND1 HIS A 47 -2.395 -2.509 15.008 1.00 0.00 N ATOM 689 CD2 HIS A 47 -4.255 -2.841 13.914 1.00 0.00 C ATOM 690 CE1 HIS A 47 -3.335 -2.755 15.902 1.00 0.00 C ATOM 691 NE2 HIS A 47 -4.474 -2.957 15.264 1.00 0.00 N ATOM 0 H HIS A 47 -0.833 -0.299 12.940 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.416 -3.000 13.578 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -2.417 -1.361 12.073 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -2.420 -3.085 11.757 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -4.993 -2.955 13.134 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -3.196 -2.786 16.973 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -5.371 -3.165 15.703 1.00 0.00 H new ATOM 700 N PHE A 48 0.245 -2.179 10.449 1.00 0.00 N ATOM 701 CA PHE A 48 0.899 -2.654 9.234 1.00 0.00 C ATOM 702 C PHE A 48 2.378 -2.931 9.490 1.00 0.00 C ATOM 703 O PHE A 48 2.928 -3.911 8.992 1.00 0.00 O ATOM 704 CB PHE A 48 0.744 -1.637 8.101 1.00 0.00 C ATOM 705 CG PHE A 48 1.052 -2.215 6.749 1.00 0.00 C ATOM 706 CD1 PHE A 48 2.361 -2.307 6.305 1.00 0.00 C ATOM 707 CD2 PHE A 48 0.035 -2.675 5.929 1.00 0.00 C ATOM 708 CE1 PHE A 48 2.650 -2.847 5.067 1.00 0.00 C ATOM 709 CE2 PHE A 48 0.318 -3.216 4.689 1.00 0.00 C ATOM 710 CZ PHE A 48 1.628 -3.303 4.258 1.00 0.00 C ATOM 0 H PHE A 48 -0.041 -1.200 10.421 1.00 0.00 H new ATOM 0 HA PHE A 48 0.416 -3.584 8.935 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -0.276 -1.252 8.102 1.00 0.00 H new ATOM 0 HB3 PHE A 48 1.404 -0.790 8.287 1.00 0.00 H new ATOM 0 HD1 PHE A 48 3.164 -1.953 6.934 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -0.990 -2.610 6.262 1.00 0.00 H new ATOM 0 HE1 PHE A 48 3.675 -2.913 4.732 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -0.484 -3.570 4.058 1.00 0.00 H new ATOM 0 HZ PHE A 48 1.852 -3.727 3.290 1.00 0.00 H new ATOM 720 N ILE A 49 3.011 -2.063 10.279 1.00 0.00 N ATOM 721 CA ILE A 49 4.427 -2.211 10.616 1.00 0.00 C ATOM 722 C ILE A 49 4.671 -3.492 11.414 1.00 0.00 C ATOM 723 O ILE A 49 5.711 -4.137 11.273 1.00 0.00 O ATOM 724 CB ILE A 49 4.940 -1.007 11.437 1.00 0.00 C ATOM 725 CG1 ILE A 49 4.618 0.306 10.719 1.00 0.00 C ATOM 726 CG2 ILE A 49 6.438 -1.123 11.687 1.00 0.00 C ATOM 727 CD1 ILE A 49 4.613 1.510 11.636 1.00 0.00 C ATOM 0 H ILE A 49 2.564 -1.247 10.698 1.00 0.00 H new ATOM 0 HA ILE A 49 4.972 -2.260 9.673 1.00 0.00 H new ATOM 0 HB ILE A 49 4.432 -1.010 12.401 1.00 0.00 H new ATOM 0 HG12 ILE A 49 5.349 0.466 9.926 1.00 0.00 H new ATOM 0 HG13 ILE A 49 3.642 0.220 10.241 1.00 0.00 H new ATOM 0 HG21 ILE A 49 6.778 -0.265 12.267 1.00 0.00 H new ATOM 0 HG22 ILE A 49 6.645 -2.039 12.240 1.00 0.00 H new ATOM 0 HG23 ILE A 49 6.965 -1.148 10.733 1.00 0.00 H new ATOM 0 HD11 ILE A 49 4.378 2.405 11.060 1.00 0.00 H new ATOM 0 HD12 ILE A 49 3.863 1.371 12.414 1.00 0.00 H new ATOM 0 HD13 ILE A 49 5.595 1.622 12.095 1.00 0.00 H new ATOM 739 N GLN A 50 3.705 -3.849 12.258 1.00 0.00 N ATOM 740 CA GLN A 50 3.807 -5.047 13.088 1.00 0.00 C ATOM 741 C GLN A 50 3.314 -6.292 12.345 1.00 0.00 C ATOM 742 O GLN A 50 3.712 -7.413 12.666 1.00 0.00 O ATOM 743 CB GLN A 50 3.000 -4.854 14.376 1.00 0.00 C ATOM 744 CG GLN A 50 3.837 -4.929 15.642 1.00 0.00 C ATOM 745 CD GLN A 50 2.995 -5.143 16.884 1.00 0.00 C ATOM 746 OE1 GLN A 50 3.020 -4.335 17.812 1.00 0.00 O ATOM 747 NE2 GLN A 50 2.243 -6.238 16.910 1.00 0.00 N ATOM 0 H GLN A 50 2.840 -3.324 12.385 1.00 0.00 H new ATOM 0 HA GLN A 50 4.859 -5.199 13.331 1.00 0.00 H new ATOM 0 HB2 GLN A 50 2.500 -3.886 14.339 1.00 0.00 H new ATOM 0 HB3 GLN A 50 2.220 -5.614 14.422 1.00 0.00 H new ATOM 0 HG2 GLN A 50 4.556 -5.743 15.550 1.00 0.00 H new ATOM 0 HG3 GLN A 50 4.410 -4.008 15.750 1.00 0.00 H new ATOM 0 HE21 GLN A 50 2.252 -6.882 16.119 1.00 0.00 H new ATOM 0 HE22 GLN A 50 1.657 -6.435 17.721 1.00 0.00 H new ATOM 756 N GLN A 51 2.437 -6.090 11.362 1.00 0.00 N ATOM 757 CA GLN A 51 1.876 -7.192 10.581 1.00 0.00 C ATOM 758 C GLN A 51 2.784 -7.570 9.406 1.00 0.00 C ATOM 759 O GLN A 51 2.747 -8.707 8.931 1.00 0.00 O ATOM 760 CB GLN A 51 0.462 -6.817 10.101 1.00 0.00 C ATOM 761 CG GLN A 51 -0.035 -7.602 8.891 1.00 0.00 C ATOM 762 CD GLN A 51 0.605 -7.180 7.575 1.00 0.00 C ATOM 763 OE1 GLN A 51 1.222 -5.999 7.541 1.00 0.00 O flip ATOM 764 NE2 GLN A 51 0.542 -7.913 6.588 1.00 0.00 N flip ATOM 0 H GLN A 51 2.098 -5.168 11.087 1.00 0.00 H new ATOM 0 HA GLN A 51 1.808 -8.072 11.220 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -0.237 -6.966 10.924 1.00 0.00 H new ATOM 0 HB3 GLN A 51 0.447 -5.755 9.858 1.00 0.00 H new ATOM 0 HG2 GLN A 51 0.158 -8.662 9.054 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -1.116 -7.483 8.812 1.00 0.00 H new ATOM 0 HE21 GLN A 51 0.062 -8.811 6.649 1.00 0.00 H new ATOM 0 HE22 GLN A 51 0.970 -7.623 5.709 1.00 0.00 H new ATOM 773 N CYS A 52 3.593 -6.620 8.935 1.00 0.00 N ATOM 774 CA CYS A 52 4.492 -6.865 7.816 1.00 0.00 C ATOM 775 C CYS A 52 5.701 -7.708 8.240 1.00 0.00 C ATOM 776 O CYS A 52 6.839 -7.231 8.235 1.00 0.00 O ATOM 777 CB CYS A 52 4.954 -5.533 7.223 1.00 0.00 C ATOM 778 SG CYS A 52 5.903 -4.503 8.367 1.00 0.00 S ATOM 0 H CYS A 52 3.641 -5.674 9.314 1.00 0.00 H new ATOM 0 HA CYS A 52 3.947 -7.429 7.059 1.00 0.00 H new ATOM 0 HB2 CYS A 52 5.562 -5.732 6.341 1.00 0.00 H new ATOM 0 HB3 CYS A 52 4.080 -4.974 6.888 1.00 0.00 H new ATOM 0 HG CYS A 52 5.665 -4.879 9.589 1.00 0.00 H new ATOM 784 N THR A 53 5.450 -8.964 8.600 1.00 0.00 N ATOM 785 CA THR A 53 6.516 -9.873 9.019 1.00 0.00 C ATOM 786 C THR A 53 7.364 -10.308 7.823 1.00 0.00 C ATOM 787 O THR A 53 6.870 -10.392 6.696 1.00 0.00 O ATOM 788 CB THR A 53 5.930 -11.102 9.718 1.00 0.00 C ATOM 789 OG1 THR A 53 4.745 -11.535 9.071 1.00 0.00 O ATOM 790 CG2 THR A 53 5.594 -10.855 11.174 1.00 0.00 C ATOM 0 H THR A 53 4.517 -9.377 8.610 1.00 0.00 H new ATOM 0 HA THR A 53 7.156 -9.338 9.721 1.00 0.00 H new ATOM 0 HB THR A 53 6.708 -11.864 9.662 1.00 0.00 H new ATOM 0 HG1 THR A 53 4.389 -12.322 9.533 1.00 0.00 H new ATOM 0 HG21 THR A 53 5.183 -11.765 11.612 1.00 0.00 H new ATOM 0 HG22 THR A 53 6.498 -10.569 11.713 1.00 0.00 H new ATOM 0 HG23 THR A 53 4.859 -10.053 11.247 1.00 0.00 H new ATOM 798 N ASP A 54 8.644 -10.580 8.076 1.00 0.00 N ATOM 799 CA ASP A 54 9.567 -11.000 7.026 1.00 0.00 C ATOM 800 C ASP A 54 9.415 -12.491 6.710 1.00 0.00 C ATOM 801 O ASP A 54 10.383 -13.251 6.772 1.00 0.00 O ATOM 802 CB ASP A 54 11.009 -10.692 7.444 1.00 0.00 C ATOM 803 CG ASP A 54 11.336 -11.209 8.834 1.00 0.00 C ATOM 804 OD1 ASP A 54 10.830 -10.628 9.816 1.00 0.00 O ATOM 805 OD2 ASP A 54 12.090 -12.199 8.937 1.00 0.00 O ATOM 0 H ASP A 54 9.065 -10.516 9.003 1.00 0.00 H new ATOM 0 HA ASP A 54 9.326 -10.442 6.121 1.00 0.00 H new ATOM 0 HB2 ASP A 54 11.695 -11.137 6.724 1.00 0.00 H new ATOM 0 HB3 ASP A 54 11.170 -9.614 7.414 1.00 0.00 H new ATOM 810 N ASP A 55 8.198 -12.902 6.364 1.00 0.00 N ATOM 811 CA ASP A 55 7.922 -14.299 6.034 1.00 0.00 C ATOM 812 C ASP A 55 6.618 -14.426 5.247 1.00 0.00 C ATOM 813 O ASP A 55 5.839 -15.353 5.467 1.00 0.00 O ATOM 814 CB ASP A 55 7.845 -15.142 7.313 1.00 0.00 C ATOM 815 CG ASP A 55 8.562 -16.472 7.179 1.00 0.00 C ATOM 816 OD1 ASP A 55 8.299 -17.196 6.195 1.00 0.00 O ATOM 817 OD2 ASP A 55 9.387 -16.792 8.061 1.00 0.00 O ATOM 0 H ASP A 55 7.386 -12.288 6.305 1.00 0.00 H new ATOM 0 HA ASP A 55 8.738 -14.668 5.412 1.00 0.00 H new ATOM 0 HB2 ASP A 55 8.280 -14.581 8.140 1.00 0.00 H new ATOM 0 HB3 ASP A 55 6.799 -15.321 7.564 1.00 0.00 H new ATOM 822 N VAL A 56 6.387 -13.485 4.329 1.00 0.00 N ATOM 823 CA VAL A 56 5.171 -13.486 3.514 1.00 0.00 C ATOM 824 C VAL A 56 5.197 -12.367 2.479 1.00 0.00 C ATOM 825 O VAL A 56 5.833 -11.333 2.683 1.00 0.00 O ATOM 826 CB VAL A 56 3.894 -13.329 4.375 1.00 0.00 C ATOM 827 CG1 VAL A 56 3.275 -14.687 4.673 1.00 0.00 C ATOM 828 CG2 VAL A 56 4.194 -12.576 5.667 1.00 0.00 C ATOM 0 H VAL A 56 7.025 -12.714 4.132 1.00 0.00 H new ATOM 0 HA VAL A 56 5.145 -14.453 3.012 1.00 0.00 H new ATOM 0 HB VAL A 56 3.173 -12.743 3.805 1.00 0.00 H new ATOM 0 HG11 VAL A 56 2.379 -14.553 5.279 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.010 -15.179 3.737 1.00 0.00 H new ATOM 0 HG13 VAL A 56 3.992 -15.302 5.216 1.00 0.00 H new ATOM 0 HG21 VAL A 56 3.280 -12.480 6.253 1.00 0.00 H new ATOM 0 HG22 VAL A 56 4.938 -13.125 6.244 1.00 0.00 H new ATOM 0 HG23 VAL A 56 4.579 -11.584 5.429 1.00 0.00 H new ATOM 838 N ARG A 57 4.491 -12.580 1.374 1.00 0.00 N ATOM 839 CA ARG A 57 4.418 -11.592 0.300 1.00 0.00 C ATOM 840 C ARG A 57 3.006 -11.025 0.194 1.00 0.00 C ATOM 841 O ARG A 57 2.031 -11.777 0.140 1.00 0.00 O ATOM 842 CB ARG A 57 4.830 -12.228 -1.032 1.00 0.00 C ATOM 843 CG ARG A 57 4.013 -13.457 -1.402 1.00 0.00 C ATOM 844 CD ARG A 57 4.648 -14.735 -0.875 1.00 0.00 C ATOM 845 NE ARG A 57 3.667 -15.810 -0.728 1.00 0.00 N ATOM 846 CZ ARG A 57 3.824 -16.865 0.075 1.00 0.00 C ATOM 847 NH1 ARG A 57 4.922 -16.996 0.814 1.00 0.00 N ATOM 848 NH2 ARG A 57 2.875 -17.793 0.139 1.00 0.00 N ATOM 0 H ARG A 57 3.958 -13.432 1.197 1.00 0.00 H new ATOM 0 HA ARG A 57 5.105 -10.778 0.530 1.00 0.00 H new ATOM 0 HB2 ARG A 57 4.732 -11.486 -1.824 1.00 0.00 H new ATOM 0 HB3 ARG A 57 5.883 -12.504 -0.982 1.00 0.00 H new ATOM 0 HG2 ARG A 57 3.005 -13.359 -0.999 1.00 0.00 H new ATOM 0 HG3 ARG A 57 3.918 -13.518 -2.486 1.00 0.00 H new ATOM 0 HD2 ARG A 57 5.438 -15.055 -1.554 1.00 0.00 H new ATOM 0 HD3 ARG A 57 5.117 -14.537 0.089 1.00 0.00 H new ATOM 0 HE ARG A 57 2.808 -15.750 -1.274 1.00 0.00 H new ATOM 0 HH11 ARG A 57 5.654 -16.287 0.770 1.00 0.00 H new ATOM 0 HH12 ARG A 57 5.032 -17.806 1.424 1.00 0.00 H new ATOM 0 HH21 ARG A 57 2.030 -17.698 -0.424 1.00 0.00 H new ATOM 0 HH22 ARG A 57 2.992 -18.600 0.751 1.00 0.00 H new ATOM 862 N LEU A 58 2.894 -9.700 0.169 1.00 0.00 N ATOM 863 CA LEU A 58 1.584 -9.055 0.073 1.00 0.00 C ATOM 864 C LEU A 58 1.697 -7.614 -0.413 1.00 0.00 C ATOM 865 O LEU A 58 2.795 -7.088 -0.588 1.00 0.00 O ATOM 866 CB LEU A 58 0.867 -9.096 1.427 1.00 0.00 C ATOM 867 CG LEU A 58 1.715 -8.675 2.631 1.00 0.00 C ATOM 868 CD1 LEU A 58 1.420 -7.232 3.014 1.00 0.00 C ATOM 869 CD2 LEU A 58 1.464 -9.604 3.810 1.00 0.00 C ATOM 0 H LEU A 58 3.684 -9.056 0.213 1.00 0.00 H new ATOM 0 HA LEU A 58 1.000 -9.611 -0.661 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -0.008 -8.448 1.376 1.00 0.00 H new ATOM 0 HB3 LEU A 58 0.504 -10.110 1.596 1.00 0.00 H new ATOM 0 HG LEU A 58 2.767 -8.748 2.354 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.032 -6.951 3.871 1.00 0.00 H new ATOM 0 HD12 LEU A 58 1.651 -6.578 2.173 1.00 0.00 H new ATOM 0 HD13 LEU A 58 0.366 -7.132 3.272 1.00 0.00 H new ATOM 0 HD21 LEU A 58 2.075 -9.290 4.657 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.411 -9.563 4.087 1.00 0.00 H new ATOM 0 HD23 LEU A 58 1.727 -10.625 3.531 1.00 0.00 H new ATOM 881 N PHE A 59 0.546 -6.982 -0.627 1.00 0.00 N ATOM 882 CA PHE A 59 0.497 -5.600 -1.088 1.00 0.00 C ATOM 883 C PHE A 59 -0.043 -4.679 0.005 1.00 0.00 C ATOM 884 O PHE A 59 -0.391 -5.131 1.098 1.00 0.00 O ATOM 885 CB PHE A 59 -0.374 -5.487 -2.342 1.00 0.00 C ATOM 886 CG PHE A 59 0.090 -6.346 -3.485 1.00 0.00 C ATOM 887 CD1 PHE A 59 1.388 -6.249 -3.963 1.00 0.00 C ATOM 888 CD2 PHE A 59 -0.775 -7.249 -4.082 1.00 0.00 C ATOM 889 CE1 PHE A 59 1.813 -7.038 -5.015 1.00 0.00 C ATOM 890 CE2 PHE A 59 -0.354 -8.039 -5.132 1.00 0.00 C ATOM 891 CZ PHE A 59 0.941 -7.933 -5.600 1.00 0.00 C ATOM 0 H PHE A 59 -0.370 -7.409 -0.487 1.00 0.00 H new ATOM 0 HA PHE A 59 1.513 -5.290 -1.331 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -1.398 -5.760 -2.087 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -0.393 -4.447 -2.667 1.00 0.00 H new ATOM 0 HD1 PHE A 59 2.074 -5.550 -3.508 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -1.789 -7.335 -3.722 1.00 0.00 H new ATOM 0 HE1 PHE A 59 2.826 -6.954 -5.379 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -1.037 -8.740 -5.588 1.00 0.00 H new ATOM 0 HZ PHE A 59 1.271 -8.550 -6.423 1.00 0.00 H new ATOM 901 N ALA A 60 -0.109 -3.385 -0.299 1.00 0.00 N ATOM 902 CA ALA A 60 -0.602 -2.391 0.648 1.00 0.00 C ATOM 903 C ALA A 60 -1.355 -1.274 -0.072 1.00 0.00 C ATOM 904 O ALA A 60 -1.183 -1.072 -1.276 1.00 0.00 O ATOM 905 CB ALA A 60 0.552 -1.817 1.457 1.00 0.00 C ATOM 0 H ALA A 60 0.175 -3.000 -1.200 1.00 0.00 H new ATOM 0 HA ALA A 60 -1.298 -2.884 1.327 1.00 0.00 H new ATOM 0 HB1 ALA A 60 0.171 -1.076 2.160 1.00 0.00 H new ATOM 0 HB2 ALA A 60 1.045 -2.619 2.007 1.00 0.00 H new ATOM 0 HB3 ALA A 60 1.268 -1.344 0.785 1.00 0.00 H new ATOM 911 N PHE A 61 -2.188 -0.553 0.675 1.00 0.00 N ATOM 912 CA PHE A 61 -2.972 0.544 0.113 1.00 0.00 C ATOM 913 C PHE A 61 -3.213 1.630 1.158 1.00 0.00 C ATOM 914 O PHE A 61 -3.836 1.380 2.188 1.00 0.00 O ATOM 915 CB PHE A 61 -4.313 0.017 -0.410 1.00 0.00 C ATOM 916 CG PHE A 61 -4.765 0.670 -1.687 1.00 0.00 C ATOM 917 CD1 PHE A 61 -5.440 1.881 -1.661 1.00 0.00 C ATOM 918 CD2 PHE A 61 -4.520 0.070 -2.911 1.00 0.00 C ATOM 919 CE1 PHE A 61 -5.860 2.481 -2.833 1.00 0.00 C ATOM 920 CE2 PHE A 61 -4.938 0.666 -4.086 1.00 0.00 C ATOM 921 CZ PHE A 61 -5.609 1.872 -4.046 1.00 0.00 C ATOM 0 H PHE A 61 -2.337 -0.709 1.672 1.00 0.00 H new ATOM 0 HA PHE A 61 -2.409 0.979 -0.713 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -4.232 -1.058 -0.571 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -5.075 0.168 0.354 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -5.640 2.361 -0.714 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -3.997 -0.874 -2.948 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -6.384 3.425 -2.800 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -4.740 0.189 -5.034 1.00 0.00 H new ATOM 0 HZ PHE A 61 -5.937 2.338 -4.963 1.00 0.00 H new ATOM 931 N VAL A 62 -2.720 2.837 0.888 1.00 0.00 N ATOM 932 CA VAL A 62 -2.892 3.957 1.811 1.00 0.00 C ATOM 933 C VAL A 62 -2.941 5.288 1.062 1.00 0.00 C ATOM 934 O VAL A 62 -2.186 5.506 0.114 1.00 0.00 O ATOM 935 CB VAL A 62 -1.766 4.001 2.869 1.00 0.00 C ATOM 936 CG1 VAL A 62 -0.415 4.265 2.221 1.00 0.00 C ATOM 937 CG2 VAL A 62 -2.068 5.052 3.930 1.00 0.00 C ATOM 0 H VAL A 62 -2.200 3.064 0.041 1.00 0.00 H new ATOM 0 HA VAL A 62 -3.842 3.802 2.321 1.00 0.00 H new ATOM 0 HB VAL A 62 -1.721 3.025 3.353 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.358 4.291 2.989 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -0.192 3.471 1.508 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -0.442 5.223 1.701 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -1.264 5.068 4.666 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -2.148 6.032 3.459 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -3.008 4.809 4.425 1.00 0.00 H new ATOM 947 N ARG A 63 -3.836 6.172 1.498 1.00 0.00 N ATOM 948 CA ARG A 63 -3.986 7.485 0.875 1.00 0.00 C ATOM 949 C ARG A 63 -3.744 8.600 1.891 1.00 0.00 C ATOM 950 O ARG A 63 -3.957 8.418 3.091 1.00 0.00 O ATOM 951 CB ARG A 63 -5.381 7.632 0.256 1.00 0.00 C ATOM 952 CG ARG A 63 -6.518 7.285 1.206 1.00 0.00 C ATOM 953 CD ARG A 63 -7.720 8.195 0.996 1.00 0.00 C ATOM 954 NE ARG A 63 -7.497 9.535 1.540 1.00 0.00 N ATOM 955 CZ ARG A 63 -8.270 10.589 1.270 1.00 0.00 C ATOM 956 NH1 ARG A 63 -9.319 10.468 0.461 1.00 0.00 N ATOM 957 NH2 ARG A 63 -7.994 11.770 1.812 1.00 0.00 N ATOM 0 H ARG A 63 -4.468 6.003 2.280 1.00 0.00 H new ATOM 0 HA ARG A 63 -3.240 7.569 0.084 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -5.509 8.658 -0.088 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.447 6.991 -0.623 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -6.816 6.247 1.055 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.172 7.370 2.236 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.937 8.268 -0.070 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.596 7.753 1.470 1.00 0.00 H new ATOM 0 HE ARG A 63 -6.702 9.672 2.164 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -9.538 9.564 0.042 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -9.904 11.279 0.260 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -7.192 11.871 2.434 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -8.584 12.576 1.606 1.00 0.00 H new ATOM 971 N PHE A 64 -3.297 9.754 1.400 1.00 0.00 N ATOM 972 CA PHE A 64 -3.023 10.902 2.262 1.00 0.00 C ATOM 973 C PHE A 64 -3.496 12.199 1.614 1.00 0.00 C ATOM 974 O PHE A 64 -3.515 12.322 0.388 1.00 0.00 O ATOM 975 CB PHE A 64 -1.527 11.003 2.571 1.00 0.00 C ATOM 976 CG PHE A 64 -0.925 9.730 3.095 1.00 0.00 C ATOM 977 CD1 PHE A 64 -1.102 9.354 4.416 1.00 0.00 C ATOM 978 CD2 PHE A 64 -0.179 8.911 2.263 1.00 0.00 C ATOM 979 CE1 PHE A 64 -0.547 8.185 4.898 1.00 0.00 C ATOM 980 CE2 PHE A 64 0.379 7.741 2.740 1.00 0.00 C ATOM 981 CZ PHE A 64 0.195 7.378 4.057 1.00 0.00 C ATOM 0 H PHE A 64 -3.117 9.919 0.410 1.00 0.00 H new ATOM 0 HA PHE A 64 -3.572 10.752 3.192 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -0.998 11.297 1.664 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -1.370 11.795 3.303 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -1.681 9.982 5.077 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -0.032 9.190 1.230 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.693 7.902 5.930 1.00 0.00 H new ATOM 0 HE2 PHE A 64 0.959 7.111 2.082 1.00 0.00 H new ATOM 0 HZ PHE A 64 0.631 6.463 4.431 1.00 0.00 H new ATOM 991 N THR A 65 -3.865 13.168 2.449 1.00 0.00 N ATOM 992 CA THR A 65 -4.328 14.464 1.967 1.00 0.00 C ATOM 993 C THR A 65 -3.624 15.598 2.710 1.00 0.00 C ATOM 994 O THR A 65 -3.596 15.622 3.942 1.00 0.00 O ATOM 995 CB THR A 65 -5.848 14.580 2.125 1.00 0.00 C ATOM 996 OG1 THR A 65 -6.307 15.850 1.693 1.00 0.00 O ATOM 997 CG2 THR A 65 -6.327 14.373 3.549 1.00 0.00 C ATOM 0 H THR A 65 -3.852 13.078 3.465 1.00 0.00 H new ATOM 0 HA THR A 65 -4.082 14.545 0.908 1.00 0.00 H new ATOM 0 HB THR A 65 -6.259 13.783 1.506 1.00 0.00 H new ATOM 0 HG1 THR A 65 -7.280 15.901 1.801 1.00 0.00 H new ATOM 0 HG21 THR A 65 -7.412 14.469 3.586 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.039 13.378 3.889 1.00 0.00 H new ATOM 0 HG23 THR A 65 -5.874 15.123 4.198 1.00 0.00 H new ATOM 1122 N SER A 74 -5.820 15.278 -2.024 1.00 0.00 N ATOM 1123 CA SER A 74 -5.829 13.885 -1.585 1.00 0.00 C ATOM 1124 C SER A 74 -5.308 12.968 -2.689 1.00 0.00 C ATOM 1125 O SER A 74 -5.754 13.049 -3.836 1.00 0.00 O ATOM 1126 CB SER A 74 -7.244 13.463 -1.179 1.00 0.00 C ATOM 1127 OG SER A 74 -8.226 14.178 -1.911 1.00 0.00 O ATOM 0 HA SER A 74 -5.172 13.797 -0.720 1.00 0.00 H new ATOM 0 HB2 SER A 74 -7.369 12.393 -1.348 1.00 0.00 H new ATOM 0 HB3 SER A 74 -7.385 13.636 -0.112 1.00 0.00 H new ATOM 0 HG SER A 74 -7.794 14.888 -2.431 1.00 0.00 H new ATOM 1133 N LYS A 75 -4.358 12.101 -2.341 1.00 0.00 N ATOM 1134 CA LYS A 75 -3.774 11.175 -3.310 1.00 0.00 C ATOM 1135 C LYS A 75 -3.646 9.767 -2.726 1.00 0.00 C ATOM 1136 O LYS A 75 -3.669 9.585 -1.506 1.00 0.00 O ATOM 1137 CB LYS A 75 -2.401 11.685 -3.763 1.00 0.00 C ATOM 1138 CG LYS A 75 -2.457 13.024 -4.485 1.00 0.00 C ATOM 1139 CD LYS A 75 -2.431 12.849 -5.996 1.00 0.00 C ATOM 1140 CE LYS A 75 -3.721 13.336 -6.641 1.00 0.00 C ATOM 1141 NZ LYS A 75 -3.738 14.817 -6.808 1.00 0.00 N ATOM 0 H LYS A 75 -3.977 12.021 -1.398 1.00 0.00 H new ATOM 0 HA LYS A 75 -4.440 11.123 -4.171 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -1.752 11.778 -2.892 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -1.947 10.945 -4.422 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -3.363 13.556 -4.196 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -1.613 13.640 -4.175 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -1.586 13.398 -6.412 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -2.277 11.797 -6.238 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -3.842 12.860 -7.614 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -4.570 13.030 -6.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -4.634 15.106 -7.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.649 15.272 -5.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -2.943 15.107 -7.413 1.00 0.00 H new ATOM 1155 N PHE A 76 -3.512 8.775 -3.608 1.00 0.00 N ATOM 1156 CA PHE A 76 -3.384 7.379 -3.191 1.00 0.00 C ATOM 1157 C PHE A 76 -1.988 6.839 -3.498 1.00 0.00 C ATOM 1158 O PHE A 76 -1.246 7.422 -4.291 1.00 0.00 O ATOM 1159 CB PHE A 76 -4.436 6.513 -3.891 1.00 0.00 C ATOM 1160 CG PHE A 76 -5.853 6.876 -3.544 1.00 0.00 C ATOM 1161 CD1 PHE A 76 -6.486 7.935 -4.175 1.00 0.00 C ATOM 1162 CD2 PHE A 76 -6.552 6.156 -2.589 1.00 0.00 C ATOM 1163 CE1 PHE A 76 -7.788 8.270 -3.858 1.00 0.00 C ATOM 1164 CE2 PHE A 76 -7.854 6.485 -2.268 1.00 0.00 C ATOM 1165 CZ PHE A 76 -8.474 7.543 -2.904 1.00 0.00 C ATOM 0 H PHE A 76 -3.489 8.914 -4.618 1.00 0.00 H new ATOM 0 HA PHE A 76 -3.543 7.338 -2.113 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -4.303 6.598 -4.970 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -4.265 5.469 -3.630 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -5.955 8.505 -4.923 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -6.073 5.327 -2.089 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -8.269 9.099 -4.355 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -8.387 5.916 -1.521 1.00 0.00 H new ATOM 0 HZ PHE A 76 -9.493 7.801 -2.656 1.00 0.00 H new ATOM 1175 N ALA A 77 -1.637 5.720 -2.865 1.00 0.00 N ATOM 1176 CA ALA A 77 -0.332 5.096 -3.069 1.00 0.00 C ATOM 1177 C ALA A 77 -0.400 3.586 -2.863 1.00 0.00 C ATOM 1178 O ALA A 77 -0.861 3.111 -1.822 1.00 0.00 O ATOM 1179 CB ALA A 77 0.699 5.711 -2.134 1.00 0.00 C ATOM 0 H ALA A 77 -2.240 5.227 -2.206 1.00 0.00 H new ATOM 0 HA ALA A 77 -0.030 5.280 -4.100 1.00 0.00 H new ATOM 0 HB1 ALA A 77 1.667 5.237 -2.297 1.00 0.00 H new ATOM 0 HB2 ALA A 77 0.780 6.779 -2.334 1.00 0.00 H new ATOM 0 HB3 ALA A 77 0.389 5.558 -1.100 1.00 0.00 H new ATOM 1185 N LEU A 78 0.068 2.838 -3.860 1.00 0.00 N ATOM 1186 CA LEU A 78 0.073 1.381 -3.795 1.00 0.00 C ATOM 1187 C LEU A 78 1.462 0.872 -3.421 1.00 0.00 C ATOM 1188 O LEU A 78 2.413 1.016 -4.188 1.00 0.00 O ATOM 1189 CB LEU A 78 -0.363 0.786 -5.136 1.00 0.00 C ATOM 1190 CG LEU A 78 -1.874 0.620 -5.314 1.00 0.00 C ATOM 1191 CD1 LEU A 78 -2.497 1.910 -5.821 1.00 0.00 C ATOM 1192 CD2 LEU A 78 -2.173 -0.529 -6.264 1.00 0.00 C ATOM 0 H LEU A 78 0.450 3.220 -4.725 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.634 1.067 -3.027 1.00 0.00 H new ATOM 0 HB2 LEU A 78 0.014 1.422 -5.937 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.110 -0.189 -5.254 1.00 0.00 H new ATOM 0 HG LEU A 78 -2.313 0.388 -4.344 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -3.572 1.772 -5.941 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.312 2.710 -5.104 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.055 2.174 -6.782 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -3.252 -0.634 -6.380 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.722 -0.325 -7.235 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -1.760 -1.453 -5.859 1.00 0.00 H new ATOM 1204 N ILE A 79 1.575 0.285 -2.234 1.00 0.00 N ATOM 1205 CA ILE A 79 2.855 -0.232 -1.759 1.00 0.00 C ATOM 1206 C ILE A 79 2.913 -1.754 -1.861 1.00 0.00 C ATOM 1207 O ILE A 79 1.939 -2.443 -1.564 1.00 0.00 O ATOM 1208 CB ILE A 79 3.125 0.186 -0.298 1.00 0.00 C ATOM 1209 CG1 ILE A 79 2.819 1.674 -0.101 1.00 0.00 C ATOM 1210 CG2 ILE A 79 4.566 -0.114 0.086 1.00 0.00 C ATOM 1211 CD1 ILE A 79 2.713 2.083 1.354 1.00 0.00 C ATOM 0 H ILE A 79 0.799 0.155 -1.585 1.00 0.00 H new ATOM 0 HA ILE A 79 3.624 0.199 -2.401 1.00 0.00 H new ATOM 0 HB ILE A 79 2.467 -0.392 0.351 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.601 2.264 -0.580 1.00 0.00 H new ATOM 0 HG13 ILE A 79 1.884 1.914 -0.607 1.00 0.00 H new ATOM 0 HG21 ILE A 79 4.737 0.188 1.119 1.00 0.00 H new ATOM 0 HG22 ILE A 79 4.755 -1.183 -0.016 1.00 0.00 H new ATOM 0 HG23 ILE A 79 5.240 0.438 -0.570 1.00 0.00 H new ATOM 0 HD11 ILE A 79 2.495 3.149 1.417 1.00 0.00 H new ATOM 0 HD12 ILE A 79 1.912 1.520 1.833 1.00 0.00 H new ATOM 0 HD13 ILE A 79 3.656 1.875 1.860 1.00 0.00 H new ATOM 1223 N THR A 80 4.067 -2.271 -2.274 1.00 0.00 N ATOM 1224 CA THR A 80 4.264 -3.712 -2.405 1.00 0.00 C ATOM 1225 C THR A 80 5.210 -4.218 -1.319 1.00 0.00 C ATOM 1226 O THR A 80 6.319 -3.704 -1.167 1.00 0.00 O ATOM 1227 CB THR A 80 4.820 -4.057 -3.790 1.00 0.00 C ATOM 1228 OG1 THR A 80 4.080 -3.411 -4.814 1.00 0.00 O ATOM 1229 CG2 THR A 80 4.811 -5.543 -4.085 1.00 0.00 C ATOM 0 H THR A 80 4.882 -1.712 -2.524 1.00 0.00 H new ATOM 0 HA THR A 80 3.298 -4.202 -2.288 1.00 0.00 H new ATOM 0 HB THR A 80 5.853 -3.709 -3.776 1.00 0.00 H new ATOM 0 HG1 THR A 80 4.229 -3.872 -5.666 1.00 0.00 H new ATOM 0 HG21 THR A 80 5.217 -5.719 -5.081 1.00 0.00 H new ATOM 0 HG22 THR A 80 5.421 -6.064 -3.347 1.00 0.00 H new ATOM 0 HG23 THR A 80 3.788 -5.917 -4.039 1.00 0.00 H new ATOM 1237 N TRP A 81 4.765 -5.219 -0.564 1.00 0.00 N ATOM 1238 CA TRP A 81 5.575 -5.783 0.510 1.00 0.00 C ATOM 1239 C TRP A 81 6.053 -7.196 0.171 1.00 0.00 C ATOM 1240 O TRP A 81 5.316 -7.991 -0.412 1.00 0.00 O ATOM 1241 CB TRP A 81 4.782 -5.805 1.823 1.00 0.00 C ATOM 1242 CG TRP A 81 5.527 -6.448 2.955 1.00 0.00 C ATOM 1243 CD1 TRP A 81 5.173 -7.576 3.638 1.00 0.00 C ATOM 1244 CD2 TRP A 81 6.761 -6.002 3.532 1.00 0.00 C ATOM 1245 NE1 TRP A 81 6.109 -7.859 4.603 1.00 0.00 N ATOM 1246 CE2 TRP A 81 7.093 -6.906 4.558 1.00 0.00 C ATOM 1247 CE3 TRP A 81 7.615 -4.926 3.279 1.00 0.00 C ATOM 1248 CZ2 TRP A 81 8.244 -6.765 5.329 1.00 0.00 C ATOM 1249 CZ3 TRP A 81 8.757 -4.787 4.045 1.00 0.00 C ATOM 1250 CH2 TRP A 81 9.063 -5.703 5.060 1.00 0.00 C ATOM 0 H TRP A 81 3.850 -5.655 -0.676 1.00 0.00 H new ATOM 0 HA TRP A 81 6.452 -5.147 0.628 1.00 0.00 H new ATOM 0 HB2 TRP A 81 4.524 -4.783 2.101 1.00 0.00 H new ATOM 0 HB3 TRP A 81 3.845 -6.338 1.664 1.00 0.00 H new ATOM 0 HD1 TRP A 81 4.286 -8.161 3.447 1.00 0.00 H new ATOM 0 HE1 TRP A 81 6.077 -8.649 5.247 1.00 0.00 H new ATOM 0 HE3 TRP A 81 7.387 -4.215 2.499 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 8.482 -7.470 6.112 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 9.424 -3.959 3.858 1.00 0.00 H new ATOM 0 HH2 TRP A 81 9.963 -5.568 5.641 1.00 0.00 H new ATOM 1261 N ILE A 82 7.290 -7.497 0.558 1.00 0.00 N ATOM 1262 CA ILE A 82 7.879 -8.809 0.321 1.00 0.00 C ATOM 1263 C ILE A 82 8.684 -9.246 1.544 1.00 0.00 C ATOM 1264 O ILE A 82 9.799 -8.771 1.769 1.00 0.00 O ATOM 1265 CB ILE A 82 8.781 -8.812 -0.931 1.00 0.00 C ATOM 1266 CG1 ILE A 82 7.985 -8.371 -2.163 1.00 0.00 C ATOM 1267 CG2 ILE A 82 9.385 -10.192 -1.155 1.00 0.00 C ATOM 1268 CD1 ILE A 82 8.827 -8.227 -3.413 1.00 0.00 C ATOM 0 H ILE A 82 7.907 -6.843 1.041 1.00 0.00 H new ATOM 0 HA ILE A 82 7.065 -9.513 0.147 1.00 0.00 H new ATOM 0 HB ILE A 82 9.594 -8.104 -0.770 1.00 0.00 H new ATOM 0 HG12 ILE A 82 7.193 -9.096 -2.351 1.00 0.00 H new ATOM 0 HG13 ILE A 82 7.501 -7.418 -1.950 1.00 0.00 H new ATOM 0 HG21 ILE A 82 10.017 -10.173 -2.043 1.00 0.00 H new ATOM 0 HG22 ILE A 82 9.984 -10.472 -0.289 1.00 0.00 H new ATOM 0 HG23 ILE A 82 8.586 -10.920 -1.295 1.00 0.00 H new ATOM 0 HD11 ILE A 82 8.195 -7.912 -4.243 1.00 0.00 H new ATOM 0 HD12 ILE A 82 9.603 -7.481 -3.245 1.00 0.00 H new ATOM 0 HD13 ILE A 82 9.290 -9.184 -3.652 1.00 0.00 H new ATOM 1280 N GLY A 83 8.094 -10.132 2.342 1.00 0.00 N ATOM 1281 CA GLY A 83 8.743 -10.605 3.552 1.00 0.00 C ATOM 1282 C GLY A 83 9.865 -11.597 3.299 1.00 0.00 C ATOM 1283 O GLY A 83 9.628 -12.802 3.277 1.00 0.00 O ATOM 0 H GLY A 83 7.172 -10.533 2.170 1.00 0.00 H new ATOM 0 HA2 GLY A 83 9.143 -9.750 4.097 1.00 0.00 H new ATOM 0 HA3 GLY A 83 7.996 -11.071 4.195 1.00 0.00 H new ATOM 1287 N GLU A 84 11.083 -11.057 3.145 1.00 0.00 N ATOM 1288 CA GLU A 84 12.331 -11.819 2.924 1.00 0.00 C ATOM 1289 C GLU A 84 12.143 -13.254 2.425 1.00 0.00 C ATOM 1290 O GLU A 84 12.435 -13.555 1.267 1.00 0.00 O ATOM 1291 CB GLU A 84 13.132 -11.856 4.222 1.00 0.00 C ATOM 1292 CG GLU A 84 14.449 -11.101 4.155 1.00 0.00 C ATOM 1293 CD GLU A 84 14.901 -10.602 5.513 1.00 0.00 C ATOM 1294 OE1 GLU A 84 14.135 -9.850 6.154 1.00 0.00 O ATOM 1295 OE2 GLU A 84 16.018 -10.965 5.938 1.00 0.00 O ATOM 0 H GLU A 84 11.236 -10.049 3.171 1.00 0.00 H new ATOM 0 HA GLU A 84 12.854 -11.291 2.126 1.00 0.00 H new ATOM 0 HB2 GLU A 84 12.525 -11.437 5.024 1.00 0.00 H new ATOM 0 HB3 GLU A 84 13.333 -12.895 4.484 1.00 0.00 H new ATOM 0 HG2 GLU A 84 15.217 -11.752 3.737 1.00 0.00 H new ATOM 0 HG3 GLU A 84 14.345 -10.254 3.476 1.00 0.00 H new ATOM 1302 N ASN A 85 11.689 -14.137 3.325 1.00 0.00 N ATOM 1303 CA ASN A 85 11.485 -15.554 3.021 1.00 0.00 C ATOM 1304 C ASN A 85 10.857 -15.763 1.651 1.00 0.00 C ATOM 1305 O ASN A 85 11.055 -16.806 1.027 1.00 0.00 O ATOM 1306 CB ASN A 85 10.613 -16.197 4.096 1.00 0.00 C ATOM 1307 CG ASN A 85 11.407 -16.585 5.327 1.00 0.00 C ATOM 1308 OD1 ASN A 85 11.881 -17.715 5.441 1.00 0.00 O ATOM 1309 ND2 ASN A 85 11.560 -15.649 6.256 1.00 0.00 N ATOM 0 H ASN A 85 11.453 -13.885 4.285 1.00 0.00 H new ATOM 0 HA ASN A 85 12.466 -16.030 3.007 1.00 0.00 H new ATOM 0 HB2 ASN A 85 9.822 -15.504 4.381 1.00 0.00 H new ATOM 0 HB3 ASN A 85 10.128 -17.083 3.685 1.00 0.00 H new ATOM 0 HD21 ASN A 85 12.087 -15.854 7.105 1.00 0.00 H new ATOM 0 HD22 ASN A 85 11.150 -14.725 6.121 1.00 0.00 H new ATOM 1316 N VAL A 86 10.110 -14.762 1.187 1.00 0.00 N ATOM 1317 CA VAL A 86 9.464 -14.828 -0.122 1.00 0.00 C ATOM 1318 C VAL A 86 10.435 -15.370 -1.176 1.00 0.00 C ATOM 1319 O VAL A 86 11.346 -14.667 -1.615 1.00 0.00 O ATOM 1320 CB VAL A 86 8.959 -13.441 -0.572 1.00 0.00 C ATOM 1321 CG1 VAL A 86 8.087 -13.575 -1.804 1.00 0.00 C ATOM 1322 CG2 VAL A 86 8.202 -12.742 0.550 1.00 0.00 C ATOM 0 H VAL A 86 9.938 -13.896 1.698 1.00 0.00 H new ATOM 0 HA VAL A 86 8.611 -15.500 -0.027 1.00 0.00 H new ATOM 0 HB VAL A 86 9.824 -12.827 -0.822 1.00 0.00 H new ATOM 0 HG11 VAL A 86 7.737 -12.589 -2.111 1.00 0.00 H new ATOM 0 HG12 VAL A 86 8.665 -14.023 -2.612 1.00 0.00 H new ATOM 0 HG13 VAL A 86 7.230 -14.209 -1.576 1.00 0.00 H new ATOM 0 HG21 VAL A 86 7.858 -11.767 0.205 1.00 0.00 H new ATOM 0 HG22 VAL A 86 7.344 -13.347 0.842 1.00 0.00 H new ATOM 0 HG23 VAL A 86 8.862 -12.611 1.408 1.00 0.00 H new ATOM 1332 N SER A 87 10.245 -16.632 -1.561 1.00 0.00 N ATOM 1333 CA SER A 87 11.115 -17.279 -2.544 1.00 0.00 C ATOM 1334 C SER A 87 10.932 -16.690 -3.943 1.00 0.00 C ATOM 1335 O SER A 87 10.045 -15.866 -4.174 1.00 0.00 O ATOM 1336 CB SER A 87 10.845 -18.785 -2.574 1.00 0.00 C ATOM 1337 OG SER A 87 11.673 -19.473 -1.653 1.00 0.00 O ATOM 0 H SER A 87 9.496 -17.227 -1.207 1.00 0.00 H new ATOM 0 HA SER A 87 12.146 -17.098 -2.240 1.00 0.00 H new ATOM 0 HB2 SER A 87 9.798 -18.974 -2.337 1.00 0.00 H new ATOM 0 HB3 SER A 87 11.019 -19.168 -3.580 1.00 0.00 H new ATOM 0 HG SER A 87 11.478 -20.433 -1.692 1.00 0.00 H new ATOM 1343 N GLY A 88 11.783 -17.129 -4.876 1.00 0.00 N ATOM 1344 CA GLY A 88 11.715 -16.652 -6.249 1.00 0.00 C ATOM 1345 C GLY A 88 10.362 -16.908 -6.888 1.00 0.00 C ATOM 1346 O GLY A 88 9.799 -16.021 -7.532 1.00 0.00 O ATOM 0 H GLY A 88 12.521 -17.811 -4.701 1.00 0.00 H new ATOM 0 HA2 GLY A 88 11.926 -15.583 -6.269 1.00 0.00 H new ATOM 0 HA3 GLY A 88 12.490 -17.141 -6.839 1.00 0.00 H new ATOM 1350 N LEU A 89 9.837 -18.120 -6.703 1.00 0.00 N ATOM 1351 CA LEU A 89 8.537 -18.488 -7.258 1.00 0.00 C ATOM 1352 C LEU A 89 7.462 -17.498 -6.814 1.00 0.00 C ATOM 1353 O LEU A 89 6.613 -17.090 -7.607 1.00 0.00 O ATOM 1354 CB LEU A 89 8.151 -19.908 -6.826 1.00 0.00 C ATOM 1355 CG LEU A 89 7.516 -20.774 -7.918 1.00 0.00 C ATOM 1356 CD1 LEU A 89 6.251 -20.119 -8.453 1.00 0.00 C ATOM 1357 CD2 LEU A 89 8.508 -21.023 -9.044 1.00 0.00 C ATOM 0 H LEU A 89 10.293 -18.862 -6.173 1.00 0.00 H new ATOM 0 HA LEU A 89 8.612 -18.459 -8.345 1.00 0.00 H new ATOM 0 HB2 LEU A 89 9.044 -20.413 -6.458 1.00 0.00 H new ATOM 0 HB3 LEU A 89 7.456 -19.839 -5.989 1.00 0.00 H new ATOM 0 HG LEU A 89 7.244 -21.735 -7.481 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.815 -20.749 -9.228 1.00 0.00 H new ATOM 0 HD12 LEU A 89 5.535 -19.994 -7.641 1.00 0.00 H new ATOM 0 HD13 LEU A 89 6.496 -19.144 -8.874 1.00 0.00 H new ATOM 0 HD21 LEU A 89 8.040 -21.640 -9.811 1.00 0.00 H new ATOM 0 HD22 LEU A 89 8.811 -20.071 -9.479 1.00 0.00 H new ATOM 0 HD23 LEU A 89 9.385 -21.537 -8.650 1.00 0.00 H new ATOM 1369 N GLN A 90 7.519 -17.109 -5.540 1.00 0.00 N ATOM 1370 CA GLN A 90 6.567 -16.157 -4.981 1.00 0.00 C ATOM 1371 C GLN A 90 6.737 -14.784 -5.631 1.00 0.00 C ATOM 1372 O GLN A 90 5.756 -14.075 -5.864 1.00 0.00 O ATOM 1373 CB GLN A 90 6.754 -16.050 -3.467 1.00 0.00 C ATOM 1374 CG GLN A 90 6.040 -17.140 -2.681 1.00 0.00 C ATOM 1375 CD GLN A 90 6.574 -18.531 -2.975 1.00 0.00 C ATOM 1376 OE1 GLN A 90 7.771 -18.716 -3.192 1.00 0.00 O ATOM 1377 NE2 GLN A 90 5.685 -19.519 -2.981 1.00 0.00 N ATOM 0 H GLN A 90 8.218 -17.442 -4.876 1.00 0.00 H new ATOM 0 HA GLN A 90 5.559 -16.515 -5.187 1.00 0.00 H new ATOM 0 HB2 GLN A 90 7.819 -16.089 -3.238 1.00 0.00 H new ATOM 0 HB3 GLN A 90 6.391 -15.078 -3.133 1.00 0.00 H new ATOM 0 HG2 GLN A 90 6.140 -16.936 -1.615 1.00 0.00 H new ATOM 0 HG3 GLN A 90 4.975 -17.109 -2.913 1.00 0.00 H new ATOM 0 HE21 GLN A 90 4.702 -19.321 -2.796 1.00 0.00 H new ATOM 0 HE22 GLN A 90 5.986 -20.475 -3.171 1.00 0.00 H new ATOM 1386 N ARG A 91 7.988 -14.422 -5.932 1.00 0.00 N ATOM 1387 CA ARG A 91 8.287 -13.140 -6.571 1.00 0.00 C ATOM 1388 C ARG A 91 7.522 -13.007 -7.886 1.00 0.00 C ATOM 1389 O ARG A 91 6.901 -11.976 -8.149 1.00 0.00 O ATOM 1390 CB ARG A 91 9.792 -13.003 -6.823 1.00 0.00 C ATOM 1391 CG ARG A 91 10.467 -11.967 -5.938 1.00 0.00 C ATOM 1392 CD ARG A 91 11.609 -12.573 -5.136 1.00 0.00 C ATOM 1393 NE ARG A 91 12.798 -11.721 -5.146 1.00 0.00 N ATOM 1394 CZ ARG A 91 14.001 -12.115 -4.723 1.00 0.00 C ATOM 1395 NH1 ARG A 91 14.179 -13.343 -4.244 1.00 0.00 N ATOM 1396 NH2 ARG A 91 15.028 -11.274 -4.776 1.00 0.00 N ATOM 0 H ARG A 91 8.808 -14.999 -5.743 1.00 0.00 H new ATOM 0 HA ARG A 91 7.971 -12.342 -5.899 1.00 0.00 H new ATOM 0 HB2 ARG A 91 10.268 -13.970 -6.663 1.00 0.00 H new ATOM 0 HB3 ARG A 91 9.954 -12.737 -7.868 1.00 0.00 H new ATOM 0 HG2 ARG A 91 10.847 -11.153 -6.555 1.00 0.00 H new ATOM 0 HG3 ARG A 91 9.733 -11.535 -5.258 1.00 0.00 H new ATOM 0 HD2 ARG A 91 11.285 -12.732 -4.107 1.00 0.00 H new ATOM 0 HD3 ARG A 91 11.861 -13.551 -5.546 1.00 0.00 H new ATOM 0 HE ARG A 91 12.702 -10.768 -5.497 1.00 0.00 H new ATOM 0 HH11 ARG A 91 13.393 -13.991 -4.198 1.00 0.00 H new ATOM 0 HH12 ARG A 91 15.102 -13.636 -3.923 1.00 0.00 H new ATOM 0 HH21 ARG A 91 14.896 -10.330 -5.139 1.00 0.00 H new ATOM 0 HH22 ARG A 91 15.949 -11.572 -4.453 1.00 0.00 H new ATOM 1410 N ALA A 92 7.562 -14.065 -8.702 1.00 0.00 N ATOM 1411 CA ALA A 92 6.859 -14.073 -9.984 1.00 0.00 C ATOM 1412 C ALA A 92 5.352 -13.965 -9.768 1.00 0.00 C ATOM 1413 O ALA A 92 4.663 -13.237 -10.485 1.00 0.00 O ATOM 1414 CB ALA A 92 7.193 -15.336 -10.768 1.00 0.00 C ATOM 0 H ALA A 92 8.073 -14.924 -8.496 1.00 0.00 H new ATOM 0 HA ALA A 92 7.189 -13.210 -10.562 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.661 -15.325 -11.719 1.00 0.00 H new ATOM 0 HB2 ALA A 92 8.266 -15.376 -10.953 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.891 -16.212 -10.193 1.00 0.00 H new ATOM 1420 N LYS A 93 4.853 -14.685 -8.761 1.00 0.00 N ATOM 1421 CA LYS A 93 3.431 -14.669 -8.425 1.00 0.00 C ATOM 1422 C LYS A 93 2.975 -13.250 -8.084 1.00 0.00 C ATOM 1423 O LYS A 93 1.877 -12.835 -8.456 1.00 0.00 O ATOM 1424 CB LYS A 93 3.157 -15.605 -7.246 1.00 0.00 C ATOM 1425 CG LYS A 93 2.924 -17.052 -7.657 1.00 0.00 C ATOM 1426 CD LYS A 93 1.444 -17.408 -7.640 1.00 0.00 C ATOM 1427 CE LYS A 93 1.190 -18.717 -6.905 1.00 0.00 C ATOM 1428 NZ LYS A 93 -0.253 -19.095 -6.918 1.00 0.00 N ATOM 0 H LYS A 93 5.417 -15.288 -8.163 1.00 0.00 H new ATOM 0 HA LYS A 93 2.868 -15.016 -9.292 1.00 0.00 H new ATOM 0 HB2 LYS A 93 4.000 -15.563 -6.556 1.00 0.00 H new ATOM 0 HB3 LYS A 93 2.283 -15.245 -6.703 1.00 0.00 H new ATOM 0 HG2 LYS A 93 3.327 -17.216 -8.656 1.00 0.00 H new ATOM 0 HG3 LYS A 93 3.466 -17.714 -6.982 1.00 0.00 H new ATOM 0 HD2 LYS A 93 0.882 -16.606 -7.161 1.00 0.00 H new ATOM 0 HD3 LYS A 93 1.077 -17.488 -8.663 1.00 0.00 H new ATOM 0 HE2 LYS A 93 1.777 -19.511 -7.366 1.00 0.00 H new ATOM 0 HE3 LYS A 93 1.532 -18.626 -5.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -0.382 -19.992 -6.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -0.811 -18.350 -6.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -0.574 -19.208 -7.901 1.00 0.00 H new ATOM 1442 N THR A 94 3.837 -12.508 -7.386 1.00 0.00 N ATOM 1443 CA THR A 94 3.540 -11.128 -7.002 1.00 0.00 C ATOM 1444 C THR A 94 3.397 -10.242 -8.238 1.00 0.00 C ATOM 1445 O THR A 94 2.525 -9.374 -8.290 1.00 0.00 O ATOM 1446 CB THR A 94 4.641 -10.581 -6.085 1.00 0.00 C ATOM 1447 OG1 THR A 94 4.867 -11.454 -4.991 1.00 0.00 O ATOM 1448 CG2 THR A 94 4.329 -9.212 -5.516 1.00 0.00 C ATOM 0 H THR A 94 4.749 -12.842 -7.075 1.00 0.00 H new ATOM 0 HA THR A 94 2.594 -11.120 -6.460 1.00 0.00 H new ATOM 0 HB THR A 94 5.524 -10.502 -6.719 1.00 0.00 H new ATOM 0 HG1 THR A 94 5.269 -12.287 -5.315 1.00 0.00 H new ATOM 0 HG21 THR A 94 5.151 -8.888 -4.877 1.00 0.00 H new ATOM 0 HG22 THR A 94 4.200 -8.500 -6.331 1.00 0.00 H new ATOM 0 HG23 THR A 94 3.412 -9.262 -4.930 1.00 0.00 H new ATOM 1456 N GLY A 95 4.254 -10.474 -9.235 1.00 0.00 N ATOM 1457 CA GLY A 95 4.202 -9.695 -10.461 1.00 0.00 C ATOM 1458 C GLY A 95 2.872 -9.841 -11.182 1.00 0.00 C ATOM 1459 O GLY A 95 2.281 -8.846 -11.605 1.00 0.00 O ATOM 0 H GLY A 95 4.982 -11.188 -9.213 1.00 0.00 H new ATOM 0 HA2 GLY A 95 4.373 -8.644 -10.228 1.00 0.00 H new ATOM 0 HA3 GLY A 95 5.008 -10.010 -11.123 1.00 0.00 H new ATOM 1463 N THR A 96 2.397 -11.082 -11.313 1.00 0.00 N ATOM 1464 CA THR A 96 1.122 -11.350 -11.981 1.00 0.00 C ATOM 1465 C THR A 96 -0.030 -10.692 -11.226 1.00 0.00 C ATOM 1466 O THR A 96 -0.938 -10.125 -11.837 1.00 0.00 O ATOM 1467 CB THR A 96 0.873 -12.860 -12.104 1.00 0.00 C ATOM 1468 OG1 THR A 96 1.561 -13.577 -11.093 1.00 0.00 O ATOM 1469 CG2 THR A 96 1.304 -13.429 -13.438 1.00 0.00 C ATOM 0 H THR A 96 2.874 -11.914 -10.967 1.00 0.00 H new ATOM 0 HA THR A 96 1.175 -10.925 -12.983 1.00 0.00 H new ATOM 0 HB THR A 96 -0.206 -12.978 -12.002 1.00 0.00 H new ATOM 0 HG1 THR A 96 1.462 -13.111 -10.237 1.00 0.00 H new ATOM 0 HG21 THR A 96 1.101 -14.500 -13.460 1.00 0.00 H new ATOM 0 HG22 THR A 96 0.751 -12.938 -14.239 1.00 0.00 H new ATOM 0 HG23 THR A 96 2.372 -13.259 -13.578 1.00 0.00 H new ATOM 1477 N ASP A 97 0.017 -10.763 -9.896 1.00 0.00 N ATOM 1478 CA ASP A 97 -1.018 -10.168 -9.056 1.00 0.00 C ATOM 1479 C ASP A 97 -1.014 -8.644 -9.183 1.00 0.00 C ATOM 1480 O ASP A 97 -2.074 -8.015 -9.197 1.00 0.00 O ATOM 1481 CB ASP A 97 -0.824 -10.579 -7.593 1.00 0.00 C ATOM 1482 CG ASP A 97 -0.908 -12.083 -7.391 1.00 0.00 C ATOM 1483 OD1 ASP A 97 -1.648 -12.750 -8.146 1.00 0.00 O ATOM 1484 OD2 ASP A 97 -0.232 -12.595 -6.473 1.00 0.00 O ATOM 0 H ASP A 97 0.763 -11.228 -9.378 1.00 0.00 H new ATOM 0 HA ASP A 97 -1.985 -10.538 -9.398 1.00 0.00 H new ATOM 0 HB2 ASP A 97 0.146 -10.223 -7.245 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -1.581 -10.091 -6.979 1.00 0.00 H new ATOM 1489 N LYS A 98 0.182 -8.060 -9.285 1.00 0.00 N ATOM 1490 CA LYS A 98 0.326 -6.611 -9.425 1.00 0.00 C ATOM 1491 C LYS A 98 -0.446 -6.104 -10.645 1.00 0.00 C ATOM 1492 O LYS A 98 -0.986 -4.997 -10.632 1.00 0.00 O ATOM 1493 CB LYS A 98 1.807 -6.233 -9.548 1.00 0.00 C ATOM 1494 CG LYS A 98 2.097 -4.767 -9.255 1.00 0.00 C ATOM 1495 CD LYS A 98 3.394 -4.311 -9.908 1.00 0.00 C ATOM 1496 CE LYS A 98 4.596 -4.570 -9.010 1.00 0.00 C ATOM 1497 NZ LYS A 98 4.915 -3.397 -8.148 1.00 0.00 N ATOM 0 H LYS A 98 1.065 -8.570 -9.273 1.00 0.00 H new ATOM 0 HA LYS A 98 -0.088 -6.140 -8.533 1.00 0.00 H new ATOM 0 HB2 LYS A 98 2.388 -6.852 -8.864 1.00 0.00 H new ATOM 0 HB3 LYS A 98 2.149 -6.466 -10.556 1.00 0.00 H new ATOM 0 HG2 LYS A 98 1.272 -4.153 -9.616 1.00 0.00 H new ATOM 0 HG3 LYS A 98 2.159 -4.616 -8.177 1.00 0.00 H new ATOM 0 HD2 LYS A 98 3.528 -4.833 -10.855 1.00 0.00 H new ATOM 0 HD3 LYS A 98 3.332 -3.247 -10.136 1.00 0.00 H new ATOM 0 HE2 LYS A 98 4.398 -5.438 -8.381 1.00 0.00 H new ATOM 0 HE3 LYS A 98 5.462 -4.813 -9.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 5.739 -3.617 -7.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 5.130 -2.574 -8.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 4.099 -3.180 -7.541 1.00 0.00 H new ATOM 1511 N THR A 99 -0.502 -6.928 -11.694 1.00 0.00 N ATOM 1512 CA THR A 99 -1.215 -6.574 -12.919 1.00 0.00 C ATOM 1513 C THR A 99 -2.725 -6.683 -12.708 1.00 0.00 C ATOM 1514 O THR A 99 -3.489 -5.829 -13.164 1.00 0.00 O ATOM 1515 CB THR A 99 -0.777 -7.484 -14.071 1.00 0.00 C ATOM 1516 OG1 THR A 99 0.629 -7.433 -14.241 1.00 0.00 O ATOM 1517 CG2 THR A 99 -1.410 -7.131 -15.400 1.00 0.00 C ATOM 0 H THR A 99 -0.060 -7.847 -11.717 1.00 0.00 H new ATOM 0 HA THR A 99 -0.972 -5.543 -13.174 1.00 0.00 H new ATOM 0 HB THR A 99 -1.110 -8.482 -13.787 1.00 0.00 H new ATOM 0 HG1 THR A 99 0.891 -8.021 -14.980 1.00 0.00 H new ATOM 0 HG21 THR A 99 -1.053 -7.818 -16.167 1.00 0.00 H new ATOM 0 HG22 THR A 99 -2.494 -7.210 -15.319 1.00 0.00 H new ATOM 0 HG23 THR A 99 -1.140 -6.111 -15.672 1.00 0.00 H new ATOM 1525 N LEU A 100 -3.142 -7.739 -12.008 1.00 0.00 N ATOM 1526 CA LEU A 100 -4.552 -7.973 -11.721 1.00 0.00 C ATOM 1527 C LEU A 100 -5.137 -6.836 -10.886 1.00 0.00 C ATOM 1528 O LEU A 100 -6.220 -6.330 -11.185 1.00 0.00 O ATOM 1529 CB LEU A 100 -4.717 -9.304 -10.985 1.00 0.00 C ATOM 1530 CG LEU A 100 -4.488 -10.551 -11.844 1.00 0.00 C ATOM 1531 CD1 LEU A 100 -4.136 -11.747 -10.974 1.00 0.00 C ATOM 1532 CD2 LEU A 100 -5.718 -10.849 -12.687 1.00 0.00 C ATOM 0 H LEU A 100 -2.516 -8.449 -11.628 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.094 -8.013 -12.666 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -4.022 -9.327 -10.146 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -5.723 -9.349 -10.567 1.00 0.00 H new ATOM 0 HG LEU A 100 -3.649 -10.357 -12.512 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.978 -12.622 -11.605 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.226 -11.534 -10.414 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -4.952 -11.944 -10.279 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -5.538 -11.738 -13.291 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -6.574 -11.021 -12.034 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -5.925 -10.002 -13.341 1.00 0.00 H new ATOM 1544 N VAL A 101 -4.409 -6.435 -9.843 1.00 0.00 N ATOM 1545 CA VAL A 101 -4.847 -5.352 -8.965 1.00 0.00 C ATOM 1546 C VAL A 101 -4.875 -4.021 -9.718 1.00 0.00 C ATOM 1547 O VAL A 101 -5.797 -3.223 -9.549 1.00 0.00 O ATOM 1548 CB VAL A 101 -3.933 -5.216 -7.727 1.00 0.00 C ATOM 1549 CG1 VAL A 101 -4.504 -4.207 -6.742 1.00 0.00 C ATOM 1550 CG2 VAL A 101 -3.732 -6.567 -7.053 1.00 0.00 C ATOM 0 H VAL A 101 -3.511 -6.846 -9.586 1.00 0.00 H new ATOM 0 HA VAL A 101 -5.853 -5.602 -8.629 1.00 0.00 H new ATOM 0 HB VAL A 101 -2.962 -4.853 -8.063 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -3.844 -4.128 -5.878 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -4.587 -3.234 -7.225 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -5.491 -4.536 -6.415 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -3.085 -6.447 -6.184 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -4.697 -6.962 -6.736 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -3.270 -7.259 -7.757 1.00 0.00 H new ATOM 1560 N LYS A 102 -3.858 -3.794 -10.552 1.00 0.00 N ATOM 1561 CA LYS A 102 -3.761 -2.566 -11.340 1.00 0.00 C ATOM 1562 C LYS A 102 -4.998 -2.373 -12.217 1.00 0.00 C ATOM 1563 O LYS A 102 -5.522 -1.265 -12.326 1.00 0.00 O ATOM 1564 CB LYS A 102 -2.506 -2.599 -12.215 1.00 0.00 C ATOM 1565 CG LYS A 102 -1.305 -1.914 -11.586 1.00 0.00 C ATOM 1566 CD LYS A 102 -0.089 -1.977 -12.497 1.00 0.00 C ATOM 1567 CE LYS A 102 0.734 -0.701 -12.418 1.00 0.00 C ATOM 1568 NZ LYS A 102 1.566 -0.498 -13.637 1.00 0.00 N ATOM 0 H LYS A 102 -3.089 -4.447 -10.698 1.00 0.00 H new ATOM 0 HA LYS A 102 -3.698 -1.727 -10.647 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -2.250 -3.637 -12.429 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -2.727 -2.122 -13.170 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -1.548 -0.873 -11.373 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -1.072 -2.388 -10.633 1.00 0.00 H new ATOM 0 HD2 LYS A 102 0.531 -2.829 -12.219 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -0.412 -2.140 -13.525 1.00 0.00 H new ATOM 0 HE2 LYS A 102 0.069 0.152 -12.287 1.00 0.00 H new ATOM 0 HE3 LYS A 102 1.380 -0.740 -11.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 2.111 0.383 -13.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 2.219 -1.299 -13.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 0.949 -0.435 -14.472 1.00 0.00 H new ATOM 1582 N GLU A 103 -5.458 -3.459 -12.836 1.00 0.00 N ATOM 1583 CA GLU A 103 -6.635 -3.413 -13.701 1.00 0.00 C ATOM 1584 C GLU A 103 -7.887 -3.071 -12.893 1.00 0.00 C ATOM 1585 O GLU A 103 -8.728 -2.290 -13.339 1.00 0.00 O ATOM 1586 CB GLU A 103 -6.819 -4.755 -14.415 1.00 0.00 C ATOM 1587 CG GLU A 103 -7.302 -4.626 -15.852 1.00 0.00 C ATOM 1588 CD GLU A 103 -7.548 -5.974 -16.505 1.00 0.00 C ATOM 1589 OE1 GLU A 103 -6.567 -6.713 -16.730 1.00 0.00 O ATOM 1590 OE2 GLU A 103 -8.722 -6.292 -16.787 1.00 0.00 O ATOM 0 H GLU A 103 -5.033 -4.382 -12.754 1.00 0.00 H new ATOM 0 HA GLU A 103 -6.483 -2.633 -14.447 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -5.871 -5.293 -14.407 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -7.533 -5.359 -13.855 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -8.223 -4.043 -15.872 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -6.563 -4.074 -16.432 1.00 0.00 H new ATOM 1597 N VAL A 104 -7.998 -3.660 -11.700 1.00 0.00 N ATOM 1598 CA VAL A 104 -9.142 -3.417 -10.824 1.00 0.00 C ATOM 1599 C VAL A 104 -9.102 -2.000 -10.252 1.00 0.00 C ATOM 1600 O VAL A 104 -10.098 -1.278 -10.296 1.00 0.00 O ATOM 1601 CB VAL A 104 -9.194 -4.434 -9.660 1.00 0.00 C ATOM 1602 CG1 VAL A 104 -10.461 -4.252 -8.838 1.00 0.00 C ATOM 1603 CG2 VAL A 104 -9.100 -5.860 -10.185 1.00 0.00 C ATOM 0 H VAL A 104 -7.308 -4.308 -11.320 1.00 0.00 H new ATOM 0 HA VAL A 104 -10.038 -3.536 -11.433 1.00 0.00 H new ATOM 0 HB VAL A 104 -8.337 -4.249 -9.013 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -10.475 -4.978 -8.025 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -10.485 -3.244 -8.424 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -11.333 -4.403 -9.475 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -9.138 -6.559 -9.349 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -9.934 -6.055 -10.860 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -8.160 -5.989 -10.722 1.00 0.00 H new ATOM 1613 N VAL A 105 -7.944 -1.610 -9.719 1.00 0.00 N ATOM 1614 CA VAL A 105 -7.770 -0.281 -9.140 1.00 0.00 C ATOM 1615 C VAL A 105 -6.789 0.548 -9.965 1.00 0.00 C ATOM 1616 O VAL A 105 -5.581 0.300 -9.945 1.00 0.00 O ATOM 1617 CB VAL A 105 -7.267 -0.355 -7.684 1.00 0.00 C ATOM 1618 CG1 VAL A 105 -7.314 1.020 -7.033 1.00 0.00 C ATOM 1619 CG2 VAL A 105 -8.084 -1.358 -6.883 1.00 0.00 C ATOM 0 H VAL A 105 -7.112 -2.198 -9.677 1.00 0.00 H new ATOM 0 HA VAL A 105 -8.749 0.198 -9.148 1.00 0.00 H new ATOM 0 HB VAL A 105 -6.231 -0.694 -7.696 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -6.956 0.949 -6.006 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -6.680 1.709 -7.592 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -8.340 1.388 -7.034 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -7.713 -1.395 -5.859 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -9.131 -1.054 -6.879 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -7.995 -2.345 -7.337 1.00 0.00 H new ATOM 1629 N GLN A 106 -7.317 1.529 -10.694 1.00 0.00 N ATOM 1630 CA GLN A 106 -6.493 2.396 -11.534 1.00 0.00 C ATOM 1631 C GLN A 106 -6.369 3.806 -10.949 1.00 0.00 C ATOM 1632 O GLN A 106 -5.427 4.533 -11.268 1.00 0.00 O ATOM 1633 CB GLN A 106 -7.080 2.469 -12.946 1.00 0.00 C ATOM 1634 CG GLN A 106 -6.774 1.246 -13.797 1.00 0.00 C ATOM 1635 CD GLN A 106 -7.707 1.110 -14.986 1.00 0.00 C ATOM 1636 OE1 GLN A 106 -7.302 1.312 -16.132 1.00 0.00 O ATOM 1637 NE2 GLN A 106 -8.962 0.765 -14.722 1.00 0.00 N ATOM 0 H GLN A 106 -8.314 1.744 -10.720 1.00 0.00 H new ATOM 0 HA GLN A 106 -5.493 1.963 -11.574 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -8.161 2.591 -12.875 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -6.691 3.356 -13.447 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -5.745 1.304 -14.153 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -6.847 0.351 -13.179 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -9.256 0.607 -13.758 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -9.632 0.658 -15.483 1.00 0.00 H new ATOM 1646 N ASN A 107 -7.323 4.193 -10.099 1.00 0.00 N ATOM 1647 CA ASN A 107 -7.313 5.521 -9.485 1.00 0.00 C ATOM 1648 C ASN A 107 -6.272 5.611 -8.368 1.00 0.00 C ATOM 1649 O ASN A 107 -6.606 5.524 -7.185 1.00 0.00 O ATOM 1650 CB ASN A 107 -8.702 5.871 -8.941 1.00 0.00 C ATOM 1651 CG ASN A 107 -9.543 6.640 -9.943 1.00 0.00 C ATOM 1652 OD1 ASN A 107 -9.921 7.785 -9.700 1.00 0.00 O ATOM 1653 ND2 ASN A 107 -9.840 6.012 -11.076 1.00 0.00 N ATOM 0 H ASN A 107 -8.110 3.607 -9.821 1.00 0.00 H new ATOM 0 HA ASN A 107 -7.043 6.241 -10.258 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -9.222 4.954 -8.664 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -8.594 6.463 -8.032 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -10.403 6.480 -11.786 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -9.505 5.062 -11.235 1.00 0.00 H new ATOM 1660 N PHE A 108 -5.010 5.791 -8.754 1.00 0.00 N ATOM 1661 CA PHE A 108 -3.918 5.903 -7.790 1.00 0.00 C ATOM 1662 C PHE A 108 -2.878 6.918 -8.266 1.00 0.00 C ATOM 1663 O PHE A 108 -2.810 7.235 -9.455 1.00 0.00 O ATOM 1664 CB PHE A 108 -3.260 4.538 -7.557 1.00 0.00 C ATOM 1665 CG PHE A 108 -2.725 3.893 -8.807 1.00 0.00 C ATOM 1666 CD1 PHE A 108 -1.520 4.302 -9.353 1.00 0.00 C ATOM 1667 CD2 PHE A 108 -3.428 2.873 -9.430 1.00 0.00 C ATOM 1668 CE1 PHE A 108 -1.024 3.708 -10.497 1.00 0.00 C ATOM 1669 CE2 PHE A 108 -2.937 2.276 -10.575 1.00 0.00 C ATOM 1670 CZ PHE A 108 -1.734 2.694 -11.109 1.00 0.00 C ATOM 0 H PHE A 108 -4.719 5.862 -9.729 1.00 0.00 H new ATOM 0 HA PHE A 108 -4.335 6.253 -6.846 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -2.444 4.657 -6.844 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -3.988 3.869 -7.099 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -0.961 5.095 -8.879 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -4.369 2.542 -9.016 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -0.082 4.036 -10.912 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -3.494 1.483 -11.052 1.00 0.00 H new ATOM 0 HZ PHE A 108 -1.349 2.228 -12.004 1.00 0.00 H new ATOM 1680 N ALA A 109 -2.072 7.425 -7.335 1.00 0.00 N ATOM 1681 CA ALA A 109 -1.039 8.402 -7.669 1.00 0.00 C ATOM 1682 C ALA A 109 0.258 7.713 -8.081 1.00 0.00 C ATOM 1683 O ALA A 109 0.754 7.919 -9.189 1.00 0.00 O ATOM 1684 CB ALA A 109 -0.789 9.342 -6.499 1.00 0.00 C ATOM 0 H ALA A 109 -2.114 7.176 -6.347 1.00 0.00 H new ATOM 0 HA ALA A 109 -1.397 8.987 -8.516 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -0.016 10.062 -6.769 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -1.710 9.872 -6.255 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -0.462 8.766 -5.633 1.00 0.00 H new ATOM 1690 N LYS A 110 0.807 6.899 -7.181 1.00 0.00 N ATOM 1691 CA LYS A 110 2.050 6.183 -7.452 1.00 0.00 C ATOM 1692 C LYS A 110 2.101 4.855 -6.697 1.00 0.00 C ATOM 1693 O LYS A 110 1.234 4.567 -5.869 1.00 0.00 O ATOM 1694 CB LYS A 110 3.254 7.049 -7.071 1.00 0.00 C ATOM 1695 CG LYS A 110 3.279 7.447 -5.602 1.00 0.00 C ATOM 1696 CD LYS A 110 4.648 7.207 -4.982 1.00 0.00 C ATOM 1697 CE LYS A 110 4.874 8.089 -3.764 1.00 0.00 C ATOM 1698 NZ LYS A 110 3.959 7.742 -2.638 1.00 0.00 N ATOM 0 H LYS A 110 0.410 6.720 -6.259 1.00 0.00 H new ATOM 0 HA LYS A 110 2.087 5.968 -8.520 1.00 0.00 H new ATOM 0 HB2 LYS A 110 4.170 6.507 -7.307 1.00 0.00 H new ATOM 0 HB3 LYS A 110 3.250 7.951 -7.683 1.00 0.00 H new ATOM 0 HG2 LYS A 110 3.014 8.500 -5.505 1.00 0.00 H new ATOM 0 HG3 LYS A 110 2.527 6.877 -5.057 1.00 0.00 H new ATOM 0 HD2 LYS A 110 4.739 6.159 -4.695 1.00 0.00 H new ATOM 0 HD3 LYS A 110 5.423 7.403 -5.723 1.00 0.00 H new ATOM 0 HE2 LYS A 110 5.908 7.990 -3.433 1.00 0.00 H new ATOM 0 HE3 LYS A 110 4.726 9.133 -4.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 4.499 7.710 -1.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 3.212 8.462 -2.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 3.528 6.812 -2.815 1.00 0.00 H new ATOM 1712 N GLU A 111 3.121 4.051 -6.989 1.00 0.00 N ATOM 1713 CA GLU A 111 3.285 2.754 -6.342 1.00 0.00 C ATOM 1714 C GLU A 111 4.749 2.326 -6.326 1.00 0.00 C ATOM 1715 O GLU A 111 5.522 2.684 -7.217 1.00 0.00 O ATOM 1716 CB GLU A 111 2.445 1.693 -7.059 1.00 0.00 C ATOM 1717 CG GLU A 111 2.843 1.479 -8.511 1.00 0.00 C ATOM 1718 CD GLU A 111 2.137 0.293 -9.142 1.00 0.00 C ATOM 1719 OE1 GLU A 111 0.942 0.427 -9.483 1.00 0.00 O ATOM 1720 OE2 GLU A 111 2.778 -0.767 -9.295 1.00 0.00 O ATOM 0 H GLU A 111 3.846 4.276 -7.670 1.00 0.00 H new ATOM 0 HA GLU A 111 2.943 2.850 -5.311 1.00 0.00 H new ATOM 0 HB2 GLU A 111 2.535 0.748 -6.523 1.00 0.00 H new ATOM 0 HB3 GLU A 111 1.395 1.984 -7.018 1.00 0.00 H new ATOM 0 HG2 GLU A 111 2.615 2.379 -9.083 1.00 0.00 H new ATOM 0 HG3 GLU A 111 3.921 1.329 -8.570 1.00 0.00 H new ATOM 1727 N PHE A 112 5.122 1.552 -5.310 1.00 0.00 N ATOM 1728 CA PHE A 112 6.494 1.063 -5.179 1.00 0.00 C ATOM 1729 C PHE A 112 6.562 -0.153 -4.258 1.00 0.00 C ATOM 1730 O PHE A 112 5.609 -0.450 -3.534 1.00 0.00 O ATOM 1731 CB PHE A 112 7.412 2.169 -4.652 1.00 0.00 C ATOM 1732 CG PHE A 112 6.846 2.920 -3.481 1.00 0.00 C ATOM 1733 CD1 PHE A 112 6.799 2.340 -2.224 1.00 0.00 C ATOM 1734 CD2 PHE A 112 6.363 4.207 -3.640 1.00 0.00 C ATOM 1735 CE1 PHE A 112 6.280 3.031 -1.147 1.00 0.00 C ATOM 1736 CE2 PHE A 112 5.843 4.903 -2.567 1.00 0.00 C ATOM 1737 CZ PHE A 112 5.801 4.314 -1.319 1.00 0.00 C ATOM 0 H PHE A 112 4.494 1.249 -4.565 1.00 0.00 H new ATOM 0 HA PHE A 112 6.834 0.762 -6.170 1.00 0.00 H new ATOM 0 HB2 PHE A 112 8.366 1.729 -4.363 1.00 0.00 H new ATOM 0 HB3 PHE A 112 7.617 2.873 -5.458 1.00 0.00 H new ATOM 0 HD1 PHE A 112 7.172 1.336 -2.085 1.00 0.00 H new ATOM 0 HD2 PHE A 112 6.393 4.672 -4.614 1.00 0.00 H new ATOM 0 HE1 PHE A 112 6.249 2.568 -0.172 1.00 0.00 H new ATOM 0 HE2 PHE A 112 5.469 5.907 -2.704 1.00 0.00 H new ATOM 0 HZ PHE A 112 5.394 4.856 -0.478 1.00 0.00 H new ATOM 1747 N VAL A 113 7.694 -0.851 -4.292 1.00 0.00 N ATOM 1748 CA VAL A 113 7.892 -2.035 -3.460 1.00 0.00 C ATOM 1749 C VAL A 113 8.887 -1.760 -2.333 1.00 0.00 C ATOM 1750 O VAL A 113 9.846 -1.005 -2.507 1.00 0.00 O ATOM 1751 CB VAL A 113 8.384 -3.238 -4.299 1.00 0.00 C ATOM 1752 CG1 VAL A 113 9.761 -2.964 -4.889 1.00 0.00 C ATOM 1753 CG2 VAL A 113 8.396 -4.512 -3.464 1.00 0.00 C ATOM 0 H VAL A 113 8.489 -0.617 -4.887 1.00 0.00 H new ATOM 0 HA VAL A 113 6.924 -2.282 -3.025 1.00 0.00 H new ATOM 0 HB VAL A 113 7.687 -3.380 -5.124 1.00 0.00 H new ATOM 0 HG11 VAL A 113 10.084 -3.825 -5.474 1.00 0.00 H new ATOM 0 HG12 VAL A 113 9.713 -2.085 -5.532 1.00 0.00 H new ATOM 0 HG13 VAL A 113 10.473 -2.785 -4.083 1.00 0.00 H new ATOM 0 HG21 VAL A 113 8.745 -5.344 -4.075 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.063 -4.382 -2.612 1.00 0.00 H new ATOM 0 HG23 VAL A 113 7.388 -4.722 -3.107 1.00 0.00 H new ATOM 1763 N ILE A 114 8.650 -2.382 -1.180 1.00 0.00 N ATOM 1764 CA ILE A 114 9.520 -2.216 -0.018 1.00 0.00 C ATOM 1765 C ILE A 114 9.810 -3.565 0.636 1.00 0.00 C ATOM 1766 O ILE A 114 8.960 -4.457 0.639 1.00 0.00 O ATOM 1767 CB ILE A 114 8.897 -1.269 1.032 1.00 0.00 C ATOM 1768 CG1 ILE A 114 8.435 0.035 0.375 1.00 0.00 C ATOM 1769 CG2 ILE A 114 9.892 -0.979 2.148 1.00 0.00 C ATOM 1770 CD1 ILE A 114 7.698 0.961 1.321 1.00 0.00 C ATOM 0 H ILE A 114 7.860 -3.008 -1.025 1.00 0.00 H new ATOM 0 HA ILE A 114 10.450 -1.774 -0.377 1.00 0.00 H new ATOM 0 HB ILE A 114 8.027 -1.763 1.465 1.00 0.00 H new ATOM 0 HG12 ILE A 114 9.303 0.557 -0.028 1.00 0.00 H new ATOM 0 HG13 ILE A 114 7.786 -0.202 -0.468 1.00 0.00 H new ATOM 0 HG21 ILE A 114 9.435 -0.311 2.878 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.173 -1.912 2.636 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.781 -0.507 1.729 1.00 0.00 H new ATOM 0 HD11 ILE A 114 7.401 1.864 0.788 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.811 0.458 1.705 1.00 0.00 H new ATOM 0 HD13 ILE A 114 8.352 1.228 2.151 1.00 0.00 H new ATOM 1782 N SER A 115 11.014 -3.705 1.187 1.00 0.00 N ATOM 1783 CA SER A 115 11.419 -4.943 1.847 1.00 0.00 C ATOM 1784 C SER A 115 12.187 -4.658 3.141 1.00 0.00 C ATOM 1785 O SER A 115 13.035 -5.448 3.557 1.00 0.00 O ATOM 1786 CB SER A 115 12.272 -5.787 0.897 1.00 0.00 C ATOM 1787 OG SER A 115 13.294 -5.007 0.295 1.00 0.00 O ATOM 0 H SER A 115 11.726 -2.975 1.189 1.00 0.00 H new ATOM 0 HA SER A 115 10.519 -5.499 2.109 1.00 0.00 H new ATOM 0 HB2 SER A 115 12.719 -6.616 1.445 1.00 0.00 H new ATOM 0 HB3 SER A 115 11.638 -6.221 0.123 1.00 0.00 H new ATOM 0 HG SER A 115 13.825 -5.571 -0.306 1.00 0.00 H new ATOM 1793 N ASP A 116 11.878 -3.526 3.774 1.00 0.00 N ATOM 1794 CA ASP A 116 12.530 -3.132 5.020 1.00 0.00 C ATOM 1795 C ASP A 116 11.542 -2.431 5.946 1.00 0.00 C ATOM 1796 O ASP A 116 10.775 -1.572 5.512 1.00 0.00 O ATOM 1797 CB ASP A 116 13.722 -2.218 4.730 1.00 0.00 C ATOM 1798 CG ASP A 116 14.406 -1.731 5.994 1.00 0.00 C ATOM 1799 OD1 ASP A 116 14.718 -2.569 6.868 1.00 0.00 O ATOM 1800 OD2 ASP A 116 14.628 -0.508 6.110 1.00 0.00 O ATOM 0 H ASP A 116 11.177 -2.864 3.441 1.00 0.00 H new ATOM 0 HA ASP A 116 12.890 -4.032 5.518 1.00 0.00 H new ATOM 0 HB2 ASP A 116 14.444 -2.754 4.114 1.00 0.00 H new ATOM 0 HB3 ASP A 116 13.384 -1.359 4.150 1.00 0.00 H new ATOM 1805 N ARG A 117 11.569 -2.805 7.224 1.00 0.00 N ATOM 1806 CA ARG A 117 10.677 -2.215 8.219 1.00 0.00 C ATOM 1807 C ARG A 117 10.887 -0.704 8.327 1.00 0.00 C ATOM 1808 O ARG A 117 9.927 0.053 8.484 1.00 0.00 O ATOM 1809 CB ARG A 117 10.897 -2.874 9.584 1.00 0.00 C ATOM 1810 CG ARG A 117 9.608 -3.294 10.274 1.00 0.00 C ATOM 1811 CD ARG A 117 9.395 -2.543 11.580 1.00 0.00 C ATOM 1812 NE ARG A 117 10.535 -2.682 12.488 1.00 0.00 N ATOM 1813 CZ ARG A 117 11.457 -1.737 12.694 1.00 0.00 C ATOM 1814 NH1 ARG A 117 11.402 -0.577 12.044 1.00 0.00 N ATOM 1815 NH2 ARG A 117 12.447 -1.960 13.550 1.00 0.00 N ATOM 0 H ARG A 117 12.200 -3.515 7.595 1.00 0.00 H new ATOM 0 HA ARG A 117 9.651 -2.392 7.896 1.00 0.00 H new ATOM 0 HB2 ARG A 117 11.533 -3.750 9.457 1.00 0.00 H new ATOM 0 HB3 ARG A 117 11.435 -2.181 10.230 1.00 0.00 H new ATOM 0 HG2 ARG A 117 8.764 -3.113 9.609 1.00 0.00 H new ATOM 0 HG3 ARG A 117 9.634 -4.366 10.471 1.00 0.00 H new ATOM 0 HD2 ARG A 117 9.228 -1.487 11.367 1.00 0.00 H new ATOM 0 HD3 ARG A 117 8.495 -2.916 12.069 1.00 0.00 H new ATOM 0 HE ARG A 117 10.632 -3.560 12.998 1.00 0.00 H new ATOM 0 HH11 ARG A 117 10.649 -0.400 11.379 1.00 0.00 H new ATOM 0 HH12 ARG A 117 12.113 0.135 12.211 1.00 0.00 H new ATOM 0 HH21 ARG A 117 12.501 -2.849 14.047 1.00 0.00 H new ATOM 0 HH22 ARG A 117 13.153 -1.242 13.711 1.00 0.00 H new ATOM 1829 N LYS A 118 12.145 -0.268 8.235 1.00 0.00 N ATOM 1830 CA LYS A 118 12.470 1.155 8.318 1.00 0.00 C ATOM 1831 C LYS A 118 11.886 1.914 7.128 1.00 0.00 C ATOM 1832 O LYS A 118 11.269 2.966 7.295 1.00 0.00 O ATOM 1833 CB LYS A 118 13.988 1.363 8.382 1.00 0.00 C ATOM 1834 CG LYS A 118 14.394 2.674 9.036 1.00 0.00 C ATOM 1835 CD LYS A 118 15.870 2.975 8.818 1.00 0.00 C ATOM 1836 CE LYS A 118 16.153 4.468 8.910 1.00 0.00 C ATOM 1837 NZ LYS A 118 17.436 4.752 9.614 1.00 0.00 N ATOM 0 H LYS A 118 12.952 -0.878 8.104 1.00 0.00 H new ATOM 0 HA LYS A 118 12.026 1.548 9.233 1.00 0.00 H new ATOM 0 HB2 LYS A 118 14.437 0.537 8.933 1.00 0.00 H new ATOM 0 HB3 LYS A 118 14.394 1.329 7.371 1.00 0.00 H new ATOM 0 HG2 LYS A 118 13.792 3.486 8.628 1.00 0.00 H new ATOM 0 HG3 LYS A 118 14.185 2.628 10.105 1.00 0.00 H new ATOM 0 HD2 LYS A 118 16.465 2.444 9.561 1.00 0.00 H new ATOM 0 HD3 LYS A 118 16.178 2.605 7.840 1.00 0.00 H new ATOM 0 HE2 LYS A 118 16.189 4.893 7.907 1.00 0.00 H new ATOM 0 HE3 LYS A 118 15.335 4.960 9.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 17.590 5.780 9.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 17.394 4.370 10.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 18.221 4.305 9.099 1.00 0.00 H new ATOM 1851 N GLU A 119 12.080 1.367 5.926 1.00 0.00 N ATOM 1852 CA GLU A 119 11.564 1.984 4.706 1.00 0.00 C ATOM 1853 C GLU A 119 10.038 1.900 4.650 1.00 0.00 C ATOM 1854 O GLU A 119 9.380 2.767 4.076 1.00 0.00 O ATOM 1855 CB GLU A 119 12.168 1.312 3.471 1.00 0.00 C ATOM 1856 CG GLU A 119 13.668 1.528 3.328 1.00 0.00 C ATOM 1857 CD GLU A 119 14.047 2.104 1.977 1.00 0.00 C ATOM 1858 OE1 GLU A 119 13.766 1.448 0.951 1.00 0.00 O ATOM 1859 OE2 GLU A 119 14.624 3.212 1.945 1.00 0.00 O ATOM 0 H GLU A 119 12.591 0.498 5.773 1.00 0.00 H new ATOM 0 HA GLU A 119 11.851 3.036 4.716 1.00 0.00 H new ATOM 0 HB2 GLU A 119 11.967 0.242 3.516 1.00 0.00 H new ATOM 0 HB3 GLU A 119 11.669 1.693 2.580 1.00 0.00 H new ATOM 0 HG2 GLU A 119 14.011 2.200 4.115 1.00 0.00 H new ATOM 0 HG3 GLU A 119 14.184 0.579 3.472 1.00 0.00 H new ATOM 1866 N LEU A 120 9.480 0.848 5.252 1.00 0.00 N ATOM 1867 CA LEU A 120 8.032 0.652 5.272 1.00 0.00 C ATOM 1868 C LEU A 120 7.345 1.656 6.201 1.00 0.00 C ATOM 1869 O LEU A 120 6.155 1.934 6.047 1.00 0.00 O ATOM 1870 CB LEU A 120 7.691 -0.779 5.709 1.00 0.00 C ATOM 1871 CG LEU A 120 6.914 -1.610 4.683 1.00 0.00 C ATOM 1872 CD1 LEU A 120 6.353 -2.866 5.335 1.00 0.00 C ATOM 1873 CD2 LEU A 120 5.794 -0.786 4.058 1.00 0.00 C ATOM 0 H LEU A 120 10.010 0.120 5.731 1.00 0.00 H new ATOM 0 HA LEU A 120 7.663 0.816 4.260 1.00 0.00 H new ATOM 0 HB2 LEU A 120 8.619 -1.300 5.946 1.00 0.00 H new ATOM 0 HB3 LEU A 120 7.109 -0.731 6.629 1.00 0.00 H new ATOM 0 HG LEU A 120 7.601 -1.907 3.890 1.00 0.00 H new ATOM 0 HD11 LEU A 120 5.803 -3.446 4.594 1.00 0.00 H new ATOM 0 HD12 LEU A 120 7.171 -3.466 5.732 1.00 0.00 H new ATOM 0 HD13 LEU A 120 5.682 -2.586 6.147 1.00 0.00 H new ATOM 0 HD21 LEU A 120 5.255 -1.395 3.332 1.00 0.00 H new ATOM 0 HD22 LEU A 120 5.106 -0.457 4.837 1.00 0.00 H new ATOM 0 HD23 LEU A 120 6.218 0.084 3.557 1.00 0.00 H new ATOM 1885 N GLU A 121 8.098 2.190 7.167 1.00 0.00 N ATOM 1886 CA GLU A 121 7.570 3.151 8.125 1.00 0.00 C ATOM 1887 C GLU A 121 6.785 4.266 7.436 1.00 0.00 C ATOM 1888 O GLU A 121 7.188 4.777 6.388 1.00 0.00 O ATOM 1889 CB GLU A 121 8.712 3.744 8.951 1.00 0.00 C ATOM 1890 CG GLU A 121 8.242 4.581 10.125 1.00 0.00 C ATOM 1891 CD GLU A 121 9.276 4.671 11.229 1.00 0.00 C ATOM 1892 OE1 GLU A 121 9.562 3.632 11.860 1.00 0.00 O ATOM 1893 OE2 GLU A 121 9.801 5.779 11.460 1.00 0.00 O ATOM 0 H GLU A 121 9.084 1.967 7.302 1.00 0.00 H new ATOM 0 HA GLU A 121 6.881 2.622 8.783 1.00 0.00 H new ATOM 0 HB2 GLU A 121 9.340 2.934 9.322 1.00 0.00 H new ATOM 0 HB3 GLU A 121 9.336 4.360 8.303 1.00 0.00 H new ATOM 0 HG2 GLU A 121 8.000 5.585 9.777 1.00 0.00 H new ATOM 0 HG3 GLU A 121 7.324 4.153 10.527 1.00 0.00 H new ATOM 1900 N GLU A 122 5.658 4.628 8.042 1.00 0.00 N ATOM 1901 CA GLU A 122 4.782 5.675 7.513 1.00 0.00 C ATOM 1902 C GLU A 122 5.551 6.955 7.184 1.00 0.00 C ATOM 1903 O GLU A 122 5.245 7.634 6.203 1.00 0.00 O ATOM 1904 CB GLU A 122 3.666 5.989 8.514 1.00 0.00 C ATOM 1905 CG GLU A 122 2.279 5.982 7.896 1.00 0.00 C ATOM 1906 CD GLU A 122 1.989 7.247 7.114 1.00 0.00 C ATOM 1907 OE1 GLU A 122 2.362 7.305 5.924 1.00 0.00 O ATOM 1908 OE2 GLU A 122 1.393 8.181 7.691 1.00 0.00 O ATOM 0 H GLU A 122 5.325 4.208 8.910 1.00 0.00 H new ATOM 0 HA GLU A 122 4.350 5.296 6.587 1.00 0.00 H new ATOM 0 HB2 GLU A 122 3.698 5.259 9.323 1.00 0.00 H new ATOM 0 HB3 GLU A 122 3.852 6.967 8.959 1.00 0.00 H new ATOM 0 HG2 GLU A 122 2.183 5.120 7.236 1.00 0.00 H new ATOM 0 HG3 GLU A 122 1.534 5.866 8.683 1.00 0.00 H new ATOM 1915 N ASN A 123 6.547 7.278 8.006 1.00 0.00 N ATOM 1916 CA ASN A 123 7.356 8.475 7.797 1.00 0.00 C ATOM 1917 C ASN A 123 7.967 8.469 6.400 1.00 0.00 C ATOM 1918 O ASN A 123 8.034 9.503 5.734 1.00 0.00 O ATOM 1919 CB ASN A 123 8.462 8.559 8.853 1.00 0.00 C ATOM 1920 CG ASN A 123 8.019 9.298 10.102 1.00 0.00 C ATOM 1921 OD1 ASN A 123 8.295 10.487 10.263 1.00 0.00 O ATOM 1922 ND2 ASN A 123 7.331 8.596 10.997 1.00 0.00 N ATOM 0 H ASN A 123 6.813 6.727 8.822 1.00 0.00 H new ATOM 0 HA ASN A 123 6.710 9.348 7.892 1.00 0.00 H new ATOM 0 HB2 ASN A 123 8.778 7.552 9.124 1.00 0.00 H new ATOM 0 HB3 ASN A 123 9.330 9.062 8.426 1.00 0.00 H new ATOM 0 HD21 ASN A 123 7.010 9.041 11.857 1.00 0.00 H new ATOM 0 HD22 ASN A 123 7.124 7.612 10.824 1.00 0.00 H new ATOM 1929 N PHE A 124 8.406 7.291 5.968 1.00 0.00 N ATOM 1930 CA PHE A 124 9.012 7.126 4.653 1.00 0.00 C ATOM 1931 C PHE A 124 7.966 7.251 3.546 1.00 0.00 C ATOM 1932 O PHE A 124 8.185 7.944 2.551 1.00 0.00 O ATOM 1933 CB PHE A 124 9.699 5.763 4.570 1.00 0.00 C ATOM 1934 CG PHE A 124 10.514 5.577 3.322 1.00 0.00 C ATOM 1935 CD1 PHE A 124 9.904 5.214 2.133 1.00 0.00 C ATOM 1936 CD2 PHE A 124 11.886 5.770 3.336 1.00 0.00 C ATOM 1937 CE1 PHE A 124 10.645 5.046 0.981 1.00 0.00 C ATOM 1938 CE2 PHE A 124 12.633 5.602 2.187 1.00 0.00 C ATOM 1939 CZ PHE A 124 12.011 5.240 1.007 1.00 0.00 C ATOM 0 H PHE A 124 8.352 6.431 6.515 1.00 0.00 H new ATOM 0 HA PHE A 124 9.750 7.916 4.513 1.00 0.00 H new ATOM 0 HB2 PHE A 124 10.346 5.638 5.439 1.00 0.00 H new ATOM 0 HB3 PHE A 124 8.942 4.980 4.620 1.00 0.00 H new ATOM 0 HD1 PHE A 124 8.835 5.060 2.107 1.00 0.00 H new ATOM 0 HD2 PHE A 124 12.376 6.055 4.255 1.00 0.00 H new ATOM 0 HE1 PHE A 124 10.156 4.763 0.060 1.00 0.00 H new ATOM 0 HE2 PHE A 124 13.702 5.753 2.210 1.00 0.00 H new ATOM 0 HZ PHE A 124 12.593 5.109 0.107 1.00 0.00 H new ATOM 1949 N ILE A 125 6.832 6.574 3.728 1.00 0.00 N ATOM 1950 CA ILE A 125 5.747 6.599 2.748 1.00 0.00 C ATOM 1951 C ILE A 125 5.197 8.013 2.569 1.00 0.00 C ATOM 1952 O ILE A 125 5.020 8.481 1.443 1.00 0.00 O ATOM 1953 CB ILE A 125 4.589 5.663 3.161 1.00 0.00 C ATOM 1954 CG1 ILE A 125 5.109 4.254 3.458 1.00 0.00 C ATOM 1955 CG2 ILE A 125 3.527 5.621 2.070 1.00 0.00 C ATOM 1956 CD1 ILE A 125 4.118 3.390 4.209 1.00 0.00 C ATOM 0 H ILE A 125 6.641 5.999 4.549 1.00 0.00 H new ATOM 0 HA ILE A 125 6.169 6.251 1.805 1.00 0.00 H new ATOM 0 HB ILE A 125 4.137 6.057 4.071 1.00 0.00 H new ATOM 0 HG12 ILE A 125 5.366 3.765 2.519 1.00 0.00 H new ATOM 0 HG13 ILE A 125 6.027 4.330 4.040 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.718 4.958 2.375 1.00 0.00 H new ATOM 0 HG22 ILE A 125 3.132 6.624 1.908 1.00 0.00 H new ATOM 0 HG23 ILE A 125 3.970 5.251 1.145 1.00 0.00 H new ATOM 0 HD11 ILE A 125 4.553 2.406 4.385 1.00 0.00 H new ATOM 0 HD12 ILE A 125 3.879 3.857 5.164 1.00 0.00 H new ATOM 0 HD13 ILE A 125 3.208 3.284 3.619 1.00 0.00 H new ATOM 1968 N LYS A 126 4.924 8.681 3.688 1.00 0.00 N ATOM 1969 CA LYS A 126 4.388 10.040 3.666 1.00 0.00 C ATOM 1970 C LYS A 126 5.377 11.015 3.029 1.00 0.00 C ATOM 1971 O LYS A 126 4.978 11.921 2.294 1.00 0.00 O ATOM 1972 CB LYS A 126 4.041 10.494 5.086 1.00 0.00 C ATOM 1973 CG LYS A 126 2.550 10.673 5.323 1.00 0.00 C ATOM 1974 CD LYS A 126 2.277 11.804 6.302 1.00 0.00 C ATOM 1975 CE LYS A 126 0.960 11.605 7.038 1.00 0.00 C ATOM 1976 NZ LYS A 126 -0.047 12.639 6.662 1.00 0.00 N ATOM 0 H LYS A 126 5.066 8.302 4.624 1.00 0.00 H new ATOM 0 HA LYS A 126 3.482 10.035 3.061 1.00 0.00 H new ATOM 0 HB2 LYS A 126 4.428 9.763 5.796 1.00 0.00 H new ATOM 0 HB3 LYS A 126 4.548 11.437 5.291 1.00 0.00 H new ATOM 0 HG2 LYS A 126 2.052 10.881 4.376 1.00 0.00 H new ATOM 0 HG3 LYS A 126 2.127 9.745 5.709 1.00 0.00 H new ATOM 0 HD2 LYS A 126 3.092 11.865 7.024 1.00 0.00 H new ATOM 0 HD3 LYS A 126 2.254 12.752 5.765 1.00 0.00 H new ATOM 0 HE2 LYS A 126 0.565 10.614 6.814 1.00 0.00 H new ATOM 0 HE3 LYS A 126 1.135 11.643 8.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -0.930 12.469 7.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 0.320 13.583 6.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -0.233 12.587 5.640 1.00 0.00 H new ATOM 1990 N SER A 127 6.667 10.821 3.309 1.00 0.00 N ATOM 1991 CA SER A 127 7.708 11.683 2.755 1.00 0.00 C ATOM 1992 C SER A 127 7.816 11.490 1.244 1.00 0.00 C ATOM 1993 O SER A 127 7.928 12.460 0.493 1.00 0.00 O ATOM 1994 CB SER A 127 9.055 11.389 3.422 1.00 0.00 C ATOM 1995 OG SER A 127 10.033 12.348 3.051 1.00 0.00 O ATOM 0 H SER A 127 7.013 10.077 3.914 1.00 0.00 H new ATOM 0 HA SER A 127 7.437 12.720 2.954 1.00 0.00 H new ATOM 0 HB2 SER A 127 8.935 11.389 4.505 1.00 0.00 H new ATOM 0 HB3 SER A 127 9.394 10.392 3.139 1.00 0.00 H new ATOM 0 HG SER A 127 10.882 12.137 3.492 1.00 0.00 H new ATOM 2001 N GLU A 128 7.775 10.230 0.811 1.00 0.00 N ATOM 2002 CA GLU A 128 7.862 9.893 -0.608 1.00 0.00 C ATOM 2003 C GLU A 128 6.658 10.437 -1.378 1.00 0.00 C ATOM 2004 O GLU A 128 6.811 11.014 -2.454 1.00 0.00 O ATOM 2005 CB GLU A 128 7.948 8.374 -0.782 1.00 0.00 C ATOM 2006 CG GLU A 128 8.487 7.939 -2.135 1.00 0.00 C ATOM 2007 CD GLU A 128 9.891 8.451 -2.397 1.00 0.00 C ATOM 2008 OE1 GLU A 128 10.802 8.109 -1.614 1.00 0.00 O ATOM 2009 OE2 GLU A 128 10.078 9.196 -3.383 1.00 0.00 O ATOM 0 H GLU A 128 7.682 9.423 1.427 1.00 0.00 H new ATOM 0 HA GLU A 128 8.763 10.355 -1.011 1.00 0.00 H new ATOM 0 HB2 GLU A 128 8.586 7.964 0.001 1.00 0.00 H new ATOM 0 HB3 GLU A 128 6.956 7.945 -0.642 1.00 0.00 H new ATOM 0 HG2 GLU A 128 8.485 6.850 -2.189 1.00 0.00 H new ATOM 0 HG3 GLU A 128 7.821 8.298 -2.920 1.00 0.00 H new ATOM 2016 N LEU A 129 5.463 10.249 -0.814 1.00 0.00 N ATOM 2017 CA LEU A 129 4.230 10.721 -1.443 1.00 0.00 C ATOM 2018 C LEU A 129 4.226 12.244 -1.586 1.00 0.00 C ATOM 2019 O LEU A 129 3.683 12.781 -2.553 1.00 0.00 O ATOM 2020 CB LEU A 129 3.014 10.274 -0.627 1.00 0.00 C ATOM 2021 CG LEU A 129 1.663 10.425 -1.337 1.00 0.00 C ATOM 2022 CD1 LEU A 129 0.905 9.105 -1.338 1.00 0.00 C ATOM 2023 CD2 LEU A 129 0.833 11.516 -0.679 1.00 0.00 C ATOM 0 H LEU A 129 5.324 9.773 0.077 1.00 0.00 H new ATOM 0 HA LEU A 129 4.177 10.284 -2.440 1.00 0.00 H new ATOM 0 HB2 LEU A 129 3.146 9.228 -0.350 1.00 0.00 H new ATOM 0 HB3 LEU A 129 2.986 10.848 0.299 1.00 0.00 H new ATOM 0 HG LEU A 129 1.851 10.712 -2.372 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -0.050 9.234 -1.846 1.00 0.00 H new ATOM 0 HD12 LEU A 129 1.493 8.348 -1.857 1.00 0.00 H new ATOM 0 HD13 LEU A 129 0.729 8.786 -0.311 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -0.122 11.609 -1.196 1.00 0.00 H new ATOM 0 HD22 LEU A 129 0.656 11.259 0.365 1.00 0.00 H new ATOM 0 HD23 LEU A 129 1.369 12.464 -0.734 1.00 0.00 H new ATOM 2035 N LYS A 130 4.832 12.933 -0.619 1.00 0.00 N ATOM 2036 CA LYS A 130 4.898 14.391 -0.635 1.00 0.00 C ATOM 2037 C LYS A 130 5.841 14.895 -1.730 1.00 0.00 C ATOM 2038 O LYS A 130 5.652 15.989 -2.262 1.00 0.00 O ATOM 2039 CB LYS A 130 5.358 14.911 0.729 1.00 0.00 C ATOM 2040 CG LYS A 130 4.972 16.358 0.993 1.00 0.00 C ATOM 2041 CD LYS A 130 6.198 17.237 1.157 1.00 0.00 C ATOM 2042 CE LYS A 130 5.814 18.671 1.484 1.00 0.00 C ATOM 2043 NZ LYS A 130 5.773 18.914 2.953 1.00 0.00 N ATOM 0 H LYS A 130 5.285 12.502 0.187 1.00 0.00 H new ATOM 0 HA LYS A 130 3.898 14.769 -0.849 1.00 0.00 H new ATOM 0 HB2 LYS A 130 4.932 14.282 1.510 1.00 0.00 H new ATOM 0 HB3 LYS A 130 6.442 14.815 0.798 1.00 0.00 H new ATOM 0 HG2 LYS A 130 4.363 16.730 0.169 1.00 0.00 H new ATOM 0 HG3 LYS A 130 4.359 16.414 1.893 1.00 0.00 H new ATOM 0 HD2 LYS A 130 6.830 16.838 1.951 1.00 0.00 H new ATOM 0 HD3 LYS A 130 6.787 17.217 0.240 1.00 0.00 H new ATOM 0 HE2 LYS A 130 6.529 19.352 1.023 1.00 0.00 H new ATOM 0 HE3 LYS A 130 4.838 18.893 1.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 5.507 19.903 3.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 5.072 18.282 3.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 6.711 18.727 3.362 1.00 0.00 H new