USER MOD reduce.3.24.130724 H: found=0, std=0, add=966, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 967 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 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 144 MET CE :methyl -171:sc= -0.821 (180deg=-1.04) USER MOD Single : A 5 THR OG1 : rot -32:sc= 0.101 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 13 LYS NZ :NH3+ -161:sc= -0.194 (180deg=-0.85) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 68:sc= 1.25 USER MOD Single : A 28 THR OG1 : rot -60:sc= 0.942 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -169:sc=-0.00094 (180deg=-0.0977) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 MET CE :methyl -176:sc= 0 (180deg=-0.0152) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -0.163 X(o=-0.16,f=-0.11) USER MOD Single : A 42 ASN : amide:sc= 0.32 K(o=0.32,f=-0.73) USER MOD Single : A 44 THR OG1 : rot -76:sc= 1.32 USER MOD Single : A 49 GLN : amide:sc= 0 K(o=0,f=-2!) USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.0181 K(o=-0.018,f=-1.1) USER MOD Single : A 60 ASN : amide:sc= 0.255 K(o=0.25,f=-1.7!) USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.0997 USER MOD Single : A 70 THR OG1 : rot 83:sc= 0.677 USER MOD Single : A 71 MET CE :methyl -179:sc= 0 (180deg=-0.00158) USER MOD Single : A 72 MET CE :methyl -124:sc= -0.149 (180deg=-0.926) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0.0017) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot -53:sc= 0.837 USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 110 THR OG1 : rot 72:sc= 0.553 USER MOD Single : A 111 ASN : amide:sc= -0.0283 X(o=-0.028,f=-0.16) USER MOD Single : A 115 LYS NZ :NH3+ 179:sc= -0.0112 (180deg=-0.0207) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl 158:sc= -0.317 (180deg=-1.61!) USER MOD Single : A 135 GLN : amide:sc= -0.221 K(o=-0.22,f=-1.7!) USER MOD Single : A 137 ASN : amide:sc= -0.634 K(o=-0.63,f=-9.6!) USER MOD Single : A 138 TYR OH : rot 180:sc=-0.00536 USER MOD Single : A 143 GLN : amide:sc= 1.08 K(o=1.1,f=-0.068) USER MOD Single : A 145 MET CE :methyl -146:sc= -0.056 (180deg=-0.789) USER MOD ----------------------------------------------------------------- ATOM 58 N THR A 5 -11.013 14.923 0.346 1.00 0.00 N ATOM 59 CA THR A 5 -11.461 16.084 -0.359 1.00 0.00 C ATOM 60 C THR A 5 -12.884 15.882 -0.751 1.00 0.00 C ATOM 61 O THR A 5 -13.270 14.731 -0.951 1.00 0.00 O ATOM 62 CB THR A 5 -10.666 16.551 -1.543 1.00 0.00 C ATOM 63 OG1 THR A 5 -10.445 15.487 -2.456 1.00 0.00 O ATOM 64 CG2 THR A 5 -9.230 16.881 -1.102 1.00 0.00 C ATOM 0 HA THR A 5 -11.318 16.896 0.354 1.00 0.00 H new ATOM 0 HB THR A 5 -11.219 17.387 -1.970 1.00 0.00 H new ATOM 0 HG1 THR A 5 -10.374 14.643 -1.963 1.00 0.00 H new ATOM 0 HG21 THR A 5 -8.654 17.220 -1.963 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.253 17.668 -0.348 1.00 0.00 H new ATOM 0 HG23 THR A 5 -8.764 15.989 -0.682 1.00 0.00 H new ATOM 72 N GLU A 6 -13.591 16.991 -1.034 1.00 0.00 N ATOM 73 CA GLU A 6 -14.909 16.966 -1.588 1.00 0.00 C ATOM 74 C GLU A 6 -14.883 16.279 -2.911 1.00 0.00 C ATOM 75 O GLU A 6 -15.789 15.496 -3.188 1.00 0.00 O ATOM 76 CB GLU A 6 -15.440 18.384 -1.855 1.00 0.00 C ATOM 77 CG GLU A 6 -15.766 19.320 -0.690 1.00 0.00 C ATOM 78 CD GLU A 6 -14.541 20.024 -0.124 1.00 0.00 C ATOM 79 OE1 GLU A 6 -13.413 19.849 -0.659 1.00 0.00 O ATOM 80 OE2 GLU A 6 -14.677 20.663 0.953 1.00 0.00 O ATOM 0 H GLU A 6 -13.235 17.933 -0.873 1.00 0.00 H new ATOM 0 HA GLU A 6 -15.545 16.453 -0.867 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -14.705 18.891 -2.480 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -16.348 18.282 -2.450 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -16.485 20.068 -1.024 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -16.247 18.748 0.103 1.00 0.00 H new ATOM 87 N GLU A 7 -13.861 16.426 -3.773 1.00 0.00 N ATOM 88 CA GLU A 7 -13.816 15.780 -5.048 1.00 0.00 C ATOM 89 C GLU A 7 -13.587 14.311 -4.949 1.00 0.00 C ATOM 90 O GLU A 7 -14.094 13.530 -5.753 1.00 0.00 O ATOM 91 CB GLU A 7 -12.758 16.360 -6.002 1.00 0.00 C ATOM 92 CG GLU A 7 -12.901 17.869 -6.207 1.00 0.00 C ATOM 93 CD GLU A 7 -12.126 18.312 -7.439 1.00 0.00 C ATOM 94 OE1 GLU A 7 -12.372 18.052 -8.647 1.00 0.00 O ATOM 95 OE2 GLU A 7 -11.069 18.921 -7.122 1.00 0.00 O ATOM 0 H GLU A 7 -13.046 17.008 -3.579 1.00 0.00 H new ATOM 0 HA GLU A 7 -14.806 15.972 -5.461 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -11.765 16.145 -5.608 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -12.833 15.859 -6.967 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -13.954 18.129 -6.319 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -12.533 18.398 -5.328 1.00 0.00 H new ATOM 102 N GLN A 8 -12.786 13.806 -3.994 1.00 0.00 N ATOM 103 CA GLN A 8 -12.704 12.407 -3.709 1.00 0.00 C ATOM 104 C GLN A 8 -13.914 11.727 -3.165 1.00 0.00 C ATOM 105 O GLN A 8 -14.330 10.654 -3.600 1.00 0.00 O ATOM 106 CB GLN A 8 -11.571 12.138 -2.704 1.00 0.00 C ATOM 107 CG GLN A 8 -10.161 12.270 -3.284 1.00 0.00 C ATOM 108 CD GLN A 8 -9.091 12.022 -2.231 1.00 0.00 C ATOM 109 OE1 GLN A 8 -9.379 12.029 -1.035 1.00 0.00 O ATOM 110 NE2 GLN A 8 -7.805 11.957 -2.668 1.00 0.00 N ATOM 0 H GLN A 8 -12.182 14.382 -3.407 1.00 0.00 H new ATOM 0 HA GLN A 8 -12.544 11.986 -4.702 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -11.672 12.830 -1.868 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -11.691 11.132 -2.301 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -10.037 11.561 -4.102 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -10.033 13.267 -3.704 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -7.606 11.953 -3.668 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -7.039 11.912 -1.995 1.00 0.00 H new ATOM 119 N ILE A 9 -14.631 12.464 -2.299 1.00 0.00 N ATOM 120 CA ILE A 9 -15.864 12.004 -1.740 1.00 0.00 C ATOM 121 C ILE A 9 -16.949 11.831 -2.747 1.00 0.00 C ATOM 122 O ILE A 9 -17.643 10.816 -2.784 1.00 0.00 O ATOM 123 CB ILE A 9 -16.426 12.947 -0.718 1.00 0.00 C ATOM 124 CG1 ILE A 9 -15.508 12.997 0.514 1.00 0.00 C ATOM 125 CG2 ILE A 9 -17.898 12.646 -0.390 1.00 0.00 C ATOM 126 CD1 ILE A 9 -15.685 14.324 1.251 1.00 0.00 C ATOM 0 H ILE A 9 -14.351 13.392 -1.982 1.00 0.00 H new ATOM 0 HA ILE A 9 -15.588 11.047 -1.298 1.00 0.00 H new ATOM 0 HB ILE A 9 -16.445 13.951 -1.141 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -15.739 12.168 1.183 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -14.469 12.879 0.207 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -18.257 13.356 0.355 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -18.498 12.735 -1.296 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -17.983 11.633 0.004 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -15.029 14.347 2.122 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -15.431 15.148 0.584 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -16.721 14.425 1.574 1.00 0.00 H new ATOM 138 N ALA A 10 -16.996 12.726 -3.750 1.00 0.00 N ATOM 139 CA ALA A 10 -17.805 12.582 -4.920 1.00 0.00 C ATOM 140 C ALA A 10 -17.649 11.313 -5.685 1.00 0.00 C ATOM 141 O ALA A 10 -18.619 10.697 -6.124 1.00 0.00 O ATOM 142 CB ALA A 10 -17.454 13.849 -5.720 1.00 0.00 C ATOM 0 H ALA A 10 -16.447 13.586 -3.745 1.00 0.00 H new ATOM 0 HA ALA A 10 -18.862 12.497 -4.667 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -18.017 13.858 -6.653 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -17.709 14.732 -5.134 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -16.387 13.856 -5.941 1.00 0.00 H new ATOM 148 N GLU A 11 -16.447 10.777 -5.959 1.00 0.00 N ATOM 149 CA GLU A 11 -16.335 9.525 -6.641 1.00 0.00 C ATOM 150 C GLU A 11 -16.796 8.373 -5.817 1.00 0.00 C ATOM 151 O GLU A 11 -17.448 7.453 -6.309 1.00 0.00 O ATOM 152 CB GLU A 11 -14.862 9.280 -7.008 1.00 0.00 C ATOM 153 CG GLU A 11 -14.441 10.175 -8.176 1.00 0.00 C ATOM 154 CD GLU A 11 -12.983 9.989 -8.571 1.00 0.00 C ATOM 155 OE1 GLU A 11 -12.082 10.602 -7.938 1.00 0.00 O ATOM 156 OE2 GLU A 11 -12.778 9.109 -9.449 1.00 0.00 O ATOM 0 H GLU A 11 -15.556 11.207 -5.710 1.00 0.00 H new ATOM 0 HA GLU A 11 -16.971 9.589 -7.524 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -14.228 9.479 -6.144 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -14.717 8.233 -7.275 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -15.075 9.962 -9.037 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -14.609 11.218 -7.907 1.00 0.00 H new ATOM 163 N PHE A 12 -16.527 8.481 -4.504 1.00 0.00 N ATOM 164 CA PHE A 12 -16.871 7.488 -3.533 1.00 0.00 C ATOM 165 C PHE A 12 -18.343 7.320 -3.379 1.00 0.00 C ATOM 166 O PHE A 12 -18.770 6.174 -3.249 1.00 0.00 O ATOM 167 CB PHE A 12 -16.188 7.692 -2.170 1.00 0.00 C ATOM 168 CG PHE A 12 -14.705 7.812 -2.251 1.00 0.00 C ATOM 169 CD1 PHE A 12 -13.996 7.034 -3.136 1.00 0.00 C ATOM 170 CD2 PHE A 12 -14.008 8.551 -1.324 1.00 0.00 C ATOM 171 CE1 PHE A 12 -12.639 7.206 -3.279 1.00 0.00 C ATOM 172 CE2 PHE A 12 -12.665 8.775 -1.512 1.00 0.00 C ATOM 173 CZ PHE A 12 -11.966 8.109 -2.491 1.00 0.00 C ATOM 0 H PHE A 12 -16.052 9.290 -4.103 1.00 0.00 H new ATOM 0 HA PHE A 12 -16.475 6.557 -3.938 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -16.591 8.591 -1.704 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -16.440 6.855 -1.519 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -14.507 6.284 -3.722 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -14.511 8.952 -0.456 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -12.099 6.628 -4.015 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -12.151 9.485 -0.881 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.912 8.291 -2.638 1.00 0.00 H new ATOM 183 N LYS A 13 -19.139 8.402 -3.451 1.00 0.00 N ATOM 184 CA LYS A 13 -20.565 8.495 -3.482 1.00 0.00 C ATOM 185 C LYS A 13 -21.215 7.810 -4.634 1.00 0.00 C ATOM 186 O LYS A 13 -22.079 6.948 -4.475 1.00 0.00 O ATOM 187 CB LYS A 13 -21.011 9.966 -3.504 1.00 0.00 C ATOM 188 CG LYS A 13 -22.503 10.255 -3.327 1.00 0.00 C ATOM 189 CD LYS A 13 -22.890 9.936 -1.881 1.00 0.00 C ATOM 190 CE LYS A 13 -24.253 10.534 -1.526 1.00 0.00 C ATOM 191 NZ LYS A 13 -24.297 11.993 -1.770 1.00 0.00 N ATOM 0 H LYS A 13 -18.722 9.332 -3.493 1.00 0.00 H new ATOM 0 HA LYS A 13 -20.886 7.983 -2.575 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -20.471 10.493 -2.717 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -20.695 10.399 -4.453 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -22.716 11.299 -3.555 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -23.091 9.651 -4.019 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -22.916 8.856 -1.739 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -22.131 10.328 -1.204 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -25.029 10.044 -2.115 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -24.475 10.335 -0.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -25.085 12.411 -1.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -23.402 12.424 -1.461 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -24.434 12.171 -2.785 1.00 0.00 H new ATOM 205 N GLU A 14 -20.700 8.057 -5.852 1.00 0.00 N ATOM 206 CA GLU A 14 -21.128 7.333 -7.009 1.00 0.00 C ATOM 207 C GLU A 14 -20.814 5.879 -6.929 1.00 0.00 C ATOM 208 O GLU A 14 -21.627 5.039 -7.311 1.00 0.00 O ATOM 209 CB GLU A 14 -20.374 7.918 -8.215 1.00 0.00 C ATOM 210 CG GLU A 14 -20.756 9.368 -8.523 1.00 0.00 C ATOM 211 CD GLU A 14 -22.061 9.339 -9.305 1.00 0.00 C ATOM 212 OE1 GLU A 14 -22.003 8.717 -10.400 1.00 0.00 O ATOM 213 OE2 GLU A 14 -23.084 9.948 -8.891 1.00 0.00 O ATOM 0 H GLU A 14 -19.985 8.761 -6.036 1.00 0.00 H new ATOM 0 HA GLU A 14 -22.210 7.430 -7.094 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -19.302 7.865 -8.025 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -20.573 7.303 -9.092 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -20.874 9.938 -7.601 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -19.972 9.857 -9.102 1.00 0.00 H new ATOM 220 N ALA A 15 -19.610 5.524 -6.445 1.00 0.00 N ATOM 221 CA ALA A 15 -19.130 4.178 -6.403 1.00 0.00 C ATOM 222 C ALA A 15 -19.910 3.271 -5.514 1.00 0.00 C ATOM 223 O ALA A 15 -20.201 2.139 -5.898 1.00 0.00 O ATOM 224 CB ALA A 15 -17.679 4.109 -5.899 1.00 0.00 C ATOM 0 H ALA A 15 -18.946 6.201 -6.069 1.00 0.00 H new ATOM 0 HA ALA A 15 -19.228 3.845 -7.436 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -17.349 3.070 -5.881 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -17.035 4.683 -6.565 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -17.623 4.525 -4.893 1.00 0.00 H new ATOM 230 N PHE A 16 -20.335 3.807 -4.356 1.00 0.00 N ATOM 231 CA PHE A 16 -21.283 3.238 -3.448 1.00 0.00 C ATOM 232 C PHE A 16 -22.528 2.674 -4.041 1.00 0.00 C ATOM 233 O PHE A 16 -22.763 1.498 -3.769 1.00 0.00 O ATOM 234 CB PHE A 16 -21.531 4.312 -2.376 1.00 0.00 C ATOM 235 CG PHE A 16 -21.913 3.581 -1.134 1.00 0.00 C ATOM 236 CD1 PHE A 16 -20.960 2.999 -0.332 1.00 0.00 C ATOM 237 CD2 PHE A 16 -23.258 3.499 -0.859 1.00 0.00 C ATOM 238 CE1 PHE A 16 -21.364 2.313 0.789 1.00 0.00 C ATOM 239 CE2 PHE A 16 -23.654 2.774 0.240 1.00 0.00 C ATOM 240 CZ PHE A 16 -22.708 2.210 1.063 1.00 0.00 C ATOM 0 H PHE A 16 -19.988 4.709 -4.030 1.00 0.00 H new ATOM 0 HA PHE A 16 -20.859 2.328 -3.023 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -20.637 4.914 -2.214 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -22.323 4.995 -2.685 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -19.912 3.079 -0.578 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -23.984 3.991 -1.490 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -20.636 1.861 1.446 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -24.705 2.648 0.456 1.00 0.00 H new ATOM 0 HZ PHE A 16 -23.027 1.674 1.945 1.00 0.00 H new ATOM 250 N SER A 17 -23.321 3.491 -4.758 1.00 0.00 N ATOM 251 CA SER A 17 -24.478 3.079 -5.491 1.00 0.00 C ATOM 252 C SER A 17 -24.209 2.392 -6.785 1.00 0.00 C ATOM 253 O SER A 17 -25.106 1.738 -7.316 1.00 0.00 O ATOM 254 CB SER A 17 -25.503 4.193 -5.763 1.00 0.00 C ATOM 255 OG SER A 17 -25.030 5.181 -6.666 1.00 0.00 O ATOM 0 H SER A 17 -23.145 4.493 -4.830 1.00 0.00 H new ATOM 0 HA SER A 17 -24.901 2.357 -4.793 1.00 0.00 H new ATOM 0 HB2 SER A 17 -26.414 3.749 -6.165 1.00 0.00 H new ATOM 0 HB3 SER A 17 -25.770 4.670 -4.820 1.00 0.00 H new ATOM 0 HG SER A 17 -25.724 5.860 -6.801 1.00 0.00 H new ATOM 261 N LEU A 18 -23.010 2.430 -7.393 1.00 0.00 N ATOM 262 CA LEU A 18 -22.624 1.573 -8.470 1.00 0.00 C ATOM 263 C LEU A 18 -22.421 0.190 -7.954 1.00 0.00 C ATOM 264 O LEU A 18 -22.807 -0.754 -8.642 1.00 0.00 O ATOM 265 CB LEU A 18 -21.397 1.979 -9.303 1.00 0.00 C ATOM 266 CG LEU A 18 -21.395 1.669 -10.810 1.00 0.00 C ATOM 267 CD1 LEU A 18 -22.266 2.650 -11.612 1.00 0.00 C ATOM 268 CD2 LEU A 18 -20.030 1.601 -11.516 1.00 0.00 C ATOM 0 H LEU A 18 -22.278 3.087 -7.122 1.00 0.00 H new ATOM 0 HA LEU A 18 -23.456 1.654 -9.169 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -21.258 3.054 -9.186 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -20.524 1.495 -8.864 1.00 0.00 H new ATOM 0 HG LEU A 18 -21.801 0.658 -10.809 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -22.230 2.388 -12.669 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -23.296 2.595 -11.259 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -21.890 3.664 -11.477 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -20.177 1.375 -12.572 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -19.521 2.560 -11.417 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -19.423 0.819 -11.059 1.00 0.00 H new ATOM 280 N PHE A 19 -21.836 -0.092 -6.777 1.00 0.00 N ATOM 281 CA PHE A 19 -21.569 -1.440 -6.378 1.00 0.00 C ATOM 282 C PHE A 19 -22.771 -2.066 -5.759 1.00 0.00 C ATOM 283 O PHE A 19 -22.874 -3.281 -5.917 1.00 0.00 O ATOM 284 CB PHE A 19 -20.316 -1.409 -5.488 1.00 0.00 C ATOM 285 CG PHE A 19 -19.087 -0.871 -6.137 1.00 0.00 C ATOM 286 CD1 PHE A 19 -18.878 -1.079 -7.480 1.00 0.00 C ATOM 287 CD2 PHE A 19 -18.221 -0.094 -5.404 1.00 0.00 C ATOM 288 CE1 PHE A 19 -17.748 -0.528 -8.037 1.00 0.00 C ATOM 289 CE2 PHE A 19 -17.051 0.382 -5.947 1.00 0.00 C ATOM 290 CZ PHE A 19 -16.813 0.136 -7.278 1.00 0.00 C ATOM 0 H PHE A 19 -21.547 0.614 -6.100 1.00 0.00 H new ATOM 0 HA PHE A 19 -21.357 -2.086 -7.230 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -20.533 -0.809 -4.604 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -20.111 -2.422 -5.142 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -19.574 -1.653 -8.074 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -18.465 0.147 -4.380 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -17.590 -0.619 -9.101 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -16.341 0.932 -5.347 1.00 0.00 H new ATOM 0 HZ PHE A 19 -15.889 0.465 -7.729 1.00 0.00 H new ATOM 300 N ASP A 20 -23.627 -1.307 -5.052 1.00 0.00 N ATOM 301 CA ASP A 20 -24.945 -1.628 -4.598 1.00 0.00 C ATOM 302 C ASP A 20 -25.823 -2.087 -5.712 1.00 0.00 C ATOM 303 O ASP A 20 -26.209 -1.305 -6.579 1.00 0.00 O ATOM 304 CB ASP A 20 -25.566 -0.442 -3.842 1.00 0.00 C ATOM 305 CG ASP A 20 -26.598 -1.039 -2.896 1.00 0.00 C ATOM 306 OD1 ASP A 20 -26.964 -2.245 -2.913 1.00 0.00 O ATOM 307 OD2 ASP A 20 -27.175 -0.194 -2.160 1.00 0.00 O ATOM 0 H ASP A 20 -23.363 -0.363 -4.768 1.00 0.00 H new ATOM 0 HA ASP A 20 -24.858 -2.463 -3.903 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -24.805 0.110 -3.291 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -26.031 0.260 -4.533 1.00 0.00 H new ATOM 312 N LYS A 21 -26.187 -3.380 -5.761 1.00 0.00 N ATOM 313 CA LYS A 21 -26.865 -3.995 -6.860 1.00 0.00 C ATOM 314 C LYS A 21 -28.337 -3.797 -6.746 1.00 0.00 C ATOM 315 O LYS A 21 -28.951 -3.334 -7.706 1.00 0.00 O ATOM 316 CB LYS A 21 -26.645 -5.516 -6.919 1.00 0.00 C ATOM 317 CG LYS A 21 -27.034 -6.134 -8.264 1.00 0.00 C ATOM 318 CD LYS A 21 -26.040 -5.915 -9.406 1.00 0.00 C ATOM 319 CE LYS A 21 -26.414 -6.707 -10.660 1.00 0.00 C ATOM 320 NZ LYS A 21 -25.699 -6.265 -11.879 1.00 0.00 N ATOM 0 H LYS A 21 -25.999 -4.029 -4.997 1.00 0.00 H new ATOM 0 HA LYS A 21 -26.454 -3.523 -7.753 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -25.596 -5.732 -6.718 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -27.225 -5.991 -6.128 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -27.169 -7.207 -8.125 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -28.000 -5.727 -8.564 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -25.997 -4.853 -9.649 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -25.043 -6.208 -9.078 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -26.203 -7.763 -10.489 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -27.488 -6.620 -10.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -26.001 -6.844 -12.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -25.919 -5.266 -12.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -24.674 -6.374 -11.739 1.00 0.00 H new ATOM 334 N ASP A 22 -28.933 -3.939 -5.548 1.00 0.00 N ATOM 335 CA ASP A 22 -30.339 -3.788 -5.336 1.00 0.00 C ATOM 336 C ASP A 22 -30.771 -2.418 -4.943 1.00 0.00 C ATOM 337 O ASP A 22 -31.862 -1.984 -5.310 1.00 0.00 O ATOM 338 CB ASP A 22 -30.824 -4.907 -4.398 1.00 0.00 C ATOM 339 CG ASP A 22 -30.001 -5.079 -3.130 1.00 0.00 C ATOM 340 OD1 ASP A 22 -29.050 -4.305 -2.836 1.00 0.00 O ATOM 341 OD2 ASP A 22 -30.221 -6.100 -2.425 1.00 0.00 O ATOM 0 H ASP A 22 -28.418 -4.167 -4.698 1.00 0.00 H new ATOM 0 HA ASP A 22 -30.840 -3.903 -6.297 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -31.858 -4.705 -4.118 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -30.821 -5.849 -4.947 1.00 0.00 H new ATOM 346 N GLY A 23 -29.859 -1.712 -4.250 1.00 0.00 N ATOM 347 CA GLY A 23 -29.834 -0.286 -4.159 1.00 0.00 C ATOM 348 C GLY A 23 -30.438 0.081 -2.847 1.00 0.00 C ATOM 349 O GLY A 23 -31.273 0.979 -2.753 1.00 0.00 O ATOM 0 H GLY A 23 -29.104 -2.158 -3.729 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -28.812 0.086 -4.230 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -30.394 0.162 -4.980 1.00 0.00 H new ATOM 353 N ASP A 24 -30.132 -0.627 -1.745 1.00 0.00 N ATOM 354 CA ASP A 24 -30.752 -0.304 -0.497 1.00 0.00 C ATOM 355 C ASP A 24 -29.972 0.734 0.234 1.00 0.00 C ATOM 356 O ASP A 24 -30.389 1.225 1.282 1.00 0.00 O ATOM 357 CB ASP A 24 -30.864 -1.569 0.370 1.00 0.00 C ATOM 358 CG ASP A 24 -29.581 -2.328 0.677 1.00 0.00 C ATOM 359 OD1 ASP A 24 -28.782 -2.572 -0.266 1.00 0.00 O ATOM 360 OD2 ASP A 24 -29.259 -2.507 1.882 1.00 0.00 O ATOM 0 H ASP A 24 -29.472 -1.404 -1.715 1.00 0.00 H new ATOM 0 HA ASP A 24 -31.747 0.092 -0.702 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -31.323 -1.287 1.318 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -31.551 -2.256 -0.125 1.00 0.00 H new ATOM 365 N GLY A 25 -28.796 1.156 -0.263 1.00 0.00 N ATOM 366 CA GLY A 25 -27.872 1.893 0.542 1.00 0.00 C ATOM 367 C GLY A 25 -26.891 1.130 1.364 1.00 0.00 C ATOM 368 O GLY A 25 -26.318 1.662 2.313 1.00 0.00 O ATOM 0 H GLY A 25 -28.485 0.988 -1.220 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -27.311 2.555 -0.117 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -28.449 2.527 1.215 1.00 0.00 H new ATOM 372 N THR A 26 -26.651 -0.148 1.018 1.00 0.00 N ATOM 373 CA THR A 26 -25.727 -0.958 1.749 1.00 0.00 C ATOM 374 C THR A 26 -24.967 -1.820 0.799 1.00 0.00 C ATOM 375 O THR A 26 -25.554 -2.479 -0.058 1.00 0.00 O ATOM 376 CB THR A 26 -26.325 -1.805 2.833 1.00 0.00 C ATOM 377 OG1 THR A 26 -27.545 -1.369 3.415 1.00 0.00 O ATOM 378 CG2 THR A 26 -25.334 -1.897 4.005 1.00 0.00 C ATOM 0 H THR A 26 -27.097 -0.620 0.232 1.00 0.00 H new ATOM 0 HA THR A 26 -25.075 -0.256 2.268 1.00 0.00 H new ATOM 0 HB THR A 26 -26.537 -2.740 2.315 1.00 0.00 H new ATOM 0 HG1 THR A 26 -28.264 -1.428 2.751 1.00 0.00 H new ATOM 0 HG21 THR A 26 -25.763 -2.512 4.797 1.00 0.00 H new ATOM 0 HG22 THR A 26 -24.403 -2.347 3.660 1.00 0.00 H new ATOM 0 HG23 THR A 26 -25.133 -0.898 4.390 1.00 0.00 H new ATOM 386 N ILE A 27 -23.644 -1.977 0.983 1.00 0.00 N ATOM 387 CA ILE A 27 -22.839 -2.886 0.228 1.00 0.00 C ATOM 388 C ILE A 27 -22.644 -4.209 0.886 1.00 0.00 C ATOM 389 O ILE A 27 -22.417 -4.345 2.087 1.00 0.00 O ATOM 390 CB ILE A 27 -21.467 -2.439 -0.181 1.00 0.00 C ATOM 391 CG1 ILE A 27 -21.502 -0.933 -0.488 1.00 0.00 C ATOM 392 CG2 ILE A 27 -21.152 -3.166 -1.500 1.00 0.00 C ATOM 393 CD1 ILE A 27 -20.195 -0.314 -0.981 1.00 0.00 C ATOM 0 H ILE A 27 -23.117 -1.453 1.681 1.00 0.00 H new ATOM 0 HA ILE A 27 -23.459 -2.945 -0.667 1.00 0.00 H new ATOM 0 HB ILE A 27 -20.737 -2.647 0.601 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -22.271 -0.755 -1.240 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -21.811 -0.406 0.415 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -20.160 -2.877 -1.847 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -21.180 -4.243 -1.337 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -21.893 -2.893 -2.252 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -20.343 0.750 -1.164 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -19.421 -0.448 -0.225 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -19.888 -0.802 -1.906 1.00 0.00 H new ATOM 405 N THR A 28 -22.976 -5.294 0.162 1.00 0.00 N ATOM 406 CA THR A 28 -22.807 -6.640 0.614 1.00 0.00 C ATOM 407 C THR A 28 -21.511 -7.200 0.137 1.00 0.00 C ATOM 408 O THR A 28 -20.861 -6.716 -0.789 1.00 0.00 O ATOM 409 CB THR A 28 -23.944 -7.611 0.497 1.00 0.00 C ATOM 410 OG1 THR A 28 -24.294 -7.692 -0.877 1.00 0.00 O ATOM 411 CG2 THR A 28 -25.177 -7.153 1.294 1.00 0.00 C ATOM 0 H THR A 28 -23.377 -5.231 -0.774 1.00 0.00 H new ATOM 0 HA THR A 28 -22.797 -6.516 1.697 1.00 0.00 H new ATOM 0 HB THR A 28 -23.630 -8.574 0.899 1.00 0.00 H new ATOM 0 HG1 THR A 28 -24.566 -6.807 -1.198 1.00 0.00 H new ATOM 0 HG21 THR A 28 -25.976 -7.886 1.181 1.00 0.00 H new ATOM 0 HG22 THR A 28 -24.915 -7.061 2.348 1.00 0.00 H new ATOM 0 HG23 THR A 28 -25.515 -6.187 0.919 1.00 0.00 H new ATOM 419 N THR A 29 -21.086 -8.366 0.655 1.00 0.00 N ATOM 420 CA THR A 29 -20.056 -9.158 0.058 1.00 0.00 C ATOM 421 C THR A 29 -20.372 -9.680 -1.301 1.00 0.00 C ATOM 422 O THR A 29 -19.498 -9.709 -2.167 1.00 0.00 O ATOM 423 CB THR A 29 -19.731 -10.338 0.925 1.00 0.00 C ATOM 424 OG1 THR A 29 -20.837 -11.163 1.260 1.00 0.00 O ATOM 425 CG2 THR A 29 -18.938 -9.816 2.135 1.00 0.00 C ATOM 0 H THR A 29 -21.468 -8.769 1.511 1.00 0.00 H new ATOM 0 HA THR A 29 -19.214 -8.472 -0.040 1.00 0.00 H new ATOM 0 HB THR A 29 -19.117 -11.036 0.356 1.00 0.00 H new ATOM 0 HG1 THR A 29 -20.533 -11.905 1.823 1.00 0.00 H new ATOM 0 HG21 THR A 29 -18.683 -10.649 2.790 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.024 -9.333 1.790 1.00 0.00 H new ATOM 0 HG23 THR A 29 -19.544 -9.095 2.684 1.00 0.00 H new ATOM 433 N LYS A 30 -21.619 -10.145 -1.494 1.00 0.00 N ATOM 434 CA LYS A 30 -22.096 -10.665 -2.738 1.00 0.00 C ATOM 435 C LYS A 30 -22.128 -9.642 -3.820 1.00 0.00 C ATOM 436 O LYS A 30 -21.997 -9.901 -5.016 1.00 0.00 O ATOM 437 CB LYS A 30 -23.520 -11.222 -2.570 1.00 0.00 C ATOM 438 CG LYS A 30 -23.791 -12.441 -3.453 1.00 0.00 C ATOM 439 CD LYS A 30 -25.120 -13.111 -3.098 1.00 0.00 C ATOM 440 CE LYS A 30 -25.408 -14.228 -4.103 1.00 0.00 C ATOM 441 NZ LYS A 30 -25.767 -13.735 -5.452 1.00 0.00 N ATOM 0 H LYS A 30 -22.322 -10.159 -0.755 1.00 0.00 H new ATOM 0 HA LYS A 30 -21.396 -11.450 -3.026 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -23.677 -11.494 -1.526 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -24.241 -10.440 -2.808 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -23.805 -12.137 -4.500 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -22.979 -13.160 -3.341 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -25.077 -13.518 -2.088 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -25.926 -12.377 -3.112 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -24.530 -14.869 -4.182 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -26.221 -14.846 -3.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -26.127 -14.524 -6.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -26.501 -13.003 -5.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -24.925 -13.331 -5.909 1.00 0.00 H new ATOM 455 N GLU A 31 -22.218 -8.330 -3.537 1.00 0.00 N ATOM 456 CA GLU A 31 -22.104 -7.252 -4.469 1.00 0.00 C ATOM 457 C GLU A 31 -20.690 -6.916 -4.797 1.00 0.00 C ATOM 458 O GLU A 31 -20.222 -7.017 -5.930 1.00 0.00 O ATOM 459 CB GLU A 31 -22.790 -6.060 -3.780 1.00 0.00 C ATOM 460 CG GLU A 31 -24.295 -6.189 -4.026 1.00 0.00 C ATOM 461 CD GLU A 31 -25.162 -5.402 -3.054 1.00 0.00 C ATOM 462 OE1 GLU A 31 -24.923 -5.225 -1.830 1.00 0.00 O ATOM 463 OE2 GLU A 31 -26.206 -4.892 -3.543 1.00 0.00 O ATOM 0 H GLU A 31 -22.383 -8.000 -2.586 1.00 0.00 H new ATOM 0 HA GLU A 31 -22.562 -7.519 -5.421 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -22.575 -6.059 -2.711 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -22.415 -5.118 -4.181 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -24.515 -5.856 -5.041 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -24.571 -7.242 -3.969 1.00 0.00 H new ATOM 470 N LEU A 32 -19.861 -6.392 -3.877 1.00 0.00 N ATOM 471 CA LEU A 32 -18.505 -5.982 -4.077 1.00 0.00 C ATOM 472 C LEU A 32 -17.556 -7.043 -4.518 1.00 0.00 C ATOM 473 O LEU A 32 -16.565 -6.785 -5.200 1.00 0.00 O ATOM 474 CB LEU A 32 -18.137 -5.362 -2.719 1.00 0.00 C ATOM 475 CG LEU A 32 -16.925 -4.416 -2.745 1.00 0.00 C ATOM 476 CD1 LEU A 32 -17.050 -3.342 -3.840 1.00 0.00 C ATOM 477 CD2 LEU A 32 -16.861 -3.782 -1.345 1.00 0.00 C ATOM 0 H LEU A 32 -20.165 -6.243 -2.915 1.00 0.00 H new ATOM 0 HA LEU A 32 -18.422 -5.293 -4.918 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -19.000 -4.813 -2.341 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -17.936 -6.166 -2.011 1.00 0.00 H new ATOM 0 HG LEU A 32 -16.012 -4.962 -2.983 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -16.171 -2.698 -3.820 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -17.125 -3.823 -4.815 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -17.943 -2.743 -3.662 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -16.017 -3.095 -1.295 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -17.785 -3.237 -1.150 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -16.736 -4.565 -0.597 1.00 0.00 H new ATOM 489 N GLY A 33 -17.730 -8.362 -4.320 1.00 0.00 N ATOM 490 CA GLY A 33 -16.882 -9.375 -4.868 1.00 0.00 C ATOM 491 C GLY A 33 -17.092 -9.471 -6.340 1.00 0.00 C ATOM 492 O GLY A 33 -16.066 -9.754 -6.956 1.00 0.00 O ATOM 0 H GLY A 33 -18.492 -8.738 -3.756 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -15.839 -9.142 -4.655 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -17.097 -10.335 -4.398 1.00 0.00 H new ATOM 496 N THR A 34 -18.258 -9.170 -6.940 1.00 0.00 N ATOM 497 CA THR A 34 -18.428 -9.111 -8.359 1.00 0.00 C ATOM 498 C THR A 34 -17.573 -8.060 -8.980 1.00 0.00 C ATOM 499 O THR A 34 -17.081 -8.177 -10.102 1.00 0.00 O ATOM 500 CB THR A 34 -19.824 -8.709 -8.733 1.00 0.00 C ATOM 501 OG1 THR A 34 -20.738 -9.635 -8.165 1.00 0.00 O ATOM 502 CG2 THR A 34 -20.098 -8.785 -10.244 1.00 0.00 C ATOM 0 H THR A 34 -19.110 -8.961 -6.420 1.00 0.00 H new ATOM 0 HA THR A 34 -18.172 -10.111 -8.709 1.00 0.00 H new ATOM 0 HB THR A 34 -19.939 -7.684 -8.381 1.00 0.00 H new ATOM 0 HG1 THR A 34 -21.654 -9.379 -8.403 1.00 0.00 H new ATOM 0 HG21 THR A 34 -21.126 -8.481 -10.443 1.00 0.00 H new ATOM 0 HG22 THR A 34 -19.414 -8.120 -10.772 1.00 0.00 H new ATOM 0 HG23 THR A 34 -19.949 -9.808 -10.590 1.00 0.00 H new ATOM 510 N VAL A 35 -17.373 -6.869 -8.389 1.00 0.00 N ATOM 511 CA VAL A 35 -16.624 -5.767 -8.906 1.00 0.00 C ATOM 512 C VAL A 35 -15.182 -6.141 -8.893 1.00 0.00 C ATOM 513 O VAL A 35 -14.491 -6.075 -9.908 1.00 0.00 O ATOM 514 CB VAL A 35 -16.684 -4.603 -7.962 1.00 0.00 C ATOM 515 CG1 VAL A 35 -16.078 -3.380 -8.671 1.00 0.00 C ATOM 516 CG2 VAL A 35 -18.152 -4.343 -7.585 1.00 0.00 C ATOM 0 H VAL A 35 -17.769 -6.662 -7.472 1.00 0.00 H new ATOM 0 HA VAL A 35 -17.022 -5.525 -9.891 1.00 0.00 H new ATOM 0 HB VAL A 35 -16.122 -4.806 -7.050 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -16.110 -2.519 -8.003 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -15.043 -3.591 -8.940 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -16.650 -3.162 -9.573 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -18.207 -3.498 -6.898 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -18.724 -4.117 -8.485 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -18.567 -5.229 -7.104 1.00 0.00 H new ATOM 526 N MET A 36 -14.668 -6.751 -7.809 1.00 0.00 N ATOM 527 CA MET A 36 -13.338 -7.270 -7.732 1.00 0.00 C ATOM 528 C MET A 36 -13.021 -8.317 -8.744 1.00 0.00 C ATOM 529 O MET A 36 -11.952 -8.319 -9.353 1.00 0.00 O ATOM 530 CB MET A 36 -13.167 -7.741 -6.278 1.00 0.00 C ATOM 531 CG MET A 36 -12.995 -6.510 -5.386 1.00 0.00 C ATOM 532 SD MET A 36 -12.199 -6.976 -3.819 1.00 0.00 S ATOM 533 CE MET A 36 -12.417 -5.271 -3.234 1.00 0.00 C ATOM 0 H MET A 36 -15.202 -6.888 -6.951 1.00 0.00 H new ATOM 0 HA MET A 36 -12.613 -6.497 -7.986 1.00 0.00 H new ATOM 0 HB2 MET A 36 -14.036 -8.319 -5.962 1.00 0.00 H new ATOM 0 HB3 MET A 36 -12.300 -8.396 -6.191 1.00 0.00 H new ATOM 0 HG2 MET A 36 -12.392 -5.761 -5.900 1.00 0.00 H new ATOM 0 HG3 MET A 36 -13.966 -6.057 -5.188 1.00 0.00 H new ATOM 0 HE1 MET A 36 -11.950 -5.160 -2.256 1.00 0.00 H new ATOM 0 HE2 MET A 36 -11.952 -4.582 -3.939 1.00 0.00 H new ATOM 0 HE3 MET A 36 -13.481 -5.046 -3.156 1.00 0.00 H new ATOM 543 N ARG A 37 -13.962 -9.237 -9.020 1.00 0.00 N ATOM 544 CA ARG A 37 -13.891 -10.268 -10.009 1.00 0.00 C ATOM 545 C ARG A 37 -13.927 -9.750 -11.406 1.00 0.00 C ATOM 546 O ARG A 37 -13.236 -10.291 -12.267 1.00 0.00 O ATOM 547 CB ARG A 37 -14.987 -11.330 -9.820 1.00 0.00 C ATOM 548 CG ARG A 37 -14.787 -12.649 -10.569 1.00 0.00 C ATOM 549 CD ARG A 37 -15.634 -13.737 -9.905 1.00 0.00 C ATOM 550 NE ARG A 37 -14.987 -15.033 -10.252 1.00 0.00 N ATOM 551 CZ ARG A 37 -15.595 -16.251 -10.158 1.00 0.00 C ATOM 552 NH1 ARG A 37 -16.883 -16.406 -9.732 1.00 0.00 N ATOM 553 NH2 ARG A 37 -14.800 -17.344 -10.349 1.00 0.00 N ATOM 0 H ARG A 37 -14.844 -9.261 -8.509 1.00 0.00 H new ATOM 0 HA ARG A 37 -12.918 -10.735 -9.857 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -15.071 -11.550 -8.756 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -15.938 -10.900 -10.132 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -15.074 -12.535 -11.614 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -13.735 -12.932 -10.557 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -15.671 -13.597 -8.825 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -16.662 -13.705 -10.266 1.00 0.00 H new ATOM 0 HE ARG A 37 -14.022 -15.008 -10.583 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -17.434 -15.590 -9.467 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -17.294 -17.338 -9.679 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -13.807 -17.224 -10.550 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -15.199 -18.281 -10.291 1.00 0.00 H new ATOM 567 N SER A 38 -14.799 -8.763 -11.681 1.00 0.00 N ATOM 568 CA SER A 38 -15.065 -8.118 -12.929 1.00 0.00 C ATOM 569 C SER A 38 -13.849 -7.441 -13.462 1.00 0.00 C ATOM 570 O SER A 38 -13.628 -7.374 -14.670 1.00 0.00 O ATOM 571 CB SER A 38 -16.203 -7.103 -12.728 1.00 0.00 C ATOM 572 OG SER A 38 -16.618 -6.381 -13.878 1.00 0.00 O ATOM 0 H SER A 38 -15.383 -8.375 -10.940 1.00 0.00 H new ATOM 0 HA SER A 38 -15.362 -8.869 -13.661 1.00 0.00 H new ATOM 0 HB2 SER A 38 -17.067 -7.634 -12.328 1.00 0.00 H new ATOM 0 HB3 SER A 38 -15.890 -6.386 -11.969 1.00 0.00 H new ATOM 0 HG SER A 38 -17.344 -5.769 -13.636 1.00 0.00 H new ATOM 578 N LEU A 39 -12.959 -6.996 -12.557 1.00 0.00 N ATOM 579 CA LEU A 39 -11.739 -6.319 -12.870 1.00 0.00 C ATOM 580 C LEU A 39 -10.658 -7.328 -13.050 1.00 0.00 C ATOM 581 O LEU A 39 -9.686 -7.060 -13.755 1.00 0.00 O ATOM 582 CB LEU A 39 -11.344 -5.371 -11.725 1.00 0.00 C ATOM 583 CG LEU A 39 -12.109 -4.044 -11.868 1.00 0.00 C ATOM 584 CD1 LEU A 39 -11.854 -3.197 -10.609 1.00 0.00 C ATOM 585 CD2 LEU A 39 -11.706 -3.288 -13.145 1.00 0.00 C ATOM 0 H LEU A 39 -13.098 -7.115 -11.554 1.00 0.00 H new ATOM 0 HA LEU A 39 -11.879 -5.740 -13.783 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -11.571 -5.831 -10.763 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -10.270 -5.187 -11.745 1.00 0.00 H new ATOM 0 HG LEU A 39 -13.175 -4.251 -11.961 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -12.389 -2.251 -10.692 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -12.206 -3.737 -9.730 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -10.786 -3.002 -10.512 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -12.268 -2.357 -13.209 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -10.639 -3.066 -13.115 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -11.924 -3.904 -14.017 1.00 0.00 H new ATOM 597 N GLY A 40 -10.692 -8.475 -12.349 1.00 0.00 N ATOM 598 CA GLY A 40 -9.717 -9.521 -12.343 1.00 0.00 C ATOM 599 C GLY A 40 -8.765 -9.487 -11.197 1.00 0.00 C ATOM 600 O GLY A 40 -7.552 -9.618 -11.350 1.00 0.00 O ATOM 0 H GLY A 40 -11.475 -8.688 -11.730 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -10.235 -10.480 -12.337 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -9.147 -9.472 -13.271 1.00 0.00 H new ATOM 604 N GLN A 41 -9.253 -9.327 -9.954 1.00 0.00 N ATOM 605 CA GLN A 41 -8.477 -9.235 -8.757 1.00 0.00 C ATOM 606 C GLN A 41 -8.689 -10.406 -7.860 1.00 0.00 C ATOM 607 O GLN A 41 -9.143 -11.424 -8.380 1.00 0.00 O ATOM 608 CB GLN A 41 -8.766 -7.911 -8.030 1.00 0.00 C ATOM 609 CG GLN A 41 -8.485 -6.695 -8.916 1.00 0.00 C ATOM 610 CD GLN A 41 -7.032 -6.608 -9.362 1.00 0.00 C ATOM 611 OE1 GLN A 41 -6.720 -6.409 -10.535 1.00 0.00 O ATOM 612 NE2 GLN A 41 -6.047 -6.835 -8.452 1.00 0.00 N ATOM 0 H GLN A 41 -10.255 -9.258 -9.775 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.425 -9.248 -9.043 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.808 -7.893 -7.710 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -8.155 -7.852 -7.129 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.128 -6.737 -9.795 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.748 -5.788 -8.372 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -6.285 -7.002 -7.474 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -5.071 -6.838 -8.747 1.00 0.00 H new ATOM 621 N ASN A 42 -8.377 -10.324 -6.554 1.00 0.00 N ATOM 622 CA ASN A 42 -8.308 -11.480 -5.714 1.00 0.00 C ATOM 623 C ASN A 42 -9.455 -11.793 -4.816 1.00 0.00 C ATOM 624 O ASN A 42 -9.920 -12.906 -5.055 1.00 0.00 O ATOM 625 CB ASN A 42 -7.001 -11.649 -4.921 1.00 0.00 C ATOM 626 CG ASN A 42 -5.798 -11.694 -5.852 1.00 0.00 C ATOM 627 OD1 ASN A 42 -5.273 -12.789 -6.047 1.00 0.00 O ATOM 628 ND2 ASN A 42 -5.323 -10.488 -6.265 1.00 0.00 N ATOM 0 H ASN A 42 -8.170 -9.447 -6.076 1.00 0.00 H new ATOM 0 HA ASN A 42 -8.356 -12.217 -6.516 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -6.890 -10.824 -4.217 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -7.044 -12.566 -4.333 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -4.450 -10.436 -6.791 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -5.839 -9.635 -6.049 1.00 0.00 H new ATOM 635 N PRO A 43 -9.930 -11.060 -3.854 1.00 0.00 N ATOM 636 CA PRO A 43 -10.555 -11.503 -2.641 1.00 0.00 C ATOM 637 C PRO A 43 -11.782 -12.322 -2.849 1.00 0.00 C ATOM 638 O PRO A 43 -12.642 -12.160 -3.713 1.00 0.00 O ATOM 639 CB PRO A 43 -10.886 -10.232 -1.863 1.00 0.00 C ATOM 640 CG PRO A 43 -9.746 -9.284 -2.268 1.00 0.00 C ATOM 641 CD PRO A 43 -9.561 -9.657 -3.748 1.00 0.00 C ATOM 0 HA PRO A 43 -9.876 -12.168 -2.107 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -11.862 -9.832 -2.137 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -10.904 -10.408 -0.787 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -10.016 -8.236 -2.138 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -8.842 -9.455 -1.684 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -10.190 -9.038 -4.388 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -8.530 -9.499 -4.065 1.00 0.00 H new ATOM 649 N THR A 44 -11.989 -13.243 -1.891 1.00 0.00 N ATOM 650 CA THR A 44 -13.210 -13.966 -1.715 1.00 0.00 C ATOM 651 C THR A 44 -14.145 -13.210 -0.835 1.00 0.00 C ATOM 652 O THR A 44 -13.783 -12.229 -0.187 1.00 0.00 O ATOM 653 CB THR A 44 -13.139 -15.388 -1.243 1.00 0.00 C ATOM 654 OG1 THR A 44 -12.393 -15.484 -0.039 1.00 0.00 O ATOM 655 CG2 THR A 44 -12.530 -16.329 -2.297 1.00 0.00 C ATOM 0 H THR A 44 -11.274 -13.495 -1.209 1.00 0.00 H new ATOM 0 HA THR A 44 -13.569 -14.051 -2.741 1.00 0.00 H new ATOM 0 HB THR A 44 -14.167 -15.704 -1.065 1.00 0.00 H new ATOM 0 HG1 THR A 44 -11.437 -15.401 -0.239 1.00 0.00 H new ATOM 0 HG21 THR A 44 -12.502 -17.345 -1.904 1.00 0.00 H new ATOM 0 HG22 THR A 44 -13.139 -16.306 -3.201 1.00 0.00 H new ATOM 0 HG23 THR A 44 -11.517 -16.003 -2.534 1.00 0.00 H new ATOM 663 N GLU A 45 -15.415 -13.645 -0.756 1.00 0.00 N ATOM 664 CA GLU A 45 -16.440 -13.032 0.031 1.00 0.00 C ATOM 665 C GLU A 45 -16.235 -13.202 1.497 1.00 0.00 C ATOM 666 O GLU A 45 -16.612 -12.355 2.305 1.00 0.00 O ATOM 667 CB GLU A 45 -17.851 -13.446 -0.421 1.00 0.00 C ATOM 668 CG GLU A 45 -18.270 -12.866 -1.773 1.00 0.00 C ATOM 669 CD GLU A 45 -18.517 -13.975 -2.786 1.00 0.00 C ATOM 670 OE1 GLU A 45 -19.416 -14.820 -2.531 1.00 0.00 O ATOM 671 OE2 GLU A 45 -17.892 -14.009 -3.879 1.00 0.00 O ATOM 0 H GLU A 45 -15.743 -14.465 -1.266 1.00 0.00 H new ATOM 0 HA GLU A 45 -16.357 -11.961 -0.154 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -17.899 -14.534 -0.474 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -18.570 -13.131 0.336 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -19.174 -12.269 -1.653 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -17.493 -12.197 -2.143 1.00 0.00 H new ATOM 678 N ALA A 46 -15.568 -14.281 1.944 1.00 0.00 N ATOM 679 CA ALA A 46 -15.113 -14.422 3.292 1.00 0.00 C ATOM 680 C ALA A 46 -13.903 -13.620 3.628 1.00 0.00 C ATOM 681 O ALA A 46 -13.760 -13.148 4.755 1.00 0.00 O ATOM 682 CB ALA A 46 -14.898 -15.915 3.591 1.00 0.00 C ATOM 0 H ALA A 46 -15.339 -15.078 1.351 1.00 0.00 H new ATOM 0 HA ALA A 46 -15.892 -14.011 3.935 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -14.551 -16.034 4.617 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -15.838 -16.451 3.462 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -14.153 -16.320 2.906 1.00 0.00 H new ATOM 688 N GLU A 47 -12.971 -13.449 2.673 1.00 0.00 N ATOM 689 CA GLU A 47 -11.968 -12.447 2.863 1.00 0.00 C ATOM 690 C GLU A 47 -12.466 -11.043 2.859 1.00 0.00 C ATOM 691 O GLU A 47 -12.101 -10.310 3.776 1.00 0.00 O ATOM 692 CB GLU A 47 -10.820 -12.533 1.843 1.00 0.00 C ATOM 693 CG GLU A 47 -10.101 -13.883 1.817 1.00 0.00 C ATOM 694 CD GLU A 47 -9.290 -14.189 0.566 1.00 0.00 C ATOM 695 OE1 GLU A 47 -8.118 -13.728 0.515 1.00 0.00 O ATOM 696 OE2 GLU A 47 -9.911 -14.785 -0.354 1.00 0.00 O ATOM 0 H GLU A 47 -12.910 -13.979 1.804 1.00 0.00 H new ATOM 0 HA GLU A 47 -11.606 -12.680 3.864 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -11.217 -12.327 0.849 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.093 -11.752 2.065 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.434 -13.933 2.678 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.845 -14.670 1.944 1.00 0.00 H new ATOM 703 N LEU A 48 -13.408 -10.625 1.994 1.00 0.00 N ATOM 704 CA LEU A 48 -14.120 -9.392 2.133 1.00 0.00 C ATOM 705 C LEU A 48 -14.766 -9.180 3.459 1.00 0.00 C ATOM 706 O LEU A 48 -14.747 -8.075 3.998 1.00 0.00 O ATOM 707 CB LEU A 48 -15.238 -9.361 1.077 1.00 0.00 C ATOM 708 CG LEU A 48 -14.829 -8.803 -0.296 1.00 0.00 C ATOM 709 CD1 LEU A 48 -16.102 -8.616 -1.140 1.00 0.00 C ATOM 710 CD2 LEU A 48 -14.059 -7.472 -0.315 1.00 0.00 C ATOM 0 H LEU A 48 -13.683 -11.162 1.172 1.00 0.00 H new ATOM 0 HA LEU A 48 -13.375 -8.605 2.014 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -15.615 -10.375 0.941 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -16.063 -8.763 1.463 1.00 0.00 H new ATOM 0 HG LEU A 48 -14.129 -9.540 -0.689 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -15.834 -8.220 -2.120 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -16.603 -9.577 -1.261 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -16.772 -7.918 -0.638 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -13.835 -7.196 -1.345 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -14.667 -6.693 0.145 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -13.129 -7.582 0.242 1.00 0.00 H new ATOM 722 N GLN A 49 -15.492 -10.182 3.986 1.00 0.00 N ATOM 723 CA GLN A 49 -16.274 -10.037 5.175 1.00 0.00 C ATOM 724 C GLN A 49 -15.512 -9.707 6.412 1.00 0.00 C ATOM 725 O GLN A 49 -16.041 -8.957 7.231 1.00 0.00 O ATOM 726 CB GLN A 49 -17.078 -11.325 5.421 1.00 0.00 C ATOM 727 CG GLN A 49 -18.201 -11.196 6.452 1.00 0.00 C ATOM 728 CD GLN A 49 -19.187 -12.355 6.415 1.00 0.00 C ATOM 729 OE1 GLN A 49 -18.873 -13.301 5.694 1.00 0.00 O ATOM 730 NE2 GLN A 49 -20.284 -12.289 7.216 1.00 0.00 N ATOM 0 H GLN A 49 -15.537 -11.115 3.576 1.00 0.00 H new ATOM 0 HA GLN A 49 -16.916 -9.177 4.984 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -17.509 -11.653 4.475 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -16.393 -12.107 5.748 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -17.764 -11.131 7.449 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -18.739 -10.264 6.278 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -20.456 -11.455 7.778 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -20.935 -13.073 7.255 1.00 0.00 H new ATOM 739 N ASP A 50 -14.231 -10.117 6.408 1.00 0.00 N ATOM 740 CA ASP A 50 -13.366 -9.866 7.518 1.00 0.00 C ATOM 741 C ASP A 50 -12.976 -8.428 7.511 1.00 0.00 C ATOM 742 O ASP A 50 -12.960 -7.753 8.539 1.00 0.00 O ATOM 743 CB ASP A 50 -12.184 -10.803 7.216 1.00 0.00 C ATOM 744 CG ASP A 50 -10.975 -10.653 8.129 1.00 0.00 C ATOM 745 OD1 ASP A 50 -11.092 -11.203 9.256 1.00 0.00 O ATOM 746 OD2 ASP A 50 -9.868 -10.178 7.760 1.00 0.00 O ATOM 0 H ASP A 50 -13.795 -10.622 5.637 1.00 0.00 H new ATOM 0 HA ASP A 50 -13.795 -10.048 8.504 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -12.536 -11.833 7.275 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -11.863 -10.634 6.188 1.00 0.00 H new ATOM 751 N MET A 51 -12.621 -7.942 6.308 1.00 0.00 N ATOM 752 CA MET A 51 -12.412 -6.551 6.054 1.00 0.00 C ATOM 753 C MET A 51 -13.544 -5.662 6.441 1.00 0.00 C ATOM 754 O MET A 51 -13.510 -4.586 7.034 1.00 0.00 O ATOM 755 CB MET A 51 -12.046 -6.318 4.578 1.00 0.00 C ATOM 756 CG MET A 51 -10.783 -6.969 4.013 1.00 0.00 C ATOM 757 SD MET A 51 -10.583 -6.882 2.208 1.00 0.00 S ATOM 758 CE MET A 51 -9.587 -8.373 1.919 1.00 0.00 C ATOM 0 H MET A 51 -12.475 -8.533 5.490 1.00 0.00 H new ATOM 0 HA MET A 51 -11.582 -6.271 6.703 1.00 0.00 H new ATOM 0 HB2 MET A 51 -12.888 -6.655 3.974 1.00 0.00 H new ATOM 0 HB3 MET A 51 -11.956 -5.242 4.428 1.00 0.00 H new ATOM 0 HG2 MET A 51 -9.916 -6.499 4.478 1.00 0.00 H new ATOM 0 HG3 MET A 51 -10.774 -8.018 4.310 1.00 0.00 H new ATOM 0 HE1 MET A 51 -9.375 -8.468 0.854 1.00 0.00 H new ATOM 0 HE2 MET A 51 -8.650 -8.297 2.470 1.00 0.00 H new ATOM 0 HE3 MET A 51 -10.138 -9.250 2.259 1.00 0.00 H new ATOM 768 N ILE A 52 -14.753 -6.108 6.054 1.00 0.00 N ATOM 769 CA ILE A 52 -15.998 -5.510 6.424 1.00 0.00 C ATOM 770 C ILE A 52 -16.109 -5.229 7.883 1.00 0.00 C ATOM 771 O ILE A 52 -16.056 -4.075 8.306 1.00 0.00 O ATOM 772 CB ILE A 52 -17.099 -6.306 5.788 1.00 0.00 C ATOM 773 CG1 ILE A 52 -17.136 -5.951 4.291 1.00 0.00 C ATOM 774 CG2 ILE A 52 -18.461 -5.991 6.428 1.00 0.00 C ATOM 775 CD1 ILE A 52 -18.097 -6.738 3.401 1.00 0.00 C ATOM 0 H ILE A 52 -14.867 -6.925 5.454 1.00 0.00 H new ATOM 0 HA ILE A 52 -16.081 -4.497 6.029 1.00 0.00 H new ATOM 0 HB ILE A 52 -16.905 -7.369 5.934 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -17.386 -4.894 4.203 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -16.130 -6.075 3.891 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -19.236 -6.585 5.944 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -18.429 -6.233 7.490 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -18.685 -4.931 6.304 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -18.016 -6.382 2.374 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -17.843 -7.797 3.439 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -19.118 -6.597 3.755 1.00 0.00 H new ATOM 787 N ASN A 53 -16.058 -6.298 8.699 1.00 0.00 N ATOM 788 CA ASN A 53 -16.176 -6.343 10.124 1.00 0.00 C ATOM 789 C ASN A 53 -15.228 -5.373 10.741 1.00 0.00 C ATOM 790 O ASN A 53 -15.613 -4.654 11.661 1.00 0.00 O ATOM 791 CB ASN A 53 -15.920 -7.785 10.592 1.00 0.00 C ATOM 792 CG ASN A 53 -17.140 -8.681 10.430 1.00 0.00 C ATOM 793 OD1 ASN A 53 -18.265 -8.268 10.156 1.00 0.00 O ATOM 794 ND2 ASN A 53 -16.826 -9.994 10.600 1.00 0.00 N ATOM 0 H ASN A 53 -15.919 -7.232 8.314 1.00 0.00 H new ATOM 0 HA ASN A 53 -17.179 -6.054 10.438 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -15.089 -8.204 10.025 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -15.619 -7.775 11.639 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -17.548 -10.708 10.501 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -15.869 -10.264 10.827 1.00 0.00 H new ATOM 801 N GLU A 54 -14.030 -5.163 10.165 1.00 0.00 N ATOM 802 CA GLU A 54 -12.955 -4.407 10.728 1.00 0.00 C ATOM 803 C GLU A 54 -13.231 -2.944 10.795 1.00 0.00 C ATOM 804 O GLU A 54 -12.888 -2.179 11.694 1.00 0.00 O ATOM 805 CB GLU A 54 -11.707 -4.688 9.875 1.00 0.00 C ATOM 806 CG GLU A 54 -10.382 -4.667 10.641 1.00 0.00 C ATOM 807 CD GLU A 54 -9.282 -4.963 9.632 1.00 0.00 C ATOM 808 OE1 GLU A 54 -8.945 -6.154 9.394 1.00 0.00 O ATOM 809 OE2 GLU A 54 -8.734 -3.980 9.066 1.00 0.00 O ATOM 0 H GLU A 54 -13.799 -5.546 9.248 1.00 0.00 H new ATOM 0 HA GLU A 54 -12.811 -4.716 11.763 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -11.821 -5.664 9.402 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -11.659 -3.950 9.075 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -10.223 -3.697 11.111 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.385 -5.411 11.438 1.00 0.00 H new ATOM 816 N VAL A 55 -14.033 -2.534 9.796 1.00 0.00 N ATOM 817 CA VAL A 55 -14.393 -1.172 9.550 1.00 0.00 C ATOM 818 C VAL A 55 -15.861 -0.991 9.733 1.00 0.00 C ATOM 819 O VAL A 55 -16.409 0.108 9.665 1.00 0.00 O ATOM 820 CB VAL A 55 -13.908 -0.662 8.225 1.00 0.00 C ATOM 821 CG1 VAL A 55 -14.790 -1.306 7.143 1.00 0.00 C ATOM 822 CG2 VAL A 55 -13.867 0.876 8.234 1.00 0.00 C ATOM 0 H VAL A 55 -14.450 -3.183 9.129 1.00 0.00 H new ATOM 0 HA VAL A 55 -13.879 -0.556 10.288 1.00 0.00 H new ATOM 0 HB VAL A 55 -12.879 -0.947 8.006 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -14.470 -0.961 6.160 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -14.696 -2.391 7.195 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -15.830 -1.024 7.306 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -13.514 1.236 7.268 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -14.867 1.266 8.423 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -13.191 1.217 9.018 1.00 0.00 H new ATOM 832 N ASP A 56 -16.504 -2.011 10.329 1.00 0.00 N ATOM 833 CA ASP A 56 -17.884 -2.033 10.702 1.00 0.00 C ATOM 834 C ASP A 56 -18.104 -1.406 12.036 1.00 0.00 C ATOM 835 O ASP A 56 -18.090 -2.060 13.078 1.00 0.00 O ATOM 836 CB ASP A 56 -18.522 -3.417 10.499 1.00 0.00 C ATOM 837 CG ASP A 56 -20.044 -3.414 10.475 1.00 0.00 C ATOM 838 OD1 ASP A 56 -20.671 -2.397 10.072 1.00 0.00 O ATOM 839 OD2 ASP A 56 -20.604 -4.511 10.738 1.00 0.00 O ATOM 0 H ASP A 56 -16.025 -2.880 10.566 1.00 0.00 H new ATOM 0 HA ASP A 56 -18.437 -1.396 10.012 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -18.157 -3.837 9.562 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -18.185 -4.079 11.297 1.00 0.00 H new ATOM 844 N ALA A 57 -18.403 -0.095 12.018 1.00 0.00 N ATOM 845 CA ALA A 57 -18.577 0.683 13.205 1.00 0.00 C ATOM 846 C ALA A 57 -19.756 0.245 14.004 1.00 0.00 C ATOM 847 O ALA A 57 -19.693 0.024 15.212 1.00 0.00 O ATOM 848 CB ALA A 57 -18.611 2.184 12.870 1.00 0.00 C ATOM 0 H ALA A 57 -18.527 0.438 11.157 1.00 0.00 H new ATOM 0 HA ALA A 57 -17.712 0.511 13.845 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -18.744 2.758 13.787 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -17.674 2.472 12.394 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -19.440 2.387 12.191 1.00 0.00 H new ATOM 854 N ASP A 58 -20.950 0.142 13.394 1.00 0.00 N ATOM 855 CA ASP A 58 -22.224 -0.197 13.948 1.00 0.00 C ATOM 856 C ASP A 58 -22.348 -1.635 14.320 1.00 0.00 C ATOM 857 O ASP A 58 -23.044 -2.020 15.258 1.00 0.00 O ATOM 858 CB ASP A 58 -23.349 0.325 13.038 1.00 0.00 C ATOM 859 CG ASP A 58 -23.232 -0.207 11.617 1.00 0.00 C ATOM 860 OD1 ASP A 58 -23.031 -1.430 11.391 1.00 0.00 O ATOM 861 OD2 ASP A 58 -23.331 0.638 10.688 1.00 0.00 O ATOM 0 H ASP A 58 -21.027 0.318 12.392 1.00 0.00 H new ATOM 0 HA ASP A 58 -22.324 0.313 14.906 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -24.314 0.036 13.454 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -23.323 1.415 13.020 1.00 0.00 H new ATOM 866 N GLY A 59 -21.624 -2.466 13.549 1.00 0.00 N ATOM 867 CA GLY A 59 -21.703 -3.893 13.590 1.00 0.00 C ATOM 868 C GLY A 59 -22.922 -4.585 13.084 1.00 0.00 C ATOM 869 O GLY A 59 -23.265 -5.719 13.413 1.00 0.00 O ATOM 0 H GLY A 59 -20.950 -2.125 12.863 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -20.853 -4.281 13.029 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -21.565 -4.196 14.628 1.00 0.00 H new ATOM 873 N ASN A 60 -23.583 -3.927 12.114 1.00 0.00 N ATOM 874 CA ASN A 60 -24.731 -4.517 11.499 1.00 0.00 C ATOM 875 C ASN A 60 -24.384 -5.547 10.480 1.00 0.00 C ATOM 876 O ASN A 60 -25.182 -6.385 10.064 1.00 0.00 O ATOM 877 CB ASN A 60 -25.711 -3.531 10.842 1.00 0.00 C ATOM 878 CG ASN A 60 -25.235 -2.901 9.541 1.00 0.00 C ATOM 879 OD1 ASN A 60 -24.067 -2.791 9.173 1.00 0.00 O ATOM 880 ND2 ASN A 60 -26.219 -2.505 8.689 1.00 0.00 N ATOM 0 H ASN A 60 -23.329 -3.004 11.761 1.00 0.00 H new ATOM 0 HA ASN A 60 -25.231 -4.972 12.354 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -26.649 -4.052 10.651 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -25.928 -2.734 11.553 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -25.979 -2.129 7.772 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -27.197 -2.585 8.967 1.00 0.00 H new ATOM 887 N GLY A 61 -23.102 -5.613 10.079 1.00 0.00 N ATOM 888 CA GLY A 61 -22.518 -6.604 9.229 1.00 0.00 C ATOM 889 C GLY A 61 -22.149 -6.153 7.858 1.00 0.00 C ATOM 890 O GLY A 61 -21.407 -6.818 7.138 1.00 0.00 O ATOM 0 H GLY A 61 -22.419 -4.915 10.374 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -21.623 -6.990 9.716 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -23.217 -7.436 9.141 1.00 0.00 H new ATOM 894 N THR A 62 -22.662 -4.980 7.445 1.00 0.00 N ATOM 895 CA THR A 62 -22.474 -4.476 6.120 1.00 0.00 C ATOM 896 C THR A 62 -21.904 -3.103 6.019 1.00 0.00 C ATOM 897 O THR A 62 -21.734 -2.384 7.002 1.00 0.00 O ATOM 898 CB THR A 62 -23.700 -4.729 5.294 1.00 0.00 C ATOM 899 OG1 THR A 62 -24.930 -4.513 5.971 1.00 0.00 O ATOM 900 CG2 THR A 62 -23.735 -6.152 4.711 1.00 0.00 C ATOM 0 H THR A 62 -23.218 -4.370 8.043 1.00 0.00 H new ATOM 0 HA THR A 62 -21.661 -5.051 5.678 1.00 0.00 H new ATOM 0 HB THR A 62 -23.613 -3.988 4.499 1.00 0.00 H new ATOM 0 HG1 THR A 62 -25.675 -4.698 5.362 1.00 0.00 H new ATOM 0 HG21 THR A 62 -24.643 -6.282 4.122 1.00 0.00 H new ATOM 0 HG22 THR A 62 -22.864 -6.306 4.074 1.00 0.00 H new ATOM 0 HG23 THR A 62 -23.723 -6.878 5.524 1.00 0.00 H new ATOM 908 N ILE A 63 -21.379 -2.740 4.835 1.00 0.00 N ATOM 909 CA ILE A 63 -20.678 -1.507 4.650 1.00 0.00 C ATOM 910 C ILE A 63 -21.680 -0.474 4.267 1.00 0.00 C ATOM 911 O ILE A 63 -22.272 -0.506 3.189 1.00 0.00 O ATOM 912 CB ILE A 63 -19.618 -1.527 3.589 1.00 0.00 C ATOM 913 CG1 ILE A 63 -19.010 -2.921 3.362 1.00 0.00 C ATOM 914 CG2 ILE A 63 -18.546 -0.484 3.946 1.00 0.00 C ATOM 915 CD1 ILE A 63 -18.150 -2.889 2.099 1.00 0.00 C ATOM 0 H ILE A 63 -21.442 -3.312 3.992 1.00 0.00 H new ATOM 0 HA ILE A 63 -20.165 -1.303 5.590 1.00 0.00 H new ATOM 0 HB ILE A 63 -20.082 -1.269 2.637 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -18.406 -3.213 4.221 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -19.801 -3.665 3.261 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -17.768 -0.487 3.183 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -19.002 0.505 3.995 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -18.107 -0.730 4.913 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -17.715 -3.874 1.930 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -18.769 -2.614 1.245 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -17.353 -2.156 2.220 1.00 0.00 H new ATOM 927 N ASP A 64 -21.915 0.416 5.248 1.00 0.00 N ATOM 928 CA ASP A 64 -22.641 1.631 5.049 1.00 0.00 C ATOM 929 C ASP A 64 -21.720 2.667 4.504 1.00 0.00 C ATOM 930 O ASP A 64 -20.501 2.519 4.585 1.00 0.00 O ATOM 931 CB ASP A 64 -23.419 2.199 6.249 1.00 0.00 C ATOM 932 CG ASP A 64 -24.281 1.124 6.895 1.00 0.00 C ATOM 933 OD1 ASP A 64 -23.733 0.375 7.747 1.00 0.00 O ATOM 934 OD2 ASP A 64 -25.518 1.231 6.686 1.00 0.00 O ATOM 0 H ASP A 64 -21.591 0.286 6.206 1.00 0.00 H new ATOM 0 HA ASP A 64 -23.429 1.359 4.347 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -22.721 2.601 6.983 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -24.048 3.027 5.921 1.00 0.00 H new ATOM 939 N PHE A 65 -22.392 3.716 3.998 1.00 0.00 N ATOM 940 CA PHE A 65 -21.713 4.782 3.330 1.00 0.00 C ATOM 941 C PHE A 65 -20.748 5.513 4.199 1.00 0.00 C ATOM 942 O PHE A 65 -19.595 5.638 3.789 1.00 0.00 O ATOM 943 CB PHE A 65 -22.800 5.671 2.702 1.00 0.00 C ATOM 944 CG PHE A 65 -22.291 6.912 2.053 1.00 0.00 C ATOM 945 CD1 PHE A 65 -21.542 6.837 0.902 1.00 0.00 C ATOM 946 CD2 PHE A 65 -22.431 8.155 2.624 1.00 0.00 C ATOM 947 CE1 PHE A 65 -20.903 7.936 0.381 1.00 0.00 C ATOM 948 CE2 PHE A 65 -21.896 9.298 2.079 1.00 0.00 C ATOM 949 CZ PHE A 65 -21.179 9.174 0.912 1.00 0.00 C ATOM 0 H PHE A 65 -23.405 3.826 4.051 1.00 0.00 H new ATOM 0 HA PHE A 65 -21.063 4.389 2.548 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -23.345 5.087 1.960 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -23.515 5.949 3.476 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -21.454 5.888 0.394 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -22.988 8.237 3.545 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -20.198 7.830 -0.430 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -22.034 10.260 2.551 1.00 0.00 H new ATOM 0 HZ PHE A 65 -20.828 10.061 0.406 1.00 0.00 H new ATOM 959 N PRO A 66 -21.004 6.078 5.341 1.00 0.00 N ATOM 960 CA PRO A 66 -20.016 6.735 6.146 1.00 0.00 C ATOM 961 C PRO A 66 -18.923 5.901 6.721 1.00 0.00 C ATOM 962 O PRO A 66 -17.876 6.334 7.200 1.00 0.00 O ATOM 963 CB PRO A 66 -20.816 7.474 7.216 1.00 0.00 C ATOM 964 CG PRO A 66 -22.116 6.668 7.372 1.00 0.00 C ATOM 965 CD PRO A 66 -22.333 6.239 5.912 1.00 0.00 C ATOM 0 HA PRO A 66 -19.428 7.389 5.502 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -20.267 7.522 8.156 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -21.023 8.501 6.915 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -22.002 5.818 8.045 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -22.938 7.271 7.757 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -22.896 5.307 5.858 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -22.905 6.989 5.365 1.00 0.00 H new ATOM 973 N GLU A 67 -19.065 4.566 6.634 1.00 0.00 N ATOM 974 CA GLU A 67 -18.046 3.588 6.858 1.00 0.00 C ATOM 975 C GLU A 67 -17.227 3.374 5.632 1.00 0.00 C ATOM 976 O GLU A 67 -16.058 3.005 5.731 1.00 0.00 O ATOM 977 CB GLU A 67 -18.554 2.217 7.338 1.00 0.00 C ATOM 978 CG GLU A 67 -19.568 2.315 8.479 1.00 0.00 C ATOM 979 CD GLU A 67 -20.173 0.925 8.610 1.00 0.00 C ATOM 980 OE1 GLU A 67 -20.714 0.279 7.673 1.00 0.00 O ATOM 981 OE2 GLU A 67 -20.320 0.494 9.785 1.00 0.00 O ATOM 0 H GLU A 67 -19.959 4.140 6.389 1.00 0.00 H new ATOM 0 HA GLU A 67 -17.450 4.012 7.666 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -19.011 1.692 6.499 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -17.705 1.617 7.666 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -19.085 2.621 9.407 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -20.335 3.057 8.259 1.00 0.00 H new ATOM 988 N PHE A 68 -17.770 3.680 4.440 1.00 0.00 N ATOM 989 CA PHE A 68 -17.002 3.601 3.237 1.00 0.00 C ATOM 990 C PHE A 68 -16.149 4.815 3.101 1.00 0.00 C ATOM 991 O PHE A 68 -15.038 4.709 2.584 1.00 0.00 O ATOM 992 CB PHE A 68 -17.992 3.335 2.090 1.00 0.00 C ATOM 993 CG PHE A 68 -17.381 2.791 0.844 1.00 0.00 C ATOM 994 CD1 PHE A 68 -16.958 1.498 0.645 1.00 0.00 C ATOM 995 CD2 PHE A 68 -17.213 3.616 -0.243 1.00 0.00 C ATOM 996 CE1 PHE A 68 -16.361 1.056 -0.512 1.00 0.00 C ATOM 997 CE2 PHE A 68 -16.616 3.256 -1.428 1.00 0.00 C ATOM 998 CZ PHE A 68 -16.172 1.959 -1.532 1.00 0.00 C ATOM 0 H PHE A 68 -18.736 3.981 4.310 1.00 0.00 H new ATOM 0 HA PHE A 68 -16.285 2.780 3.231 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -18.751 2.635 2.440 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -18.504 4.266 1.849 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -17.103 0.787 1.445 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -17.580 4.628 -0.159 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -16.049 0.027 -0.617 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -16.501 3.959 -2.239 1.00 0.00 H new ATOM 0 HZ PHE A 68 -15.665 1.643 -2.432 1.00 0.00 H new ATOM 1008 N LEU A 69 -16.572 6.001 3.573 1.00 0.00 N ATOM 1009 CA LEU A 69 -15.772 7.178 3.711 1.00 0.00 C ATOM 1010 C LEU A 69 -14.714 7.008 4.746 1.00 0.00 C ATOM 1011 O LEU A 69 -13.656 7.629 4.659 1.00 0.00 O ATOM 1012 CB LEU A 69 -16.654 8.401 4.014 1.00 0.00 C ATOM 1013 CG LEU A 69 -17.722 8.874 3.013 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -18.416 10.152 3.514 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -17.188 9.087 1.587 1.00 0.00 C ATOM 0 H LEU A 69 -17.535 6.146 3.878 1.00 0.00 H new ATOM 0 HA LEU A 69 -15.267 7.348 2.760 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -17.165 8.201 4.956 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -15.984 9.243 4.188 1.00 0.00 H new ATOM 0 HG LEU A 69 -18.446 8.062 2.953 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -19.167 10.466 2.789 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -18.897 9.953 4.472 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -17.677 10.943 3.637 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -18.000 9.420 0.940 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -16.403 9.843 1.602 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -16.782 8.150 1.207 1.00 0.00 H new ATOM 1027 N THR A 70 -14.916 6.157 5.768 1.00 0.00 N ATOM 1028 CA THR A 70 -13.950 5.692 6.715 1.00 0.00 C ATOM 1029 C THR A 70 -13.042 4.737 6.020 1.00 0.00 C ATOM 1030 O THR A 70 -11.816 4.822 6.065 1.00 0.00 O ATOM 1031 CB THR A 70 -14.504 5.141 7.996 1.00 0.00 C ATOM 1032 OG1 THR A 70 -15.255 6.238 8.496 1.00 0.00 O ATOM 1033 CG2 THR A 70 -13.308 4.897 8.930 1.00 0.00 C ATOM 0 H THR A 70 -15.839 5.760 5.946 1.00 0.00 H new ATOM 0 HA THR A 70 -13.396 6.563 7.065 1.00 0.00 H new ATOM 0 HB THR A 70 -15.083 4.223 7.897 1.00 0.00 H new ATOM 0 HG1 THR A 70 -16.136 6.254 8.067 1.00 0.00 H new ATOM 0 HG21 THR A 70 -13.663 4.494 9.879 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.624 4.185 8.467 1.00 0.00 H new ATOM 0 HG23 THR A 70 -12.787 5.838 9.108 1.00 0.00 H new ATOM 1041 N MET A 71 -13.523 3.711 5.296 1.00 0.00 N ATOM 1042 CA MET A 71 -12.731 2.845 4.478 1.00 0.00 C ATOM 1043 C MET A 71 -11.723 3.453 3.566 1.00 0.00 C ATOM 1044 O MET A 71 -10.558 3.059 3.595 1.00 0.00 O ATOM 1045 CB MET A 71 -13.506 1.694 3.815 1.00 0.00 C ATOM 1046 CG MET A 71 -12.642 0.617 3.157 1.00 0.00 C ATOM 1047 SD MET A 71 -13.627 -0.330 1.957 1.00 0.00 S ATOM 1048 CE MET A 71 -14.332 -1.541 3.113 1.00 0.00 C ATOM 0 H MET A 71 -14.515 3.473 5.280 1.00 0.00 H new ATOM 0 HA MET A 71 -12.104 2.408 5.255 1.00 0.00 H new ATOM 0 HB2 MET A 71 -14.136 1.221 4.568 1.00 0.00 H new ATOM 0 HB3 MET A 71 -14.172 2.113 3.061 1.00 0.00 H new ATOM 0 HG2 MET A 71 -11.791 1.079 2.656 1.00 0.00 H new ATOM 0 HG3 MET A 71 -12.240 -0.052 3.918 1.00 0.00 H new ATOM 0 HE1 MET A 71 -14.966 -2.240 2.567 1.00 0.00 H new ATOM 0 HE2 MET A 71 -13.527 -2.088 3.603 1.00 0.00 H new ATOM 0 HE3 MET A 71 -14.928 -1.023 3.865 1.00 0.00 H new ATOM 1058 N MET A 72 -12.167 4.456 2.787 1.00 0.00 N ATOM 1059 CA MET A 72 -11.223 5.054 1.895 1.00 0.00 C ATOM 1060 C MET A 72 -10.278 5.951 2.617 1.00 0.00 C ATOM 1061 O MET A 72 -9.140 6.120 2.182 1.00 0.00 O ATOM 1062 CB MET A 72 -11.955 5.916 0.853 1.00 0.00 C ATOM 1063 CG MET A 72 -12.884 5.139 -0.082 1.00 0.00 C ATOM 1064 SD MET A 72 -11.944 3.944 -1.078 1.00 0.00 S ATOM 1065 CE MET A 72 -12.210 2.449 -0.081 1.00 0.00 C ATOM 0 H MET A 72 -13.114 4.834 2.770 1.00 0.00 H new ATOM 0 HA MET A 72 -10.674 4.239 1.423 1.00 0.00 H new ATOM 0 HB2 MET A 72 -12.539 6.675 1.375 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.214 6.442 0.251 1.00 0.00 H new ATOM 0 HG2 MET A 72 -13.641 4.616 0.502 1.00 0.00 H new ATOM 0 HG3 MET A 72 -13.410 5.832 -0.738 1.00 0.00 H new ATOM 0 HE1 MET A 72 -11.247 2.021 0.198 1.00 0.00 H new ATOM 0 HE2 MET A 72 -12.767 2.707 0.820 1.00 0.00 H new ATOM 0 HE3 MET A 72 -12.776 1.721 -0.661 1.00 0.00 H new ATOM 1075 N ALA A 73 -10.601 6.580 3.761 1.00 0.00 N ATOM 1076 CA ALA A 73 -9.727 7.565 4.320 1.00 0.00 C ATOM 1077 C ALA A 73 -8.611 6.919 5.066 1.00 0.00 C ATOM 1078 O ALA A 73 -7.471 7.372 5.156 1.00 0.00 O ATOM 1079 CB ALA A 73 -10.400 8.550 5.290 1.00 0.00 C ATOM 0 H ALA A 73 -11.455 6.411 4.293 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.377 8.128 3.454 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.659 9.258 5.662 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -11.190 9.091 4.769 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.829 8.000 6.128 1.00 0.00 H new ATOM 1234 N GLU A 83 3.084 9.265 -5.083 1.00 0.00 N ATOM 1235 CA GLU A 83 4.374 9.517 -5.648 1.00 0.00 C ATOM 1236 C GLU A 83 5.513 8.967 -4.861 1.00 0.00 C ATOM 1237 O GLU A 83 6.640 8.882 -5.346 1.00 0.00 O ATOM 1238 CB GLU A 83 4.740 11.002 -5.813 1.00 0.00 C ATOM 1239 CG GLU A 83 3.867 11.994 -6.584 1.00 0.00 C ATOM 1240 CD GLU A 83 3.442 11.433 -7.934 1.00 0.00 C ATOM 1241 OE1 GLU A 83 4.405 11.176 -8.705 1.00 0.00 O ATOM 1242 OE2 GLU A 83 2.235 11.416 -8.295 1.00 0.00 O ATOM 0 HA GLU A 83 4.255 9.021 -6.611 1.00 0.00 H new ATOM 0 HB2 GLU A 83 4.854 11.406 -4.807 1.00 0.00 H new ATOM 0 HB3 GLU A 83 5.725 11.028 -6.280 1.00 0.00 H new ATOM 0 HG2 GLU A 83 2.982 12.236 -5.995 1.00 0.00 H new ATOM 0 HG3 GLU A 83 4.416 12.924 -6.732 1.00 0.00 H new ATOM 1249 N GLU A 84 5.330 8.550 -3.595 1.00 0.00 N ATOM 1250 CA GLU A 84 6.420 7.992 -2.856 1.00 0.00 C ATOM 1251 C GLU A 84 6.589 6.548 -3.184 1.00 0.00 C ATOM 1252 O GLU A 84 7.688 6.008 -3.078 1.00 0.00 O ATOM 1253 CB GLU A 84 6.229 8.168 -1.340 1.00 0.00 C ATOM 1254 CG GLU A 84 7.530 8.217 -0.536 1.00 0.00 C ATOM 1255 CD GLU A 84 8.309 9.490 -0.831 1.00 0.00 C ATOM 1256 OE1 GLU A 84 7.729 10.582 -0.586 1.00 0.00 O ATOM 1257 OE2 GLU A 84 9.444 9.334 -1.355 1.00 0.00 O ATOM 0 H GLU A 84 4.445 8.597 -3.091 1.00 0.00 H new ATOM 0 HA GLU A 84 7.321 8.533 -3.146 1.00 0.00 H new ATOM 0 HB2 GLU A 84 5.672 9.088 -1.162 1.00 0.00 H new ATOM 0 HB3 GLU A 84 5.617 7.347 -0.966 1.00 0.00 H new ATOM 0 HG2 GLU A 84 7.305 8.163 0.529 1.00 0.00 H new ATOM 0 HG3 GLU A 84 8.143 7.348 -0.777 1.00 0.00 H new ATOM 1264 N ILE A 85 5.505 5.895 -3.640 1.00 0.00 N ATOM 1265 CA ILE A 85 5.589 4.627 -4.296 1.00 0.00 C ATOM 1266 C ILE A 85 6.155 4.752 -5.669 1.00 0.00 C ATOM 1267 O ILE A 85 6.981 3.948 -6.098 1.00 0.00 O ATOM 1268 CB ILE A 85 4.231 3.991 -4.281 1.00 0.00 C ATOM 1269 CG1 ILE A 85 3.577 3.696 -2.920 1.00 0.00 C ATOM 1270 CG2 ILE A 85 4.257 2.653 -5.038 1.00 0.00 C ATOM 1271 CD1 ILE A 85 2.559 4.710 -2.401 1.00 0.00 C ATOM 0 H ILE A 85 4.554 6.253 -3.552 1.00 0.00 H new ATOM 0 HA ILE A 85 6.282 3.979 -3.759 1.00 0.00 H new ATOM 0 HB ILE A 85 3.625 4.768 -4.747 1.00 0.00 H new ATOM 0 HG12 ILE A 85 3.085 2.726 -2.985 1.00 0.00 H new ATOM 0 HG13 ILE A 85 4.369 3.602 -2.177 1.00 0.00 H new ATOM 0 HG21 ILE A 85 3.264 2.204 -5.018 1.00 0.00 H new ATOM 0 HG22 ILE A 85 4.556 2.826 -6.072 1.00 0.00 H new ATOM 0 HG23 ILE A 85 4.969 1.979 -4.562 1.00 0.00 H new ATOM 0 HD11 ILE A 85 2.177 4.380 -1.435 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.039 5.682 -2.289 1.00 0.00 H new ATOM 0 HD13 ILE A 85 1.734 4.792 -3.109 1.00 0.00 H new ATOM 1283 N ARG A 86 5.651 5.710 -6.467 1.00 0.00 N ATOM 1284 CA ARG A 86 6.139 5.929 -7.793 1.00 0.00 C ATOM 1285 C ARG A 86 7.588 6.222 -7.981 1.00 0.00 C ATOM 1286 O ARG A 86 8.145 6.077 -9.068 1.00 0.00 O ATOM 1287 CB ARG A 86 5.318 7.053 -8.447 1.00 0.00 C ATOM 1288 CG ARG A 86 5.088 6.949 -9.956 1.00 0.00 C ATOM 1289 CD ARG A 86 4.767 8.242 -10.709 1.00 0.00 C ATOM 1290 NE ARG A 86 3.597 8.977 -10.150 1.00 0.00 N ATOM 1291 CZ ARG A 86 2.319 8.504 -10.069 1.00 0.00 C ATOM 1292 NH1 ARG A 86 1.889 7.405 -10.755 1.00 0.00 N ATOM 1293 NH2 ARG A 86 1.458 9.129 -9.214 1.00 0.00 N ATOM 0 H ARG A 86 4.897 6.339 -6.190 1.00 0.00 H new ATOM 0 HA ARG A 86 6.017 4.955 -8.266 1.00 0.00 H new ATOM 0 HB2 ARG A 86 4.345 7.093 -7.957 1.00 0.00 H new ATOM 0 HB3 ARG A 86 5.817 8.001 -8.244 1.00 0.00 H new ATOM 0 HG2 ARG A 86 5.980 6.511 -10.404 1.00 0.00 H new ATOM 0 HG3 ARG A 86 4.270 6.249 -10.125 1.00 0.00 H new ATOM 0 HD2 ARG A 86 5.641 8.893 -10.686 1.00 0.00 H new ATOM 0 HD3 ARG A 86 4.572 8.006 -11.755 1.00 0.00 H new ATOM 0 HE ARG A 86 3.767 9.918 -9.796 1.00 0.00 H new ATOM 0 HH11 ARG A 86 2.534 6.898 -11.362 1.00 0.00 H new ATOM 0 HH12 ARG A 86 0.923 7.091 -10.661 1.00 0.00 H new ATOM 0 HH21 ARG A 86 1.777 9.924 -8.660 1.00 0.00 H new ATOM 0 HH22 ARG A 86 0.496 8.801 -9.129 1.00 0.00 H new ATOM 1307 N GLU A 87 8.261 6.904 -7.037 1.00 0.00 N ATOM 1308 CA GLU A 87 9.687 7.000 -7.042 1.00 0.00 C ATOM 1309 C GLU A 87 10.327 5.766 -6.505 1.00 0.00 C ATOM 1310 O GLU A 87 11.357 5.337 -7.024 1.00 0.00 O ATOM 1311 CB GLU A 87 10.265 8.298 -6.453 1.00 0.00 C ATOM 1312 CG GLU A 87 11.792 8.376 -6.394 1.00 0.00 C ATOM 1313 CD GLU A 87 12.260 9.190 -5.196 1.00 0.00 C ATOM 1314 OE1 GLU A 87 12.063 10.434 -5.210 1.00 0.00 O ATOM 1315 OE2 GLU A 87 12.895 8.652 -4.250 1.00 0.00 O ATOM 0 H GLU A 87 7.812 7.393 -6.263 1.00 0.00 H new ATOM 0 HA GLU A 87 9.958 7.072 -8.095 1.00 0.00 H new ATOM 0 HB2 GLU A 87 9.899 9.138 -7.043 1.00 0.00 H new ATOM 0 HB3 GLU A 87 9.874 8.423 -5.443 1.00 0.00 H new ATOM 0 HG2 GLU A 87 12.207 7.370 -6.337 1.00 0.00 H new ATOM 0 HG3 GLU A 87 12.171 8.826 -7.312 1.00 0.00 H new ATOM 1322 N ALA A 88 9.744 4.992 -5.573 1.00 0.00 N ATOM 1323 CA ALA A 88 10.322 3.787 -5.065 1.00 0.00 C ATOM 1324 C ALA A 88 10.291 2.665 -6.046 1.00 0.00 C ATOM 1325 O ALA A 88 11.199 1.841 -6.144 1.00 0.00 O ATOM 1326 CB ALA A 88 9.759 3.380 -3.693 1.00 0.00 C ATOM 0 H ALA A 88 8.839 5.213 -5.158 1.00 0.00 H new ATOM 0 HA ALA A 88 11.375 4.019 -4.904 1.00 0.00 H new ATOM 0 HB1 ALA A 88 10.238 2.458 -3.362 1.00 0.00 H new ATOM 0 HB2 ALA A 88 9.956 4.171 -2.970 1.00 0.00 H new ATOM 0 HB3 ALA A 88 8.684 3.222 -3.773 1.00 0.00 H new ATOM 1332 N PHE A 89 9.391 2.728 -7.043 1.00 0.00 N ATOM 1333 CA PHE A 89 9.099 1.721 -8.015 1.00 0.00 C ATOM 1334 C PHE A 89 10.281 1.618 -8.917 1.00 0.00 C ATOM 1335 O PHE A 89 10.806 0.522 -9.111 1.00 0.00 O ATOM 1336 CB PHE A 89 7.773 2.115 -8.686 1.00 0.00 C ATOM 1337 CG PHE A 89 7.487 1.214 -9.838 1.00 0.00 C ATOM 1338 CD1 PHE A 89 7.239 -0.115 -9.589 1.00 0.00 C ATOM 1339 CD2 PHE A 89 7.573 1.617 -11.150 1.00 0.00 C ATOM 1340 CE1 PHE A 89 7.082 -1.031 -10.603 1.00 0.00 C ATOM 1341 CE2 PHE A 89 7.388 0.739 -12.192 1.00 0.00 C ATOM 1342 CZ PHE A 89 7.105 -0.574 -11.899 1.00 0.00 C ATOM 0 H PHE A 89 8.817 3.560 -7.179 1.00 0.00 H new ATOM 0 HA PHE A 89 8.948 0.721 -7.609 1.00 0.00 H new ATOM 0 HB2 PHE A 89 6.961 2.059 -7.962 1.00 0.00 H new ATOM 0 HB3 PHE A 89 7.824 3.149 -9.028 1.00 0.00 H new ATOM 0 HD1 PHE A 89 7.165 -0.450 -8.565 1.00 0.00 H new ATOM 0 HD2 PHE A 89 7.792 2.652 -11.368 1.00 0.00 H new ATOM 0 HE1 PHE A 89 6.944 -2.080 -10.387 1.00 0.00 H new ATOM 0 HE2 PHE A 89 7.463 1.073 -13.216 1.00 0.00 H new ATOM 0 HZ PHE A 89 6.896 -1.262 -12.705 1.00 0.00 H new ATOM 1352 N ARG A 90 10.735 2.796 -9.380 1.00 0.00 N ATOM 1353 CA ARG A 90 11.721 2.995 -10.396 1.00 0.00 C ATOM 1354 C ARG A 90 13.061 2.872 -9.757 1.00 0.00 C ATOM 1355 O ARG A 90 14.075 2.573 -10.386 1.00 0.00 O ATOM 1356 CB ARG A 90 11.567 4.336 -11.133 1.00 0.00 C ATOM 1357 CG ARG A 90 12.538 4.640 -12.275 1.00 0.00 C ATOM 1358 CD ARG A 90 12.151 5.802 -13.191 1.00 0.00 C ATOM 1359 NE ARG A 90 13.341 6.300 -13.936 1.00 0.00 N ATOM 1360 CZ ARG A 90 13.867 5.659 -15.021 1.00 0.00 C ATOM 1361 NH1 ARG A 90 13.209 4.754 -15.802 1.00 0.00 N ATOM 1362 NH2 ARG A 90 15.118 6.092 -15.353 1.00 0.00 N ATOM 0 H ARG A 90 10.383 3.680 -9.013 1.00 0.00 H new ATOM 0 HA ARG A 90 11.593 2.236 -11.167 1.00 0.00 H new ATOM 0 HB2 ARG A 90 10.554 4.383 -11.533 1.00 0.00 H new ATOM 0 HB3 ARG A 90 11.656 5.135 -10.397 1.00 0.00 H new ATOM 0 HG2 ARG A 90 13.518 4.852 -11.846 1.00 0.00 H new ATOM 0 HG3 ARG A 90 12.644 3.742 -12.884 1.00 0.00 H new ATOM 0 HD2 ARG A 90 11.384 5.478 -13.894 1.00 0.00 H new ATOM 0 HD3 ARG A 90 11.720 6.610 -12.600 1.00 0.00 H new ATOM 0 HE ARG A 90 13.785 7.162 -13.620 1.00 0.00 H new ATOM 0 HH11 ARG A 90 12.242 4.507 -15.592 1.00 0.00 H new ATOM 0 HH12 ARG A 90 13.684 4.324 -16.595 1.00 0.00 H new ATOM 0 HH21 ARG A 90 15.565 6.827 -14.805 1.00 0.00 H new ATOM 0 HH22 ARG A 90 15.606 5.681 -16.149 1.00 0.00 H new ATOM 1376 N VAL A 91 13.176 3.104 -8.437 1.00 0.00 N ATOM 1377 CA VAL A 91 14.361 3.030 -7.640 1.00 0.00 C ATOM 1378 C VAL A 91 14.641 1.570 -7.530 1.00 0.00 C ATOM 1379 O VAL A 91 15.821 1.231 -7.469 1.00 0.00 O ATOM 1380 CB VAL A 91 14.133 3.787 -6.366 1.00 0.00 C ATOM 1381 CG1 VAL A 91 15.031 3.151 -5.292 1.00 0.00 C ATOM 1382 CG2 VAL A 91 14.315 5.292 -6.625 1.00 0.00 C ATOM 0 H VAL A 91 12.364 3.367 -7.879 1.00 0.00 H new ATOM 0 HA VAL A 91 15.252 3.505 -8.051 1.00 0.00 H new ATOM 0 HB VAL A 91 13.114 3.715 -5.985 1.00 0.00 H new ATOM 0 HG11 VAL A 91 14.894 3.675 -4.346 1.00 0.00 H new ATOM 0 HG12 VAL A 91 14.762 2.102 -5.168 1.00 0.00 H new ATOM 0 HG13 VAL A 91 16.074 3.224 -5.600 1.00 0.00 H new ATOM 0 HG21 VAL A 91 14.149 5.843 -5.699 1.00 0.00 H new ATOM 0 HG22 VAL A 91 15.327 5.480 -6.983 1.00 0.00 H new ATOM 0 HG23 VAL A 91 13.597 5.621 -7.377 1.00 0.00 H new ATOM 1392 N PHE A 92 13.620 0.703 -7.408 1.00 0.00 N ATOM 1393 CA PHE A 92 13.664 -0.721 -7.289 1.00 0.00 C ATOM 1394 C PHE A 92 13.906 -1.322 -8.631 1.00 0.00 C ATOM 1395 O PHE A 92 14.605 -2.329 -8.719 1.00 0.00 O ATOM 1396 CB PHE A 92 12.383 -1.348 -6.713 1.00 0.00 C ATOM 1397 CG PHE A 92 12.077 -0.970 -5.304 1.00 0.00 C ATOM 1398 CD1 PHE A 92 13.047 -0.677 -4.375 1.00 0.00 C ATOM 1399 CD2 PHE A 92 10.771 -0.649 -5.017 1.00 0.00 C ATOM 1400 CE1 PHE A 92 12.763 -0.191 -3.121 1.00 0.00 C ATOM 1401 CE2 PHE A 92 10.522 -0.122 -3.771 1.00 0.00 C ATOM 1402 CZ PHE A 92 11.474 0.186 -2.827 1.00 0.00 C ATOM 0 H PHE A 92 12.658 1.041 -7.391 1.00 0.00 H new ATOM 0 HA PHE A 92 14.471 -0.934 -6.588 1.00 0.00 H new ATOM 0 HB2 PHE A 92 11.541 -1.060 -7.342 1.00 0.00 H new ATOM 0 HB3 PHE A 92 12.469 -2.433 -6.772 1.00 0.00 H new ATOM 0 HD1 PHE A 92 14.081 -0.836 -4.643 1.00 0.00 H new ATOM 0 HD2 PHE A 92 9.979 -0.803 -5.735 1.00 0.00 H new ATOM 0 HE1 PHE A 92 13.541 -0.106 -2.377 1.00 0.00 H new ATOM 0 HE2 PHE A 92 9.491 0.066 -3.512 1.00 0.00 H new ATOM 0 HZ PHE A 92 11.223 0.695 -1.908 1.00 0.00 H new ATOM 1412 N ASP A 93 13.433 -0.776 -9.766 1.00 0.00 N ATOM 1413 CA ASP A 93 13.694 -1.099 -11.134 1.00 0.00 C ATOM 1414 C ASP A 93 15.108 -0.804 -11.499 1.00 0.00 C ATOM 1415 O ASP A 93 15.460 0.359 -11.692 1.00 0.00 O ATOM 1416 CB ASP A 93 12.691 -0.446 -12.101 1.00 0.00 C ATOM 1417 CG ASP A 93 12.511 -1.168 -13.429 1.00 0.00 C ATOM 1418 OD1 ASP A 93 13.283 -2.122 -13.714 1.00 0.00 O ATOM 1419 OD2 ASP A 93 11.663 -0.714 -14.242 1.00 0.00 O ATOM 0 H ASP A 93 12.775 0.001 -9.709 1.00 0.00 H new ATOM 0 HA ASP A 93 13.549 -2.174 -11.240 1.00 0.00 H new ATOM 0 HB2 ASP A 93 11.722 -0.381 -11.606 1.00 0.00 H new ATOM 0 HB3 ASP A 93 13.015 0.575 -12.301 1.00 0.00 H new ATOM 1424 N LYS A 94 15.930 -1.848 -11.710 1.00 0.00 N ATOM 1425 CA LYS A 94 17.294 -1.737 -12.127 1.00 0.00 C ATOM 1426 C LYS A 94 17.639 -1.041 -13.398 1.00 0.00 C ATOM 1427 O LYS A 94 18.384 -0.062 -13.386 1.00 0.00 O ATOM 1428 CB LYS A 94 17.944 -3.126 -12.011 1.00 0.00 C ATOM 1429 CG LYS A 94 19.443 -3.232 -12.302 1.00 0.00 C ATOM 1430 CD LYS A 94 20.219 -2.348 -11.324 1.00 0.00 C ATOM 1431 CE LYS A 94 20.960 -3.209 -10.299 1.00 0.00 C ATOM 1432 NZ LYS A 94 21.923 -2.325 -9.605 1.00 0.00 N ATOM 0 H LYS A 94 15.629 -2.815 -11.584 1.00 0.00 H new ATOM 0 HA LYS A 94 17.719 -1.008 -11.437 1.00 0.00 H new ATOM 0 HB2 LYS A 94 17.771 -3.495 -11.000 1.00 0.00 H new ATOM 0 HB3 LYS A 94 17.421 -3.800 -12.690 1.00 0.00 H new ATOM 0 HG2 LYS A 94 19.769 -4.268 -12.209 1.00 0.00 H new ATOM 0 HG3 LYS A 94 19.647 -2.924 -13.327 1.00 0.00 H new ATOM 0 HD2 LYS A 94 20.930 -1.728 -11.870 1.00 0.00 H new ATOM 0 HD3 LYS A 94 19.534 -1.672 -10.813 1.00 0.00 H new ATOM 0 HE2 LYS A 94 20.261 -3.650 -9.589 1.00 0.00 H new ATOM 0 HE3 LYS A 94 21.478 -4.033 -10.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 22.450 -2.874 -8.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 22.588 -1.925 -10.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 21.409 -1.554 -9.133 1.00 0.00 H new ATOM 1446 N ASP A 95 17.069 -1.507 -14.524 1.00 0.00 N ATOM 1447 CA ASP A 95 17.176 -0.966 -15.843 1.00 0.00 C ATOM 1448 C ASP A 95 16.263 0.181 -16.107 1.00 0.00 C ATOM 1449 O ASP A 95 16.506 1.005 -16.987 1.00 0.00 O ATOM 1450 CB ASP A 95 16.898 -2.019 -16.928 1.00 0.00 C ATOM 1451 CG ASP A 95 15.667 -2.892 -16.732 1.00 0.00 C ATOM 1452 OD1 ASP A 95 15.416 -3.289 -15.562 1.00 0.00 O ATOM 1453 OD2 ASP A 95 15.008 -3.169 -17.769 1.00 0.00 O ATOM 0 H ASP A 95 16.479 -2.339 -14.507 1.00 0.00 H new ATOM 0 HA ASP A 95 18.208 -0.618 -15.890 1.00 0.00 H new ATOM 0 HB2 ASP A 95 16.802 -1.505 -17.885 1.00 0.00 H new ATOM 0 HB3 ASP A 95 17.769 -2.670 -17.002 1.00 0.00 H new ATOM 1458 N GLY A 96 15.175 0.345 -15.332 1.00 0.00 N ATOM 1459 CA GLY A 96 14.296 1.465 -15.456 1.00 0.00 C ATOM 1460 C GLY A 96 13.472 1.429 -16.697 1.00 0.00 C ATOM 1461 O GLY A 96 13.328 2.435 -17.390 1.00 0.00 O ATOM 0 H GLY A 96 14.901 -0.315 -14.604 1.00 0.00 H new ATOM 0 HA2 GLY A 96 13.635 1.498 -14.590 1.00 0.00 H new ATOM 0 HA3 GLY A 96 14.884 2.383 -15.444 1.00 0.00 H new ATOM 1465 N ASN A 97 12.824 0.281 -16.963 1.00 0.00 N ATOM 1466 CA ASN A 97 11.963 0.064 -18.084 1.00 0.00 C ATOM 1467 C ASN A 97 10.554 0.402 -17.736 1.00 0.00 C ATOM 1468 O ASN A 97 9.873 1.107 -18.479 1.00 0.00 O ATOM 1469 CB ASN A 97 11.944 -1.427 -18.460 1.00 0.00 C ATOM 1470 CG ASN A 97 11.314 -1.661 -19.825 1.00 0.00 C ATOM 1471 OD1 ASN A 97 10.163 -2.026 -20.061 1.00 0.00 O ATOM 1472 ND2 ASN A 97 12.128 -1.296 -20.851 1.00 0.00 N ATOM 0 H ASN A 97 12.905 -0.540 -16.363 1.00 0.00 H new ATOM 0 HA ASN A 97 12.337 0.686 -18.897 1.00 0.00 H new ATOM 0 HB2 ASN A 97 12.963 -1.814 -18.459 1.00 0.00 H new ATOM 0 HB3 ASN A 97 11.391 -1.985 -17.705 1.00 0.00 H new ATOM 0 HD21 ASN A 97 11.784 -1.326 -21.811 1.00 0.00 H new ATOM 0 HD22 ASN A 97 13.083 -0.993 -20.661 1.00 0.00 H new ATOM 1479 N GLY A 98 10.074 -0.190 -16.628 1.00 0.00 N ATOM 1480 CA GLY A 98 8.684 -0.193 -16.292 1.00 0.00 C ATOM 1481 C GLY A 98 8.187 -1.280 -15.402 1.00 0.00 C ATOM 1482 O GLY A 98 7.051 -1.314 -14.931 1.00 0.00 O ATOM 0 H GLY A 98 10.663 -0.676 -15.952 1.00 0.00 H new ATOM 0 HA2 GLY A 98 8.452 0.761 -15.818 1.00 0.00 H new ATOM 0 HA3 GLY A 98 8.115 -0.234 -17.221 1.00 0.00 H new ATOM 1486 N TYR A 99 9.073 -2.252 -15.119 1.00 0.00 N ATOM 1487 CA TYR A 99 8.830 -3.467 -14.406 1.00 0.00 C ATOM 1488 C TYR A 99 9.925 -3.794 -13.450 1.00 0.00 C ATOM 1489 O TYR A 99 11.090 -4.051 -13.751 1.00 0.00 O ATOM 1490 CB TYR A 99 8.601 -4.728 -15.255 1.00 0.00 C ATOM 1491 CG TYR A 99 7.669 -4.567 -16.406 1.00 0.00 C ATOM 1492 CD1 TYR A 99 8.109 -3.908 -17.529 1.00 0.00 C ATOM 1493 CD2 TYR A 99 6.378 -5.041 -16.379 1.00 0.00 C ATOM 1494 CE1 TYR A 99 7.354 -3.807 -18.674 1.00 0.00 C ATOM 1495 CE2 TYR A 99 5.566 -4.930 -17.483 1.00 0.00 C ATOM 1496 CZ TYR A 99 6.053 -4.238 -18.567 1.00 0.00 C ATOM 1497 OH TYR A 99 5.229 -4.113 -19.705 1.00 0.00 O ATOM 0 H TYR A 99 10.046 -2.178 -15.417 1.00 0.00 H new ATOM 0 HA TYR A 99 7.894 -3.232 -13.899 1.00 0.00 H new ATOM 0 HB2 TYR A 99 9.564 -5.069 -15.635 1.00 0.00 H new ATOM 0 HB3 TYR A 99 8.217 -5.516 -14.607 1.00 0.00 H new ATOM 0 HD1 TYR A 99 9.087 -3.451 -17.512 1.00 0.00 H new ATOM 0 HD2 TYR A 99 5.998 -5.505 -15.481 1.00 0.00 H new ATOM 0 HE1 TYR A 99 7.757 -3.415 -19.596 1.00 0.00 H new ATOM 0 HE2 TYR A 99 4.580 -5.371 -17.498 1.00 0.00 H new ATOM 0 HH TYR A 99 4.334 -4.454 -19.500 1.00 0.00 H new ATOM 1507 N ILE A 100 9.465 -4.090 -12.221 1.00 0.00 N ATOM 1508 CA ILE A 100 10.339 -4.804 -11.344 1.00 0.00 C ATOM 1509 C ILE A 100 10.150 -6.268 -11.550 1.00 0.00 C ATOM 1510 O ILE A 100 9.073 -6.773 -11.237 1.00 0.00 O ATOM 1511 CB ILE A 100 10.257 -4.541 -9.870 1.00 0.00 C ATOM 1512 CG1 ILE A 100 9.900 -3.076 -9.564 1.00 0.00 C ATOM 1513 CG2 ILE A 100 11.701 -4.796 -9.407 1.00 0.00 C ATOM 1514 CD1 ILE A 100 9.160 -3.017 -8.229 1.00 0.00 C ATOM 0 H ILE A 100 8.545 -3.853 -11.850 1.00 0.00 H new ATOM 0 HA ILE A 100 11.320 -4.424 -11.630 1.00 0.00 H new ATOM 0 HB ILE A 100 9.495 -5.152 -9.387 1.00 0.00 H new ATOM 0 HG12 ILE A 100 10.804 -2.468 -9.521 1.00 0.00 H new ATOM 0 HG13 ILE A 100 9.277 -2.666 -10.359 1.00 0.00 H new ATOM 0 HG21 ILE A 100 11.772 -4.634 -8.331 1.00 0.00 H new ATOM 0 HG22 ILE A 100 11.981 -5.824 -9.639 1.00 0.00 H new ATOM 0 HG23 ILE A 100 12.375 -4.111 -9.922 1.00 0.00 H new ATOM 0 HD11 ILE A 100 8.902 -1.983 -8.002 1.00 0.00 H new ATOM 0 HD12 ILE A 100 8.250 -3.613 -8.291 1.00 0.00 H new ATOM 0 HD13 ILE A 100 9.800 -3.413 -7.440 1.00 0.00 H new ATOM 1526 N SER A 101 11.033 -7.079 -12.160 1.00 0.00 N ATOM 1527 CA SER A 101 10.858 -8.486 -12.342 1.00 0.00 C ATOM 1528 C SER A 101 10.950 -9.161 -11.017 1.00 0.00 C ATOM 1529 O SER A 101 11.549 -8.650 -10.072 1.00 0.00 O ATOM 1530 CB SER A 101 11.856 -9.106 -13.335 1.00 0.00 C ATOM 1531 OG SER A 101 13.224 -8.877 -13.033 1.00 0.00 O ATOM 0 H SER A 101 11.913 -6.735 -12.545 1.00 0.00 H new ATOM 0 HA SER A 101 9.872 -8.638 -12.781 1.00 0.00 H new ATOM 0 HB2 SER A 101 11.684 -10.182 -13.376 1.00 0.00 H new ATOM 0 HB3 SER A 101 11.648 -8.712 -14.330 1.00 0.00 H new ATOM 0 HG SER A 101 13.378 -7.916 -12.921 1.00 0.00 H new ATOM 1537 N ALA A 102 10.323 -10.339 -10.850 1.00 0.00 N ATOM 1538 CA ALA A 102 10.358 -11.075 -9.624 1.00 0.00 C ATOM 1539 C ALA A 102 11.558 -11.171 -8.747 1.00 0.00 C ATOM 1540 O ALA A 102 11.507 -10.802 -7.575 1.00 0.00 O ATOM 1541 CB ALA A 102 9.872 -12.501 -9.937 1.00 0.00 C ATOM 0 H ALA A 102 9.779 -10.791 -11.585 1.00 0.00 H new ATOM 0 HA ALA A 102 9.737 -10.438 -8.994 1.00 0.00 H new ATOM 0 HB1 ALA A 102 9.884 -13.098 -9.025 1.00 0.00 H new ATOM 0 HB2 ALA A 102 8.857 -12.461 -10.332 1.00 0.00 H new ATOM 0 HB3 ALA A 102 10.531 -12.956 -10.677 1.00 0.00 H new ATOM 1547 N ALA A 103 12.713 -11.521 -9.342 1.00 0.00 N ATOM 1548 CA ALA A 103 13.855 -11.737 -8.509 1.00 0.00 C ATOM 1549 C ALA A 103 14.599 -10.487 -8.186 1.00 0.00 C ATOM 1550 O ALA A 103 15.286 -10.347 -7.176 1.00 0.00 O ATOM 1551 CB ALA A 103 14.694 -12.808 -9.226 1.00 0.00 C ATOM 0 H ALA A 103 12.855 -11.649 -10.344 1.00 0.00 H new ATOM 0 HA ALA A 103 13.562 -12.086 -7.519 1.00 0.00 H new ATOM 0 HB1 ALA A 103 15.588 -13.022 -8.640 1.00 0.00 H new ATOM 0 HB2 ALA A 103 14.105 -13.719 -9.336 1.00 0.00 H new ATOM 0 HB3 ALA A 103 14.985 -12.443 -10.211 1.00 0.00 H new ATOM 1557 N GLU A 104 14.536 -9.449 -9.039 1.00 0.00 N ATOM 1558 CA GLU A 104 15.025 -8.110 -8.926 1.00 0.00 C ATOM 1559 C GLU A 104 14.301 -7.469 -7.792 1.00 0.00 C ATOM 1560 O GLU A 104 14.894 -6.866 -6.899 1.00 0.00 O ATOM 1561 CB GLU A 104 14.728 -7.463 -10.289 1.00 0.00 C ATOM 1562 CG GLU A 104 14.882 -5.944 -10.397 1.00 0.00 C ATOM 1563 CD GLU A 104 14.431 -5.465 -11.769 1.00 0.00 C ATOM 1564 OE1 GLU A 104 13.638 -6.096 -12.518 1.00 0.00 O ATOM 1565 OE2 GLU A 104 14.820 -4.311 -12.092 1.00 0.00 O ATOM 0 H GLU A 104 14.072 -9.575 -9.939 1.00 0.00 H new ATOM 0 HA GLU A 104 16.090 -8.021 -8.713 1.00 0.00 H new ATOM 0 HB2 GLU A 104 15.384 -7.921 -11.029 1.00 0.00 H new ATOM 0 HB3 GLU A 104 13.706 -7.718 -10.567 1.00 0.00 H new ATOM 0 HG2 GLU A 104 14.292 -5.456 -9.621 1.00 0.00 H new ATOM 0 HG3 GLU A 104 15.922 -5.664 -10.230 1.00 0.00 H new ATOM 1572 N LEU A 105 12.973 -7.685 -7.778 1.00 0.00 N ATOM 1573 CA LEU A 105 12.020 -7.317 -6.778 1.00 0.00 C ATOM 1574 C LEU A 105 12.271 -7.940 -5.448 1.00 0.00 C ATOM 1575 O LEU A 105 12.186 -7.229 -4.449 1.00 0.00 O ATOM 1576 CB LEU A 105 10.574 -7.570 -7.237 1.00 0.00 C ATOM 1577 CG LEU A 105 9.426 -7.450 -6.220 1.00 0.00 C ATOM 1578 CD1 LEU A 105 9.265 -6.046 -5.614 1.00 0.00 C ATOM 1579 CD2 LEU A 105 8.001 -7.568 -6.785 1.00 0.00 C ATOM 0 H LEU A 105 12.522 -8.171 -8.553 1.00 0.00 H new ATOM 0 HA LEU A 105 12.154 -6.244 -6.643 1.00 0.00 H new ATOM 0 HB2 LEU A 105 10.363 -6.876 -8.051 1.00 0.00 H new ATOM 0 HB3 LEU A 105 10.535 -8.575 -7.657 1.00 0.00 H new ATOM 0 HG LEU A 105 9.728 -8.253 -5.548 1.00 0.00 H new ATOM 0 HD11 LEU A 105 8.435 -6.048 -4.908 1.00 0.00 H new ATOM 0 HD12 LEU A 105 10.182 -5.766 -5.095 1.00 0.00 H new ATOM 0 HD13 LEU A 105 9.064 -5.328 -6.409 1.00 0.00 H new ATOM 0 HD21 LEU A 105 7.279 -7.468 -5.975 1.00 0.00 H new ATOM 0 HD22 LEU A 105 7.834 -6.780 -7.519 1.00 0.00 H new ATOM 0 HD23 LEU A 105 7.878 -8.540 -7.262 1.00 0.00 H new ATOM 1591 N ARG A 106 12.785 -9.182 -5.395 1.00 0.00 N ATOM 1592 CA ARG A 106 13.053 -9.834 -4.150 1.00 0.00 C ATOM 1593 C ARG A 106 14.318 -9.260 -3.611 1.00 0.00 C ATOM 1594 O ARG A 106 14.425 -8.725 -2.509 1.00 0.00 O ATOM 1595 CB ARG A 106 13.039 -11.372 -4.196 1.00 0.00 C ATOM 1596 CG ARG A 106 13.141 -12.247 -2.945 1.00 0.00 C ATOM 1597 CD ARG A 106 13.185 -13.732 -3.308 1.00 0.00 C ATOM 1598 NE ARG A 106 13.636 -14.470 -2.095 1.00 0.00 N ATOM 1599 CZ ARG A 106 13.563 -15.831 -2.022 1.00 0.00 C ATOM 1600 NH1 ARG A 106 13.311 -16.636 -3.095 1.00 0.00 N ATOM 1601 NH2 ARG A 106 13.851 -16.503 -0.870 1.00 0.00 N ATOM 0 H ARG A 106 13.016 -9.737 -6.219 1.00 0.00 H new ATOM 0 HA ARG A 106 12.227 -9.633 -3.468 1.00 0.00 H new ATOM 0 HB2 ARG A 106 12.114 -11.657 -4.698 1.00 0.00 H new ATOM 0 HB3 ARG A 106 13.860 -11.669 -4.848 1.00 0.00 H new ATOM 0 HG2 ARG A 106 14.037 -11.981 -2.384 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.289 -12.055 -2.294 1.00 0.00 H new ATOM 0 HD2 ARG A 106 12.202 -14.079 -3.626 1.00 0.00 H new ATOM 0 HD3 ARG A 106 13.868 -13.905 -4.139 1.00 0.00 H new ATOM 0 HE ARG A 106 14.007 -13.947 -1.302 1.00 0.00 H new ATOM 0 HH11 ARG A 106 13.165 -16.226 -4.017 1.00 0.00 H new ATOM 0 HH12 ARG A 106 13.269 -17.648 -2.975 1.00 0.00 H new ATOM 0 HH21 ARG A 106 14.129 -15.988 -0.035 1.00 0.00 H new ATOM 0 HH22 ARG A 106 13.788 -17.521 -0.844 1.00 0.00 H new ATOM 1615 N HIS A 107 15.403 -9.241 -4.406 1.00 0.00 N ATOM 1616 CA HIS A 107 16.688 -8.691 -4.104 1.00 0.00 C ATOM 1617 C HIS A 107 16.639 -7.356 -3.443 1.00 0.00 C ATOM 1618 O HIS A 107 17.383 -7.144 -2.487 1.00 0.00 O ATOM 1619 CB HIS A 107 17.597 -8.606 -5.342 1.00 0.00 C ATOM 1620 CG HIS A 107 19.035 -8.261 -5.091 1.00 0.00 C ATOM 1621 ND1 HIS A 107 19.968 -8.878 -4.283 1.00 0.00 N ATOM 1622 CD2 HIS A 107 19.673 -7.220 -5.692 1.00 0.00 C ATOM 1623 CE1 HIS A 107 21.125 -8.190 -4.479 1.00 0.00 C ATOM 1624 NE2 HIS A 107 21.026 -7.279 -5.429 1.00 0.00 N ATOM 0 H HIS A 107 15.376 -9.647 -5.342 1.00 0.00 H new ATOM 0 HA HIS A 107 17.113 -9.397 -3.390 1.00 0.00 H new ATOM 0 HB2 HIS A 107 17.561 -9.565 -5.859 1.00 0.00 H new ATOM 0 HB3 HIS A 107 17.181 -7.862 -6.021 1.00 0.00 H new ATOM 0 HD2 HIS A 107 19.191 -6.459 -6.288 1.00 0.00 H new ATOM 0 HE1 HIS A 107 22.029 -8.370 -3.917 1.00 0.00 H new ATOM 0 HE2 HIS A 107 21.775 -6.743 -5.867 1.00 0.00 H new ATOM 1632 N VAL A 108 15.925 -6.365 -4.007 1.00 0.00 N ATOM 1633 CA VAL A 108 15.783 -5.099 -3.358 1.00 0.00 C ATOM 1634 C VAL A 108 15.057 -5.023 -2.058 1.00 0.00 C ATOM 1635 O VAL A 108 15.440 -4.234 -1.197 1.00 0.00 O ATOM 1636 CB VAL A 108 15.243 -4.029 -4.259 1.00 0.00 C ATOM 1637 CG1 VAL A 108 16.254 -3.376 -5.218 1.00 0.00 C ATOM 1638 CG2 VAL A 108 14.001 -4.398 -5.088 1.00 0.00 C ATOM 0 H VAL A 108 15.449 -6.439 -4.906 1.00 0.00 H new ATOM 0 HA VAL A 108 16.829 -4.930 -3.102 1.00 0.00 H new ATOM 0 HB VAL A 108 14.957 -3.307 -3.494 1.00 0.00 H new ATOM 0 HG11 VAL A 108 15.749 -2.619 -5.818 1.00 0.00 H new ATOM 0 HG12 VAL A 108 17.053 -2.909 -4.642 1.00 0.00 H new ATOM 0 HG13 VAL A 108 16.677 -4.137 -5.874 1.00 0.00 H new ATOM 0 HG21 VAL A 108 13.705 -3.545 -5.699 1.00 0.00 H new ATOM 0 HG22 VAL A 108 14.233 -5.244 -5.734 1.00 0.00 H new ATOM 0 HG23 VAL A 108 13.183 -4.666 -4.419 1.00 0.00 H new ATOM 1648 N MET A 109 13.949 -5.756 -1.848 1.00 0.00 N ATOM 1649 CA MET A 109 13.208 -5.727 -0.625 1.00 0.00 C ATOM 1650 C MET A 109 13.967 -6.411 0.460 1.00 0.00 C ATOM 1651 O MET A 109 13.858 -6.026 1.623 1.00 0.00 O ATOM 1652 CB MET A 109 11.868 -6.426 -0.912 1.00 0.00 C ATOM 1653 CG MET A 109 10.865 -5.497 -1.598 1.00 0.00 C ATOM 1654 SD MET A 109 9.181 -6.160 -1.770 1.00 0.00 S ATOM 1655 CE MET A 109 8.518 -4.565 -2.333 1.00 0.00 C ATOM 0 H MET A 109 13.558 -6.386 -2.548 1.00 0.00 H new ATOM 0 HA MET A 109 13.037 -4.707 -0.282 1.00 0.00 H new ATOM 0 HB2 MET A 109 12.043 -7.298 -1.543 1.00 0.00 H new ATOM 0 HB3 MET A 109 11.443 -6.790 0.023 1.00 0.00 H new ATOM 0 HG2 MET A 109 10.815 -4.565 -1.035 1.00 0.00 H new ATOM 0 HG3 MET A 109 11.243 -5.250 -2.590 1.00 0.00 H new ATOM 0 HE1 MET A 109 7.450 -4.663 -2.528 1.00 0.00 H new ATOM 0 HE2 MET A 109 8.678 -3.812 -1.562 1.00 0.00 H new ATOM 0 HE3 MET A 109 9.027 -4.262 -3.248 1.00 0.00 H new ATOM 1665 N THR A 110 14.812 -7.408 0.144 1.00 0.00 N ATOM 1666 CA THR A 110 15.756 -8.019 1.027 1.00 0.00 C ATOM 1667 C THR A 110 16.802 -7.030 1.413 1.00 0.00 C ATOM 1668 O THR A 110 17.039 -6.883 2.611 1.00 0.00 O ATOM 1669 CB THR A 110 16.406 -9.245 0.458 1.00 0.00 C ATOM 1670 OG1 THR A 110 15.450 -10.124 -0.116 1.00 0.00 O ATOM 1671 CG2 THR A 110 17.124 -10.048 1.556 1.00 0.00 C ATOM 0 H THR A 110 14.837 -7.814 -0.791 1.00 0.00 H new ATOM 0 HA THR A 110 15.193 -8.343 1.902 1.00 0.00 H new ATOM 0 HB THR A 110 17.107 -8.890 -0.297 1.00 0.00 H new ATOM 0 HG1 THR A 110 15.116 -9.741 -0.954 1.00 0.00 H new ATOM 0 HG21 THR A 110 17.587 -10.932 1.117 1.00 0.00 H new ATOM 0 HG22 THR A 110 17.892 -9.427 2.017 1.00 0.00 H new ATOM 0 HG23 THR A 110 16.402 -10.355 2.313 1.00 0.00 H new ATOM 1679 N ASN A 111 17.353 -6.225 0.488 1.00 0.00 N ATOM 1680 CA ASN A 111 18.247 -5.133 0.718 1.00 0.00 C ATOM 1681 C ASN A 111 17.709 -4.099 1.646 1.00 0.00 C ATOM 1682 O ASN A 111 18.354 -3.486 2.495 1.00 0.00 O ATOM 1683 CB ASN A 111 18.818 -4.480 -0.553 1.00 0.00 C ATOM 1684 CG ASN A 111 19.650 -5.377 -1.457 1.00 0.00 C ATOM 1685 OD1 ASN A 111 20.202 -6.417 -1.101 1.00 0.00 O ATOM 1686 ND2 ASN A 111 19.928 -4.859 -2.684 1.00 0.00 N ATOM 0 H ASN A 111 17.155 -6.350 -0.505 1.00 0.00 H new ATOM 0 HA ASN A 111 19.087 -5.617 1.215 1.00 0.00 H new ATOM 0 HB2 ASN A 111 17.987 -4.083 -1.136 1.00 0.00 H new ATOM 0 HB3 ASN A 111 19.433 -3.631 -0.255 1.00 0.00 H new ATOM 0 HD21 ASN A 111 20.589 -5.333 -3.300 1.00 0.00 H new ATOM 0 HD22 ASN A 111 19.475 -3.997 -2.988 1.00 0.00 H new ATOM 1693 N LEU A 112 16.433 -3.732 1.435 1.00 0.00 N ATOM 1694 CA LEU A 112 15.725 -2.709 2.140 1.00 0.00 C ATOM 1695 C LEU A 112 15.450 -3.146 3.538 1.00 0.00 C ATOM 1696 O LEU A 112 15.909 -2.415 4.413 1.00 0.00 O ATOM 1697 CB LEU A 112 14.444 -2.384 1.353 1.00 0.00 C ATOM 1698 CG LEU A 112 13.803 -1.085 1.871 1.00 0.00 C ATOM 1699 CD1 LEU A 112 14.666 0.130 1.493 1.00 0.00 C ATOM 1700 CD2 LEU A 112 12.404 -0.845 1.277 1.00 0.00 C ATOM 0 H LEU A 112 15.857 -4.181 0.723 1.00 0.00 H new ATOM 0 HA LEU A 112 16.321 -1.799 2.216 1.00 0.00 H new ATOM 0 HB2 LEU A 112 14.678 -2.283 0.293 1.00 0.00 H new ATOM 0 HB3 LEU A 112 13.736 -3.207 1.446 1.00 0.00 H new ATOM 0 HG LEU A 112 13.726 -1.199 2.952 1.00 0.00 H new ATOM 0 HD11 LEU A 112 14.197 1.040 1.868 1.00 0.00 H new ATOM 0 HD12 LEU A 112 15.657 0.024 1.935 1.00 0.00 H new ATOM 0 HD13 LEU A 112 14.757 0.189 0.408 1.00 0.00 H new ATOM 0 HD21 LEU A 112 11.995 0.084 1.674 1.00 0.00 H new ATOM 0 HD22 LEU A 112 12.477 -0.775 0.192 1.00 0.00 H new ATOM 0 HD23 LEU A 112 11.748 -1.674 1.544 1.00 0.00 H new ATOM 1712 N GLY A 113 14.836 -4.299 3.858 1.00 0.00 N ATOM 1713 CA GLY A 113 14.492 -4.659 5.199 1.00 0.00 C ATOM 1714 C GLY A 113 13.513 -5.765 5.399 1.00 0.00 C ATOM 1715 O GLY A 113 13.668 -6.416 6.430 1.00 0.00 O ATOM 0 H GLY A 113 14.572 -5.000 3.166 1.00 0.00 H new ATOM 0 HA2 GLY A 113 15.411 -4.929 5.718 1.00 0.00 H new ATOM 0 HA3 GLY A 113 14.097 -3.771 5.692 1.00 0.00 H new ATOM 1719 N GLU A 114 12.677 -6.085 4.395 1.00 0.00 N ATOM 1720 CA GLU A 114 11.677 -7.105 4.461 1.00 0.00 C ATOM 1721 C GLU A 114 12.164 -8.511 4.550 1.00 0.00 C ATOM 1722 O GLU A 114 12.907 -8.988 3.694 1.00 0.00 O ATOM 1723 CB GLU A 114 10.673 -6.944 3.307 1.00 0.00 C ATOM 1724 CG GLU A 114 10.021 -5.562 3.229 1.00 0.00 C ATOM 1725 CD GLU A 114 8.956 -5.328 4.291 1.00 0.00 C ATOM 1726 OE1 GLU A 114 7.798 -5.727 3.991 1.00 0.00 O ATOM 1727 OE2 GLU A 114 9.228 -4.711 5.355 1.00 0.00 O ATOM 0 H GLU A 114 12.700 -5.609 3.493 1.00 0.00 H new ATOM 0 HA GLU A 114 11.190 -6.942 5.422 1.00 0.00 H new ATOM 0 HB2 GLU A 114 11.184 -7.146 2.365 1.00 0.00 H new ATOM 0 HB3 GLU A 114 9.891 -7.696 3.413 1.00 0.00 H new ATOM 0 HG2 GLU A 114 10.794 -4.799 3.327 1.00 0.00 H new ATOM 0 HG3 GLU A 114 9.573 -5.436 2.243 1.00 0.00 H new ATOM 1734 N LYS A 115 11.826 -9.280 5.600 1.00 0.00 N ATOM 1735 CA LYS A 115 12.094 -10.683 5.656 1.00 0.00 C ATOM 1736 C LYS A 115 11.198 -11.515 4.805 1.00 0.00 C ATOM 1737 O LYS A 115 9.985 -11.328 4.892 1.00 0.00 O ATOM 1738 CB LYS A 115 12.032 -11.305 7.061 1.00 0.00 C ATOM 1739 CG LYS A 115 12.951 -10.608 8.066 1.00 0.00 C ATOM 1740 CD LYS A 115 12.867 -11.246 9.454 1.00 0.00 C ATOM 1741 CE LYS A 115 11.933 -10.731 10.551 1.00 0.00 C ATOM 1742 NZ LYS A 115 10.549 -10.772 10.028 1.00 0.00 N ATOM 0 H LYS A 115 11.355 -8.918 6.429 1.00 0.00 H new ATOM 0 HA LYS A 115 13.117 -10.706 5.282 1.00 0.00 H new ATOM 0 HB2 LYS A 115 11.006 -11.263 7.426 1.00 0.00 H new ATOM 0 HB3 LYS A 115 12.305 -12.358 6.998 1.00 0.00 H new ATOM 0 HG2 LYS A 115 13.980 -10.652 7.708 1.00 0.00 H new ATOM 0 HG3 LYS A 115 12.682 -9.554 8.134 1.00 0.00 H new ATOM 0 HD2 LYS A 115 12.613 -12.294 9.298 1.00 0.00 H new ATOM 0 HD3 LYS A 115 13.875 -11.220 9.868 1.00 0.00 H new ATOM 0 HE2 LYS A 115 12.021 -11.346 11.446 1.00 0.00 H new ATOM 0 HE3 LYS A 115 12.203 -9.714 10.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 9.891 -10.442 10.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 10.475 -10.155 9.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 10.308 -11.748 9.760 1.00 0.00 H new ATOM 1756 N LEU A 116 11.754 -12.320 3.882 1.00 0.00 N ATOM 1757 CA LEU A 116 11.004 -12.931 2.830 1.00 0.00 C ATOM 1758 C LEU A 116 11.212 -14.402 2.715 1.00 0.00 C ATOM 1759 O LEU A 116 12.292 -14.889 2.386 1.00 0.00 O ATOM 1760 CB LEU A 116 11.596 -12.399 1.513 1.00 0.00 C ATOM 1761 CG LEU A 116 11.134 -10.935 1.433 1.00 0.00 C ATOM 1762 CD1 LEU A 116 11.785 -10.308 0.189 1.00 0.00 C ATOM 1763 CD2 LEU A 116 9.628 -10.778 1.163 1.00 0.00 C ATOM 0 H LEU A 116 12.747 -12.551 3.867 1.00 0.00 H new ATOM 0 HA LEU A 116 9.954 -12.717 3.027 1.00 0.00 H new ATOM 0 HB2 LEU A 116 12.684 -12.470 1.512 1.00 0.00 H new ATOM 0 HB3 LEU A 116 11.238 -12.973 0.659 1.00 0.00 H new ATOM 0 HG LEU A 116 11.396 -10.481 2.389 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.477 -9.266 0.103 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.870 -10.359 0.281 1.00 0.00 H new ATOM 0 HD13 LEU A 116 11.471 -10.854 -0.700 1.00 0.00 H new ATOM 0 HD21 LEU A 116 9.375 -9.719 1.120 1.00 0.00 H new ATOM 0 HD22 LEU A 116 9.377 -11.250 0.213 1.00 0.00 H new ATOM 0 HD23 LEU A 116 9.063 -11.254 1.965 1.00 0.00 H new ATOM 1775 N THR A 117 10.218 -15.276 2.956 1.00 0.00 N ATOM 1776 CA THR A 117 10.158 -16.659 2.598 1.00 0.00 C ATOM 1777 C THR A 117 9.620 -16.749 1.211 1.00 0.00 C ATOM 1778 O THR A 117 8.888 -15.869 0.760 1.00 0.00 O ATOM 1779 CB THR A 117 9.172 -17.419 3.434 1.00 0.00 C ATOM 1780 OG1 THR A 117 7.862 -16.872 3.483 1.00 0.00 O ATOM 1781 CG2 THR A 117 9.632 -17.603 4.891 1.00 0.00 C ATOM 0 H THR A 117 9.375 -14.983 3.450 1.00 0.00 H new ATOM 0 HA THR A 117 11.160 -17.069 2.724 1.00 0.00 H new ATOM 0 HB THR A 117 9.130 -18.374 2.910 1.00 0.00 H new ATOM 0 HG1 THR A 117 7.293 -17.435 4.048 1.00 0.00 H new ATOM 0 HG21 THR A 117 8.876 -18.160 5.444 1.00 0.00 H new ATOM 0 HG22 THR A 117 10.573 -18.153 4.909 1.00 0.00 H new ATOM 0 HG23 THR A 117 9.774 -16.626 5.354 1.00 0.00 H new ATOM 1789 N ASP A 118 9.974 -17.795 0.443 1.00 0.00 N ATOM 1790 CA ASP A 118 9.613 -18.021 -0.922 1.00 0.00 C ATOM 1791 C ASP A 118 8.150 -18.158 -1.166 1.00 0.00 C ATOM 1792 O ASP A 118 7.644 -17.380 -1.973 1.00 0.00 O ATOM 1793 CB ASP A 118 10.361 -19.252 -1.460 1.00 0.00 C ATOM 1794 CG ASP A 118 11.872 -19.110 -1.573 1.00 0.00 C ATOM 1795 OD1 ASP A 118 12.496 -19.046 -0.480 1.00 0.00 O ATOM 1796 OD2 ASP A 118 12.390 -19.009 -2.717 1.00 0.00 O ATOM 0 H ASP A 118 10.562 -18.544 0.809 1.00 0.00 H new ATOM 0 HA ASP A 118 9.911 -17.122 -1.462 1.00 0.00 H new ATOM 0 HB2 ASP A 118 10.142 -20.100 -0.811 1.00 0.00 H new ATOM 0 HB3 ASP A 118 9.963 -19.494 -2.445 1.00 0.00 H new ATOM 1801 N GLU A 119 7.470 -19.010 -0.378 1.00 0.00 N ATOM 1802 CA GLU A 119 6.055 -19.001 -0.174 1.00 0.00 C ATOM 1803 C GLU A 119 5.403 -17.661 -0.141 1.00 0.00 C ATOM 1804 O GLU A 119 4.598 -17.417 -1.038 1.00 0.00 O ATOM 1805 CB GLU A 119 5.716 -19.796 1.098 1.00 0.00 C ATOM 1806 CG GLU A 119 6.333 -21.193 1.183 1.00 0.00 C ATOM 1807 CD GLU A 119 7.742 -21.165 1.758 1.00 0.00 C ATOM 1808 OE1 GLU A 119 7.811 -20.913 2.991 1.00 0.00 O ATOM 1809 OE2 GLU A 119 8.727 -21.479 1.037 1.00 0.00 O ATOM 0 H GLU A 119 7.937 -19.749 0.148 1.00 0.00 H new ATOM 0 HA GLU A 119 5.637 -19.474 -1.063 1.00 0.00 H new ATOM 0 HB2 GLU A 119 6.043 -19.220 1.964 1.00 0.00 H new ATOM 0 HB3 GLU A 119 4.632 -19.891 1.169 1.00 0.00 H new ATOM 0 HG2 GLU A 119 5.702 -21.830 1.803 1.00 0.00 H new ATOM 0 HG3 GLU A 119 6.357 -21.639 0.189 1.00 0.00 H new ATOM 1816 N GLU A 120 5.851 -16.747 0.738 1.00 0.00 N ATOM 1817 CA GLU A 120 5.298 -15.431 0.815 1.00 0.00 C ATOM 1818 C GLU A 120 5.601 -14.654 -0.421 1.00 0.00 C ATOM 1819 O GLU A 120 4.781 -13.941 -0.997 1.00 0.00 O ATOM 1820 CB GLU A 120 5.864 -14.666 2.023 1.00 0.00 C ATOM 1821 CG GLU A 120 5.701 -13.145 2.001 1.00 0.00 C ATOM 1822 CD GLU A 120 5.716 -12.462 3.361 1.00 0.00 C ATOM 1823 OE1 GLU A 120 5.944 -13.147 4.393 1.00 0.00 O ATOM 1824 OE2 GLU A 120 5.671 -11.203 3.387 1.00 0.00 O ATOM 0 H GLU A 120 6.605 -16.923 1.402 1.00 0.00 H new ATOM 0 HA GLU A 120 4.219 -15.541 0.925 1.00 0.00 H new ATOM 0 HB2 GLU A 120 5.385 -15.048 2.925 1.00 0.00 H new ATOM 0 HB3 GLU A 120 6.927 -14.895 2.105 1.00 0.00 H new ATOM 0 HG2 GLU A 120 6.500 -12.721 1.393 1.00 0.00 H new ATOM 0 HG3 GLU A 120 4.761 -12.906 1.505 1.00 0.00 H new ATOM 1831 N VAL A 121 6.850 -14.662 -0.921 1.00 0.00 N ATOM 1832 CA VAL A 121 7.161 -14.062 -2.182 1.00 0.00 C ATOM 1833 C VAL A 121 6.295 -14.455 -3.329 1.00 0.00 C ATOM 1834 O VAL A 121 5.842 -13.501 -3.961 1.00 0.00 O ATOM 1835 CB VAL A 121 8.617 -14.188 -2.518 1.00 0.00 C ATOM 1836 CG1 VAL A 121 8.890 -13.513 -3.874 1.00 0.00 C ATOM 1837 CG2 VAL A 121 9.533 -13.599 -1.433 1.00 0.00 C ATOM 0 H VAL A 121 7.648 -15.086 -0.449 1.00 0.00 H new ATOM 0 HA VAL A 121 6.924 -13.009 -2.028 1.00 0.00 H new ATOM 0 HB VAL A 121 8.849 -15.251 -2.575 1.00 0.00 H new ATOM 0 HG11 VAL A 121 9.948 -13.604 -4.119 1.00 0.00 H new ATOM 0 HG12 VAL A 121 8.295 -13.998 -4.648 1.00 0.00 H new ATOM 0 HG13 VAL A 121 8.620 -12.458 -3.816 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.574 -13.719 -1.731 1.00 0.00 H new ATOM 0 HG22 VAL A 121 9.312 -12.539 -1.306 1.00 0.00 H new ATOM 0 HG23 VAL A 121 9.363 -14.120 -0.491 1.00 0.00 H new ATOM 1847 N ASP A 122 6.002 -15.752 -3.527 1.00 0.00 N ATOM 1848 CA ASP A 122 5.028 -16.256 -4.445 1.00 0.00 C ATOM 1849 C ASP A 122 3.629 -15.855 -4.123 1.00 0.00 C ATOM 1850 O ASP A 122 2.893 -15.483 -5.036 1.00 0.00 O ATOM 1851 CB ASP A 122 5.083 -17.793 -4.481 1.00 0.00 C ATOM 1852 CG ASP A 122 6.345 -18.455 -5.015 1.00 0.00 C ATOM 1853 OD1 ASP A 122 6.991 -17.975 -5.984 1.00 0.00 O ATOM 1854 OD2 ASP A 122 6.650 -19.548 -4.468 1.00 0.00 O ATOM 0 H ASP A 122 6.475 -16.495 -3.013 1.00 0.00 H new ATOM 0 HA ASP A 122 5.285 -15.819 -5.410 1.00 0.00 H new ATOM 0 HB2 ASP A 122 4.921 -18.156 -3.466 1.00 0.00 H new ATOM 0 HB3 ASP A 122 4.244 -18.142 -5.082 1.00 0.00 H new ATOM 1859 N GLU A 123 3.177 -15.940 -2.860 1.00 0.00 N ATOM 1860 CA GLU A 123 1.912 -15.438 -2.419 1.00 0.00 C ATOM 1861 C GLU A 123 1.721 -13.989 -2.709 1.00 0.00 C ATOM 1862 O GLU A 123 0.630 -13.631 -3.149 1.00 0.00 O ATOM 1863 CB GLU A 123 1.610 -15.692 -0.932 1.00 0.00 C ATOM 1864 CG GLU A 123 0.151 -15.502 -0.513 1.00 0.00 C ATOM 1865 CD GLU A 123 -0.174 -15.981 0.894 1.00 0.00 C ATOM 1866 OE1 GLU A 123 0.745 -16.121 1.745 1.00 0.00 O ATOM 1867 OE2 GLU A 123 -1.372 -16.262 1.163 1.00 0.00 O ATOM 0 H GLU A 123 3.716 -16.378 -2.113 1.00 0.00 H new ATOM 0 HA GLU A 123 1.201 -16.018 -3.008 1.00 0.00 H new ATOM 0 HB2 GLU A 123 1.910 -16.711 -0.688 1.00 0.00 H new ATOM 0 HB3 GLU A 123 2.231 -15.025 -0.334 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -0.100 -14.444 -0.589 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -0.488 -16.032 -1.219 1.00 0.00 H new ATOM 1874 N MET A 124 2.738 -13.113 -2.620 1.00 0.00 N ATOM 1875 CA MET A 124 2.795 -11.774 -3.118 1.00 0.00 C ATOM 1876 C MET A 124 2.608 -11.593 -4.585 1.00 0.00 C ATOM 1877 O MET A 124 1.611 -11.012 -5.012 1.00 0.00 O ATOM 1878 CB MET A 124 4.085 -11.035 -2.723 1.00 0.00 C ATOM 1879 CG MET A 124 3.913 -9.525 -2.902 1.00 0.00 C ATOM 1880 SD MET A 124 4.890 -8.509 -1.754 1.00 0.00 S ATOM 1881 CE MET A 124 6.353 -9.580 -1.642 1.00 0.00 C ATOM 0 H MET A 124 3.606 -13.372 -2.152 1.00 0.00 H new ATOM 0 HA MET A 124 1.924 -11.341 -2.627 1.00 0.00 H new ATOM 0 HB2 MET A 124 4.336 -11.258 -1.686 1.00 0.00 H new ATOM 0 HB3 MET A 124 4.915 -11.388 -3.335 1.00 0.00 H new ATOM 0 HG2 MET A 124 4.187 -9.260 -3.923 1.00 0.00 H new ATOM 0 HG3 MET A 124 2.859 -9.276 -2.780 1.00 0.00 H new ATOM 0 HE1 MET A 124 7.211 -8.991 -1.318 1.00 0.00 H new ATOM 0 HE2 MET A 124 6.167 -10.376 -0.921 1.00 0.00 H new ATOM 0 HE3 MET A 124 6.560 -10.016 -2.619 1.00 0.00 H new ATOM 1891 N ILE A 125 3.504 -12.224 -5.364 1.00 0.00 N ATOM 1892 CA ILE A 125 3.493 -12.316 -6.791 1.00 0.00 C ATOM 1893 C ILE A 125 2.195 -12.760 -7.373 1.00 0.00 C ATOM 1894 O ILE A 125 1.698 -12.302 -8.401 1.00 0.00 O ATOM 1895 CB ILE A 125 4.673 -13.115 -7.260 1.00 0.00 C ATOM 1896 CG1 ILE A 125 5.892 -12.190 -7.099 1.00 0.00 C ATOM 1897 CG2 ILE A 125 4.595 -13.664 -8.694 1.00 0.00 C ATOM 1898 CD1 ILE A 125 7.216 -12.949 -7.165 1.00 0.00 C ATOM 0 H ILE A 125 4.304 -12.711 -4.959 1.00 0.00 H new ATOM 0 HA ILE A 125 3.595 -11.303 -7.181 1.00 0.00 H new ATOM 0 HB ILE A 125 4.726 -14.022 -6.658 1.00 0.00 H new ATOM 0 HG12 ILE A 125 5.873 -11.430 -7.881 1.00 0.00 H new ATOM 0 HG13 ILE A 125 5.824 -11.667 -6.145 1.00 0.00 H new ATOM 0 HG21 ILE A 125 5.503 -14.223 -8.919 1.00 0.00 H new ATOM 0 HG22 ILE A 125 3.731 -14.323 -8.785 1.00 0.00 H new ATOM 0 HG23 ILE A 125 4.495 -12.836 -9.396 1.00 0.00 H new ATOM 0 HD11 ILE A 125 8.043 -12.249 -7.046 1.00 0.00 H new ATOM 0 HD12 ILE A 125 7.250 -13.691 -6.367 1.00 0.00 H new ATOM 0 HD13 ILE A 125 7.301 -13.450 -8.129 1.00 0.00 H new ATOM 1910 N ARG A 126 1.522 -13.699 -6.684 1.00 0.00 N ATOM 1911 CA ARG A 126 0.287 -14.345 -7.005 1.00 0.00 C ATOM 1912 C ARG A 126 -0.797 -13.335 -6.846 1.00 0.00 C ATOM 1913 O ARG A 126 -1.545 -13.112 -7.796 1.00 0.00 O ATOM 1914 CB ARG A 126 -0.096 -15.580 -6.172 1.00 0.00 C ATOM 1915 CG ARG A 126 -1.527 -16.062 -6.415 1.00 0.00 C ATOM 1916 CD ARG A 126 -1.893 -17.302 -5.597 1.00 0.00 C ATOM 1917 NE ARG A 126 -3.279 -17.675 -5.996 1.00 0.00 N ATOM 1918 CZ ARG A 126 -3.941 -18.840 -5.734 1.00 0.00 C ATOM 1919 NH1 ARG A 126 -3.330 -19.880 -5.096 1.00 0.00 N ATOM 1920 NH2 ARG A 126 -5.206 -19.055 -6.199 1.00 0.00 N ATOM 0 H ARG A 126 1.891 -14.043 -5.797 1.00 0.00 H new ATOM 0 HA ARG A 126 0.418 -14.724 -8.018 1.00 0.00 H new ATOM 0 HB2 ARG A 126 0.596 -16.391 -6.401 1.00 0.00 H new ATOM 0 HB3 ARG A 126 0.025 -15.346 -5.114 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -2.221 -15.257 -6.172 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -1.654 -16.283 -7.475 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -1.198 -18.118 -5.797 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -1.840 -17.092 -4.529 1.00 0.00 H new ATOM 0 HE ARG A 126 -3.796 -16.976 -6.529 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -2.356 -19.797 -4.803 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -3.847 -20.740 -4.912 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -5.674 -18.338 -6.753 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -5.683 -19.932 -5.992 1.00 0.00 H new ATOM 1934 N GLU A 127 -0.939 -12.584 -5.740 1.00 0.00 N ATOM 1935 CA GLU A 127 -1.893 -11.520 -5.677 1.00 0.00 C ATOM 1936 C GLU A 127 -1.639 -10.282 -6.467 1.00 0.00 C ATOM 1937 O GLU A 127 -2.554 -9.568 -6.874 1.00 0.00 O ATOM 1938 CB GLU A 127 -2.202 -11.182 -4.209 1.00 0.00 C ATOM 1939 CG GLU A 127 -2.810 -12.398 -3.506 1.00 0.00 C ATOM 1940 CD GLU A 127 -3.455 -11.942 -2.205 1.00 0.00 C ATOM 1941 OE1 GLU A 127 -4.517 -11.265 -2.211 1.00 0.00 O ATOM 1942 OE2 GLU A 127 -2.871 -12.232 -1.127 1.00 0.00 O ATOM 0 H GLU A 127 -0.393 -12.713 -4.888 1.00 0.00 H new ATOM 0 HA GLU A 127 -2.758 -11.937 -6.194 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -1.289 -10.876 -3.698 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -2.893 -10.340 -4.159 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -3.551 -12.873 -4.148 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -2.039 -13.142 -3.304 1.00 0.00 H new ATOM 1949 N ALA A 128 -0.343 -10.014 -6.710 1.00 0.00 N ATOM 1950 CA ALA A 128 0.168 -8.865 -7.390 1.00 0.00 C ATOM 1951 C ALA A 128 0.064 -8.895 -8.876 1.00 0.00 C ATOM 1952 O ALA A 128 -0.469 -7.960 -9.473 1.00 0.00 O ATOM 1953 CB ALA A 128 1.623 -8.592 -6.975 1.00 0.00 C ATOM 0 H ALA A 128 0.399 -10.646 -6.409 1.00 0.00 H new ATOM 0 HA ALA A 128 -0.485 -8.052 -7.073 1.00 0.00 H new ATOM 0 HB1 ALA A 128 1.993 -7.714 -7.504 1.00 0.00 H new ATOM 0 HB2 ALA A 128 1.668 -8.415 -5.900 1.00 0.00 H new ATOM 0 HB3 ALA A 128 2.241 -9.454 -7.226 1.00 0.00 H new ATOM 1959 N ASP A 129 0.576 -9.940 -9.550 1.00 0.00 N ATOM 1960 CA ASP A 129 0.530 -9.948 -10.979 1.00 0.00 C ATOM 1961 C ASP A 129 -0.818 -10.119 -11.590 1.00 0.00 C ATOM 1962 O ASP A 129 -1.528 -11.095 -11.354 1.00 0.00 O ATOM 1963 CB ASP A 129 1.648 -10.856 -11.519 1.00 0.00 C ATOM 1964 CG ASP A 129 2.120 -10.188 -12.802 1.00 0.00 C ATOM 1965 OD1 ASP A 129 1.448 -10.260 -13.865 1.00 0.00 O ATOM 1966 OD2 ASP A 129 3.219 -9.572 -12.752 1.00 0.00 O ATOM 0 H ASP A 129 1.010 -10.757 -9.121 1.00 0.00 H new ATOM 0 HA ASP A 129 0.741 -8.936 -11.324 1.00 0.00 H new ATOM 0 HB2 ASP A 129 2.462 -10.948 -10.800 1.00 0.00 H new ATOM 0 HB3 ASP A 129 1.278 -11.863 -11.712 1.00 0.00 H new ATOM 1971 N ILE A 130 -1.203 -9.178 -12.471 1.00 0.00 N ATOM 1972 CA ILE A 130 -2.377 -9.121 -13.285 1.00 0.00 C ATOM 1973 C ILE A 130 -2.242 -10.049 -14.442 1.00 0.00 C ATOM 1974 O ILE A 130 -3.063 -10.944 -14.636 1.00 0.00 O ATOM 1975 CB ILE A 130 -2.518 -7.669 -13.633 1.00 0.00 C ATOM 1976 CG1 ILE A 130 -3.408 -7.060 -12.536 1.00 0.00 C ATOM 1977 CG2 ILE A 130 -3.303 -7.411 -14.929 1.00 0.00 C ATOM 1978 CD1 ILE A 130 -3.498 -5.536 -12.473 1.00 0.00 C ATOM 0 H ILE A 130 -0.616 -8.359 -12.628 1.00 0.00 H new ATOM 0 HA ILE A 130 -3.289 -9.461 -12.795 1.00 0.00 H new ATOM 0 HB ILE A 130 -1.513 -7.261 -13.736 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -4.417 -7.453 -12.663 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -3.047 -7.417 -11.572 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.361 -6.338 -15.112 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -2.796 -7.894 -15.764 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -4.310 -7.818 -14.832 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -4.157 -5.244 -11.655 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -2.505 -5.120 -12.305 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -3.896 -5.156 -13.414 1.00 0.00 H new ATOM 1990 N ASP A 131 -1.118 -9.924 -15.170 1.00 0.00 N ATOM 1991 CA ASP A 131 -0.742 -10.846 -16.197 1.00 0.00 C ATOM 1992 C ASP A 131 -0.529 -12.253 -15.755 1.00 0.00 C ATOM 1993 O ASP A 131 -0.685 -13.270 -16.430 1.00 0.00 O ATOM 1994 CB ASP A 131 0.541 -10.368 -16.898 1.00 0.00 C ATOM 1995 CG ASP A 131 0.501 -8.936 -17.414 1.00 0.00 C ATOM 1996 OD1 ASP A 131 -0.292 -8.632 -18.344 1.00 0.00 O ATOM 1997 OD2 ASP A 131 1.207 -8.103 -16.785 1.00 0.00 O ATOM 0 H ASP A 131 -0.453 -9.162 -15.041 1.00 0.00 H new ATOM 0 HA ASP A 131 -1.600 -10.859 -16.869 1.00 0.00 H new ATOM 0 HB2 ASP A 131 1.374 -10.463 -16.201 1.00 0.00 H new ATOM 0 HB3 ASP A 131 0.748 -11.034 -17.736 1.00 0.00 H new ATOM 2002 N GLY A 132 -0.254 -12.481 -14.459 1.00 0.00 N ATOM 2003 CA GLY A 132 0.126 -13.771 -13.974 1.00 0.00 C ATOM 2004 C GLY A 132 1.493 -14.163 -14.418 1.00 0.00 C ATOM 2005 O GLY A 132 1.860 -15.327 -14.264 1.00 0.00 O ATOM 0 H GLY A 132 -0.296 -11.761 -13.738 1.00 0.00 H new ATOM 0 HA2 GLY A 132 0.086 -13.773 -12.885 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -0.593 -14.513 -14.321 1.00 0.00 H new ATOM 2009 N ASP A 133 2.340 -13.179 -14.768 1.00 0.00 N ATOM 2010 CA ASP A 133 3.595 -13.443 -15.400 1.00 0.00 C ATOM 2011 C ASP A 133 4.712 -13.441 -14.413 1.00 0.00 C ATOM 2012 O ASP A 133 5.609 -14.278 -14.494 1.00 0.00 O ATOM 2013 CB ASP A 133 3.959 -12.579 -16.619 1.00 0.00 C ATOM 2014 CG ASP A 133 4.320 -11.116 -16.402 1.00 0.00 C ATOM 2015 OD1 ASP A 133 3.875 -10.407 -15.460 1.00 0.00 O ATOM 2016 OD2 ASP A 133 4.997 -10.624 -17.344 1.00 0.00 O ATOM 0 H ASP A 133 2.152 -12.189 -14.611 1.00 0.00 H new ATOM 0 HA ASP A 133 3.451 -14.440 -15.815 1.00 0.00 H new ATOM 0 HB2 ASP A 133 4.801 -13.055 -17.121 1.00 0.00 H new ATOM 0 HB3 ASP A 133 3.116 -12.612 -17.310 1.00 0.00 H new ATOM 2021 N GLY A 134 4.620 -12.487 -13.469 1.00 0.00 N ATOM 2022 CA GLY A 134 5.491 -12.427 -12.336 1.00 0.00 C ATOM 2023 C GLY A 134 6.221 -11.130 -12.267 1.00 0.00 C ATOM 2024 O GLY A 134 6.735 -10.779 -11.206 1.00 0.00 O ATOM 0 H GLY A 134 3.925 -11.741 -13.494 1.00 0.00 H new ATOM 0 HA2 GLY A 134 4.911 -12.566 -11.424 1.00 0.00 H new ATOM 0 HA3 GLY A 134 6.209 -13.246 -12.386 1.00 0.00 H new ATOM 2028 N GLN A 135 6.323 -10.414 -13.401 1.00 0.00 N ATOM 2029 CA GLN A 135 7.024 -9.170 -13.478 1.00 0.00 C ATOM 2030 C GLN A 135 6.135 -8.013 -13.175 1.00 0.00 C ATOM 2031 O GLN A 135 5.260 -7.696 -13.979 1.00 0.00 O ATOM 2032 CB GLN A 135 7.530 -8.732 -14.863 1.00 0.00 C ATOM 2033 CG GLN A 135 8.369 -9.789 -15.584 1.00 0.00 C ATOM 2034 CD GLN A 135 9.329 -9.108 -16.549 1.00 0.00 C ATOM 2035 OE1 GLN A 135 10.224 -8.325 -16.235 1.00 0.00 O ATOM 2036 NE2 GLN A 135 9.222 -9.426 -17.867 1.00 0.00 N ATOM 0 H GLN A 135 5.908 -10.707 -14.286 1.00 0.00 H new ATOM 0 HA GLN A 135 7.840 -9.376 -12.785 1.00 0.00 H new ATOM 0 HB2 GLN A 135 6.674 -8.476 -15.487 1.00 0.00 H new ATOM 0 HB3 GLN A 135 8.125 -7.826 -14.751 1.00 0.00 H new ATOM 0 HG2 GLN A 135 8.926 -10.382 -14.859 1.00 0.00 H new ATOM 0 HG3 GLN A 135 7.719 -10.476 -16.126 1.00 0.00 H new ATOM 0 HE21 GLN A 135 8.496 -10.071 -18.179 1.00 0.00 H new ATOM 0 HE22 GLN A 135 9.868 -9.019 -18.544 1.00 0.00 H new ATOM 2045 N VAL A 136 6.402 -7.332 -12.046 1.00 0.00 N ATOM 2046 CA VAL A 136 5.484 -6.362 -11.534 1.00 0.00 C ATOM 2047 C VAL A 136 5.726 -5.045 -12.187 1.00 0.00 C ATOM 2048 O VAL A 136 6.711 -4.316 -12.086 1.00 0.00 O ATOM 2049 CB VAL A 136 5.580 -6.433 -10.039 1.00 0.00 C ATOM 2050 CG1 VAL A 136 5.572 -5.027 -9.416 1.00 0.00 C ATOM 2051 CG2 VAL A 136 4.455 -7.273 -9.410 1.00 0.00 C ATOM 0 H VAL A 136 7.249 -7.452 -11.490 1.00 0.00 H new ATOM 0 HA VAL A 136 4.438 -6.553 -11.776 1.00 0.00 H new ATOM 0 HB VAL A 136 6.528 -6.925 -9.822 1.00 0.00 H new ATOM 0 HG11 VAL A 136 5.643 -5.109 -8.331 1.00 0.00 H new ATOM 0 HG12 VAL A 136 6.421 -4.457 -9.793 1.00 0.00 H new ATOM 0 HG13 VAL A 136 4.646 -4.517 -9.682 1.00 0.00 H new ATOM 0 HG21 VAL A 136 4.575 -7.289 -8.327 1.00 0.00 H new ATOM 0 HG22 VAL A 136 3.489 -6.834 -9.661 1.00 0.00 H new ATOM 0 HG23 VAL A 136 4.502 -8.291 -9.796 1.00 0.00 H new ATOM 2061 N ASN A 137 4.652 -4.543 -12.822 1.00 0.00 N ATOM 2062 CA ASN A 137 4.590 -3.199 -13.307 1.00 0.00 C ATOM 2063 C ASN A 137 4.127 -2.268 -12.240 1.00 0.00 C ATOM 2064 O ASN A 137 3.778 -2.694 -11.140 1.00 0.00 O ATOM 2065 CB ASN A 137 3.826 -3.026 -14.631 1.00 0.00 C ATOM 2066 CG ASN A 137 2.325 -3.269 -14.569 1.00 0.00 C ATOM 2067 OD1 ASN A 137 1.684 -2.707 -13.682 1.00 0.00 O ATOM 2068 ND2 ASN A 137 1.791 -3.842 -15.681 1.00 0.00 N ATOM 0 H ASN A 137 3.806 -5.084 -13.003 1.00 0.00 H new ATOM 0 HA ASN A 137 5.613 -2.928 -13.568 1.00 0.00 H new ATOM 0 HB2 ASN A 137 3.996 -2.013 -14.996 1.00 0.00 H new ATOM 0 HB3 ASN A 137 4.255 -3.706 -15.367 1.00 0.00 H new ATOM 0 HD21 ASN A 137 0.782 -3.826 -15.829 1.00 0.00 H new ATOM 0 HD22 ASN A 137 2.400 -4.288 -16.367 1.00 0.00 H new ATOM 2075 N TYR A 138 4.104 -0.952 -12.513 1.00 0.00 N ATOM 2076 CA TYR A 138 3.710 0.057 -11.579 1.00 0.00 C ATOM 2077 C TYR A 138 2.295 -0.180 -11.176 1.00 0.00 C ATOM 2078 O TYR A 138 1.968 -0.177 -9.990 1.00 0.00 O ATOM 2079 CB TYR A 138 3.846 1.463 -12.187 1.00 0.00 C ATOM 2080 CG TYR A 138 3.353 2.593 -11.349 1.00 0.00 C ATOM 2081 CD1 TYR A 138 4.008 3.012 -10.216 1.00 0.00 C ATOM 2082 CD2 TYR A 138 2.128 3.125 -11.677 1.00 0.00 C ATOM 2083 CE1 TYR A 138 3.343 3.911 -9.415 1.00 0.00 C ATOM 2084 CE2 TYR A 138 1.457 3.940 -10.796 1.00 0.00 C ATOM 2085 CZ TYR A 138 2.069 4.374 -9.644 1.00 0.00 C ATOM 2086 OH TYR A 138 1.289 5.165 -8.774 1.00 0.00 O ATOM 0 H TYR A 138 4.371 -0.575 -13.422 1.00 0.00 H new ATOM 0 HA TYR A 138 4.365 0.001 -10.709 1.00 0.00 H new ATOM 0 HB2 TYR A 138 4.898 1.638 -12.414 1.00 0.00 H new ATOM 0 HB3 TYR A 138 3.309 1.480 -13.135 1.00 0.00 H new ATOM 0 HD1 TYR A 138 4.996 2.653 -9.967 1.00 0.00 H new ATOM 0 HD2 TYR A 138 1.688 2.900 -12.637 1.00 0.00 H new ATOM 0 HE1 TYR A 138 3.860 4.280 -8.542 1.00 0.00 H new ATOM 0 HE2 TYR A 138 0.442 4.241 -11.010 1.00 0.00 H new ATOM 0 HH TYR A 138 0.421 5.351 -9.190 1.00 0.00 H new ATOM 2096 N GLU A 139 1.368 -0.465 -12.107 1.00 0.00 N ATOM 2097 CA GLU A 139 0.021 -0.683 -11.679 1.00 0.00 C ATOM 2098 C GLU A 139 -0.212 -1.964 -10.954 1.00 0.00 C ATOM 2099 O GLU A 139 -1.199 -2.123 -10.238 1.00 0.00 O ATOM 2100 CB GLU A 139 -1.044 -0.627 -12.787 1.00 0.00 C ATOM 2101 CG GLU A 139 -1.474 0.761 -13.266 1.00 0.00 C ATOM 2102 CD GLU A 139 -2.830 0.790 -13.956 1.00 0.00 C ATOM 2103 OE1 GLU A 139 -2.922 0.135 -15.028 1.00 0.00 O ATOM 2104 OE2 GLU A 139 -3.797 1.427 -13.460 1.00 0.00 O ATOM 0 H GLU A 139 1.537 -0.542 -13.110 1.00 0.00 H new ATOM 0 HA GLU A 139 -0.097 0.165 -11.005 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -0.668 -1.181 -13.647 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -1.930 -1.153 -12.432 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -1.499 1.436 -12.411 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -0.721 1.145 -13.954 1.00 0.00 H new ATOM 2111 N GLU A 140 0.716 -2.936 -11.000 1.00 0.00 N ATOM 2112 CA GLU A 140 0.762 -4.070 -10.130 1.00 0.00 C ATOM 2113 C GLU A 140 1.291 -3.914 -8.746 1.00 0.00 C ATOM 2114 O GLU A 140 0.793 -4.346 -7.707 1.00 0.00 O ATOM 2115 CB GLU A 140 1.347 -5.288 -10.865 1.00 0.00 C ATOM 2116 CG GLU A 140 0.679 -5.544 -12.217 1.00 0.00 C ATOM 2117 CD GLU A 140 1.472 -6.489 -13.109 1.00 0.00 C ATOM 2118 OE1 GLU A 140 2.691 -6.270 -13.339 1.00 0.00 O ATOM 2119 OE2 GLU A 140 0.882 -7.463 -13.648 1.00 0.00 O ATOM 0 H GLU A 140 1.475 -2.930 -11.681 1.00 0.00 H new ATOM 0 HA GLU A 140 -0.290 -4.228 -9.895 1.00 0.00 H new ATOM 0 HB2 GLU A 140 2.416 -5.136 -11.016 1.00 0.00 H new ATOM 0 HB3 GLU A 140 1.237 -6.172 -10.237 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -0.315 -5.960 -12.051 1.00 0.00 H new ATOM 0 HG3 GLU A 140 0.545 -4.594 -12.734 1.00 0.00 H new ATOM 2126 N PHE A 141 2.306 -3.031 -8.743 1.00 0.00 N ATOM 2127 CA PHE A 141 3.064 -2.647 -7.593 1.00 0.00 C ATOM 2128 C PHE A 141 2.332 -1.735 -6.670 1.00 0.00 C ATOM 2129 O PHE A 141 2.392 -1.970 -5.465 1.00 0.00 O ATOM 2130 CB PHE A 141 4.346 -1.919 -8.029 1.00 0.00 C ATOM 2131 CG PHE A 141 5.329 -1.666 -6.938 1.00 0.00 C ATOM 2132 CD1 PHE A 141 6.008 -2.686 -6.315 1.00 0.00 C ATOM 2133 CD2 PHE A 141 5.561 -0.402 -6.446 1.00 0.00 C ATOM 2134 CE1 PHE A 141 7.022 -2.463 -5.412 1.00 0.00 C ATOM 2135 CE2 PHE A 141 6.538 -0.086 -5.532 1.00 0.00 C ATOM 2136 CZ PHE A 141 7.241 -1.159 -5.037 1.00 0.00 C ATOM 0 H PHE A 141 2.615 -2.558 -9.593 1.00 0.00 H new ATOM 0 HA PHE A 141 3.277 -3.574 -7.061 1.00 0.00 H new ATOM 0 HB2 PHE A 141 4.833 -2.507 -8.807 1.00 0.00 H new ATOM 0 HB3 PHE A 141 4.069 -0.965 -8.477 1.00 0.00 H new ATOM 0 HD1 PHE A 141 5.734 -3.705 -6.544 1.00 0.00 H new ATOM 0 HD2 PHE A 141 4.931 0.399 -6.803 1.00 0.00 H new ATOM 0 HE1 PHE A 141 7.617 -3.273 -5.017 1.00 0.00 H new ATOM 0 HE2 PHE A 141 6.739 0.930 -5.225 1.00 0.00 H new ATOM 0 HZ PHE A 141 8.014 -0.965 -4.308 1.00 0.00 H new ATOM 2146 N VAL A 142 1.556 -0.737 -7.131 1.00 0.00 N ATOM 2147 CA VAL A 142 0.776 0.065 -6.240 1.00 0.00 C ATOM 2148 C VAL A 142 -0.186 -0.691 -5.391 1.00 0.00 C ATOM 2149 O VAL A 142 -0.178 -0.633 -4.162 1.00 0.00 O ATOM 2150 CB VAL A 142 0.013 1.201 -6.855 1.00 0.00 C ATOM 2151 CG1 VAL A 142 0.933 2.434 -6.865 1.00 0.00 C ATOM 2152 CG2 VAL A 142 -0.584 1.069 -8.266 1.00 0.00 C ATOM 0 H VAL A 142 1.469 -0.486 -8.116 1.00 0.00 H new ATOM 0 HA VAL A 142 1.580 0.476 -5.629 1.00 0.00 H new ATOM 0 HB VAL A 142 -0.872 1.252 -6.221 1.00 0.00 H new ATOM 0 HG11 VAL A 142 0.405 3.279 -7.308 1.00 0.00 H new ATOM 0 HG12 VAL A 142 1.221 2.681 -5.843 1.00 0.00 H new ATOM 0 HG13 VAL A 142 1.826 2.217 -7.451 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -1.097 1.993 -8.532 1.00 0.00 H new ATOM 0 HG22 VAL A 142 0.215 0.878 -8.983 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -1.294 0.242 -8.285 1.00 0.00 H new ATOM 2162 N GLN A 143 -0.919 -1.586 -6.076 1.00 0.00 N ATOM 2163 CA GLN A 143 -1.905 -2.507 -5.602 1.00 0.00 C ATOM 2164 C GLN A 143 -1.301 -3.468 -4.636 1.00 0.00 C ATOM 2165 O GLN A 143 -1.827 -3.655 -3.540 1.00 0.00 O ATOM 2166 CB GLN A 143 -2.619 -3.307 -6.704 1.00 0.00 C ATOM 2167 CG GLN A 143 -3.235 -2.353 -7.730 1.00 0.00 C ATOM 2168 CD GLN A 143 -4.099 -3.089 -8.744 1.00 0.00 C ATOM 2169 OE1 GLN A 143 -5.078 -3.762 -8.421 1.00 0.00 O ATOM 2170 NE2 GLN A 143 -3.786 -2.940 -10.059 1.00 0.00 N ATOM 0 H GLN A 143 -0.803 -1.671 -7.086 1.00 0.00 H new ATOM 0 HA GLN A 143 -2.660 -1.883 -5.123 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -1.912 -3.975 -7.196 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -3.396 -3.933 -6.265 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -3.838 -1.606 -7.214 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -2.441 -1.818 -8.251 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -2.976 -2.383 -10.330 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -4.362 -3.385 -10.774 1.00 0.00 H new ATOM 2179 N MET A 144 -0.094 -3.980 -4.935 1.00 0.00 N ATOM 2180 CA MET A 144 0.707 -4.805 -4.085 1.00 0.00 C ATOM 2181 C MET A 144 1.120 -4.147 -2.813 1.00 0.00 C ATOM 2182 O MET A 144 0.962 -4.710 -1.731 1.00 0.00 O ATOM 2183 CB MET A 144 1.889 -5.363 -4.894 1.00 0.00 C ATOM 2184 CG MET A 144 2.695 -6.516 -4.291 1.00 0.00 C ATOM 2185 SD MET A 144 4.178 -6.805 -5.302 1.00 0.00 S ATOM 2186 CE MET A 144 5.205 -5.455 -4.653 1.00 0.00 C ATOM 0 H MET A 144 0.353 -3.804 -5.835 1.00 0.00 H new ATOM 0 HA MET A 144 0.090 -5.637 -3.746 1.00 0.00 H new ATOM 0 HB2 MET A 144 1.506 -5.693 -5.860 1.00 0.00 H new ATOM 0 HB3 MET A 144 2.578 -4.541 -5.089 1.00 0.00 H new ATOM 0 HG2 MET A 144 2.980 -6.279 -3.266 1.00 0.00 H new ATOM 0 HG3 MET A 144 2.086 -7.419 -4.252 1.00 0.00 H new ATOM 0 HE1 MET A 144 6.106 -5.359 -5.259 1.00 0.00 H new ATOM 0 HE2 MET A 144 4.643 -4.522 -4.688 1.00 0.00 H new ATOM 0 HE3 MET A 144 5.483 -5.673 -3.622 1.00 0.00 H new ATOM 2196 N MET A 145 1.623 -2.900 -2.846 1.00 0.00 N ATOM 2197 CA MET A 145 2.038 -2.148 -1.702 1.00 0.00 C ATOM 2198 C MET A 145 0.954 -1.704 -0.781 1.00 0.00 C ATOM 2199 O MET A 145 1.124 -1.619 0.434 1.00 0.00 O ATOM 2200 CB MET A 145 2.830 -0.924 -2.192 1.00 0.00 C ATOM 2201 CG MET A 145 4.146 -1.475 -2.747 1.00 0.00 C ATOM 2202 SD MET A 145 5.631 -1.526 -1.700 1.00 0.00 S ATOM 2203 CE MET A 145 5.728 0.276 -1.501 1.00 0.00 C ATOM 0 H MET A 145 1.747 -2.388 -3.720 1.00 0.00 H new ATOM 0 HA MET A 145 2.641 -2.830 -1.102 1.00 0.00 H new ATOM 0 HB2 MET A 145 2.278 -0.383 -2.960 1.00 0.00 H new ATOM 0 HB3 MET A 145 3.012 -0.224 -1.377 1.00 0.00 H new ATOM 0 HG2 MET A 145 3.953 -2.494 -3.084 1.00 0.00 H new ATOM 0 HG3 MET A 145 4.394 -0.888 -3.631 1.00 0.00 H new ATOM 0 HE1 MET A 145 6.773 0.580 -1.445 1.00 0.00 H new ATOM 0 HE2 MET A 145 5.254 0.762 -2.354 1.00 0.00 H new ATOM 0 HE3 MET A 145 5.215 0.569 -0.585 1.00 0.00 H new