USER MOD reduce.3.24.130724 H: found=0, std=0, add=1059, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1058 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 18 SER OG : rot -89:sc= 1.15 USER MOD Set 1.2: A 19 ASN : amide:sc= -0.86 X(o=0.29,f=0.32) USER MOD Single : A 16 THR OG1 : rot -154:sc= -0.569 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 MET CE :methyl -143:sc= -4.72! (180deg=-8.13!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 TYR OH : rot 130:sc= -0.0507 USER MOD Single : A 38 HIS : no HD1:sc= 0.0326 K(o=0.033,f=-1.1) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.303 USER MOD Single : A 51 HIS : no HD1:sc= -2.55 K(o=-2.6,f=-6.6!) USER MOD Single : A 59 SER OG : rot 91:sc= 0.495 USER MOD Single : A 63 GLN : amide:sc= -0.402 K(o=-0.4,f=-2.1!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.134) USER MOD Single : A 70 SER OG : rot 41:sc= 1.28 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0.133 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0.225 K(o=0.23,f=-4.1!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 151:sc= 0.337 USER MOD Single : A 104 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 LYS NZ :NH3+ -156:sc= 0 (180deg=-0.0139) USER MOD Single : A 114 MET CE :methyl 172:sc= -2.28! (180deg=-2.45!) USER MOD Single : A 119 SER OG : rot -30:sc= 0.198 USER MOD Single : A 120 ASN : amide:sc= -0.805 K(o=-0.81,f=-1.5) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 CYS SG : rot 180:sc= -0.224 USER MOD Single : A 126 CYS SG : rot 93:sc= -0.667 USER MOD Single : A 127 ASN : amide:sc= -0.0735 X(o=-0.073,f=-0.55) USER MOD Single : A 135 LYS NZ :NH3+ -151:sc= -0.0751 (180deg=-0.488) USER MOD Single : A 136 ASN : amide:sc=-0.000631 X(o=-0.00063,f=-0.31) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 35:sc= 0.492 USER MOD Single : A 144 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 SER OG : rot 180:sc= -2.04! USER MOD Single : A 150 CYS SG : rot -121:sc= 0.292 USER MOD ----------------------------------------------------------------- ATOM 87 N ASP A 9 -6.084 -9.607 10.102 1.00 0.00 N ATOM 88 CA ASP A 9 -7.116 -8.642 10.463 1.00 0.00 C ATOM 89 C ASP A 9 -8.081 -8.421 9.303 1.00 0.00 C ATOM 90 O ASP A 9 -7.663 -8.135 8.181 1.00 0.00 O ATOM 91 CB ASP A 9 -6.479 -7.314 10.874 1.00 0.00 C ATOM 92 CG ASP A 9 -7.210 -6.657 12.029 1.00 0.00 C ATOM 93 OD1 ASP A 9 -7.813 -7.387 12.842 1.00 0.00 O ATOM 94 OD2 ASP A 9 -7.178 -5.412 12.120 1.00 0.00 O ATOM 0 HA ASP A 9 -7.677 -9.043 11.307 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -5.440 -7.484 11.155 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -6.472 -6.637 10.020 1.00 0.00 H new ATOM 99 N ILE A 10 -9.373 -8.553 9.581 1.00 0.00 N ATOM 100 CA ILE A 10 -10.399 -8.367 8.562 1.00 0.00 C ATOM 101 C ILE A 10 -11.444 -7.352 9.014 1.00 0.00 C ATOM 102 O ILE A 10 -11.896 -7.379 10.159 1.00 0.00 O ATOM 103 CB ILE A 10 -11.097 -9.698 8.219 1.00 0.00 C ATOM 104 CG1 ILE A 10 -12.096 -9.501 7.076 1.00 0.00 C ATOM 105 CG2 ILE A 10 -11.795 -10.266 9.446 1.00 0.00 C ATOM 106 CD1 ILE A 10 -12.122 -10.649 6.090 1.00 0.00 C ATOM 0 H ILE A 10 -9.735 -8.788 10.505 1.00 0.00 H new ATOM 0 HA ILE A 10 -9.898 -7.991 7.670 1.00 0.00 H new ATOM 0 HB ILE A 10 -10.339 -10.410 7.894 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -13.094 -9.370 7.495 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -11.850 -8.582 6.544 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.282 -11.205 9.185 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.061 -10.444 10.232 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -12.542 -9.556 9.801 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -12.852 -10.441 5.308 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -11.135 -10.767 5.643 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -12.398 -11.568 6.608 1.00 0.00 H new ATOM 118 N VAL A 11 -11.824 -6.459 8.106 1.00 0.00 N ATOM 119 CA VAL A 11 -12.817 -5.435 8.411 1.00 0.00 C ATOM 120 C VAL A 11 -13.859 -5.334 7.303 1.00 0.00 C ATOM 121 O VAL A 11 -13.644 -4.665 6.293 1.00 0.00 O ATOM 122 CB VAL A 11 -12.160 -4.056 8.610 1.00 0.00 C ATOM 123 CG1 VAL A 11 -13.178 -3.049 9.122 1.00 0.00 C ATOM 124 CG2 VAL A 11 -10.977 -4.160 9.561 1.00 0.00 C ATOM 0 H VAL A 11 -11.460 -6.424 7.154 1.00 0.00 H new ATOM 0 HA VAL A 11 -13.304 -5.733 9.339 1.00 0.00 H new ATOM 0 HB VAL A 11 -11.791 -3.707 7.646 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -12.696 -2.081 9.257 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -13.990 -2.953 8.401 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -13.579 -3.390 10.076 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -10.526 -3.176 9.689 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -11.318 -4.531 10.527 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -10.238 -4.847 9.149 1.00 0.00 H new ATOM 134 N GLY A 12 -14.991 -6.004 7.499 1.00 0.00 N ATOM 135 CA GLY A 12 -16.050 -5.977 6.507 1.00 0.00 C ATOM 136 C GLY A 12 -15.653 -6.668 5.218 1.00 0.00 C ATOM 137 O GLY A 12 -15.934 -7.851 5.028 1.00 0.00 O ATOM 0 H GLY A 12 -15.193 -6.565 8.327 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -16.939 -6.458 6.915 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -16.318 -4.942 6.294 1.00 0.00 H new ATOM 141 N ILE A 13 -14.998 -5.928 4.329 1.00 0.00 N ATOM 142 CA ILE A 13 -14.561 -6.476 3.051 1.00 0.00 C ATOM 143 C ILE A 13 -13.095 -6.150 2.785 1.00 0.00 C ATOM 144 O ILE A 13 -12.681 -6.000 1.636 1.00 0.00 O ATOM 145 CB ILE A 13 -15.414 -5.936 1.886 1.00 0.00 C ATOM 146 CG1 ILE A 13 -15.402 -4.404 1.881 1.00 0.00 C ATOM 147 CG2 ILE A 13 -16.839 -6.462 1.986 1.00 0.00 C ATOM 148 CD1 ILE A 13 -15.058 -3.810 0.532 1.00 0.00 C ATOM 0 H ILE A 13 -14.758 -4.947 4.471 1.00 0.00 H new ATOM 0 HA ILE A 13 -14.685 -7.557 3.112 1.00 0.00 H new ATOM 0 HB ILE A 13 -14.984 -6.285 0.947 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -16.381 -4.039 2.191 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -14.682 -4.051 2.619 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -17.430 -6.072 1.157 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -16.829 -7.551 1.944 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -17.281 -6.140 2.929 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -15.068 -2.722 0.600 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -14.066 -4.146 0.229 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -15.792 -4.134 -0.206 1.00 0.00 H new ATOM 160 N TRP A 14 -12.316 -6.044 3.856 1.00 0.00 N ATOM 161 CA TRP A 14 -10.894 -5.737 3.739 1.00 0.00 C ATOM 162 C TRP A 14 -10.066 -6.643 4.645 1.00 0.00 C ATOM 163 O TRP A 14 -10.489 -6.989 5.748 1.00 0.00 O ATOM 164 CB TRP A 14 -10.636 -4.272 4.092 1.00 0.00 C ATOM 165 CG TRP A 14 -11.329 -3.308 3.177 1.00 0.00 C ATOM 166 CD1 TRP A 14 -12.607 -2.842 3.293 1.00 0.00 C ATOM 167 CD2 TRP A 14 -10.782 -2.694 2.004 1.00 0.00 C ATOM 168 NE1 TRP A 14 -12.888 -1.976 2.265 1.00 0.00 N ATOM 169 CE2 TRP A 14 -11.783 -1.868 1.460 1.00 0.00 C ATOM 170 CE3 TRP A 14 -9.542 -2.762 1.363 1.00 0.00 C ATOM 171 CZ2 TRP A 14 -11.582 -1.116 0.306 1.00 0.00 C ATOM 172 CZ3 TRP A 14 -9.344 -2.016 0.217 1.00 0.00 C ATOM 173 CH2 TRP A 14 -10.359 -1.202 -0.301 1.00 0.00 C ATOM 0 H TRP A 14 -12.644 -6.166 4.814 1.00 0.00 H new ATOM 0 HA TRP A 14 -10.594 -5.913 2.706 1.00 0.00 H new ATOM 0 HB2 TRP A 14 -10.964 -4.090 5.115 1.00 0.00 H new ATOM 0 HB3 TRP A 14 -9.563 -4.082 4.062 1.00 0.00 H new ATOM 0 HD1 TRP A 14 -13.296 -3.115 4.078 1.00 0.00 H new ATOM 0 HE1 TRP A 14 -13.774 -1.492 2.123 1.00 0.00 H new ATOM 0 HE3 TRP A 14 -8.753 -3.386 1.756 1.00 0.00 H new ATOM 0 HZ2 TRP A 14 -12.363 -0.488 -0.096 1.00 0.00 H new ATOM 0 HZ3 TRP A 14 -8.390 -2.061 -0.288 1.00 0.00 H new ATOM 0 HH2 TRP A 14 -10.172 -0.630 -1.198 1.00 0.00 H new ATOM 184 N TRP A 15 -8.885 -7.024 4.171 1.00 0.00 N ATOM 185 CA TRP A 15 -7.997 -7.891 4.938 1.00 0.00 C ATOM 186 C TRP A 15 -6.546 -7.440 4.802 1.00 0.00 C ATOM 187 O TRP A 15 -6.083 -7.128 3.704 1.00 0.00 O ATOM 188 CB TRP A 15 -8.139 -9.341 4.474 1.00 0.00 C ATOM 189 CG TRP A 15 -8.040 -9.501 2.987 1.00 0.00 C ATOM 190 CD1 TRP A 15 -9.070 -9.482 2.091 1.00 0.00 C ATOM 191 CD2 TRP A 15 -6.846 -9.705 2.223 1.00 0.00 C ATOM 192 NE1 TRP A 15 -8.589 -9.662 0.817 1.00 0.00 N ATOM 193 CE2 TRP A 15 -7.227 -9.801 0.872 1.00 0.00 C ATOM 194 CE3 TRP A 15 -5.492 -9.815 2.552 1.00 0.00 C ATOM 195 CZ2 TRP A 15 -6.302 -10.002 -0.150 1.00 0.00 C ATOM 196 CZ3 TRP A 15 -4.575 -10.014 1.536 1.00 0.00 C ATOM 197 CH2 TRP A 15 -4.983 -10.105 0.200 1.00 0.00 C ATOM 0 H TRP A 15 -8.520 -6.747 3.260 1.00 0.00 H new ATOM 0 HA TRP A 15 -8.282 -7.824 5.988 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -7.366 -9.945 4.949 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -9.100 -9.730 4.811 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -10.110 -9.345 2.346 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -9.154 -9.688 -0.032 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -5.168 -9.746 3.580 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.614 -10.074 -1.181 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -3.526 -10.101 1.778 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -4.242 -10.260 -0.570 1.00 0.00 H new ATOM 208 N THR A 16 -5.834 -7.408 5.923 1.00 0.00 N ATOM 209 CA THR A 16 -4.435 -6.996 5.928 1.00 0.00 C ATOM 210 C THR A 16 -3.555 -8.044 5.254 1.00 0.00 C ATOM 211 O THR A 16 -3.791 -9.245 5.387 1.00 0.00 O ATOM 212 CB THR A 16 -3.958 -6.759 7.362 1.00 0.00 C ATOM 213 OG1 THR A 16 -5.052 -6.472 8.214 1.00 0.00 O ATOM 214 CG2 THR A 16 -2.970 -5.618 7.483 1.00 0.00 C ATOM 0 H THR A 16 -6.202 -7.662 6.840 1.00 0.00 H new ATOM 0 HA THR A 16 -4.354 -6.066 5.366 1.00 0.00 H new ATOM 0 HB THR A 16 -3.460 -7.683 7.657 1.00 0.00 H new ATOM 0 HG1 THR A 16 -4.742 -5.938 8.976 1.00 0.00 H new ATOM 0 HG21 THR A 16 -2.672 -5.504 8.525 1.00 0.00 H new ATOM 0 HG22 THR A 16 -2.091 -5.832 6.876 1.00 0.00 H new ATOM 0 HG23 THR A 16 -3.435 -4.696 7.135 1.00 0.00 H new ATOM 222 N VAL A 17 -2.540 -7.581 4.532 1.00 0.00 N ATOM 223 CA VAL A 17 -1.625 -8.479 3.839 1.00 0.00 C ATOM 224 C VAL A 17 -0.563 -9.021 4.789 1.00 0.00 C ATOM 225 O VAL A 17 -0.436 -8.558 5.922 1.00 0.00 O ATOM 226 CB VAL A 17 -0.930 -7.772 2.660 1.00 0.00 C ATOM 227 CG1 VAL A 17 -1.941 -7.402 1.586 1.00 0.00 C ATOM 228 CG2 VAL A 17 -0.180 -6.539 3.144 1.00 0.00 C ATOM 0 H VAL A 17 -2.331 -6.590 4.412 1.00 0.00 H new ATOM 0 HA VAL A 17 -2.223 -9.306 3.456 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.207 -8.461 2.223 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.430 -6.904 0.762 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.428 -8.305 1.218 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -2.690 -6.732 2.007 1.00 0.00 H new ATOM 0 HG21 VAL A 17 0.305 -6.052 2.298 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -0.881 -5.846 3.608 1.00 0.00 H new ATOM 0 HG23 VAL A 17 0.574 -6.835 3.873 1.00 0.00 H new ATOM 238 N SER A 18 0.198 -10.004 4.319 1.00 0.00 N ATOM 239 CA SER A 18 1.250 -10.610 5.126 1.00 0.00 C ATOM 240 C SER A 18 2.581 -10.600 4.382 1.00 0.00 C ATOM 241 O SER A 18 3.619 -10.256 4.948 1.00 0.00 O ATOM 242 CB SER A 18 0.873 -12.044 5.501 1.00 0.00 C ATOM 243 OG SER A 18 0.689 -12.842 4.344 1.00 0.00 O ATOM 0 H SER A 18 0.105 -10.398 3.383 1.00 0.00 H new ATOM 0 HA SER A 18 1.359 -10.021 6.036 1.00 0.00 H new ATOM 0 HB2 SER A 18 1.654 -12.477 6.125 1.00 0.00 H new ATOM 0 HB3 SER A 18 -0.042 -12.040 6.093 1.00 0.00 H new ATOM 0 HG SER A 18 -0.245 -12.786 4.053 1.00 0.00 H new ATOM 249 N ASN A 19 2.544 -10.979 3.109 1.00 0.00 N ATOM 250 CA ASN A 19 3.747 -11.015 2.286 1.00 0.00 C ATOM 251 C ASN A 19 3.526 -10.284 0.965 1.00 0.00 C ATOM 252 O ASN A 19 2.411 -9.861 0.658 1.00 0.00 O ATOM 253 CB ASN A 19 4.169 -12.462 2.018 1.00 0.00 C ATOM 254 CG ASN A 19 2.992 -13.360 1.685 1.00 0.00 C ATOM 255 OD1 ASN A 19 2.443 -14.032 2.559 1.00 0.00 O ATOM 256 ND2 ASN A 19 2.598 -13.375 0.418 1.00 0.00 N ATOM 0 H ASN A 19 1.693 -11.266 2.625 1.00 0.00 H new ATOM 0 HA ASN A 19 4.543 -10.509 2.832 1.00 0.00 H new ATOM 0 HB2 ASN A 19 4.882 -12.482 1.193 1.00 0.00 H new ATOM 0 HB3 ASN A 19 4.685 -12.855 2.894 1.00 0.00 H new ATOM 0 HD21 ASN A 19 1.811 -13.959 0.135 1.00 0.00 H new ATOM 0 HD22 ASN A 19 3.082 -12.802 -0.273 1.00 0.00 H new ATOM 263 N PHE A 20 4.595 -10.138 0.189 1.00 0.00 N ATOM 264 CA PHE A 20 4.519 -9.456 -1.098 1.00 0.00 C ATOM 265 C PHE A 20 3.534 -10.156 -2.030 1.00 0.00 C ATOM 266 O PHE A 20 2.718 -9.509 -2.687 1.00 0.00 O ATOM 267 CB PHE A 20 5.902 -9.398 -1.750 1.00 0.00 C ATOM 268 CG PHE A 20 6.010 -8.368 -2.837 1.00 0.00 C ATOM 269 CD1 PHE A 20 6.169 -7.027 -2.527 1.00 0.00 C ATOM 270 CD2 PHE A 20 5.952 -8.740 -4.171 1.00 0.00 C ATOM 271 CE1 PHE A 20 6.269 -6.077 -3.525 1.00 0.00 C ATOM 272 CE2 PHE A 20 6.050 -7.794 -5.174 1.00 0.00 C ATOM 273 CZ PHE A 20 6.209 -6.461 -4.850 1.00 0.00 C ATOM 0 H PHE A 20 5.524 -10.483 0.429 1.00 0.00 H new ATOM 0 HA PHE A 20 4.164 -8.441 -0.921 1.00 0.00 H new ATOM 0 HB2 PHE A 20 6.647 -9.185 -0.984 1.00 0.00 H new ATOM 0 HB3 PHE A 20 6.141 -10.378 -2.164 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.215 -6.721 -1.492 1.00 0.00 H new ATOM 0 HD2 PHE A 20 5.829 -9.781 -4.430 1.00 0.00 H new ATOM 0 HE1 PHE A 20 6.394 -5.035 -3.269 1.00 0.00 H new ATOM 0 HE2 PHE A 20 6.002 -8.097 -6.210 1.00 0.00 H new ATOM 0 HZ PHE A 20 6.286 -5.720 -5.632 1.00 0.00 H new ATOM 283 N GLY A 21 3.617 -11.482 -2.083 1.00 0.00 N ATOM 284 CA GLY A 21 2.729 -12.248 -2.938 1.00 0.00 C ATOM 285 C GLY A 21 1.264 -11.984 -2.644 1.00 0.00 C ATOM 286 O GLY A 21 0.411 -12.138 -3.519 1.00 0.00 O ATOM 0 H GLY A 21 4.284 -12.039 -1.549 1.00 0.00 H new ATOM 0 HA2 GLY A 21 2.936 -12.006 -3.980 1.00 0.00 H new ATOM 0 HA3 GLY A 21 2.935 -13.311 -2.811 1.00 0.00 H new ATOM 290 N GLU A 22 0.971 -11.585 -1.410 1.00 0.00 N ATOM 291 CA GLU A 22 -0.400 -11.300 -1.005 1.00 0.00 C ATOM 292 C GLU A 22 -0.880 -9.979 -1.597 1.00 0.00 C ATOM 293 O GLU A 22 -2.053 -9.831 -1.940 1.00 0.00 O ATOM 294 CB GLU A 22 -0.504 -11.257 0.521 1.00 0.00 C ATOM 295 CG GLU A 22 -0.645 -12.630 1.159 1.00 0.00 C ATOM 296 CD GLU A 22 -1.858 -12.733 2.063 1.00 0.00 C ATOM 297 OE1 GLU A 22 -2.992 -12.611 1.551 1.00 0.00 O ATOM 298 OE2 GLU A 22 -1.676 -12.935 3.282 1.00 0.00 O ATOM 0 H GLU A 22 1.665 -11.452 -0.674 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.038 -12.099 -1.384 1.00 0.00 H new ATOM 0 HB2 GLU A 22 0.383 -10.767 0.924 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -1.361 -10.645 0.802 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -0.716 -13.385 0.376 1.00 0.00 H new ATOM 0 HG3 GLU A 22 0.253 -12.852 1.736 1.00 0.00 H new ATOM 305 N ILE A 23 0.034 -9.020 -1.712 1.00 0.00 N ATOM 306 CA ILE A 23 -0.298 -7.711 -2.261 1.00 0.00 C ATOM 307 C ILE A 23 -0.452 -7.775 -3.777 1.00 0.00 C ATOM 308 O ILE A 23 0.517 -8.009 -4.500 1.00 0.00 O ATOM 309 CB ILE A 23 0.778 -6.665 -1.909 1.00 0.00 C ATOM 310 CG1 ILE A 23 1.101 -6.717 -0.415 1.00 0.00 C ATOM 311 CG2 ILE A 23 0.314 -5.273 -2.310 1.00 0.00 C ATOM 312 CD1 ILE A 23 2.182 -5.744 0.003 1.00 0.00 C ATOM 0 H ILE A 23 1.009 -9.125 -1.432 1.00 0.00 H new ATOM 0 HA ILE A 23 -1.246 -7.411 -1.814 1.00 0.00 H new ATOM 0 HB ILE A 23 1.686 -6.897 -2.465 1.00 0.00 H new ATOM 0 HG12 ILE A 23 0.194 -6.506 0.152 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.413 -7.728 -0.154 1.00 0.00 H new ATOM 0 HG21 ILE A 23 1.084 -4.545 -2.055 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.130 -5.246 -3.384 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -0.606 -5.029 -1.779 1.00 0.00 H new ATOM 0 HD11 ILE A 23 2.359 -5.835 1.075 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.102 -5.968 -0.537 1.00 0.00 H new ATOM 0 HD13 ILE A 23 1.865 -4.727 -0.227 1.00 0.00 H new ATOM 324 N SER A 24 -1.675 -7.564 -4.251 1.00 0.00 N ATOM 325 CA SER A 24 -1.956 -7.597 -5.682 1.00 0.00 C ATOM 326 C SER A 24 -3.364 -7.087 -5.971 1.00 0.00 C ATOM 327 O SER A 24 -4.344 -7.814 -5.810 1.00 0.00 O ATOM 328 CB SER A 24 -1.795 -9.018 -6.222 1.00 0.00 C ATOM 329 OG SER A 24 -1.241 -9.010 -7.526 1.00 0.00 O ATOM 0 H SER A 24 -2.487 -7.368 -3.666 1.00 0.00 H new ATOM 0 HA SER A 24 -1.242 -6.943 -6.183 1.00 0.00 H new ATOM 0 HB2 SER A 24 -1.153 -9.593 -5.555 1.00 0.00 H new ATOM 0 HB3 SER A 24 -2.765 -9.516 -6.239 1.00 0.00 H new ATOM 0 HG SER A 24 -1.147 -9.931 -7.847 1.00 0.00 H new ATOM 335 N GLY A 25 -3.457 -5.831 -6.398 1.00 0.00 N ATOM 336 CA GLY A 25 -4.749 -5.244 -6.703 1.00 0.00 C ATOM 337 C GLY A 25 -5.021 -3.992 -5.893 1.00 0.00 C ATOM 338 O GLY A 25 -4.100 -3.246 -5.563 1.00 0.00 O ATOM 0 H GLY A 25 -2.660 -5.210 -6.538 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.794 -5.003 -7.765 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -5.533 -5.976 -6.509 1.00 0.00 H new ATOM 342 N THR A 26 -6.291 -3.761 -5.573 1.00 0.00 N ATOM 343 CA THR A 26 -6.681 -2.590 -4.796 1.00 0.00 C ATOM 344 C THR A 26 -6.382 -2.797 -3.314 1.00 0.00 C ATOM 345 O THR A 26 -6.799 -3.790 -2.719 1.00 0.00 O ATOM 346 CB THR A 26 -8.170 -2.297 -4.991 1.00 0.00 C ATOM 347 OG1 THR A 26 -8.501 -2.276 -6.367 1.00 0.00 O ATOM 348 CG2 THR A 26 -8.602 -0.976 -4.393 1.00 0.00 C ATOM 0 H THR A 26 -7.066 -4.368 -5.839 1.00 0.00 H new ATOM 0 HA THR A 26 -6.100 -1.739 -5.150 1.00 0.00 H new ATOM 0 HB THR A 26 -8.693 -3.100 -4.473 1.00 0.00 H new ATOM 0 HG1 THR A 26 -9.457 -2.089 -6.471 1.00 0.00 H new ATOM 0 HG21 THR A 26 -9.668 -0.830 -4.566 1.00 0.00 H new ATOM 0 HG22 THR A 26 -8.406 -0.980 -3.321 1.00 0.00 H new ATOM 0 HG23 THR A 26 -8.044 -0.165 -4.861 1.00 0.00 H new ATOM 356 N ILE A 27 -5.657 -1.851 -2.725 1.00 0.00 N ATOM 357 CA ILE A 27 -5.303 -1.930 -1.313 1.00 0.00 C ATOM 358 C ILE A 27 -5.362 -0.556 -0.653 1.00 0.00 C ATOM 359 O ILE A 27 -5.090 0.461 -1.289 1.00 0.00 O ATOM 360 CB ILE A 27 -3.894 -2.528 -1.116 1.00 0.00 C ATOM 361 CG1 ILE A 27 -2.827 -1.612 -1.723 1.00 0.00 C ATOM 362 CG2 ILE A 27 -3.819 -3.921 -1.726 1.00 0.00 C ATOM 363 CD1 ILE A 27 -2.903 -1.500 -3.230 1.00 0.00 C ATOM 0 H ILE A 27 -5.304 -1.022 -3.203 1.00 0.00 H new ATOM 0 HA ILE A 27 -6.034 -2.587 -0.841 1.00 0.00 H new ATOM 0 HB ILE A 27 -3.701 -2.610 -0.046 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -2.926 -0.617 -1.289 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -1.841 -1.984 -1.445 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.819 -4.329 -1.579 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.550 -4.569 -1.243 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -4.034 -3.863 -2.793 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -2.116 -0.835 -3.586 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -2.773 -2.486 -3.675 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -3.875 -1.098 -3.516 1.00 0.00 H new ATOM 375 N ALA A 28 -5.717 -0.536 0.628 1.00 0.00 N ATOM 376 CA ALA A 28 -5.812 0.712 1.376 1.00 0.00 C ATOM 377 C ALA A 28 -4.848 0.717 2.557 1.00 0.00 C ATOM 378 O ALA A 28 -4.765 -0.255 3.307 1.00 0.00 O ATOM 379 CB ALA A 28 -7.238 0.933 1.855 1.00 0.00 C ATOM 0 H ALA A 28 -5.944 -1.370 1.169 1.00 0.00 H new ATOM 0 HA ALA A 28 -5.534 1.529 0.710 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.294 1.868 2.412 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -7.907 0.982 0.996 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.537 0.108 2.501 1.00 0.00 H new ATOM 385 N ILE A 29 -4.121 1.818 2.716 1.00 0.00 N ATOM 386 CA ILE A 29 -3.162 1.950 3.807 1.00 0.00 C ATOM 387 C ILE A 29 -3.647 2.951 4.850 1.00 0.00 C ATOM 388 O ILE A 29 -3.993 4.085 4.522 1.00 0.00 O ATOM 389 CB ILE A 29 -1.779 2.393 3.291 1.00 0.00 C ATOM 390 CG1 ILE A 29 -1.363 1.546 2.087 1.00 0.00 C ATOM 391 CG2 ILE A 29 -0.743 2.296 4.401 1.00 0.00 C ATOM 392 CD1 ILE A 29 -1.623 2.220 0.756 1.00 0.00 C ATOM 0 H ILE A 29 -4.178 2.632 2.103 1.00 0.00 H new ATOM 0 HA ILE A 29 -3.072 0.966 4.267 1.00 0.00 H new ATOM 0 HB ILE A 29 -1.843 3.433 2.972 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.301 1.313 2.166 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -1.900 0.598 2.116 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.228 2.612 4.021 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -1.036 2.941 5.229 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -0.678 1.265 4.749 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -1.304 1.563 -0.053 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -2.688 2.429 0.656 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -1.064 3.154 0.706 1.00 0.00 H new ATOM 404 N GLU A 30 -3.671 2.521 6.108 1.00 0.00 N ATOM 405 CA GLU A 30 -4.113 3.381 7.199 1.00 0.00 C ATOM 406 C GLU A 30 -2.927 3.859 8.030 1.00 0.00 C ATOM 407 O GLU A 30 -2.319 3.082 8.766 1.00 0.00 O ATOM 408 CB GLU A 30 -5.109 2.636 8.090 1.00 0.00 C ATOM 409 CG GLU A 30 -5.850 3.540 9.062 1.00 0.00 C ATOM 410 CD GLU A 30 -6.356 2.794 10.281 1.00 0.00 C ATOM 411 OE1 GLU A 30 -5.523 2.402 11.126 1.00 0.00 O ATOM 412 OE2 GLU A 30 -7.585 2.602 10.393 1.00 0.00 O ATOM 0 H GLU A 30 -3.390 1.584 6.396 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.604 4.253 6.766 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.835 2.122 7.459 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -4.577 1.869 8.653 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -5.187 4.344 9.382 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -6.692 4.005 8.550 1.00 0.00 H new ATOM 419 N MET A 31 -2.605 5.142 7.908 1.00 0.00 N ATOM 420 CA MET A 31 -1.491 5.724 8.648 1.00 0.00 C ATOM 421 C MET A 31 -1.903 6.059 10.078 1.00 0.00 C ATOM 422 O MET A 31 -1.429 5.440 11.032 1.00 0.00 O ATOM 423 CB MET A 31 -0.986 6.984 7.943 1.00 0.00 C ATOM 424 CG MET A 31 -0.519 6.737 6.517 1.00 0.00 C ATOM 425 SD MET A 31 0.075 8.237 5.711 1.00 0.00 S ATOM 426 CE MET A 31 1.715 7.722 5.205 1.00 0.00 C ATOM 0 H MET A 31 -3.099 5.799 7.304 1.00 0.00 H new ATOM 0 HA MET A 31 -0.687 4.988 8.683 1.00 0.00 H new ATOM 0 HB2 MET A 31 -1.782 7.728 7.932 1.00 0.00 H new ATOM 0 HB3 MET A 31 -0.162 7.407 8.518 1.00 0.00 H new ATOM 0 HG2 MET A 31 0.277 5.993 6.523 1.00 0.00 H new ATOM 0 HG3 MET A 31 -1.341 6.319 5.937 1.00 0.00 H new ATOM 0 HE1 MET A 31 2.408 8.557 5.312 1.00 0.00 H new ATOM 0 HE2 MET A 31 2.045 6.893 5.831 1.00 0.00 H new ATOM 0 HE3 MET A 31 1.691 7.402 4.163 1.00 0.00 H new ATOM 436 N ASP A 32 -2.788 7.040 10.219 1.00 0.00 N ATOM 437 CA ASP A 32 -3.263 7.457 11.534 1.00 0.00 C ATOM 438 C ASP A 32 -4.200 6.411 12.130 1.00 0.00 C ATOM 439 O ASP A 32 -4.495 5.395 11.499 1.00 0.00 O ATOM 440 CB ASP A 32 -3.977 8.808 11.435 1.00 0.00 C ATOM 441 CG ASP A 32 -3.367 9.852 12.351 1.00 0.00 C ATOM 442 OD1 ASP A 32 -2.157 9.751 12.642 1.00 0.00 O ATOM 443 OD2 ASP A 32 -4.100 10.768 12.778 1.00 0.00 O ATOM 0 H ASP A 32 -3.191 7.561 9.440 1.00 0.00 H new ATOM 0 HA ASP A 32 -2.400 7.559 12.192 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -3.936 9.163 10.405 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -5.030 8.679 11.686 1.00 0.00 H new ATOM 448 N LYS A 33 -4.665 6.667 13.349 1.00 0.00 N ATOM 449 CA LYS A 33 -5.568 5.747 14.030 1.00 0.00 C ATOM 450 C LYS A 33 -6.989 5.884 13.493 1.00 0.00 C ATOM 451 O LYS A 33 -7.812 6.605 14.060 1.00 0.00 O ATOM 452 CB LYS A 33 -5.550 6.007 15.539 1.00 0.00 C ATOM 453 CG LYS A 33 -4.921 4.881 16.342 1.00 0.00 C ATOM 454 CD LYS A 33 -5.963 3.871 16.796 1.00 0.00 C ATOM 455 CE LYS A 33 -6.642 3.201 15.613 1.00 0.00 C ATOM 456 NZ LYS A 33 -7.509 2.068 16.039 1.00 0.00 N ATOM 0 H LYS A 33 -4.431 7.503 13.884 1.00 0.00 H new ATOM 0 HA LYS A 33 -5.225 4.730 13.840 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -5.004 6.930 15.734 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.572 6.162 15.885 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.166 4.379 15.737 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -4.410 5.294 17.212 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -5.489 3.114 17.421 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -6.711 4.370 17.411 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -7.242 3.935 15.075 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -5.885 2.838 14.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -7.954 1.638 15.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -6.932 1.355 16.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -8.247 2.419 16.682 1.00 0.00 H new ATOM 470 N GLY A 34 -7.272 5.187 12.397 1.00 0.00 N ATOM 471 CA GLY A 34 -8.594 5.245 11.802 1.00 0.00 C ATOM 472 C GLY A 34 -8.617 6.045 10.515 1.00 0.00 C ATOM 473 O GLY A 34 -9.429 5.784 9.628 1.00 0.00 O ATOM 0 H GLY A 34 -6.609 4.583 11.911 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -8.944 4.232 11.603 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -9.290 5.688 12.514 1.00 0.00 H new ATOM 477 N ALA A 35 -7.723 7.025 10.414 1.00 0.00 N ATOM 478 CA ALA A 35 -7.644 7.866 9.226 1.00 0.00 C ATOM 479 C ALA A 35 -6.808 7.201 8.138 1.00 0.00 C ATOM 480 O ALA A 35 -5.929 6.389 8.426 1.00 0.00 O ATOM 481 CB ALA A 35 -7.064 9.227 9.582 1.00 0.00 C ATOM 0 H ALA A 35 -7.045 7.255 11.140 1.00 0.00 H new ATOM 0 HA ALA A 35 -8.654 8.003 8.839 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -7.010 9.845 8.686 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -7.702 9.713 10.320 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.063 9.099 9.995 1.00 0.00 H new ATOM 487 N TYR A 36 -7.089 7.550 6.886 1.00 0.00 N ATOM 488 CA TYR A 36 -6.364 6.985 5.754 1.00 0.00 C ATOM 489 C TYR A 36 -5.749 8.088 4.898 1.00 0.00 C ATOM 490 O TYR A 36 -5.911 9.273 5.185 1.00 0.00 O ATOM 491 CB TYR A 36 -7.297 6.122 4.903 1.00 0.00 C ATOM 492 CG TYR A 36 -7.938 4.987 5.669 1.00 0.00 C ATOM 493 CD1 TYR A 36 -9.072 5.200 6.442 1.00 0.00 C ATOM 494 CD2 TYR A 36 -7.410 3.703 5.618 1.00 0.00 C ATOM 495 CE1 TYR A 36 -9.662 4.165 7.144 1.00 0.00 C ATOM 496 CE2 TYR A 36 -7.994 2.663 6.316 1.00 0.00 C ATOM 497 CZ TYR A 36 -9.120 2.900 7.078 1.00 0.00 C ATOM 498 OH TYR A 36 -9.703 1.867 7.774 1.00 0.00 O ATOM 0 H TYR A 36 -7.813 8.221 6.630 1.00 0.00 H new ATOM 0 HA TYR A 36 -5.560 6.361 6.144 1.00 0.00 H new ATOM 0 HB2 TYR A 36 -8.080 6.753 4.483 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -6.734 5.711 4.065 1.00 0.00 H new ATOM 0 HD1 TYR A 36 -9.500 6.190 6.496 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -6.529 3.514 5.023 1.00 0.00 H new ATOM 0 HE1 TYR A 36 -10.543 4.347 7.741 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -7.572 1.670 6.265 1.00 0.00 H new ATOM 0 HH TYR A 36 -9.837 1.103 7.175 1.00 0.00 H new ATOM 508 N ILE A 37 -5.042 7.687 3.846 1.00 0.00 N ATOM 509 CA ILE A 37 -4.404 8.641 2.947 1.00 0.00 C ATOM 510 C ILE A 37 -5.398 9.187 1.928 1.00 0.00 C ATOM 511 O ILE A 37 -6.019 8.430 1.183 1.00 0.00 O ATOM 512 CB ILE A 37 -3.219 8.001 2.199 1.00 0.00 C ATOM 513 CG1 ILE A 37 -2.299 7.273 3.180 1.00 0.00 C ATOM 514 CG2 ILE A 37 -2.446 9.058 1.426 1.00 0.00 C ATOM 515 CD1 ILE A 37 -1.370 6.281 2.516 1.00 0.00 C ATOM 0 H ILE A 37 -4.897 6.709 3.596 1.00 0.00 H new ATOM 0 HA ILE A 37 -4.035 9.460 3.565 1.00 0.00 H new ATOM 0 HB ILE A 37 -3.610 7.273 1.489 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.704 8.009 3.722 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -2.908 6.750 3.917 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.612 8.589 0.903 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -3.106 9.535 0.702 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -2.064 9.809 2.118 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -0.748 5.803 3.272 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.957 5.523 1.997 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -0.735 6.801 1.799 1.00 0.00 H new ATOM 527 N HIS A 38 -5.543 10.509 1.900 1.00 0.00 N ATOM 528 CA HIS A 38 -6.462 11.157 0.973 1.00 0.00 C ATOM 529 C HIS A 38 -5.699 11.876 -0.136 1.00 0.00 C ATOM 530 O HIS A 38 -4.582 12.350 0.072 1.00 0.00 O ATOM 531 CB HIS A 38 -7.357 12.150 1.716 1.00 0.00 C ATOM 532 CG HIS A 38 -8.471 12.694 0.878 1.00 0.00 C ATOM 533 ND1 HIS A 38 -9.129 11.968 -0.089 1.00 0.00 N ATOM 534 CD2 HIS A 38 -9.045 13.924 0.878 1.00 0.00 C ATOM 535 CE1 HIS A 38 -10.059 12.761 -0.636 1.00 0.00 C ATOM 536 NE2 HIS A 38 -10.050 13.959 -0.084 1.00 0.00 N ATOM 0 H HIS A 38 -5.036 11.151 2.509 1.00 0.00 H new ATOM 0 HA HIS A 38 -7.085 10.385 0.521 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -7.779 11.660 2.593 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -6.746 12.978 2.076 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -8.766 14.745 1.522 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -10.730 12.459 -1.427 1.00 0.00 H new ATOM 0 HE2 HIS A 38 -10.654 14.748 -0.314 1.00 0.00 H new ATOM 544 N ALA A 39 -6.309 11.953 -1.314 1.00 0.00 N ATOM 545 CA ALA A 39 -5.688 12.613 -2.455 1.00 0.00 C ATOM 546 C ALA A 39 -6.383 13.933 -2.770 1.00 0.00 C ATOM 547 O ALA A 39 -7.531 14.150 -2.380 1.00 0.00 O ATOM 548 CB ALA A 39 -5.710 11.698 -3.671 1.00 0.00 C ATOM 0 H ALA A 39 -7.234 11.566 -1.503 1.00 0.00 H new ATOM 0 HA ALA A 39 -4.651 12.831 -2.198 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -5.243 12.204 -4.516 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.161 10.783 -3.448 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -6.742 11.451 -3.922 1.00 0.00 H new ATOM 554 N LEU A 40 -5.682 14.812 -3.479 1.00 0.00 N ATOM 555 CA LEU A 40 -6.234 16.111 -3.847 1.00 0.00 C ATOM 556 C LEU A 40 -6.099 16.356 -5.347 1.00 0.00 C ATOM 557 O LEU A 40 -5.414 15.612 -6.048 1.00 0.00 O ATOM 558 CB LEU A 40 -5.528 17.225 -3.071 1.00 0.00 C ATOM 559 CG LEU A 40 -5.761 17.209 -1.559 1.00 0.00 C ATOM 560 CD1 LEU A 40 -4.982 18.331 -0.888 1.00 0.00 C ATOM 561 CD2 LEU A 40 -7.245 17.329 -1.249 1.00 0.00 C ATOM 0 H LEU A 40 -4.731 14.649 -3.810 1.00 0.00 H new ATOM 0 HA LEU A 40 -7.294 16.113 -3.592 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -4.457 17.155 -3.259 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -5.858 18.186 -3.464 1.00 0.00 H new ATOM 0 HG LEU A 40 -5.403 16.258 -1.164 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.159 18.305 0.187 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.917 18.202 -1.083 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.310 19.291 -1.287 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -7.393 17.316 -0.169 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -7.627 18.265 -1.657 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.779 16.492 -1.699 1.00 0.00 H new ATOM 573 N ASP A 41 -6.761 17.401 -5.831 1.00 0.00 N ATOM 574 CA ASP A 41 -6.717 17.744 -7.248 1.00 0.00 C ATOM 575 C ASP A 41 -5.577 18.714 -7.539 1.00 0.00 C ATOM 576 O ASP A 41 -4.972 18.674 -8.610 1.00 0.00 O ATOM 577 CB ASP A 41 -8.048 18.355 -7.688 1.00 0.00 C ATOM 578 CG ASP A 41 -9.206 17.387 -7.541 1.00 0.00 C ATOM 579 OD1 ASP A 41 -9.449 16.920 -6.408 1.00 0.00 O ATOM 580 OD2 ASP A 41 -9.868 17.095 -8.559 1.00 0.00 O ATOM 0 H ASP A 41 -7.334 18.025 -5.263 1.00 0.00 H new ATOM 0 HA ASP A 41 -6.542 16.828 -7.812 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -8.248 19.248 -7.096 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -7.973 18.672 -8.728 1.00 0.00 H new ATOM 585 N ASN A 42 -5.289 19.586 -6.578 1.00 0.00 N ATOM 586 CA ASN A 42 -4.222 20.568 -6.730 1.00 0.00 C ATOM 587 C ASN A 42 -2.878 19.882 -6.955 1.00 0.00 C ATOM 588 O ASN A 42 -1.994 20.429 -7.614 1.00 0.00 O ATOM 589 CB ASN A 42 -4.147 21.467 -5.495 1.00 0.00 C ATOM 590 CG ASN A 42 -3.480 22.797 -5.786 1.00 0.00 C ATOM 591 OD1 ASN A 42 -4.116 23.728 -6.281 1.00 0.00 O ATOM 592 ND2 ASN A 42 -2.192 22.892 -5.480 1.00 0.00 N ATOM 0 H ASN A 42 -5.780 19.632 -5.685 1.00 0.00 H new ATOM 0 HA ASN A 42 -4.448 21.180 -7.603 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -5.154 21.644 -5.117 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -3.596 20.952 -4.708 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -1.689 23.762 -5.654 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -1.705 22.095 -5.071 1.00 0.00 H new ATOM 599 N GLY A 43 -2.733 18.681 -6.406 1.00 0.00 N ATOM 600 CA GLY A 43 -1.494 17.940 -6.559 1.00 0.00 C ATOM 601 C GLY A 43 -0.821 17.653 -5.231 1.00 0.00 C ATOM 602 O GLY A 43 0.407 17.646 -5.138 1.00 0.00 O ATOM 0 H GLY A 43 -3.451 18.207 -5.858 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -1.698 16.999 -7.070 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -0.812 18.506 -7.193 1.00 0.00 H new ATOM 606 N LEU A 44 -1.625 17.413 -4.201 1.00 0.00 N ATOM 607 CA LEU A 44 -1.100 17.124 -2.871 1.00 0.00 C ATOM 608 C LEU A 44 -1.871 15.982 -2.219 1.00 0.00 C ATOM 609 O LEU A 44 -2.884 15.522 -2.746 1.00 0.00 O ATOM 610 CB LEU A 44 -1.171 18.372 -1.990 1.00 0.00 C ATOM 611 CG LEU A 44 -0.582 19.639 -2.611 1.00 0.00 C ATOM 612 CD1 LEU A 44 -1.285 20.875 -2.072 1.00 0.00 C ATOM 613 CD2 LEU A 44 0.914 19.715 -2.346 1.00 0.00 C ATOM 0 H LEU A 44 -2.643 17.413 -4.261 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.058 16.821 -2.976 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.214 18.561 -1.738 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.649 18.168 -1.055 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.739 19.600 -3.689 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -0.852 21.767 -2.525 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.347 20.824 -2.313 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.161 20.921 -0.990 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.317 20.623 -2.795 1.00 0.00 H new ATOM 0 HD22 LEU A 44 1.093 19.731 -1.271 1.00 0.00 H new ATOM 0 HD23 LEU A 44 1.405 18.845 -2.782 1.00 0.00 H new ATOM 625 N PHE A 45 -1.384 15.527 -1.069 1.00 0.00 N ATOM 626 CA PHE A 45 -2.027 14.439 -0.343 1.00 0.00 C ATOM 627 C PHE A 45 -2.127 14.759 1.144 1.00 0.00 C ATOM 628 O PHE A 45 -1.113 14.914 1.825 1.00 0.00 O ATOM 629 CB PHE A 45 -1.250 13.136 -0.545 1.00 0.00 C ATOM 630 CG PHE A 45 -1.568 12.441 -1.838 1.00 0.00 C ATOM 631 CD1 PHE A 45 -1.200 13.003 -3.050 1.00 0.00 C ATOM 632 CD2 PHE A 45 -2.237 11.227 -1.841 1.00 0.00 C ATOM 633 CE1 PHE A 45 -1.491 12.366 -4.241 1.00 0.00 C ATOM 634 CE2 PHE A 45 -2.531 10.586 -3.030 1.00 0.00 C ATOM 635 CZ PHE A 45 -2.158 11.157 -4.231 1.00 0.00 C ATOM 0 H PHE A 45 -0.546 15.896 -0.620 1.00 0.00 H new ATOM 0 HA PHE A 45 -3.036 14.319 -0.738 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.182 13.351 -0.511 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.467 12.461 0.283 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -0.680 13.949 -3.064 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -2.532 10.777 -0.904 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.197 12.813 -5.179 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -3.052 9.640 -3.020 1.00 0.00 H new ATOM 0 HZ PHE A 45 -2.388 10.659 -5.161 1.00 0.00 H new ATOM 645 N THR A 46 -3.355 14.856 1.642 1.00 0.00 N ATOM 646 CA THR A 46 -3.587 15.158 3.050 1.00 0.00 C ATOM 647 C THR A 46 -4.205 13.963 3.767 1.00 0.00 C ATOM 648 O THR A 46 -4.617 12.991 3.134 1.00 0.00 O ATOM 649 CB THR A 46 -4.499 16.378 3.187 1.00 0.00 C ATOM 650 OG1 THR A 46 -4.730 16.682 4.552 1.00 0.00 O ATOM 651 CG2 THR A 46 -5.846 16.197 2.523 1.00 0.00 C ATOM 0 H THR A 46 -4.205 14.730 1.092 1.00 0.00 H new ATOM 0 HA THR A 46 -2.625 15.379 3.513 1.00 0.00 H new ATOM 0 HB THR A 46 -3.971 17.189 2.686 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.314 17.466 4.618 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.442 17.099 2.658 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.705 16.012 1.458 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.363 15.350 2.973 1.00 0.00 H new ATOM 659 N LEU A 47 -4.269 14.043 5.092 1.00 0.00 N ATOM 660 CA LEU A 47 -4.838 12.967 5.896 1.00 0.00 C ATOM 661 C LEU A 47 -6.357 12.937 5.766 1.00 0.00 C ATOM 662 O LEU A 47 -7.044 13.873 6.173 1.00 0.00 O ATOM 663 CB LEU A 47 -4.443 13.136 7.364 1.00 0.00 C ATOM 664 CG LEU A 47 -4.688 11.910 8.246 1.00 0.00 C ATOM 665 CD1 LEU A 47 -3.921 10.709 7.716 1.00 0.00 C ATOM 666 CD2 LEU A 47 -4.293 12.204 9.685 1.00 0.00 C ATOM 0 H LEU A 47 -3.934 14.841 5.632 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.441 12.021 5.527 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.385 13.394 7.412 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.996 13.979 7.778 1.00 0.00 H new ATOM 0 HG LEU A 47 -5.752 11.674 8.222 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -4.108 9.847 8.356 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -4.251 10.486 6.701 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.854 10.932 7.710 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.473 11.322 10.299 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.235 12.465 9.726 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.887 13.037 10.062 1.00 0.00 H new ATOM 678 N GLY A 48 -6.876 11.853 5.199 1.00 0.00 N ATOM 679 CA GLY A 48 -8.311 11.720 5.027 1.00 0.00 C ATOM 680 C GLY A 48 -9.060 11.776 6.344 1.00 0.00 C ATOM 681 O GLY A 48 -8.453 11.717 7.413 1.00 0.00 O ATOM 0 H GLY A 48 -6.328 11.064 4.855 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.671 12.515 4.374 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.528 10.775 4.529 1.00 0.00 H new ATOM 685 N ALA A 49 -10.381 11.893 6.267 1.00 0.00 N ATOM 686 CA ALA A 49 -11.212 11.958 7.462 1.00 0.00 C ATOM 687 C ALA A 49 -11.277 10.600 8.160 1.00 0.00 C ATOM 688 O ALA A 49 -11.654 9.600 7.549 1.00 0.00 O ATOM 689 CB ALA A 49 -12.612 12.436 7.104 1.00 0.00 C ATOM 0 H ALA A 49 -10.899 11.945 5.390 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.760 12.671 8.152 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -13.223 12.480 8.006 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -12.554 13.428 6.656 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -13.063 11.743 6.394 1.00 0.00 H new ATOM 695 N PRO A 50 -10.912 10.542 9.455 1.00 0.00 N ATOM 696 CA PRO A 50 -10.936 9.293 10.223 1.00 0.00 C ATOM 697 C PRO A 50 -12.355 8.806 10.492 1.00 0.00 C ATOM 698 O PRO A 50 -13.214 9.574 10.926 1.00 0.00 O ATOM 699 CB PRO A 50 -10.242 9.667 11.535 1.00 0.00 C ATOM 700 CG PRO A 50 -10.452 11.135 11.669 1.00 0.00 C ATOM 701 CD PRO A 50 -10.450 11.683 10.269 1.00 0.00 C ATOM 0 HA PRO A 50 -10.451 8.477 9.687 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -10.672 9.127 12.378 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -9.181 9.420 11.506 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -11.395 11.350 12.171 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -9.662 11.589 12.267 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -11.115 12.541 10.172 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -9.456 12.015 9.969 1.00 0.00 H new ATOM 709 N HIS A 51 -12.594 7.525 10.232 1.00 0.00 N ATOM 710 CA HIS A 51 -13.910 6.935 10.447 1.00 0.00 C ATOM 711 C HIS A 51 -14.107 6.562 11.912 1.00 0.00 C ATOM 712 O HIS A 51 -13.358 5.757 12.464 1.00 0.00 O ATOM 713 CB HIS A 51 -14.087 5.697 9.565 1.00 0.00 C ATOM 714 CG HIS A 51 -13.978 5.985 8.100 1.00 0.00 C ATOM 715 ND1 HIS A 51 -14.830 5.407 7.191 1.00 0.00 N ATOM 716 CD2 HIS A 51 -13.108 6.789 7.442 1.00 0.00 C ATOM 717 CE1 HIS A 51 -14.463 5.867 6.009 1.00 0.00 C ATOM 718 NE2 HIS A 51 -13.423 6.709 6.111 1.00 0.00 N ATOM 0 H HIS A 51 -11.894 6.876 9.872 1.00 0.00 H new ATOM 0 HA HIS A 51 -14.661 7.677 10.176 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -13.336 4.956 9.838 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -15.061 5.253 9.768 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -12.318 7.379 7.882 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -14.940 5.599 5.078 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -12.957 7.196 5.345 1.00 0.00 H new ATOM 726 N ARG A 52 -15.120 7.154 12.538 1.00 0.00 N ATOM 727 CA ARG A 52 -15.415 6.883 13.941 1.00 0.00 C ATOM 728 C ARG A 52 -15.727 5.406 14.155 1.00 0.00 C ATOM 729 O ARG A 52 -15.214 4.781 15.085 1.00 0.00 O ATOM 730 CB ARG A 52 -16.592 7.739 14.411 1.00 0.00 C ATOM 731 CG ARG A 52 -17.844 7.567 13.567 1.00 0.00 C ATOM 732 CD ARG A 52 -18.672 8.842 13.529 1.00 0.00 C ATOM 733 NE ARG A 52 -19.113 9.169 12.175 1.00 0.00 N ATOM 734 CZ ARG A 52 -18.296 9.592 11.213 1.00 0.00 C ATOM 735 NH1 ARG A 52 -16.999 9.738 11.449 1.00 0.00 N ATOM 736 NH2 ARG A 52 -18.779 9.870 10.009 1.00 0.00 N ATOM 0 H ARG A 52 -15.750 7.824 12.096 1.00 0.00 H new ATOM 0 HA ARG A 52 -14.533 7.138 14.528 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -16.824 7.487 15.446 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -16.296 8.788 14.397 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -17.564 7.284 12.552 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -18.446 6.753 13.970 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -19.542 8.729 14.176 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -18.084 9.668 13.928 1.00 0.00 H new ATOM 0 HE ARG A 52 -20.104 9.067 11.954 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -16.622 9.526 12.373 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -16.379 10.063 10.707 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -19.775 9.760 9.821 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -18.154 10.194 9.271 1.00 0.00 H new ATOM 750 N GLU A 53 -16.570 4.853 13.291 1.00 0.00 N ATOM 751 CA GLU A 53 -16.950 3.448 13.386 1.00 0.00 C ATOM 752 C GLU A 53 -15.798 2.542 12.964 1.00 0.00 C ATOM 753 O GLU A 53 -15.045 2.867 12.045 1.00 0.00 O ATOM 754 CB GLU A 53 -18.178 3.170 12.518 1.00 0.00 C ATOM 755 CG GLU A 53 -19.437 3.873 13.000 1.00 0.00 C ATOM 756 CD GLU A 53 -20.680 3.416 12.262 1.00 0.00 C ATOM 757 OE1 GLU A 53 -20.760 3.645 11.036 1.00 0.00 O ATOM 758 OE2 GLU A 53 -21.573 2.829 12.908 1.00 0.00 O ATOM 0 H GLU A 53 -17.004 5.356 12.517 1.00 0.00 H new ATOM 0 HA GLU A 53 -17.194 3.234 14.427 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -17.967 3.482 11.495 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -18.359 2.095 12.493 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -19.565 3.690 14.067 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -19.319 4.949 12.873 1.00 0.00 H new ATOM 765 N VAL A 54 -15.669 1.405 13.638 1.00 0.00 N ATOM 766 CA VAL A 54 -14.609 0.451 13.333 1.00 0.00 C ATOM 767 C VAL A 54 -14.902 -0.298 12.037 1.00 0.00 C ATOM 768 O VAL A 54 -13.987 -0.673 11.305 1.00 0.00 O ATOM 769 CB VAL A 54 -14.425 -0.569 14.471 1.00 0.00 C ATOM 770 CG1 VAL A 54 -13.192 -1.426 14.228 1.00 0.00 C ATOM 771 CG2 VAL A 54 -14.334 0.140 15.814 1.00 0.00 C ATOM 0 H VAL A 54 -16.285 1.121 14.400 1.00 0.00 H new ATOM 0 HA VAL A 54 -13.690 1.025 13.219 1.00 0.00 H new ATOM 0 HB VAL A 54 -15.296 -1.224 14.490 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -13.079 -2.141 15.043 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -13.303 -1.964 13.287 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -12.309 -0.788 14.180 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -14.204 -0.597 16.606 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -13.483 0.821 15.809 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -15.250 0.705 15.990 1.00 0.00 H new ATOM 781 N ASP A 55 -16.184 -0.514 11.761 1.00 0.00 N ATOM 782 CA ASP A 55 -16.599 -1.218 10.555 1.00 0.00 C ATOM 783 C ASP A 55 -16.956 -0.235 9.445 1.00 0.00 C ATOM 784 O ASP A 55 -18.117 0.142 9.285 1.00 0.00 O ATOM 785 CB ASP A 55 -17.793 -2.127 10.854 1.00 0.00 C ATOM 786 CG ASP A 55 -17.673 -3.481 10.181 1.00 0.00 C ATOM 787 OD1 ASP A 55 -16.875 -4.313 10.660 1.00 0.00 O ATOM 788 OD2 ASP A 55 -18.376 -3.707 9.174 1.00 0.00 O ATOM 0 H ASP A 55 -16.954 -0.211 12.358 1.00 0.00 H new ATOM 0 HA ASP A 55 -15.763 -1.830 10.216 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -17.879 -2.266 11.932 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -18.709 -1.639 10.522 1.00 0.00 H new ATOM 793 N GLU A 56 -15.950 0.177 8.680 1.00 0.00 N ATOM 794 CA GLU A 56 -16.157 1.117 7.585 1.00 0.00 C ATOM 795 C GLU A 56 -15.012 1.040 6.578 1.00 0.00 C ATOM 796 O GLU A 56 -13.848 1.222 6.933 1.00 0.00 O ATOM 797 CB GLU A 56 -16.281 2.543 8.124 1.00 0.00 C ATOM 798 CG GLU A 56 -17.671 2.880 8.639 1.00 0.00 C ATOM 799 CD GLU A 56 -17.980 4.362 8.557 1.00 0.00 C ATOM 800 OE1 GLU A 56 -17.030 5.170 8.623 1.00 0.00 O ATOM 801 OE2 GLU A 56 -19.171 4.714 8.424 1.00 0.00 O ATOM 0 H GLU A 56 -14.983 -0.126 8.799 1.00 0.00 H new ATOM 0 HA GLU A 56 -17.083 0.846 7.078 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -15.560 2.682 8.930 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -16.015 3.245 7.334 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -18.412 2.326 8.063 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -17.761 2.551 9.674 1.00 0.00 H new ATOM 808 N GLY A 57 -15.352 0.769 5.323 1.00 0.00 N ATOM 809 CA GLY A 57 -14.342 0.672 4.286 1.00 0.00 C ATOM 810 C GLY A 57 -13.846 2.032 3.829 1.00 0.00 C ATOM 811 O GLY A 57 -14.606 3.000 3.822 1.00 0.00 O ATOM 0 H GLY A 57 -16.309 0.615 5.005 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -13.500 0.088 4.657 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -14.753 0.133 3.432 1.00 0.00 H new ATOM 815 N PRO A 58 -12.564 2.138 3.437 1.00 0.00 N ATOM 816 CA PRO A 58 -11.982 3.404 2.977 1.00 0.00 C ATOM 817 C PRO A 58 -12.797 4.042 1.857 1.00 0.00 C ATOM 818 O PRO A 58 -13.514 3.357 1.128 1.00 0.00 O ATOM 819 CB PRO A 58 -10.599 2.996 2.463 1.00 0.00 C ATOM 820 CG PRO A 58 -10.274 1.743 3.198 1.00 0.00 C ATOM 821 CD PRO A 58 -11.584 1.037 3.412 1.00 0.00 C ATOM 0 HA PRO A 58 -11.953 4.150 3.771 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -10.610 2.831 1.386 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -9.859 3.772 2.659 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -9.585 1.122 2.625 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -9.789 1.963 4.149 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -11.795 0.329 2.610 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -11.589 0.473 4.345 1.00 0.00 H new ATOM 829 N SER A 59 -12.680 5.360 1.725 1.00 0.00 N ATOM 830 CA SER A 59 -13.404 6.091 0.693 1.00 0.00 C ATOM 831 C SER A 59 -12.803 5.825 -0.685 1.00 0.00 C ATOM 832 O SER A 59 -11.658 5.383 -0.796 1.00 0.00 O ATOM 833 CB SER A 59 -13.381 7.591 0.991 1.00 0.00 C ATOM 834 OG SER A 59 -13.890 7.862 2.286 1.00 0.00 O ATOM 0 H SER A 59 -12.091 5.942 2.320 1.00 0.00 H new ATOM 0 HA SER A 59 -14.437 5.743 0.693 1.00 0.00 H new ATOM 0 HB2 SER A 59 -12.360 7.965 0.913 1.00 0.00 H new ATOM 0 HB3 SER A 59 -13.973 8.122 0.246 1.00 0.00 H new ATOM 0 HG SER A 59 -13.155 7.858 2.934 1.00 0.00 H new ATOM 840 N PRO A 60 -13.567 6.093 -1.758 1.00 0.00 N ATOM 841 CA PRO A 60 -13.101 5.881 -3.131 1.00 0.00 C ATOM 842 C PRO A 60 -11.740 6.525 -3.397 1.00 0.00 C ATOM 843 O PRO A 60 -10.842 5.881 -3.940 1.00 0.00 O ATOM 844 CB PRO A 60 -14.185 6.540 -3.984 1.00 0.00 C ATOM 845 CG PRO A 60 -15.412 6.498 -3.139 1.00 0.00 C ATOM 846 CD PRO A 60 -14.942 6.625 -1.716 1.00 0.00 C ATOM 0 HA PRO A 60 -12.956 4.823 -3.349 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -13.917 7.565 -4.242 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -14.332 6.003 -4.921 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -16.092 7.309 -3.399 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -15.956 5.565 -3.288 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -14.961 7.661 -1.378 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -15.572 6.055 -1.033 1.00 0.00 H new ATOM 854 N PRO A 61 -11.560 7.808 -3.022 1.00 0.00 N ATOM 855 CA PRO A 61 -10.292 8.513 -3.236 1.00 0.00 C ATOM 856 C PRO A 61 -9.172 7.983 -2.344 1.00 0.00 C ATOM 857 O PRO A 61 -7.992 8.188 -2.630 1.00 0.00 O ATOM 858 CB PRO A 61 -10.623 9.963 -2.875 1.00 0.00 C ATOM 859 CG PRO A 61 -11.771 9.868 -1.933 1.00 0.00 C ATOM 860 CD PRO A 61 -12.567 8.668 -2.366 1.00 0.00 C ATOM 0 HA PRO A 61 -9.926 8.387 -4.255 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -9.771 10.459 -2.411 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -10.885 10.541 -3.761 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -11.424 9.756 -0.906 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -12.379 10.772 -1.967 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -13.032 8.167 -1.517 1.00 0.00 H new ATOM 0 HD3 PRO A 61 -13.368 8.943 -3.052 1.00 0.00 H new ATOM 868 N GLU A 62 -9.547 7.303 -1.265 1.00 0.00 N ATOM 869 CA GLU A 62 -8.569 6.746 -0.337 1.00 0.00 C ATOM 870 C GLU A 62 -8.053 5.398 -0.832 1.00 0.00 C ATOM 871 O GLU A 62 -6.908 5.028 -0.573 1.00 0.00 O ATOM 872 CB GLU A 62 -9.187 6.591 1.054 1.00 0.00 C ATOM 873 CG GLU A 62 -8.950 7.788 1.961 1.00 0.00 C ATOM 874 CD GLU A 62 -9.992 7.904 3.057 1.00 0.00 C ATOM 875 OE1 GLU A 62 -11.166 7.562 2.799 1.00 0.00 O ATOM 876 OE2 GLU A 62 -9.635 8.335 4.172 1.00 0.00 O ATOM 0 H GLU A 62 -10.519 7.125 -1.012 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.727 7.436 -0.278 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -10.260 6.431 0.950 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.776 5.699 1.528 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -7.961 7.707 2.412 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -8.954 8.699 1.363 1.00 0.00 H new ATOM 883 N GLN A 63 -8.906 4.668 -1.543 1.00 0.00 N ATOM 884 CA GLN A 63 -8.536 3.360 -2.074 1.00 0.00 C ATOM 885 C GLN A 63 -7.377 3.481 -3.060 1.00 0.00 C ATOM 886 O GLN A 63 -7.406 4.311 -3.968 1.00 0.00 O ATOM 887 CB GLN A 63 -9.736 2.705 -2.759 1.00 0.00 C ATOM 888 CG GLN A 63 -10.991 2.686 -1.901 1.00 0.00 C ATOM 889 CD GLN A 63 -11.859 1.471 -2.163 1.00 0.00 C ATOM 890 OE1 GLN A 63 -11.543 0.640 -3.016 1.00 0.00 O ATOM 891 NE2 GLN A 63 -12.959 1.359 -1.429 1.00 0.00 N ATOM 0 H GLN A 63 -9.858 4.959 -1.765 1.00 0.00 H new ATOM 0 HA GLN A 63 -8.217 2.735 -1.240 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -9.948 3.236 -3.687 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -9.475 1.682 -3.030 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -10.707 2.705 -0.849 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -11.570 3.589 -2.091 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -13.183 2.071 -0.733 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -13.581 0.561 -1.560 1.00 0.00 H new ATOM 900 N PHE A 64 -6.359 2.646 -2.875 1.00 0.00 N ATOM 901 CA PHE A 64 -5.192 2.658 -3.750 1.00 0.00 C ATOM 902 C PHE A 64 -5.079 1.348 -4.524 1.00 0.00 C ATOM 903 O PHE A 64 -5.645 0.330 -4.127 1.00 0.00 O ATOM 904 CB PHE A 64 -3.919 2.892 -2.933 1.00 0.00 C ATOM 905 CG PHE A 64 -3.880 4.232 -2.256 1.00 0.00 C ATOM 906 CD1 PHE A 64 -3.456 5.358 -2.943 1.00 0.00 C ATOM 907 CD2 PHE A 64 -4.267 4.366 -0.932 1.00 0.00 C ATOM 908 CE1 PHE A 64 -3.419 6.593 -2.323 1.00 0.00 C ATOM 909 CE2 PHE A 64 -4.231 5.598 -0.306 1.00 0.00 C ATOM 910 CZ PHE A 64 -3.807 6.712 -1.002 1.00 0.00 C ATOM 0 H PHE A 64 -6.319 1.953 -2.128 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.313 3.472 -4.464 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -3.832 2.110 -2.179 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -3.053 2.800 -3.589 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -3.151 5.270 -3.975 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -4.601 3.498 -0.383 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -3.087 7.463 -2.870 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -4.534 5.689 0.727 1.00 0.00 H new ATOM 0 HZ PHE A 64 -3.779 7.675 -0.515 1.00 0.00 H new ATOM 920 N THR A 65 -4.347 1.383 -5.633 1.00 0.00 N ATOM 921 CA THR A 65 -4.160 0.198 -6.464 1.00 0.00 C ATOM 922 C THR A 65 -2.682 -0.152 -6.595 1.00 0.00 C ATOM 923 O THR A 65 -1.872 0.679 -7.006 1.00 0.00 O ATOM 924 CB THR A 65 -4.768 0.422 -7.849 1.00 0.00 C ATOM 925 OG1 THR A 65 -5.840 1.347 -7.784 1.00 0.00 O ATOM 926 CG2 THR A 65 -5.295 -0.846 -8.485 1.00 0.00 C ATOM 0 H THR A 65 -3.874 2.218 -5.977 1.00 0.00 H new ATOM 0 HA THR A 65 -4.668 -0.636 -5.981 1.00 0.00 H new ATOM 0 HB THR A 65 -3.952 0.805 -8.462 1.00 0.00 H new ATOM 0 HG1 THR A 65 -6.214 1.478 -8.680 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.712 -0.615 -9.465 1.00 0.00 H new ATOM 0 HG22 THR A 65 -4.481 -1.562 -8.597 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.072 -1.275 -7.852 1.00 0.00 H new ATOM 934 N ALA A 66 -2.338 -1.386 -6.243 1.00 0.00 N ATOM 935 CA ALA A 66 -0.956 -1.846 -6.323 1.00 0.00 C ATOM 936 C ALA A 66 -0.609 -2.291 -7.739 1.00 0.00 C ATOM 937 O ALA A 66 -1.486 -2.670 -8.515 1.00 0.00 O ATOM 938 CB ALA A 66 -0.721 -2.981 -5.334 1.00 0.00 C ATOM 0 H ALA A 66 -2.996 -2.085 -5.900 1.00 0.00 H new ATOM 0 HA ALA A 66 -0.303 -1.013 -6.063 1.00 0.00 H new ATOM 0 HB1 ALA A 66 0.314 -3.316 -5.403 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -0.922 -2.629 -4.322 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -1.387 -3.811 -5.568 1.00 0.00 H new ATOM 944 N VAL A 67 0.677 -2.241 -8.072 1.00 0.00 N ATOM 945 CA VAL A 67 1.139 -2.638 -9.396 1.00 0.00 C ATOM 946 C VAL A 67 2.539 -3.240 -9.335 1.00 0.00 C ATOM 947 O VAL A 67 3.509 -2.548 -9.027 1.00 0.00 O ATOM 948 CB VAL A 67 1.149 -1.444 -10.369 1.00 0.00 C ATOM 949 CG1 VAL A 67 1.438 -1.911 -11.787 1.00 0.00 C ATOM 950 CG2 VAL A 67 -0.171 -0.692 -10.306 1.00 0.00 C ATOM 0 H VAL A 67 1.417 -1.929 -7.443 1.00 0.00 H new ATOM 0 HA VAL A 67 0.439 -3.390 -9.761 1.00 0.00 H new ATOM 0 HB VAL A 67 1.944 -0.762 -10.068 1.00 0.00 H new ATOM 0 HG11 VAL A 67 1.441 -1.053 -12.459 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.412 -2.399 -11.818 1.00 0.00 H new ATOM 0 HG13 VAL A 67 0.669 -2.616 -12.102 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.145 0.148 -11.000 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -0.985 -1.363 -10.579 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -0.330 -0.321 -9.294 1.00 0.00 H new ATOM 960 N LYS A 68 2.635 -4.532 -9.629 1.00 0.00 N ATOM 961 CA LYS A 68 3.917 -5.228 -9.608 1.00 0.00 C ATOM 962 C LYS A 68 4.853 -4.671 -10.676 1.00 0.00 C ATOM 963 O LYS A 68 4.410 -4.234 -11.737 1.00 0.00 O ATOM 964 CB LYS A 68 3.710 -6.728 -9.826 1.00 0.00 C ATOM 965 CG LYS A 68 3.520 -7.509 -8.536 1.00 0.00 C ATOM 966 CD LYS A 68 3.576 -9.009 -8.781 1.00 0.00 C ATOM 967 CE LYS A 68 4.986 -9.550 -8.610 1.00 0.00 C ATOM 968 NZ LYS A 68 5.677 -9.723 -9.917 1.00 0.00 N ATOM 0 H LYS A 68 1.841 -5.119 -9.885 1.00 0.00 H new ATOM 0 HA LYS A 68 4.374 -5.070 -8.631 1.00 0.00 H new ATOM 0 HB2 LYS A 68 2.838 -6.877 -10.463 1.00 0.00 H new ATOM 0 HB3 LYS A 68 4.569 -7.131 -10.362 1.00 0.00 H new ATOM 0 HG2 LYS A 68 4.293 -7.227 -7.821 1.00 0.00 H new ATOM 0 HG3 LYS A 68 2.561 -7.248 -8.089 1.00 0.00 H new ATOM 0 HD2 LYS A 68 2.904 -9.517 -8.089 1.00 0.00 H new ATOM 0 HD3 LYS A 68 3.221 -9.228 -9.788 1.00 0.00 H new ATOM 0 HE2 LYS A 68 5.562 -8.870 -7.982 1.00 0.00 H new ATOM 0 HE3 LYS A 68 4.947 -10.507 -8.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 6.519 -10.320 -9.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 5.031 -10.177 -10.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 5.964 -8.793 -10.284 1.00 0.00 H new ATOM 982 N LEU A 69 6.151 -4.692 -10.389 1.00 0.00 N ATOM 983 CA LEU A 69 7.147 -4.189 -11.327 1.00 0.00 C ATOM 984 C LEU A 69 8.380 -5.090 -11.350 1.00 0.00 C ATOM 985 O LEU A 69 8.611 -5.815 -12.318 1.00 0.00 O ATOM 986 CB LEU A 69 7.547 -2.758 -10.961 1.00 0.00 C ATOM 987 CG LEU A 69 6.381 -1.780 -10.806 1.00 0.00 C ATOM 988 CD1 LEU A 69 6.829 -0.530 -10.065 1.00 0.00 C ATOM 989 CD2 LEU A 69 5.806 -1.417 -12.168 1.00 0.00 C ATOM 0 H LEU A 69 6.537 -5.051 -9.516 1.00 0.00 H new ATOM 0 HA LEU A 69 6.704 -4.189 -12.323 1.00 0.00 H new ATOM 0 HB2 LEU A 69 8.108 -2.781 -10.027 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.221 -2.378 -11.729 1.00 0.00 H new ATOM 0 HG LEU A 69 5.600 -2.265 -10.221 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.987 0.155 -9.964 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.194 -0.805 -9.075 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.628 -0.042 -10.624 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.977 -0.721 -12.039 1.00 0.00 H new ATOM 0 HD22 LEU A 69 6.580 -0.951 -12.777 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.448 -2.319 -12.664 1.00 0.00 H new ATOM 1001 N SER A 70 9.169 -5.039 -10.281 1.00 0.00 N ATOM 1002 CA SER A 70 10.378 -5.851 -10.182 1.00 0.00 C ATOM 1003 C SER A 70 11.096 -5.601 -8.860 1.00 0.00 C ATOM 1004 O SER A 70 10.971 -4.529 -8.267 1.00 0.00 O ATOM 1005 CB SER A 70 11.318 -5.552 -11.351 1.00 0.00 C ATOM 1006 OG SER A 70 11.062 -6.414 -12.446 1.00 0.00 O ATOM 0 H SER A 70 8.993 -4.444 -9.471 1.00 0.00 H new ATOM 0 HA SER A 70 10.084 -6.900 -10.222 1.00 0.00 H new ATOM 0 HB2 SER A 70 11.195 -4.515 -11.664 1.00 0.00 H new ATOM 0 HB3 SER A 70 12.353 -5.667 -11.028 1.00 0.00 H new ATOM 0 HG SER A 70 10.095 -6.525 -12.556 1.00 0.00 H new ATOM 1012 N ASP A 71 11.850 -6.596 -8.404 1.00 0.00 N ATOM 1013 CA ASP A 71 12.591 -6.482 -7.152 1.00 0.00 C ATOM 1014 C ASP A 71 11.651 -6.199 -5.985 1.00 0.00 C ATOM 1015 O ASP A 71 12.007 -5.482 -5.049 1.00 0.00 O ATOM 1016 CB ASP A 71 13.642 -5.375 -7.257 1.00 0.00 C ATOM 1017 CG ASP A 71 14.971 -5.887 -7.776 1.00 0.00 C ATOM 1018 OD1 ASP A 71 15.306 -7.058 -7.498 1.00 0.00 O ATOM 1019 OD2 ASP A 71 15.678 -5.118 -8.461 1.00 0.00 O ATOM 0 H ASP A 71 11.964 -7.490 -8.882 1.00 0.00 H new ATOM 0 HA ASP A 71 13.091 -7.433 -6.967 1.00 0.00 H new ATOM 0 HB2 ASP A 71 13.275 -4.591 -7.919 1.00 0.00 H new ATOM 0 HB3 ASP A 71 13.788 -4.922 -6.276 1.00 0.00 H new ATOM 1024 N SER A 72 10.450 -6.763 -6.048 1.00 0.00 N ATOM 1025 CA SER A 72 9.459 -6.570 -4.995 1.00 0.00 C ATOM 1026 C SER A 72 9.092 -5.096 -4.857 1.00 0.00 C ATOM 1027 O SER A 72 8.773 -4.625 -3.766 1.00 0.00 O ATOM 1028 CB SER A 72 9.988 -7.103 -3.663 1.00 0.00 C ATOM 1029 OG SER A 72 10.130 -8.512 -3.696 1.00 0.00 O ATOM 0 H SER A 72 10.139 -7.357 -6.816 1.00 0.00 H new ATOM 0 HA SER A 72 8.562 -7.125 -5.269 1.00 0.00 H new ATOM 0 HB2 SER A 72 10.951 -6.643 -3.441 1.00 0.00 H new ATOM 0 HB3 SER A 72 9.307 -6.822 -2.860 1.00 0.00 H new ATOM 0 HG SER A 72 10.471 -8.827 -2.833 1.00 0.00 H new ATOM 1035 N ARG A 73 9.141 -4.373 -5.971 1.00 0.00 N ATOM 1036 CA ARG A 73 8.816 -2.951 -5.976 1.00 0.00 C ATOM 1037 C ARG A 73 7.485 -2.703 -6.681 1.00 0.00 C ATOM 1038 O ARG A 73 7.385 -2.835 -7.901 1.00 0.00 O ATOM 1039 CB ARG A 73 9.925 -2.150 -6.663 1.00 0.00 C ATOM 1040 CG ARG A 73 11.330 -2.615 -6.306 1.00 0.00 C ATOM 1041 CD ARG A 73 11.803 -2.010 -4.995 1.00 0.00 C ATOM 1042 NE ARG A 73 12.089 -0.583 -5.121 1.00 0.00 N ATOM 1043 CZ ARG A 73 12.905 0.088 -4.310 1.00 0.00 C ATOM 1044 NH1 ARG A 73 13.519 -0.533 -3.311 1.00 0.00 N ATOM 1045 NH2 ARG A 73 13.109 1.384 -4.500 1.00 0.00 N ATOM 0 H ARG A 73 9.403 -4.749 -6.882 1.00 0.00 H new ATOM 0 HA ARG A 73 8.730 -2.621 -4.941 1.00 0.00 H new ATOM 0 HB2 ARG A 73 9.793 -2.217 -7.743 1.00 0.00 H new ATOM 0 HB3 ARG A 73 9.821 -1.099 -6.394 1.00 0.00 H new ATOM 0 HG2 ARG A 73 11.346 -3.702 -6.232 1.00 0.00 H new ATOM 0 HG3 ARG A 73 12.019 -2.339 -7.104 1.00 0.00 H new ATOM 0 HD2 ARG A 73 11.041 -2.161 -4.231 1.00 0.00 H new ATOM 0 HD3 ARG A 73 12.699 -2.531 -4.658 1.00 0.00 H new ATOM 0 HE ARG A 73 11.636 -0.069 -5.877 1.00 0.00 H new ATOM 0 HH11 ARG A 73 13.367 -1.530 -3.160 1.00 0.00 H new ATOM 0 HH12 ARG A 73 14.143 -0.013 -2.694 1.00 0.00 H new ATOM 0 HH21 ARG A 73 12.641 1.867 -5.267 1.00 0.00 H new ATOM 0 HH22 ARG A 73 13.734 1.898 -3.879 1.00 0.00 H new ATOM 1059 N ILE A 74 6.467 -2.345 -5.905 1.00 0.00 N ATOM 1060 CA ILE A 74 5.144 -2.080 -6.458 1.00 0.00 C ATOM 1061 C ILE A 74 4.878 -0.583 -6.563 1.00 0.00 C ATOM 1062 O ILE A 74 5.642 0.232 -6.044 1.00 0.00 O ATOM 1063 CB ILE A 74 4.037 -2.725 -5.602 1.00 0.00 C ATOM 1064 CG1 ILE A 74 4.210 -2.341 -4.131 1.00 0.00 C ATOM 1065 CG2 ILE A 74 4.049 -4.238 -5.767 1.00 0.00 C ATOM 1066 CD1 ILE A 74 3.051 -2.764 -3.256 1.00 0.00 C ATOM 0 H ILE A 74 6.533 -2.232 -4.893 1.00 0.00 H new ATOM 0 HA ILE A 74 5.128 -2.520 -7.455 1.00 0.00 H new ATOM 0 HB ILE A 74 3.072 -2.352 -5.944 1.00 0.00 H new ATOM 0 HG12 ILE A 74 5.126 -2.794 -3.751 1.00 0.00 H new ATOM 0 HG13 ILE A 74 4.334 -1.261 -4.058 1.00 0.00 H new ATOM 0 HG21 ILE A 74 3.261 -4.677 -5.155 1.00 0.00 H new ATOM 0 HG22 ILE A 74 3.880 -4.491 -6.814 1.00 0.00 H new ATOM 0 HG23 ILE A 74 5.015 -4.631 -5.450 1.00 0.00 H new ATOM 0 HD11 ILE A 74 3.242 -2.459 -2.227 1.00 0.00 H new ATOM 0 HD12 ILE A 74 2.136 -2.291 -3.611 1.00 0.00 H new ATOM 0 HD13 ILE A 74 2.939 -3.847 -3.299 1.00 0.00 H new ATOM 1078 N ALA A 75 3.790 -0.226 -7.239 1.00 0.00 N ATOM 1079 CA ALA A 75 3.421 1.173 -7.414 1.00 0.00 C ATOM 1080 C ALA A 75 2.013 1.437 -6.891 1.00 0.00 C ATOM 1081 O ALA A 75 1.055 0.780 -7.300 1.00 0.00 O ATOM 1082 CB ALA A 75 3.525 1.567 -8.879 1.00 0.00 C ATOM 0 H ALA A 75 3.148 -0.888 -7.675 1.00 0.00 H new ATOM 0 HA ALA A 75 4.116 1.782 -6.836 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.246 2.614 -8.995 1.00 0.00 H new ATOM 0 HB2 ALA A 75 4.550 1.424 -9.222 1.00 0.00 H new ATOM 0 HB3 ALA A 75 2.854 0.945 -9.471 1.00 0.00 H new ATOM 1088 N LEU A 76 1.895 2.402 -5.984 1.00 0.00 N ATOM 1089 CA LEU A 76 0.602 2.752 -5.406 1.00 0.00 C ATOM 1090 C LEU A 76 -0.150 3.730 -6.303 1.00 0.00 C ATOM 1091 O LEU A 76 0.308 4.848 -6.540 1.00 0.00 O ATOM 1092 CB LEU A 76 0.791 3.359 -4.015 1.00 0.00 C ATOM 1093 CG LEU A 76 0.897 2.346 -2.874 1.00 0.00 C ATOM 1094 CD1 LEU A 76 1.242 3.046 -1.569 1.00 0.00 C ATOM 1095 CD2 LEU A 76 -0.399 1.564 -2.737 1.00 0.00 C ATOM 0 H LEU A 76 2.678 2.955 -5.634 1.00 0.00 H new ATOM 0 HA LEU A 76 0.011 1.840 -5.321 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.693 3.971 -4.022 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -0.046 4.027 -3.810 1.00 0.00 H new ATOM 0 HG LEU A 76 1.698 1.645 -3.107 1.00 0.00 H new ATOM 0 HD11 LEU A 76 1.313 2.309 -0.769 1.00 0.00 H new ATOM 0 HD12 LEU A 76 2.197 3.561 -1.674 1.00 0.00 H new ATOM 0 HD13 LEU A 76 0.464 3.770 -1.328 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -0.307 0.847 -1.921 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.218 2.251 -2.526 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -0.603 1.031 -3.666 1.00 0.00 H new ATOM 1107 N LYS A 77 -1.307 3.302 -6.798 1.00 0.00 N ATOM 1108 CA LYS A 77 -2.123 4.141 -7.668 1.00 0.00 C ATOM 1109 C LYS A 77 -3.328 4.694 -6.915 1.00 0.00 C ATOM 1110 O LYS A 77 -4.170 3.937 -6.430 1.00 0.00 O ATOM 1111 CB LYS A 77 -2.590 3.344 -8.887 1.00 0.00 C ATOM 1112 CG LYS A 77 -2.988 4.216 -10.068 1.00 0.00 C ATOM 1113 CD LYS A 77 -4.029 3.532 -10.939 1.00 0.00 C ATOM 1114 CE LYS A 77 -3.383 2.605 -11.954 1.00 0.00 C ATOM 1115 NZ LYS A 77 -4.345 1.596 -12.478 1.00 0.00 N ATOM 0 H LYS A 77 -1.700 2.380 -6.612 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.511 4.979 -8.003 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -1.792 2.669 -9.197 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -3.439 2.724 -8.601 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -3.383 5.165 -9.704 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.106 4.446 -10.666 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -4.715 2.964 -10.310 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -4.622 4.285 -11.458 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -2.987 3.193 -12.782 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -2.537 2.095 -11.493 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -3.864 0.983 -13.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -4.704 1.017 -11.692 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -5.140 2.082 -12.941 1.00 0.00 H new ATOM 1129 N SER A 78 -3.405 6.017 -6.821 1.00 0.00 N ATOM 1130 CA SER A 78 -4.508 6.672 -6.126 1.00 0.00 C ATOM 1131 C SER A 78 -5.844 6.323 -6.776 1.00 0.00 C ATOM 1132 O SER A 78 -5.885 5.781 -7.880 1.00 0.00 O ATOM 1133 CB SER A 78 -4.309 8.189 -6.124 1.00 0.00 C ATOM 1134 OG SER A 78 -4.334 8.710 -7.442 1.00 0.00 O ATOM 0 H SER A 78 -2.717 6.657 -7.217 1.00 0.00 H new ATOM 0 HA SER A 78 -4.520 6.313 -5.097 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.091 8.660 -5.529 1.00 0.00 H new ATOM 0 HB3 SER A 78 -3.358 8.433 -5.651 1.00 0.00 H new ATOM 0 HG SER A 78 -4.206 9.681 -7.412 1.00 0.00 H new ATOM 1140 N GLY A 79 -6.933 6.639 -6.084 1.00 0.00 N ATOM 1141 CA GLY A 79 -8.255 6.352 -6.609 1.00 0.00 C ATOM 1142 C GLY A 79 -8.517 7.042 -7.933 1.00 0.00 C ATOM 1143 O GLY A 79 -9.132 6.465 -8.831 1.00 0.00 O ATOM 0 H GLY A 79 -6.924 7.089 -5.169 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -8.366 5.275 -6.736 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -9.006 6.666 -5.884 1.00 0.00 H new ATOM 1147 N TYR A 80 -8.049 8.280 -8.057 1.00 0.00 N ATOM 1148 CA TYR A 80 -8.236 9.049 -9.281 1.00 0.00 C ATOM 1149 C TYR A 80 -7.590 8.345 -10.471 1.00 0.00 C ATOM 1150 O TYR A 80 -8.055 8.468 -11.604 1.00 0.00 O ATOM 1151 CB TYR A 80 -7.646 10.452 -9.122 1.00 0.00 C ATOM 1152 CG TYR A 80 -8.345 11.289 -8.076 1.00 0.00 C ATOM 1153 CD1 TYR A 80 -9.731 11.389 -8.052 1.00 0.00 C ATOM 1154 CD2 TYR A 80 -7.621 11.981 -7.114 1.00 0.00 C ATOM 1155 CE1 TYR A 80 -10.374 12.154 -7.098 1.00 0.00 C ATOM 1156 CE2 TYR A 80 -8.257 12.749 -6.157 1.00 0.00 C ATOM 1157 CZ TYR A 80 -9.633 12.831 -6.152 1.00 0.00 C ATOM 1158 OH TYR A 80 -10.271 13.594 -5.201 1.00 0.00 O ATOM 0 H TYR A 80 -7.537 8.772 -7.324 1.00 0.00 H new ATOM 0 HA TYR A 80 -9.307 9.131 -9.468 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -6.591 10.366 -8.861 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -7.696 10.968 -10.081 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -10.315 10.860 -8.791 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -6.543 11.918 -7.114 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -11.452 12.222 -7.093 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -7.679 13.282 -5.417 1.00 0.00 H new ATOM 0 HH TYR A 80 -9.605 14.004 -4.610 1.00 0.00 H new ATOM 1168 N GLY A 81 -6.517 7.607 -10.205 1.00 0.00 N ATOM 1169 CA GLY A 81 -5.826 6.895 -11.264 1.00 0.00 C ATOM 1170 C GLY A 81 -4.423 7.421 -11.497 1.00 0.00 C ATOM 1171 O GLY A 81 -3.914 7.374 -12.617 1.00 0.00 O ATOM 0 H GLY A 81 -6.114 7.489 -9.275 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -5.776 5.835 -11.013 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -6.400 6.977 -12.187 1.00 0.00 H new ATOM 1175 N LYS A 82 -3.798 7.924 -10.438 1.00 0.00 N ATOM 1176 CA LYS A 82 -2.445 8.461 -10.531 1.00 0.00 C ATOM 1177 C LYS A 82 -1.484 7.670 -9.650 1.00 0.00 C ATOM 1178 O LYS A 82 -1.861 7.181 -8.585 1.00 0.00 O ATOM 1179 CB LYS A 82 -2.432 9.936 -10.125 1.00 0.00 C ATOM 1180 CG LYS A 82 -2.834 10.880 -11.246 1.00 0.00 C ATOM 1181 CD LYS A 82 -2.311 12.287 -11.004 1.00 0.00 C ATOM 1182 CE LYS A 82 -2.025 13.011 -12.311 1.00 0.00 C ATOM 1183 NZ LYS A 82 -2.684 14.344 -12.362 1.00 0.00 N ATOM 0 H LYS A 82 -4.207 7.971 -9.505 1.00 0.00 H new ATOM 0 HA LYS A 82 -2.115 8.373 -11.566 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.108 10.078 -9.282 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.432 10.200 -9.780 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.448 10.505 -12.194 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -3.920 10.904 -11.331 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -3.042 12.853 -10.426 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -1.400 12.240 -10.407 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -0.948 13.133 -12.430 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -2.371 12.403 -13.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -2.465 14.805 -13.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -3.713 14.226 -12.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -2.335 14.934 -11.580 1.00 0.00 H new ATOM 1197 N TYR A 83 -0.240 7.548 -10.101 1.00 0.00 N ATOM 1198 CA TYR A 83 0.776 6.817 -9.353 1.00 0.00 C ATOM 1199 C TYR A 83 1.390 7.695 -8.267 1.00 0.00 C ATOM 1200 O TYR A 83 1.757 8.843 -8.518 1.00 0.00 O ATOM 1201 CB TYR A 83 1.869 6.312 -10.296 1.00 0.00 C ATOM 1202 CG TYR A 83 1.462 5.100 -11.103 1.00 0.00 C ATOM 1203 CD1 TYR A 83 1.557 3.821 -10.568 1.00 0.00 C ATOM 1204 CD2 TYR A 83 0.982 5.235 -12.400 1.00 0.00 C ATOM 1205 CE1 TYR A 83 1.186 2.711 -11.303 1.00 0.00 C ATOM 1206 CE2 TYR A 83 0.609 4.130 -13.141 1.00 0.00 C ATOM 1207 CZ TYR A 83 0.713 2.871 -12.589 1.00 0.00 C ATOM 1208 OH TYR A 83 0.342 1.769 -13.324 1.00 0.00 O ATOM 0 H TYR A 83 0.089 7.946 -10.981 1.00 0.00 H new ATOM 0 HA TYR A 83 0.295 5.963 -8.875 1.00 0.00 H new ATOM 0 HB2 TYR A 83 2.148 7.115 -10.978 1.00 0.00 H new ATOM 0 HB3 TYR A 83 2.756 6.068 -9.712 1.00 0.00 H new ATOM 0 HD1 TYR A 83 1.927 3.692 -9.561 1.00 0.00 H new ATOM 0 HD2 TYR A 83 0.899 6.220 -12.836 1.00 0.00 H new ATOM 0 HE1 TYR A 83 1.266 1.724 -10.873 1.00 0.00 H new ATOM 0 HE2 TYR A 83 0.238 4.252 -14.148 1.00 0.00 H new ATOM 0 HH TYR A 83 0.030 2.055 -14.208 1.00 0.00 H new ATOM 1218 N LEU A 84 1.499 7.149 -7.061 1.00 0.00 N ATOM 1219 CA LEU A 84 2.068 7.882 -5.937 1.00 0.00 C ATOM 1220 C LEU A 84 3.572 8.066 -6.114 1.00 0.00 C ATOM 1221 O LEU A 84 4.319 7.093 -6.221 1.00 0.00 O ATOM 1222 CB LEU A 84 1.784 7.148 -4.625 1.00 0.00 C ATOM 1223 CG LEU A 84 0.318 7.147 -4.188 1.00 0.00 C ATOM 1224 CD1 LEU A 84 0.149 6.377 -2.887 1.00 0.00 C ATOM 1225 CD2 LEU A 84 -0.194 8.571 -4.039 1.00 0.00 C ATOM 0 H LEU A 84 1.200 6.200 -6.837 1.00 0.00 H new ATOM 0 HA LEU A 84 1.600 8.866 -5.903 1.00 0.00 H new ATOM 0 HB2 LEU A 84 2.118 6.115 -4.724 1.00 0.00 H new ATOM 0 HB3 LEU A 84 2.382 7.602 -3.835 1.00 0.00 H new ATOM 0 HG LEU A 84 -0.271 6.650 -4.958 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.900 6.387 -2.592 1.00 0.00 H new ATOM 0 HD12 LEU A 84 0.476 5.347 -3.029 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.750 6.844 -2.107 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -1.238 8.551 -3.728 1.00 0.00 H new ATOM 0 HD22 LEU A 84 0.399 9.094 -3.288 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.110 9.090 -4.994 1.00 0.00 H new ATOM 1237 N GLY A 85 4.010 9.321 -6.145 1.00 0.00 N ATOM 1238 CA GLY A 85 5.422 9.611 -6.310 1.00 0.00 C ATOM 1239 C GLY A 85 5.932 10.612 -5.292 1.00 0.00 C ATOM 1240 O GLY A 85 5.298 11.639 -5.049 1.00 0.00 O ATOM 0 H GLY A 85 3.411 10.142 -6.059 1.00 0.00 H new ATOM 0 HA2 GLY A 85 5.992 8.686 -6.223 1.00 0.00 H new ATOM 0 HA3 GLY A 85 5.595 9.998 -7.314 1.00 0.00 H new ATOM 1244 N ILE A 86 7.083 10.314 -4.696 1.00 0.00 N ATOM 1245 CA ILE A 86 7.678 11.195 -3.700 1.00 0.00 C ATOM 1246 C ILE A 86 8.343 12.400 -4.358 1.00 0.00 C ATOM 1247 O ILE A 86 9.120 12.254 -5.302 1.00 0.00 O ATOM 1248 CB ILE A 86 8.724 10.453 -2.845 1.00 0.00 C ATOM 1249 CG1 ILE A 86 9.725 9.723 -3.742 1.00 0.00 C ATOM 1250 CG2 ILE A 86 8.038 9.474 -1.902 1.00 0.00 C ATOM 1251 CD1 ILE A 86 11.147 9.777 -3.228 1.00 0.00 C ATOM 0 H ILE A 86 7.621 9.469 -4.887 1.00 0.00 H new ATOM 0 HA ILE A 86 6.867 11.535 -3.056 1.00 0.00 H new ATOM 0 HB ILE A 86 9.268 11.185 -2.247 1.00 0.00 H new ATOM 0 HG12 ILE A 86 9.421 8.681 -3.839 1.00 0.00 H new ATOM 0 HG13 ILE A 86 9.691 10.159 -4.741 1.00 0.00 H new ATOM 0 HG21 ILE A 86 8.789 8.957 -1.305 1.00 0.00 H new ATOM 0 HG22 ILE A 86 7.361 10.017 -1.243 1.00 0.00 H new ATOM 0 HG23 ILE A 86 7.472 8.745 -2.483 1.00 0.00 H new ATOM 0 HD11 ILE A 86 11.802 9.239 -3.913 1.00 0.00 H new ATOM 0 HD12 ILE A 86 11.469 10.816 -3.158 1.00 0.00 H new ATOM 0 HD13 ILE A 86 11.195 9.315 -2.242 1.00 0.00 H new ATOM 1263 N ASN A 87 8.032 13.590 -3.855 1.00 0.00 N ATOM 1264 CA ASN A 87 8.600 14.820 -4.395 1.00 0.00 C ATOM 1265 C ASN A 87 10.110 14.861 -4.182 1.00 0.00 C ATOM 1266 O ASN A 87 10.680 13.976 -3.541 1.00 0.00 O ATOM 1267 CB ASN A 87 7.948 16.039 -3.740 1.00 0.00 C ATOM 1268 CG ASN A 87 7.893 17.234 -4.669 1.00 0.00 C ATOM 1269 OD1 ASN A 87 8.428 17.199 -5.779 1.00 0.00 O ATOM 1270 ND2 ASN A 87 7.245 18.304 -4.222 1.00 0.00 N ATOM 0 H ASN A 87 7.390 13.729 -3.075 1.00 0.00 H new ATOM 0 HA ASN A 87 8.401 14.842 -5.466 1.00 0.00 H new ATOM 0 HB2 ASN A 87 6.937 15.781 -3.424 1.00 0.00 H new ATOM 0 HB3 ASN A 87 8.504 16.306 -2.841 1.00 0.00 H new ATOM 0 HD21 ASN A 87 7.176 19.139 -4.804 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.816 18.291 -3.297 1.00 0.00 H new ATOM 1277 N SER A 88 10.752 15.891 -4.721 1.00 0.00 N ATOM 1278 CA SER A 88 12.195 16.046 -4.589 1.00 0.00 C ATOM 1279 C SER A 88 12.600 16.155 -3.122 1.00 0.00 C ATOM 1280 O SER A 88 13.601 15.577 -2.700 1.00 0.00 O ATOM 1281 CB SER A 88 12.668 17.284 -5.353 1.00 0.00 C ATOM 1282 OG SER A 88 14.064 17.478 -5.198 1.00 0.00 O ATOM 0 H SER A 88 10.295 16.631 -5.254 1.00 0.00 H new ATOM 0 HA SER A 88 12.670 15.161 -5.013 1.00 0.00 H new ATOM 0 HB2 SER A 88 12.428 17.176 -6.411 1.00 0.00 H new ATOM 0 HB3 SER A 88 12.134 18.163 -4.993 1.00 0.00 H new ATOM 0 HG SER A 88 14.341 18.275 -5.697 1.00 0.00 H new ATOM 1288 N ASP A 89 11.815 16.899 -2.352 1.00 0.00 N ATOM 1289 CA ASP A 89 12.090 17.084 -0.931 1.00 0.00 C ATOM 1290 C ASP A 89 11.770 15.817 -0.144 1.00 0.00 C ATOM 1291 O ASP A 89 12.553 15.386 0.702 1.00 0.00 O ATOM 1292 CB ASP A 89 11.279 18.259 -0.383 1.00 0.00 C ATOM 1293 CG ASP A 89 12.038 19.570 -0.457 1.00 0.00 C ATOM 1294 OD1 ASP A 89 12.828 19.745 -1.406 1.00 0.00 O ATOM 1295 OD2 ASP A 89 11.838 20.421 0.435 1.00 0.00 O ATOM 0 H ASP A 89 10.983 17.384 -2.687 1.00 0.00 H new ATOM 0 HA ASP A 89 13.152 17.300 -0.817 1.00 0.00 H new ATOM 0 HB2 ASP A 89 10.349 18.348 -0.945 1.00 0.00 H new ATOM 0 HB3 ASP A 89 11.007 18.058 0.653 1.00 0.00 H new ATOM 1300 N GLY A 90 10.615 15.227 -0.429 1.00 0.00 N ATOM 1301 CA GLY A 90 10.211 14.016 0.261 1.00 0.00 C ATOM 1302 C GLY A 90 8.750 14.037 0.664 1.00 0.00 C ATOM 1303 O GLY A 90 8.403 13.671 1.787 1.00 0.00 O ATOM 0 H GLY A 90 9.951 15.565 -1.125 1.00 0.00 H new ATOM 0 HA2 GLY A 90 10.394 13.156 -0.383 1.00 0.00 H new ATOM 0 HA3 GLY A 90 10.828 13.885 1.150 1.00 0.00 H new ATOM 1307 N LEU A 91 7.892 14.468 -0.255 1.00 0.00 N ATOM 1308 CA LEU A 91 6.458 14.537 0.010 1.00 0.00 C ATOM 1309 C LEU A 91 5.702 13.506 -0.820 1.00 0.00 C ATOM 1310 O LEU A 91 5.990 13.313 -2.002 1.00 0.00 O ATOM 1311 CB LEU A 91 5.930 15.940 -0.294 1.00 0.00 C ATOM 1312 CG LEU A 91 4.723 16.372 0.542 1.00 0.00 C ATOM 1313 CD1 LEU A 91 5.175 17.171 1.755 1.00 0.00 C ATOM 1314 CD2 LEU A 91 3.752 17.183 -0.303 1.00 0.00 C ATOM 0 H LEU A 91 8.164 14.775 -1.189 1.00 0.00 H new ATOM 0 HA LEU A 91 6.297 14.316 1.065 1.00 0.00 H new ATOM 0 HB2 LEU A 91 6.736 16.657 -0.138 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.659 15.989 -1.349 1.00 0.00 H new ATOM 0 HG LEU A 91 4.207 15.478 0.893 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.304 17.470 2.339 1.00 0.00 H new ATOM 0 HD12 LEU A 91 5.831 16.557 2.371 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.714 18.059 1.425 1.00 0.00 H new ATOM 0 HD21 LEU A 91 2.900 17.482 0.308 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.255 18.072 -0.683 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.404 16.577 -1.140 1.00 0.00 H new ATOM 1326 N VAL A 92 4.734 12.843 -0.195 1.00 0.00 N ATOM 1327 CA VAL A 92 3.936 11.832 -0.876 1.00 0.00 C ATOM 1328 C VAL A 92 2.906 12.476 -1.798 1.00 0.00 C ATOM 1329 O VAL A 92 1.747 12.652 -1.424 1.00 0.00 O ATOM 1330 CB VAL A 92 3.208 10.919 0.129 1.00 0.00 C ATOM 1331 CG1 VAL A 92 2.508 9.777 -0.595 1.00 0.00 C ATOM 1332 CG2 VAL A 92 4.183 10.382 1.168 1.00 0.00 C ATOM 0 H VAL A 92 4.484 12.989 0.783 1.00 0.00 H new ATOM 0 HA VAL A 92 4.626 11.230 -1.468 1.00 0.00 H new ATOM 0 HB VAL A 92 2.451 11.510 0.645 1.00 0.00 H new ATOM 0 HG11 VAL A 92 2.000 9.143 0.131 1.00 0.00 H new ATOM 0 HG12 VAL A 92 1.779 10.183 -1.296 1.00 0.00 H new ATOM 0 HG13 VAL A 92 3.244 9.186 -1.140 1.00 0.00 H new ATOM 0 HG21 VAL A 92 3.650 9.739 1.869 1.00 0.00 H new ATOM 0 HG22 VAL A 92 4.965 9.807 0.671 1.00 0.00 H new ATOM 0 HG23 VAL A 92 4.633 11.214 1.709 1.00 0.00 H new ATOM 1342 N VAL A 93 3.338 12.826 -3.006 1.00 0.00 N ATOM 1343 CA VAL A 93 2.453 13.451 -3.982 1.00 0.00 C ATOM 1344 C VAL A 93 2.050 12.462 -5.070 1.00 0.00 C ATOM 1345 O VAL A 93 2.631 11.382 -5.188 1.00 0.00 O ATOM 1346 CB VAL A 93 3.117 14.676 -4.639 1.00 0.00 C ATOM 1347 CG1 VAL A 93 3.311 15.788 -3.621 1.00 0.00 C ATOM 1348 CG2 VAL A 93 4.443 14.287 -5.274 1.00 0.00 C ATOM 0 H VAL A 93 4.295 12.687 -3.332 1.00 0.00 H new ATOM 0 HA VAL A 93 1.564 13.775 -3.441 1.00 0.00 H new ATOM 0 HB VAL A 93 2.459 15.046 -5.425 1.00 0.00 H new ATOM 0 HG11 VAL A 93 3.781 16.645 -4.103 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.343 16.085 -3.217 1.00 0.00 H new ATOM 0 HG13 VAL A 93 3.948 15.433 -2.811 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.898 15.165 -5.733 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.111 13.891 -4.509 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.272 13.526 -6.036 1.00 0.00 H new ATOM 1358 N GLY A 94 1.052 12.836 -5.864 1.00 0.00 N ATOM 1359 CA GLY A 94 0.589 11.971 -6.932 1.00 0.00 C ATOM 1360 C GLY A 94 0.322 12.729 -8.218 1.00 0.00 C ATOM 1361 O GLY A 94 -0.805 13.152 -8.474 1.00 0.00 O ATOM 0 H GLY A 94 0.556 13.724 -5.786 1.00 0.00 H new ATOM 0 HA2 GLY A 94 1.334 11.198 -7.118 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -0.323 11.465 -6.616 1.00 0.00 H new ATOM 1365 N ARG A 95 1.362 12.900 -9.028 1.00 0.00 N ATOM 1366 CA ARG A 95 1.234 13.612 -10.294 1.00 0.00 C ATOM 1367 C ARG A 95 2.332 13.194 -11.267 1.00 0.00 C ATOM 1368 O ARG A 95 3.326 13.901 -11.438 1.00 0.00 O ATOM 1369 CB ARG A 95 1.291 15.124 -10.061 1.00 0.00 C ATOM 1370 CG ARG A 95 2.546 15.580 -9.334 1.00 0.00 C ATOM 1371 CD ARG A 95 2.257 16.751 -8.409 1.00 0.00 C ATOM 1372 NE ARG A 95 2.440 18.036 -9.078 1.00 0.00 N ATOM 1373 CZ ARG A 95 2.597 19.191 -8.436 1.00 0.00 C ATOM 1374 NH1 ARG A 95 2.594 19.226 -7.109 1.00 0.00 N ATOM 1375 NH2 ARG A 95 2.757 20.314 -9.122 1.00 0.00 N ATOM 0 H ARG A 95 2.302 12.556 -8.830 1.00 0.00 H new ATOM 0 HA ARG A 95 0.269 13.355 -10.731 1.00 0.00 H new ATOM 0 HB2 ARG A 95 1.232 15.634 -11.023 1.00 0.00 H new ATOM 0 HB3 ARG A 95 0.417 15.428 -9.485 1.00 0.00 H new ATOM 0 HG2 ARG A 95 2.955 14.751 -8.757 1.00 0.00 H new ATOM 0 HG3 ARG A 95 3.305 15.868 -10.061 1.00 0.00 H new ATOM 0 HD2 ARG A 95 1.234 16.677 -8.040 1.00 0.00 H new ATOM 0 HD3 ARG A 95 2.914 16.698 -7.541 1.00 0.00 H new ATOM 0 HE ARG A 95 2.448 18.049 -10.098 1.00 0.00 H new ATOM 0 HH11 ARG A 95 2.471 18.365 -6.576 1.00 0.00 H new ATOM 0 HH12 ARG A 95 2.715 20.114 -6.622 1.00 0.00 H new ATOM 0 HH21 ARG A 95 2.760 20.293 -10.142 1.00 0.00 H new ATOM 0 HH22 ARG A 95 2.877 21.199 -8.630 1.00 0.00 H new ATOM 1389 N SER A 96 2.147 12.042 -11.902 1.00 0.00 N ATOM 1390 CA SER A 96 3.122 11.530 -12.857 1.00 0.00 C ATOM 1391 C SER A 96 2.461 10.586 -13.857 1.00 0.00 C ATOM 1392 O SER A 96 2.668 10.702 -15.065 1.00 0.00 O ATOM 1393 CB SER A 96 4.253 10.805 -12.125 1.00 0.00 C ATOM 1394 OG SER A 96 5.356 11.668 -11.908 1.00 0.00 O ATOM 0 H SER A 96 1.330 11.445 -11.772 1.00 0.00 H new ATOM 0 HA SER A 96 3.537 12.377 -13.403 1.00 0.00 H new ATOM 0 HB2 SER A 96 3.889 10.428 -11.169 1.00 0.00 H new ATOM 0 HB3 SER A 96 4.572 9.941 -12.708 1.00 0.00 H new ATOM 0 HG SER A 96 5.829 11.396 -11.094 1.00 0.00 H new ATOM 1400 N ASP A 97 1.665 9.654 -13.345 1.00 0.00 N ATOM 1401 CA ASP A 97 0.973 8.691 -14.193 1.00 0.00 C ATOM 1402 C ASP A 97 1.968 7.854 -14.991 1.00 0.00 C ATOM 1403 O ASP A 97 1.683 7.434 -16.112 1.00 0.00 O ATOM 1404 CB ASP A 97 0.016 9.412 -15.145 1.00 0.00 C ATOM 1405 CG ASP A 97 -1.202 8.575 -15.485 1.00 0.00 C ATOM 1406 OD1 ASP A 97 -1.597 7.735 -14.650 1.00 0.00 O ATOM 1407 OD2 ASP A 97 -1.761 8.761 -16.586 1.00 0.00 O ATOM 0 H ASP A 97 1.483 9.545 -12.347 1.00 0.00 H new ATOM 0 HA ASP A 97 0.400 8.024 -13.549 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -0.306 10.349 -14.691 1.00 0.00 H new ATOM 0 HB3 ASP A 97 0.545 9.668 -16.063 1.00 0.00 H new ATOM 1412 N ALA A 98 3.137 7.616 -14.404 1.00 0.00 N ATOM 1413 CA ALA A 98 4.174 6.830 -15.059 1.00 0.00 C ATOM 1414 C ALA A 98 5.104 6.187 -14.036 1.00 0.00 C ATOM 1415 O ALA A 98 5.414 6.782 -13.004 1.00 0.00 O ATOM 1416 CB ALA A 98 4.967 7.702 -16.022 1.00 0.00 C ATOM 0 H ALA A 98 3.389 7.957 -13.476 1.00 0.00 H new ATOM 0 HA ALA A 98 3.690 6.032 -15.622 1.00 0.00 H new ATOM 0 HB1 ALA A 98 5.739 7.102 -16.505 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.297 8.110 -16.779 1.00 0.00 H new ATOM 0 HB3 ALA A 98 5.434 8.520 -15.472 1.00 0.00 H new ATOM 1422 N ILE A 99 5.547 4.968 -14.328 1.00 0.00 N ATOM 1423 CA ILE A 99 6.442 4.246 -13.433 1.00 0.00 C ATOM 1424 C ILE A 99 7.835 4.865 -13.429 1.00 0.00 C ATOM 1425 O ILE A 99 8.564 4.785 -14.418 1.00 0.00 O ATOM 1426 CB ILE A 99 6.553 2.760 -13.827 1.00 0.00 C ATOM 1427 CG1 ILE A 99 5.163 2.158 -14.034 1.00 0.00 C ATOM 1428 CG2 ILE A 99 7.320 1.987 -12.765 1.00 0.00 C ATOM 1429 CD1 ILE A 99 4.269 2.272 -12.818 1.00 0.00 C ATOM 0 H ILE A 99 5.300 4.460 -15.178 1.00 0.00 H new ATOM 0 HA ILE A 99 6.014 4.318 -12.433 1.00 0.00 H new ATOM 0 HB ILE A 99 7.101 2.689 -14.767 1.00 0.00 H new ATOM 0 HG12 ILE A 99 4.682 2.655 -14.877 1.00 0.00 H new ATOM 0 HG13 ILE A 99 5.267 1.106 -14.301 1.00 0.00 H new ATOM 0 HG21 ILE A 99 7.390 0.939 -13.057 1.00 0.00 H new ATOM 0 HG22 ILE A 99 8.322 2.404 -12.664 1.00 0.00 H new ATOM 0 HG23 ILE A 99 6.798 2.063 -11.811 1.00 0.00 H new ATOM 0 HD11 ILE A 99 3.299 1.825 -13.036 1.00 0.00 H new ATOM 0 HD12 ILE A 99 4.729 1.751 -11.978 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.134 3.323 -12.563 1.00 0.00 H new ATOM 1441 N GLY A 100 8.198 5.485 -12.311 1.00 0.00 N ATOM 1442 CA GLY A 100 9.503 6.110 -12.199 1.00 0.00 C ATOM 1443 C GLY A 100 10.218 5.735 -10.915 1.00 0.00 C ATOM 1444 O GLY A 100 9.613 5.160 -10.010 1.00 0.00 O ATOM 0 H GLY A 100 7.612 5.566 -11.480 1.00 0.00 H new ATOM 0 HA2 GLY A 100 10.117 5.818 -13.051 1.00 0.00 H new ATOM 0 HA3 GLY A 100 9.389 7.193 -12.245 1.00 0.00 H new ATOM 1448 N PRO A 101 11.520 6.050 -10.804 1.00 0.00 N ATOM 1449 CA PRO A 101 12.311 5.735 -9.610 1.00 0.00 C ATOM 1450 C PRO A 101 11.668 6.266 -8.333 1.00 0.00 C ATOM 1451 O PRO A 101 11.536 5.544 -7.345 1.00 0.00 O ATOM 1452 CB PRO A 101 13.646 6.439 -9.867 1.00 0.00 C ATOM 1453 CG PRO A 101 13.735 6.557 -11.349 1.00 0.00 C ATOM 1454 CD PRO A 101 12.323 6.735 -11.834 1.00 0.00 C ATOM 0 HA PRO A 101 12.405 4.660 -9.458 1.00 0.00 H new ATOM 0 HB2 PRO A 101 13.675 7.419 -9.390 1.00 0.00 H new ATOM 0 HB3 PRO A 101 14.480 5.864 -9.465 1.00 0.00 H new ATOM 0 HG2 PRO A 101 14.357 7.405 -11.637 1.00 0.00 H new ATOM 0 HG3 PRO A 101 14.188 5.667 -11.785 1.00 0.00 H new ATOM 0 HD2 PRO A 101 12.056 7.789 -11.917 1.00 0.00 H new ATOM 0 HD3 PRO A 101 12.177 6.291 -12.819 1.00 0.00 H new ATOM 1462 N ARG A 102 11.270 7.534 -8.360 1.00 0.00 N ATOM 1463 CA ARG A 102 10.641 8.163 -7.204 1.00 0.00 C ATOM 1464 C ARG A 102 9.297 7.510 -6.891 1.00 0.00 C ATOM 1465 O ARG A 102 8.918 7.376 -5.728 1.00 0.00 O ATOM 1466 CB ARG A 102 10.449 9.660 -7.454 1.00 0.00 C ATOM 1467 CG ARG A 102 11.739 10.459 -7.377 1.00 0.00 C ATOM 1468 CD ARG A 102 11.622 11.776 -8.127 1.00 0.00 C ATOM 1469 NE ARG A 102 12.926 12.395 -8.352 1.00 0.00 N ATOM 1470 CZ ARG A 102 13.150 13.345 -9.259 1.00 0.00 C ATOM 1471 NH1 ARG A 102 12.160 13.786 -10.026 1.00 0.00 N ATOM 1472 NH2 ARG A 102 14.366 13.854 -9.398 1.00 0.00 N ATOM 0 H ARG A 102 11.372 8.146 -9.170 1.00 0.00 H new ATOM 0 HA ARG A 102 11.298 8.026 -6.345 1.00 0.00 H new ATOM 0 HB2 ARG A 102 10.002 9.801 -8.438 1.00 0.00 H new ATOM 0 HB3 ARG A 102 9.743 10.054 -6.723 1.00 0.00 H new ATOM 0 HG2 ARG A 102 11.986 10.654 -6.333 1.00 0.00 H new ATOM 0 HG3 ARG A 102 12.557 9.872 -7.794 1.00 0.00 H new ATOM 0 HD2 ARG A 102 11.132 11.605 -9.085 1.00 0.00 H new ATOM 0 HD3 ARG A 102 10.989 12.460 -7.562 1.00 0.00 H new ATOM 0 HE ARG A 102 13.711 12.082 -7.781 1.00 0.00 H new ATOM 0 HH11 ARG A 102 11.223 13.397 -9.922 1.00 0.00 H new ATOM 0 HH12 ARG A 102 12.337 14.513 -10.719 1.00 0.00 H new ATOM 0 HH21 ARG A 102 15.130 13.518 -8.811 1.00 0.00 H new ATOM 0 HH22 ARG A 102 14.538 14.581 -10.092 1.00 0.00 H new ATOM 1486 N GLU A 103 8.583 7.109 -7.937 1.00 0.00 N ATOM 1487 CA GLU A 103 7.281 6.471 -7.773 1.00 0.00 C ATOM 1488 C GLU A 103 7.432 5.036 -7.275 1.00 0.00 C ATOM 1489 O GLU A 103 6.538 4.499 -6.622 1.00 0.00 O ATOM 1490 CB GLU A 103 6.513 6.488 -9.097 1.00 0.00 C ATOM 1491 CG GLU A 103 5.509 7.625 -9.202 1.00 0.00 C ATOM 1492 CD GLU A 103 6.052 8.812 -9.973 1.00 0.00 C ATOM 1493 OE1 GLU A 103 6.791 8.594 -10.955 1.00 0.00 O ATOM 1494 OE2 GLU A 103 5.736 9.960 -9.596 1.00 0.00 O ATOM 0 H GLU A 103 8.883 7.214 -8.906 1.00 0.00 H new ATOM 0 HA GLU A 103 6.720 7.034 -7.027 1.00 0.00 H new ATOM 0 HB2 GLU A 103 7.224 6.565 -9.919 1.00 0.00 H new ATOM 0 HB3 GLU A 103 5.989 5.539 -9.216 1.00 0.00 H new ATOM 0 HG2 GLU A 103 4.604 7.262 -9.690 1.00 0.00 H new ATOM 0 HG3 GLU A 103 5.224 7.947 -8.200 1.00 0.00 H new ATOM 1501 N GLN A 104 8.568 4.420 -7.589 1.00 0.00 N ATOM 1502 CA GLN A 104 8.833 3.047 -7.173 1.00 0.00 C ATOM 1503 C GLN A 104 8.784 2.917 -5.654 1.00 0.00 C ATOM 1504 O GLN A 104 9.292 3.774 -4.930 1.00 0.00 O ATOM 1505 CB GLN A 104 10.199 2.591 -7.690 1.00 0.00 C ATOM 1506 CG GLN A 104 10.146 1.956 -9.070 1.00 0.00 C ATOM 1507 CD GLN A 104 11.522 1.763 -9.675 1.00 0.00 C ATOM 1508 OE1 GLN A 104 12.530 1.771 -8.969 1.00 0.00 O ATOM 1509 NE2 GLN A 104 11.571 1.587 -10.991 1.00 0.00 N ATOM 0 H GLN A 104 9.319 4.850 -8.130 1.00 0.00 H new ATOM 0 HA GLN A 104 8.058 2.410 -7.599 1.00 0.00 H new ATOM 0 HB2 GLN A 104 10.872 3.448 -7.719 1.00 0.00 H new ATOM 0 HB3 GLN A 104 10.624 1.876 -6.986 1.00 0.00 H new ATOM 0 HG2 GLN A 104 9.644 0.991 -9.003 1.00 0.00 H new ATOM 0 HG3 GLN A 104 9.547 2.582 -9.731 1.00 0.00 H new ATOM 0 HE21 GLN A 104 10.710 1.587 -11.538 1.00 0.00 H new ATOM 0 HE22 GLN A 104 12.470 1.451 -11.454 1.00 0.00 H new ATOM 1518 N TRP A 105 8.170 1.838 -5.177 1.00 0.00 N ATOM 1519 CA TRP A 105 8.055 1.593 -3.743 1.00 0.00 C ATOM 1520 C TRP A 105 8.678 0.252 -3.370 1.00 0.00 C ATOM 1521 O TRP A 105 9.189 -0.467 -4.229 1.00 0.00 O ATOM 1522 CB TRP A 105 6.587 1.622 -3.315 1.00 0.00 C ATOM 1523 CG TRP A 105 5.950 2.971 -3.461 1.00 0.00 C ATOM 1524 CD1 TRP A 105 5.189 3.408 -4.506 1.00 0.00 C ATOM 1525 CD2 TRP A 105 6.019 4.058 -2.532 1.00 0.00 C ATOM 1526 NE1 TRP A 105 4.781 4.701 -4.284 1.00 0.00 N ATOM 1527 CE2 TRP A 105 5.278 5.122 -3.078 1.00 0.00 C ATOM 1528 CE3 TRP A 105 6.635 4.234 -1.289 1.00 0.00 C ATOM 1529 CZ2 TRP A 105 5.136 6.344 -2.426 1.00 0.00 C ATOM 1530 CZ3 TRP A 105 6.495 5.448 -0.643 1.00 0.00 C ATOM 1531 CH2 TRP A 105 5.750 6.489 -1.212 1.00 0.00 C ATOM 0 H TRP A 105 7.744 1.119 -5.763 1.00 0.00 H new ATOM 0 HA TRP A 105 8.594 2.383 -3.220 1.00 0.00 H new ATOM 0 HB2 TRP A 105 6.029 0.899 -3.909 1.00 0.00 H new ATOM 0 HB3 TRP A 105 6.513 1.304 -2.275 1.00 0.00 H new ATOM 0 HD1 TRP A 105 4.943 2.823 -5.380 1.00 0.00 H new ATOM 0 HE1 TRP A 105 4.203 5.257 -4.914 1.00 0.00 H new ATOM 0 HE3 TRP A 105 7.210 3.436 -0.842 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 4.562 7.148 -2.863 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 6.968 5.596 0.317 1.00 0.00 H new ATOM 0 HH2 TRP A 105 5.658 7.425 -0.681 1.00 0.00 H new ATOM 1542 N GLU A 106 8.632 -0.080 -2.084 1.00 0.00 N ATOM 1543 CA GLU A 106 9.192 -1.337 -1.600 1.00 0.00 C ATOM 1544 C GLU A 106 8.701 -1.646 -0.187 1.00 0.00 C ATOM 1545 O GLU A 106 9.273 -1.172 0.794 1.00 0.00 O ATOM 1546 CB GLU A 106 10.721 -1.279 -1.617 1.00 0.00 C ATOM 1547 CG GLU A 106 11.382 -2.646 -1.537 1.00 0.00 C ATOM 1548 CD GLU A 106 12.177 -2.838 -0.261 1.00 0.00 C ATOM 1549 OE1 GLU A 106 13.125 -2.057 -0.029 1.00 0.00 O ATOM 1550 OE2 GLU A 106 11.854 -3.768 0.507 1.00 0.00 O ATOM 0 H GLU A 106 8.213 0.503 -1.359 1.00 0.00 H new ATOM 0 HA GLU A 106 8.856 -2.133 -2.265 1.00 0.00 H new ATOM 0 HB2 GLU A 106 11.047 -0.780 -2.529 1.00 0.00 H new ATOM 0 HB3 GLU A 106 11.063 -0.670 -0.780 1.00 0.00 H new ATOM 0 HG2 GLU A 106 10.617 -3.419 -1.603 1.00 0.00 H new ATOM 0 HG3 GLU A 106 12.042 -2.777 -2.395 1.00 0.00 H new ATOM 1557 N PRO A 107 7.629 -2.449 -0.062 1.00 0.00 N ATOM 1558 CA PRO A 107 7.068 -2.816 1.242 1.00 0.00 C ATOM 1559 C PRO A 107 7.994 -3.737 2.031 1.00 0.00 C ATOM 1560 O PRO A 107 8.690 -4.573 1.456 1.00 0.00 O ATOM 1561 CB PRO A 107 5.770 -3.545 0.881 1.00 0.00 C ATOM 1562 CG PRO A 107 6.000 -4.069 -0.493 1.00 0.00 C ATOM 1563 CD PRO A 107 6.883 -3.063 -1.177 1.00 0.00 C ATOM 0 HA PRO A 107 6.919 -1.945 1.880 1.00 0.00 H new ATOM 0 HB2 PRO A 107 5.561 -4.352 1.583 1.00 0.00 H new ATOM 0 HB3 PRO A 107 4.915 -2.869 0.909 1.00 0.00 H new ATOM 0 HG2 PRO A 107 6.476 -5.049 -0.462 1.00 0.00 H new ATOM 0 HG3 PRO A 107 5.058 -4.189 -1.028 1.00 0.00 H new ATOM 0 HD2 PRO A 107 7.552 -3.538 -1.895 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.300 -2.324 -1.726 1.00 0.00 H new ATOM 1571 N VAL A 108 7.997 -3.575 3.350 1.00 0.00 N ATOM 1572 CA VAL A 108 8.840 -4.390 4.217 1.00 0.00 C ATOM 1573 C VAL A 108 8.009 -5.098 5.282 1.00 0.00 C ATOM 1574 O VAL A 108 6.909 -4.660 5.618 1.00 0.00 O ATOM 1575 CB VAL A 108 9.923 -3.542 4.908 1.00 0.00 C ATOM 1576 CG1 VAL A 108 10.911 -4.432 5.647 1.00 0.00 C ATOM 1577 CG2 VAL A 108 10.640 -2.663 3.894 1.00 0.00 C ATOM 0 H VAL A 108 7.426 -2.888 3.841 1.00 0.00 H new ATOM 0 HA VAL A 108 9.322 -5.133 3.581 1.00 0.00 H new ATOM 0 HB VAL A 108 9.439 -2.894 5.639 1.00 0.00 H new ATOM 0 HG11 VAL A 108 11.668 -3.813 6.129 1.00 0.00 H new ATOM 0 HG12 VAL A 108 10.383 -5.013 6.403 1.00 0.00 H new ATOM 0 HG13 VAL A 108 11.391 -5.108 4.940 1.00 0.00 H new ATOM 0 HG21 VAL A 108 11.402 -2.071 4.400 1.00 0.00 H new ATOM 0 HG22 VAL A 108 11.111 -3.290 3.138 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.921 -1.997 3.417 1.00 0.00 H new ATOM 1587 N PHE A 109 8.544 -6.195 5.809 1.00 0.00 N ATOM 1588 CA PHE A 109 7.853 -6.964 6.837 1.00 0.00 C ATOM 1589 C PHE A 109 8.829 -7.448 7.904 1.00 0.00 C ATOM 1590 O PHE A 109 9.944 -7.868 7.595 1.00 0.00 O ATOM 1591 CB PHE A 109 7.131 -8.159 6.210 1.00 0.00 C ATOM 1592 CG PHE A 109 5.924 -7.775 5.402 1.00 0.00 C ATOM 1593 CD1 PHE A 109 6.061 -7.339 4.094 1.00 0.00 C ATOM 1594 CD2 PHE A 109 4.654 -7.849 5.950 1.00 0.00 C ATOM 1595 CE1 PHE A 109 4.953 -6.985 3.348 1.00 0.00 C ATOM 1596 CE2 PHE A 109 3.543 -7.498 5.209 1.00 0.00 C ATOM 1597 CZ PHE A 109 3.692 -7.065 3.906 1.00 0.00 C ATOM 0 H PHE A 109 9.454 -6.571 5.541 1.00 0.00 H new ATOM 0 HA PHE A 109 7.119 -6.312 7.311 1.00 0.00 H new ATOM 0 HB2 PHE A 109 7.829 -8.700 5.571 1.00 0.00 H new ATOM 0 HB3 PHE A 109 6.826 -8.844 7.001 1.00 0.00 H new ATOM 0 HD1 PHE A 109 7.045 -7.275 3.653 1.00 0.00 H new ATOM 0 HD2 PHE A 109 4.531 -8.185 6.969 1.00 0.00 H new ATOM 0 HE1 PHE A 109 5.073 -6.646 2.330 1.00 0.00 H new ATOM 0 HE2 PHE A 109 2.558 -7.562 5.648 1.00 0.00 H new ATOM 0 HZ PHE A 109 2.824 -6.790 3.325 1.00 0.00 H new ATOM 1607 N GLN A 110 8.403 -7.386 9.161 1.00 0.00 N ATOM 1608 CA GLN A 110 9.241 -7.817 10.274 1.00 0.00 C ATOM 1609 C GLN A 110 8.389 -8.346 11.425 1.00 0.00 C ATOM 1610 O GLN A 110 7.744 -7.576 12.137 1.00 0.00 O ATOM 1611 CB GLN A 110 10.113 -6.660 10.762 1.00 0.00 C ATOM 1612 CG GLN A 110 11.217 -7.088 11.715 1.00 0.00 C ATOM 1613 CD GLN A 110 12.589 -7.064 11.070 1.00 0.00 C ATOM 1614 OE1 GLN A 110 13.189 -8.110 10.821 1.00 0.00 O ATOM 1615 NE2 GLN A 110 13.092 -5.866 10.794 1.00 0.00 N ATOM 0 H GLN A 110 7.483 -7.042 9.435 1.00 0.00 H new ATOM 0 HA GLN A 110 9.883 -8.623 9.920 1.00 0.00 H new ATOM 0 HB2 GLN A 110 10.561 -6.165 9.900 1.00 0.00 H new ATOM 0 HB3 GLN A 110 9.481 -5.924 11.259 1.00 0.00 H new ATOM 0 HG2 GLN A 110 11.217 -6.430 12.584 1.00 0.00 H new ATOM 0 HG3 GLN A 110 11.008 -8.094 12.078 1.00 0.00 H new ATOM 0 HE21 GLN A 110 12.559 -5.025 11.018 1.00 0.00 H new ATOM 0 HE22 GLN A 110 14.011 -5.787 10.358 1.00 0.00 H new ATOM 1624 N ASP A 111 8.394 -9.663 11.602 1.00 0.00 N ATOM 1625 CA ASP A 111 7.623 -10.294 12.666 1.00 0.00 C ATOM 1626 C ASP A 111 6.136 -9.990 12.517 1.00 0.00 C ATOM 1627 O ASP A 111 5.428 -9.805 13.506 1.00 0.00 O ATOM 1628 CB ASP A 111 8.118 -9.817 14.034 1.00 0.00 C ATOM 1629 CG ASP A 111 9.530 -10.283 14.331 1.00 0.00 C ATOM 1630 OD1 ASP A 111 9.800 -11.493 14.181 1.00 0.00 O ATOM 1631 OD2 ASP A 111 10.365 -9.437 14.717 1.00 0.00 O ATOM 0 H ASP A 111 8.924 -10.314 11.022 1.00 0.00 H new ATOM 0 HA ASP A 111 7.763 -11.372 12.591 1.00 0.00 H new ATOM 0 HB2 ASP A 111 8.082 -8.728 14.071 1.00 0.00 H new ATOM 0 HB3 ASP A 111 7.446 -10.185 14.809 1.00 0.00 H new ATOM 1636 N GLY A 112 5.670 -9.940 11.273 1.00 0.00 N ATOM 1637 CA GLY A 112 4.269 -9.659 11.018 1.00 0.00 C ATOM 1638 C GLY A 112 4.026 -8.207 10.655 1.00 0.00 C ATOM 1639 O GLY A 112 3.215 -7.906 9.779 1.00 0.00 O ATOM 0 H GLY A 112 6.237 -10.089 10.438 1.00 0.00 H new ATOM 0 HA2 GLY A 112 3.915 -10.297 10.208 1.00 0.00 H new ATOM 0 HA3 GLY A 112 3.684 -9.912 11.902 1.00 0.00 H new ATOM 1643 N LYS A 113 4.730 -7.304 11.330 1.00 0.00 N ATOM 1644 CA LYS A 113 4.586 -5.876 11.075 1.00 0.00 C ATOM 1645 C LYS A 113 4.928 -5.544 9.626 1.00 0.00 C ATOM 1646 O LYS A 113 5.493 -6.368 8.908 1.00 0.00 O ATOM 1647 CB LYS A 113 5.484 -5.074 12.019 1.00 0.00 C ATOM 1648 CG LYS A 113 5.070 -5.167 13.479 1.00 0.00 C ATOM 1649 CD LYS A 113 6.046 -4.432 14.382 1.00 0.00 C ATOM 1650 CE LYS A 113 6.252 -5.168 15.697 1.00 0.00 C ATOM 1651 NZ LYS A 113 7.102 -6.380 15.531 1.00 0.00 N ATOM 0 H LYS A 113 5.406 -7.536 12.058 1.00 0.00 H new ATOM 0 HA LYS A 113 3.546 -5.604 11.256 1.00 0.00 H new ATOM 0 HB2 LYS A 113 6.510 -5.427 11.918 1.00 0.00 H new ATOM 0 HB3 LYS A 113 5.475 -4.028 11.714 1.00 0.00 H new ATOM 0 HG2 LYS A 113 4.072 -4.747 13.603 1.00 0.00 H new ATOM 0 HG3 LYS A 113 5.015 -6.214 13.777 1.00 0.00 H new ATOM 0 HD2 LYS A 113 7.003 -4.322 13.872 1.00 0.00 H new ATOM 0 HD3 LYS A 113 5.673 -3.427 14.581 1.00 0.00 H new ATOM 0 HE2 LYS A 113 6.716 -4.496 16.420 1.00 0.00 H new ATOM 0 HE3 LYS A 113 5.284 -5.457 16.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 6.899 -7.054 16.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 6.897 -6.825 14.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 8.105 -6.108 15.567 1.00 0.00 H new ATOM 1665 N MET A 114 4.582 -4.333 9.204 1.00 0.00 N ATOM 1666 CA MET A 114 4.852 -3.893 7.840 1.00 0.00 C ATOM 1667 C MET A 114 4.968 -2.374 7.771 1.00 0.00 C ATOM 1668 O MET A 114 4.417 -1.661 8.610 1.00 0.00 O ATOM 1669 CB MET A 114 3.748 -4.376 6.898 1.00 0.00 C ATOM 1670 CG MET A 114 2.346 -4.126 7.428 1.00 0.00 C ATOM 1671 SD MET A 114 1.074 -4.931 6.434 1.00 0.00 S ATOM 1672 CE MET A 114 0.496 -6.184 7.574 1.00 0.00 C ATOM 0 H MET A 114 4.114 -3.639 9.786 1.00 0.00 H new ATOM 0 HA MET A 114 5.802 -4.326 7.527 1.00 0.00 H new ATOM 0 HB2 MET A 114 3.858 -3.876 5.936 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.875 -5.444 6.719 1.00 0.00 H new ATOM 0 HG2 MET A 114 2.281 -4.485 8.455 1.00 0.00 H new ATOM 0 HG3 MET A 114 2.157 -3.053 7.453 1.00 0.00 H new ATOM 0 HE1 MET A 114 -0.386 -6.673 7.161 1.00 0.00 H new ATOM 0 HE2 MET A 114 1.281 -6.924 7.730 1.00 0.00 H new ATOM 0 HE3 MET A 114 0.241 -5.719 8.527 1.00 0.00 H new ATOM 1682 N ALA A 115 5.687 -1.886 6.766 1.00 0.00 N ATOM 1683 CA ALA A 115 5.875 -0.453 6.587 1.00 0.00 C ATOM 1684 C ALA A 115 6.312 -0.131 5.163 1.00 0.00 C ATOM 1685 O ALA A 115 7.370 -0.569 4.713 1.00 0.00 O ATOM 1686 CB ALA A 115 6.895 0.074 7.585 1.00 0.00 C ATOM 0 H ALA A 115 6.149 -2.463 6.063 1.00 0.00 H new ATOM 0 HA ALA A 115 4.919 0.039 6.766 1.00 0.00 H new ATOM 0 HB1 ALA A 115 7.026 1.146 7.440 1.00 0.00 H new ATOM 0 HB2 ALA A 115 6.543 -0.115 8.599 1.00 0.00 H new ATOM 0 HB3 ALA A 115 7.848 -0.432 7.432 1.00 0.00 H new ATOM 1692 N LEU A 116 5.489 0.639 4.457 1.00 0.00 N ATOM 1693 CA LEU A 116 5.791 1.019 3.082 1.00 0.00 C ATOM 1694 C LEU A 116 7.043 1.888 3.020 1.00 0.00 C ATOM 1695 O LEU A 116 7.077 2.985 3.579 1.00 0.00 O ATOM 1696 CB LEU A 116 4.605 1.766 2.467 1.00 0.00 C ATOM 1697 CG LEU A 116 4.771 2.142 0.994 1.00 0.00 C ATOM 1698 CD1 LEU A 116 4.282 1.014 0.097 1.00 0.00 C ATOM 1699 CD2 LEU A 116 4.025 3.431 0.686 1.00 0.00 C ATOM 0 H LEU A 116 4.609 1.011 4.814 1.00 0.00 H new ATOM 0 HA LEU A 116 5.975 0.109 2.511 1.00 0.00 H new ATOM 0 HB2 LEU A 116 3.713 1.148 2.570 1.00 0.00 H new ATOM 0 HB3 LEU A 116 4.431 2.676 3.041 1.00 0.00 H new ATOM 0 HG LEU A 116 5.831 2.303 0.797 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.408 1.299 -0.947 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.860 0.112 0.299 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.228 0.822 0.296 1.00 0.00 H new ATOM 0 HD21 LEU A 116 4.154 3.683 -0.366 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.965 3.298 0.900 1.00 0.00 H new ATOM 0 HD23 LEU A 116 4.421 4.237 1.304 1.00 0.00 H new ATOM 1711 N LEU A 117 8.069 1.391 2.337 1.00 0.00 N ATOM 1712 CA LEU A 117 9.323 2.123 2.203 1.00 0.00 C ATOM 1713 C LEU A 117 9.405 2.817 0.847 1.00 0.00 C ATOM 1714 O LEU A 117 9.150 2.205 -0.191 1.00 0.00 O ATOM 1715 CB LEU A 117 10.512 1.177 2.378 1.00 0.00 C ATOM 1716 CG LEU A 117 11.871 1.865 2.510 1.00 0.00 C ATOM 1717 CD1 LEU A 117 12.008 2.521 3.876 1.00 0.00 C ATOM 1718 CD2 LEU A 117 12.996 0.867 2.281 1.00 0.00 C ATOM 0 H LEU A 117 8.057 0.485 1.868 1.00 0.00 H new ATOM 0 HA LEU A 117 9.356 2.884 2.983 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.343 0.566 3.265 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.546 0.499 1.525 1.00 0.00 H new ATOM 0 HG LEU A 117 11.939 2.642 1.749 1.00 0.00 H new ATOM 0 HD11 LEU A 117 12.982 3.005 3.951 1.00 0.00 H new ATOM 0 HD12 LEU A 117 11.222 3.265 4.003 1.00 0.00 H new ATOM 0 HD13 LEU A 117 11.919 1.763 4.654 1.00 0.00 H new ATOM 0 HD21 LEU A 117 13.957 1.373 2.378 1.00 0.00 H new ATOM 0 HD22 LEU A 117 12.930 0.068 3.020 1.00 0.00 H new ATOM 0 HD23 LEU A 117 12.909 0.444 1.280 1.00 0.00 H new ATOM 1730 N ALA A 118 9.761 4.097 0.863 1.00 0.00 N ATOM 1731 CA ALA A 118 9.877 4.874 -0.363 1.00 0.00 C ATOM 1732 C ALA A 118 11.224 4.643 -1.036 1.00 0.00 C ATOM 1733 O ALA A 118 12.115 4.015 -0.466 1.00 0.00 O ATOM 1734 CB ALA A 118 9.680 6.354 -0.069 1.00 0.00 C ATOM 0 H ALA A 118 9.974 4.618 1.714 1.00 0.00 H new ATOM 0 HA ALA A 118 9.097 4.542 -1.048 1.00 0.00 H new ATOM 0 HB1 ALA A 118 9.769 6.924 -0.994 1.00 0.00 H new ATOM 0 HB2 ALA A 118 8.690 6.511 0.360 1.00 0.00 H new ATOM 0 HB3 ALA A 118 10.439 6.689 0.638 1.00 0.00 H new ATOM 1740 N SER A 119 11.366 5.159 -2.253 1.00 0.00 N ATOM 1741 CA SER A 119 12.606 5.012 -3.006 1.00 0.00 C ATOM 1742 C SER A 119 13.745 5.793 -2.351 1.00 0.00 C ATOM 1743 O SER A 119 14.910 5.620 -2.706 1.00 0.00 O ATOM 1744 CB SER A 119 12.412 5.487 -4.447 1.00 0.00 C ATOM 1745 OG SER A 119 13.588 5.292 -5.212 1.00 0.00 O ATOM 0 H SER A 119 10.638 5.683 -2.738 1.00 0.00 H new ATOM 0 HA SER A 119 12.872 3.955 -3.009 1.00 0.00 H new ATOM 0 HB2 SER A 119 11.584 4.945 -4.903 1.00 0.00 H new ATOM 0 HB3 SER A 119 12.143 6.543 -4.452 1.00 0.00 H new ATOM 0 HG SER A 119 14.373 5.358 -4.628 1.00 0.00 H new ATOM 1751 N ASN A 120 13.403 6.655 -1.394 1.00 0.00 N ATOM 1752 CA ASN A 120 14.402 7.459 -0.698 1.00 0.00 C ATOM 1753 C ASN A 120 14.851 6.782 0.596 1.00 0.00 C ATOM 1754 O ASN A 120 15.347 7.440 1.511 1.00 0.00 O ATOM 1755 CB ASN A 120 13.840 8.848 -0.390 1.00 0.00 C ATOM 1756 CG ASN A 120 14.886 9.784 0.183 1.00 0.00 C ATOM 1757 OD1 ASN A 120 16.063 9.709 -0.171 1.00 0.00 O ATOM 1758 ND2 ASN A 120 14.462 10.671 1.075 1.00 0.00 N ATOM 0 H ASN A 120 12.444 6.813 -1.085 1.00 0.00 H new ATOM 0 HA ASN A 120 15.269 7.557 -1.351 1.00 0.00 H new ATOM 0 HB2 ASN A 120 13.430 9.281 -1.303 1.00 0.00 H new ATOM 0 HB3 ASN A 120 13.015 8.754 0.316 1.00 0.00 H new ATOM 0 HD21 ASN A 120 15.121 11.326 1.496 1.00 0.00 H new ATOM 0 HD22 ASN A 120 13.477 10.698 1.339 1.00 0.00 H new ATOM 1765 N SER A 121 14.679 5.464 0.668 1.00 0.00 N ATOM 1766 CA SER A 121 15.070 4.704 1.850 1.00 0.00 C ATOM 1767 C SER A 121 14.400 5.255 3.103 1.00 0.00 C ATOM 1768 O SER A 121 14.966 5.208 4.195 1.00 0.00 O ATOM 1769 CB SER A 121 16.591 4.731 2.019 1.00 0.00 C ATOM 1770 OG SER A 121 17.065 3.518 2.578 1.00 0.00 O ATOM 0 H SER A 121 14.271 4.901 -0.079 1.00 0.00 H new ATOM 0 HA SER A 121 14.743 3.674 1.710 1.00 0.00 H new ATOM 0 HB2 SER A 121 17.064 4.898 1.052 1.00 0.00 H new ATOM 0 HB3 SER A 121 16.874 5.565 2.661 1.00 0.00 H new ATOM 0 HG SER A 121 18.039 3.561 2.674 1.00 0.00 H new ATOM 1776 N CYS A 122 13.189 5.779 2.938 1.00 0.00 N ATOM 1777 CA CYS A 122 12.441 6.341 4.057 1.00 0.00 C ATOM 1778 C CYS A 122 10.972 5.938 3.986 1.00 0.00 C ATOM 1779 O CYS A 122 10.340 6.041 2.934 1.00 0.00 O ATOM 1780 CB CYS A 122 12.565 7.866 4.067 1.00 0.00 C ATOM 1781 SG CYS A 122 13.923 8.489 5.086 1.00 0.00 S ATOM 0 H CYS A 122 12.706 5.826 2.041 1.00 0.00 H new ATOM 0 HA CYS A 122 12.863 5.944 4.980 1.00 0.00 H new ATOM 0 HB2 CYS A 122 12.703 8.215 3.044 1.00 0.00 H new ATOM 0 HB3 CYS A 122 11.629 8.294 4.427 1.00 0.00 H new ATOM 0 HG CYS A 122 13.948 9.788 5.029 1.00 0.00 H new ATOM 1787 N PHE A 123 10.435 5.480 5.111 1.00 0.00 N ATOM 1788 CA PHE A 123 9.039 5.062 5.177 1.00 0.00 C ATOM 1789 C PHE A 123 8.106 6.256 5.004 1.00 0.00 C ATOM 1790 O PHE A 123 8.557 7.389 4.836 1.00 0.00 O ATOM 1791 CB PHE A 123 8.755 4.366 6.508 1.00 0.00 C ATOM 1792 CG PHE A 123 9.641 3.180 6.766 1.00 0.00 C ATOM 1793 CD1 PHE A 123 9.450 1.992 6.076 1.00 0.00 C ATOM 1794 CD2 PHE A 123 10.663 3.252 7.698 1.00 0.00 C ATOM 1795 CE1 PHE A 123 10.263 0.901 6.311 1.00 0.00 C ATOM 1796 CE2 PHE A 123 11.480 2.162 7.938 1.00 0.00 C ATOM 1797 CZ PHE A 123 11.279 0.985 7.242 1.00 0.00 C ATOM 0 H PHE A 123 10.945 5.389 5.990 1.00 0.00 H new ATOM 0 HA PHE A 123 8.857 4.360 4.363 1.00 0.00 H new ATOM 0 HB2 PHE A 123 8.878 5.085 7.318 1.00 0.00 H new ATOM 0 HB3 PHE A 123 7.714 4.042 6.525 1.00 0.00 H new ATOM 0 HD1 PHE A 123 8.657 1.920 5.347 1.00 0.00 H new ATOM 0 HD2 PHE A 123 10.824 4.170 8.244 1.00 0.00 H new ATOM 0 HE1 PHE A 123 10.104 -0.018 5.767 1.00 0.00 H new ATOM 0 HE2 PHE A 123 12.273 2.231 8.668 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.916 0.132 7.426 1.00 0.00 H new ATOM 1807 N ILE A 124 6.804 5.994 5.047 1.00 0.00 N ATOM 1808 CA ILE A 124 5.808 7.048 4.895 1.00 0.00 C ATOM 1809 C ILE A 124 5.067 7.297 6.205 1.00 0.00 C ATOM 1810 O ILE A 124 4.830 6.372 6.981 1.00 0.00 O ATOM 1811 CB ILE A 124 4.783 6.699 3.800 1.00 0.00 C ATOM 1812 CG1 ILE A 124 4.255 5.278 3.997 1.00 0.00 C ATOM 1813 CG2 ILE A 124 5.410 6.851 2.422 1.00 0.00 C ATOM 1814 CD1 ILE A 124 2.814 5.103 3.568 1.00 0.00 C ATOM 0 H ILE A 124 6.414 5.062 5.186 1.00 0.00 H new ATOM 0 HA ILE A 124 6.346 7.951 4.606 1.00 0.00 H new ATOM 0 HB ILE A 124 3.944 7.390 3.875 1.00 0.00 H new ATOM 0 HG12 ILE A 124 4.880 4.586 3.433 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.348 5.007 5.049 1.00 0.00 H new ATOM 0 HG21 ILE A 124 4.674 6.601 1.658 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.741 7.880 2.284 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.265 6.181 2.335 1.00 0.00 H new ATOM 0 HD11 ILE A 124 2.507 4.071 3.736 1.00 0.00 H new ATOM 0 HD12 ILE A 124 2.178 5.770 4.149 1.00 0.00 H new ATOM 0 HD13 ILE A 124 2.718 5.342 2.509 1.00 0.00 H new ATOM 1826 N ARG A 125 4.706 8.553 6.445 1.00 0.00 N ATOM 1827 CA ARG A 125 3.993 8.924 7.661 1.00 0.00 C ATOM 1828 C ARG A 125 3.207 10.215 7.459 1.00 0.00 C ATOM 1829 O ARG A 125 3.655 11.123 6.759 1.00 0.00 O ATOM 1830 CB ARG A 125 4.975 9.088 8.823 1.00 0.00 C ATOM 1831 CG ARG A 125 4.321 8.987 10.191 1.00 0.00 C ATOM 1832 CD ARG A 125 4.973 9.926 11.192 1.00 0.00 C ATOM 1833 NE ARG A 125 4.052 10.317 12.256 1.00 0.00 N ATOM 1834 CZ ARG A 125 4.233 11.376 13.043 1.00 0.00 C ATOM 1835 NH1 ARG A 125 5.298 12.152 12.888 1.00 0.00 N ATOM 1836 NH2 ARG A 125 3.345 11.660 13.986 1.00 0.00 N ATOM 0 H ARG A 125 4.896 9.331 5.813 1.00 0.00 H new ATOM 0 HA ARG A 125 3.290 8.125 7.898 1.00 0.00 H new ATOM 0 HB2 ARG A 125 5.750 8.326 8.743 1.00 0.00 H new ATOM 0 HB3 ARG A 125 5.469 10.056 8.736 1.00 0.00 H new ATOM 0 HG2 ARG A 125 3.260 9.224 10.106 1.00 0.00 H new ATOM 0 HG3 ARG A 125 4.391 7.962 10.554 1.00 0.00 H new ATOM 0 HD2 ARG A 125 5.846 9.441 11.628 1.00 0.00 H new ATOM 0 HD3 ARG A 125 5.329 10.817 10.675 1.00 0.00 H new ATOM 0 HE ARG A 125 3.221 9.745 12.405 1.00 0.00 H new ATOM 0 HH11 ARG A 125 5.983 11.939 12.163 1.00 0.00 H new ATOM 0 HH12 ARG A 125 5.431 12.962 13.494 1.00 0.00 H new ATOM 0 HH21 ARG A 125 2.524 11.067 14.108 1.00 0.00 H new ATOM 0 HH22 ARG A 125 3.483 12.471 14.589 1.00 0.00 H new ATOM 1850 N CYS A 126 2.032 10.289 8.074 1.00 0.00 N ATOM 1851 CA CYS A 126 1.183 11.468 7.962 1.00 0.00 C ATOM 1852 C CYS A 126 1.439 12.435 9.114 1.00 0.00 C ATOM 1853 O CYS A 126 1.911 12.036 10.178 1.00 0.00 O ATOM 1854 CB CYS A 126 -0.291 11.060 7.941 1.00 0.00 C ATOM 1855 SG CYS A 126 -0.798 10.052 9.353 1.00 0.00 S ATOM 0 H CYS A 126 1.646 9.545 8.656 1.00 0.00 H new ATOM 0 HA CYS A 126 1.427 11.973 7.027 1.00 0.00 H new ATOM 0 HB2 CYS A 126 -0.906 11.960 7.911 1.00 0.00 H new ATOM 0 HB3 CYS A 126 -0.491 10.507 7.023 1.00 0.00 H new ATOM 0 HG CYS A 126 -1.258 10.823 10.293 1.00 0.00 H new ATOM 1861 N ASN A 127 1.125 13.707 8.893 1.00 0.00 N ATOM 1862 CA ASN A 127 1.323 14.730 9.914 1.00 0.00 C ATOM 1863 C ASN A 127 -0.006 15.137 10.542 1.00 0.00 C ATOM 1864 O ASN A 127 -1.068 14.671 10.130 1.00 0.00 O ATOM 1865 CB ASN A 127 2.012 15.956 9.310 1.00 0.00 C ATOM 1866 CG ASN A 127 3.519 15.902 9.457 1.00 0.00 C ATOM 1867 OD1 ASN A 127 4.039 15.543 10.514 1.00 0.00 O ATOM 1868 ND2 ASN A 127 4.231 16.262 8.396 1.00 0.00 N ATOM 0 H ASN A 127 0.733 14.054 8.018 1.00 0.00 H new ATOM 0 HA ASN A 127 1.959 14.311 10.694 1.00 0.00 H new ATOM 0 HB2 ASN A 127 1.755 16.030 8.253 1.00 0.00 H new ATOM 0 HB3 ASN A 127 1.634 16.857 9.794 1.00 0.00 H new ATOM 0 HD21 ASN A 127 5.250 16.248 8.437 1.00 0.00 H new ATOM 0 HD22 ASN A 127 3.759 16.553 7.540 1.00 0.00 H new ATOM 1875 N GLU A 128 0.062 16.008 11.545 1.00 0.00 N ATOM 1876 CA GLU A 128 -1.136 16.477 12.232 1.00 0.00 C ATOM 1877 C GLU A 128 -1.738 17.682 11.517 1.00 0.00 C ATOM 1878 O GLU A 128 -2.953 17.880 11.529 1.00 0.00 O ATOM 1879 CB GLU A 128 -0.805 16.842 13.681 1.00 0.00 C ATOM 1880 CG GLU A 128 -0.355 15.657 14.520 1.00 0.00 C ATOM 1881 CD GLU A 128 -1.360 15.284 15.592 1.00 0.00 C ATOM 1882 OE1 GLU A 128 -1.433 16.000 16.613 1.00 0.00 O ATOM 1883 OE2 GLU A 128 -2.074 14.275 15.411 1.00 0.00 O ATOM 0 H GLU A 128 0.933 16.403 11.899 1.00 0.00 H new ATOM 0 HA GLU A 128 -1.869 15.671 12.224 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -0.020 17.599 13.686 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -1.684 17.291 14.144 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -0.189 14.799 13.869 1.00 0.00 H new ATOM 0 HG3 GLU A 128 0.601 15.891 14.989 1.00 0.00 H new ATOM 1890 N ALA A 129 -0.880 18.485 10.895 1.00 0.00 N ATOM 1891 CA ALA A 129 -1.329 19.671 10.175 1.00 0.00 C ATOM 1892 C ALA A 129 -2.036 19.291 8.879 1.00 0.00 C ATOM 1893 O ALA A 129 -2.985 19.955 8.461 1.00 0.00 O ATOM 1894 CB ALA A 129 -0.150 20.588 9.885 1.00 0.00 C ATOM 0 H ALA A 129 0.129 18.336 10.875 1.00 0.00 H new ATOM 0 HA ALA A 129 -2.043 20.201 10.806 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -0.499 21.470 9.347 1.00 0.00 H new ATOM 0 HB2 ALA A 129 0.312 20.894 10.823 1.00 0.00 H new ATOM 0 HB3 ALA A 129 0.582 20.058 9.276 1.00 0.00 H new ATOM 1900 N GLY A 130 -1.568 18.219 8.247 1.00 0.00 N ATOM 1901 CA GLY A 130 -2.168 17.770 7.004 1.00 0.00 C ATOM 1902 C GLY A 130 -1.158 17.667 5.878 1.00 0.00 C ATOM 1903 O GLY A 130 -1.412 18.128 4.764 1.00 0.00 O ATOM 0 H GLY A 130 -0.784 17.654 8.573 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -2.635 16.797 7.160 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -2.960 18.461 6.716 1.00 0.00 H new ATOM 1907 N ASP A 131 -0.010 17.064 6.167 1.00 0.00 N ATOM 1908 CA ASP A 131 1.042 16.904 5.169 1.00 0.00 C ATOM 1909 C ASP A 131 1.646 15.504 5.236 1.00 0.00 C ATOM 1910 O ASP A 131 2.342 15.163 6.192 1.00 0.00 O ATOM 1911 CB ASP A 131 2.134 17.954 5.376 1.00 0.00 C ATOM 1912 CG ASP A 131 1.731 19.319 4.854 1.00 0.00 C ATOM 1913 OD1 ASP A 131 0.841 19.950 5.464 1.00 0.00 O ATOM 1914 OD2 ASP A 131 2.303 19.757 3.834 1.00 0.00 O ATOM 0 H ASP A 131 0.216 16.678 7.084 1.00 0.00 H new ATOM 0 HA ASP A 131 0.598 17.042 4.183 1.00 0.00 H new ATOM 0 HB2 ASP A 131 2.366 18.028 6.438 1.00 0.00 H new ATOM 0 HB3 ASP A 131 3.045 17.630 4.873 1.00 0.00 H new ATOM 1919 N ILE A 132 1.375 14.700 4.214 1.00 0.00 N ATOM 1920 CA ILE A 132 1.892 13.338 4.155 1.00 0.00 C ATOM 1921 C ILE A 132 3.254 13.298 3.469 1.00 0.00 C ATOM 1922 O ILE A 132 3.362 13.533 2.265 1.00 0.00 O ATOM 1923 CB ILE A 132 0.925 12.401 3.406 1.00 0.00 C ATOM 1924 CG1 ILE A 132 -0.498 12.569 3.939 1.00 0.00 C ATOM 1925 CG2 ILE A 132 1.379 10.956 3.537 1.00 0.00 C ATOM 1926 CD1 ILE A 132 -1.535 11.802 3.147 1.00 0.00 C ATOM 0 H ILE A 132 0.800 14.968 3.415 1.00 0.00 H new ATOM 0 HA ILE A 132 1.995 12.993 5.184 1.00 0.00 H new ATOM 0 HB ILE A 132 0.930 12.668 2.349 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -0.529 12.240 4.978 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -0.757 13.628 3.932 1.00 0.00 H new ATOM 0 HG21 ILE A 132 0.685 10.307 3.003 1.00 0.00 H new ATOM 0 HG22 ILE A 132 2.377 10.848 3.113 1.00 0.00 H new ATOM 0 HG23 ILE A 132 1.400 10.675 4.590 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -2.521 11.968 3.582 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -1.532 12.147 2.113 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -1.300 10.738 3.175 1.00 0.00 H new ATOM 1938 N GLU A 133 4.292 12.997 4.243 1.00 0.00 N ATOM 1939 CA GLU A 133 5.647 12.926 3.710 1.00 0.00 C ATOM 1940 C GLU A 133 6.357 11.665 4.193 1.00 0.00 C ATOM 1941 O GLU A 133 5.832 10.926 5.026 1.00 0.00 O ATOM 1942 CB GLU A 133 6.445 14.164 4.121 1.00 0.00 C ATOM 1943 CG GLU A 133 6.335 14.496 5.600 1.00 0.00 C ATOM 1944 CD GLU A 133 7.403 15.469 6.060 1.00 0.00 C ATOM 1945 OE1 GLU A 133 7.221 16.688 5.863 1.00 0.00 O ATOM 1946 OE2 GLU A 133 8.423 15.011 6.618 1.00 0.00 O ATOM 0 H GLU A 133 4.220 12.798 5.241 1.00 0.00 H new ATOM 0 HA GLU A 133 5.581 12.890 2.623 1.00 0.00 H new ATOM 0 HB2 GLU A 133 7.494 14.010 3.869 1.00 0.00 H new ATOM 0 HB3 GLU A 133 6.100 15.018 3.539 1.00 0.00 H new ATOM 0 HG2 GLU A 133 5.351 14.920 5.801 1.00 0.00 H new ATOM 0 HG3 GLU A 133 6.411 13.577 6.182 1.00 0.00 H new ATOM 1953 N ALA A 134 7.555 11.427 3.667 1.00 0.00 N ATOM 1954 CA ALA A 134 8.336 10.256 4.045 1.00 0.00 C ATOM 1955 C ALA A 134 9.087 10.495 5.351 1.00 0.00 C ATOM 1956 O ALA A 134 9.922 11.394 5.442 1.00 0.00 O ATOM 1957 CB ALA A 134 9.309 9.889 2.934 1.00 0.00 C ATOM 0 H ALA A 134 8.005 12.030 2.978 1.00 0.00 H new ATOM 0 HA ALA A 134 7.647 9.425 4.199 1.00 0.00 H new ATOM 0 HB1 ALA A 134 9.886 9.013 3.230 1.00 0.00 H new ATOM 0 HB2 ALA A 134 8.754 9.667 2.023 1.00 0.00 H new ATOM 0 HB3 ALA A 134 9.986 10.724 2.752 1.00 0.00 H new ATOM 1963 N LYS A 135 8.784 9.682 6.359 1.00 0.00 N ATOM 1964 CA LYS A 135 9.431 9.805 7.660 1.00 0.00 C ATOM 1965 C LYS A 135 10.875 9.317 7.596 1.00 0.00 C ATOM 1966 O LYS A 135 11.284 8.685 6.622 1.00 0.00 O ATOM 1967 CB LYS A 135 8.658 9.010 8.714 1.00 0.00 C ATOM 1968 CG LYS A 135 8.640 9.669 10.084 1.00 0.00 C ATOM 1969 CD LYS A 135 8.077 11.080 10.020 1.00 0.00 C ATOM 1970 CE LYS A 135 9.160 12.126 10.240 1.00 0.00 C ATOM 1971 NZ LYS A 135 9.772 12.015 11.593 1.00 0.00 N ATOM 0 H LYS A 135 8.095 8.932 6.299 1.00 0.00 H new ATOM 0 HA LYS A 135 9.434 10.859 7.940 1.00 0.00 H new ATOM 0 HB2 LYS A 135 7.632 8.873 8.373 1.00 0.00 H new ATOM 0 HB3 LYS A 135 9.099 8.017 8.804 1.00 0.00 H new ATOM 0 HG2 LYS A 135 8.041 9.069 10.769 1.00 0.00 H new ATOM 0 HG3 LYS A 135 9.652 9.699 10.487 1.00 0.00 H new ATOM 0 HD2 LYS A 135 7.607 11.241 9.050 1.00 0.00 H new ATOM 0 HD3 LYS A 135 7.299 11.197 10.775 1.00 0.00 H new ATOM 0 HE2 LYS A 135 9.934 12.012 9.481 1.00 0.00 H new ATOM 0 HE3 LYS A 135 8.734 13.122 10.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 10.105 12.951 11.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 9.063 11.661 12.267 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 10.576 11.356 11.558 1.00 0.00 H new ATOM 1985 N ASN A 136 11.643 9.615 8.640 1.00 0.00 N ATOM 1986 CA ASN A 136 13.042 9.207 8.702 1.00 0.00 C ATOM 1987 C ASN A 136 13.174 7.691 8.593 1.00 0.00 C ATOM 1988 O ASN A 136 12.180 6.967 8.627 1.00 0.00 O ATOM 1989 CB ASN A 136 13.680 9.696 10.005 1.00 0.00 C ATOM 1990 CG ASN A 136 14.455 10.986 9.820 1.00 0.00 C ATOM 1991 OD1 ASN A 136 14.114 11.814 8.976 1.00 0.00 O ATOM 1992 ND2 ASN A 136 15.508 11.161 10.611 1.00 0.00 N ATOM 0 H ASN A 136 11.320 10.137 9.454 1.00 0.00 H new ATOM 0 HA ASN A 136 13.564 9.659 7.858 1.00 0.00 H new ATOM 0 HB2 ASN A 136 12.902 9.847 10.753 1.00 0.00 H new ATOM 0 HB3 ASN A 136 14.348 8.926 10.391 1.00 0.00 H new ATOM 0 HD21 ASN A 136 16.070 12.009 10.532 1.00 0.00 H new ATOM 0 HD22 ASN A 136 15.754 10.448 11.297 1.00 0.00 H new ATOM 1999 N LYS A 137 14.410 7.219 8.462 1.00 0.00 N ATOM 2000 CA LYS A 137 14.673 5.789 8.348 1.00 0.00 C ATOM 2001 C LYS A 137 14.163 5.041 9.575 1.00 0.00 C ATOM 2002 O LYS A 137 13.716 3.898 9.476 1.00 0.00 O ATOM 2003 CB LYS A 137 16.172 5.538 8.171 1.00 0.00 C ATOM 2004 CG LYS A 137 16.704 5.969 6.813 1.00 0.00 C ATOM 2005 CD LYS A 137 18.224 5.965 6.784 1.00 0.00 C ATOM 2006 CE LYS A 137 18.779 4.550 6.799 1.00 0.00 C ATOM 2007 NZ LYS A 137 19.946 4.401 5.886 1.00 0.00 N ATOM 0 H LYS A 137 15.244 7.805 8.432 1.00 0.00 H new ATOM 0 HA LYS A 137 14.142 5.417 7.472 1.00 0.00 H new ATOM 0 HB2 LYS A 137 16.716 6.071 8.951 1.00 0.00 H new ATOM 0 HB3 LYS A 137 16.373 4.476 8.311 1.00 0.00 H new ATOM 0 HG2 LYS A 137 16.322 5.299 6.042 1.00 0.00 H new ATOM 0 HG3 LYS A 137 16.337 6.968 6.578 1.00 0.00 H new ATOM 0 HD2 LYS A 137 18.573 6.484 5.891 1.00 0.00 H new ATOM 0 HD3 LYS A 137 18.607 6.516 7.643 1.00 0.00 H new ATOM 0 HE2 LYS A 137 19.077 4.288 7.814 1.00 0.00 H new ATOM 0 HE3 LYS A 137 17.997 3.850 6.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 20.295 3.422 5.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 19.656 4.627 4.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 20.703 5.050 6.181 1.00 0.00 H new ATOM 2021 N THR A 138 14.232 5.694 10.730 1.00 0.00 N ATOM 2022 CA THR A 138 13.776 5.090 11.977 1.00 0.00 C ATOM 2023 C THR A 138 12.273 4.835 11.940 1.00 0.00 C ATOM 2024 O THR A 138 11.479 5.764 11.785 1.00 0.00 O ATOM 2025 CB THR A 138 14.124 5.994 13.161 1.00 0.00 C ATOM 2026 OG1 THR A 138 13.496 7.257 13.029 1.00 0.00 O ATOM 2027 CG2 THR A 138 15.610 6.232 13.316 1.00 0.00 C ATOM 0 H THR A 138 14.599 6.641 10.829 1.00 0.00 H new ATOM 0 HA THR A 138 14.285 4.133 12.097 1.00 0.00 H new ATOM 0 HB THR A 138 13.764 5.465 14.044 1.00 0.00 H new ATOM 0 HG1 THR A 138 12.621 7.144 12.603 1.00 0.00 H new ATOM 0 HG21 THR A 138 15.787 6.881 14.174 1.00 0.00 H new ATOM 0 HG22 THR A 138 16.117 5.279 13.471 1.00 0.00 H new ATOM 0 HG23 THR A 138 15.998 6.707 12.415 1.00 0.00 H new ATOM 2035 N ALA A 139 11.889 3.571 12.084 1.00 0.00 N ATOM 2036 CA ALA A 139 10.481 3.194 12.068 1.00 0.00 C ATOM 2037 C ALA A 139 9.900 3.181 13.477 1.00 0.00 C ATOM 2038 O ALA A 139 10.322 2.396 14.327 1.00 0.00 O ATOM 2039 CB ALA A 139 10.309 1.832 11.411 1.00 0.00 C ATOM 0 H ALA A 139 12.533 2.791 12.213 1.00 0.00 H new ATOM 0 HA ALA A 139 9.937 3.938 11.487 1.00 0.00 H new ATOM 0 HB1 ALA A 139 9.253 1.562 11.405 1.00 0.00 H new ATOM 0 HB2 ALA A 139 10.679 1.873 10.386 1.00 0.00 H new ATOM 0 HB3 ALA A 139 10.872 1.085 11.970 1.00 0.00 H new ATOM 2045 N GLY A 140 8.928 4.054 13.719 1.00 0.00 N ATOM 2046 CA GLY A 140 8.304 4.127 15.026 1.00 0.00 C ATOM 2047 C GLY A 140 7.030 3.308 15.106 1.00 0.00 C ATOM 2048 O GLY A 140 6.582 2.747 14.107 1.00 0.00 O ATOM 0 H GLY A 140 8.561 4.713 13.032 1.00 0.00 H new ATOM 0 HA2 GLY A 140 9.007 3.775 15.781 1.00 0.00 H new ATOM 0 HA3 GLY A 140 8.079 5.167 15.260 1.00 0.00 H new ATOM 2052 N GLU A 141 6.446 3.239 16.299 1.00 0.00 N ATOM 2053 CA GLU A 141 5.216 2.483 16.504 1.00 0.00 C ATOM 2054 C GLU A 141 4.072 3.072 15.685 1.00 0.00 C ATOM 2055 O GLU A 141 3.230 2.342 15.160 1.00 0.00 O ATOM 2056 CB GLU A 141 4.844 2.466 17.989 1.00 0.00 C ATOM 2057 CG GLU A 141 4.393 1.103 18.486 1.00 0.00 C ATOM 2058 CD GLU A 141 3.179 1.183 19.389 1.00 0.00 C ATOM 2059 OE1 GLU A 141 3.057 2.179 20.133 1.00 0.00 O ATOM 2060 OE2 GLU A 141 2.349 0.251 19.354 1.00 0.00 O ATOM 0 H GLU A 141 6.805 3.697 17.137 1.00 0.00 H new ATOM 0 HA GLU A 141 5.387 1.460 16.169 1.00 0.00 H new ATOM 0 HB2 GLU A 141 5.704 2.791 18.574 1.00 0.00 H new ATOM 0 HB3 GLU A 141 4.048 3.189 18.164 1.00 0.00 H new ATOM 0 HG2 GLU A 141 4.164 0.467 17.631 1.00 0.00 H new ATOM 0 HG3 GLU A 141 5.212 0.628 19.026 1.00 0.00 H new ATOM 2067 N GLU A 142 4.046 4.397 15.580 1.00 0.00 N ATOM 2068 CA GLU A 142 3.005 5.084 14.825 1.00 0.00 C ATOM 2069 C GLU A 142 3.217 4.910 13.324 1.00 0.00 C ATOM 2070 O GLU A 142 2.259 4.855 12.554 1.00 0.00 O ATOM 2071 CB GLU A 142 2.987 6.571 15.180 1.00 0.00 C ATOM 2072 CG GLU A 142 2.846 6.839 16.670 1.00 0.00 C ATOM 2073 CD GLU A 142 1.717 7.800 16.987 1.00 0.00 C ATOM 2074 OE1 GLU A 142 0.670 7.731 16.309 1.00 0.00 O ATOM 2075 OE2 GLU A 142 1.880 8.622 17.913 1.00 0.00 O ATOM 0 H GLU A 142 4.734 5.016 16.008 1.00 0.00 H new ATOM 0 HA GLU A 142 2.045 4.642 15.092 1.00 0.00 H new ATOM 0 HB2 GLU A 142 3.907 7.033 14.822 1.00 0.00 H new ATOM 0 HB3 GLU A 142 2.163 7.052 14.653 1.00 0.00 H new ATOM 0 HG2 GLU A 142 2.672 5.897 17.190 1.00 0.00 H new ATOM 0 HG3 GLU A 142 3.782 7.246 17.052 1.00 0.00 H new ATOM 2082 N GLU A 143 4.480 4.825 12.917 1.00 0.00 N ATOM 2083 CA GLU A 143 4.818 4.657 11.508 1.00 0.00 C ATOM 2084 C GLU A 143 4.222 3.366 10.952 1.00 0.00 C ATOM 2085 O GLU A 143 3.971 3.254 9.753 1.00 0.00 O ATOM 2086 CB GLU A 143 6.337 4.654 11.324 1.00 0.00 C ATOM 2087 CG GLU A 143 6.914 6.027 11.016 1.00 0.00 C ATOM 2088 CD GLU A 143 7.914 5.998 9.876 1.00 0.00 C ATOM 2089 OE1 GLU A 143 9.100 5.700 10.135 1.00 0.00 O ATOM 2090 OE2 GLU A 143 7.513 6.273 8.727 1.00 0.00 O ATOM 0 H GLU A 143 5.285 4.870 13.542 1.00 0.00 H new ATOM 0 HA GLU A 143 4.393 5.496 10.956 1.00 0.00 H new ATOM 0 HB2 GLU A 143 6.804 4.267 12.230 1.00 0.00 H new ATOM 0 HB3 GLU A 143 6.596 3.970 10.515 1.00 0.00 H new ATOM 0 HG2 GLU A 143 6.102 6.710 10.765 1.00 0.00 H new ATOM 0 HG3 GLU A 143 7.398 6.422 11.909 1.00 0.00 H new ATOM 2097 N MET A 144 3.999 2.393 11.833 1.00 0.00 N ATOM 2098 CA MET A 144 3.434 1.110 11.429 1.00 0.00 C ATOM 2099 C MET A 144 2.107 1.301 10.701 1.00 0.00 C ATOM 2100 O MET A 144 1.160 1.860 11.251 1.00 0.00 O ATOM 2101 CB MET A 144 3.231 0.211 12.651 1.00 0.00 C ATOM 2102 CG MET A 144 4.516 -0.085 13.408 1.00 0.00 C ATOM 2103 SD MET A 144 5.508 -1.367 12.616 1.00 0.00 S ATOM 2104 CE MET A 144 7.154 -0.689 12.810 1.00 0.00 C ATOM 0 H MET A 144 4.201 2.470 12.830 1.00 0.00 H new ATOM 0 HA MET A 144 4.137 0.633 10.746 1.00 0.00 H new ATOM 0 HB2 MET A 144 2.522 0.687 13.328 1.00 0.00 H new ATOM 0 HB3 MET A 144 2.783 -0.729 12.330 1.00 0.00 H new ATOM 0 HG2 MET A 144 5.105 0.828 13.487 1.00 0.00 H new ATOM 0 HG3 MET A 144 4.272 -0.396 14.424 1.00 0.00 H new ATOM 0 HE1 MET A 144 7.882 -1.370 12.369 1.00 0.00 H new ATOM 0 HE2 MET A 144 7.211 0.278 12.309 1.00 0.00 H new ATOM 0 HE3 MET A 144 7.372 -0.562 13.870 1.00 0.00 H new ATOM 2114 N ILE A 145 2.047 0.830 9.458 1.00 0.00 N ATOM 2115 CA ILE A 145 0.838 0.948 8.654 1.00 0.00 C ATOM 2116 C ILE A 145 0.165 -0.408 8.472 1.00 0.00 C ATOM 2117 O ILE A 145 0.770 -1.451 8.719 1.00 0.00 O ATOM 2118 CB ILE A 145 1.141 1.547 7.267 1.00 0.00 C ATOM 2119 CG1 ILE A 145 2.330 0.829 6.626 1.00 0.00 C ATOM 2120 CG2 ILE A 145 1.415 3.039 7.384 1.00 0.00 C ATOM 2121 CD1 ILE A 145 2.184 0.633 5.132 1.00 0.00 C ATOM 0 H ILE A 145 2.822 0.363 8.987 1.00 0.00 H new ATOM 0 HA ILE A 145 0.165 1.616 9.191 1.00 0.00 H new ATOM 0 HB ILE A 145 0.269 1.407 6.628 1.00 0.00 H new ATOM 0 HG12 ILE A 145 3.238 1.400 6.822 1.00 0.00 H new ATOM 0 HG13 ILE A 145 2.456 -0.144 7.101 1.00 0.00 H new ATOM 0 HG21 ILE A 145 1.627 3.448 6.396 1.00 0.00 H new ATOM 0 HG22 ILE A 145 0.541 3.538 7.803 1.00 0.00 H new ATOM 0 HG23 ILE A 145 2.273 3.201 8.036 1.00 0.00 H new ATOM 0 HD11 ILE A 145 3.063 0.118 4.745 1.00 0.00 H new ATOM 0 HD12 ILE A 145 1.295 0.036 4.928 1.00 0.00 H new ATOM 0 HD13 ILE A 145 2.089 1.604 4.645 1.00 0.00 H new ATOM 2133 N LYS A 146 -1.092 -0.387 8.040 1.00 0.00 N ATOM 2134 CA LYS A 146 -1.849 -1.615 7.824 1.00 0.00 C ATOM 2135 C LYS A 146 -2.403 -1.672 6.406 1.00 0.00 C ATOM 2136 O LYS A 146 -3.527 -1.240 6.149 1.00 0.00 O ATOM 2137 CB LYS A 146 -2.993 -1.718 8.835 1.00 0.00 C ATOM 2138 CG LYS A 146 -2.545 -1.557 10.279 1.00 0.00 C ATOM 2139 CD LYS A 146 -3.466 -2.302 11.233 1.00 0.00 C ATOM 2140 CE LYS A 146 -3.206 -1.909 12.679 1.00 0.00 C ATOM 2141 NZ LYS A 146 -4.468 -1.817 13.467 1.00 0.00 N ATOM 0 H LYS A 146 -1.608 0.468 7.832 1.00 0.00 H new ATOM 0 HA LYS A 146 -1.172 -2.458 7.963 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -3.738 -0.956 8.607 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -3.482 -2.685 8.721 1.00 0.00 H new ATOM 0 HG2 LYS A 146 -1.527 -1.930 10.389 1.00 0.00 H new ATOM 0 HG3 LYS A 146 -2.527 -0.499 10.540 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -4.504 -2.090 10.978 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -3.322 -3.376 11.115 1.00 0.00 H new ATOM 0 HE2 LYS A 146 -2.543 -2.641 13.140 1.00 0.00 H new ATOM 0 HE3 LYS A 146 -2.690 -0.949 12.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 -4.247 -1.547 14.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -5.091 -1.100 13.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -4.948 -2.740 13.462 1.00 0.00 H new ATOM 2155 N ILE A 147 -1.606 -2.207 5.486 1.00 0.00 N ATOM 2156 CA ILE A 147 -2.017 -2.320 4.091 1.00 0.00 C ATOM 2157 C ILE A 147 -3.140 -3.341 3.933 1.00 0.00 C ATOM 2158 O ILE A 147 -2.888 -4.535 3.774 1.00 0.00 O ATOM 2159 CB ILE A 147 -0.837 -2.727 3.187 1.00 0.00 C ATOM 2160 CG1 ILE A 147 0.362 -1.807 3.430 1.00 0.00 C ATOM 2161 CG2 ILE A 147 -1.251 -2.687 1.724 1.00 0.00 C ATOM 2162 CD1 ILE A 147 1.698 -2.482 3.200 1.00 0.00 C ATOM 0 H ILE A 147 -0.673 -2.569 5.681 1.00 0.00 H new ATOM 0 HA ILE A 147 -2.375 -1.337 3.785 1.00 0.00 H new ATOM 0 HB ILE A 147 -0.546 -3.748 3.435 1.00 0.00 H new ATOM 0 HG12 ILE A 147 0.284 -0.941 2.773 1.00 0.00 H new ATOM 0 HG13 ILE A 147 0.323 -1.435 4.454 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -0.407 -2.977 1.099 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -2.078 -3.378 1.561 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -1.566 -1.677 1.462 1.00 0.00 H new ATOM 0 HD11 ILE A 147 2.502 -1.771 3.391 1.00 0.00 H new ATOM 0 HD12 ILE A 147 1.797 -3.332 3.875 1.00 0.00 H new ATOM 0 HD13 ILE A 147 1.757 -2.829 2.168 1.00 0.00 H new ATOM 2174 N ARG A 148 -4.379 -2.862 3.976 1.00 0.00 N ATOM 2175 CA ARG A 148 -5.541 -3.733 3.837 1.00 0.00 C ATOM 2176 C ARG A 148 -5.883 -3.953 2.367 1.00 0.00 C ATOM 2177 O ARG A 148 -5.676 -3.073 1.532 1.00 0.00 O ATOM 2178 CB ARG A 148 -6.744 -3.134 4.568 1.00 0.00 C ATOM 2179 CG ARG A 148 -6.674 -3.284 6.080 1.00 0.00 C ATOM 2180 CD ARG A 148 -7.665 -2.367 6.780 1.00 0.00 C ATOM 2181 NE ARG A 148 -7.018 -1.528 7.785 1.00 0.00 N ATOM 2182 CZ ARG A 148 -7.682 -0.788 8.672 1.00 0.00 C ATOM 2183 NH1 ARG A 148 -9.008 -0.781 8.681 1.00 0.00 N ATOM 2184 NH2 ARG A 148 -7.015 -0.053 9.553 1.00 0.00 N ATOM 0 H ARG A 148 -4.604 -1.876 4.106 1.00 0.00 H new ATOM 0 HA ARG A 148 -5.297 -4.697 4.283 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -6.819 -2.075 4.319 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -7.654 -3.612 4.206 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -6.879 -4.319 6.353 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -5.664 -3.058 6.422 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -8.157 -1.734 6.042 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -8.442 -2.967 7.254 1.00 0.00 H new ATOM 0 HE ARG A 148 -5.999 -1.507 7.809 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -9.526 -1.344 8.006 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -9.510 -0.212 9.363 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -5.995 -0.055 9.551 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -7.522 0.514 10.232 1.00 0.00 H new ATOM 2198 N SER A 149 -6.410 -5.134 2.058 1.00 0.00 N ATOM 2199 CA SER A 149 -6.782 -5.471 0.688 1.00 0.00 C ATOM 2200 C SER A 149 -8.229 -5.948 0.619 1.00 0.00 C ATOM 2201 O SER A 149 -8.756 -6.504 1.582 1.00 0.00 O ATOM 2202 CB SER A 149 -5.850 -6.551 0.136 1.00 0.00 C ATOM 2203 OG SER A 149 -5.602 -6.354 -1.245 1.00 0.00 O ATOM 0 H SER A 149 -6.589 -5.873 2.738 1.00 0.00 H new ATOM 0 HA SER A 149 -6.686 -4.572 0.080 1.00 0.00 H new ATOM 0 HB2 SER A 149 -4.908 -6.537 0.683 1.00 0.00 H new ATOM 0 HB3 SER A 149 -6.295 -7.534 0.292 1.00 0.00 H new ATOM 0 HG SER A 149 -5.002 -7.056 -1.573 1.00 0.00 H new ATOM 2209 N CYS A 150 -8.864 -5.727 -0.527 1.00 0.00 N ATOM 2210 CA CYS A 150 -10.251 -6.134 -0.724 1.00 0.00 C ATOM 2211 C CYS A 150 -10.362 -7.163 -1.844 1.00 0.00 C ATOM 2212 O CYS A 150 -11.327 -7.164 -2.607 1.00 0.00 O ATOM 2213 CB CYS A 150 -11.121 -4.917 -1.046 1.00 0.00 C ATOM 2214 SG CYS A 150 -10.581 -3.988 -2.500 1.00 0.00 S ATOM 0 H CYS A 150 -8.441 -5.268 -1.334 1.00 0.00 H new ATOM 0 HA CYS A 150 -10.604 -6.590 0.201 1.00 0.00 H new ATOM 0 HB2 CYS A 150 -12.148 -5.248 -1.201 1.00 0.00 H new ATOM 0 HB3 CYS A 150 -11.128 -4.250 -0.184 1.00 0.00 H new ATOM 0 HG CYS A 150 -10.328 -2.759 -2.160 1.00 0.00 H new ATOM 2220 N ALA A 151 -9.367 -8.038 -1.937 1.00 0.00 N ATOM 2221 CA ALA A 151 -9.352 -9.073 -2.963 1.00 0.00 C ATOM 2222 C ALA A 151 -9.961 -10.370 -2.443 1.00 0.00 C ATOM 2223 O ALA A 151 -10.272 -10.491 -1.258 1.00 0.00 O ATOM 2224 CB ALA A 151 -7.930 -9.313 -3.449 1.00 0.00 C ATOM 0 H ALA A 151 -8.560 -8.051 -1.314 1.00 0.00 H new ATOM 0 HA ALA A 151 -9.958 -8.728 -3.801 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -7.933 -10.088 -4.215 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -7.528 -8.391 -3.868 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -7.309 -9.632 -2.612 1.00 0.00 H new