USER MOD reduce.3.24.130724 H: found=0, std=0, add=1082, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1075 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 90 TYR OH : rot -176:sc= -0.69 USER MOD Set 1.2: A 124 HIS : no HD1:sc= -3.66! X(o=-4.3!,f=-4.1) USER MOD Set 2.1: A 33 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 70 HIS : no HD1:sc= 0 X(o=0,f=-0.011) USER MOD Set 3.1: A 16 TYR OH : rot 15:sc= -0.328 USER MOD Set 3.2: A 48 ASN : amide:sc= -1.15 X(o=-1.5,f=-1.2) USER MOD Set 4.1: A 3 THR OG1 : rot 113:sc= 0.00709 USER MOD Set 4.2: A 6 GLN : amide:sc= 0.00824 X(o=0.015,f=-0.1) USER MOD Single : A 1 VAL N :NH3+ 168:sc= -0.0246 (180deg=-0.19) USER MOD Single : A 2 GLN : amide:sc= -0.421 X(o=-0.42,f=-0.42) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 15 GLN :FLIP amide:sc= -1.51! C(o=-3!,f=-1.5!) USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=-0.078) USER MOD Single : A 19 HIS : no HD1:sc= 0 X(o=0,f=-0.059) USER MOD Single : A 21 MET CE :methyl -164:sc= -0.103 (180deg=-0.572) USER MOD Single : A 23 ASN : amide:sc= -2.07 K(o=-2.1,f=-6.5!) USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 29 GLN : amide:sc= -0.153 K(o=-0.15,f=-1!) USER MOD Single : A 31 MET CE :methyl -136:sc= -1.68 (180deg=-5.31!) USER MOD Single : A 34 ASN : amide:sc= -0.464 K(o=-0.46,f=-2.9!) USER MOD Single : A 36 MET CE :methyl -133:sc= -2.23 (180deg=-6.78!) USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 HIS : no HD1:sc= -3.68 X(o=-3.7,f=-3.9) USER MOD Single : A 53 GLN : amide:sc= -0.0807 X(o=-0.081,f=0) USER MOD Single : A 57 GLN : amide:sc= -0.0352 K(o=-0.035,f=-1.2!) USER MOD Single : A 60 GLN : amide:sc= -0.476 K(o=-0.48,f=-3.7!) USER MOD Single : A 64 LYS NZ :NH3+ -156:sc= -0.0752 (180deg=-0.431) USER MOD Single : A 65 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 74 HIS : no HD1:sc= -0.992 X(o=-0.99,f=-1) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot 107:sc= 0.441 USER MOD Single : A 92 LYS NZ :NH3+ -116:sc= -0.028 (180deg=-0.872) USER MOD Single : A 97 ASN : amide:sc= -3.62 K(o=-3.6,f=-4.4) USER MOD Single : A 99 TYR OH : rot -140:sc= -0.856 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.0209 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 MET CE :methyl -165:sc= -0.0562 (180deg=-0.212) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ 158:sc= -0.0957 (180deg=-0.615) USER MOD Single : A 115 ASN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 126 LYS NZ :NH3+ -104:sc= -0.86 (180deg=-3.27!) USER MOD Single : A 131 SER OG : rot -147:sc= 1.33 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 7.453 -16.067 8.778 1.00 0.00 N ATOM 2 CA VAL A 1 7.033 -14.673 8.864 1.00 0.00 C ATOM 3 C VAL A 1 8.217 -13.730 8.675 1.00 0.00 C ATOM 4 O VAL A 1 9.278 -13.925 9.268 1.00 0.00 O ATOM 5 CB VAL A 1 6.363 -14.371 10.217 1.00 0.00 C ATOM 6 CG1 VAL A 1 7.353 -14.555 11.357 1.00 0.00 C ATOM 7 CG2 VAL A 1 5.785 -12.964 10.223 1.00 0.00 C ATOM 0 H1 VAL A 1 6.682 -16.683 9.108 1.00 0.00 H new ATOM 0 H2 VAL A 1 7.684 -16.300 7.791 1.00 0.00 H new ATOM 0 H3 VAL A 1 8.293 -16.214 9.374 1.00 0.00 H new ATOM 0 HA VAL A 1 6.310 -14.510 8.064 1.00 0.00 H new ATOM 0 HB VAL A 1 5.544 -15.076 10.362 1.00 0.00 H new ATOM 0 HG11 VAL A 1 6.861 -14.337 12.305 1.00 0.00 H new ATOM 0 HG12 VAL A 1 7.713 -15.584 11.363 1.00 0.00 H new ATOM 0 HG13 VAL A 1 8.195 -13.876 11.221 1.00 0.00 H new ATOM 0 HG21 VAL A 1 5.315 -12.768 11.187 1.00 0.00 H new ATOM 0 HG22 VAL A 1 6.584 -12.242 10.055 1.00 0.00 H new ATOM 0 HG23 VAL A 1 5.041 -12.873 9.432 1.00 0.00 H new ATOM 17 N GLN A 2 8.026 -12.709 7.845 1.00 0.00 N ATOM 18 CA GLN A 2 9.079 -11.737 7.577 1.00 0.00 C ATOM 19 C GLN A 2 8.657 -10.342 8.026 1.00 0.00 C ATOM 20 O GLN A 2 7.481 -10.092 8.294 1.00 0.00 O ATOM 21 CB GLN A 2 9.424 -11.724 6.087 1.00 0.00 C ATOM 22 CG GLN A 2 10.880 -11.393 5.803 1.00 0.00 C ATOM 23 CD GLN A 2 11.841 -12.317 6.526 1.00 0.00 C ATOM 24 OE1 GLN A 2 11.833 -13.530 6.312 1.00 0.00 O ATOM 25 NE2 GLN A 2 12.675 -11.747 7.388 1.00 0.00 N ATOM 0 H GLN A 2 7.153 -12.534 7.347 1.00 0.00 H new ATOM 0 HA GLN A 2 9.963 -12.030 8.144 1.00 0.00 H new ATOM 0 HB2 GLN A 2 9.192 -12.700 5.660 1.00 0.00 H new ATOM 0 HB3 GLN A 2 8.789 -10.996 5.582 1.00 0.00 H new ATOM 0 HG2 GLN A 2 11.060 -11.456 4.730 1.00 0.00 H new ATOM 0 HG3 GLN A 2 11.079 -10.363 6.100 1.00 0.00 H new ATOM 0 HE21 GLN A 2 12.647 -10.738 7.534 1.00 0.00 H new ATOM 0 HE22 GLN A 2 13.344 -12.318 7.904 1.00 0.00 H new ATOM 34 N THR A 3 9.624 -9.432 8.105 1.00 0.00 N ATOM 35 CA THR A 3 9.353 -8.062 8.521 1.00 0.00 C ATOM 36 C THR A 3 10.155 -7.067 7.691 1.00 0.00 C ATOM 37 O THR A 3 11.346 -7.263 7.447 1.00 0.00 O ATOM 38 CB THR A 3 9.682 -7.853 10.011 1.00 0.00 C ATOM 39 OG1 THR A 3 8.959 -8.796 10.810 1.00 0.00 O ATOM 40 CG2 THR A 3 9.336 -6.438 10.449 1.00 0.00 C ATOM 0 H THR A 3 10.602 -9.620 7.886 1.00 0.00 H new ATOM 0 HA THR A 3 8.289 -7.888 8.363 1.00 0.00 H new ATOM 0 HB THR A 3 10.752 -8.007 10.148 1.00 0.00 H new ATOM 0 HG1 THR A 3 9.588 -9.419 11.231 1.00 0.00 H new ATOM 0 HG21 THR A 3 9.577 -6.315 11.505 1.00 0.00 H new ATOM 0 HG22 THR A 3 9.911 -5.724 9.860 1.00 0.00 H new ATOM 0 HG23 THR A 3 8.271 -6.260 10.297 1.00 0.00 H new ATOM 48 N VAL A 4 9.495 -5.997 7.259 1.00 0.00 N ATOM 49 CA VAL A 4 10.147 -4.968 6.458 1.00 0.00 C ATOM 50 C VAL A 4 11.446 -4.507 7.107 1.00 0.00 C ATOM 51 O VAL A 4 12.441 -4.263 6.425 1.00 0.00 O ATOM 52 CB VAL A 4 9.228 -3.750 6.251 1.00 0.00 C ATOM 53 CG1 VAL A 4 9.963 -2.646 5.508 1.00 0.00 C ATOM 54 CG2 VAL A 4 7.965 -4.156 5.506 1.00 0.00 C ATOM 0 H VAL A 4 8.509 -5.820 7.451 1.00 0.00 H new ATOM 0 HA VAL A 4 10.368 -5.415 5.489 1.00 0.00 H new ATOM 0 HB VAL A 4 8.938 -3.366 7.229 1.00 0.00 H new ATOM 0 HG11 VAL A 4 9.297 -1.794 5.371 1.00 0.00 H new ATOM 0 HG12 VAL A 4 10.834 -2.337 6.085 1.00 0.00 H new ATOM 0 HG13 VAL A 4 10.285 -3.015 4.534 1.00 0.00 H new ATOM 0 HG21 VAL A 4 7.327 -3.283 5.368 1.00 0.00 H new ATOM 0 HG22 VAL A 4 8.233 -4.567 4.532 1.00 0.00 H new ATOM 0 HG23 VAL A 4 7.429 -4.910 6.083 1.00 0.00 H new ATOM 64 N GLY A 5 11.430 -4.388 8.431 1.00 0.00 N ATOM 65 CA GLY A 5 12.613 -3.955 9.152 1.00 0.00 C ATOM 66 C GLY A 5 13.785 -4.898 8.963 1.00 0.00 C ATOM 67 O GLY A 5 14.899 -4.463 8.677 1.00 0.00 O ATOM 0 H GLY A 5 10.619 -4.584 9.017 1.00 0.00 H new ATOM 0 HA2 GLY A 5 12.895 -2.958 8.815 1.00 0.00 H new ATOM 0 HA3 GLY A 5 12.380 -3.879 10.214 1.00 0.00 H new ATOM 71 N GLN A 6 13.531 -6.193 9.124 1.00 0.00 N ATOM 72 CA GLN A 6 14.575 -7.200 8.971 1.00 0.00 C ATOM 73 C GLN A 6 15.104 -7.222 7.541 1.00 0.00 C ATOM 74 O GLN A 6 16.311 -7.125 7.314 1.00 0.00 O ATOM 75 CB GLN A 6 14.040 -8.581 9.352 1.00 0.00 C ATOM 76 CG GLN A 6 13.589 -8.681 10.800 1.00 0.00 C ATOM 77 CD GLN A 6 12.971 -10.027 11.126 1.00 0.00 C ATOM 78 OE1 GLN A 6 11.818 -10.105 11.552 1.00 0.00 O ATOM 79 NE2 GLN A 6 13.734 -11.094 10.928 1.00 0.00 N ATOM 0 H GLN A 6 12.613 -6.569 9.360 1.00 0.00 H new ATOM 0 HA GLN A 6 15.397 -6.940 9.638 1.00 0.00 H new ATOM 0 HB2 GLN A 6 13.201 -8.829 8.701 1.00 0.00 H new ATOM 0 HB3 GLN A 6 14.816 -9.325 9.170 1.00 0.00 H new ATOM 0 HG2 GLN A 6 14.443 -8.509 11.455 1.00 0.00 H new ATOM 0 HG3 GLN A 6 12.865 -7.893 11.006 1.00 0.00 H new ATOM 0 HE21 GLN A 6 14.684 -10.983 10.573 1.00 0.00 H new ATOM 0 HE22 GLN A 6 13.371 -12.025 11.130 1.00 0.00 H new ATOM 88 N TRP A 7 14.196 -7.351 6.581 1.00 0.00 N ATOM 89 CA TRP A 7 14.572 -7.387 5.172 1.00 0.00 C ATOM 90 C TRP A 7 15.312 -6.115 4.774 1.00 0.00 C ATOM 91 O TRP A 7 16.422 -6.172 4.243 1.00 0.00 O ATOM 92 CB TRP A 7 13.330 -7.565 4.296 1.00 0.00 C ATOM 93 CG TRP A 7 13.599 -7.360 2.836 1.00 0.00 C ATOM 94 CD1 TRP A 7 14.255 -8.213 1.995 1.00 0.00 C ATOM 95 CD2 TRP A 7 13.221 -6.227 2.047 1.00 0.00 C ATOM 96 NE1 TRP A 7 14.307 -7.679 0.730 1.00 0.00 N ATOM 97 CE2 TRP A 7 13.678 -6.462 0.736 1.00 0.00 C ATOM 98 CE3 TRP A 7 12.537 -5.038 2.319 1.00 0.00 C ATOM 99 CZ2 TRP A 7 13.475 -5.551 -0.298 1.00 0.00 C ATOM 100 CZ3 TRP A 7 12.337 -4.135 1.293 1.00 0.00 C ATOM 101 CH2 TRP A 7 12.805 -4.395 -0.003 1.00 0.00 C ATOM 0 H TRP A 7 13.194 -7.432 6.752 1.00 0.00 H new ATOM 0 HA TRP A 7 15.239 -8.236 5.021 1.00 0.00 H new ATOM 0 HB2 TRP A 7 12.928 -8.567 4.447 1.00 0.00 H new ATOM 0 HB3 TRP A 7 12.562 -6.862 4.619 1.00 0.00 H new ATOM 0 HD1 TRP A 7 14.672 -9.167 2.282 1.00 0.00 H new ATOM 0 HE1 TRP A 7 14.743 -8.117 -0.081 1.00 0.00 H new ATOM 0 HE3 TRP A 7 12.172 -4.829 3.314 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 13.834 -5.750 -1.297 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 11.811 -3.213 1.492 1.00 0.00 H new ATOM 0 HH2 TRP A 7 12.633 -3.669 -0.784 1.00 0.00 H new ATOM 112 N LEU A 8 14.692 -4.969 5.034 1.00 0.00 N ATOM 113 CA LEU A 8 15.292 -3.682 4.702 1.00 0.00 C ATOM 114 C LEU A 8 16.649 -3.523 5.381 1.00 0.00 C ATOM 115 O LEU A 8 17.572 -2.938 4.816 1.00 0.00 O ATOM 116 CB LEU A 8 14.365 -2.541 5.119 1.00 0.00 C ATOM 117 CG LEU A 8 14.733 -1.151 4.600 1.00 0.00 C ATOM 118 CD1 LEU A 8 14.453 -1.046 3.109 1.00 0.00 C ATOM 119 CD2 LEU A 8 13.974 -0.077 5.364 1.00 0.00 C ATOM 0 H LEU A 8 13.774 -4.905 5.474 1.00 0.00 H new ATOM 0 HA LEU A 8 15.439 -3.646 3.623 1.00 0.00 H new ATOM 0 HB2 LEU A 8 13.356 -2.778 4.781 1.00 0.00 H new ATOM 0 HB3 LEU A 8 14.335 -2.504 6.208 1.00 0.00 H new ATOM 0 HG LEU A 8 15.800 -0.996 4.760 1.00 0.00 H new ATOM 0 HD11 LEU A 8 14.721 -0.050 2.758 1.00 0.00 H new ATOM 0 HD12 LEU A 8 15.043 -1.790 2.575 1.00 0.00 H new ATOM 0 HD13 LEU A 8 13.393 -1.223 2.924 1.00 0.00 H new ATOM 0 HD21 LEU A 8 14.249 0.906 4.980 1.00 0.00 H new ATOM 0 HD22 LEU A 8 12.902 -0.229 5.237 1.00 0.00 H new ATOM 0 HD23 LEU A 8 14.226 -0.137 6.423 1.00 0.00 H new ATOM 131 N GLU A 9 16.762 -4.051 6.597 1.00 0.00 N ATOM 132 CA GLU A 9 18.007 -3.968 7.351 1.00 0.00 C ATOM 133 C GLU A 9 19.099 -4.807 6.693 1.00 0.00 C ATOM 134 O GLU A 9 20.259 -4.400 6.637 1.00 0.00 O ATOM 135 CB GLU A 9 17.787 -4.436 8.792 1.00 0.00 C ATOM 136 CG GLU A 9 19.071 -4.553 9.596 1.00 0.00 C ATOM 137 CD GLU A 9 18.858 -4.295 11.075 1.00 0.00 C ATOM 138 OE1 GLU A 9 17.939 -4.906 11.659 1.00 0.00 O ATOM 139 OE2 GLU A 9 19.611 -3.479 11.648 1.00 0.00 O ATOM 0 H GLU A 9 16.008 -4.540 7.079 1.00 0.00 H new ATOM 0 HA GLU A 9 18.329 -2.927 7.359 1.00 0.00 H new ATOM 0 HB2 GLU A 9 17.116 -3.738 9.293 1.00 0.00 H new ATOM 0 HB3 GLU A 9 17.287 -5.405 8.778 1.00 0.00 H new ATOM 0 HG2 GLU A 9 19.490 -5.550 9.462 1.00 0.00 H new ATOM 0 HG3 GLU A 9 19.804 -3.845 9.209 1.00 0.00 H new ATOM 146 N SER A 10 18.719 -5.982 6.200 1.00 0.00 N ATOM 147 CA SER A 10 19.665 -6.880 5.550 1.00 0.00 C ATOM 148 C SER A 10 20.182 -6.275 4.248 1.00 0.00 C ATOM 149 O SER A 10 21.387 -6.264 3.992 1.00 0.00 O ATOM 150 CB SER A 10 19.007 -8.233 5.271 1.00 0.00 C ATOM 151 OG SER A 10 19.938 -9.148 4.720 1.00 0.00 O ATOM 0 H SER A 10 17.762 -6.334 6.239 1.00 0.00 H new ATOM 0 HA SER A 10 20.510 -7.027 6.223 1.00 0.00 H new ATOM 0 HB2 SER A 10 18.597 -8.639 6.196 1.00 0.00 H new ATOM 0 HB3 SER A 10 18.172 -8.100 4.583 1.00 0.00 H new ATOM 0 HG SER A 10 19.494 -10.005 4.552 1.00 0.00 H new ATOM 157 N ILE A 11 19.264 -5.772 3.430 1.00 0.00 N ATOM 158 CA ILE A 11 19.626 -5.166 2.155 1.00 0.00 C ATOM 159 C ILE A 11 20.249 -3.789 2.361 1.00 0.00 C ATOM 160 O ILE A 11 20.996 -3.302 1.513 1.00 0.00 O ATOM 161 CB ILE A 11 18.404 -5.031 1.228 1.00 0.00 C ATOM 162 CG1 ILE A 11 17.365 -4.096 1.850 1.00 0.00 C ATOM 163 CG2 ILE A 11 17.797 -6.398 0.951 1.00 0.00 C ATOM 164 CD1 ILE A 11 16.142 -3.891 0.984 1.00 0.00 C ATOM 0 H ILE A 11 18.263 -5.772 3.628 1.00 0.00 H new ATOM 0 HA ILE A 11 20.355 -5.827 1.686 1.00 0.00 H new ATOM 0 HB ILE A 11 18.730 -4.601 0.281 1.00 0.00 H new ATOM 0 HG12 ILE A 11 17.054 -4.500 2.813 1.00 0.00 H new ATOM 0 HG13 ILE A 11 17.829 -3.129 2.045 1.00 0.00 H new ATOM 0 HG21 ILE A 11 16.934 -6.287 0.294 1.00 0.00 H new ATOM 0 HG22 ILE A 11 18.539 -7.035 0.470 1.00 0.00 H new ATOM 0 HG23 ILE A 11 17.482 -6.853 1.890 1.00 0.00 H new ATOM 0 HD11 ILE A 11 15.448 -3.217 1.487 1.00 0.00 H new ATOM 0 HD12 ILE A 11 16.441 -3.457 0.030 1.00 0.00 H new ATOM 0 HD13 ILE A 11 15.654 -4.850 0.810 1.00 0.00 H new ATOM 176 N GLY A 12 19.937 -3.166 3.494 1.00 0.00 N ATOM 177 CA GLY A 12 20.475 -1.852 3.790 1.00 0.00 C ATOM 178 C GLY A 12 20.527 -1.569 5.278 1.00 0.00 C ATOM 179 O GLY A 12 21.400 -2.077 5.984 1.00 0.00 O ATOM 0 H GLY A 12 19.321 -3.549 4.212 1.00 0.00 H new ATOM 0 HA2 GLY A 12 21.479 -1.771 3.373 1.00 0.00 H new ATOM 0 HA3 GLY A 12 19.864 -1.094 3.300 1.00 0.00 H new ATOM 183 N LEU A 13 19.593 -0.757 5.758 1.00 0.00 N ATOM 184 CA LEU A 13 19.536 -0.406 7.173 1.00 0.00 C ATOM 185 C LEU A 13 18.118 -0.024 7.583 1.00 0.00 C ATOM 186 O LEU A 13 17.306 0.416 6.769 1.00 0.00 O ATOM 187 CB LEU A 13 20.493 0.750 7.470 1.00 0.00 C ATOM 188 CG LEU A 13 21.984 0.443 7.321 1.00 0.00 C ATOM 189 CD1 LEU A 13 22.810 1.708 7.495 1.00 0.00 C ATOM 190 CD2 LEU A 13 22.413 -0.618 8.322 1.00 0.00 C ATOM 0 H LEU A 13 18.864 -0.328 5.188 1.00 0.00 H new ATOM 0 HA LEU A 13 19.839 -1.279 7.751 1.00 0.00 H new ATOM 0 HB2 LEU A 13 20.245 1.579 6.808 1.00 0.00 H new ATOM 0 HB3 LEU A 13 20.313 1.091 8.489 1.00 0.00 H new ATOM 0 HG LEU A 13 22.157 0.057 6.316 1.00 0.00 H new ATOM 0 HD11 LEU A 13 23.868 1.470 7.386 1.00 0.00 H new ATOM 0 HD12 LEU A 13 22.522 2.437 6.738 1.00 0.00 H new ATOM 0 HD13 LEU A 13 22.633 2.125 8.486 1.00 0.00 H new ATOM 0 HD21 LEU A 13 23.477 -0.823 8.201 1.00 0.00 H new ATOM 0 HD22 LEU A 13 22.225 -0.260 9.334 1.00 0.00 H new ATOM 0 HD23 LEU A 13 21.845 -1.532 8.149 1.00 0.00 H new ATOM 202 N PRO A 14 17.809 -0.195 8.878 1.00 0.00 N ATOM 203 CA PRO A 14 16.489 0.128 9.426 1.00 0.00 C ATOM 204 C PRO A 14 16.227 1.629 9.461 1.00 0.00 C ATOM 205 O PRO A 14 15.114 2.067 9.752 1.00 0.00 O ATOM 206 CB PRO A 14 16.548 -0.437 10.847 1.00 0.00 C ATOM 207 CG PRO A 14 17.998 -0.446 11.192 1.00 0.00 C ATOM 208 CD PRO A 14 18.728 -0.715 9.905 1.00 0.00 C ATOM 0 HA PRO A 14 15.684 -0.287 8.820 1.00 0.00 H new ATOM 0 HB2 PRO A 14 15.980 0.181 11.542 1.00 0.00 H new ATOM 0 HB3 PRO A 14 16.124 -1.440 10.892 1.00 0.00 H new ATOM 0 HG2 PRO A 14 18.303 0.508 11.622 1.00 0.00 H new ATOM 0 HG3 PRO A 14 18.218 -1.214 11.933 1.00 0.00 H new ATOM 0 HD2 PRO A 14 19.692 -0.207 9.876 1.00 0.00 H new ATOM 0 HD3 PRO A 14 18.923 -1.779 9.768 1.00 0.00 H new ATOM 216 N GLN A 15 17.257 2.413 9.160 1.00 0.00 N ATOM 217 CA GLN A 15 17.137 3.866 9.157 1.00 0.00 C ATOM 218 C GLN A 15 15.979 4.314 8.272 1.00 0.00 C ATOM 219 O GLN A 15 15.382 5.366 8.500 1.00 0.00 O ATOM 220 CB GLN A 15 18.439 4.506 8.676 1.00 0.00 C ATOM 221 CG GLN A 15 19.410 4.833 9.800 1.00 0.00 C ATOM 222 CD GLN A 15 20.132 3.606 10.323 1.00 0.00 C ATOM 223 OE1 GLN A 15 21.233 3.245 9.675 1.00 0.00 O flip ATOM 224 NE2 GLN A 15 19.704 2.989 11.299 1.00 0.00 N flip ATOM 0 H GLN A 15 18.184 2.066 8.915 1.00 0.00 H new ATOM 0 HA GLN A 15 16.937 4.191 10.178 1.00 0.00 H new ATOM 0 HB2 GLN A 15 18.926 3.832 7.971 1.00 0.00 H new ATOM 0 HB3 GLN A 15 18.205 5.421 8.132 1.00 0.00 H new ATOM 0 HG2 GLN A 15 20.143 5.556 9.443 1.00 0.00 H new ATOM 0 HG3 GLN A 15 18.867 5.307 10.618 1.00 0.00 H new ATOM 0 HE21 GLN A 15 18.853 3.302 11.767 1.00 0.00 H new ATOM 0 HE22 GLN A 15 20.200 2.165 11.639 1.00 0.00 H new ATOM 233 N TYR A 16 15.667 3.509 7.262 1.00 0.00 N ATOM 234 CA TYR A 16 14.582 3.825 6.341 1.00 0.00 C ATOM 235 C TYR A 16 13.328 3.027 6.684 1.00 0.00 C ATOM 236 O TYR A 16 12.237 3.325 6.196 1.00 0.00 O ATOM 237 CB TYR A 16 15.007 3.534 4.901 1.00 0.00 C ATOM 238 CG TYR A 16 16.282 4.237 4.493 1.00 0.00 C ATOM 239 CD1 TYR A 16 17.522 3.640 4.693 1.00 0.00 C ATOM 240 CD2 TYR A 16 16.248 5.496 3.907 1.00 0.00 C ATOM 241 CE1 TYR A 16 18.690 4.279 4.322 1.00 0.00 C ATOM 242 CE2 TYR A 16 17.411 6.142 3.533 1.00 0.00 C ATOM 243 CZ TYR A 16 18.629 5.529 3.742 1.00 0.00 C ATOM 244 OH TYR A 16 19.790 6.169 3.371 1.00 0.00 O ATOM 0 H TYR A 16 16.150 2.633 7.061 1.00 0.00 H new ATOM 0 HA TYR A 16 14.354 4.886 6.438 1.00 0.00 H new ATOM 0 HB2 TYR A 16 15.140 2.459 4.780 1.00 0.00 H new ATOM 0 HB3 TYR A 16 14.205 3.834 4.227 1.00 0.00 H new ATOM 0 HD1 TYR A 16 17.573 2.661 5.146 1.00 0.00 H new ATOM 0 HD2 TYR A 16 15.296 5.978 3.741 1.00 0.00 H new ATOM 0 HE1 TYR A 16 19.645 3.802 4.485 1.00 0.00 H new ATOM 0 HE2 TYR A 16 17.367 7.121 3.080 1.00 0.00 H new ATOM 0 HH TYR A 16 20.530 5.526 3.362 1.00 0.00 H new ATOM 254 N GLU A 17 13.491 2.011 7.526 1.00 0.00 N ATOM 255 CA GLU A 17 12.372 1.170 7.933 1.00 0.00 C ATOM 256 C GLU A 17 11.205 2.019 8.426 1.00 0.00 C ATOM 257 O GLU A 17 10.059 1.807 8.031 1.00 0.00 O ATOM 258 CB GLU A 17 12.810 0.198 9.031 1.00 0.00 C ATOM 259 CG GLU A 17 11.702 -0.732 9.498 1.00 0.00 C ATOM 260 CD GLU A 17 12.026 -1.408 10.817 1.00 0.00 C ATOM 261 OE1 GLU A 17 13.144 -1.198 11.332 1.00 0.00 O ATOM 262 OE2 GLU A 17 11.161 -2.147 11.333 1.00 0.00 O ATOM 0 H GLU A 17 14.387 1.751 7.939 1.00 0.00 H new ATOM 0 HA GLU A 17 12.043 0.601 7.064 1.00 0.00 H new ATOM 0 HB2 GLU A 17 13.644 -0.400 8.664 1.00 0.00 H new ATOM 0 HB3 GLU A 17 13.178 0.768 9.884 1.00 0.00 H new ATOM 0 HG2 GLU A 17 10.777 -0.165 9.602 1.00 0.00 H new ATOM 0 HG3 GLU A 17 11.526 -1.493 8.737 1.00 0.00 H new ATOM 269 N ASN A 18 11.505 2.980 9.293 1.00 0.00 N ATOM 270 CA ASN A 18 10.480 3.861 9.842 1.00 0.00 C ATOM 271 C ASN A 18 9.642 4.481 8.728 1.00 0.00 C ATOM 272 O ASN A 18 8.414 4.525 8.812 1.00 0.00 O ATOM 273 CB ASN A 18 11.124 4.964 10.684 1.00 0.00 C ATOM 274 CG ASN A 18 11.758 4.427 11.953 1.00 0.00 C ATOM 275 OD1 ASN A 18 11.115 3.726 12.733 1.00 0.00 O ATOM 276 ND2 ASN A 18 13.028 4.756 12.164 1.00 0.00 N ATOM 0 H ASN A 18 12.449 3.169 9.631 1.00 0.00 H new ATOM 0 HA ASN A 18 9.825 3.264 10.476 1.00 0.00 H new ATOM 0 HB2 ASN A 18 11.882 5.475 10.090 1.00 0.00 H new ATOM 0 HB3 ASN A 18 10.369 5.706 10.944 1.00 0.00 H new ATOM 0 HD21 ASN A 18 13.509 4.425 13.000 1.00 0.00 H new ATOM 0 HD22 ASN A 18 13.522 5.340 11.490 1.00 0.00 H new ATOM 283 N HIS A 19 10.313 4.959 7.685 1.00 0.00 N ATOM 284 CA HIS A 19 9.630 5.575 6.553 1.00 0.00 C ATOM 285 C HIS A 19 8.752 4.558 5.829 1.00 0.00 C ATOM 286 O HIS A 19 7.584 4.823 5.543 1.00 0.00 O ATOM 287 CB HIS A 19 10.648 6.172 5.580 1.00 0.00 C ATOM 288 CG HIS A 19 10.775 7.660 5.686 1.00 0.00 C ATOM 289 ND1 HIS A 19 10.860 8.325 6.891 1.00 0.00 N ATOM 290 CD2 HIS A 19 10.831 8.614 4.727 1.00 0.00 C ATOM 291 CE1 HIS A 19 10.964 9.624 6.669 1.00 0.00 C ATOM 292 NE2 HIS A 19 10.949 9.825 5.364 1.00 0.00 N ATOM 0 H HIS A 19 11.329 4.932 7.600 1.00 0.00 H new ATOM 0 HA HIS A 19 8.992 6.372 6.935 1.00 0.00 H new ATOM 0 HB2 HIS A 19 11.622 5.718 5.762 1.00 0.00 H new ATOM 0 HB3 HIS A 19 10.361 5.912 4.561 1.00 0.00 H new ATOM 0 HD2 HIS A 19 10.790 8.453 3.660 1.00 0.00 H new ATOM 0 HE1 HIS A 19 11.047 10.390 7.426 1.00 0.00 H new ATOM 0 HE2 HIS A 19 11.014 10.733 4.904 1.00 0.00 H new ATOM 300 N LEU A 20 9.323 3.395 5.534 1.00 0.00 N ATOM 301 CA LEU A 20 8.593 2.338 4.843 1.00 0.00 C ATOM 302 C LEU A 20 7.282 2.024 5.558 1.00 0.00 C ATOM 303 O LEU A 20 6.200 2.223 5.006 1.00 0.00 O ATOM 304 CB LEU A 20 9.451 1.075 4.749 1.00 0.00 C ATOM 305 CG LEU A 20 10.180 0.858 3.423 1.00 0.00 C ATOM 306 CD1 LEU A 20 11.624 1.326 3.524 1.00 0.00 C ATOM 307 CD2 LEU A 20 10.120 -0.608 3.015 1.00 0.00 C ATOM 0 H LEU A 20 10.289 3.160 5.763 1.00 0.00 H new ATOM 0 HA LEU A 20 8.362 2.688 3.837 1.00 0.00 H new ATOM 0 HB2 LEU A 20 10.192 1.103 5.548 1.00 0.00 H new ATOM 0 HB3 LEU A 20 8.813 0.211 4.936 1.00 0.00 H new ATOM 0 HG LEU A 20 9.681 1.449 2.655 1.00 0.00 H new ATOM 0 HD11 LEU A 20 12.127 1.163 2.571 1.00 0.00 H new ATOM 0 HD12 LEU A 20 11.646 2.388 3.769 1.00 0.00 H new ATOM 0 HD13 LEU A 20 12.135 0.763 4.304 1.00 0.00 H new ATOM 0 HD21 LEU A 20 10.644 -0.744 2.069 1.00 0.00 H new ATOM 0 HD22 LEU A 20 10.594 -1.219 3.783 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.079 -0.911 2.900 1.00 0.00 H new ATOM 319 N MET A 21 7.388 1.535 6.789 1.00 0.00 N ATOM 320 CA MET A 21 6.211 1.197 7.581 1.00 0.00 C ATOM 321 C MET A 21 5.260 2.386 7.676 1.00 0.00 C ATOM 322 O MET A 21 4.051 2.240 7.496 1.00 0.00 O ATOM 323 CB MET A 21 6.626 0.748 8.984 1.00 0.00 C ATOM 324 CG MET A 21 7.372 1.814 9.768 1.00 0.00 C ATOM 325 SD MET A 21 8.199 1.153 11.228 1.00 0.00 S ATOM 326 CE MET A 21 6.881 0.178 11.950 1.00 0.00 C ATOM 0 H MET A 21 8.277 1.364 7.260 1.00 0.00 H new ATOM 0 HA MET A 21 5.692 0.378 7.083 1.00 0.00 H new ATOM 0 HB2 MET A 21 5.736 0.456 9.541 1.00 0.00 H new ATOM 0 HB3 MET A 21 7.256 -0.138 8.901 1.00 0.00 H new ATOM 0 HG2 MET A 21 8.110 2.286 9.120 1.00 0.00 H new ATOM 0 HG3 MET A 21 6.672 2.592 10.073 1.00 0.00 H new ATOM 0 HE1 MET A 21 7.129 -0.060 12.984 1.00 0.00 H new ATOM 0 HE2 MET A 21 5.951 0.746 11.922 1.00 0.00 H new ATOM 0 HE3 MET A 21 6.760 -0.746 11.384 1.00 0.00 H new ATOM 336 N ALA A 22 5.814 3.560 7.958 1.00 0.00 N ATOM 337 CA ALA A 22 5.015 4.773 8.075 1.00 0.00 C ATOM 338 C ALA A 22 4.298 5.086 6.766 1.00 0.00 C ATOM 339 O ALA A 22 3.253 5.736 6.759 1.00 0.00 O ATOM 340 CB ALA A 22 5.891 5.945 8.492 1.00 0.00 C ATOM 0 H ALA A 22 6.813 3.697 8.110 1.00 0.00 H new ATOM 0 HA ALA A 22 4.259 4.608 8.843 1.00 0.00 H new ATOM 0 HB1 ALA A 22 5.280 6.844 8.575 1.00 0.00 H new ATOM 0 HB2 ALA A 22 6.353 5.729 9.456 1.00 0.00 H new ATOM 0 HB3 ALA A 22 6.668 6.102 7.744 1.00 0.00 H new ATOM 346 N ASN A 23 4.868 4.621 5.659 1.00 0.00 N ATOM 347 CA ASN A 23 4.283 4.854 4.343 1.00 0.00 C ATOM 348 C ASN A 23 3.403 3.680 3.924 1.00 0.00 C ATOM 349 O ASN A 23 3.096 3.511 2.744 1.00 0.00 O ATOM 350 CB ASN A 23 5.385 5.076 3.305 1.00 0.00 C ATOM 351 CG ASN A 23 4.938 5.978 2.171 1.00 0.00 C ATOM 352 OD1 ASN A 23 3.803 5.888 1.702 1.00 0.00 O ATOM 353 ND2 ASN A 23 5.831 6.853 1.725 1.00 0.00 N ATOM 0 H ASN A 23 5.733 4.081 5.647 1.00 0.00 H new ATOM 0 HA ASN A 23 3.662 5.748 4.401 1.00 0.00 H new ATOM 0 HB2 ASN A 23 6.256 5.514 3.792 1.00 0.00 H new ATOM 0 HB3 ASN A 23 5.697 4.114 2.899 1.00 0.00 H new ATOM 0 HD21 ASN A 23 5.588 7.486 0.963 1.00 0.00 H new ATOM 0 HD22 ASN A 23 6.760 6.892 2.144 1.00 0.00 H new ATOM 360 N GLY A 24 3.000 2.872 4.900 1.00 0.00 N ATOM 361 CA GLY A 24 2.158 1.725 4.612 1.00 0.00 C ATOM 362 C GLY A 24 2.961 0.459 4.391 1.00 0.00 C ATOM 363 O GLY A 24 2.433 -0.648 4.513 1.00 0.00 O ATOM 0 H GLY A 24 3.241 2.991 5.884 1.00 0.00 H new ATOM 0 HA2 GLY A 24 1.463 1.572 5.438 1.00 0.00 H new ATOM 0 HA3 GLY A 24 1.559 1.931 3.725 1.00 0.00 H new ATOM 367 N PHE A 25 4.238 0.618 4.064 1.00 0.00 N ATOM 368 CA PHE A 25 5.115 -0.521 3.822 1.00 0.00 C ATOM 369 C PHE A 25 5.584 -1.136 5.137 1.00 0.00 C ATOM 370 O PHE A 25 6.776 -1.131 5.446 1.00 0.00 O ATOM 371 CB PHE A 25 6.323 -0.095 2.985 1.00 0.00 C ATOM 372 CG PHE A 25 6.150 -0.341 1.514 1.00 0.00 C ATOM 373 CD1 PHE A 25 5.950 -1.624 1.032 1.00 0.00 C ATOM 374 CD2 PHE A 25 6.189 0.711 0.613 1.00 0.00 C ATOM 375 CE1 PHE A 25 5.791 -1.854 -0.322 1.00 0.00 C ATOM 376 CE2 PHE A 25 6.030 0.487 -0.742 1.00 0.00 C ATOM 377 CZ PHE A 25 5.832 -0.797 -1.210 1.00 0.00 C ATOM 0 H PHE A 25 4.690 1.527 3.960 1.00 0.00 H new ATOM 0 HA PHE A 25 4.548 -1.272 3.272 1.00 0.00 H new ATOM 0 HB2 PHE A 25 6.512 0.966 3.148 1.00 0.00 H new ATOM 0 HB3 PHE A 25 7.205 -0.633 3.334 1.00 0.00 H new ATOM 0 HD1 PHE A 25 5.918 -2.454 1.722 1.00 0.00 H new ATOM 0 HD2 PHE A 25 6.345 1.717 0.973 1.00 0.00 H new ATOM 0 HE1 PHE A 25 5.635 -2.859 -0.685 1.00 0.00 H new ATOM 0 HE2 PHE A 25 6.061 1.316 -1.434 1.00 0.00 H new ATOM 0 HZ PHE A 25 5.709 -0.974 -2.268 1.00 0.00 H new ATOM 387 N ASP A 26 4.638 -1.661 5.908 1.00 0.00 N ATOM 388 CA ASP A 26 4.953 -2.280 7.191 1.00 0.00 C ATOM 389 C ASP A 26 4.914 -3.801 7.085 1.00 0.00 C ATOM 390 O ASP A 26 5.394 -4.507 7.971 1.00 0.00 O ATOM 391 CB ASP A 26 3.974 -1.805 8.265 1.00 0.00 C ATOM 392 CG ASP A 26 2.609 -2.452 8.129 1.00 0.00 C ATOM 393 OD1 ASP A 26 2.476 -3.638 8.494 1.00 0.00 O ATOM 394 OD2 ASP A 26 1.674 -1.772 7.658 1.00 0.00 O ATOM 0 H ASP A 26 3.647 -1.670 5.667 1.00 0.00 H new ATOM 0 HA ASP A 26 5.962 -1.980 7.473 1.00 0.00 H new ATOM 0 HB2 ASP A 26 4.383 -2.029 9.250 1.00 0.00 H new ATOM 0 HB3 ASP A 26 3.868 -0.722 8.203 1.00 0.00 H new ATOM 399 N ASN A 27 4.338 -4.298 5.995 1.00 0.00 N ATOM 400 CA ASN A 27 4.234 -5.736 5.774 1.00 0.00 C ATOM 401 C ASN A 27 5.032 -6.156 4.543 1.00 0.00 C ATOM 402 O ASN A 27 4.806 -5.652 3.443 1.00 0.00 O ATOM 403 CB ASN A 27 2.769 -6.144 5.611 1.00 0.00 C ATOM 404 CG ASN A 27 2.309 -7.097 6.698 1.00 0.00 C ATOM 405 OD1 ASN A 27 1.446 -6.761 7.509 1.00 0.00 O ATOM 406 ND2 ASN A 27 2.887 -8.292 6.719 1.00 0.00 N ATOM 0 H ASN A 27 3.936 -3.727 5.252 1.00 0.00 H new ATOM 0 HA ASN A 27 4.650 -6.243 6.645 1.00 0.00 H new ATOM 0 HB2 ASN A 27 2.143 -5.252 5.625 1.00 0.00 H new ATOM 0 HB3 ASN A 27 2.632 -6.615 4.637 1.00 0.00 H new ATOM 0 HD21 ASN A 27 2.620 -8.975 7.428 1.00 0.00 H new ATOM 0 HD22 ASN A 27 3.598 -8.527 6.026 1.00 0.00 H new ATOM 413 N VAL A 28 5.964 -7.084 4.736 1.00 0.00 N ATOM 414 CA VAL A 28 6.793 -7.574 3.641 1.00 0.00 C ATOM 415 C VAL A 28 5.936 -8.130 2.509 1.00 0.00 C ATOM 416 O VAL A 28 6.379 -8.206 1.363 1.00 0.00 O ATOM 417 CB VAL A 28 7.765 -8.668 4.120 1.00 0.00 C ATOM 418 CG1 VAL A 28 8.731 -9.047 3.007 1.00 0.00 C ATOM 419 CG2 VAL A 28 8.520 -8.205 5.357 1.00 0.00 C ATOM 0 H VAL A 28 6.164 -7.512 5.640 1.00 0.00 H new ATOM 0 HA VAL A 28 7.367 -6.724 3.273 1.00 0.00 H new ATOM 0 HB VAL A 28 7.187 -9.553 4.385 1.00 0.00 H new ATOM 0 HG11 VAL A 28 9.411 -9.821 3.363 1.00 0.00 H new ATOM 0 HG12 VAL A 28 8.170 -9.422 2.151 1.00 0.00 H new ATOM 0 HG13 VAL A 28 9.305 -8.170 2.709 1.00 0.00 H new ATOM 0 HG21 VAL A 28 9.202 -8.990 5.682 1.00 0.00 H new ATOM 0 HG22 VAL A 28 9.088 -7.305 5.121 1.00 0.00 H new ATOM 0 HG23 VAL A 28 7.811 -7.987 6.156 1.00 0.00 H new ATOM 429 N GLN A 29 4.709 -8.517 2.839 1.00 0.00 N ATOM 430 CA GLN A 29 3.790 -9.066 1.850 1.00 0.00 C ATOM 431 C GLN A 29 3.533 -8.066 0.729 1.00 0.00 C ATOM 432 O GLN A 29 3.307 -8.448 -0.419 1.00 0.00 O ATOM 433 CB GLN A 29 2.467 -9.458 2.512 1.00 0.00 C ATOM 434 CG GLN A 29 1.616 -10.391 1.667 1.00 0.00 C ATOM 435 CD GLN A 29 0.754 -11.315 2.504 1.00 0.00 C ATOM 436 OE1 GLN A 29 1.171 -11.778 3.567 1.00 0.00 O ATOM 437 NE2 GLN A 29 -0.455 -11.588 2.031 1.00 0.00 N ATOM 0 H GLN A 29 4.328 -8.461 3.784 1.00 0.00 H new ATOM 0 HA GLN A 29 4.251 -9.955 1.420 1.00 0.00 H new ATOM 0 HB2 GLN A 29 2.677 -9.938 3.468 1.00 0.00 H new ATOM 0 HB3 GLN A 29 1.896 -8.555 2.727 1.00 0.00 H new ATOM 0 HG2 GLN A 29 0.977 -9.799 1.011 1.00 0.00 H new ATOM 0 HG3 GLN A 29 2.265 -10.988 1.026 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -0.760 -11.183 1.146 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -1.080 -12.203 2.552 1.00 0.00 H new ATOM 446 N ALA A 30 3.571 -6.781 1.069 1.00 0.00 N ATOM 447 CA ALA A 30 3.344 -5.725 0.091 1.00 0.00 C ATOM 448 C ALA A 30 4.438 -5.716 -0.971 1.00 0.00 C ATOM 449 O ALA A 30 4.294 -5.088 -2.019 1.00 0.00 O ATOM 450 CB ALA A 30 3.268 -4.371 0.783 1.00 0.00 C ATOM 0 H ALA A 30 3.757 -6.447 2.015 1.00 0.00 H new ATOM 0 HA ALA A 30 2.393 -5.922 -0.405 1.00 0.00 H new ATOM 0 HB1 ALA A 30 3.098 -3.592 0.040 1.00 0.00 H new ATOM 0 HB2 ALA A 30 2.447 -4.374 1.500 1.00 0.00 H new ATOM 0 HB3 ALA A 30 4.205 -4.176 1.305 1.00 0.00 H new ATOM 456 N MET A 31 5.531 -6.418 -0.694 1.00 0.00 N ATOM 457 CA MET A 31 6.650 -6.492 -1.626 1.00 0.00 C ATOM 458 C MET A 31 6.777 -7.893 -2.214 1.00 0.00 C ATOM 459 O MET A 31 7.792 -8.234 -2.820 1.00 0.00 O ATOM 460 CB MET A 31 7.953 -6.100 -0.926 1.00 0.00 C ATOM 461 CG MET A 31 7.933 -4.694 -0.350 1.00 0.00 C ATOM 462 SD MET A 31 7.669 -4.679 1.435 1.00 0.00 S ATOM 463 CE MET A 31 9.301 -5.126 2.022 1.00 0.00 C ATOM 0 H MET A 31 5.666 -6.944 0.169 1.00 0.00 H new ATOM 0 HA MET A 31 6.458 -5.792 -2.439 1.00 0.00 H new ATOM 0 HB2 MET A 31 8.153 -6.810 -0.123 1.00 0.00 H new ATOM 0 HB3 MET A 31 8.776 -6.182 -1.636 1.00 0.00 H new ATOM 0 HG2 MET A 31 8.877 -4.198 -0.578 1.00 0.00 H new ATOM 0 HG3 MET A 31 7.145 -4.118 -0.835 1.00 0.00 H new ATOM 0 HE1 MET A 31 9.212 -5.865 2.818 1.00 0.00 H new ATOM 0 HE2 MET A 31 9.881 -5.546 1.200 1.00 0.00 H new ATOM 0 HE3 MET A 31 9.805 -4.239 2.405 1.00 0.00 H new ATOM 473 N GLY A 32 5.739 -8.704 -2.030 1.00 0.00 N ATOM 474 CA GLY A 32 5.755 -10.059 -2.547 1.00 0.00 C ATOM 475 C GLY A 32 6.106 -10.114 -4.021 1.00 0.00 C ATOM 476 O GLY A 32 6.663 -11.102 -4.497 1.00 0.00 O ATOM 0 H GLY A 32 4.887 -8.446 -1.532 1.00 0.00 H new ATOM 0 HA2 GLY A 32 6.476 -10.651 -1.983 1.00 0.00 H new ATOM 0 HA3 GLY A 32 4.777 -10.515 -2.392 1.00 0.00 H new ATOM 480 N SER A 33 5.778 -9.049 -4.745 1.00 0.00 N ATOM 481 CA SER A 33 6.056 -8.981 -6.175 1.00 0.00 C ATOM 482 C SER A 33 7.068 -7.881 -6.480 1.00 0.00 C ATOM 483 O SER A 33 7.651 -7.290 -5.572 1.00 0.00 O ATOM 484 CB SER A 33 4.765 -8.733 -6.956 1.00 0.00 C ATOM 485 OG SER A 33 3.798 -9.729 -6.674 1.00 0.00 O ATOM 0 H SER A 33 5.319 -8.221 -4.365 1.00 0.00 H new ATOM 0 HA SER A 33 6.480 -9.937 -6.483 1.00 0.00 H new ATOM 0 HB2 SER A 33 4.365 -7.751 -6.701 1.00 0.00 H new ATOM 0 HB3 SER A 33 4.979 -8.722 -8.025 1.00 0.00 H new ATOM 0 HG SER A 33 2.982 -9.546 -7.185 1.00 0.00 H new ATOM 491 N ASN A 34 7.271 -7.612 -7.765 1.00 0.00 N ATOM 492 CA ASN A 34 8.213 -6.583 -8.191 1.00 0.00 C ATOM 493 C ASN A 34 7.498 -5.257 -8.435 1.00 0.00 C ATOM 494 O ASN A 34 7.986 -4.403 -9.175 1.00 0.00 O ATOM 495 CB ASN A 34 8.942 -7.023 -9.463 1.00 0.00 C ATOM 496 CG ASN A 34 10.068 -7.998 -9.176 1.00 0.00 C ATOM 497 OD1 ASN A 34 10.617 -8.023 -8.075 1.00 0.00 O ATOM 498 ND2 ASN A 34 10.415 -8.808 -10.169 1.00 0.00 N ATOM 0 H ASN A 34 6.796 -8.092 -8.530 1.00 0.00 H new ATOM 0 HA ASN A 34 8.942 -6.441 -7.393 1.00 0.00 H new ATOM 0 HB2 ASN A 34 8.229 -7.486 -10.145 1.00 0.00 H new ATOM 0 HB3 ASN A 34 9.345 -6.146 -9.970 1.00 0.00 H new ATOM 0 HD21 ASN A 34 11.165 -9.486 -10.035 1.00 0.00 H new ATOM 0 HD22 ASN A 34 9.932 -8.752 -11.066 1.00 0.00 H new ATOM 505 N VAL A 35 6.339 -5.092 -7.806 1.00 0.00 N ATOM 506 CA VAL A 35 5.556 -3.871 -7.951 1.00 0.00 C ATOM 507 C VAL A 35 6.365 -2.647 -7.536 1.00 0.00 C ATOM 508 O VAL A 35 6.256 -1.583 -8.144 1.00 0.00 O ATOM 509 CB VAL A 35 4.265 -3.927 -7.115 1.00 0.00 C ATOM 510 CG1 VAL A 35 4.588 -4.188 -5.652 1.00 0.00 C ATOM 511 CG2 VAL A 35 3.471 -2.640 -7.272 1.00 0.00 C ATOM 0 H VAL A 35 5.921 -5.790 -7.190 1.00 0.00 H new ATOM 0 HA VAL A 35 5.292 -3.789 -9.005 1.00 0.00 H new ATOM 0 HB VAL A 35 3.652 -4.751 -7.481 1.00 0.00 H new ATOM 0 HG11 VAL A 35 3.663 -4.224 -5.076 1.00 0.00 H new ATOM 0 HG12 VAL A 35 5.111 -5.140 -5.559 1.00 0.00 H new ATOM 0 HG13 VAL A 35 5.222 -3.387 -5.271 1.00 0.00 H new ATOM 0 HG21 VAL A 35 2.562 -2.698 -6.674 1.00 0.00 H new ATOM 0 HG22 VAL A 35 4.074 -1.797 -6.935 1.00 0.00 H new ATOM 0 HG23 VAL A 35 3.207 -2.501 -8.320 1.00 0.00 H new ATOM 521 N MET A 36 7.177 -2.807 -6.496 1.00 0.00 N ATOM 522 CA MET A 36 8.006 -1.715 -5.999 1.00 0.00 C ATOM 523 C MET A 36 8.981 -1.241 -7.073 1.00 0.00 C ATOM 524 O MET A 36 10.002 -1.881 -7.320 1.00 0.00 O ATOM 525 CB MET A 36 8.776 -2.156 -4.753 1.00 0.00 C ATOM 526 CG MET A 36 8.210 -1.596 -3.459 1.00 0.00 C ATOM 527 SD MET A 36 8.963 -0.025 -2.993 1.00 0.00 S ATOM 528 CE MET A 36 9.090 -0.224 -1.217 1.00 0.00 C ATOM 0 H MET A 36 7.279 -3.682 -5.981 1.00 0.00 H new ATOM 0 HA MET A 36 7.350 -0.885 -5.736 1.00 0.00 H new ATOM 0 HB2 MET A 36 8.773 -3.245 -4.700 1.00 0.00 H new ATOM 0 HB3 MET A 36 9.816 -1.845 -4.850 1.00 0.00 H new ATOM 0 HG2 MET A 36 7.134 -1.461 -3.566 1.00 0.00 H new ATOM 0 HG3 MET A 36 8.362 -2.319 -2.658 1.00 0.00 H new ATOM 0 HE1 MET A 36 8.721 0.675 -0.723 1.00 0.00 H new ATOM 0 HE2 MET A 36 8.494 -1.081 -0.903 1.00 0.00 H new ATOM 0 HE3 MET A 36 10.132 -0.387 -0.943 1.00 0.00 H new ATOM 538 N GLU A 37 8.659 -0.118 -7.704 1.00 0.00 N ATOM 539 CA GLU A 37 9.507 0.439 -8.752 1.00 0.00 C ATOM 540 C GLU A 37 10.118 1.766 -8.309 1.00 0.00 C ATOM 541 O GLU A 37 9.923 2.204 -7.175 1.00 0.00 O ATOM 542 CB GLU A 37 8.703 0.639 -10.038 1.00 0.00 C ATOM 543 CG GLU A 37 8.480 -0.643 -10.822 1.00 0.00 C ATOM 544 CD GLU A 37 7.188 -0.623 -11.617 1.00 0.00 C ATOM 545 OE1 GLU A 37 6.110 -0.751 -11.001 1.00 0.00 O ATOM 546 OE2 GLU A 37 7.257 -0.479 -12.856 1.00 0.00 O ATOM 0 H GLU A 37 7.818 0.425 -7.509 1.00 0.00 H new ATOM 0 HA GLU A 37 10.315 -0.267 -8.944 1.00 0.00 H new ATOM 0 HB2 GLU A 37 7.736 1.075 -9.788 1.00 0.00 H new ATOM 0 HB3 GLU A 37 9.222 1.358 -10.673 1.00 0.00 H new ATOM 0 HG2 GLU A 37 9.318 -0.800 -11.501 1.00 0.00 H new ATOM 0 HG3 GLU A 37 8.466 -1.488 -10.133 1.00 0.00 H new ATOM 553 N ASP A 38 10.858 2.400 -9.212 1.00 0.00 N ATOM 554 CA ASP A 38 11.498 3.677 -8.917 1.00 0.00 C ATOM 555 C ASP A 38 10.476 4.695 -8.420 1.00 0.00 C ATOM 556 O ASP A 38 10.769 5.508 -7.545 1.00 0.00 O ATOM 557 CB ASP A 38 12.211 4.214 -10.158 1.00 0.00 C ATOM 558 CG ASP A 38 11.243 4.750 -11.195 1.00 0.00 C ATOM 559 OD1 ASP A 38 10.589 3.932 -11.874 1.00 0.00 O ATOM 560 OD2 ASP A 38 11.141 5.988 -11.328 1.00 0.00 O ATOM 0 H ASP A 38 11.030 2.050 -10.155 1.00 0.00 H new ATOM 0 HA ASP A 38 12.233 3.513 -8.129 1.00 0.00 H new ATOM 0 HB2 ASP A 38 12.899 5.006 -9.864 1.00 0.00 H new ATOM 0 HB3 ASP A 38 12.811 3.419 -10.601 1.00 0.00 H new ATOM 565 N GLN A 39 9.274 4.644 -8.989 1.00 0.00 N ATOM 566 CA GLN A 39 8.210 5.564 -8.605 1.00 0.00 C ATOM 567 C GLN A 39 8.024 5.581 -7.091 1.00 0.00 C ATOM 568 O GLN A 39 8.167 6.622 -6.450 1.00 0.00 O ATOM 569 CB GLN A 39 6.898 5.171 -9.288 1.00 0.00 C ATOM 570 CG GLN A 39 6.992 5.126 -10.804 1.00 0.00 C ATOM 571 CD GLN A 39 5.866 4.328 -11.434 1.00 0.00 C ATOM 572 OE1 GLN A 39 6.092 3.264 -12.011 1.00 0.00 O ATOM 573 NE2 GLN A 39 4.646 4.840 -11.327 1.00 0.00 N ATOM 0 H GLN A 39 9.014 3.977 -9.715 1.00 0.00 H new ATOM 0 HA GLN A 39 8.495 6.565 -8.928 1.00 0.00 H new ATOM 0 HB2 GLN A 39 6.586 4.193 -8.922 1.00 0.00 H new ATOM 0 HB3 GLN A 39 6.122 5.881 -9.001 1.00 0.00 H new ATOM 0 HG2 GLN A 39 6.975 6.143 -11.196 1.00 0.00 H new ATOM 0 HG3 GLN A 39 7.948 4.689 -11.092 1.00 0.00 H new ATOM 0 HE21 GLN A 39 4.505 5.725 -10.840 1.00 0.00 H new ATOM 0 HE22 GLN A 39 3.849 4.348 -11.732 1.00 0.00 H new ATOM 582 N ASP A 40 7.704 4.421 -6.526 1.00 0.00 N ATOM 583 CA ASP A 40 7.499 4.303 -5.088 1.00 0.00 C ATOM 584 C ASP A 40 8.795 4.577 -4.329 1.00 0.00 C ATOM 585 O ASP A 40 8.794 5.263 -3.307 1.00 0.00 O ATOM 586 CB ASP A 40 6.976 2.909 -4.739 1.00 0.00 C ATOM 587 CG ASP A 40 5.982 2.392 -5.760 1.00 0.00 C ATOM 588 OD1 ASP A 40 5.029 3.130 -6.088 1.00 0.00 O ATOM 589 OD2 ASP A 40 6.157 1.248 -6.232 1.00 0.00 O ATOM 0 H ASP A 40 7.581 3.550 -7.043 1.00 0.00 H new ATOM 0 HA ASP A 40 6.760 5.046 -4.790 1.00 0.00 H new ATOM 0 HB2 ASP A 40 7.815 2.216 -4.669 1.00 0.00 H new ATOM 0 HB3 ASP A 40 6.503 2.937 -3.757 1.00 0.00 H new ATOM 594 N LEU A 41 9.897 4.037 -4.838 1.00 0.00 N ATOM 595 CA LEU A 41 11.199 4.223 -4.208 1.00 0.00 C ATOM 596 C LEU A 41 11.465 5.698 -3.931 1.00 0.00 C ATOM 597 O LEU A 41 12.016 6.057 -2.889 1.00 0.00 O ATOM 598 CB LEU A 41 12.304 3.652 -5.099 1.00 0.00 C ATOM 599 CG LEU A 41 13.674 4.323 -4.983 1.00 0.00 C ATOM 600 CD1 LEU A 41 14.210 4.198 -3.565 1.00 0.00 C ATOM 601 CD2 LEU A 41 14.651 3.717 -5.979 1.00 0.00 C ATOM 0 H LEU A 41 9.915 3.468 -5.684 1.00 0.00 H new ATOM 0 HA LEU A 41 11.195 3.690 -3.257 1.00 0.00 H new ATOM 0 HB2 LEU A 41 12.419 2.593 -4.867 1.00 0.00 H new ATOM 0 HB3 LEU A 41 11.976 3.717 -6.137 1.00 0.00 H new ATOM 0 HG LEU A 41 13.560 5.382 -5.215 1.00 0.00 H new ATOM 0 HD11 LEU A 41 15.185 4.681 -3.501 1.00 0.00 H new ATOM 0 HD12 LEU A 41 13.520 4.679 -2.872 1.00 0.00 H new ATOM 0 HD13 LEU A 41 14.309 3.144 -3.305 1.00 0.00 H new ATOM 0 HD21 LEU A 41 15.620 4.207 -5.882 1.00 0.00 H new ATOM 0 HD22 LEU A 41 14.761 2.651 -5.778 1.00 0.00 H new ATOM 0 HD23 LEU A 41 14.273 3.858 -6.992 1.00 0.00 H new ATOM 613 N LEU A 42 11.068 6.552 -4.868 1.00 0.00 N ATOM 614 CA LEU A 42 11.259 7.991 -4.724 1.00 0.00 C ATOM 615 C LEU A 42 10.088 8.626 -3.983 1.00 0.00 C ATOM 616 O LEU A 42 10.243 9.648 -3.317 1.00 0.00 O ATOM 617 CB LEU A 42 11.423 8.643 -6.098 1.00 0.00 C ATOM 618 CG LEU A 42 12.386 9.828 -6.167 1.00 0.00 C ATOM 619 CD1 LEU A 42 11.890 10.972 -5.296 1.00 0.00 C ATOM 620 CD2 LEU A 42 13.786 9.405 -5.748 1.00 0.00 C ATOM 0 H LEU A 42 10.611 6.273 -5.736 1.00 0.00 H new ATOM 0 HA LEU A 42 12.165 8.155 -4.140 1.00 0.00 H new ATOM 0 HB2 LEU A 42 11.763 7.882 -6.801 1.00 0.00 H new ATOM 0 HB3 LEU A 42 10.443 8.976 -6.439 1.00 0.00 H new ATOM 0 HG LEU A 42 12.427 10.176 -7.199 1.00 0.00 H new ATOM 0 HD11 LEU A 42 12.589 11.806 -5.358 1.00 0.00 H new ATOM 0 HD12 LEU A 42 10.908 11.294 -5.643 1.00 0.00 H new ATOM 0 HD13 LEU A 42 11.817 10.636 -4.262 1.00 0.00 H new ATOM 0 HD21 LEU A 42 14.457 10.262 -5.804 1.00 0.00 H new ATOM 0 HD22 LEU A 42 13.762 9.029 -4.725 1.00 0.00 H new ATOM 0 HD23 LEU A 42 14.144 8.620 -6.415 1.00 0.00 H new ATOM 632 N GLU A 43 8.915 8.010 -4.102 1.00 0.00 N ATOM 633 CA GLU A 43 7.717 8.516 -3.442 1.00 0.00 C ATOM 634 C GLU A 43 7.779 8.264 -1.938 1.00 0.00 C ATOM 635 O GLU A 43 7.051 8.888 -1.164 1.00 0.00 O ATOM 636 CB GLU A 43 6.468 7.857 -4.030 1.00 0.00 C ATOM 637 CG GLU A 43 5.227 8.730 -3.956 1.00 0.00 C ATOM 638 CD GLU A 43 4.019 7.984 -3.424 1.00 0.00 C ATOM 639 OE1 GLU A 43 3.470 7.140 -4.163 1.00 0.00 O ATOM 640 OE2 GLU A 43 3.622 8.245 -2.270 1.00 0.00 O ATOM 0 H GLU A 43 8.769 7.161 -4.649 1.00 0.00 H new ATOM 0 HA GLU A 43 7.665 9.592 -3.611 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.659 7.600 -5.072 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.277 6.923 -3.501 1.00 0.00 H new ATOM 0 HG2 GLU A 43 5.429 9.589 -3.316 1.00 0.00 H new ATOM 0 HG3 GLU A 43 5.001 9.118 -4.949 1.00 0.00 H new ATOM 647 N ILE A 44 8.651 7.348 -1.532 1.00 0.00 N ATOM 648 CA ILE A 44 8.807 7.015 -0.122 1.00 0.00 C ATOM 649 C ILE A 44 9.550 8.119 0.625 1.00 0.00 C ATOM 650 O ILE A 44 9.105 8.580 1.675 1.00 0.00 O ATOM 651 CB ILE A 44 9.564 5.687 0.063 1.00 0.00 C ATOM 652 CG1 ILE A 44 8.729 4.521 -0.469 1.00 0.00 C ATOM 653 CG2 ILE A 44 9.910 5.474 1.529 1.00 0.00 C ATOM 654 CD1 ILE A 44 9.553 3.445 -1.141 1.00 0.00 C ATOM 0 H ILE A 44 9.260 6.823 -2.159 1.00 0.00 H new ATOM 0 HA ILE A 44 7.803 6.912 0.290 1.00 0.00 H new ATOM 0 HB ILE A 44 10.493 5.733 -0.505 1.00 0.00 H new ATOM 0 HG12 ILE A 44 8.171 4.078 0.356 1.00 0.00 H new ATOM 0 HG13 ILE A 44 7.997 4.904 -1.180 1.00 0.00 H new ATOM 0 HG21 ILE A 44 10.445 4.531 1.643 1.00 0.00 H new ATOM 0 HG22 ILE A 44 10.540 6.293 1.877 1.00 0.00 H new ATOM 0 HG23 ILE A 44 8.994 5.445 2.119 1.00 0.00 H new ATOM 0 HD11 ILE A 44 8.896 2.650 -1.494 1.00 0.00 H new ATOM 0 HD12 ILE A 44 10.090 3.873 -1.987 1.00 0.00 H new ATOM 0 HD13 ILE A 44 10.268 3.035 -0.427 1.00 0.00 H new ATOM 666 N GLY A 45 10.684 8.539 0.073 1.00 0.00 N ATOM 667 CA GLY A 45 11.470 9.587 0.698 1.00 0.00 C ATOM 668 C GLY A 45 12.956 9.423 0.449 1.00 0.00 C ATOM 669 O GLY A 45 13.738 10.345 0.691 1.00 0.00 O ATOM 0 H GLY A 45 11.073 8.172 -0.796 1.00 0.00 H new ATOM 0 HA2 GLY A 45 11.146 10.556 0.318 1.00 0.00 H new ATOM 0 HA3 GLY A 45 11.282 9.587 1.772 1.00 0.00 H new ATOM 673 N ILE A 46 13.349 8.248 -0.030 1.00 0.00 N ATOM 674 CA ILE A 46 14.751 7.967 -0.309 1.00 0.00 C ATOM 675 C ILE A 46 15.359 9.040 -1.206 1.00 0.00 C ATOM 676 O ILE A 46 15.131 9.055 -2.417 1.00 0.00 O ATOM 677 CB ILE A 46 14.926 6.592 -0.982 1.00 0.00 C ATOM 678 CG1 ILE A 46 14.156 5.520 -0.209 1.00 0.00 C ATOM 679 CG2 ILE A 46 16.402 6.230 -1.070 1.00 0.00 C ATOM 680 CD1 ILE A 46 14.455 5.510 1.273 1.00 0.00 C ATOM 0 H ILE A 46 12.715 7.475 -0.233 1.00 0.00 H new ATOM 0 HA ILE A 46 15.269 7.962 0.650 1.00 0.00 H new ATOM 0 HB ILE A 46 14.523 6.645 -1.993 1.00 0.00 H new ATOM 0 HG12 ILE A 46 13.087 5.676 -0.354 1.00 0.00 H new ATOM 0 HG13 ILE A 46 14.395 4.542 -0.626 1.00 0.00 H new ATOM 0 HG21 ILE A 46 16.510 5.256 -1.548 1.00 0.00 H new ATOM 0 HG22 ILE A 46 16.927 6.983 -1.658 1.00 0.00 H new ATOM 0 HG23 ILE A 46 16.828 6.191 -0.067 1.00 0.00 H new ATOM 0 HD11 ILE A 46 13.874 4.725 1.756 1.00 0.00 H new ATOM 0 HD12 ILE A 46 15.517 5.323 1.429 1.00 0.00 H new ATOM 0 HD13 ILE A 46 14.190 6.475 1.704 1.00 0.00 H new ATOM 692 N LEU A 47 16.135 9.935 -0.606 1.00 0.00 N ATOM 693 CA LEU A 47 16.778 11.013 -1.350 1.00 0.00 C ATOM 694 C LEU A 47 18.266 10.733 -1.535 1.00 0.00 C ATOM 695 O LEU A 47 18.803 10.883 -2.632 1.00 0.00 O ATOM 696 CB LEU A 47 16.584 12.346 -0.625 1.00 0.00 C ATOM 697 CG LEU A 47 17.115 13.585 -1.348 1.00 0.00 C ATOM 698 CD1 LEU A 47 16.179 13.985 -2.478 1.00 0.00 C ATOM 699 CD2 LEU A 47 17.294 14.737 -0.369 1.00 0.00 C ATOM 0 H LEU A 47 16.335 9.936 0.394 1.00 0.00 H new ATOM 0 HA LEU A 47 16.313 11.071 -2.334 1.00 0.00 H new ATOM 0 HB2 LEU A 47 15.519 12.485 -0.441 1.00 0.00 H new ATOM 0 HB3 LEU A 47 17.070 12.282 0.349 1.00 0.00 H new ATOM 0 HG LEU A 47 18.088 13.344 -1.777 1.00 0.00 H new ATOM 0 HD11 LEU A 47 16.573 14.868 -2.981 1.00 0.00 H new ATOM 0 HD12 LEU A 47 16.100 13.165 -3.192 1.00 0.00 H new ATOM 0 HD13 LEU A 47 15.193 14.208 -2.072 1.00 0.00 H new ATOM 0 HD21 LEU A 47 17.672 15.610 -0.900 1.00 0.00 H new ATOM 0 HD22 LEU A 47 16.334 14.978 0.089 1.00 0.00 H new ATOM 0 HD23 LEU A 47 18.003 14.448 0.407 1.00 0.00 H new ATOM 711 N ASN A 48 18.925 10.323 -0.457 1.00 0.00 N ATOM 712 CA ASN A 48 20.351 10.020 -0.501 1.00 0.00 C ATOM 713 C ASN A 48 20.656 8.997 -1.591 1.00 0.00 C ATOM 714 O ASN A 48 20.003 7.958 -1.681 1.00 0.00 O ATOM 715 CB ASN A 48 20.825 9.495 0.855 1.00 0.00 C ATOM 716 CG ASN A 48 20.420 8.051 1.088 1.00 0.00 C ATOM 717 OD1 ASN A 48 19.239 7.708 1.033 1.00 0.00 O ATOM 718 ND2 ASN A 48 21.403 7.197 1.351 1.00 0.00 N ATOM 0 H ASN A 48 18.494 10.193 0.458 1.00 0.00 H new ATOM 0 HA ASN A 48 20.886 10.941 -0.732 1.00 0.00 H new ATOM 0 HB2 ASN A 48 21.910 9.580 0.916 1.00 0.00 H new ATOM 0 HB3 ASN A 48 20.412 10.118 1.648 1.00 0.00 H new ATOM 0 HD21 ASN A 48 21.193 6.213 1.517 1.00 0.00 H new ATOM 0 HD22 ASN A 48 22.368 7.525 1.387 1.00 0.00 H new ATOM 725 N SER A 49 21.653 9.299 -2.416 1.00 0.00 N ATOM 726 CA SER A 49 22.044 8.408 -3.503 1.00 0.00 C ATOM 727 C SER A 49 22.854 7.229 -2.972 1.00 0.00 C ATOM 728 O SER A 49 23.880 7.410 -2.318 1.00 0.00 O ATOM 729 CB SER A 49 22.856 9.171 -4.550 1.00 0.00 C ATOM 730 OG SER A 49 23.057 8.384 -5.712 1.00 0.00 O ATOM 0 H SER A 49 22.205 10.154 -2.353 1.00 0.00 H new ATOM 0 HA SER A 49 21.137 8.023 -3.969 1.00 0.00 H new ATOM 0 HB2 SER A 49 22.338 10.092 -4.816 1.00 0.00 H new ATOM 0 HB3 SER A 49 23.820 9.457 -4.130 1.00 0.00 H new ATOM 0 HG SER A 49 23.577 8.895 -6.367 1.00 0.00 H new ATOM 736 N GLY A 50 22.386 6.019 -3.262 1.00 0.00 N ATOM 737 CA GLY A 50 23.078 4.827 -2.807 1.00 0.00 C ATOM 738 C GLY A 50 22.129 3.773 -2.273 1.00 0.00 C ATOM 739 O GLY A 50 22.185 2.612 -2.683 1.00 0.00 O ATOM 0 H GLY A 50 21.540 5.843 -3.804 1.00 0.00 H new ATOM 0 HA2 GLY A 50 23.654 4.408 -3.632 1.00 0.00 H new ATOM 0 HA3 GLY A 50 23.789 5.099 -2.027 1.00 0.00 H new ATOM 743 N HIS A 51 21.256 4.176 -1.355 1.00 0.00 N ATOM 744 CA HIS A 51 20.291 3.256 -0.763 1.00 0.00 C ATOM 745 C HIS A 51 19.161 2.948 -1.742 1.00 0.00 C ATOM 746 O HIS A 51 18.709 1.809 -1.844 1.00 0.00 O ATOM 747 CB HIS A 51 19.718 3.846 0.525 1.00 0.00 C ATOM 748 CG HIS A 51 19.424 2.819 1.576 1.00 0.00 C ATOM 749 ND1 HIS A 51 20.364 2.384 2.486 1.00 0.00 N ATOM 750 CD2 HIS A 51 18.287 2.141 1.858 1.00 0.00 C ATOM 751 CE1 HIS A 51 19.819 1.482 3.282 1.00 0.00 C ATOM 752 NE2 HIS A 51 18.559 1.316 2.923 1.00 0.00 N ATOM 0 H HIS A 51 21.197 5.132 -1.005 1.00 0.00 H new ATOM 0 HA HIS A 51 20.809 2.326 -0.530 1.00 0.00 H new ATOM 0 HB2 HIS A 51 20.423 4.573 0.927 1.00 0.00 H new ATOM 0 HB3 HIS A 51 18.801 4.387 0.291 1.00 0.00 H new ATOM 0 HD2 HIS A 51 17.342 2.231 1.342 1.00 0.00 H new ATOM 0 HE1 HIS A 51 20.319 0.968 4.089 1.00 0.00 H new ATOM 0 HE2 HIS A 51 17.896 0.679 3.364 1.00 0.00 H new ATOM 760 N ARG A 52 18.711 3.973 -2.459 1.00 0.00 N ATOM 761 CA ARG A 52 17.634 3.813 -3.428 1.00 0.00 C ATOM 762 C ARG A 52 17.934 2.666 -4.389 1.00 0.00 C ATOM 763 O ARG A 52 17.070 1.832 -4.661 1.00 0.00 O ATOM 764 CB ARG A 52 17.429 5.110 -4.213 1.00 0.00 C ATOM 765 CG ARG A 52 18.704 5.657 -4.832 1.00 0.00 C ATOM 766 CD ARG A 52 18.804 5.302 -6.308 1.00 0.00 C ATOM 767 NE ARG A 52 18.206 6.328 -7.157 1.00 0.00 N ATOM 768 CZ ARG A 52 18.101 6.218 -8.477 1.00 0.00 C ATOM 769 NH1 ARG A 52 18.552 5.135 -9.094 1.00 0.00 N ATOM 770 NH2 ARG A 52 17.544 7.195 -9.183 1.00 0.00 N ATOM 0 H ARG A 52 19.076 4.923 -2.387 1.00 0.00 H new ATOM 0 HA ARG A 52 16.720 3.578 -2.883 1.00 0.00 H new ATOM 0 HB2 ARG A 52 16.698 4.935 -5.003 1.00 0.00 H new ATOM 0 HB3 ARG A 52 17.006 5.863 -3.549 1.00 0.00 H new ATOM 0 HG2 ARG A 52 18.731 6.740 -4.715 1.00 0.00 H new ATOM 0 HG3 ARG A 52 19.568 5.257 -4.301 1.00 0.00 H new ATOM 0 HD2 ARG A 52 19.851 5.171 -6.580 1.00 0.00 H new ATOM 0 HD3 ARG A 52 18.307 4.348 -6.486 1.00 0.00 H new ATOM 0 HE ARG A 52 17.850 7.174 -6.713 1.00 0.00 H new ATOM 0 HH11 ARG A 52 18.981 4.383 -8.555 1.00 0.00 H new ATOM 0 HH12 ARG A 52 18.470 5.054 -10.107 1.00 0.00 H new ATOM 0 HH21 ARG A 52 17.197 8.030 -8.712 1.00 0.00 H new ATOM 0 HH22 ARG A 52 17.464 7.110 -10.196 1.00 0.00 H new ATOM 784 N GLN A 53 19.160 2.634 -4.898 1.00 0.00 N ATOM 785 CA GLN A 53 19.572 1.590 -5.830 1.00 0.00 C ATOM 786 C GLN A 53 19.546 0.220 -5.159 1.00 0.00 C ATOM 787 O GLN A 53 19.205 -0.782 -5.787 1.00 0.00 O ATOM 788 CB GLN A 53 20.974 1.881 -6.368 1.00 0.00 C ATOM 789 CG GLN A 53 21.446 0.881 -7.411 1.00 0.00 C ATOM 790 CD GLN A 53 21.039 1.271 -8.819 1.00 0.00 C ATOM 791 OE1 GLN A 53 20.277 0.562 -9.477 1.00 0.00 O ATOM 792 NE2 GLN A 53 21.548 2.404 -9.290 1.00 0.00 N ATOM 0 H GLN A 53 19.885 3.318 -4.682 1.00 0.00 H new ATOM 0 HA GLN A 53 18.867 1.581 -6.661 1.00 0.00 H new ATOM 0 HB2 GLN A 53 20.987 2.880 -6.803 1.00 0.00 H new ATOM 0 HB3 GLN A 53 21.679 1.886 -5.537 1.00 0.00 H new ATOM 0 HG2 GLN A 53 22.531 0.795 -7.361 1.00 0.00 H new ATOM 0 HG3 GLN A 53 21.037 -0.102 -7.178 1.00 0.00 H new ATOM 0 HE21 GLN A 53 22.176 2.961 -8.710 1.00 0.00 H new ATOM 0 HE22 GLN A 53 21.311 2.717 -10.231 1.00 0.00 H new ATOM 801 N ARG A 54 19.909 0.186 -3.882 1.00 0.00 N ATOM 802 CA ARG A 54 19.929 -1.061 -3.127 1.00 0.00 C ATOM 803 C ARG A 54 18.526 -1.652 -3.016 1.00 0.00 C ATOM 804 O ARG A 54 18.311 -2.827 -3.315 1.00 0.00 O ATOM 805 CB ARG A 54 20.506 -0.827 -1.729 1.00 0.00 C ATOM 806 CG ARG A 54 21.981 -0.459 -1.735 1.00 0.00 C ATOM 807 CD ARG A 54 22.440 0.023 -0.367 1.00 0.00 C ATOM 808 NE ARG A 54 22.916 -1.076 0.469 1.00 0.00 N ATOM 809 CZ ARG A 54 23.608 -0.901 1.590 1.00 0.00 C ATOM 810 NH1 ARG A 54 23.902 0.322 2.006 1.00 0.00 N ATOM 811 NH2 ARG A 54 24.005 -1.952 2.296 1.00 0.00 N ATOM 0 H ARG A 54 20.193 1.007 -3.348 1.00 0.00 H new ATOM 0 HA ARG A 54 20.563 -1.769 -3.661 1.00 0.00 H new ATOM 0 HB2 ARG A 54 19.943 -0.031 -1.241 1.00 0.00 H new ATOM 0 HB3 ARG A 54 20.367 -1.728 -1.132 1.00 0.00 H new ATOM 0 HG2 ARG A 54 22.572 -1.325 -2.034 1.00 0.00 H new ATOM 0 HG3 ARG A 54 22.160 0.321 -2.476 1.00 0.00 H new ATOM 0 HD2 ARG A 54 23.237 0.757 -0.490 1.00 0.00 H new ATOM 0 HD3 ARG A 54 21.615 0.529 0.135 1.00 0.00 H new ATOM 0 HE ARG A 54 22.706 -2.030 0.176 1.00 0.00 H new ATOM 0 HH11 ARG A 54 23.597 1.132 1.466 1.00 0.00 H new ATOM 0 HH12 ARG A 54 24.433 0.454 2.867 1.00 0.00 H new ATOM 0 HH21 ARG A 54 23.779 -2.895 1.978 1.00 0.00 H new ATOM 0 HH22 ARG A 54 24.536 -1.817 3.156 1.00 0.00 H new ATOM 825 N ILE A 55 17.576 -0.830 -2.583 1.00 0.00 N ATOM 826 CA ILE A 55 16.195 -1.271 -2.433 1.00 0.00 C ATOM 827 C ILE A 55 15.589 -1.649 -3.780 1.00 0.00 C ATOM 828 O ILE A 55 15.030 -2.734 -3.940 1.00 0.00 O ATOM 829 CB ILE A 55 15.324 -0.183 -1.778 1.00 0.00 C ATOM 830 CG1 ILE A 55 15.832 0.128 -0.368 1.00 0.00 C ATOM 831 CG2 ILE A 55 13.868 -0.622 -1.738 1.00 0.00 C ATOM 832 CD1 ILE A 55 15.006 1.169 0.356 1.00 0.00 C ATOM 0 H ILE A 55 17.737 0.145 -2.330 1.00 0.00 H new ATOM 0 HA ILE A 55 16.213 -2.148 -1.786 1.00 0.00 H new ATOM 0 HB ILE A 55 15.392 0.725 -2.377 1.00 0.00 H new ATOM 0 HG12 ILE A 55 15.838 -0.791 0.218 1.00 0.00 H new ATOM 0 HG13 ILE A 55 16.864 0.474 -0.430 1.00 0.00 H new ATOM 0 HG21 ILE A 55 13.266 0.158 -1.272 1.00 0.00 H new ATOM 0 HG22 ILE A 55 13.513 -0.797 -2.753 1.00 0.00 H new ATOM 0 HG23 ILE A 55 13.781 -1.542 -1.160 1.00 0.00 H new ATOM 0 HD11 ILE A 55 15.424 1.339 1.348 1.00 0.00 H new ATOM 0 HD12 ILE A 55 15.020 2.101 -0.208 1.00 0.00 H new ATOM 0 HD13 ILE A 55 13.979 0.817 0.450 1.00 0.00 H new ATOM 844 N LEU A 56 15.706 -0.746 -4.748 1.00 0.00 N ATOM 845 CA LEU A 56 15.171 -0.985 -6.084 1.00 0.00 C ATOM 846 C LEU A 56 15.668 -2.315 -6.640 1.00 0.00 C ATOM 847 O LEU A 56 14.876 -3.152 -7.071 1.00 0.00 O ATOM 848 CB LEU A 56 15.570 0.154 -7.025 1.00 0.00 C ATOM 849 CG LEU A 56 14.485 0.642 -7.986 1.00 0.00 C ATOM 850 CD1 LEU A 56 15.041 1.699 -8.927 1.00 0.00 C ATOM 851 CD2 LEU A 56 13.905 -0.524 -8.772 1.00 0.00 C ATOM 0 H LEU A 56 16.166 0.157 -4.633 1.00 0.00 H new ATOM 0 HA LEU A 56 14.084 -1.026 -6.011 1.00 0.00 H new ATOM 0 HB2 LEU A 56 15.899 0.999 -6.421 1.00 0.00 H new ATOM 0 HB3 LEU A 56 16.429 -0.171 -7.613 1.00 0.00 H new ATOM 0 HG LEU A 56 13.684 1.093 -7.400 1.00 0.00 H new ATOM 0 HD11 LEU A 56 14.255 2.034 -9.603 1.00 0.00 H new ATOM 0 HD12 LEU A 56 15.406 2.546 -8.347 1.00 0.00 H new ATOM 0 HD13 LEU A 56 15.861 1.275 -9.506 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.135 -0.158 -9.451 1.00 0.00 H new ATOM 0 HD22 LEU A 56 14.696 -1.005 -9.347 1.00 0.00 H new ATOM 0 HD23 LEU A 56 13.468 -1.246 -8.082 1.00 0.00 H new ATOM 863 N GLN A 57 16.983 -2.504 -6.624 1.00 0.00 N ATOM 864 CA GLN A 57 17.584 -3.734 -7.125 1.00 0.00 C ATOM 865 C GLN A 57 17.161 -4.930 -6.279 1.00 0.00 C ATOM 866 O GLN A 57 16.687 -5.937 -6.804 1.00 0.00 O ATOM 867 CB GLN A 57 19.109 -3.614 -7.134 1.00 0.00 C ATOM 868 CG GLN A 57 19.807 -4.784 -7.809 1.00 0.00 C ATOM 869 CD GLN A 57 21.295 -4.825 -7.514 1.00 0.00 C ATOM 870 OE1 GLN A 57 21.737 -4.417 -6.440 1.00 0.00 O ATOM 871 NE2 GLN A 57 22.073 -5.321 -8.469 1.00 0.00 N ATOM 0 H GLN A 57 17.653 -1.821 -6.270 1.00 0.00 H new ATOM 0 HA GLN A 57 17.233 -3.891 -8.145 1.00 0.00 H new ATOM 0 HB2 GLN A 57 19.390 -2.692 -7.643 1.00 0.00 H new ATOM 0 HB3 GLN A 57 19.465 -3.533 -6.107 1.00 0.00 H new ATOM 0 HG2 GLN A 57 19.349 -5.716 -7.478 1.00 0.00 H new ATOM 0 HG3 GLN A 57 19.656 -4.720 -8.887 1.00 0.00 H new ATOM 0 HE21 GLN A 57 21.662 -5.647 -9.344 1.00 0.00 H new ATOM 0 HE22 GLN A 57 23.082 -5.376 -8.328 1.00 0.00 H new ATOM 880 N ALA A 58 17.337 -4.813 -4.967 1.00 0.00 N ATOM 881 CA ALA A 58 16.971 -5.884 -4.048 1.00 0.00 C ATOM 882 C ALA A 58 15.543 -6.356 -4.296 1.00 0.00 C ATOM 883 O ALA A 58 15.304 -7.540 -4.538 1.00 0.00 O ATOM 884 CB ALA A 58 17.135 -5.423 -2.608 1.00 0.00 C ATOM 0 H ALA A 58 17.731 -3.987 -4.516 1.00 0.00 H new ATOM 0 HA ALA A 58 17.640 -6.726 -4.226 1.00 0.00 H new ATOM 0 HB1 ALA A 58 16.858 -6.233 -1.933 1.00 0.00 H new ATOM 0 HB2 ALA A 58 18.173 -5.143 -2.432 1.00 0.00 H new ATOM 0 HB3 ALA A 58 16.491 -4.563 -2.426 1.00 0.00 H new ATOM 890 N ILE A 59 14.597 -5.425 -4.234 1.00 0.00 N ATOM 891 CA ILE A 59 13.193 -5.747 -4.452 1.00 0.00 C ATOM 892 C ILE A 59 12.948 -6.195 -5.888 1.00 0.00 C ATOM 893 O ILE A 59 12.051 -6.993 -6.155 1.00 0.00 O ATOM 894 CB ILE A 59 12.285 -4.543 -4.140 1.00 0.00 C ATOM 895 CG1 ILE A 59 10.842 -5.006 -3.927 1.00 0.00 C ATOM 896 CG2 ILE A 59 12.357 -3.519 -5.264 1.00 0.00 C ATOM 897 CD1 ILE A 59 10.143 -4.298 -2.787 1.00 0.00 C ATOM 0 H ILE A 59 14.778 -4.441 -4.034 1.00 0.00 H new ATOM 0 HA ILE A 59 12.947 -6.563 -3.773 1.00 0.00 H new ATOM 0 HB ILE A 59 12.635 -4.072 -3.222 1.00 0.00 H new ATOM 0 HG12 ILE A 59 10.278 -4.844 -4.845 1.00 0.00 H new ATOM 0 HG13 ILE A 59 10.838 -6.079 -3.735 1.00 0.00 H new ATOM 0 HG21 ILE A 59 11.710 -2.674 -5.029 1.00 0.00 H new ATOM 0 HG22 ILE A 59 13.384 -3.170 -5.373 1.00 0.00 H new ATOM 0 HG23 ILE A 59 12.029 -3.979 -6.196 1.00 0.00 H new ATOM 0 HD11 ILE A 59 9.125 -4.676 -2.694 1.00 0.00 H new ATOM 0 HD12 ILE A 59 10.684 -4.481 -1.859 1.00 0.00 H new ATOM 0 HD13 ILE A 59 10.116 -3.227 -2.986 1.00 0.00 H new ATOM 909 N GLN A 60 13.755 -5.678 -6.810 1.00 0.00 N ATOM 910 CA GLN A 60 13.626 -6.026 -8.220 1.00 0.00 C ATOM 911 C GLN A 60 13.865 -7.518 -8.436 1.00 0.00 C ATOM 912 O GLN A 60 13.139 -8.171 -9.186 1.00 0.00 O ATOM 913 CB GLN A 60 14.612 -5.212 -9.060 1.00 0.00 C ATOM 914 CG GLN A 60 13.996 -3.974 -9.691 1.00 0.00 C ATOM 915 CD GLN A 60 13.041 -4.309 -10.821 1.00 0.00 C ATOM 916 OE1 GLN A 60 12.487 -5.406 -10.876 1.00 0.00 O ATOM 917 NE2 GLN A 60 12.844 -3.360 -11.730 1.00 0.00 N ATOM 0 H GLN A 60 14.505 -5.017 -6.605 1.00 0.00 H new ATOM 0 HA GLN A 60 12.610 -5.790 -8.536 1.00 0.00 H new ATOM 0 HB2 GLN A 60 15.450 -4.911 -8.431 1.00 0.00 H new ATOM 0 HB3 GLN A 60 15.017 -5.848 -9.847 1.00 0.00 H new ATOM 0 HG2 GLN A 60 13.464 -3.408 -8.927 1.00 0.00 H new ATOM 0 HG3 GLN A 60 14.790 -3.331 -10.070 1.00 0.00 H new ATOM 0 HE21 GLN A 60 13.325 -2.464 -11.645 1.00 0.00 H new ATOM 0 HE22 GLN A 60 12.212 -3.527 -12.513 1.00 0.00 H new ATOM 926 N LEU A 61 14.888 -8.049 -7.775 1.00 0.00 N ATOM 927 CA LEU A 61 15.223 -9.464 -7.895 1.00 0.00 C ATOM 928 C LEU A 61 14.545 -10.279 -6.799 1.00 0.00 C ATOM 929 O LEU A 61 13.689 -11.120 -7.075 1.00 0.00 O ATOM 930 CB LEU A 61 16.739 -9.656 -7.826 1.00 0.00 C ATOM 931 CG LEU A 61 17.302 -10.839 -8.615 1.00 0.00 C ATOM 932 CD1 LEU A 61 16.570 -12.121 -8.250 1.00 0.00 C ATOM 933 CD2 LEU A 61 17.206 -10.577 -10.111 1.00 0.00 C ATOM 0 H LEU A 61 15.499 -7.522 -7.151 1.00 0.00 H new ATOM 0 HA LEU A 61 14.861 -9.818 -8.861 1.00 0.00 H new ATOM 0 HB2 LEU A 61 17.217 -8.745 -8.185 1.00 0.00 H new ATOM 0 HB3 LEU A 61 17.023 -9.774 -6.780 1.00 0.00 H new ATOM 0 HG LEU A 61 18.353 -10.957 -8.353 1.00 0.00 H new ATOM 0 HD11 LEU A 61 16.984 -12.952 -8.821 1.00 0.00 H new ATOM 0 HD12 LEU A 61 16.690 -12.318 -7.185 1.00 0.00 H new ATOM 0 HD13 LEU A 61 15.510 -12.014 -8.482 1.00 0.00 H new ATOM 0 HD21 LEU A 61 17.611 -11.429 -10.656 1.00 0.00 H new ATOM 0 HD22 LEU A 61 16.162 -10.432 -10.389 1.00 0.00 H new ATOM 0 HD23 LEU A 61 17.776 -9.682 -10.361 1.00 0.00 H new ATOM 945 N LEU A 62 14.932 -10.024 -5.554 1.00 0.00 N ATOM 946 CA LEU A 62 14.360 -10.732 -4.414 1.00 0.00 C ATOM 947 C LEU A 62 14.292 -12.232 -4.684 1.00 0.00 C ATOM 948 O LEU A 62 13.233 -12.787 -4.979 1.00 0.00 O ATOM 949 CB LEU A 62 12.963 -10.194 -4.104 1.00 0.00 C ATOM 950 CG LEU A 62 12.870 -9.185 -2.959 1.00 0.00 C ATOM 951 CD1 LEU A 62 11.453 -8.651 -2.830 1.00 0.00 C ATOM 952 CD2 LEU A 62 13.325 -9.818 -1.651 1.00 0.00 C ATOM 0 H LEU A 62 15.640 -9.332 -5.308 1.00 0.00 H new ATOM 0 HA LEU A 62 15.006 -10.566 -3.552 1.00 0.00 H new ATOM 0 HB2 LEU A 62 12.567 -9.727 -5.006 1.00 0.00 H new ATOM 0 HB3 LEU A 62 12.314 -11.038 -3.871 1.00 0.00 H new ATOM 0 HG LEU A 62 13.532 -8.348 -3.184 1.00 0.00 H new ATOM 0 HD11 LEU A 62 11.407 -7.935 -2.010 1.00 0.00 H new ATOM 0 HD12 LEU A 62 11.164 -8.159 -3.758 1.00 0.00 H new ATOM 0 HD13 LEU A 62 10.770 -9.476 -2.629 1.00 0.00 H new ATOM 0 HD21 LEU A 62 13.252 -9.085 -0.847 1.00 0.00 H new ATOM 0 HD22 LEU A 62 12.690 -10.674 -1.421 1.00 0.00 H new ATOM 0 HD23 LEU A 62 14.359 -10.149 -1.747 1.00 0.00 H new ATOM 964 N PRO A 63 15.447 -12.906 -4.577 1.00 0.00 N ATOM 965 CA PRO A 63 15.543 -14.350 -4.803 1.00 0.00 C ATOM 966 C PRO A 63 14.860 -15.157 -3.704 1.00 0.00 C ATOM 967 O PRO A 63 15.470 -15.480 -2.685 1.00 0.00 O ATOM 968 CB PRO A 63 17.052 -14.610 -4.796 1.00 0.00 C ATOM 969 CG PRO A 63 17.623 -13.504 -3.977 1.00 0.00 C ATOM 970 CD PRO A 63 16.747 -12.308 -4.228 1.00 0.00 C ATOM 0 HA PRO A 63 15.048 -14.651 -5.726 1.00 0.00 H new ATOM 0 HB2 PRO A 63 17.284 -15.583 -4.364 1.00 0.00 H new ATOM 0 HB3 PRO A 63 17.459 -14.605 -5.807 1.00 0.00 H new ATOM 0 HG2 PRO A 63 17.632 -13.766 -2.919 1.00 0.00 H new ATOM 0 HG3 PRO A 63 18.655 -13.299 -4.263 1.00 0.00 H new ATOM 0 HD2 PRO A 63 16.673 -11.672 -3.346 1.00 0.00 H new ATOM 0 HD3 PRO A 63 17.135 -11.688 -5.037 1.00 0.00 H new ATOM 978 N LYS A 64 13.588 -15.478 -3.918 1.00 0.00 N ATOM 979 CA LYS A 64 12.820 -16.248 -2.947 1.00 0.00 C ATOM 980 C LYS A 64 11.894 -17.238 -3.646 1.00 0.00 C ATOM 981 O LYS A 64 11.347 -16.945 -4.709 1.00 0.00 O ATOM 982 CB LYS A 64 12.002 -15.311 -2.055 1.00 0.00 C ATOM 983 CG LYS A 64 12.797 -14.712 -0.909 1.00 0.00 C ATOM 984 CD LYS A 64 13.083 -15.742 0.170 1.00 0.00 C ATOM 985 CE LYS A 64 11.906 -15.895 1.121 1.00 0.00 C ATOM 986 NZ LYS A 64 11.678 -14.662 1.925 1.00 0.00 N ATOM 0 H LYS A 64 13.068 -15.217 -4.755 1.00 0.00 H new ATOM 0 HA LYS A 64 13.522 -16.808 -2.329 1.00 0.00 H new ATOM 0 HB2 LYS A 64 11.597 -14.504 -2.666 1.00 0.00 H new ATOM 0 HB3 LYS A 64 11.153 -15.860 -1.649 1.00 0.00 H new ATOM 0 HG2 LYS A 64 13.737 -14.310 -1.288 1.00 0.00 H new ATOM 0 HG3 LYS A 64 12.244 -13.877 -0.479 1.00 0.00 H new ATOM 0 HD2 LYS A 64 13.305 -16.703 -0.293 1.00 0.00 H new ATOM 0 HD3 LYS A 64 13.969 -15.446 0.731 1.00 0.00 H new ATOM 0 HE2 LYS A 64 11.007 -16.128 0.551 1.00 0.00 H new ATOM 0 HE3 LYS A 64 12.087 -16.736 1.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 11.179 -14.908 2.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 12.593 -14.225 2.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 11.103 -13.991 1.376 1.00 0.00 H new ATOM 1000 N MET A 65 11.723 -18.409 -3.042 1.00 0.00 N ATOM 1001 CA MET A 65 10.860 -19.440 -3.606 1.00 0.00 C ATOM 1002 C MET A 65 9.631 -19.662 -2.730 1.00 0.00 C ATOM 1003 O MET A 65 8.588 -20.105 -3.209 1.00 0.00 O ATOM 1004 CB MET A 65 11.633 -20.751 -3.764 1.00 0.00 C ATOM 1005 CG MET A 65 12.161 -21.306 -2.450 1.00 0.00 C ATOM 1006 SD MET A 65 11.021 -22.471 -1.679 1.00 0.00 S ATOM 1007 CE MET A 65 12.163 -23.511 -0.772 1.00 0.00 C ATOM 0 H MET A 65 12.170 -18.668 -2.163 1.00 0.00 H new ATOM 0 HA MET A 65 10.527 -19.102 -4.587 1.00 0.00 H new ATOM 0 HB2 MET A 65 10.983 -21.493 -4.228 1.00 0.00 H new ATOM 0 HB3 MET A 65 12.470 -20.591 -4.444 1.00 0.00 H new ATOM 0 HG2 MET A 65 13.116 -21.801 -2.627 1.00 0.00 H new ATOM 0 HG3 MET A 65 12.352 -20.482 -1.763 1.00 0.00 H new ATOM 0 HE1 MET A 65 11.608 -24.284 -0.240 1.00 0.00 H new ATOM 0 HE2 MET A 65 12.860 -23.979 -1.467 1.00 0.00 H new ATOM 0 HE3 MET A 65 12.717 -22.904 -0.056 1.00 0.00 H new ATOM 1017 N ARG A 66 9.764 -19.353 -1.444 1.00 0.00 N ATOM 1018 CA ARG A 66 8.664 -19.520 -0.501 1.00 0.00 C ATOM 1019 C ARG A 66 7.417 -18.788 -0.986 1.00 0.00 C ATOM 1020 O ARG A 66 6.351 -19.378 -1.166 1.00 0.00 O ATOM 1021 CB ARG A 66 9.067 -19.004 0.881 1.00 0.00 C ATOM 1022 CG ARG A 66 7.894 -18.509 1.712 1.00 0.00 C ATOM 1023 CD ARG A 66 6.874 -19.611 1.946 1.00 0.00 C ATOM 1024 NE ARG A 66 5.645 -19.101 2.548 1.00 0.00 N ATOM 1025 CZ ARG A 66 4.640 -19.878 2.939 1.00 0.00 C ATOM 1026 NH1 ARG A 66 4.718 -21.193 2.791 1.00 0.00 N ATOM 1027 NH2 ARG A 66 3.555 -19.339 3.479 1.00 0.00 N ATOM 0 H ARG A 66 10.622 -18.986 -1.031 1.00 0.00 H new ATOM 0 HA ARG A 66 8.436 -20.584 -0.432 1.00 0.00 H new ATOM 0 HB2 ARG A 66 9.575 -19.801 1.423 1.00 0.00 H new ATOM 0 HB3 ARG A 66 9.785 -18.193 0.761 1.00 0.00 H new ATOM 0 HG2 ARG A 66 8.257 -18.138 2.671 1.00 0.00 H new ATOM 0 HG3 ARG A 66 7.416 -17.671 1.206 1.00 0.00 H new ATOM 0 HD2 ARG A 66 6.639 -20.095 0.998 1.00 0.00 H new ATOM 0 HD3 ARG A 66 7.306 -20.373 2.595 1.00 0.00 H new ATOM 0 HE ARG A 66 5.553 -18.093 2.675 1.00 0.00 H new ATOM 0 HH11 ARG A 66 5.551 -21.611 2.376 1.00 0.00 H new ATOM 0 HH12 ARG A 66 3.945 -21.787 3.092 1.00 0.00 H new ATOM 0 HH21 ARG A 66 3.491 -18.328 3.594 1.00 0.00 H new ATOM 0 HH22 ARG A 66 2.784 -19.936 3.779 1.00 0.00 H new ATOM 1041 N PRO A 67 7.548 -17.471 -1.202 1.00 0.00 N ATOM 1042 CA PRO A 67 6.442 -16.630 -1.669 1.00 0.00 C ATOM 1043 C PRO A 67 6.057 -16.927 -3.113 1.00 0.00 C ATOM 1044 O PRO A 67 6.587 -16.320 -4.045 1.00 0.00 O ATOM 1045 CB PRO A 67 6.999 -15.210 -1.544 1.00 0.00 C ATOM 1046 CG PRO A 67 8.477 -15.373 -1.641 1.00 0.00 C ATOM 1047 CD PRO A 67 8.789 -16.701 -1.008 1.00 0.00 C ATOM 0 HA PRO A 67 5.532 -16.797 -1.093 1.00 0.00 H new ATOM 0 HB2 PRO A 67 6.619 -14.565 -2.336 1.00 0.00 H new ATOM 0 HB3 PRO A 67 6.712 -14.754 -0.596 1.00 0.00 H new ATOM 0 HG2 PRO A 67 8.805 -15.349 -2.680 1.00 0.00 H new ATOM 0 HG3 PRO A 67 8.994 -14.564 -1.125 1.00 0.00 H new ATOM 0 HD2 PRO A 67 9.641 -17.184 -1.487 1.00 0.00 H new ATOM 0 HD3 PRO A 67 9.035 -16.595 0.049 1.00 0.00 H new ATOM 1055 N ILE A 68 5.132 -17.865 -3.293 1.00 0.00 N ATOM 1056 CA ILE A 68 4.676 -18.241 -4.625 1.00 0.00 C ATOM 1057 C ILE A 68 3.159 -18.394 -4.664 1.00 0.00 C ATOM 1058 O ILE A 68 2.512 -18.531 -3.627 1.00 0.00 O ATOM 1059 CB ILE A 68 5.325 -19.556 -5.093 1.00 0.00 C ATOM 1060 CG1 ILE A 68 5.191 -20.630 -4.011 1.00 0.00 C ATOM 1061 CG2 ILE A 68 6.789 -19.329 -5.442 1.00 0.00 C ATOM 1062 CD1 ILE A 68 5.450 -22.032 -4.515 1.00 0.00 C ATOM 0 H ILE A 68 4.684 -18.378 -2.533 1.00 0.00 H new ATOM 0 HA ILE A 68 4.976 -17.438 -5.299 1.00 0.00 H new ATOM 0 HB ILE A 68 4.807 -19.901 -5.988 1.00 0.00 H new ATOM 0 HG12 ILE A 68 5.888 -20.409 -3.203 1.00 0.00 H new ATOM 0 HG13 ILE A 68 4.188 -20.584 -3.588 1.00 0.00 H new ATOM 0 HG21 ILE A 68 7.234 -20.268 -5.771 1.00 0.00 H new ATOM 0 HG22 ILE A 68 6.862 -18.592 -6.242 1.00 0.00 H new ATOM 0 HG23 ILE A 68 7.320 -18.964 -4.563 1.00 0.00 H new ATOM 0 HD11 ILE A 68 5.337 -22.740 -3.694 1.00 0.00 H new ATOM 0 HD12 ILE A 68 4.736 -22.273 -5.303 1.00 0.00 H new ATOM 0 HD13 ILE A 68 6.463 -22.095 -4.912 1.00 0.00 H new ATOM 1074 N GLY A 69 2.598 -18.372 -5.869 1.00 0.00 N ATOM 1075 CA GLY A 69 1.162 -18.511 -6.021 1.00 0.00 C ATOM 1076 C GLY A 69 0.661 -17.960 -7.342 1.00 0.00 C ATOM 1077 O GLY A 69 0.878 -18.560 -8.395 1.00 0.00 O ATOM 0 H GLY A 69 3.113 -18.260 -6.743 1.00 0.00 H new ATOM 0 HA2 GLY A 69 0.892 -19.564 -5.945 1.00 0.00 H new ATOM 0 HA3 GLY A 69 0.662 -17.994 -5.202 1.00 0.00 H new ATOM 1081 N HIS A 70 -0.012 -16.815 -7.287 1.00 0.00 N ATOM 1082 CA HIS A 70 -0.544 -16.184 -8.488 1.00 0.00 C ATOM 1083 C HIS A 70 -1.504 -17.121 -9.215 1.00 0.00 C ATOM 1084 O HIS A 70 -1.564 -17.132 -10.445 1.00 0.00 O ATOM 1085 CB HIS A 70 0.595 -15.774 -9.423 1.00 0.00 C ATOM 1086 CG HIS A 70 1.458 -14.681 -8.873 1.00 0.00 C ATOM 1087 ND1 HIS A 70 2.790 -14.858 -8.565 1.00 0.00 N ATOM 1088 CD2 HIS A 70 1.173 -13.391 -8.579 1.00 0.00 C ATOM 1089 CE1 HIS A 70 3.286 -13.725 -8.102 1.00 0.00 C ATOM 1090 NE2 HIS A 70 2.325 -12.819 -8.101 1.00 0.00 N ATOM 0 H HIS A 70 -0.201 -16.306 -6.424 1.00 0.00 H new ATOM 0 HA HIS A 70 -1.094 -15.293 -8.186 1.00 0.00 H new ATOM 0 HB2 HIS A 70 1.215 -16.646 -9.630 1.00 0.00 H new ATOM 0 HB3 HIS A 70 0.174 -15.449 -10.374 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.217 -12.903 -8.698 1.00 0.00 H new ATOM 0 HE1 HIS A 70 4.304 -13.566 -7.779 1.00 0.00 H new ATOM 0 HE2 HIS A 70 2.423 -11.851 -7.795 1.00 0.00 H new ATOM 1098 N ASP A 71 -2.250 -17.907 -8.447 1.00 0.00 N ATOM 1099 CA ASP A 71 -3.206 -18.848 -9.018 1.00 0.00 C ATOM 1100 C ASP A 71 -4.421 -19.008 -8.109 1.00 0.00 C ATOM 1101 O ASP A 71 -4.286 -19.300 -6.921 1.00 0.00 O ATOM 1102 CB ASP A 71 -2.543 -20.208 -9.247 1.00 0.00 C ATOM 1103 CG ASP A 71 -3.294 -21.057 -10.253 1.00 0.00 C ATOM 1104 OD1 ASP A 71 -3.424 -20.622 -11.417 1.00 0.00 O ATOM 1105 OD2 ASP A 71 -3.751 -22.156 -9.878 1.00 0.00 O ATOM 0 H ASP A 71 -2.211 -17.911 -7.428 1.00 0.00 H new ATOM 0 HA ASP A 71 -3.541 -18.450 -9.976 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.521 -20.057 -9.595 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -2.481 -20.743 -8.299 1.00 0.00 H new ATOM 1110 N GLY A 72 -5.608 -18.812 -8.675 1.00 0.00 N ATOM 1111 CA GLY A 72 -6.829 -18.938 -7.900 1.00 0.00 C ATOM 1112 C GLY A 72 -7.785 -17.784 -8.134 1.00 0.00 C ATOM 1113 O GLY A 72 -7.361 -16.669 -8.434 1.00 0.00 O ATOM 0 H GLY A 72 -5.746 -18.568 -9.656 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -7.324 -19.874 -8.157 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -6.580 -18.990 -6.840 1.00 0.00 H new ATOM 1117 N ALA A 73 -9.079 -18.054 -7.999 1.00 0.00 N ATOM 1118 CA ALA A 73 -10.098 -17.031 -8.197 1.00 0.00 C ATOM 1119 C ALA A 73 -11.398 -17.407 -7.495 1.00 0.00 C ATOM 1120 O ALA A 73 -11.967 -18.469 -7.749 1.00 0.00 O ATOM 1121 CB ALA A 73 -10.342 -16.811 -9.682 1.00 0.00 C ATOM 0 H ALA A 73 -9.447 -18.973 -7.753 1.00 0.00 H new ATOM 0 HA ALA A 73 -9.735 -16.102 -7.758 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -11.105 -16.044 -9.816 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -9.416 -16.489 -10.159 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -10.679 -17.742 -10.137 1.00 0.00 H new ATOM 1127 N HIS A 74 -11.863 -16.530 -6.611 1.00 0.00 N ATOM 1128 CA HIS A 74 -13.097 -16.771 -5.872 1.00 0.00 C ATOM 1129 C HIS A 74 -13.890 -15.479 -5.702 1.00 0.00 C ATOM 1130 O HIS A 74 -13.334 -14.408 -5.457 1.00 0.00 O ATOM 1131 CB HIS A 74 -12.787 -17.376 -4.503 1.00 0.00 C ATOM 1132 CG HIS A 74 -13.659 -18.542 -4.151 1.00 0.00 C ATOM 1133 ND1 HIS A 74 -13.664 -19.720 -4.866 1.00 0.00 N ATOM 1134 CD2 HIS A 74 -14.555 -18.706 -3.151 1.00 0.00 C ATOM 1135 CE1 HIS A 74 -14.528 -20.559 -4.323 1.00 0.00 C ATOM 1136 NE2 HIS A 74 -15.082 -19.968 -3.280 1.00 0.00 N ATOM 0 H HIS A 74 -11.404 -15.646 -6.389 1.00 0.00 H new ATOM 0 HA HIS A 74 -13.701 -17.475 -6.444 1.00 0.00 H new ATOM 0 HB2 HIS A 74 -11.745 -17.694 -4.483 1.00 0.00 H new ATOM 0 HB3 HIS A 74 -12.900 -16.605 -3.741 1.00 0.00 H new ATOM 0 HD2 HIS A 74 -14.809 -17.980 -2.393 1.00 0.00 H new ATOM 0 HE1 HIS A 74 -14.744 -21.558 -4.672 1.00 0.00 H new ATOM 0 HE2 HIS A 74 -15.787 -20.381 -2.669 1.00 0.00 H new ATOM 1144 N PRO A 75 -15.221 -15.578 -5.838 1.00 0.00 N ATOM 1145 CA PRO A 75 -16.118 -14.427 -5.704 1.00 0.00 C ATOM 1146 C PRO A 75 -16.204 -13.922 -4.268 1.00 0.00 C ATOM 1147 O PRO A 75 -16.749 -14.595 -3.393 1.00 0.00 O ATOM 1148 CB PRO A 75 -17.472 -14.977 -6.160 1.00 0.00 C ATOM 1149 CG PRO A 75 -17.389 -16.443 -5.906 1.00 0.00 C ATOM 1150 CD PRO A 75 -15.952 -16.822 -6.132 1.00 0.00 C ATOM 0 HA PRO A 75 -15.772 -13.572 -6.285 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -18.292 -14.524 -5.602 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -17.650 -14.767 -7.215 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -17.700 -16.681 -4.889 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -18.048 -16.993 -6.578 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -15.643 -17.635 -5.475 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -15.781 -17.157 -7.155 1.00 0.00 H new ATOM 1158 N THR A 76 -15.661 -12.731 -4.030 1.00 0.00 N ATOM 1159 CA THR A 76 -15.676 -12.136 -2.700 1.00 0.00 C ATOM 1160 C THR A 76 -15.979 -10.644 -2.768 1.00 0.00 C ATOM 1161 O THR A 76 -15.724 -9.994 -3.782 1.00 0.00 O ATOM 1162 CB THR A 76 -14.331 -12.343 -1.977 1.00 0.00 C ATOM 1163 OG1 THR A 76 -13.255 -11.891 -2.807 1.00 0.00 O ATOM 1164 CG2 THR A 76 -14.125 -13.809 -1.626 1.00 0.00 C ATOM 0 H THR A 76 -15.205 -12.160 -4.742 1.00 0.00 H new ATOM 0 HA THR A 76 -16.464 -12.638 -2.138 1.00 0.00 H new ATOM 0 HB THR A 76 -14.347 -11.763 -1.054 1.00 0.00 H new ATOM 0 HG1 THR A 76 -12.404 -12.024 -2.340 1.00 0.00 H new ATOM 0 HG21 THR A 76 -13.169 -13.930 -1.117 1.00 0.00 H new ATOM 0 HG22 THR A 76 -14.930 -14.143 -0.971 1.00 0.00 H new ATOM 0 HG23 THR A 76 -14.128 -14.405 -2.538 1.00 0.00 H new ATOM 1172 N SER A 77 -16.523 -10.105 -1.682 1.00 0.00 N ATOM 1173 CA SER A 77 -16.864 -8.689 -1.620 1.00 0.00 C ATOM 1174 C SER A 77 -15.657 -7.858 -1.192 1.00 0.00 C ATOM 1175 O SER A 77 -14.635 -8.399 -0.769 1.00 0.00 O ATOM 1176 CB SER A 77 -18.023 -8.464 -0.647 1.00 0.00 C ATOM 1177 OG SER A 77 -18.801 -7.343 -1.031 1.00 0.00 O ATOM 0 H SER A 77 -16.737 -10.628 -0.833 1.00 0.00 H new ATOM 0 HA SER A 77 -17.169 -8.370 -2.617 1.00 0.00 H new ATOM 0 HB2 SER A 77 -18.652 -9.353 -0.614 1.00 0.00 H new ATOM 0 HB3 SER A 77 -17.633 -8.312 0.359 1.00 0.00 H new ATOM 0 HG SER A 77 -19.536 -7.221 -0.394 1.00 0.00 H new ATOM 1183 N VAL A 78 -15.784 -6.540 -1.307 1.00 0.00 N ATOM 1184 CA VAL A 78 -14.705 -5.633 -0.932 1.00 0.00 C ATOM 1185 C VAL A 78 -14.219 -5.913 0.485 1.00 0.00 C ATOM 1186 O VAL A 78 -13.037 -5.758 0.788 1.00 0.00 O ATOM 1187 CB VAL A 78 -15.151 -4.162 -1.029 1.00 0.00 C ATOM 1188 CG1 VAL A 78 -13.996 -3.231 -0.694 1.00 0.00 C ATOM 1189 CG2 VAL A 78 -15.704 -3.863 -2.414 1.00 0.00 C ATOM 0 H VAL A 78 -16.623 -6.076 -1.657 1.00 0.00 H new ATOM 0 HA VAL A 78 -13.888 -5.805 -1.633 1.00 0.00 H new ATOM 0 HB VAL A 78 -15.945 -3.992 -0.302 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -14.330 -2.196 -0.768 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -13.651 -3.430 0.321 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -13.178 -3.399 -1.395 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -16.014 -2.819 -2.464 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -14.933 -4.049 -3.162 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -16.562 -4.506 -2.610 1.00 0.00 H new ATOM 1199 N ALA A 79 -15.140 -6.328 1.349 1.00 0.00 N ATOM 1200 CA ALA A 79 -14.805 -6.633 2.735 1.00 0.00 C ATOM 1201 C ALA A 79 -13.786 -7.766 2.816 1.00 0.00 C ATOM 1202 O ALA A 79 -12.641 -7.556 3.217 1.00 0.00 O ATOM 1203 CB ALA A 79 -16.060 -6.993 3.514 1.00 0.00 C ATOM 0 H ALA A 79 -16.124 -6.461 1.114 1.00 0.00 H new ATOM 0 HA ALA A 79 -14.358 -5.744 3.180 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -15.795 -7.218 4.547 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -16.755 -6.154 3.493 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -16.531 -7.866 3.062 1.00 0.00 H new ATOM 1209 N GLU A 80 -14.211 -8.966 2.434 1.00 0.00 N ATOM 1210 CA GLU A 80 -13.335 -10.132 2.466 1.00 0.00 C ATOM 1211 C GLU A 80 -12.181 -9.973 1.481 1.00 0.00 C ATOM 1212 O GLU A 80 -11.184 -10.690 1.556 1.00 0.00 O ATOM 1213 CB GLU A 80 -14.126 -11.400 2.141 1.00 0.00 C ATOM 1214 CG GLU A 80 -15.170 -11.752 3.187 1.00 0.00 C ATOM 1215 CD GLU A 80 -14.608 -12.601 4.311 1.00 0.00 C ATOM 1216 OE1 GLU A 80 -14.250 -13.769 4.048 1.00 0.00 O ATOM 1217 OE2 GLU A 80 -14.527 -12.099 5.451 1.00 0.00 O ATOM 0 H GLU A 80 -15.155 -9.157 2.099 1.00 0.00 H new ATOM 0 HA GLU A 80 -12.922 -10.217 3.471 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -14.618 -11.274 1.177 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -13.432 -12.234 2.038 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -15.586 -10.834 3.603 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -15.991 -12.286 2.709 1.00 0.00 H new ATOM 1224 N TRP A 81 -12.324 -9.028 0.560 1.00 0.00 N ATOM 1225 CA TRP A 81 -11.294 -8.774 -0.441 1.00 0.00 C ATOM 1226 C TRP A 81 -10.148 -7.959 0.150 1.00 0.00 C ATOM 1227 O TRP A 81 -8.981 -8.184 -0.175 1.00 0.00 O ATOM 1228 CB TRP A 81 -11.891 -8.038 -1.643 1.00 0.00 C ATOM 1229 CG TRP A 81 -10.856 -7.468 -2.565 1.00 0.00 C ATOM 1230 CD1 TRP A 81 -9.937 -8.165 -3.297 1.00 0.00 C ATOM 1231 CD2 TRP A 81 -10.633 -6.082 -2.851 1.00 0.00 C ATOM 1232 NE1 TRP A 81 -9.156 -7.296 -4.021 1.00 0.00 N ATOM 1233 CE2 TRP A 81 -9.564 -6.014 -3.766 1.00 0.00 C ATOM 1234 CE3 TRP A 81 -11.234 -4.895 -2.426 1.00 0.00 C ATOM 1235 CZ2 TRP A 81 -9.085 -4.803 -4.259 1.00 0.00 C ATOM 1236 CZ3 TRP A 81 -10.757 -3.695 -2.917 1.00 0.00 C ATOM 1237 CH2 TRP A 81 -9.692 -3.656 -3.826 1.00 0.00 C ATOM 0 H TRP A 81 -13.143 -8.425 0.485 1.00 0.00 H new ATOM 0 HA TRP A 81 -10.900 -9.735 -0.771 1.00 0.00 H new ATOM 0 HB2 TRP A 81 -12.526 -8.725 -2.202 1.00 0.00 H new ATOM 0 HB3 TRP A 81 -12.531 -7.232 -1.285 1.00 0.00 H new ATOM 0 HD1 TRP A 81 -9.839 -9.240 -3.306 1.00 0.00 H new ATOM 0 HE1 TRP A 81 -8.396 -7.563 -4.647 1.00 0.00 H new ATOM 0 HE3 TRP A 81 -12.057 -4.915 -1.726 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 -8.263 -4.770 -4.959 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 -11.213 -2.771 -2.594 1.00 0.00 H new ATOM 0 HH2 TRP A 81 -9.343 -2.702 -4.192 1.00 0.00 H new ATOM 1248 N LEU A 82 -10.488 -7.014 1.019 1.00 0.00 N ATOM 1249 CA LEU A 82 -9.487 -6.166 1.657 1.00 0.00 C ATOM 1250 C LEU A 82 -9.011 -6.779 2.970 1.00 0.00 C ATOM 1251 O LEU A 82 -7.830 -6.707 3.310 1.00 0.00 O ATOM 1252 CB LEU A 82 -10.059 -4.770 1.911 1.00 0.00 C ATOM 1253 CG LEU A 82 -9.897 -3.762 0.772 1.00 0.00 C ATOM 1254 CD1 LEU A 82 -11.004 -2.721 0.820 1.00 0.00 C ATOM 1255 CD2 LEU A 82 -8.532 -3.094 0.841 1.00 0.00 C ATOM 0 H LEU A 82 -11.449 -6.815 1.298 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.633 -6.085 0.984 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -11.121 -4.869 2.134 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -9.583 -4.361 2.802 1.00 0.00 H new ATOM 0 HG LEU A 82 -9.970 -4.298 -0.175 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -10.873 -2.012 0.002 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -11.971 -3.214 0.721 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -10.963 -2.190 1.771 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -8.434 -2.380 0.023 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -8.430 -2.572 1.792 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -7.752 -3.851 0.757 1.00 0.00 H new ATOM 1267 N ASP A 83 -9.938 -7.384 3.705 1.00 0.00 N ATOM 1268 CA ASP A 83 -9.614 -8.013 4.980 1.00 0.00 C ATOM 1269 C ASP A 83 -8.713 -9.226 4.774 1.00 0.00 C ATOM 1270 O ASP A 83 -8.099 -9.724 5.717 1.00 0.00 O ATOM 1271 CB ASP A 83 -10.893 -8.429 5.709 1.00 0.00 C ATOM 1272 CG ASP A 83 -10.738 -8.394 7.216 1.00 0.00 C ATOM 1273 OD1 ASP A 83 -9.623 -8.671 7.705 1.00 0.00 O ATOM 1274 OD2 ASP A 83 -11.733 -8.089 7.909 1.00 0.00 O ATOM 0 H ASP A 83 -10.920 -7.452 3.439 1.00 0.00 H new ATOM 0 HA ASP A 83 -9.079 -7.285 5.590 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -11.707 -7.766 5.415 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -11.173 -9.436 5.399 1.00 0.00 H new ATOM 1279 N SER A 84 -8.641 -9.699 3.533 1.00 0.00 N ATOM 1280 CA SER A 84 -7.820 -10.858 3.204 1.00 0.00 C ATOM 1281 C SER A 84 -6.452 -10.425 2.683 1.00 0.00 C ATOM 1282 O SER A 84 -5.508 -11.215 2.654 1.00 0.00 O ATOM 1283 CB SER A 84 -8.524 -11.727 2.160 1.00 0.00 C ATOM 1284 OG SER A 84 -7.811 -12.931 1.935 1.00 0.00 O ATOM 0 H SER A 84 -9.141 -9.297 2.740 1.00 0.00 H new ATOM 0 HA SER A 84 -7.675 -11.440 4.114 1.00 0.00 H new ATOM 0 HB2 SER A 84 -9.535 -11.957 2.495 1.00 0.00 H new ATOM 0 HB3 SER A 84 -8.616 -11.175 1.225 1.00 0.00 H new ATOM 0 HG SER A 84 -8.282 -13.470 1.265 1.00 0.00 H new ATOM 1290 N ILE A 85 -6.355 -9.165 2.274 1.00 0.00 N ATOM 1291 CA ILE A 85 -5.103 -8.625 1.756 1.00 0.00 C ATOM 1292 C ILE A 85 -4.226 -8.091 2.884 1.00 0.00 C ATOM 1293 O ILE A 85 -3.263 -8.738 3.294 1.00 0.00 O ATOM 1294 CB ILE A 85 -5.355 -7.497 0.738 1.00 0.00 C ATOM 1295 CG1 ILE A 85 -6.014 -8.057 -0.523 1.00 0.00 C ATOM 1296 CG2 ILE A 85 -4.051 -6.793 0.394 1.00 0.00 C ATOM 1297 CD1 ILE A 85 -6.642 -6.996 -1.399 1.00 0.00 C ATOM 0 H ILE A 85 -7.127 -8.499 2.291 1.00 0.00 H new ATOM 0 HA ILE A 85 -4.588 -9.446 1.256 1.00 0.00 H new ATOM 0 HB ILE A 85 -6.031 -6.768 1.185 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -5.268 -8.600 -1.103 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -6.779 -8.778 -0.234 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -4.246 -5.999 -0.326 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -3.619 -6.365 1.299 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -3.353 -7.511 -0.037 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -7.090 -7.466 -2.275 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -7.412 -6.468 -0.836 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -5.877 -6.288 -1.718 1.00 0.00 H new ATOM 1309 N GLU A 86 -4.569 -6.906 3.383 1.00 0.00 N ATOM 1310 CA GLU A 86 -3.813 -6.286 4.464 1.00 0.00 C ATOM 1311 C GLU A 86 -4.747 -5.619 5.468 1.00 0.00 C ATOM 1312 O GLU A 86 -4.918 -6.099 6.589 1.00 0.00 O ATOM 1313 CB GLU A 86 -2.830 -5.256 3.903 1.00 0.00 C ATOM 1314 CG GLU A 86 -1.770 -5.858 2.997 1.00 0.00 C ATOM 1315 CD GLU A 86 -1.077 -7.054 3.621 1.00 0.00 C ATOM 1316 OE1 GLU A 86 -0.972 -7.096 4.865 1.00 0.00 O ATOM 1317 OE2 GLU A 86 -0.640 -7.948 2.866 1.00 0.00 O ATOM 0 H GLU A 86 -5.364 -6.358 3.056 1.00 0.00 H new ATOM 0 HA GLU A 86 -3.255 -7.069 4.978 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -3.386 -4.501 3.347 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -2.340 -4.745 4.732 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -2.231 -6.160 2.057 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -1.027 -5.097 2.758 1.00 0.00 H new ATOM 1324 N LEU A 87 -5.351 -4.509 5.059 1.00 0.00 N ATOM 1325 CA LEU A 87 -6.268 -3.774 5.922 1.00 0.00 C ATOM 1326 C LEU A 87 -7.691 -3.825 5.373 1.00 0.00 C ATOM 1327 O LEU A 87 -7.915 -3.619 4.182 1.00 0.00 O ATOM 1328 CB LEU A 87 -5.815 -2.320 6.060 1.00 0.00 C ATOM 1329 CG LEU A 87 -5.456 -1.602 4.758 1.00 0.00 C ATOM 1330 CD1 LEU A 87 -5.611 -0.097 4.917 1.00 0.00 C ATOM 1331 CD2 LEU A 87 -4.038 -1.951 4.331 1.00 0.00 C ATOM 0 H LEU A 87 -5.222 -4.098 4.134 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.260 -4.246 6.905 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -6.608 -1.759 6.554 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -4.947 -2.292 6.718 1.00 0.00 H new ATOM 0 HG LEU A 87 -6.142 -1.937 3.980 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -5.351 0.396 3.980 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -6.644 0.137 5.176 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.949 0.255 5.708 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.799 -1.432 3.403 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.338 -1.645 5.109 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -3.959 -3.027 4.175 1.00 0.00 H new ATOM 1343 N GLY A 88 -8.649 -4.099 6.254 1.00 0.00 N ATOM 1344 CA GLY A 88 -10.038 -4.171 5.839 1.00 0.00 C ATOM 1345 C GLY A 88 -10.806 -2.905 6.165 1.00 0.00 C ATOM 1346 O GLY A 88 -11.979 -2.773 5.812 1.00 0.00 O ATOM 0 H GLY A 88 -8.488 -4.272 7.246 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -10.084 -4.354 4.766 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -10.517 -5.019 6.328 1.00 0.00 H new ATOM 1350 N ASP A 89 -10.146 -1.971 6.840 1.00 0.00 N ATOM 1351 CA ASP A 89 -10.773 -0.709 7.215 1.00 0.00 C ATOM 1352 C ASP A 89 -11.319 0.011 5.986 1.00 0.00 C ATOM 1353 O ASP A 89 -12.409 0.583 6.021 1.00 0.00 O ATOM 1354 CB ASP A 89 -9.773 0.187 7.945 1.00 0.00 C ATOM 1355 CG ASP A 89 -10.452 1.221 8.819 1.00 0.00 C ATOM 1356 OD1 ASP A 89 -11.373 0.847 9.575 1.00 0.00 O ATOM 1357 OD2 ASP A 89 -10.064 2.406 8.749 1.00 0.00 O ATOM 0 H ASP A 89 -9.175 -2.064 7.139 1.00 0.00 H new ATOM 0 HA ASP A 89 -11.604 -0.930 7.885 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -9.118 -0.430 8.560 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -9.141 0.692 7.214 1.00 0.00 H new ATOM 1362 N TYR A 90 -10.554 -0.018 4.900 1.00 0.00 N ATOM 1363 CA TYR A 90 -10.958 0.635 3.662 1.00 0.00 C ATOM 1364 C TYR A 90 -12.337 0.158 3.219 1.00 0.00 C ATOM 1365 O TYR A 90 -13.051 0.859 2.500 1.00 0.00 O ATOM 1366 CB TYR A 90 -9.934 0.362 2.559 1.00 0.00 C ATOM 1367 CG TYR A 90 -8.852 1.414 2.463 1.00 0.00 C ATOM 1368 CD1 TYR A 90 -9.167 2.739 2.185 1.00 0.00 C ATOM 1369 CD2 TYR A 90 -7.516 1.084 2.652 1.00 0.00 C ATOM 1370 CE1 TYR A 90 -8.181 3.704 2.096 1.00 0.00 C ATOM 1371 CE2 TYR A 90 -6.524 2.042 2.566 1.00 0.00 C ATOM 1372 CZ TYR A 90 -6.862 3.350 2.287 1.00 0.00 C ATOM 1373 OH TYR A 90 -5.878 4.308 2.202 1.00 0.00 O ATOM 0 H TYR A 90 -9.650 -0.488 4.853 1.00 0.00 H new ATOM 0 HA TYR A 90 -11.007 1.708 3.847 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -9.471 -0.608 2.737 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -10.452 0.297 1.602 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -10.199 3.019 2.036 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -7.248 0.061 2.870 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -8.442 4.729 1.878 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -5.490 1.768 2.716 1.00 0.00 H new ATOM 0 HH TYR A 90 -5.000 3.884 2.299 1.00 0.00 H new ATOM 1383 N THR A 91 -12.709 -1.043 3.655 1.00 0.00 N ATOM 1384 CA THR A 91 -14.002 -1.616 3.304 1.00 0.00 C ATOM 1385 C THR A 91 -15.127 -0.610 3.522 1.00 0.00 C ATOM 1386 O THR A 91 -16.124 -0.611 2.799 1.00 0.00 O ATOM 1387 CB THR A 91 -14.297 -2.884 4.127 1.00 0.00 C ATOM 1388 OG1 THR A 91 -13.283 -3.867 3.892 1.00 0.00 O ATOM 1389 CG2 THR A 91 -15.659 -3.458 3.769 1.00 0.00 C ATOM 0 H THR A 91 -12.133 -1.637 4.251 1.00 0.00 H new ATOM 0 HA THR A 91 -13.954 -1.880 2.248 1.00 0.00 H new ATOM 0 HB THR A 91 -14.302 -2.612 5.182 1.00 0.00 H new ATOM 0 HG1 THR A 91 -12.705 -3.936 4.680 1.00 0.00 H new ATOM 0 HG21 THR A 91 -15.844 -4.353 4.363 1.00 0.00 H new ATOM 0 HG22 THR A 91 -16.432 -2.718 3.977 1.00 0.00 H new ATOM 0 HG23 THR A 91 -15.678 -3.715 2.710 1.00 0.00 H new ATOM 1397 N LYS A 92 -14.961 0.248 4.522 1.00 0.00 N ATOM 1398 CA LYS A 92 -15.961 1.262 4.834 1.00 0.00 C ATOM 1399 C LYS A 92 -16.106 2.256 3.686 1.00 0.00 C ATOM 1400 O LYS A 92 -17.201 2.456 3.161 1.00 0.00 O ATOM 1401 CB LYS A 92 -15.583 2.002 6.119 1.00 0.00 C ATOM 1402 CG LYS A 92 -16.770 2.613 6.842 1.00 0.00 C ATOM 1403 CD LYS A 92 -17.095 3.999 6.309 1.00 0.00 C ATOM 1404 CE LYS A 92 -18.398 4.528 6.889 1.00 0.00 C ATOM 1405 NZ LYS A 92 -18.583 5.977 6.607 1.00 0.00 N ATOM 0 H LYS A 92 -14.143 0.262 5.131 1.00 0.00 H new ATOM 0 HA LYS A 92 -16.918 0.760 4.979 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -15.076 1.309 6.791 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -14.870 2.791 5.878 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -17.639 1.965 6.728 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -16.555 2.674 7.909 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -16.283 4.683 6.553 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -17.167 3.964 5.222 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -19.235 3.967 6.472 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -18.409 4.364 7.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -18.586 6.507 7.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -17.805 6.316 6.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -19.488 6.122 6.115 1.00 0.00 H new ATOM 1419 N ALA A 93 -14.994 2.875 3.303 1.00 0.00 N ATOM 1420 CA ALA A 93 -14.997 3.845 2.215 1.00 0.00 C ATOM 1421 C ALA A 93 -15.473 3.208 0.913 1.00 0.00 C ATOM 1422 O ALA A 93 -16.261 3.799 0.173 1.00 0.00 O ATOM 1423 CB ALA A 93 -13.609 4.442 2.036 1.00 0.00 C ATOM 0 H ALA A 93 -14.080 2.722 3.730 1.00 0.00 H new ATOM 0 HA ALA A 93 -15.693 4.643 2.475 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -13.626 5.165 1.220 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -13.306 4.941 2.956 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -12.899 3.649 1.803 1.00 0.00 H new ATOM 1429 N PHE A 94 -14.990 2.002 0.638 1.00 0.00 N ATOM 1430 CA PHE A 94 -15.364 1.286 -0.575 1.00 0.00 C ATOM 1431 C PHE A 94 -16.874 1.072 -0.637 1.00 0.00 C ATOM 1432 O PHE A 94 -17.511 1.347 -1.655 1.00 0.00 O ATOM 1433 CB PHE A 94 -14.644 -0.063 -0.641 1.00 0.00 C ATOM 1434 CG PHE A 94 -13.322 -0.002 -1.350 1.00 0.00 C ATOM 1435 CD1 PHE A 94 -13.245 -0.203 -2.719 1.00 0.00 C ATOM 1436 CD2 PHE A 94 -12.155 0.255 -0.648 1.00 0.00 C ATOM 1437 CE1 PHE A 94 -12.029 -0.147 -3.375 1.00 0.00 C ATOM 1438 CE2 PHE A 94 -10.937 0.313 -1.299 1.00 0.00 C ATOM 1439 CZ PHE A 94 -10.874 0.110 -2.663 1.00 0.00 C ATOM 0 H PHE A 94 -14.338 1.499 1.240 1.00 0.00 H new ATOM 0 HA PHE A 94 -15.064 1.892 -1.430 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -14.487 -0.432 0.373 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -15.286 -0.784 -1.147 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -14.145 -0.406 -3.280 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -12.198 0.412 0.420 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -11.983 -0.304 -4.443 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -10.035 0.517 -0.741 1.00 0.00 H new ATOM 0 HZ PHE A 94 -9.923 0.152 -3.173 1.00 0.00 H new ATOM 1449 N LEU A 95 -17.441 0.580 0.459 1.00 0.00 N ATOM 1450 CA LEU A 95 -18.876 0.328 0.533 1.00 0.00 C ATOM 1451 C LEU A 95 -19.667 1.615 0.315 1.00 0.00 C ATOM 1452 O LEU A 95 -20.470 1.712 -0.613 1.00 0.00 O ATOM 1453 CB LEU A 95 -19.239 -0.284 1.886 1.00 0.00 C ATOM 1454 CG LEU A 95 -18.861 -1.753 2.082 1.00 0.00 C ATOM 1455 CD1 LEU A 95 -18.965 -2.141 3.548 1.00 0.00 C ATOM 1456 CD2 LEU A 95 -19.746 -2.648 1.227 1.00 0.00 C ATOM 0 H LEU A 95 -16.928 0.347 1.310 1.00 0.00 H new ATOM 0 HA LEU A 95 -19.137 -0.376 -0.258 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -18.757 0.302 2.668 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -20.315 -0.184 2.030 1.00 0.00 H new ATOM 0 HG LEU A 95 -17.827 -1.888 1.766 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -18.692 -3.190 3.667 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -18.289 -1.521 4.137 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -19.988 -1.991 3.892 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -19.464 -3.690 1.378 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -20.789 -2.509 1.513 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -19.620 -2.387 0.176 1.00 0.00 H new ATOM 1468 N ILE A 96 -19.429 2.600 1.174 1.00 0.00 N ATOM 1469 CA ILE A 96 -20.118 3.882 1.074 1.00 0.00 C ATOM 1470 C ILE A 96 -19.909 4.511 -0.299 1.00 0.00 C ATOM 1471 O ILE A 96 -20.759 5.253 -0.789 1.00 0.00 O ATOM 1472 CB ILE A 96 -19.634 4.866 2.156 1.00 0.00 C ATOM 1473 CG1 ILE A 96 -18.178 5.260 1.905 1.00 0.00 C ATOM 1474 CG2 ILE A 96 -19.791 4.250 3.539 1.00 0.00 C ATOM 1475 CD1 ILE A 96 -17.644 6.267 2.899 1.00 0.00 C ATOM 0 H ILE A 96 -18.766 2.536 1.946 1.00 0.00 H new ATOM 0 HA ILE A 96 -21.179 3.684 1.223 1.00 0.00 H new ATOM 0 HB ILE A 96 -20.247 5.766 2.108 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -17.557 4.365 1.938 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -18.090 5.672 0.900 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -19.445 4.957 4.293 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -20.841 4.015 3.716 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -19.200 3.336 3.600 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -16.606 6.500 2.660 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -18.241 7.178 2.850 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -17.700 5.850 3.905 1.00 0.00 H new ATOM 1487 N ASN A 97 -18.771 4.209 -0.916 1.00 0.00 N ATOM 1488 CA ASN A 97 -18.451 4.745 -2.234 1.00 0.00 C ATOM 1489 C ASN A 97 -19.330 4.109 -3.307 1.00 0.00 C ATOM 1490 O ASN A 97 -19.568 4.701 -4.359 1.00 0.00 O ATOM 1491 CB ASN A 97 -16.975 4.505 -2.559 1.00 0.00 C ATOM 1492 CG ASN A 97 -16.090 5.651 -2.109 1.00 0.00 C ATOM 1493 OD1 ASN A 97 -15.080 5.442 -1.438 1.00 0.00 O ATOM 1494 ND2 ASN A 97 -16.468 6.870 -2.476 1.00 0.00 N ATOM 0 H ASN A 97 -18.056 3.596 -0.525 1.00 0.00 H new ATOM 0 HA ASN A 97 -18.644 5.818 -2.221 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -16.645 3.584 -2.078 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -16.861 4.362 -3.634 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -15.913 7.680 -2.201 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -17.313 6.996 -3.033 1.00 0.00 H new ATOM 1501 N GLY A 98 -19.809 2.900 -3.033 1.00 0.00 N ATOM 1502 CA GLY A 98 -20.656 2.205 -3.984 1.00 0.00 C ATOM 1503 C GLY A 98 -19.940 1.059 -4.670 1.00 0.00 C ATOM 1504 O GLY A 98 -20.229 0.737 -5.823 1.00 0.00 O ATOM 0 H GLY A 98 -19.626 2.389 -2.169 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -21.537 1.822 -3.469 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -21.008 2.911 -4.736 1.00 0.00 H new ATOM 1508 N TYR A 99 -19.002 0.441 -3.960 1.00 0.00 N ATOM 1509 CA TYR A 99 -18.239 -0.673 -4.509 1.00 0.00 C ATOM 1510 C TYR A 99 -18.811 -2.008 -4.042 1.00 0.00 C ATOM 1511 O TYR A 99 -18.075 -2.969 -3.819 1.00 0.00 O ATOM 1512 CB TYR A 99 -16.770 -0.564 -4.098 1.00 0.00 C ATOM 1513 CG TYR A 99 -16.001 0.485 -4.871 1.00 0.00 C ATOM 1514 CD1 TYR A 99 -15.651 0.279 -6.200 1.00 0.00 C ATOM 1515 CD2 TYR A 99 -15.626 1.681 -4.272 1.00 0.00 C ATOM 1516 CE1 TYR A 99 -14.949 1.234 -6.909 1.00 0.00 C ATOM 1517 CE2 TYR A 99 -14.924 2.642 -4.973 1.00 0.00 C ATOM 1518 CZ TYR A 99 -14.587 2.415 -6.291 1.00 0.00 C ATOM 1519 OH TYR A 99 -13.889 3.368 -6.995 1.00 0.00 O ATOM 0 H TYR A 99 -18.752 0.693 -3.004 1.00 0.00 H new ATOM 0 HA TYR A 99 -18.310 -0.628 -5.596 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -16.715 -0.332 -3.034 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -16.289 -1.532 -4.239 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -15.933 -0.643 -6.687 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -15.888 1.863 -3.240 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -14.684 1.058 -7.941 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -14.640 3.566 -4.492 1.00 0.00 H new ATOM 0 HH TYR A 99 -13.204 3.765 -6.417 1.00 0.00 H new ATOM 1529 N THR A 100 -20.132 -2.060 -3.896 1.00 0.00 N ATOM 1530 CA THR A 100 -20.804 -3.275 -3.455 1.00 0.00 C ATOM 1531 C THR A 100 -20.465 -4.452 -4.363 1.00 0.00 C ATOM 1532 O THR A 100 -20.455 -5.602 -3.926 1.00 0.00 O ATOM 1533 CB THR A 100 -22.334 -3.090 -3.423 1.00 0.00 C ATOM 1534 OG1 THR A 100 -22.754 -2.293 -4.536 1.00 0.00 O ATOM 1535 CG2 THR A 100 -22.772 -2.429 -2.124 1.00 0.00 C ATOM 0 H THR A 100 -20.757 -1.274 -4.077 1.00 0.00 H new ATOM 0 HA THR A 100 -20.449 -3.484 -2.446 1.00 0.00 H new ATOM 0 HB THR A 100 -22.799 -4.074 -3.486 1.00 0.00 H new ATOM 0 HG1 THR A 100 -23.727 -2.181 -4.510 1.00 0.00 H new ATOM 0 HG21 THR A 100 -23.855 -2.309 -2.124 1.00 0.00 H new ATOM 0 HG22 THR A 100 -22.476 -3.053 -1.281 1.00 0.00 H new ATOM 0 HG23 THR A 100 -22.298 -1.451 -2.036 1.00 0.00 H new ATOM 1543 N SER A 101 -20.188 -4.156 -5.629 1.00 0.00 N ATOM 1544 CA SER A 101 -19.851 -5.190 -6.599 1.00 0.00 C ATOM 1545 C SER A 101 -18.345 -5.236 -6.844 1.00 0.00 C ATOM 1546 O SER A 101 -17.719 -4.212 -7.115 1.00 0.00 O ATOM 1547 CB SER A 101 -20.586 -4.941 -7.917 1.00 0.00 C ATOM 1548 OG SER A 101 -20.228 -5.907 -8.891 1.00 0.00 O ATOM 0 H SER A 101 -20.190 -3.208 -6.006 1.00 0.00 H new ATOM 0 HA SER A 101 -20.165 -6.151 -6.192 1.00 0.00 H new ATOM 0 HB2 SER A 101 -21.662 -4.972 -7.748 1.00 0.00 H new ATOM 0 HB3 SER A 101 -20.350 -3.943 -8.286 1.00 0.00 H new ATOM 0 HG SER A 101 -20.712 -5.727 -9.724 1.00 0.00 H new ATOM 1554 N MET A 102 -17.772 -6.431 -6.746 1.00 0.00 N ATOM 1555 CA MET A 102 -16.341 -6.612 -6.958 1.00 0.00 C ATOM 1556 C MET A 102 -15.932 -6.131 -8.347 1.00 0.00 C ATOM 1557 O MET A 102 -14.959 -5.392 -8.498 1.00 0.00 O ATOM 1558 CB MET A 102 -15.958 -8.083 -6.782 1.00 0.00 C ATOM 1559 CG MET A 102 -14.528 -8.393 -7.193 1.00 0.00 C ATOM 1560 SD MET A 102 -13.769 -9.662 -6.162 1.00 0.00 S ATOM 1561 CE MET A 102 -12.257 -8.838 -5.669 1.00 0.00 C ATOM 0 H MET A 102 -18.277 -7.288 -6.521 1.00 0.00 H new ATOM 0 HA MET A 102 -15.812 -6.015 -6.215 1.00 0.00 H new ATOM 0 HB2 MET A 102 -16.096 -8.363 -5.738 1.00 0.00 H new ATOM 0 HB3 MET A 102 -16.638 -8.700 -7.370 1.00 0.00 H new ATOM 0 HG2 MET A 102 -14.516 -8.720 -8.233 1.00 0.00 H new ATOM 0 HG3 MET A 102 -13.933 -7.482 -7.138 1.00 0.00 H new ATOM 0 HE1 MET A 102 -11.562 -9.569 -5.257 1.00 0.00 H new ATOM 0 HE2 MET A 102 -11.805 -8.357 -6.537 1.00 0.00 H new ATOM 0 HE3 MET A 102 -12.482 -8.086 -4.913 1.00 0.00 H new ATOM 1571 N ASP A 103 -16.681 -6.556 -9.360 1.00 0.00 N ATOM 1572 CA ASP A 103 -16.396 -6.169 -10.736 1.00 0.00 C ATOM 1573 C ASP A 103 -16.263 -4.654 -10.858 1.00 0.00 C ATOM 1574 O ASP A 103 -15.516 -4.151 -11.698 1.00 0.00 O ATOM 1575 CB ASP A 103 -17.499 -6.673 -11.668 1.00 0.00 C ATOM 1576 CG ASP A 103 -16.961 -7.112 -13.017 1.00 0.00 C ATOM 1577 OD1 ASP A 103 -16.098 -8.015 -13.045 1.00 0.00 O ATOM 1578 OD2 ASP A 103 -17.404 -6.555 -14.042 1.00 0.00 O ATOM 0 H ASP A 103 -17.490 -7.168 -9.253 1.00 0.00 H new ATOM 0 HA ASP A 103 -15.449 -6.623 -11.027 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -18.015 -7.509 -11.196 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -18.237 -5.884 -11.813 1.00 0.00 H new ATOM 1583 N LEU A 104 -16.993 -3.931 -10.015 1.00 0.00 N ATOM 1584 CA LEU A 104 -16.959 -2.473 -10.029 1.00 0.00 C ATOM 1585 C LEU A 104 -15.532 -1.961 -9.856 1.00 0.00 C ATOM 1586 O LEU A 104 -15.141 -0.963 -10.463 1.00 0.00 O ATOM 1587 CB LEU A 104 -17.851 -1.912 -8.921 1.00 0.00 C ATOM 1588 CG LEU A 104 -18.499 -0.556 -9.203 1.00 0.00 C ATOM 1589 CD1 LEU A 104 -19.830 -0.439 -8.476 1.00 0.00 C ATOM 1590 CD2 LEU A 104 -17.566 0.576 -8.797 1.00 0.00 C ATOM 0 H LEU A 104 -17.616 -4.331 -9.313 1.00 0.00 H new ATOM 0 HA LEU A 104 -17.333 -2.134 -10.995 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -18.641 -2.635 -8.718 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -17.256 -1.826 -8.012 1.00 0.00 H new ATOM 0 HG LEU A 104 -18.685 -0.480 -10.274 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -20.276 0.532 -8.688 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -20.501 -1.229 -8.815 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -19.668 -0.537 -7.403 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -18.044 1.533 -9.005 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -17.348 0.503 -7.732 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -16.638 0.503 -9.363 1.00 0.00 H new ATOM 1602 N LEU A 105 -14.757 -2.653 -9.028 1.00 0.00 N ATOM 1603 CA LEU A 105 -13.372 -2.270 -8.777 1.00 0.00 C ATOM 1604 C LEU A 105 -12.537 -2.385 -10.048 1.00 0.00 C ATOM 1605 O LEU A 105 -11.504 -1.728 -10.188 1.00 0.00 O ATOM 1606 CB LEU A 105 -12.770 -3.146 -7.677 1.00 0.00 C ATOM 1607 CG LEU A 105 -13.613 -3.304 -6.410 1.00 0.00 C ATOM 1608 CD1 LEU A 105 -13.144 -4.506 -5.604 1.00 0.00 C ATOM 1609 CD2 LEU A 105 -13.553 -2.039 -5.568 1.00 0.00 C ATOM 0 H LEU A 105 -15.064 -3.482 -8.519 1.00 0.00 H new ATOM 0 HA LEU A 105 -13.362 -1.230 -8.450 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -12.582 -4.137 -8.091 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -11.803 -2.729 -7.397 1.00 0.00 H new ATOM 0 HG LEU A 105 -14.649 -3.471 -6.704 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -13.755 -4.603 -4.706 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -13.240 -5.409 -6.207 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -12.101 -4.369 -5.320 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -14.158 -2.170 -4.671 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -12.520 -1.840 -5.283 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -13.938 -1.199 -6.146 1.00 0.00 H new ATOM 1621 N LYS A 106 -12.990 -3.223 -10.974 1.00 0.00 N ATOM 1622 CA LYS A 106 -12.288 -3.423 -12.236 1.00 0.00 C ATOM 1623 C LYS A 106 -12.627 -2.315 -13.229 1.00 0.00 C ATOM 1624 O LYS A 106 -12.051 -2.244 -14.314 1.00 0.00 O ATOM 1625 CB LYS A 106 -12.647 -4.785 -12.833 1.00 0.00 C ATOM 1626 CG LYS A 106 -11.532 -5.400 -13.661 1.00 0.00 C ATOM 1627 CD LYS A 106 -11.656 -5.027 -15.128 1.00 0.00 C ATOM 1628 CE LYS A 106 -11.122 -6.129 -16.031 1.00 0.00 C ATOM 1629 NZ LYS A 106 -12.166 -7.141 -16.349 1.00 0.00 N ATOM 0 H LYS A 106 -13.842 -3.775 -10.874 1.00 0.00 H new ATOM 0 HA LYS A 106 -11.217 -3.392 -12.036 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -12.908 -5.469 -12.025 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -13.534 -4.676 -13.457 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -10.567 -5.065 -13.280 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -11.556 -6.485 -13.557 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -12.701 -4.833 -15.368 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -11.109 -4.103 -15.317 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -10.748 -5.691 -16.956 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -10.278 -6.619 -15.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -11.762 -7.874 -16.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -12.506 -7.578 -15.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -12.961 -6.679 -16.835 1.00 0.00 H new ATOM 1643 N LYS A 107 -13.563 -1.452 -12.849 1.00 0.00 N ATOM 1644 CA LYS A 107 -13.978 -0.347 -13.704 1.00 0.00 C ATOM 1645 C LYS A 107 -13.400 0.974 -13.203 1.00 0.00 C ATOM 1646 O LYS A 107 -13.967 2.040 -13.442 1.00 0.00 O ATOM 1647 CB LYS A 107 -15.505 -0.260 -13.756 1.00 0.00 C ATOM 1648 CG LYS A 107 -16.030 0.464 -14.984 1.00 0.00 C ATOM 1649 CD LYS A 107 -17.500 0.163 -15.222 1.00 0.00 C ATOM 1650 CE LYS A 107 -18.390 0.941 -14.264 1.00 0.00 C ATOM 1651 NZ LYS A 107 -18.248 2.412 -14.446 1.00 0.00 N ATOM 0 H LYS A 107 -14.049 -1.497 -11.953 1.00 0.00 H new ATOM 0 HA LYS A 107 -13.597 -0.534 -14.708 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -15.919 -1.268 -13.734 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -15.862 0.251 -12.862 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -15.893 1.538 -14.861 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -15.451 0.167 -15.858 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -17.762 0.414 -16.250 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -17.678 -0.905 -15.100 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -19.430 0.654 -14.421 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -18.137 0.676 -13.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -19.093 2.891 -14.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -17.408 2.746 -13.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -18.144 2.628 -15.458 1.00 0.00 H new ATOM 1665 N ILE A 108 -12.269 0.895 -12.511 1.00 0.00 N ATOM 1666 CA ILE A 108 -11.615 2.084 -11.980 1.00 0.00 C ATOM 1667 C ILE A 108 -10.097 1.965 -12.075 1.00 0.00 C ATOM 1668 O ILE A 108 -9.543 0.871 -11.982 1.00 0.00 O ATOM 1669 CB ILE A 108 -12.007 2.335 -10.512 1.00 0.00 C ATOM 1670 CG1 ILE A 108 -11.659 1.117 -9.652 1.00 0.00 C ATOM 1671 CG2 ILE A 108 -13.490 2.657 -10.408 1.00 0.00 C ATOM 1672 CD1 ILE A 108 -11.421 1.454 -8.197 1.00 0.00 C ATOM 0 H ILE A 108 -11.787 0.020 -12.305 1.00 0.00 H new ATOM 0 HA ILE A 108 -11.951 2.925 -12.586 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.442 3.191 -10.142 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -12.469 0.390 -9.721 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -10.767 0.639 -10.057 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -13.752 2.832 -9.365 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -13.710 3.551 -10.992 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -14.072 1.820 -10.793 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -11.179 0.544 -7.648 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -10.592 2.157 -8.117 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -12.320 1.904 -7.776 1.00 0.00 H new ATOM 1684 N ALA A 109 -9.430 3.100 -12.259 1.00 0.00 N ATOM 1685 CA ALA A 109 -7.977 3.124 -12.363 1.00 0.00 C ATOM 1686 C ALA A 109 -7.348 3.757 -11.126 1.00 0.00 C ATOM 1687 O ALA A 109 -8.044 4.090 -10.167 1.00 0.00 O ATOM 1688 CB ALA A 109 -7.549 3.872 -13.617 1.00 0.00 C ATOM 0 H ALA A 109 -9.874 4.015 -12.339 1.00 0.00 H new ATOM 0 HA ALA A 109 -7.626 2.094 -12.430 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -6.461 3.882 -13.681 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -7.960 3.375 -14.495 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -7.919 4.896 -13.574 1.00 0.00 H new ATOM 1694 N GLU A 110 -6.029 3.919 -11.155 1.00 0.00 N ATOM 1695 CA GLU A 110 -5.308 4.511 -10.034 1.00 0.00 C ATOM 1696 C GLU A 110 -5.943 5.834 -9.617 1.00 0.00 C ATOM 1697 O GLU A 110 -6.356 6.002 -8.469 1.00 0.00 O ATOM 1698 CB GLU A 110 -3.839 4.732 -10.403 1.00 0.00 C ATOM 1699 CG GLU A 110 -3.071 5.550 -9.379 1.00 0.00 C ATOM 1700 CD GLU A 110 -1.623 5.767 -9.774 1.00 0.00 C ATOM 1701 OE1 GLU A 110 -1.382 6.396 -10.825 1.00 0.00 O ATOM 1702 OE2 GLU A 110 -0.731 5.306 -9.030 1.00 0.00 O ATOM 0 H GLU A 110 -5.438 3.649 -11.942 1.00 0.00 H new ATOM 0 HA GLU A 110 -5.364 3.820 -9.193 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -3.353 3.763 -10.520 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -3.787 5.234 -11.369 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -3.558 6.517 -9.252 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -3.109 5.045 -8.414 1.00 0.00 H new ATOM 1709 N VAL A 111 -6.017 6.772 -10.557 1.00 0.00 N ATOM 1710 CA VAL A 111 -6.602 8.080 -10.288 1.00 0.00 C ATOM 1711 C VAL A 111 -7.994 7.945 -9.679 1.00 0.00 C ATOM 1712 O VAL A 111 -8.340 8.653 -8.734 1.00 0.00 O ATOM 1713 CB VAL A 111 -6.695 8.928 -11.570 1.00 0.00 C ATOM 1714 CG1 VAL A 111 -7.418 8.161 -12.666 1.00 0.00 C ATOM 1715 CG2 VAL A 111 -7.391 10.249 -11.285 1.00 0.00 C ATOM 0 H VAL A 111 -5.679 6.650 -11.512 1.00 0.00 H new ATOM 0 HA VAL A 111 -5.944 8.580 -9.577 1.00 0.00 H new ATOM 0 HB VAL A 111 -5.684 9.143 -11.916 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -7.474 8.776 -13.564 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -6.873 7.243 -12.888 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -8.426 7.913 -12.333 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -7.448 10.836 -12.202 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -8.398 10.057 -10.914 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.827 10.803 -10.535 1.00 0.00 H new ATOM 1725 N GLU A 112 -8.787 7.030 -10.228 1.00 0.00 N ATOM 1726 CA GLU A 112 -10.143 6.803 -9.738 1.00 0.00 C ATOM 1727 C GLU A 112 -10.131 6.434 -8.259 1.00 0.00 C ATOM 1728 O GLU A 112 -10.915 6.962 -7.469 1.00 0.00 O ATOM 1729 CB GLU A 112 -10.821 5.696 -10.547 1.00 0.00 C ATOM 1730 CG GLU A 112 -11.202 6.117 -11.957 1.00 0.00 C ATOM 1731 CD GLU A 112 -12.005 7.404 -11.984 1.00 0.00 C ATOM 1732 OE1 GLU A 112 -13.109 7.426 -11.401 1.00 0.00 O ATOM 1733 OE2 GLU A 112 -11.530 8.388 -12.588 1.00 0.00 O ATOM 0 H GLU A 112 -8.515 6.435 -11.011 1.00 0.00 H new ATOM 0 HA GLU A 112 -10.707 7.728 -9.859 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -10.153 4.837 -10.602 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -11.717 5.370 -10.020 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -10.297 6.245 -12.551 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -11.781 5.322 -12.426 1.00 0.00 H new ATOM 1740 N LEU A 113 -9.238 5.522 -7.889 1.00 0.00 N ATOM 1741 CA LEU A 113 -9.124 5.079 -6.504 1.00 0.00 C ATOM 1742 C LEU A 113 -8.624 6.210 -5.611 1.00 0.00 C ATOM 1743 O LEU A 113 -9.063 6.354 -4.470 1.00 0.00 O ATOM 1744 CB LEU A 113 -8.179 3.881 -6.407 1.00 0.00 C ATOM 1745 CG LEU A 113 -7.545 3.635 -5.037 1.00 0.00 C ATOM 1746 CD1 LEU A 113 -7.391 2.144 -4.780 1.00 0.00 C ATOM 1747 CD2 LEU A 113 -6.199 4.337 -4.938 1.00 0.00 C ATOM 0 H LEU A 113 -8.582 5.075 -8.530 1.00 0.00 H new ATOM 0 HA LEU A 113 -10.115 4.780 -6.161 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -8.729 2.986 -6.697 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -7.380 4.014 -7.136 1.00 0.00 H new ATOM 0 HG LEU A 113 -8.204 4.048 -4.274 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -6.938 1.988 -3.801 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -8.371 1.667 -4.807 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -6.753 1.706 -5.548 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -5.763 4.151 -3.957 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -5.532 3.955 -5.710 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -6.337 5.409 -5.076 1.00 0.00 H new ATOM 1759 N ILE A 114 -7.703 7.010 -6.138 1.00 0.00 N ATOM 1760 CA ILE A 114 -7.147 8.131 -5.390 1.00 0.00 C ATOM 1761 C ILE A 114 -8.137 9.287 -5.311 1.00 0.00 C ATOM 1762 O ILE A 114 -8.024 10.157 -4.450 1.00 0.00 O ATOM 1763 CB ILE A 114 -5.836 8.634 -6.022 1.00 0.00 C ATOM 1764 CG1 ILE A 114 -4.821 7.493 -6.122 1.00 0.00 C ATOM 1765 CG2 ILE A 114 -5.265 9.788 -5.212 1.00 0.00 C ATOM 1766 CD1 ILE A 114 -3.639 7.810 -7.011 1.00 0.00 C ATOM 0 H ILE A 114 -7.326 6.903 -7.080 1.00 0.00 H new ATOM 0 HA ILE A 114 -6.940 7.766 -4.384 1.00 0.00 H new ATOM 0 HB ILE A 114 -6.051 8.994 -7.028 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -4.459 7.251 -5.123 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -5.323 6.604 -6.503 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -4.339 10.132 -5.672 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -5.984 10.607 -5.188 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -5.063 9.453 -4.195 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -2.962 6.956 -7.034 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -3.990 8.022 -8.021 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -3.112 8.680 -6.619 1.00 0.00 H new ATOM 1778 N ASN A 115 -9.109 9.289 -6.219 1.00 0.00 N ATOM 1779 CA ASN A 115 -10.121 10.338 -6.252 1.00 0.00 C ATOM 1780 C ASN A 115 -11.392 9.891 -5.535 1.00 0.00 C ATOM 1781 O ASN A 115 -12.210 10.715 -5.127 1.00 0.00 O ATOM 1782 CB ASN A 115 -10.444 10.718 -7.698 1.00 0.00 C ATOM 1783 CG ASN A 115 -9.449 11.708 -8.272 1.00 0.00 C ATOM 1784 OD1 ASN A 115 -8.325 11.829 -7.784 1.00 0.00 O ATOM 1785 ND2 ASN A 115 -9.858 12.421 -9.314 1.00 0.00 N ATOM 0 H ASN A 115 -9.216 8.576 -6.941 1.00 0.00 H new ATOM 0 HA ASN A 115 -9.722 11.210 -5.735 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -10.454 9.819 -8.314 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -11.445 11.146 -7.743 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -9.232 13.102 -9.743 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -10.798 12.288 -9.686 1.00 0.00 H new ATOM 1792 N VAL A 116 -11.550 8.579 -5.386 1.00 0.00 N ATOM 1793 CA VAL A 116 -12.720 8.022 -4.718 1.00 0.00 C ATOM 1794 C VAL A 116 -12.382 7.573 -3.301 1.00 0.00 C ATOM 1795 O VAL A 116 -12.959 8.061 -2.328 1.00 0.00 O ATOM 1796 CB VAL A 116 -13.297 6.827 -5.500 1.00 0.00 C ATOM 1797 CG1 VAL A 116 -14.457 6.201 -4.741 1.00 0.00 C ATOM 1798 CG2 VAL A 116 -13.732 7.261 -6.892 1.00 0.00 C ATOM 0 H VAL A 116 -10.883 7.883 -5.719 1.00 0.00 H new ATOM 0 HA VAL A 116 -13.468 8.814 -4.676 1.00 0.00 H new ATOM 0 HB VAL A 116 -12.516 6.074 -5.606 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -14.851 5.359 -5.309 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -14.109 5.852 -3.769 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -15.243 6.943 -4.600 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -14.137 6.404 -7.430 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -14.497 8.033 -6.810 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -12.874 7.657 -7.434 1.00 0.00 H new ATOM 1808 N LEU A 117 -11.443 6.640 -3.191 1.00 0.00 N ATOM 1809 CA LEU A 117 -11.026 6.123 -1.892 1.00 0.00 C ATOM 1810 C LEU A 117 -10.083 7.099 -1.196 1.00 0.00 C ATOM 1811 O LEU A 117 -9.922 7.062 0.024 1.00 0.00 O ATOM 1812 CB LEU A 117 -10.342 4.765 -2.055 1.00 0.00 C ATOM 1813 CG LEU A 117 -11.257 3.593 -2.412 1.00 0.00 C ATOM 1814 CD1 LEU A 117 -12.418 3.505 -1.434 1.00 0.00 C ATOM 1815 CD2 LEU A 117 -11.768 3.729 -3.839 1.00 0.00 C ATOM 0 H LEU A 117 -10.956 6.226 -3.986 1.00 0.00 H new ATOM 0 HA LEU A 117 -11.916 6.002 -1.275 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -9.580 4.855 -2.829 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -9.825 4.527 -1.125 1.00 0.00 H new ATOM 0 HG LEU A 117 -10.679 2.672 -2.342 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -13.058 2.665 -1.704 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -12.033 3.358 -0.425 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -12.996 4.428 -1.471 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -12.417 2.886 -4.075 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -12.329 4.658 -3.937 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -10.924 3.741 -4.528 1.00 0.00 H new ATOM 1827 N LYS A 118 -9.461 7.974 -1.980 1.00 0.00 N ATOM 1828 CA LYS A 118 -8.536 8.963 -1.439 1.00 0.00 C ATOM 1829 C LYS A 118 -7.319 8.287 -0.817 1.00 0.00 C ATOM 1830 O LYS A 118 -6.855 8.685 0.252 1.00 0.00 O ATOM 1831 CB LYS A 118 -9.239 9.833 -0.394 1.00 0.00 C ATOM 1832 CG LYS A 118 -10.588 10.360 -0.850 1.00 0.00 C ATOM 1833 CD LYS A 118 -11.195 11.300 0.176 1.00 0.00 C ATOM 1834 CE LYS A 118 -11.998 10.542 1.222 1.00 0.00 C ATOM 1835 NZ LYS A 118 -12.027 11.259 2.527 1.00 0.00 N ATOM 0 H LYS A 118 -9.581 8.018 -2.992 1.00 0.00 H new ATOM 0 HA LYS A 118 -8.199 9.595 -2.261 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -9.375 9.252 0.518 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -8.595 10.676 -0.142 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -10.473 10.882 -1.800 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -11.266 9.524 -1.025 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -10.403 11.867 0.665 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -11.840 12.021 -0.326 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -13.017 10.399 0.864 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -11.567 9.551 1.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -12.584 10.710 3.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -11.056 11.373 2.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -12.461 12.195 2.399 1.00 0.00 H new ATOM 1849 N ILE A 119 -6.805 7.264 -1.492 1.00 0.00 N ATOM 1850 CA ILE A 119 -5.640 6.535 -1.007 1.00 0.00 C ATOM 1851 C ILE A 119 -4.347 7.204 -1.456 1.00 0.00 C ATOM 1852 O ILE A 119 -4.023 7.219 -2.643 1.00 0.00 O ATOM 1853 CB ILE A 119 -5.647 5.075 -1.494 1.00 0.00 C ATOM 1854 CG1 ILE A 119 -7.004 4.427 -1.215 1.00 0.00 C ATOM 1855 CG2 ILE A 119 -4.531 4.288 -0.824 1.00 0.00 C ATOM 1856 CD1 ILE A 119 -7.078 2.974 -1.635 1.00 0.00 C ATOM 0 H ILE A 119 -7.178 6.921 -2.377 1.00 0.00 H new ATOM 0 HA ILE A 119 -5.692 6.546 0.082 1.00 0.00 H new ATOM 0 HB ILE A 119 -5.476 5.066 -2.571 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -7.220 4.500 -0.149 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -7.780 4.988 -1.737 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -4.549 3.257 -1.179 1.00 0.00 H new ATOM 0 HG22 ILE A 119 -3.570 4.739 -1.069 1.00 0.00 H new ATOM 0 HG23 ILE A 119 -4.674 4.302 0.257 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -8.068 2.579 -1.407 1.00 0.00 H new ATOM 0 HD12 ILE A 119 -6.893 2.895 -2.706 1.00 0.00 H new ATOM 0 HD13 ILE A 119 -6.326 2.400 -1.094 1.00 0.00 H new ATOM 1868 N ASN A 120 -3.608 7.755 -0.498 1.00 0.00 N ATOM 1869 CA ASN A 120 -2.347 8.425 -0.795 1.00 0.00 C ATOM 1870 C ASN A 120 -1.161 7.579 -0.342 1.00 0.00 C ATOM 1871 O ASN A 120 -0.101 7.589 -0.968 1.00 0.00 O ATOM 1872 CB ASN A 120 -2.300 9.795 -0.114 1.00 0.00 C ATOM 1873 CG ASN A 120 -3.214 10.804 -0.783 1.00 0.00 C ATOM 1874 OD1 ASN A 120 -4.425 10.601 -0.868 1.00 0.00 O ATOM 1875 ND2 ASN A 120 -2.635 11.899 -1.262 1.00 0.00 N ATOM 0 H ASN A 120 -3.861 7.751 0.490 1.00 0.00 H new ATOM 0 HA ASN A 120 -2.282 8.561 -1.875 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -2.586 9.688 0.932 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -1.277 10.170 -0.128 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -3.198 12.614 -1.723 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -1.627 12.025 -1.169 1.00 0.00 H new ATOM 1882 N LEU A 121 -1.348 6.846 0.751 1.00 0.00 N ATOM 1883 CA LEU A 121 -0.294 5.993 1.289 1.00 0.00 C ATOM 1884 C LEU A 121 0.210 5.017 0.230 1.00 0.00 C ATOM 1885 O LEU A 121 -0.580 4.361 -0.450 1.00 0.00 O ATOM 1886 CB LEU A 121 -0.807 5.222 2.506 1.00 0.00 C ATOM 1887 CG LEU A 121 0.256 4.755 3.502 1.00 0.00 C ATOM 1888 CD1 LEU A 121 1.104 5.928 3.966 1.00 0.00 C ATOM 1889 CD2 LEU A 121 -0.394 4.061 4.689 1.00 0.00 C ATOM 0 H LEU A 121 -2.219 6.826 1.281 1.00 0.00 H new ATOM 0 HA LEU A 121 0.536 6.631 1.594 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -1.521 5.853 3.036 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -1.354 4.348 2.153 1.00 0.00 H new ATOM 0 HG LEU A 121 0.907 4.039 3.001 1.00 0.00 H new ATOM 0 HD11 LEU A 121 1.855 5.577 4.674 1.00 0.00 H new ATOM 0 HD12 LEU A 121 1.599 6.381 3.107 1.00 0.00 H new ATOM 0 HD13 LEU A 121 0.467 6.668 4.450 1.00 0.00 H new ATOM 0 HD21 LEU A 121 0.377 3.735 5.387 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -1.069 4.754 5.191 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -0.957 3.195 4.341 1.00 0.00 H new ATOM 1901 N ILE A 122 1.529 4.925 0.097 1.00 0.00 N ATOM 1902 CA ILE A 122 2.137 4.027 -0.875 1.00 0.00 C ATOM 1903 C ILE A 122 1.758 2.577 -0.598 1.00 0.00 C ATOM 1904 O ILE A 122 1.171 1.905 -1.446 1.00 0.00 O ATOM 1905 CB ILE A 122 3.673 4.153 -0.874 1.00 0.00 C ATOM 1906 CG1 ILE A 122 4.090 5.574 -1.261 1.00 0.00 C ATOM 1907 CG2 ILE A 122 4.288 3.137 -1.826 1.00 0.00 C ATOM 1908 CD1 ILE A 122 5.589 5.778 -1.281 1.00 0.00 C ATOM 0 H ILE A 122 2.197 5.462 0.651 1.00 0.00 H new ATOM 0 HA ILE A 122 1.756 4.318 -1.854 1.00 0.00 H new ATOM 0 HB ILE A 122 4.039 3.948 0.132 1.00 0.00 H new ATOM 0 HG12 ILE A 122 3.686 5.807 -2.246 1.00 0.00 H new ATOM 0 HG13 ILE A 122 3.645 6.279 -0.559 1.00 0.00 H new ATOM 0 HG21 ILE A 122 5.373 3.238 -1.815 1.00 0.00 H new ATOM 0 HG22 ILE A 122 4.014 2.130 -1.510 1.00 0.00 H new ATOM 0 HG23 ILE A 122 3.918 3.314 -2.836 1.00 0.00 H new ATOM 0 HD11 ILE A 122 5.812 6.807 -1.563 1.00 0.00 H new ATOM 0 HD12 ILE A 122 5.997 5.577 -0.290 1.00 0.00 H new ATOM 0 HD13 ILE A 122 6.039 5.098 -2.004 1.00 0.00 H new ATOM 1920 N GLY A 123 2.094 2.101 0.597 1.00 0.00 N ATOM 1921 CA GLY A 123 1.779 0.733 0.967 1.00 0.00 C ATOM 1922 C GLY A 123 0.350 0.356 0.629 1.00 0.00 C ATOM 1923 O GLY A 123 0.111 -0.546 -0.174 1.00 0.00 O ATOM 0 H GLY A 123 2.579 2.638 1.316 1.00 0.00 H new ATOM 0 HA2 GLY A 123 2.461 0.055 0.455 1.00 0.00 H new ATOM 0 HA3 GLY A 123 1.943 0.602 2.037 1.00 0.00 H new ATOM 1927 N HIS A 124 -0.603 1.048 1.245 1.00 0.00 N ATOM 1928 CA HIS A 124 -2.018 0.780 1.006 1.00 0.00 C ATOM 1929 C HIS A 124 -2.340 0.853 -0.483 1.00 0.00 C ATOM 1930 O HIS A 124 -2.814 -0.117 -1.075 1.00 0.00 O ATOM 1931 CB HIS A 124 -2.885 1.776 1.777 1.00 0.00 C ATOM 1932 CG HIS A 124 -2.727 1.681 3.264 1.00 0.00 C ATOM 1933 ND1 HIS A 124 -3.531 2.365 4.151 1.00 0.00 N ATOM 1934 CD2 HIS A 124 -1.853 0.974 4.018 1.00 0.00 C ATOM 1935 CE1 HIS A 124 -3.157 2.085 5.387 1.00 0.00 C ATOM 1936 NE2 HIS A 124 -2.141 1.243 5.334 1.00 0.00 N ATOM 0 H HIS A 124 -0.422 1.798 1.913 1.00 0.00 H new ATOM 0 HA HIS A 124 -2.236 -0.228 1.358 1.00 0.00 H new ATOM 0 HB2 HIS A 124 -2.634 2.787 1.457 1.00 0.00 H new ATOM 0 HB3 HIS A 124 -3.931 1.610 1.520 1.00 0.00 H new ATOM 0 HD2 HIS A 124 -1.075 0.320 3.653 1.00 0.00 H new ATOM 0 HE1 HIS A 124 -3.606 2.478 6.287 1.00 0.00 H new ATOM 0 HE2 HIS A 124 -1.650 0.855 6.139 1.00 0.00 H new ATOM 1944 N ARG A 125 -2.082 2.010 -1.084 1.00 0.00 N ATOM 1945 CA ARG A 125 -2.347 2.211 -2.503 1.00 0.00 C ATOM 1946 C ARG A 125 -1.824 1.037 -3.325 1.00 0.00 C ATOM 1947 O ARG A 125 -2.593 0.324 -3.970 1.00 0.00 O ATOM 1948 CB ARG A 125 -1.704 3.513 -2.986 1.00 0.00 C ATOM 1949 CG ARG A 125 -1.822 3.731 -4.484 1.00 0.00 C ATOM 1950 CD ARG A 125 -0.606 3.196 -5.224 1.00 0.00 C ATOM 1951 NE ARG A 125 -0.115 4.139 -6.226 1.00 0.00 N ATOM 1952 CZ ARG A 125 0.727 5.129 -5.953 1.00 0.00 C ATOM 1953 NH1 ARG A 125 1.171 5.305 -4.716 1.00 0.00 N ATOM 1954 NH2 ARG A 125 1.127 5.947 -6.919 1.00 0.00 N ATOM 0 H ARG A 125 -1.689 2.823 -0.609 1.00 0.00 H new ATOM 0 HA ARG A 125 -3.427 2.276 -2.639 1.00 0.00 H new ATOM 0 HB2 ARG A 125 -2.169 4.352 -2.468 1.00 0.00 H new ATOM 0 HB3 ARG A 125 -0.650 3.512 -2.710 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -2.721 3.238 -4.855 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -1.935 4.795 -4.690 1.00 0.00 H new ATOM 0 HD2 ARG A 125 0.188 2.981 -4.509 1.00 0.00 H new ATOM 0 HD3 ARG A 125 -0.862 2.254 -5.708 1.00 0.00 H new ATOM 0 HE ARG A 125 -0.437 4.031 -7.188 1.00 0.00 H new ATOM 0 HH11 ARG A 125 0.866 4.679 -3.971 1.00 0.00 H new ATOM 0 HH12 ARG A 125 1.818 6.066 -4.510 1.00 0.00 H new ATOM 0 HH21 ARG A 125 0.788 5.815 -7.872 1.00 0.00 H new ATOM 0 HH22 ARG A 125 1.774 6.707 -6.708 1.00 0.00 H new ATOM 1968 N LYS A 126 -0.509 0.842 -3.298 1.00 0.00 N ATOM 1969 CA LYS A 126 0.119 -0.245 -4.039 1.00 0.00 C ATOM 1970 C LYS A 126 -0.591 -1.569 -3.770 1.00 0.00 C ATOM 1971 O LYS A 126 -0.765 -2.385 -4.675 1.00 0.00 O ATOM 1972 CB LYS A 126 1.597 -0.361 -3.659 1.00 0.00 C ATOM 1973 CG LYS A 126 2.521 -0.520 -4.854 1.00 0.00 C ATOM 1974 CD LYS A 126 2.618 0.766 -5.658 1.00 0.00 C ATOM 1975 CE LYS A 126 2.582 0.492 -7.153 1.00 0.00 C ATOM 1976 NZ LYS A 126 3.951 0.394 -7.732 1.00 0.00 N ATOM 0 H LYS A 126 0.142 1.423 -2.770 1.00 0.00 H new ATOM 0 HA LYS A 126 0.040 -0.020 -5.102 1.00 0.00 H new ATOM 0 HB2 LYS A 126 1.890 0.527 -3.099 1.00 0.00 H new ATOM 0 HB3 LYS A 126 1.727 -1.215 -2.994 1.00 0.00 H new ATOM 0 HG2 LYS A 126 3.514 -0.812 -4.511 1.00 0.00 H new ATOM 0 HG3 LYS A 126 2.156 -1.323 -5.493 1.00 0.00 H new ATOM 0 HD2 LYS A 126 1.795 1.428 -5.388 1.00 0.00 H new ATOM 0 HD3 LYS A 126 3.542 1.286 -5.404 1.00 0.00 H new ATOM 0 HE2 LYS A 126 2.042 -0.436 -7.339 1.00 0.00 H new ATOM 0 HE3 LYS A 126 2.031 1.288 -7.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 4.171 1.267 -8.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 4.643 0.263 -6.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 3.996 -0.417 -8.382 1.00 0.00 H new ATOM 1990 N ARG A 127 -1.000 -1.772 -2.522 1.00 0.00 N ATOM 1991 CA ARG A 127 -1.692 -2.997 -2.136 1.00 0.00 C ATOM 1992 C ARG A 127 -2.966 -3.182 -2.954 1.00 0.00 C ATOM 1993 O ARG A 127 -3.180 -4.234 -3.558 1.00 0.00 O ATOM 1994 CB ARG A 127 -2.030 -2.967 -0.644 1.00 0.00 C ATOM 1995 CG ARG A 127 -1.781 -4.290 0.062 1.00 0.00 C ATOM 1996 CD ARG A 127 -0.302 -4.641 0.083 1.00 0.00 C ATOM 1997 NE ARG A 127 0.062 -5.543 -1.007 1.00 0.00 N ATOM 1998 CZ ARG A 127 0.009 -6.867 -0.913 1.00 0.00 C ATOM 1999 NH1 ARG A 127 -0.390 -7.440 0.214 1.00 0.00 N ATOM 2000 NH2 ARG A 127 0.356 -7.620 -1.949 1.00 0.00 N ATOM 0 H ARG A 127 -0.865 -1.106 -1.762 1.00 0.00 H new ATOM 0 HA ARG A 127 -1.028 -3.839 -2.335 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -1.438 -2.190 -0.161 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -3.078 -2.691 -0.523 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -2.157 -4.235 1.083 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -2.337 -5.082 -0.440 1.00 0.00 H new ATOM 0 HD2 ARG A 127 0.288 -3.728 0.010 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -0.053 -5.106 1.037 1.00 0.00 H new ATOM 0 HE ARG A 127 0.374 -5.134 -1.888 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -0.657 -6.864 1.012 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -0.430 -8.457 0.283 1.00 0.00 H new ATOM 0 HH21 ARG A 127 0.663 -7.182 -2.817 1.00 0.00 H new ATOM 0 HH22 ARG A 127 0.315 -8.637 -1.877 1.00 0.00 H new ATOM 2014 N ILE A 128 -3.810 -2.155 -2.968 1.00 0.00 N ATOM 2015 CA ILE A 128 -5.062 -2.205 -3.711 1.00 0.00 C ATOM 2016 C ILE A 128 -4.809 -2.390 -5.204 1.00 0.00 C ATOM 2017 O ILE A 128 -5.290 -3.345 -5.813 1.00 0.00 O ATOM 2018 CB ILE A 128 -5.895 -0.927 -3.497 1.00 0.00 C ATOM 2019 CG1 ILE A 128 -5.955 -0.575 -2.009 1.00 0.00 C ATOM 2020 CG2 ILE A 128 -7.296 -1.109 -4.061 1.00 0.00 C ATOM 2021 CD1 ILE A 128 -6.438 -1.712 -1.138 1.00 0.00 C ATOM 0 H ILE A 128 -3.648 -1.278 -2.473 1.00 0.00 H new ATOM 0 HA ILE A 128 -5.620 -3.061 -3.331 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.415 -0.104 -4.026 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -4.963 -0.269 -1.676 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -6.615 0.282 -1.873 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -7.873 -0.198 -3.903 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -7.234 -1.318 -5.129 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -7.786 -1.941 -3.556 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -6.455 -1.391 -0.097 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -7.443 -2.004 -1.444 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -5.765 -2.563 -1.244 1.00 0.00 H new ATOM 2033 N LEU A 129 -4.048 -1.469 -5.786 1.00 0.00 N ATOM 2034 CA LEU A 129 -3.727 -1.530 -7.208 1.00 0.00 C ATOM 2035 C LEU A 129 -3.176 -2.902 -7.584 1.00 0.00 C ATOM 2036 O LEU A 129 -3.703 -3.571 -8.472 1.00 0.00 O ATOM 2037 CB LEU A 129 -2.714 -0.444 -7.570 1.00 0.00 C ATOM 2038 CG LEU A 129 -3.294 0.861 -8.115 1.00 0.00 C ATOM 2039 CD1 LEU A 129 -3.714 1.776 -6.976 1.00 0.00 C ATOM 2040 CD2 LEU A 129 -2.285 1.558 -9.016 1.00 0.00 C ATOM 0 H LEU A 129 -3.642 -0.672 -5.296 1.00 0.00 H new ATOM 0 HA LEU A 129 -4.646 -1.362 -7.770 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -2.126 -0.214 -6.682 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -2.026 -0.850 -8.312 1.00 0.00 H new ATOM 0 HG LEU A 129 -4.178 0.623 -8.707 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -4.124 2.700 -7.384 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -4.472 1.279 -6.370 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -2.848 2.006 -6.356 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -2.715 2.485 -9.395 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -1.383 1.782 -8.447 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -2.033 0.906 -9.853 1.00 0.00 H new ATOM 2052 N ALA A 130 -2.114 -3.314 -6.900 1.00 0.00 N ATOM 2053 CA ALA A 130 -1.494 -4.608 -7.158 1.00 0.00 C ATOM 2054 C ALA A 130 -2.517 -5.735 -7.066 1.00 0.00 C ATOM 2055 O ALA A 130 -2.547 -6.630 -7.911 1.00 0.00 O ATOM 2056 CB ALA A 130 -0.350 -4.849 -6.184 1.00 0.00 C ATOM 0 H ALA A 130 -1.665 -2.771 -6.163 1.00 0.00 H new ATOM 0 HA ALA A 130 -1.096 -4.597 -8.173 1.00 0.00 H new ATOM 0 HB1 ALA A 130 0.104 -5.819 -6.388 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.399 -4.066 -6.302 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -0.732 -4.835 -5.163 1.00 0.00 H new ATOM 2062 N SER A 131 -3.352 -5.687 -6.033 1.00 0.00 N ATOM 2063 CA SER A 131 -4.374 -6.707 -5.828 1.00 0.00 C ATOM 2064 C SER A 131 -5.256 -6.849 -7.064 1.00 0.00 C ATOM 2065 O SER A 131 -5.374 -7.932 -7.637 1.00 0.00 O ATOM 2066 CB SER A 131 -5.233 -6.361 -4.610 1.00 0.00 C ATOM 2067 OG SER A 131 -6.546 -6.876 -4.749 1.00 0.00 O ATOM 0 H SER A 131 -3.341 -4.953 -5.325 1.00 0.00 H new ATOM 0 HA SER A 131 -3.872 -7.658 -5.651 1.00 0.00 H new ATOM 0 HB2 SER A 131 -4.773 -6.768 -3.709 1.00 0.00 H new ATOM 0 HB3 SER A 131 -5.275 -5.279 -4.486 1.00 0.00 H new ATOM 0 HG SER A 131 -7.182 -6.273 -4.311 1.00 0.00 H new ATOM 2073 N LEU A 132 -5.876 -5.746 -7.469 1.00 0.00 N ATOM 2074 CA LEU A 132 -6.750 -5.744 -8.637 1.00 0.00 C ATOM 2075 C LEU A 132 -5.981 -6.148 -9.892 1.00 0.00 C ATOM 2076 O LEU A 132 -6.441 -6.979 -10.674 1.00 0.00 O ATOM 2077 CB LEU A 132 -7.374 -4.361 -8.831 1.00 0.00 C ATOM 2078 CG LEU A 132 -8.588 -4.046 -7.956 1.00 0.00 C ATOM 2079 CD1 LEU A 132 -9.056 -2.617 -8.188 1.00 0.00 C ATOM 2080 CD2 LEU A 132 -9.716 -5.029 -8.235 1.00 0.00 C ATOM 0 H LEU A 132 -5.790 -4.841 -7.006 1.00 0.00 H new ATOM 0 HA LEU A 132 -7.543 -6.472 -8.468 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -6.609 -3.609 -8.641 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -7.668 -4.260 -9.876 1.00 0.00 H new ATOM 0 HG LEU A 132 -8.295 -4.147 -6.911 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -9.921 -2.410 -7.557 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -8.251 -1.926 -7.939 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -9.332 -2.490 -9.235 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -10.572 -4.790 -7.604 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -10.008 -4.960 -9.283 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -9.377 -6.042 -8.019 1.00 0.00 H new ATOM 2092 N GLY A 133 -4.807 -5.552 -10.078 1.00 0.00 N ATOM 2093 CA GLY A 133 -3.992 -5.864 -11.238 1.00 0.00 C ATOM 2094 C GLY A 133 -4.404 -5.074 -12.464 1.00 0.00 C ATOM 2095 O GLY A 133 -4.416 -5.602 -13.575 1.00 0.00 O ATOM 0 H GLY A 133 -4.406 -4.859 -9.446 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -2.946 -5.657 -11.010 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -4.066 -6.930 -11.454 1.00 0.00 H new ATOM 2099 N ASP A 134 -4.743 -3.805 -12.262 1.00 0.00 N ATOM 2100 CA ASP A 134 -5.159 -2.941 -13.360 1.00 0.00 C ATOM 2101 C ASP A 134 -3.948 -2.354 -14.079 1.00 0.00 C ATOM 2102 O ASP A 134 -2.825 -2.418 -13.577 1.00 0.00 O ATOM 2103 CB ASP A 134 -6.054 -1.814 -12.841 1.00 0.00 C ATOM 2104 CG ASP A 134 -7.048 -1.338 -13.882 1.00 0.00 C ATOM 2105 OD1 ASP A 134 -7.830 -2.175 -14.382 1.00 0.00 O ATOM 2106 OD2 ASP A 134 -7.046 -0.130 -14.195 1.00 0.00 O ATOM 0 H ASP A 134 -4.738 -3.352 -11.348 1.00 0.00 H new ATOM 0 HA ASP A 134 -5.724 -3.545 -14.070 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -6.593 -2.159 -11.959 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -5.432 -0.976 -12.527 1.00 0.00 H new ATOM 2111 N ARG A 135 -4.182 -1.784 -15.256 1.00 0.00 N ATOM 2112 CA ARG A 135 -3.110 -1.189 -16.043 1.00 0.00 C ATOM 2113 C ARG A 135 -3.623 0.001 -16.850 1.00 0.00 C ATOM 2114 O ARG A 135 -4.616 -0.107 -17.569 1.00 0.00 O ATOM 2115 CB ARG A 135 -2.500 -2.229 -16.984 1.00 0.00 C ATOM 2116 CG ARG A 135 -2.007 -3.479 -16.271 1.00 0.00 C ATOM 2117 CD ARG A 135 -1.465 -4.503 -17.256 1.00 0.00 C ATOM 2118 NE ARG A 135 -0.544 -3.904 -18.218 1.00 0.00 N ATOM 2119 CZ ARG A 135 -0.204 -4.480 -19.366 1.00 0.00 C ATOM 2120 NH1 ARG A 135 -0.706 -5.662 -19.694 1.00 0.00 N ATOM 2121 NH2 ARG A 135 0.641 -3.872 -20.189 1.00 0.00 N ATOM 0 H ARG A 135 -5.105 -1.722 -15.686 1.00 0.00 H new ATOM 0 HA ARG A 135 -2.342 -0.837 -15.354 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -3.244 -2.514 -17.728 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -1.668 -1.776 -17.523 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -1.228 -3.210 -15.558 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -2.824 -3.919 -15.699 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -0.954 -5.296 -16.710 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -2.295 -4.967 -17.789 1.00 0.00 H new ATOM 0 HE ARG A 135 -0.140 -2.994 -17.997 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -1.356 -6.133 -19.064 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -0.443 -6.101 -20.576 1.00 0.00 H new ATOM 0 HH21 ARG A 135 1.030 -2.962 -19.940 1.00 0.00 H new ATOM 0 HH22 ARG A 135 0.902 -4.314 -21.070 1.00 0.00 H new TER 2135 ARG A 135