USER MOD reduce.3.24.130724 H: found=0, std=0, add=1074, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1079 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 109 HIS : no HE2:sc= 1.95 K(o=3.1,f=-13!) USER MOD Set 1.2: A 147 SER OG : rot -167:sc= 1.12 USER MOD Set 2.1: A 58 GLN : amide:sc= 0.214 K(o=-2.5,f=-0.022) USER MOD Set 2.2: A 62 GLN : amide:sc= -2.74! K(o=-2.5!,f=0.084) USER MOD Set 3.1: A 15 ASN : amide:sc= -0.657 K(o=-1.1,f=-5.5!) USER MOD Set 3.2: A 63 THR OG1 : rot -92:sc= -0.457 USER MOD Single : A 9 LYS NZ :NH3+ -172:sc= 1.29 (180deg=1.19) USER MOD Single : A 20 SER OG : rot 180:sc= 0.539 USER MOD Single : A 21 HIS : no HE2:sc= -8.42! C(o=-8.4!,f=-3.7!) USER MOD Single : A 25 HIS : no HD1:sc= -0.605 K(o=-0.6,f=0.047) USER MOD Single : A 28 HIS : no HD1:sc= -0.285 K(o=-0.28,f=-3.3!) USER MOD Single : A 29 TYR OH : rot 100:sc= -1.2 USER MOD Single : A 31 LYS NZ :NH3+ 145:sc= 0.815 (180deg=-0.878) USER MOD Single : A 53 SER OG : rot -93:sc= 0.668 USER MOD Single : A 54 ASN : amide:sc= -1.19! C(o=-1.2!,f=-3.6!) USER MOD Single : A 61 TYR OH : rot 148:sc= 0.0223 USER MOD Single : A 70 SER OG : rot -140:sc= 1.03 USER MOD Single : A 73 TYR OH : rot -85:sc= -2.88! USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot -63:sc= -2.59! USER MOD Single : A 88 LYS NZ :NH3+ 168:sc= 1.21 (180deg=1.05) USER MOD Single : A 107 ASN : amide:sc= -0.558 X(o=-0.56,f=-0.64) USER MOD Single : A 110 THR OG1 : rot 54:sc= 0.0721 USER MOD Single : A 113 LYS NZ :NH3+ -147:sc=-0.00271 (180deg=-0.189) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0.429 USER MOD Single : A 125 THR OG1 : rot -60:sc= 1.23 USER MOD Single : A 127 HIS : no HD1:sc= -0.736 K(o=-0.74,f=-9.2!) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ -163:sc= -0.147 (180deg=-0.363) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 SER OG : rot 180:sc= -0.048 USER MOD Single : A 143 GLN : amide:sc= -0.926 K(o=-0.93,f=-2.3) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0 USER MOD Single : A 152 LYS NZ :NH3+ -178:sc= 0.0494 (180deg=0.0451) USER MOD Single : A 154 SER OG : rot 17:sc= 0.0321 USER MOD Single : A 159 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00269) USER MOD Single : A 168 CYS SG : rot -176:sc= -0.17 USER MOD Single : A 173 MET CE :methyl -130:sc= -4.4! (180deg=-5.75!) USER MOD Single : A 174 LYS NZ :NH3+ -113:sc= -0.0641 (180deg=-2.64!) USER MOD Single : A 176 THR OG1 : rot 180:sc= -0.273 USER MOD ----------------------------------------------------------------- ATOM 8 N LEU A 6 -10.070 13.117 3.851 1.00 0.72 N ATOM 9 CA LEU A 6 -9.654 11.740 3.639 1.00 0.55 C ATOM 10 C LEU A 6 -9.827 10.936 4.924 1.00 0.42 C ATOM 11 O LEU A 6 -10.127 9.740 4.893 1.00 0.36 O ATOM 12 CB LEU A 6 -8.195 11.703 3.176 1.00 0.53 C ATOM 13 CG LEU A 6 -7.652 10.319 2.823 1.00 0.44 C ATOM 14 CD1 LEU A 6 -8.464 9.695 1.701 1.00 0.52 C ATOM 15 CD2 LEU A 6 -6.186 10.403 2.434 1.00 0.47 C ATOM 0 HA LEU A 6 -10.278 11.293 2.865 1.00 0.55 H new ATOM 0 HB2 LEU A 6 -8.093 12.348 2.303 1.00 0.53 H new ATOM 0 HB3 LEU A 6 -7.572 12.129 3.962 1.00 0.53 H new ATOM 0 HG LEU A 6 -7.739 9.684 3.705 1.00 0.44 H new ATOM 0 HD11 LEU A 6 -8.061 8.710 1.465 1.00 0.52 H new ATOM 0 HD12 LEU A 6 -9.503 9.596 2.015 1.00 0.52 H new ATOM 0 HD13 LEU A 6 -8.411 10.330 0.817 1.00 0.52 H new ATOM 0 HD21 LEU A 6 -5.818 9.407 2.186 1.00 0.47 H new ATOM 0 HD22 LEU A 6 -6.076 11.056 1.569 1.00 0.47 H new ATOM 0 HD23 LEU A 6 -5.611 10.805 3.268 1.00 0.47 H new ATOM 27 N ALA A 7 -9.660 11.624 6.049 1.00 0.44 N ATOM 28 CA ALA A 7 -9.786 11.017 7.370 1.00 0.41 C ATOM 29 C ALA A 7 -11.185 10.456 7.604 1.00 0.39 C ATOM 30 O ALA A 7 -11.379 9.575 8.440 1.00 0.44 O ATOM 31 CB ALA A 7 -9.453 12.043 8.442 1.00 0.53 C ATOM 0 H ALA A 7 -9.433 12.618 6.071 1.00 0.44 H new ATOM 0 HA ALA A 7 -9.083 10.186 7.424 1.00 0.41 H new ATOM 0 HB1 ALA A 7 -9.549 11.585 9.426 1.00 0.53 H new ATOM 0 HB2 ALA A 7 -8.431 12.395 8.303 1.00 0.53 H new ATOM 0 HB3 ALA A 7 -10.141 12.885 8.366 1.00 0.53 H new ATOM 37 N ASP A 8 -12.156 10.973 6.871 1.00 0.41 N ATOM 38 CA ASP A 8 -13.540 10.555 7.035 1.00 0.48 C ATOM 39 C ASP A 8 -13.827 9.266 6.267 1.00 0.44 C ATOM 40 O ASP A 8 -14.598 8.425 6.725 1.00 0.60 O ATOM 41 CB ASP A 8 -14.485 11.664 6.564 1.00 0.61 C ATOM 42 CG ASP A 8 -15.946 11.318 6.778 1.00 1.30 C ATOM 43 OD1 ASP A 8 -16.384 11.259 7.947 1.00 1.44 O ATOM 44 OD2 ASP A 8 -16.662 11.099 5.775 1.00 2.18 O ATOM 0 H ASP A 8 -12.012 11.685 6.155 1.00 0.41 H new ATOM 0 HA ASP A 8 -13.708 10.362 8.095 1.00 0.48 H new ATOM 0 HB2 ASP A 8 -14.252 12.585 7.098 1.00 0.61 H new ATOM 0 HB3 ASP A 8 -14.313 11.857 5.505 1.00 0.61 H new ATOM 49 N LYS A 9 -13.183 9.097 5.117 1.00 0.33 N ATOM 50 CA LYS A 9 -13.535 7.998 4.223 1.00 0.34 C ATOM 51 C LYS A 9 -12.671 6.765 4.465 1.00 0.29 C ATOM 52 O LYS A 9 -12.996 5.683 3.985 1.00 0.36 O ATOM 53 CB LYS A 9 -13.423 8.422 2.757 1.00 0.44 C ATOM 54 CG LYS A 9 -13.899 9.840 2.481 1.00 0.65 C ATOM 55 CD LYS A 9 -15.348 10.037 2.895 1.00 0.86 C ATOM 56 CE LYS A 9 -15.803 11.464 2.650 1.00 1.24 C ATOM 57 NZ LYS A 9 -17.150 11.723 3.220 1.00 1.79 N ATOM 0 H LYS A 9 -12.427 9.696 4.785 1.00 0.33 H new ATOM 0 HA LYS A 9 -14.570 7.738 4.443 1.00 0.34 H new ATOM 0 HB2 LYS A 9 -12.383 8.332 2.443 1.00 0.44 H new ATOM 0 HB3 LYS A 9 -14.002 7.731 2.145 1.00 0.44 H new ATOM 0 HG2 LYS A 9 -13.267 10.547 3.019 1.00 0.65 H new ATOM 0 HG3 LYS A 9 -13.791 10.060 1.419 1.00 0.65 H new ATOM 0 HD2 LYS A 9 -15.984 9.350 2.338 1.00 0.86 H new ATOM 0 HD3 LYS A 9 -15.463 9.793 3.951 1.00 0.86 H new ATOM 0 HE2 LYS A 9 -15.084 12.155 3.090 1.00 1.24 H new ATOM 0 HE3 LYS A 9 -15.819 11.661 1.578 1.00 1.24 H new ATOM 0 HZ1 LYS A 9 -17.481 12.661 2.916 1.00 1.79 H new ATOM 0 HZ2 LYS A 9 -17.814 10.996 2.885 1.00 1.79 H new ATOM 0 HZ3 LYS A 9 -17.099 11.693 4.258 1.00 1.79 H new ATOM 71 N VAL A 10 -11.560 6.923 5.176 1.00 0.26 N ATOM 72 CA VAL A 10 -10.706 5.785 5.508 1.00 0.24 C ATOM 73 C VAL A 10 -11.491 4.669 6.198 1.00 0.23 C ATOM 74 O VAL A 10 -12.277 4.918 7.115 1.00 0.30 O ATOM 75 CB VAL A 10 -9.533 6.213 6.411 1.00 0.28 C ATOM 76 CG1 VAL A 10 -10.034 6.842 7.700 1.00 0.33 C ATOM 77 CG2 VAL A 10 -8.613 5.037 6.713 1.00 0.28 C ATOM 0 H VAL A 10 -11.230 7.820 5.532 1.00 0.26 H new ATOM 0 HA VAL A 10 -10.314 5.405 4.565 1.00 0.24 H new ATOM 0 HB VAL A 10 -8.958 6.963 5.867 1.00 0.28 H new ATOM 0 HG11 VAL A 10 -9.184 7.134 8.317 1.00 0.33 H new ATOM 0 HG12 VAL A 10 -10.632 7.723 7.467 1.00 0.33 H new ATOM 0 HG13 VAL A 10 -10.646 6.121 8.243 1.00 0.33 H new ATOM 0 HG21 VAL A 10 -7.795 5.370 7.352 1.00 0.28 H new ATOM 0 HG22 VAL A 10 -9.177 4.256 7.223 1.00 0.28 H new ATOM 0 HG23 VAL A 10 -8.208 4.643 5.781 1.00 0.28 H new ATOM 87 N ILE A 11 -11.296 3.442 5.734 1.00 0.24 N ATOM 88 CA ILE A 11 -11.920 2.296 6.375 1.00 0.29 C ATOM 89 C ILE A 11 -10.868 1.370 6.962 1.00 0.26 C ATOM 90 O ILE A 11 -11.087 0.738 7.997 1.00 0.28 O ATOM 91 CB ILE A 11 -12.811 1.491 5.402 1.00 0.38 C ATOM 92 CG1 ILE A 11 -12.024 1.084 4.153 1.00 0.53 C ATOM 93 CG2 ILE A 11 -14.046 2.294 5.029 1.00 0.92 C ATOM 94 CD1 ILE A 11 -12.761 0.108 3.263 1.00 0.62 C ATOM 0 H ILE A 11 -10.717 3.217 4.925 1.00 0.24 H new ATOM 0 HA ILE A 11 -12.553 2.693 7.169 1.00 0.29 H new ATOM 0 HB ILE A 11 -13.134 0.579 5.904 1.00 0.38 H new ATOM 0 HG12 ILE A 11 -11.785 1.978 3.577 1.00 0.53 H new ATOM 0 HG13 ILE A 11 -11.077 0.639 4.459 1.00 0.53 H new ATOM 0 HG21 ILE A 11 -14.664 1.714 4.343 1.00 0.92 H new ATOM 0 HG22 ILE A 11 -14.618 2.521 5.929 1.00 0.92 H new ATOM 0 HG23 ILE A 11 -13.744 3.224 4.547 1.00 0.92 H new ATOM 0 HD11 ILE A 11 -12.143 -0.135 2.399 1.00 0.62 H new ATOM 0 HD12 ILE A 11 -12.977 -0.803 3.822 1.00 0.62 H new ATOM 0 HD13 ILE A 11 -13.695 0.557 2.926 1.00 0.62 H new ATOM 106 N TRP A 12 -9.718 1.313 6.310 1.00 0.23 N ATOM 107 CA TRP A 12 -8.690 0.356 6.673 1.00 0.21 C ATOM 108 C TRP A 12 -7.348 0.837 6.130 1.00 0.21 C ATOM 109 O TRP A 12 -7.253 1.259 4.979 1.00 0.25 O ATOM 110 CB TRP A 12 -9.086 -1.003 6.081 1.00 0.23 C ATOM 111 CG TRP A 12 -8.208 -2.168 6.428 1.00 0.25 C ATOM 112 CD1 TRP A 12 -8.459 -3.144 7.349 1.00 0.31 C ATOM 113 CD2 TRP A 12 -6.958 -2.503 5.820 1.00 0.26 C ATOM 114 NE1 TRP A 12 -7.442 -4.070 7.345 1.00 0.33 N ATOM 115 CE2 TRP A 12 -6.507 -3.694 6.416 1.00 0.29 C ATOM 116 CE3 TRP A 12 -6.178 -1.909 4.830 1.00 0.30 C ATOM 117 CZ2 TRP A 12 -5.313 -4.301 6.041 1.00 0.33 C ATOM 118 CZ3 TRP A 12 -4.997 -2.506 4.468 1.00 0.36 C ATOM 119 CH2 TRP A 12 -4.572 -3.692 5.070 1.00 0.36 C ATOM 0 H TRP A 12 -9.475 1.919 5.527 1.00 0.23 H new ATOM 0 HA TRP A 12 -8.595 0.259 7.754 1.00 0.21 H new ATOM 0 HB2 TRP A 12 -10.101 -1.233 6.405 1.00 0.23 H new ATOM 0 HB3 TRP A 12 -9.112 -0.907 4.996 1.00 0.23 H new ATOM 0 HD1 TRP A 12 -9.329 -3.183 7.988 1.00 0.31 H new ATOM 0 HE1 TRP A 12 -7.392 -4.900 7.936 1.00 0.33 H new ATOM 0 HE3 TRP A 12 -6.498 -0.993 4.355 1.00 0.30 H new ATOM 0 HZ2 TRP A 12 -4.984 -5.221 6.502 1.00 0.33 H new ATOM 0 HZ3 TRP A 12 -4.385 -2.050 3.704 1.00 0.36 H new ATOM 0 HH2 TRP A 12 -3.638 -4.137 4.761 1.00 0.36 H new ATOM 130 N ALA A 13 -6.320 0.810 6.956 1.00 0.23 N ATOM 131 CA ALA A 13 -5.000 1.231 6.517 1.00 0.23 C ATOM 132 C ALA A 13 -3.915 0.519 7.296 1.00 0.25 C ATOM 133 O ALA A 13 -3.965 0.446 8.526 1.00 0.26 O ATOM 134 CB ALA A 13 -4.840 2.736 6.655 1.00 0.25 C ATOM 0 H ALA A 13 -6.370 0.504 7.928 1.00 0.23 H new ATOM 0 HA ALA A 13 -4.900 0.964 5.465 1.00 0.23 H new ATOM 0 HB1 ALA A 13 -3.845 3.028 6.321 1.00 0.25 H new ATOM 0 HB2 ALA A 13 -5.590 3.239 6.045 1.00 0.25 H new ATOM 0 HB3 ALA A 13 -4.971 3.022 7.699 1.00 0.25 H new ATOM 140 N VAL A 14 -2.947 -0.018 6.574 1.00 0.27 N ATOM 141 CA VAL A 14 -1.800 -0.654 7.180 1.00 0.27 C ATOM 142 C VAL A 14 -0.527 -0.332 6.424 1.00 0.26 C ATOM 143 O VAL A 14 -0.387 -0.630 5.237 1.00 0.33 O ATOM 144 CB VAL A 14 -1.938 -2.187 7.264 1.00 0.33 C ATOM 145 CG1 VAL A 14 -0.614 -2.812 7.650 1.00 0.70 C ATOM 146 CG2 VAL A 14 -2.981 -2.580 8.278 1.00 0.79 C ATOM 0 H VAL A 14 -2.938 -0.023 5.554 1.00 0.27 H new ATOM 0 HA VAL A 14 -1.749 -0.253 8.192 1.00 0.27 H new ATOM 0 HB VAL A 14 -2.244 -2.548 6.282 1.00 0.33 H new ATOM 0 HG11 VAL A 14 -0.725 -3.895 7.706 1.00 0.70 H new ATOM 0 HG12 VAL A 14 0.138 -2.563 6.901 1.00 0.70 H new ATOM 0 HG13 VAL A 14 -0.300 -2.429 8.621 1.00 0.70 H new ATOM 0 HG21 VAL A 14 -3.059 -3.667 8.318 1.00 0.79 H new ATOM 0 HG22 VAL A 14 -2.696 -2.201 9.259 1.00 0.79 H new ATOM 0 HG23 VAL A 14 -3.944 -2.158 7.992 1.00 0.79 H new ATOM 156 N ASN A 15 0.401 0.273 7.130 1.00 0.26 N ATOM 157 CA ASN A 15 1.746 0.407 6.634 1.00 0.28 C ATOM 158 C ASN A 15 2.587 -0.693 7.250 1.00 0.28 C ATOM 159 O ASN A 15 2.940 -0.628 8.428 1.00 0.34 O ATOM 160 CB ASN A 15 2.343 1.779 6.953 1.00 0.32 C ATOM 161 CG ASN A 15 3.728 1.920 6.357 1.00 0.50 C ATOM 162 OD1 ASN A 15 4.044 1.310 5.343 1.00 1.49 O ATOM 163 ND2 ASN A 15 4.562 2.717 6.985 1.00 0.83 N ATOM 0 H ASN A 15 0.245 0.680 8.052 1.00 0.26 H new ATOM 0 HA ASN A 15 1.734 0.319 5.548 1.00 0.28 H new ATOM 0 HB2 ASN A 15 1.693 2.562 6.562 1.00 0.32 H new ATOM 0 HB3 ASN A 15 2.392 1.916 8.033 1.00 0.32 H new ATOM 0 HD21 ASN A 15 5.510 2.845 6.631 1.00 0.83 H new ATOM 0 HD22 ASN A 15 4.262 3.208 7.827 1.00 0.83 H new ATOM 170 N ALA A 16 2.842 -1.736 6.472 1.00 0.33 N ATOM 171 CA ALA A 16 3.616 -2.865 6.945 1.00 0.39 C ATOM 172 C ALA A 16 4.996 -2.413 7.346 1.00 0.37 C ATOM 173 O ALA A 16 5.876 -2.255 6.491 1.00 0.38 O ATOM 174 CB ALA A 16 3.702 -3.966 5.902 1.00 0.48 C ATOM 0 H ALA A 16 2.521 -1.819 5.508 1.00 0.33 H new ATOM 0 HA ALA A 16 3.106 -3.278 7.815 1.00 0.39 H new ATOM 0 HB1 ALA A 16 4.291 -4.795 6.295 1.00 0.48 H new ATOM 0 HB2 ALA A 16 2.699 -4.317 5.659 1.00 0.48 H new ATOM 0 HB3 ALA A 16 4.178 -3.578 5.002 1.00 0.48 H new ATOM 180 N GLY A 17 5.143 -2.158 8.643 1.00 0.40 N ATOM 181 CA GLY A 17 6.424 -1.771 9.186 1.00 0.45 C ATOM 182 C GLY A 17 6.365 -1.430 10.662 1.00 0.49 C ATOM 183 O GLY A 17 6.518 -2.302 11.509 1.00 0.76 O ATOM 0 H GLY A 17 4.389 -2.214 9.328 1.00 0.40 H new ATOM 0 HA2 GLY A 17 7.136 -2.582 9.035 1.00 0.45 H new ATOM 0 HA3 GLY A 17 6.800 -0.909 8.635 1.00 0.45 H new ATOM 187 N GLY A 18 6.118 -0.164 10.955 1.00 0.57 N ATOM 188 CA GLY A 18 6.187 0.330 12.326 1.00 0.66 C ATOM 189 C GLY A 18 5.001 -0.078 13.184 1.00 0.57 C ATOM 190 O GLY A 18 4.643 -1.253 13.248 1.00 0.74 O ATOM 0 H GLY A 18 5.868 0.543 10.264 1.00 0.57 H new ATOM 0 HA2 GLY A 18 7.103 -0.038 12.789 1.00 0.66 H new ATOM 0 HA3 GLY A 18 6.253 1.418 12.308 1.00 0.66 H new ATOM 194 N GLU A 19 4.399 0.892 13.866 1.00 0.53 N ATOM 195 CA GLU A 19 3.245 0.619 14.715 1.00 0.50 C ATOM 196 C GLU A 19 2.250 1.774 14.695 1.00 0.45 C ATOM 197 O GLU A 19 2.606 2.894 15.048 1.00 0.64 O ATOM 198 CB GLU A 19 3.690 0.349 16.161 1.00 0.69 C ATOM 199 CG GLU A 19 2.533 0.172 17.139 1.00 1.27 C ATOM 200 CD GLU A 19 2.984 0.016 18.578 1.00 1.45 C ATOM 201 OE1 GLU A 19 3.639 -0.999 18.898 1.00 1.77 O ATOM 202 OE2 GLU A 19 2.656 0.893 19.406 1.00 1.75 O ATOM 0 H GLU A 19 4.690 1.870 13.847 1.00 0.53 H new ATOM 0 HA GLU A 19 2.751 -0.267 14.317 1.00 0.50 H new ATOM 0 HB2 GLU A 19 4.309 -0.548 16.179 1.00 0.69 H new ATOM 0 HB3 GLU A 19 4.316 1.175 16.499 1.00 0.69 H new ATOM 0 HG2 GLU A 19 1.869 1.033 17.065 1.00 1.27 H new ATOM 0 HG3 GLU A 19 1.953 -0.704 16.850 1.00 1.27 H new ATOM 209 N SER A 20 1.024 1.470 14.245 1.00 0.42 N ATOM 210 CA SER A 20 -0.135 2.382 14.287 1.00 0.42 C ATOM 211 C SER A 20 0.216 3.877 14.156 1.00 0.38 C ATOM 212 O SER A 20 0.562 4.532 15.141 1.00 0.44 O ATOM 213 CB SER A 20 -0.920 2.141 15.576 1.00 0.59 C ATOM 214 OG SER A 20 -1.353 0.791 15.657 1.00 1.29 O ATOM 0 H SER A 20 0.803 0.564 13.832 1.00 0.42 H new ATOM 0 HA SER A 20 -0.736 2.148 13.408 1.00 0.42 H new ATOM 0 HB2 SER A 20 -0.296 2.380 16.437 1.00 0.59 H new ATOM 0 HB3 SER A 20 -1.782 2.807 15.612 1.00 0.59 H new ATOM 0 HG SER A 20 -1.852 0.657 16.490 1.00 1.29 H new ATOM 220 N HIS A 21 0.073 4.437 12.956 1.00 0.34 N ATOM 221 CA HIS A 21 0.437 5.839 12.741 1.00 0.33 C ATOM 222 C HIS A 21 -0.617 6.580 11.934 1.00 0.32 C ATOM 223 O HIS A 21 -1.102 6.083 10.922 1.00 0.32 O ATOM 224 CB HIS A 21 1.797 5.949 12.048 1.00 0.35 C ATOM 225 CG HIS A 21 2.147 7.351 11.616 1.00 0.35 C ATOM 226 ND1 HIS A 21 2.462 8.378 12.482 1.00 0.41 N ATOM 227 CD2 HIS A 21 2.192 7.890 10.384 1.00 0.40 C ATOM 228 CE1 HIS A 21 2.674 9.484 11.780 1.00 0.42 C ATOM 229 NE2 HIS A 21 2.520 9.208 10.510 1.00 0.41 N ATOM 0 H HIS A 21 -0.285 3.954 12.132 1.00 0.34 H new ATOM 0 HA HIS A 21 0.499 6.307 13.724 1.00 0.33 H new ATOM 0 HB2 HIS A 21 2.570 5.583 12.724 1.00 0.35 H new ATOM 0 HB3 HIS A 21 1.803 5.297 11.174 1.00 0.35 H new ATOM 0 HD1 HIS A 21 2.522 8.300 13.497 1.00 0.41 H new ATOM 0 HD2 HIS A 21 2.002 7.370 9.457 1.00 0.40 H new ATOM 0 HE1 HIS A 21 2.931 10.450 12.188 1.00 0.42 H new ATOM 238 N VAL A 22 -0.948 7.776 12.393 1.00 0.41 N ATOM 239 CA VAL A 22 -1.866 8.653 11.689 1.00 0.40 C ATOM 240 C VAL A 22 -1.104 9.524 10.691 1.00 0.40 C ATOM 241 O VAL A 22 -0.260 10.335 11.074 1.00 0.48 O ATOM 242 CB VAL A 22 -2.642 9.561 12.673 1.00 0.49 C ATOM 243 CG1 VAL A 22 -3.585 10.495 11.928 1.00 0.84 C ATOM 244 CG2 VAL A 22 -3.411 8.729 13.682 1.00 1.01 C ATOM 0 H VAL A 22 -0.587 8.165 13.264 1.00 0.41 H new ATOM 0 HA VAL A 22 -2.581 8.025 11.158 1.00 0.40 H new ATOM 0 HB VAL A 22 -1.913 10.169 13.209 1.00 0.49 H new ATOM 0 HG11 VAL A 22 -4.117 11.121 12.644 1.00 0.84 H new ATOM 0 HG12 VAL A 22 -3.011 11.126 11.250 1.00 0.84 H new ATOM 0 HG13 VAL A 22 -4.303 9.907 11.356 1.00 0.84 H new ATOM 0 HG21 VAL A 22 -3.949 9.389 14.363 1.00 1.01 H new ATOM 0 HG22 VAL A 22 -4.122 8.089 13.160 1.00 1.01 H new ATOM 0 HG23 VAL A 22 -2.715 8.111 14.249 1.00 1.01 H new ATOM 254 N ASP A 23 -1.388 9.328 9.416 1.00 0.37 N ATOM 255 CA ASP A 23 -0.804 10.135 8.353 1.00 0.42 C ATOM 256 C ASP A 23 -1.423 11.525 8.374 1.00 0.36 C ATOM 257 O ASP A 23 -2.514 11.711 8.912 1.00 0.33 O ATOM 258 CB ASP A 23 -1.029 9.449 6.998 1.00 0.51 C ATOM 259 CG ASP A 23 -1.191 10.430 5.854 1.00 0.55 C ATOM 260 OD1 ASP A 23 -0.164 10.844 5.285 1.00 0.75 O ATOM 261 OD2 ASP A 23 -2.340 10.759 5.491 1.00 0.77 O ATOM 0 H ASP A 23 -2.029 8.607 9.086 1.00 0.37 H new ATOM 0 HA ASP A 23 0.270 10.233 8.510 1.00 0.42 H new ATOM 0 HB2 ASP A 23 -0.187 8.790 6.787 1.00 0.51 H new ATOM 0 HB3 ASP A 23 -1.918 8.821 7.059 1.00 0.51 H new ATOM 266 N VAL A 24 -0.723 12.488 7.772 1.00 0.38 N ATOM 267 CA VAL A 24 -1.082 13.902 7.864 1.00 0.37 C ATOM 268 C VAL A 24 -2.412 14.227 7.180 1.00 0.38 C ATOM 269 O VAL A 24 -2.894 15.353 7.278 1.00 0.49 O ATOM 270 CB VAL A 24 0.018 14.803 7.264 1.00 0.42 C ATOM 271 CG1 VAL A 24 1.296 14.692 8.074 1.00 0.59 C ATOM 272 CG2 VAL A 24 0.275 14.449 5.809 1.00 0.62 C ATOM 0 H VAL A 24 0.108 12.309 7.208 1.00 0.38 H new ATOM 0 HA VAL A 24 -1.188 14.105 8.930 1.00 0.37 H new ATOM 0 HB VAL A 24 -0.329 15.836 7.305 1.00 0.42 H new ATOM 0 HG11 VAL A 24 2.061 15.334 7.637 1.00 0.59 H new ATOM 0 HG12 VAL A 24 1.104 15.004 9.101 1.00 0.59 H new ATOM 0 HG13 VAL A 24 1.642 13.659 8.067 1.00 0.59 H new ATOM 0 HG21 VAL A 24 1.054 15.098 5.409 1.00 0.62 H new ATOM 0 HG22 VAL A 24 0.597 13.410 5.739 1.00 0.62 H new ATOM 0 HG23 VAL A 24 -0.641 14.585 5.234 1.00 0.62 H new ATOM 282 N HIS A 25 -2.996 13.261 6.482 1.00 0.37 N ATOM 283 CA HIS A 25 -4.315 13.450 5.892 1.00 0.43 C ATOM 284 C HIS A 25 -5.357 12.809 6.800 1.00 0.40 C ATOM 285 O HIS A 25 -6.532 12.698 6.449 1.00 0.51 O ATOM 286 CB HIS A 25 -4.396 12.843 4.485 1.00 0.53 C ATOM 287 CG HIS A 25 -3.246 13.206 3.593 1.00 0.61 C ATOM 288 ND1 HIS A 25 -3.061 14.463 3.057 1.00 0.73 N ATOM 289 CD2 HIS A 25 -2.206 12.460 3.155 1.00 0.72 C ATOM 290 CE1 HIS A 25 -1.958 14.468 2.331 1.00 0.86 C ATOM 291 NE2 HIS A 25 -1.416 13.265 2.374 1.00 0.86 N ATOM 0 H HIS A 25 -2.581 12.345 6.311 1.00 0.37 H new ATOM 0 HA HIS A 25 -4.505 14.519 5.797 1.00 0.43 H new ATOM 0 HB2 HIS A 25 -4.446 11.758 4.572 1.00 0.53 H new ATOM 0 HB3 HIS A 25 -5.324 13.168 4.014 1.00 0.53 H new ATOM 0 HD2 HIS A 25 -2.029 11.418 3.380 1.00 0.72 H new ATOM 0 HE1 HIS A 25 -1.564 15.316 1.791 1.00 0.86 H new ATOM 0 HE2 HIS A 25 -0.555 12.982 1.906 1.00 0.86 H new ATOM 300 N GLY A 26 -4.890 12.371 7.965 1.00 0.32 N ATOM 301 CA GLY A 26 -5.762 11.807 8.970 1.00 0.33 C ATOM 302 C GLY A 26 -5.981 10.321 8.786 1.00 0.30 C ATOM 303 O GLY A 26 -7.040 9.801 9.132 1.00 0.33 O ATOM 0 H GLY A 26 -3.905 12.400 8.230 1.00 0.32 H new ATOM 0 HA2 GLY A 26 -5.337 11.988 9.957 1.00 0.33 H new ATOM 0 HA3 GLY A 26 -6.724 12.318 8.939 1.00 0.33 H new ATOM 307 N ILE A 27 -4.986 9.626 8.247 1.00 0.26 N ATOM 308 CA ILE A 27 -5.135 8.200 7.974 1.00 0.24 C ATOM 309 C ILE A 27 -4.384 7.358 8.998 1.00 0.26 C ATOM 310 O ILE A 27 -3.158 7.281 8.977 1.00 0.28 O ATOM 311 CB ILE A 27 -4.685 7.826 6.540 1.00 0.24 C ATOM 312 CG1 ILE A 27 -5.601 8.477 5.509 1.00 0.26 C ATOM 313 CG2 ILE A 27 -4.704 6.320 6.338 1.00 0.27 C ATOM 314 CD1 ILE A 27 -7.058 8.343 5.852 1.00 0.31 C ATOM 0 H ILE A 27 -4.080 10.019 7.993 1.00 0.26 H new ATOM 0 HA ILE A 27 -6.200 7.980 8.054 1.00 0.24 H new ATOM 0 HB ILE A 27 -3.666 8.190 6.408 1.00 0.24 H new ATOM 0 HG12 ILE A 27 -5.349 9.534 5.423 1.00 0.26 H new ATOM 0 HG13 ILE A 27 -5.420 8.026 4.533 1.00 0.26 H new ATOM 0 HG21 ILE A 27 -4.384 6.085 5.323 1.00 0.27 H new ATOM 0 HG22 ILE A 27 -4.027 5.849 7.050 1.00 0.27 H new ATOM 0 HG23 ILE A 27 -5.715 5.944 6.496 1.00 0.27 H new ATOM 0 HD11 ILE A 27 -7.659 8.826 5.081 1.00 0.31 H new ATOM 0 HD12 ILE A 27 -7.322 7.287 5.910 1.00 0.31 H new ATOM 0 HD13 ILE A 27 -7.251 8.819 6.814 1.00 0.31 H new ATOM 326 N HIS A 28 -5.126 6.729 9.895 1.00 0.31 N ATOM 327 CA HIS A 28 -4.527 5.924 10.949 1.00 0.33 C ATOM 328 C HIS A 28 -4.266 4.498 10.481 1.00 0.33 C ATOM 329 O HIS A 28 -5.194 3.710 10.278 1.00 0.39 O ATOM 330 CB HIS A 28 -5.424 5.919 12.188 1.00 0.40 C ATOM 331 CG HIS A 28 -4.868 5.147 13.346 1.00 0.49 C ATOM 332 ND1 HIS A 28 -4.220 5.746 14.397 1.00 0.60 N ATOM 333 CD2 HIS A 28 -4.862 3.821 13.611 1.00 0.80 C ATOM 334 CE1 HIS A 28 -3.835 4.829 15.256 1.00 0.66 C ATOM 335 NE2 HIS A 28 -4.212 3.646 14.807 1.00 0.78 N ATOM 0 H HIS A 28 -6.145 6.760 9.915 1.00 0.31 H new ATOM 0 HA HIS A 28 -3.567 6.372 11.206 1.00 0.33 H new ATOM 0 HB2 HIS A 28 -5.597 6.948 12.502 1.00 0.40 H new ATOM 0 HB3 HIS A 28 -6.394 5.501 11.919 1.00 0.40 H new ATOM 0 HD2 HIS A 28 -5.290 3.043 12.995 1.00 0.80 H new ATOM 0 HE1 HIS A 28 -3.300 5.012 16.176 1.00 0.66 H new ATOM 0 HE2 HIS A 28 -4.048 2.753 15.271 1.00 0.78 H new ATOM 344 N TYR A 29 -2.997 4.179 10.312 1.00 0.32 N ATOM 345 CA TYR A 29 -2.581 2.825 10.022 1.00 0.35 C ATOM 346 C TYR A 29 -2.618 1.985 11.293 1.00 0.40 C ATOM 347 O TYR A 29 -2.228 2.455 12.359 1.00 0.44 O ATOM 348 CB TYR A 29 -1.184 2.846 9.394 1.00 0.42 C ATOM 349 CG TYR A 29 -0.184 1.877 9.997 1.00 0.65 C ATOM 350 CD1 TYR A 29 -0.356 0.506 9.873 1.00 0.80 C ATOM 351 CD2 TYR A 29 0.920 2.333 10.698 1.00 0.98 C ATOM 352 CE1 TYR A 29 0.548 -0.376 10.430 1.00 1.17 C ATOM 353 CE2 TYR A 29 1.825 1.461 11.255 1.00 1.30 C ATOM 354 CZ TYR A 29 1.651 0.101 11.077 1.00 1.39 C ATOM 355 OH TYR A 29 2.538 -0.753 11.675 1.00 1.75 O ATOM 0 H TYR A 29 -2.231 4.849 10.372 1.00 0.32 H new ATOM 0 HA TYR A 29 -3.267 2.369 9.308 1.00 0.35 H new ATOM 0 HB2 TYR A 29 -1.279 2.628 8.330 1.00 0.42 H new ATOM 0 HB3 TYR A 29 -0.782 3.856 9.478 1.00 0.42 H new ATOM 0 HD1 TYR A 29 -1.209 0.123 9.333 1.00 0.80 H new ATOM 0 HD2 TYR A 29 1.073 3.396 10.809 1.00 0.98 H new ATOM 0 HE1 TYR A 29 0.383 -1.441 10.354 1.00 1.17 H new ATOM 0 HE2 TYR A 29 2.663 1.834 11.825 1.00 1.30 H new ATOM 0 HH TYR A 29 3.314 -0.881 11.090 1.00 1.75 H new ATOM 365 N ARG A 30 -3.094 0.751 11.169 1.00 0.50 N ATOM 366 CA ARG A 30 -3.172 -0.170 12.298 1.00 0.64 C ATOM 367 C ARG A 30 -1.991 -1.151 12.280 1.00 0.76 C ATOM 368 O ARG A 30 -1.819 -1.919 11.334 1.00 1.46 O ATOM 369 CB ARG A 30 -4.513 -0.916 12.267 1.00 0.83 C ATOM 370 CG ARG A 30 -4.743 -1.725 11.004 1.00 0.73 C ATOM 371 CD ARG A 30 -6.174 -2.217 10.909 1.00 0.93 C ATOM 372 NE ARG A 30 -7.119 -1.130 10.641 1.00 1.52 N ATOM 373 CZ ARG A 30 -8.444 -1.279 10.620 1.00 2.17 C ATOM 374 NH1 ARG A 30 -9.002 -2.428 10.980 1.00 2.48 N ATOM 375 NH2 ARG A 30 -9.219 -0.258 10.275 1.00 2.94 N ATOM 0 H ARG A 30 -3.435 0.362 10.290 1.00 0.50 H new ATOM 0 HA ARG A 30 -3.113 0.399 13.226 1.00 0.64 H new ATOM 0 HB2 ARG A 30 -4.565 -1.583 13.127 1.00 0.83 H new ATOM 0 HB3 ARG A 30 -5.321 -0.193 12.375 1.00 0.83 H new ATOM 0 HG2 ARG A 30 -4.509 -1.114 10.132 1.00 0.73 H new ATOM 0 HG3 ARG A 30 -4.063 -2.577 10.988 1.00 0.73 H new ATOM 0 HD2 ARG A 30 -6.248 -2.963 10.118 1.00 0.93 H new ATOM 0 HD3 ARG A 30 -6.448 -2.712 11.840 1.00 0.93 H new ATOM 0 HE ARG A 30 -6.740 -0.201 10.459 1.00 1.52 H new ATOM 0 HH11 ARG A 30 -8.416 -3.209 11.277 1.00 2.48 H new ATOM 0 HH12 ARG A 30 -10.017 -2.531 10.960 1.00 2.48 H new ATOM 0 HH21 ARG A 30 -8.801 0.639 10.027 1.00 2.94 H new ATOM 0 HH22 ARG A 30 -10.233 -0.370 10.258 1.00 2.94 H new ATOM 389 N LYS A 31 -1.161 -1.051 13.323 1.00 0.59 N ATOM 390 CA LYS A 31 0.043 -1.880 13.527 1.00 0.67 C ATOM 391 C LYS A 31 -0.088 -3.324 13.019 1.00 0.86 C ATOM 392 O LYS A 31 -1.144 -3.941 13.145 1.00 1.37 O ATOM 393 CB LYS A 31 0.385 -1.926 15.015 1.00 0.99 C ATOM 394 CG LYS A 31 1.653 -2.707 15.303 1.00 1.25 C ATOM 395 CD LYS A 31 1.672 -3.260 16.715 1.00 1.61 C ATOM 396 CE LYS A 31 0.515 -4.223 16.951 1.00 2.18 C ATOM 397 NZ LYS A 31 0.382 -5.219 15.852 1.00 2.78 N ATOM 0 H LYS A 31 -1.307 -0.374 14.072 1.00 0.59 H new ATOM 0 HA LYS A 31 0.830 -1.406 12.940 1.00 0.67 H new ATOM 0 HB2 LYS A 31 0.498 -0.908 15.389 1.00 0.99 H new ATOM 0 HB3 LYS A 31 -0.445 -2.376 15.560 1.00 0.99 H new ATOM 0 HG2 LYS A 31 1.743 -3.528 14.591 1.00 1.25 H new ATOM 0 HG3 LYS A 31 2.518 -2.061 15.155 1.00 1.25 H new ATOM 0 HD2 LYS A 31 2.617 -3.773 16.894 1.00 1.61 H new ATOM 0 HD3 LYS A 31 1.615 -2.439 17.430 1.00 1.61 H new ATOM 0 HE2 LYS A 31 0.665 -4.745 17.896 1.00 2.18 H new ATOM 0 HE3 LYS A 31 -0.413 -3.659 17.042 1.00 2.18 H new ATOM 0 HZ1 LYS A 31 0.068 -6.129 16.245 1.00 2.78 H new ATOM 0 HZ2 LYS A 31 -0.317 -4.881 15.160 1.00 2.78 H new ATOM 0 HZ3 LYS A 31 1.302 -5.343 15.383 1.00 2.78 H new ATOM 411 N ASP A 32 1.063 -3.846 12.549 1.00 0.75 N ATOM 412 CA ASP A 32 1.214 -5.162 11.881 1.00 1.00 C ATOM 413 C ASP A 32 0.125 -6.188 12.233 1.00 0.93 C ATOM 414 O ASP A 32 0.203 -6.920 13.215 1.00 1.29 O ATOM 415 CB ASP A 32 2.616 -5.750 12.156 1.00 1.58 C ATOM 416 CG ASP A 32 2.821 -6.261 13.575 1.00 1.92 C ATOM 417 OD1 ASP A 32 2.579 -5.502 14.531 1.00 2.41 O ATOM 418 OD2 ASP A 32 3.219 -7.435 13.733 1.00 2.36 O ATOM 0 H ASP A 32 1.949 -3.346 12.625 1.00 0.75 H new ATOM 0 HA ASP A 32 1.093 -4.962 10.816 1.00 1.00 H new ATOM 0 HB2 ASP A 32 2.795 -6.569 11.459 1.00 1.58 H new ATOM 0 HB3 ASP A 32 3.364 -4.985 11.948 1.00 1.58 H new ATOM 423 N PRO A 33 -0.927 -6.226 11.415 1.00 0.72 N ATOM 424 CA PRO A 33 -2.013 -7.180 11.538 1.00 0.89 C ATOM 425 C PRO A 33 -1.994 -8.269 10.462 1.00 1.04 C ATOM 426 O PRO A 33 -3.041 -8.649 9.944 1.00 1.87 O ATOM 427 CB PRO A 33 -3.207 -6.261 11.323 1.00 0.99 C ATOM 428 CG PRO A 33 -2.730 -5.281 10.287 1.00 0.86 C ATOM 429 CD PRO A 33 -1.214 -5.263 10.354 1.00 0.69 C ATOM 0 HA PRO A 33 -1.989 -7.735 12.476 1.00 0.89 H new ATOM 0 HB2 PRO A 33 -4.080 -6.815 10.977 1.00 0.99 H new ATOM 0 HB3 PRO A 33 -3.495 -5.758 12.246 1.00 0.99 H new ATOM 0 HG2 PRO A 33 -3.068 -5.576 9.294 1.00 0.86 H new ATOM 0 HG3 PRO A 33 -3.136 -4.288 10.480 1.00 0.86 H new ATOM 0 HD2 PRO A 33 -0.763 -5.558 9.406 1.00 0.69 H new ATOM 0 HD3 PRO A 33 -0.831 -4.271 10.593 1.00 0.69 H new ATOM 682 N ILE A 50 11.984 8.159 3.024 1.00 0.66 N ATOM 683 CA ILE A 50 11.294 8.314 1.750 1.00 0.48 C ATOM 684 C ILE A 50 11.292 9.786 1.319 1.00 0.70 C ATOM 685 O ILE A 50 10.722 10.648 1.989 1.00 1.59 O ATOM 686 CB ILE A 50 9.842 7.745 1.822 1.00 0.38 C ATOM 687 CG1 ILE A 50 9.812 6.280 1.382 1.00 0.42 C ATOM 688 CG2 ILE A 50 8.875 8.541 0.962 1.00 0.42 C ATOM 689 CD1 ILE A 50 10.567 5.343 2.288 1.00 0.51 C ATOM 0 HA ILE A 50 11.833 7.739 0.997 1.00 0.48 H new ATOM 0 HB ILE A 50 9.525 7.825 2.862 1.00 0.38 H new ATOM 0 HG12 ILE A 50 8.774 5.952 1.324 1.00 0.42 H new ATOM 0 HG13 ILE A 50 10.227 6.207 0.377 1.00 0.42 H new ATOM 0 HG21 ILE A 50 7.877 8.110 1.042 1.00 0.42 H new ATOM 0 HG22 ILE A 50 8.852 9.576 1.303 1.00 0.42 H new ATOM 0 HG23 ILE A 50 9.201 8.509 -0.077 1.00 0.42 H new ATOM 0 HD11 ILE A 50 10.494 4.326 1.902 1.00 0.51 H new ATOM 0 HD12 ILE A 50 11.615 5.641 2.328 1.00 0.51 H new ATOM 0 HD13 ILE A 50 10.140 5.383 3.290 1.00 0.51 H new ATOM 701 N LEU A 51 11.951 10.065 0.200 1.00 0.60 N ATOM 702 CA LEU A 51 12.108 11.434 -0.292 1.00 0.60 C ATOM 703 C LEU A 51 10.796 11.988 -0.839 1.00 0.62 C ATOM 704 O LEU A 51 10.637 13.196 -0.994 1.00 0.90 O ATOM 705 CB LEU A 51 13.180 11.501 -1.392 1.00 0.66 C ATOM 706 CG LEU A 51 14.640 11.279 -0.955 1.00 0.92 C ATOM 707 CD1 LEU A 51 14.986 12.121 0.267 1.00 1.51 C ATOM 708 CD2 LEU A 51 14.920 9.807 -0.691 1.00 1.91 C ATOM 0 H LEU A 51 12.389 9.357 -0.389 1.00 0.60 H new ATOM 0 HA LEU A 51 12.419 12.043 0.557 1.00 0.60 H new ATOM 0 HB2 LEU A 51 12.936 10.757 -2.150 1.00 0.66 H new ATOM 0 HB3 LEU A 51 13.114 12.478 -1.871 1.00 0.66 H new ATOM 0 HG LEU A 51 15.279 11.601 -1.778 1.00 0.92 H new ATOM 0 HD11 LEU A 51 16.023 11.942 0.551 1.00 1.51 H new ATOM 0 HD12 LEU A 51 14.851 13.177 0.031 1.00 1.51 H new ATOM 0 HD13 LEU A 51 14.331 11.848 1.094 1.00 1.51 H new ATOM 0 HD21 LEU A 51 15.959 9.683 -0.384 1.00 1.91 H new ATOM 0 HD22 LEU A 51 14.263 9.448 0.101 1.00 1.91 H new ATOM 0 HD23 LEU A 51 14.739 9.234 -1.600 1.00 1.91 H new ATOM 720 N ARG A 52 9.856 11.101 -1.126 1.00 0.56 N ATOM 721 CA ARG A 52 8.598 11.499 -1.748 1.00 0.60 C ATOM 722 C ARG A 52 7.475 11.672 -0.724 1.00 0.59 C ATOM 723 O ARG A 52 6.301 11.528 -1.062 1.00 0.83 O ATOM 724 CB ARG A 52 8.179 10.477 -2.807 1.00 0.70 C ATOM 725 CG ARG A 52 8.587 10.841 -4.229 1.00 0.93 C ATOM 726 CD ARG A 52 10.095 10.936 -4.393 1.00 1.14 C ATOM 727 NE ARG A 52 10.475 11.170 -5.785 1.00 1.80 N ATOM 728 CZ ARG A 52 11.717 11.425 -6.197 1.00 2.47 C ATOM 729 NH1 ARG A 52 12.706 11.532 -5.316 1.00 2.72 N ATOM 730 NH2 ARG A 52 11.964 11.589 -7.489 1.00 3.17 N ATOM 0 H ARG A 52 9.938 10.102 -0.939 1.00 0.56 H new ATOM 0 HA ARG A 52 8.768 12.467 -2.220 1.00 0.60 H new ATOM 0 HB2 ARG A 52 8.614 9.510 -2.553 1.00 0.70 H new ATOM 0 HB3 ARG A 52 7.096 10.359 -2.772 1.00 0.70 H new ATOM 0 HG2 ARG A 52 8.196 10.093 -4.919 1.00 0.93 H new ATOM 0 HG3 ARG A 52 8.134 11.794 -4.501 1.00 0.93 H new ATOM 0 HD2 ARG A 52 10.478 11.745 -3.771 1.00 1.14 H new ATOM 0 HD3 ARG A 52 10.558 10.015 -4.040 1.00 1.14 H new ATOM 0 HE ARG A 52 9.739 11.136 -6.490 1.00 1.80 H new ATOM 0 HH11 ARG A 52 12.516 11.419 -4.320 1.00 2.72 H new ATOM 0 HH12 ARG A 52 13.655 11.727 -5.636 1.00 2.72 H new ATOM 0 HH21 ARG A 52 11.204 11.520 -8.166 1.00 3.17 H new ATOM 0 HH22 ARG A 52 12.914 11.784 -7.806 1.00 3.17 H new ATOM 744 N SER A 53 7.829 11.969 0.521 1.00 0.49 N ATOM 745 CA SER A 53 6.821 12.214 1.548 1.00 0.47 C ATOM 746 C SER A 53 7.359 13.133 2.651 1.00 0.46 C ATOM 747 O SER A 53 8.566 13.365 2.751 1.00 0.54 O ATOM 748 CB SER A 53 6.335 10.892 2.152 1.00 0.47 C ATOM 749 OG SER A 53 4.921 10.816 2.123 1.00 0.97 O ATOM 0 H SER A 53 8.794 12.046 0.842 1.00 0.49 H new ATOM 0 HA SER A 53 5.979 12.715 1.071 1.00 0.47 H new ATOM 0 HB2 SER A 53 6.760 10.055 1.597 1.00 0.47 H new ATOM 0 HB3 SER A 53 6.687 10.805 3.180 1.00 0.47 H new ATOM 0 HG SER A 53 4.558 11.145 2.972 1.00 0.97 H new ATOM 755 N ASN A 54 6.441 13.647 3.466 1.00 0.46 N ATOM 756 CA ASN A 54 6.760 14.568 4.557 1.00 0.48 C ATOM 757 C ASN A 54 7.061 13.776 5.839 1.00 0.44 C ATOM 758 O ASN A 54 6.361 12.827 6.138 1.00 0.42 O ATOM 759 CB ASN A 54 5.575 15.538 4.726 1.00 0.60 C ATOM 760 CG ASN A 54 5.449 16.137 6.111 1.00 0.92 C ATOM 761 OD1 ASN A 54 6.038 17.175 6.412 1.00 1.92 O ATOM 762 ND2 ASN A 54 4.638 15.507 6.945 1.00 0.75 N ATOM 0 H ASN A 54 5.446 13.435 3.388 1.00 0.46 H new ATOM 0 HA ASN A 54 7.654 15.150 4.333 1.00 0.48 H new ATOM 0 HB2 ASN A 54 5.677 16.346 4.002 1.00 0.60 H new ATOM 0 HB3 ASN A 54 4.652 15.010 4.487 1.00 0.60 H new ATOM 0 HD21 ASN A 54 4.480 15.879 7.881 1.00 0.75 H new ATOM 0 HD22 ASN A 54 4.171 14.649 6.652 1.00 0.75 H new ATOM 769 N PRO A 55 8.064 14.206 6.634 1.00 0.47 N ATOM 770 CA PRO A 55 8.738 13.379 7.664 1.00 0.49 C ATOM 771 C PRO A 55 7.862 12.401 8.471 1.00 0.45 C ATOM 772 O PRO A 55 8.188 11.213 8.542 1.00 0.46 O ATOM 773 CB PRO A 55 9.321 14.437 8.591 1.00 0.57 C ATOM 774 CG PRO A 55 9.685 15.555 7.682 1.00 0.70 C ATOM 775 CD PRO A 55 8.659 15.556 6.578 1.00 0.53 C ATOM 0 HA PRO A 55 9.442 12.700 7.183 1.00 0.49 H new ATOM 0 HB2 PRO A 55 8.596 14.753 9.341 1.00 0.57 H new ATOM 0 HB3 PRO A 55 10.192 14.060 9.128 1.00 0.57 H new ATOM 0 HG2 PRO A 55 9.683 16.506 8.215 1.00 0.70 H new ATOM 0 HG3 PRO A 55 10.689 15.418 7.280 1.00 0.70 H new ATOM 0 HD2 PRO A 55 7.907 16.329 6.734 1.00 0.53 H new ATOM 0 HD3 PRO A 55 9.118 15.749 5.608 1.00 0.53 H new ATOM 783 N GLU A 56 6.776 12.854 9.087 1.00 0.47 N ATOM 784 CA GLU A 56 5.992 11.955 9.938 1.00 0.49 C ATOM 785 C GLU A 56 5.209 10.959 9.092 1.00 0.40 C ATOM 786 O GLU A 56 5.206 9.743 9.346 1.00 0.39 O ATOM 787 CB GLU A 56 5.044 12.716 10.882 1.00 0.62 C ATOM 788 CG GLU A 56 4.333 13.913 10.266 1.00 0.78 C ATOM 789 CD GLU A 56 5.152 15.182 10.345 1.00 1.73 C ATOM 790 OE1 GLU A 56 5.941 15.443 9.414 1.00 2.71 O ATOM 791 OE2 GLU A 56 5.015 15.919 11.337 1.00 2.02 O ATOM 0 H GLU A 56 6.423 13.808 9.020 1.00 0.47 H new ATOM 0 HA GLU A 56 6.702 11.413 10.562 1.00 0.49 H new ATOM 0 HB2 GLU A 56 4.292 12.020 11.253 1.00 0.62 H new ATOM 0 HB3 GLU A 56 5.615 13.058 11.745 1.00 0.62 H new ATOM 0 HG2 GLU A 56 4.105 13.697 9.222 1.00 0.78 H new ATOM 0 HG3 GLU A 56 3.382 14.067 10.775 1.00 0.78 H new ATOM 798 N ASP A 57 4.571 11.457 8.062 1.00 0.40 N ATOM 799 CA ASP A 57 3.781 10.603 7.212 1.00 0.38 C ATOM 800 C ASP A 57 4.697 9.821 6.283 1.00 0.35 C ATOM 801 O ASP A 57 4.330 8.772 5.779 1.00 0.38 O ATOM 802 CB ASP A 57 2.746 11.415 6.450 1.00 0.47 C ATOM 803 CG ASP A 57 3.336 12.294 5.364 1.00 0.92 C ATOM 804 OD1 ASP A 57 3.590 11.801 4.244 1.00 1.63 O ATOM 805 OD2 ASP A 57 3.529 13.497 5.625 1.00 1.36 O ATOM 0 H ASP A 57 4.583 12.441 7.794 1.00 0.40 H new ATOM 0 HA ASP A 57 3.232 9.886 7.823 1.00 0.38 H new ATOM 0 HB2 ASP A 57 2.023 10.734 6.001 1.00 0.47 H new ATOM 0 HB3 ASP A 57 2.199 12.042 7.154 1.00 0.47 H new ATOM 810 N GLN A 58 5.905 10.337 6.103 1.00 0.34 N ATOM 811 CA GLN A 58 6.979 9.620 5.440 1.00 0.36 C ATOM 812 C GLN A 58 7.182 8.281 6.117 1.00 0.34 C ATOM 813 O GLN A 58 7.261 7.260 5.460 1.00 0.35 O ATOM 814 CB GLN A 58 8.268 10.439 5.512 1.00 0.42 C ATOM 815 CG GLN A 58 9.482 9.762 4.906 1.00 0.51 C ATOM 816 CD GLN A 58 10.776 10.395 5.374 1.00 0.89 C ATOM 817 OE1 GLN A 58 11.360 9.972 6.371 1.00 1.52 O ATOM 818 NE2 GLN A 58 11.236 11.408 4.662 1.00 1.58 N ATOM 0 H GLN A 58 6.166 11.272 6.416 1.00 0.34 H new ATOM 0 HA GLN A 58 6.718 9.460 4.394 1.00 0.36 H new ATOM 0 HB2 GLN A 58 8.107 11.390 5.004 1.00 0.42 H new ATOM 0 HB3 GLN A 58 8.480 10.668 6.557 1.00 0.42 H new ATOM 0 HG2 GLN A 58 9.478 8.705 5.172 1.00 0.51 H new ATOM 0 HG3 GLN A 58 9.423 9.817 3.819 1.00 0.51 H new ATOM 0 HE21 GLN A 58 10.722 11.729 3.841 1.00 1.58 H new ATOM 0 HE22 GLN A 58 12.105 11.869 4.933 1.00 1.58 H new ATOM 827 N VAL A 59 7.260 8.305 7.440 1.00 0.35 N ATOM 828 CA VAL A 59 7.302 7.089 8.236 1.00 0.37 C ATOM 829 C VAL A 59 6.108 6.192 7.910 1.00 0.32 C ATOM 830 O VAL A 59 6.240 4.976 7.835 1.00 0.37 O ATOM 831 CB VAL A 59 7.320 7.427 9.744 1.00 0.45 C ATOM 832 CG1 VAL A 59 7.146 6.187 10.602 1.00 1.08 C ATOM 833 CG2 VAL A 59 8.612 8.138 10.108 1.00 1.27 C ATOM 0 H VAL A 59 7.296 9.164 7.989 1.00 0.35 H new ATOM 0 HA VAL A 59 8.218 6.552 7.989 1.00 0.37 H new ATOM 0 HB VAL A 59 6.476 8.088 9.943 1.00 0.45 H new ATOM 0 HG11 VAL A 59 7.164 6.468 11.655 1.00 1.08 H new ATOM 0 HG12 VAL A 59 6.192 5.714 10.369 1.00 1.08 H new ATOM 0 HG13 VAL A 59 7.957 5.487 10.399 1.00 1.08 H new ATOM 0 HG21 VAL A 59 8.612 8.370 11.173 1.00 1.27 H new ATOM 0 HG22 VAL A 59 9.460 7.493 9.878 1.00 1.27 H new ATOM 0 HG23 VAL A 59 8.693 9.062 9.535 1.00 1.27 H new ATOM 843 N LEU A 60 4.948 6.803 7.682 1.00 0.30 N ATOM 844 CA LEU A 60 3.748 6.033 7.330 1.00 0.31 C ATOM 845 C LEU A 60 3.799 5.532 5.884 1.00 0.33 C ATOM 846 O LEU A 60 2.977 4.726 5.468 1.00 0.41 O ATOM 847 CB LEU A 60 2.483 6.876 7.535 1.00 0.34 C ATOM 848 CG LEU A 60 1.191 6.091 7.812 1.00 0.56 C ATOM 849 CD1 LEU A 60 0.342 5.951 6.565 1.00 1.12 C ATOM 850 CD2 LEU A 60 1.520 4.723 8.376 1.00 1.18 C ATOM 0 H LEU A 60 4.809 7.812 7.732 1.00 0.30 H new ATOM 0 HA LEU A 60 3.718 5.168 7.992 1.00 0.31 H new ATOM 0 HB2 LEU A 60 2.656 7.559 8.367 1.00 0.34 H new ATOM 0 HB3 LEU A 60 2.330 7.488 6.646 1.00 0.34 H new ATOM 0 HG LEU A 60 0.613 6.653 8.545 1.00 0.56 H new ATOM 0 HD11 LEU A 60 -0.562 5.390 6.802 1.00 1.12 H new ATOM 0 HD12 LEU A 60 0.070 6.940 6.197 1.00 1.12 H new ATOM 0 HD13 LEU A 60 0.907 5.421 5.798 1.00 1.12 H new ATOM 0 HD21 LEU A 60 0.596 4.177 8.568 1.00 1.18 H new ATOM 0 HD22 LEU A 60 2.126 4.170 7.659 1.00 1.18 H new ATOM 0 HD23 LEU A 60 2.074 4.837 9.308 1.00 1.18 H new ATOM 862 N TYR A 61 4.756 6.024 5.129 1.00 0.35 N ATOM 863 CA TYR A 61 4.973 5.564 3.765 1.00 0.40 C ATOM 864 C TYR A 61 6.337 4.898 3.685 1.00 0.45 C ATOM 865 O TYR A 61 6.880 4.640 2.612 1.00 0.56 O ATOM 866 CB TYR A 61 4.844 6.725 2.776 1.00 0.42 C ATOM 867 CG TYR A 61 3.445 7.317 2.743 1.00 0.47 C ATOM 868 CD1 TYR A 61 2.361 6.571 2.317 1.00 0.59 C ATOM 869 CD2 TYR A 61 3.219 8.633 3.126 1.00 0.82 C ATOM 870 CE1 TYR A 61 1.092 7.112 2.272 1.00 0.64 C ATOM 871 CE2 TYR A 61 1.953 9.182 3.087 1.00 0.99 C ATOM 872 CZ TYR A 61 0.879 8.385 2.708 1.00 0.78 C ATOM 873 OH TYR A 61 -0.371 8.953 2.620 1.00 0.96 O ATOM 0 H TYR A 61 5.404 6.749 5.435 1.00 0.35 H new ATOM 0 HA TYR A 61 4.211 4.834 3.492 1.00 0.40 H new ATOM 0 HB2 TYR A 61 5.557 7.505 3.043 1.00 0.42 H new ATOM 0 HB3 TYR A 61 5.110 6.377 1.778 1.00 0.42 H new ATOM 0 HD1 TYR A 61 2.510 5.545 2.014 1.00 0.59 H new ATOM 0 HD2 TYR A 61 4.049 9.238 3.460 1.00 0.82 H new ATOM 0 HE1 TYR A 61 0.268 6.526 1.891 1.00 0.64 H new ATOM 0 HE2 TYR A 61 1.799 10.219 3.348 1.00 0.99 H new ATOM 0 HH TYR A 61 -0.501 9.575 3.366 1.00 0.96 H new ATOM 883 N GLN A 62 6.872 4.653 4.869 1.00 0.43 N ATOM 884 CA GLN A 62 8.158 4.010 5.060 1.00 0.58 C ATOM 885 C GLN A 62 7.977 2.821 6.009 1.00 0.73 C ATOM 886 O GLN A 62 7.039 2.052 5.849 1.00 1.49 O ATOM 887 CB GLN A 62 9.125 5.042 5.653 1.00 0.63 C ATOM 888 CG GLN A 62 10.592 4.652 5.641 1.00 0.99 C ATOM 889 CD GLN A 62 11.459 5.731 6.255 1.00 1.18 C ATOM 890 OE1 GLN A 62 12.507 5.457 6.824 1.00 1.97 O ATOM 891 NE2 GLN A 62 11.014 6.975 6.155 1.00 1.13 N ATOM 0 H GLN A 62 6.412 4.902 5.744 1.00 0.43 H new ATOM 0 HA GLN A 62 8.562 3.643 4.116 1.00 0.58 H new ATOM 0 HB2 GLN A 62 9.012 5.977 5.103 1.00 0.63 H new ATOM 0 HB3 GLN A 62 8.829 5.240 6.683 1.00 0.63 H new ATOM 0 HG2 GLN A 62 10.726 3.720 6.190 1.00 0.99 H new ATOM 0 HG3 GLN A 62 10.912 4.467 4.616 1.00 0.99 H new ATOM 0 HE21 GLN A 62 10.135 7.165 5.673 1.00 1.13 H new ATOM 0 HE22 GLN A 62 11.550 7.742 6.560 1.00 1.13 H new ATOM 900 N THR A 63 8.834 2.747 7.029 1.00 0.44 N ATOM 901 CA THR A 63 8.879 1.641 8.006 1.00 0.48 C ATOM 902 C THR A 63 8.648 0.240 7.412 1.00 0.61 C ATOM 903 O THR A 63 7.531 -0.126 7.066 1.00 1.27 O ATOM 904 CB THR A 63 7.876 1.873 9.153 1.00 0.50 C ATOM 905 OG1 THR A 63 6.564 2.101 8.643 1.00 0.89 O ATOM 906 CG2 THR A 63 8.304 3.045 10.003 1.00 0.89 C ATOM 0 H THR A 63 9.534 3.467 7.209 1.00 0.44 H new ATOM 0 HA THR A 63 9.903 1.654 8.380 1.00 0.48 H new ATOM 0 HB THR A 63 7.860 0.974 9.769 1.00 0.50 H new ATOM 0 HG1 THR A 63 6.424 3.063 8.520 1.00 0.89 H new ATOM 0 HG21 THR A 63 7.584 3.193 10.807 1.00 0.89 H new ATOM 0 HG22 THR A 63 9.287 2.846 10.429 1.00 0.89 H new ATOM 0 HG23 THR A 63 8.350 3.943 9.387 1.00 0.89 H new ATOM 914 N GLU A 64 9.716 -0.540 7.318 1.00 0.53 N ATOM 915 CA GLU A 64 9.614 -1.966 7.001 1.00 0.53 C ATOM 916 C GLU A 64 9.665 -2.748 8.317 1.00 0.58 C ATOM 917 O GLU A 64 10.257 -2.276 9.290 1.00 0.99 O ATOM 918 CB GLU A 64 10.779 -2.394 6.100 1.00 0.67 C ATOM 919 CG GLU A 64 12.146 -2.203 6.745 1.00 1.00 C ATOM 920 CD GLU A 64 13.298 -2.511 5.813 1.00 1.42 C ATOM 921 OE1 GLU A 64 13.689 -1.622 5.033 1.00 1.96 O ATOM 922 OE2 GLU A 64 13.833 -3.639 5.873 1.00 1.78 O ATOM 0 H GLU A 64 10.671 -0.210 7.457 1.00 0.53 H new ATOM 0 HA GLU A 64 8.681 -2.165 6.473 1.00 0.53 H new ATOM 0 HB2 GLU A 64 10.655 -3.443 5.833 1.00 0.67 H new ATOM 0 HB3 GLU A 64 10.740 -1.822 5.173 1.00 0.67 H new ATOM 0 HG2 GLU A 64 12.235 -1.174 7.093 1.00 1.00 H new ATOM 0 HG3 GLU A 64 12.218 -2.844 7.624 1.00 1.00 H new ATOM 929 N ARG A 65 9.047 -3.922 8.366 1.00 0.85 N ATOM 930 CA ARG A 65 9.001 -4.688 9.615 1.00 0.96 C ATOM 931 C ARG A 65 9.587 -6.093 9.458 1.00 1.17 C ATOM 932 O ARG A 65 10.380 -6.533 10.289 1.00 2.02 O ATOM 933 CB ARG A 65 7.561 -4.775 10.129 1.00 0.96 C ATOM 934 CG ARG A 65 6.640 -5.548 9.211 1.00 1.17 C ATOM 935 CD ARG A 65 5.182 -5.425 9.605 1.00 1.09 C ATOM 936 NE ARG A 65 4.386 -6.398 8.871 1.00 1.70 N ATOM 937 CZ ARG A 65 3.126 -6.233 8.525 1.00 2.50 C ATOM 938 NH1 ARG A 65 2.443 -5.174 8.942 1.00 2.93 N ATOM 939 NH2 ARG A 65 2.548 -7.146 7.760 1.00 3.35 N ATOM 0 H ARG A 65 8.578 -4.362 7.574 1.00 0.85 H new ATOM 0 HA ARG A 65 9.618 -4.158 10.341 1.00 0.96 H new ATOM 0 HB2 ARG A 65 7.562 -5.247 11.112 1.00 0.96 H new ATOM 0 HB3 ARG A 65 7.168 -3.767 10.260 1.00 0.96 H new ATOM 0 HG2 ARG A 65 6.767 -5.189 8.190 1.00 1.17 H new ATOM 0 HG3 ARG A 65 6.926 -6.600 9.218 1.00 1.17 H new ATOM 0 HD2 ARG A 65 5.071 -5.586 10.677 1.00 1.09 H new ATOM 0 HD3 ARG A 65 4.824 -4.417 9.396 1.00 1.09 H new ATOM 0 HE ARG A 65 4.838 -7.273 8.605 1.00 1.70 H new ATOM 0 HH11 ARG A 65 2.894 -4.478 9.536 1.00 2.93 H new ATOM 0 HH12 ARG A 65 1.468 -5.056 8.668 1.00 2.93 H new ATOM 0 HH21 ARG A 65 3.078 -7.960 7.449 1.00 3.35 H new ATOM 0 HH22 ARG A 65 1.573 -7.035 7.482 1.00 3.35 H new ATOM 1015 N SER A 70 3.886 -14.249 1.057 1.00 0.78 N ATOM 1016 CA SER A 70 2.851 -13.497 0.344 1.00 0.76 C ATOM 1017 C SER A 70 2.017 -12.708 1.350 1.00 0.82 C ATOM 1018 O SER A 70 1.187 -13.274 2.065 1.00 1.01 O ATOM 1019 CB SER A 70 1.956 -14.449 -0.457 1.00 0.96 C ATOM 1020 OG SER A 70 1.120 -13.739 -1.358 1.00 1.41 O ATOM 0 HA SER A 70 3.325 -12.806 -0.353 1.00 0.76 H new ATOM 0 HB2 SER A 70 2.576 -15.153 -1.012 1.00 0.96 H new ATOM 0 HB3 SER A 70 1.342 -15.035 0.227 1.00 0.96 H new ATOM 0 HG SER A 70 0.228 -14.145 -1.366 1.00 1.41 H new ATOM 1026 N PHE A 71 2.294 -11.409 1.438 1.00 0.78 N ATOM 1027 CA PHE A 71 1.646 -10.556 2.417 1.00 0.94 C ATOM 1028 C PHE A 71 0.167 -10.441 2.089 1.00 0.58 C ATOM 1029 O PHE A 71 -0.211 -9.744 1.147 1.00 0.79 O ATOM 1030 CB PHE A 71 2.270 -9.156 2.429 1.00 1.57 C ATOM 1031 CG PHE A 71 3.662 -9.039 2.989 1.00 1.10 C ATOM 1032 CD1 PHE A 71 4.072 -9.776 4.088 1.00 1.38 C ATOM 1033 CD2 PHE A 71 4.554 -8.144 2.419 1.00 1.10 C ATOM 1034 CE1 PHE A 71 5.350 -9.623 4.601 1.00 1.18 C ATOM 1035 CE2 PHE A 71 5.827 -7.990 2.924 1.00 1.29 C ATOM 1036 CZ PHE A 71 6.227 -8.727 4.014 1.00 1.02 C ATOM 0 H PHE A 71 2.965 -10.928 0.839 1.00 0.78 H new ATOM 0 HA PHE A 71 1.780 -11.004 3.402 1.00 0.94 H new ATOM 0 HB2 PHE A 71 2.283 -8.781 1.406 1.00 1.57 H new ATOM 0 HB3 PHE A 71 1.617 -8.498 3.002 1.00 1.57 H new ATOM 0 HD1 PHE A 71 3.390 -10.475 4.549 1.00 1.38 H new ATOM 0 HD2 PHE A 71 4.246 -7.558 1.566 1.00 1.10 H new ATOM 0 HE1 PHE A 71 5.662 -10.202 5.458 1.00 1.18 H new ATOM 0 HE2 PHE A 71 6.510 -7.291 2.464 1.00 1.29 H new ATOM 0 HZ PHE A 71 7.224 -8.607 4.412 1.00 1.02 H new ATOM 1046 N GLY A 72 -0.667 -11.125 2.854 1.00 0.46 N ATOM 1047 CA GLY A 72 -2.073 -11.128 2.552 1.00 0.78 C ATOM 1048 C GLY A 72 -2.914 -10.362 3.531 1.00 0.58 C ATOM 1049 O GLY A 72 -3.339 -10.888 4.559 1.00 0.74 O ATOM 0 H GLY A 72 -0.395 -11.672 3.671 1.00 0.46 H new ATOM 0 HA2 GLY A 72 -2.220 -10.708 1.557 1.00 0.78 H new ATOM 0 HA3 GLY A 72 -2.424 -12.159 2.518 1.00 0.78 H new ATOM 1053 N TYR A 73 -3.177 -9.120 3.194 1.00 0.39 N ATOM 1054 CA TYR A 73 -4.025 -8.278 4.009 1.00 0.36 C ATOM 1055 C TYR A 73 -5.481 -8.504 3.678 1.00 0.34 C ATOM 1056 O TYR A 73 -5.833 -8.811 2.535 1.00 0.43 O ATOM 1057 CB TYR A 73 -3.678 -6.815 3.809 1.00 0.51 C ATOM 1058 CG TYR A 73 -2.418 -6.409 4.516 1.00 0.58 C ATOM 1059 CD1 TYR A 73 -2.392 -6.243 5.890 1.00 0.72 C ATOM 1060 CD2 TYR A 73 -1.252 -6.193 3.801 1.00 0.78 C ATOM 1061 CE1 TYR A 73 -1.233 -5.877 6.535 1.00 0.89 C ATOM 1062 CE2 TYR A 73 -0.093 -5.825 4.435 1.00 0.97 C ATOM 1063 CZ TYR A 73 -0.112 -5.650 5.833 1.00 0.99 C ATOM 1064 OH TYR A 73 1.073 -5.311 6.431 1.00 1.21 O ATOM 0 H TYR A 73 -2.813 -8.667 2.355 1.00 0.39 H new ATOM 0 HA TYR A 73 -3.855 -8.544 5.052 1.00 0.36 H new ATOM 0 HB2 TYR A 73 -3.570 -6.615 2.743 1.00 0.51 H new ATOM 0 HB3 TYR A 73 -4.503 -6.199 4.167 1.00 0.51 H new ATOM 0 HD1 TYR A 73 -3.293 -6.403 6.463 1.00 0.72 H new ATOM 0 HD2 TYR A 73 -1.255 -6.316 2.728 1.00 0.78 H new ATOM 0 HE1 TYR A 73 -1.225 -5.772 7.610 1.00 0.89 H new ATOM 0 HE2 TYR A 73 0.817 -5.672 3.874 1.00 0.97 H new ATOM 0 HH TYR A 73 1.099 -4.343 6.579 1.00 1.21 H new ATOM 1074 N ASP A 74 -6.327 -8.352 4.675 1.00 0.35 N ATOM 1075 CA ASP A 74 -7.744 -8.505 4.473 1.00 0.39 C ATOM 1076 C ASP A 74 -8.478 -7.285 5.005 1.00 0.34 C ATOM 1077 O ASP A 74 -8.267 -6.844 6.134 1.00 0.44 O ATOM 1078 CB ASP A 74 -8.241 -9.810 5.103 1.00 0.57 C ATOM 1079 CG ASP A 74 -8.484 -9.736 6.595 1.00 1.58 C ATOM 1080 OD1 ASP A 74 -7.509 -9.595 7.359 1.00 1.92 O ATOM 1081 OD2 ASP A 74 -9.658 -9.863 7.008 1.00 2.47 O ATOM 0 H ASP A 74 -6.054 -8.123 5.631 1.00 0.35 H new ATOM 0 HA ASP A 74 -7.954 -8.573 3.405 1.00 0.39 H new ATOM 0 HB2 ASP A 74 -9.168 -10.106 4.611 1.00 0.57 H new ATOM 0 HB3 ASP A 74 -7.511 -10.595 4.905 1.00 0.57 H new ATOM 1086 N ILE A 75 -9.295 -6.716 4.143 1.00 0.28 N ATOM 1087 CA ILE A 75 -10.024 -5.496 4.427 1.00 0.27 C ATOM 1088 C ILE A 75 -11.504 -5.821 4.554 1.00 0.27 C ATOM 1089 O ILE A 75 -12.212 -5.866 3.548 1.00 0.26 O ATOM 1090 CB ILE A 75 -9.861 -4.445 3.291 1.00 0.25 C ATOM 1091 CG1 ILE A 75 -8.403 -4.066 3.019 1.00 0.28 C ATOM 1092 CG2 ILE A 75 -10.638 -3.188 3.619 1.00 0.29 C ATOM 1093 CD1 ILE A 75 -7.578 -5.126 2.338 1.00 0.38 C ATOM 0 H ILE A 75 -9.474 -7.093 3.212 1.00 0.28 H new ATOM 0 HA ILE A 75 -9.623 -5.079 5.351 1.00 0.27 H new ATOM 0 HB ILE A 75 -10.253 -4.917 2.390 1.00 0.25 H new ATOM 0 HG12 ILE A 75 -8.388 -3.166 2.404 1.00 0.28 H new ATOM 0 HG13 ILE A 75 -7.928 -3.812 3.967 1.00 0.28 H new ATOM 0 HG21 ILE A 75 -10.514 -2.463 2.815 1.00 0.29 H new ATOM 0 HG22 ILE A 75 -11.695 -3.432 3.728 1.00 0.29 H new ATOM 0 HG23 ILE A 75 -10.266 -2.763 4.551 1.00 0.29 H new ATOM 0 HD11 ILE A 75 -6.562 -4.758 2.191 1.00 0.38 H new ATOM 0 HD12 ILE A 75 -7.554 -6.022 2.958 1.00 0.38 H new ATOM 0 HD13 ILE A 75 -8.020 -5.366 1.371 1.00 0.38 H new ATOM 1105 N PRO A 76 -11.994 -6.093 5.766 1.00 0.32 N ATOM 1106 CA PRO A 76 -13.405 -6.419 5.979 1.00 0.35 C ATOM 1107 C PRO A 76 -14.323 -5.302 5.479 1.00 0.34 C ATOM 1108 O PRO A 76 -14.286 -4.179 5.988 1.00 0.41 O ATOM 1109 CB PRO A 76 -13.520 -6.562 7.493 1.00 0.45 C ATOM 1110 CG PRO A 76 -12.134 -6.840 7.966 1.00 0.59 C ATOM 1111 CD PRO A 76 -11.224 -6.111 7.019 1.00 0.41 C ATOM 0 HA PRO A 76 -13.706 -7.315 5.436 1.00 0.35 H new ATOM 0 HB2 PRO A 76 -13.915 -5.653 7.945 1.00 0.45 H new ATOM 0 HB3 PRO A 76 -14.198 -7.372 7.762 1.00 0.45 H new ATOM 0 HG2 PRO A 76 -11.993 -6.492 8.989 1.00 0.59 H new ATOM 0 HG3 PRO A 76 -11.927 -7.910 7.962 1.00 0.59 H new ATOM 0 HD2 PRO A 76 -11.001 -5.103 7.370 1.00 0.41 H new ATOM 0 HD3 PRO A 76 -10.271 -6.626 6.899 1.00 0.41 H new ATOM 1119 N ILE A 77 -15.147 -5.616 4.489 1.00 0.31 N ATOM 1120 CA ILE A 77 -15.957 -4.606 3.828 1.00 0.30 C ATOM 1121 C ILE A 77 -17.445 -4.845 4.051 1.00 0.36 C ATOM 1122 O ILE A 77 -17.947 -5.954 3.866 1.00 0.40 O ATOM 1123 CB ILE A 77 -15.666 -4.572 2.312 1.00 0.26 C ATOM 1124 CG1 ILE A 77 -14.233 -4.092 2.060 1.00 0.28 C ATOM 1125 CG2 ILE A 77 -16.665 -3.681 1.584 1.00 0.30 C ATOM 1126 CD1 ILE A 77 -13.863 -3.996 0.596 1.00 0.49 C ATOM 0 H ILE A 77 -15.271 -6.562 4.127 1.00 0.31 H new ATOM 0 HA ILE A 77 -15.690 -3.646 4.269 1.00 0.30 H new ATOM 0 HB ILE A 77 -15.771 -5.584 1.920 1.00 0.26 H new ATOM 0 HG12 ILE A 77 -14.102 -3.113 2.522 1.00 0.28 H new ATOM 0 HG13 ILE A 77 -13.541 -4.773 2.555 1.00 0.28 H new ATOM 0 HG21 ILE A 77 -16.437 -3.675 0.518 1.00 0.30 H new ATOM 0 HG22 ILE A 77 -17.674 -4.064 1.737 1.00 0.30 H new ATOM 0 HG23 ILE A 77 -16.599 -2.666 1.975 1.00 0.30 H new ATOM 0 HD11 ILE A 77 -12.834 -3.649 0.503 1.00 0.49 H new ATOM 0 HD12 ILE A 77 -13.959 -4.977 0.131 1.00 0.49 H new ATOM 0 HD13 ILE A 77 -14.529 -3.292 0.098 1.00 0.49 H new ATOM 1138 N LYS A 78 -18.143 -3.797 4.460 1.00 0.44 N ATOM 1139 CA LYS A 78 -19.586 -3.854 4.617 1.00 0.54 C ATOM 1140 C LYS A 78 -20.276 -2.949 3.605 1.00 0.55 C ATOM 1141 O LYS A 78 -21.425 -3.183 3.232 1.00 0.71 O ATOM 1142 CB LYS A 78 -19.996 -3.426 6.026 1.00 0.71 C ATOM 1143 CG LYS A 78 -19.532 -4.360 7.130 1.00 1.23 C ATOM 1144 CD LYS A 78 -19.946 -3.829 8.490 1.00 1.82 C ATOM 1145 CE LYS A 78 -19.512 -4.751 9.612 1.00 2.66 C ATOM 1146 NZ LYS A 78 -19.848 -4.180 10.939 1.00 3.32 N ATOM 0 H LYS A 78 -17.730 -2.893 4.690 1.00 0.44 H new ATOM 0 HA LYS A 78 -19.893 -4.886 4.448 1.00 0.54 H new ATOM 0 HB2 LYS A 78 -19.598 -2.430 6.219 1.00 0.71 H new ATOM 0 HB3 LYS A 78 -21.082 -3.348 6.066 1.00 0.71 H new ATOM 0 HG2 LYS A 78 -19.957 -5.352 6.977 1.00 1.23 H new ATOM 0 HG3 LYS A 78 -18.448 -4.468 7.091 1.00 1.23 H new ATOM 0 HD2 LYS A 78 -19.510 -2.842 8.642 1.00 1.82 H new ATOM 0 HD3 LYS A 78 -21.029 -3.707 8.518 1.00 1.82 H new ATOM 0 HE2 LYS A 78 -19.997 -5.720 9.497 1.00 2.66 H new ATOM 0 HE3 LYS A 78 -18.437 -4.923 9.549 1.00 2.66 H new ATOM 0 HZ1 LYS A 78 -19.539 -4.834 11.687 1.00 3.32 H new ATOM 0 HZ2 LYS A 78 -19.365 -3.266 11.056 1.00 3.32 H new ATOM 0 HZ3 LYS A 78 -20.876 -4.039 11.006 1.00 3.32 H new ATOM 1160 N GLU A 79 -19.564 -1.932 3.134 1.00 0.46 N ATOM 1161 CA GLU A 79 -20.192 -0.875 2.362 1.00 0.47 C ATOM 1162 C GLU A 79 -19.981 -1.102 0.877 1.00 0.36 C ATOM 1163 O GLU A 79 -19.297 -2.045 0.472 1.00 0.39 O ATOM 1164 CB GLU A 79 -19.610 0.478 2.775 1.00 0.60 C ATOM 1165 CG GLU A 79 -19.787 0.794 4.251 1.00 1.02 C ATOM 1166 CD GLU A 79 -21.228 1.073 4.617 1.00 1.41 C ATOM 1167 OE1 GLU A 79 -22.001 0.110 4.775 1.00 2.16 O ATOM 1168 OE2 GLU A 79 -21.589 2.264 4.744 1.00 1.87 O ATOM 0 H GLU A 79 -18.560 -1.820 3.273 1.00 0.46 H new ATOM 0 HA GLU A 79 -21.264 -0.883 2.561 1.00 0.47 H new ATOM 0 HB2 GLU A 79 -18.547 0.495 2.534 1.00 0.60 H new ATOM 0 HB3 GLU A 79 -20.084 1.263 2.185 1.00 0.60 H new ATOM 0 HG2 GLU A 79 -19.421 -0.044 4.845 1.00 1.02 H new ATOM 0 HG3 GLU A 79 -19.176 1.659 4.509 1.00 1.02 H new ATOM 1175 N GLU A 80 -20.579 -0.244 0.074 1.00 0.38 N ATOM 1176 CA GLU A 80 -20.365 -0.261 -1.357 1.00 0.34 C ATOM 1177 C GLU A 80 -19.943 1.119 -1.831 1.00 0.35 C ATOM 1178 O GLU A 80 -20.157 2.117 -1.142 1.00 0.52 O ATOM 1179 CB GLU A 80 -21.624 -0.750 -2.080 1.00 0.42 C ATOM 1180 CG GLU A 80 -21.831 -0.178 -3.462 1.00 0.71 C ATOM 1181 CD GLU A 80 -23.288 -0.097 -3.862 1.00 0.84 C ATOM 1182 OE1 GLU A 80 -24.012 -1.101 -3.691 1.00 1.20 O ATOM 1183 OE2 GLU A 80 -23.719 0.981 -4.328 1.00 0.90 O ATOM 0 H GLU A 80 -21.223 0.480 0.394 1.00 0.38 H new ATOM 0 HA GLU A 80 -19.562 -0.959 -1.595 1.00 0.34 H new ATOM 0 HB2 GLU A 80 -21.582 -1.837 -2.156 1.00 0.42 H new ATOM 0 HB3 GLU A 80 -22.493 -0.507 -1.469 1.00 0.42 H new ATOM 0 HG2 GLU A 80 -21.393 0.819 -3.505 1.00 0.71 H new ATOM 0 HG3 GLU A 80 -21.296 -0.792 -4.186 1.00 0.71 H new ATOM 1190 N GLY A 81 -19.346 1.159 -3.001 1.00 0.30 N ATOM 1191 CA GLY A 81 -18.811 2.397 -3.527 1.00 0.28 C ATOM 1192 C GLY A 81 -17.477 2.182 -4.202 1.00 0.24 C ATOM 1193 O GLY A 81 -17.116 1.044 -4.513 1.00 0.28 O ATOM 0 H GLY A 81 -19.218 0.349 -3.607 1.00 0.30 H new ATOM 0 HA2 GLY A 81 -19.516 2.825 -4.240 1.00 0.28 H new ATOM 0 HA3 GLY A 81 -18.698 3.119 -2.718 1.00 0.28 H new ATOM 1197 N GLU A 82 -16.732 3.256 -4.431 1.00 0.22 N ATOM 1198 CA GLU A 82 -15.427 3.125 -5.053 1.00 0.23 C ATOM 1199 C GLU A 82 -14.347 3.154 -3.993 1.00 0.22 C ATOM 1200 O GLU A 82 -14.077 4.191 -3.414 1.00 0.26 O ATOM 1201 CB GLU A 82 -15.177 4.243 -6.062 1.00 0.29 C ATOM 1202 CG GLU A 82 -16.277 4.400 -7.090 1.00 0.42 C ATOM 1203 CD GLU A 82 -15.863 5.300 -8.228 1.00 1.11 C ATOM 1204 OE1 GLU A 82 -15.990 6.531 -8.089 1.00 1.96 O ATOM 1205 OE2 GLU A 82 -15.407 4.779 -9.267 1.00 1.30 O ATOM 0 H GLU A 82 -17.005 4.211 -4.199 1.00 0.22 H new ATOM 0 HA GLU A 82 -15.402 2.173 -5.582 1.00 0.23 H new ATOM 0 HB2 GLU A 82 -15.059 5.184 -5.525 1.00 0.29 H new ATOM 0 HB3 GLU A 82 -14.236 4.050 -6.578 1.00 0.29 H new ATOM 0 HG2 GLU A 82 -16.548 3.420 -7.483 1.00 0.42 H new ATOM 0 HG3 GLU A 82 -17.166 4.808 -6.610 1.00 0.42 H new ATOM 1212 N TYR A 83 -13.701 2.038 -3.749 1.00 0.21 N ATOM 1213 CA TYR A 83 -12.666 2.019 -2.739 1.00 0.22 C ATOM 1214 C TYR A 83 -11.341 2.252 -3.407 1.00 0.22 C ATOM 1215 O TYR A 83 -10.958 1.530 -4.320 1.00 0.22 O ATOM 1216 CB TYR A 83 -12.636 0.684 -2.000 1.00 0.25 C ATOM 1217 CG TYR A 83 -13.849 0.421 -1.146 1.00 0.27 C ATOM 1218 CD1 TYR A 83 -14.052 1.129 0.025 1.00 0.67 C ATOM 1219 CD2 TYR A 83 -14.797 -0.523 -1.511 1.00 0.59 C ATOM 1220 CE1 TYR A 83 -15.155 0.905 0.807 1.00 0.71 C ATOM 1221 CE2 TYR A 83 -15.908 -0.750 -0.733 1.00 0.60 C ATOM 1222 CZ TYR A 83 -16.074 -0.089 0.419 1.00 0.39 C ATOM 1223 OH TYR A 83 -17.188 -0.252 1.201 1.00 0.44 O ATOM 0 H TYR A 83 -13.867 1.150 -4.223 1.00 0.21 H new ATOM 0 HA TYR A 83 -12.872 2.802 -2.009 1.00 0.22 H new ATOM 0 HB2 TYR A 83 -12.539 -0.120 -2.730 1.00 0.25 H new ATOM 0 HB3 TYR A 83 -11.748 0.651 -1.369 1.00 0.25 H new ATOM 0 HD1 TYR A 83 -13.329 1.871 0.328 1.00 0.67 H new ATOM 0 HD2 TYR A 83 -14.661 -1.089 -2.421 1.00 0.59 H new ATOM 0 HE1 TYR A 83 -15.317 1.481 1.706 1.00 0.71 H new ATOM 0 HE2 TYR A 83 -16.651 -1.466 -1.053 1.00 0.60 H new ATOM 0 HH TYR A 83 -16.918 -0.536 2.099 1.00 0.44 H new ATOM 1233 N VAL A 84 -10.634 3.251 -2.943 1.00 0.22 N ATOM 1234 CA VAL A 84 -9.401 3.632 -3.578 1.00 0.22 C ATOM 1235 C VAL A 84 -8.230 3.167 -2.747 1.00 0.23 C ATOM 1236 O VAL A 84 -7.943 3.697 -1.670 1.00 0.24 O ATOM 1237 CB VAL A 84 -9.346 5.150 -3.861 1.00 0.22 C ATOM 1238 CG1 VAL A 84 -7.951 5.588 -4.280 1.00 0.26 C ATOM 1239 CG2 VAL A 84 -10.348 5.489 -4.943 1.00 0.25 C ATOM 0 H VAL A 84 -10.891 3.812 -2.131 1.00 0.22 H new ATOM 0 HA VAL A 84 -9.346 3.140 -4.549 1.00 0.22 H new ATOM 0 HB VAL A 84 -9.595 5.684 -2.944 1.00 0.22 H new ATOM 0 HG11 VAL A 84 -7.949 6.661 -4.471 1.00 0.26 H new ATOM 0 HG12 VAL A 84 -7.243 5.360 -3.483 1.00 0.26 H new ATOM 0 HG13 VAL A 84 -7.660 5.057 -5.187 1.00 0.26 H new ATOM 0 HG21 VAL A 84 -10.314 6.559 -5.148 1.00 0.25 H new ATOM 0 HG22 VAL A 84 -10.103 4.938 -5.851 1.00 0.25 H new ATOM 0 HG23 VAL A 84 -11.349 5.214 -4.611 1.00 0.25 H new ATOM 1249 N LEU A 85 -7.589 2.133 -3.249 1.00 0.25 N ATOM 1250 CA LEU A 85 -6.474 1.526 -2.576 1.00 0.30 C ATOM 1251 C LEU A 85 -5.193 2.205 -3.017 1.00 0.29 C ATOM 1252 O LEU A 85 -4.701 1.961 -4.110 1.00 0.31 O ATOM 1253 CB LEU A 85 -6.422 0.044 -2.933 1.00 0.40 C ATOM 1254 CG LEU A 85 -5.529 -0.810 -2.046 1.00 0.92 C ATOM 1255 CD1 LEU A 85 -6.252 -1.159 -0.760 1.00 1.56 C ATOM 1256 CD2 LEU A 85 -5.095 -2.062 -2.786 1.00 1.13 C ATOM 0 H LEU A 85 -7.831 1.693 -4.137 1.00 0.25 H new ATOM 0 HA LEU A 85 -6.586 1.636 -1.497 1.00 0.30 H new ATOM 0 HB2 LEU A 85 -7.435 -0.357 -2.894 1.00 0.40 H new ATOM 0 HB3 LEU A 85 -6.080 -0.052 -3.964 1.00 0.40 H new ATOM 0 HG LEU A 85 -4.634 -0.242 -1.790 1.00 0.92 H new ATOM 0 HD11 LEU A 85 -5.604 -1.771 -0.133 1.00 1.56 H new ATOM 0 HD12 LEU A 85 -6.512 -0.243 -0.229 1.00 1.56 H new ATOM 0 HD13 LEU A 85 -7.161 -1.714 -0.993 1.00 1.56 H new ATOM 0 HD21 LEU A 85 -4.456 -2.664 -2.139 1.00 1.13 H new ATOM 0 HD22 LEU A 85 -5.974 -2.641 -3.068 1.00 1.13 H new ATOM 0 HD23 LEU A 85 -4.542 -1.782 -3.683 1.00 1.13 H new ATOM 1268 N VAL A 86 -4.661 3.056 -2.173 1.00 0.31 N ATOM 1269 CA VAL A 86 -3.428 3.749 -2.487 1.00 0.34 C ATOM 1270 C VAL A 86 -2.337 3.294 -1.532 1.00 0.32 C ATOM 1271 O VAL A 86 -2.355 3.598 -0.338 1.00 0.32 O ATOM 1272 CB VAL A 86 -3.602 5.289 -2.455 1.00 0.41 C ATOM 1273 CG1 VAL A 86 -4.314 5.742 -1.193 1.00 1.05 C ATOM 1274 CG2 VAL A 86 -2.256 5.992 -2.589 1.00 1.14 C ATOM 0 H VAL A 86 -5.060 3.287 -1.263 1.00 0.31 H new ATOM 0 HA VAL A 86 -3.139 3.495 -3.507 1.00 0.34 H new ATOM 0 HB VAL A 86 -4.223 5.565 -3.307 1.00 0.41 H new ATOM 0 HG11 VAL A 86 -4.419 6.827 -1.204 1.00 1.05 H new ATOM 0 HG12 VAL A 86 -5.301 5.282 -1.147 1.00 1.05 H new ATOM 0 HG13 VAL A 86 -3.734 5.442 -0.320 1.00 1.05 H new ATOM 0 HG21 VAL A 86 -2.405 7.071 -2.564 1.00 1.14 H new ATOM 0 HG22 VAL A 86 -1.607 5.696 -1.765 1.00 1.14 H new ATOM 0 HG23 VAL A 86 -1.792 5.712 -3.535 1.00 1.14 H new ATOM 1284 N LEU A 87 -1.412 2.518 -2.054 1.00 0.33 N ATOM 1285 CA LEU A 87 -0.364 1.946 -1.239 1.00 0.32 C ATOM 1286 C LEU A 87 0.992 2.522 -1.611 1.00 0.28 C ATOM 1287 O LEU A 87 1.272 2.780 -2.784 1.00 0.29 O ATOM 1288 CB LEU A 87 -0.374 0.411 -1.362 1.00 0.42 C ATOM 1289 CG LEU A 87 -0.635 -0.160 -2.765 1.00 0.57 C ATOM 1290 CD1 LEU A 87 0.587 -0.022 -3.658 1.00 1.37 C ATOM 1291 CD2 LEU A 87 -1.064 -1.617 -2.672 1.00 1.44 C ATOM 0 H LEU A 87 -1.365 2.269 -3.042 1.00 0.33 H new ATOM 0 HA LEU A 87 -0.553 2.206 -0.197 1.00 0.32 H new ATOM 0 HB2 LEU A 87 0.587 0.034 -1.013 1.00 0.42 H new ATOM 0 HB3 LEU A 87 -1.134 0.019 -0.687 1.00 0.42 H new ATOM 0 HG LEU A 87 -1.442 0.418 -3.216 1.00 0.57 H new ATOM 0 HD11 LEU A 87 0.367 -0.436 -4.642 1.00 1.37 H new ATOM 0 HD12 LEU A 87 0.848 1.032 -3.757 1.00 1.37 H new ATOM 0 HD13 LEU A 87 1.424 -0.563 -3.216 1.00 1.37 H new ATOM 0 HD21 LEU A 87 -1.245 -2.008 -3.673 1.00 1.44 H new ATOM 0 HD22 LEU A 87 -0.276 -2.198 -2.193 1.00 1.44 H new ATOM 0 HD23 LEU A 87 -1.978 -1.690 -2.083 1.00 1.44 H new ATOM 1303 N LYS A 88 1.818 2.768 -0.608 1.00 0.28 N ATOM 1304 CA LYS A 88 3.193 3.184 -0.869 1.00 0.28 C ATOM 1305 C LYS A 88 4.131 2.003 -0.735 1.00 0.28 C ATOM 1306 O LYS A 88 4.035 1.222 0.212 1.00 0.39 O ATOM 1307 CB LYS A 88 3.648 4.294 0.078 1.00 0.35 C ATOM 1308 CG LYS A 88 3.809 5.658 -0.572 1.00 0.67 C ATOM 1309 CD LYS A 88 2.497 6.174 -1.144 1.00 1.91 C ATOM 1310 CE LYS A 88 2.621 7.613 -1.616 1.00 2.70 C ATOM 1311 NZ LYS A 88 1.321 8.158 -2.086 1.00 3.73 N ATOM 0 H LYS A 88 1.571 2.690 0.379 1.00 0.28 H new ATOM 0 HA LYS A 88 3.221 3.573 -1.887 1.00 0.28 H new ATOM 0 HB2 LYS A 88 2.927 4.377 0.891 1.00 0.35 H new ATOM 0 HB3 LYS A 88 4.600 4.005 0.524 1.00 0.35 H new ATOM 0 HG2 LYS A 88 4.188 6.368 0.163 1.00 0.67 H new ATOM 0 HG3 LYS A 88 4.552 5.595 -1.367 1.00 0.67 H new ATOM 0 HD2 LYS A 88 2.189 5.542 -1.977 1.00 1.91 H new ATOM 0 HD3 LYS A 88 1.717 6.105 -0.386 1.00 1.91 H new ATOM 0 HE2 LYS A 88 3.000 8.230 -0.802 1.00 2.70 H new ATOM 0 HE3 LYS A 88 3.351 7.668 -2.424 1.00 2.70 H new ATOM 0 HZ1 LYS A 88 1.399 9.188 -2.206 1.00 3.73 H new ATOM 0 HZ2 LYS A 88 1.070 7.722 -2.996 1.00 3.73 H new ATOM 0 HZ3 LYS A 88 0.582 7.946 -1.385 1.00 3.73 H new ATOM 1325 N PHE A 89 5.022 1.871 -1.693 1.00 0.27 N ATOM 1326 CA PHE A 89 6.043 0.839 -1.643 1.00 0.28 C ATOM 1327 C PHE A 89 7.418 1.462 -1.584 1.00 0.28 C ATOM 1328 O PHE A 89 7.696 2.426 -2.287 1.00 0.29 O ATOM 1329 CB PHE A 89 5.957 -0.080 -2.856 1.00 0.32 C ATOM 1330 CG PHE A 89 4.907 -1.140 -2.728 1.00 0.32 C ATOM 1331 CD1 PHE A 89 4.817 -1.934 -1.595 1.00 0.37 C ATOM 1332 CD2 PHE A 89 3.989 -1.323 -3.745 1.00 0.37 C ATOM 1333 CE1 PHE A 89 3.830 -2.889 -1.489 1.00 0.44 C ATOM 1334 CE2 PHE A 89 2.998 -2.271 -3.640 1.00 0.42 C ATOM 1335 CZ PHE A 89 3.010 -3.144 -2.475 1.00 0.45 C ATOM 0 H PHE A 89 5.063 2.466 -2.520 1.00 0.27 H new ATOM 0 HA PHE A 89 5.871 0.248 -0.743 1.00 0.28 H new ATOM 0 HB2 PHE A 89 5.751 0.520 -3.743 1.00 0.32 H new ATOM 0 HB3 PHE A 89 6.925 -0.556 -3.011 1.00 0.32 H new ATOM 0 HD1 PHE A 89 5.525 -1.803 -0.790 1.00 0.37 H new ATOM 0 HD2 PHE A 89 4.051 -0.713 -4.634 1.00 0.37 H new ATOM 0 HE1 PHE A 89 3.731 -3.442 -0.567 1.00 0.44 H new ATOM 0 HE2 PHE A 89 2.235 -2.365 -4.398 1.00 0.42 H new ATOM 0 HZ PHE A 89 2.347 -3.995 -2.426 1.00 0.45 H new ATOM 1345 N ALA A 90 8.276 0.911 -0.756 1.00 0.32 N ATOM 1346 CA ALA A 90 9.642 1.404 -0.662 1.00 0.36 C ATOM 1347 C ALA A 90 10.613 0.279 -0.344 1.00 0.42 C ATOM 1348 O ALA A 90 10.202 -0.789 0.119 1.00 0.51 O ATOM 1349 CB ALA A 90 9.752 2.506 0.378 1.00 0.44 C ATOM 0 H ALA A 90 8.060 0.127 -0.140 1.00 0.32 H new ATOM 0 HA ALA A 90 9.909 1.819 -1.634 1.00 0.36 H new ATOM 0 HB1 ALA A 90 10.783 2.857 0.429 1.00 0.44 H new ATOM 0 HB2 ALA A 90 9.100 3.334 0.101 1.00 0.44 H new ATOM 0 HB3 ALA A 90 9.453 2.118 1.352 1.00 0.44 H new ATOM 1521 N VAL A 101 9.810 -8.957 -9.502 1.00 0.62 N ATOM 1522 CA VAL A 101 8.455 -8.590 -9.849 1.00 0.51 C ATOM 1523 C VAL A 101 7.473 -9.125 -8.825 1.00 0.49 C ATOM 1524 O VAL A 101 7.177 -10.319 -8.787 1.00 0.64 O ATOM 1525 CB VAL A 101 8.077 -9.139 -11.243 1.00 0.60 C ATOM 1526 CG1 VAL A 101 8.380 -8.129 -12.326 1.00 1.22 C ATOM 1527 CG2 VAL A 101 8.830 -10.428 -11.528 1.00 1.20 C ATOM 0 HA VAL A 101 8.404 -7.501 -9.864 1.00 0.51 H new ATOM 0 HB VAL A 101 7.005 -9.339 -11.241 1.00 0.60 H new ATOM 0 HG11 VAL A 101 8.104 -8.542 -13.296 1.00 1.22 H new ATOM 0 HG12 VAL A 101 7.810 -7.218 -12.144 1.00 1.22 H new ATOM 0 HG13 VAL A 101 9.445 -7.897 -12.320 1.00 1.22 H new ATOM 0 HG21 VAL A 101 8.552 -10.801 -12.514 1.00 1.20 H new ATOM 0 HG22 VAL A 101 9.903 -10.236 -11.502 1.00 1.20 H new ATOM 0 HG23 VAL A 101 8.576 -11.172 -10.773 1.00 1.20 H new ATOM 1537 N PHE A 102 6.980 -8.229 -7.985 1.00 0.43 N ATOM 1538 CA PHE A 102 5.970 -8.580 -7.008 1.00 0.43 C ATOM 1539 C PHE A 102 4.622 -8.686 -7.681 1.00 0.35 C ATOM 1540 O PHE A 102 4.406 -8.115 -8.753 1.00 0.34 O ATOM 1541 CB PHE A 102 5.882 -7.519 -5.914 1.00 0.47 C ATOM 1542 CG PHE A 102 7.159 -7.302 -5.157 1.00 0.63 C ATOM 1543 CD1 PHE A 102 7.811 -8.362 -4.553 1.00 0.80 C ATOM 1544 CD2 PHE A 102 7.704 -6.033 -5.050 1.00 0.76 C ATOM 1545 CE1 PHE A 102 8.983 -8.161 -3.855 1.00 0.97 C ATOM 1546 CE2 PHE A 102 8.875 -5.827 -4.352 1.00 0.91 C ATOM 1547 CZ PHE A 102 9.516 -6.890 -3.754 1.00 0.99 C ATOM 0 H PHE A 102 7.266 -7.250 -7.963 1.00 0.43 H new ATOM 0 HA PHE A 102 6.249 -9.535 -6.563 1.00 0.43 H new ATOM 0 HB2 PHE A 102 5.576 -6.575 -6.364 1.00 0.47 H new ATOM 0 HB3 PHE A 102 5.100 -7.805 -5.210 1.00 0.47 H new ATOM 0 HD1 PHE A 102 7.398 -9.357 -4.629 1.00 0.80 H new ATOM 0 HD2 PHE A 102 7.207 -5.196 -5.518 1.00 0.76 H new ATOM 0 HE1 PHE A 102 9.484 -8.996 -3.388 1.00 0.97 H new ATOM 0 HE2 PHE A 102 9.290 -4.833 -4.274 1.00 0.91 H new ATOM 0 HZ PHE A 102 10.434 -6.730 -3.207 1.00 0.99 H new ATOM 1557 N ASP A 103 3.715 -9.406 -7.058 1.00 0.35 N ATOM 1558 CA ASP A 103 2.349 -9.438 -7.534 1.00 0.34 C ATOM 1559 C ASP A 103 1.473 -8.749 -6.517 1.00 0.33 C ATOM 1560 O ASP A 103 1.610 -8.986 -5.332 1.00 0.40 O ATOM 1561 CB ASP A 103 1.870 -10.872 -7.739 1.00 0.45 C ATOM 1562 CG ASP A 103 2.691 -11.636 -8.758 1.00 0.86 C ATOM 1563 OD1 ASP A 103 2.701 -11.242 -9.942 1.00 1.46 O ATOM 1564 OD2 ASP A 103 3.308 -12.651 -8.380 1.00 1.53 O ATOM 0 H ASP A 103 3.895 -9.972 -6.229 1.00 0.35 H new ATOM 0 HA ASP A 103 2.294 -8.928 -8.496 1.00 0.34 H new ATOM 0 HB2 ASP A 103 1.904 -11.399 -6.786 1.00 0.45 H new ATOM 0 HB3 ASP A 103 0.828 -10.858 -8.058 1.00 0.45 H new ATOM 1569 N VAL A 104 0.581 -7.904 -6.976 1.00 0.30 N ATOM 1570 CA VAL A 104 -0.277 -7.151 -6.084 1.00 0.31 C ATOM 1571 C VAL A 104 -1.735 -7.367 -6.461 1.00 0.28 C ATOM 1572 O VAL A 104 -2.151 -7.091 -7.592 1.00 0.30 O ATOM 1573 CB VAL A 104 0.116 -5.653 -6.091 1.00 0.36 C ATOM 1574 CG1 VAL A 104 -1.097 -4.734 -6.143 1.00 0.45 C ATOM 1575 CG2 VAL A 104 0.958 -5.330 -4.872 1.00 0.63 C ATOM 0 H VAL A 104 0.428 -7.718 -7.967 1.00 0.30 H new ATOM 0 HA VAL A 104 -0.145 -7.510 -5.063 1.00 0.31 H new ATOM 0 HB VAL A 104 0.695 -5.477 -6.997 1.00 0.36 H new ATOM 0 HG11 VAL A 104 -0.767 -3.695 -6.146 1.00 0.45 H new ATOM 0 HG12 VAL A 104 -1.668 -4.936 -7.049 1.00 0.45 H new ATOM 0 HG13 VAL A 104 -1.726 -4.912 -5.271 1.00 0.45 H new ATOM 0 HG21 VAL A 104 1.229 -4.274 -4.886 1.00 0.63 H new ATOM 0 HG22 VAL A 104 0.388 -5.546 -3.968 1.00 0.63 H new ATOM 0 HG23 VAL A 104 1.863 -5.937 -4.884 1.00 0.63 H new ATOM 1585 N ARG A 105 -2.487 -7.903 -5.509 1.00 0.28 N ATOM 1586 CA ARG A 105 -3.850 -8.334 -5.751 1.00 0.26 C ATOM 1587 C ARG A 105 -4.843 -7.535 -4.918 1.00 0.28 C ATOM 1588 O ARG A 105 -4.579 -7.211 -3.767 1.00 0.39 O ATOM 1589 CB ARG A 105 -3.993 -9.818 -5.407 1.00 0.37 C ATOM 1590 CG ARG A 105 -2.866 -10.679 -5.951 1.00 0.64 C ATOM 1591 CD ARG A 105 -3.011 -12.131 -5.529 1.00 0.57 C ATOM 1592 NE ARG A 105 -1.927 -12.962 -6.050 1.00 1.11 N ATOM 1593 CZ ARG A 105 -1.940 -14.296 -6.048 1.00 1.36 C ATOM 1594 NH1 ARG A 105 -2.959 -14.951 -5.503 1.00 1.37 N ATOM 1595 NH2 ARG A 105 -0.927 -14.973 -6.579 1.00 1.95 N ATOM 0 H ARG A 105 -2.167 -8.049 -4.552 1.00 0.28 H new ATOM 0 HA ARG A 105 -4.068 -8.168 -6.806 1.00 0.26 H new ATOM 0 HB2 ARG A 105 -4.033 -9.929 -4.323 1.00 0.37 H new ATOM 0 HB3 ARG A 105 -4.941 -10.184 -5.801 1.00 0.37 H new ATOM 0 HG2 ARG A 105 -2.853 -10.616 -7.039 1.00 0.64 H new ATOM 0 HG3 ARG A 105 -1.910 -10.292 -5.598 1.00 0.64 H new ATOM 0 HD2 ARG A 105 -3.025 -12.193 -4.441 1.00 0.57 H new ATOM 0 HD3 ARG A 105 -3.967 -12.518 -5.882 1.00 0.57 H new ATOM 0 HE ARG A 105 -1.110 -12.492 -6.439 1.00 1.11 H new ATOM 0 HH11 ARG A 105 -3.733 -14.434 -5.085 1.00 1.37 H new ATOM 0 HH12 ARG A 105 -2.968 -15.971 -5.502 1.00 1.37 H new ATOM 0 HH21 ARG A 105 -0.138 -14.473 -6.989 1.00 1.95 H new ATOM 0 HH22 ARG A 105 -0.938 -15.993 -6.577 1.00 1.95 H new ATOM 1609 N VAL A 106 -5.981 -7.235 -5.517 1.00 0.28 N ATOM 1610 CA VAL A 106 -7.085 -6.590 -4.826 1.00 0.31 C ATOM 1611 C VAL A 106 -8.283 -7.532 -4.809 1.00 0.28 C ATOM 1612 O VAL A 106 -8.962 -7.700 -5.821 1.00 0.34 O ATOM 1613 CB VAL A 106 -7.479 -5.259 -5.492 1.00 0.39 C ATOM 1614 CG1 VAL A 106 -8.559 -4.550 -4.694 1.00 1.44 C ATOM 1615 CG2 VAL A 106 -6.262 -4.363 -5.653 1.00 1.41 C ATOM 0 H VAL A 106 -6.167 -7.432 -6.500 1.00 0.28 H new ATOM 0 HA VAL A 106 -6.765 -6.366 -3.808 1.00 0.31 H new ATOM 0 HB VAL A 106 -7.880 -5.482 -6.481 1.00 0.39 H new ATOM 0 HG11 VAL A 106 -8.819 -3.613 -5.186 1.00 1.44 H new ATOM 0 HG12 VAL A 106 -9.443 -5.185 -4.633 1.00 1.44 H new ATOM 0 HG13 VAL A 106 -8.192 -4.342 -3.689 1.00 1.44 H new ATOM 0 HG21 VAL A 106 -6.559 -3.427 -6.125 1.00 1.41 H new ATOM 0 HG22 VAL A 106 -5.832 -4.155 -4.674 1.00 1.41 H new ATOM 0 HG23 VAL A 106 -5.521 -4.864 -6.276 1.00 1.41 H new ATOM 1625 N ASN A 107 -8.503 -8.168 -3.663 1.00 0.28 N ATOM 1626 CA ASN A 107 -9.476 -9.255 -3.537 1.00 0.28 C ATOM 1627 C ASN A 107 -9.110 -10.347 -4.535 1.00 0.29 C ATOM 1628 O ASN A 107 -9.934 -10.838 -5.298 1.00 0.38 O ATOM 1629 CB ASN A 107 -10.921 -8.760 -3.740 1.00 0.30 C ATOM 1630 CG ASN A 107 -11.970 -9.828 -3.455 1.00 0.96 C ATOM 1631 OD1 ASN A 107 -12.427 -10.525 -4.357 1.00 1.57 O ATOM 1632 ND2 ASN A 107 -12.365 -9.962 -2.197 1.00 1.65 N ATOM 0 H ASN A 107 -8.014 -7.947 -2.795 1.00 0.28 H new ATOM 0 HA ASN A 107 -9.438 -9.658 -2.525 1.00 0.28 H new ATOM 0 HB2 ASN A 107 -11.099 -7.903 -3.090 1.00 0.30 H new ATOM 0 HB3 ASN A 107 -11.037 -8.411 -4.766 1.00 0.30 H new ATOM 0 HD21 ASN A 107 -13.068 -10.660 -1.955 1.00 1.65 H new ATOM 0 HD22 ASN A 107 -11.966 -9.367 -1.471 1.00 1.65 H new ATOM 1639 N GLY A 108 -7.826 -10.678 -4.556 1.00 0.29 N ATOM 1640 CA GLY A 108 -7.347 -11.714 -5.438 1.00 0.35 C ATOM 1641 C GLY A 108 -6.901 -11.192 -6.791 1.00 0.32 C ATOM 1642 O GLY A 108 -6.104 -11.830 -7.472 1.00 0.42 O ATOM 0 H GLY A 108 -7.109 -10.244 -3.975 1.00 0.29 H new ATOM 0 HA2 GLY A 108 -6.513 -12.229 -4.962 1.00 0.35 H new ATOM 0 HA3 GLY A 108 -8.136 -12.452 -5.583 1.00 0.35 H new ATOM 1646 N HIS A 109 -7.394 -10.021 -7.171 1.00 0.26 N ATOM 1647 CA HIS A 109 -7.161 -9.490 -8.501 1.00 0.27 C ATOM 1648 C HIS A 109 -5.772 -8.888 -8.646 1.00 0.23 C ATOM 1649 O HIS A 109 -5.503 -7.822 -8.107 1.00 0.24 O ATOM 1650 CB HIS A 109 -8.201 -8.426 -8.802 1.00 0.33 C ATOM 1651 CG HIS A 109 -9.582 -8.965 -8.991 1.00 0.44 C ATOM 1652 ND1 HIS A 109 -10.022 -9.515 -10.174 1.00 0.57 N ATOM 1653 CD2 HIS A 109 -10.627 -9.039 -8.134 1.00 0.53 C ATOM 1654 CE1 HIS A 109 -11.269 -9.905 -10.037 1.00 0.68 C ATOM 1655 NE2 HIS A 109 -11.663 -9.629 -8.810 1.00 0.65 N ATOM 0 H HIS A 109 -7.960 -9.421 -6.571 1.00 0.26 H new ATOM 0 HA HIS A 109 -7.238 -10.317 -9.206 1.00 0.27 H new ATOM 0 HB2 HIS A 109 -8.212 -7.702 -7.987 1.00 0.33 H new ATOM 0 HB3 HIS A 109 -7.905 -7.887 -9.702 1.00 0.33 H new ATOM 0 HD1 HIS A 109 -9.466 -9.606 -11.024 1.00 0.57 H new ATOM 0 HD2 HIS A 109 -10.642 -8.697 -7.110 1.00 0.53 H new ATOM 0 HE1 HIS A 109 -11.871 -10.373 -10.802 1.00 0.68 H new ATOM 1664 N THR A 110 -4.901 -9.555 -9.388 1.00 0.27 N ATOM 1665 CA THR A 110 -3.555 -9.045 -9.613 1.00 0.30 C ATOM 1666 C THR A 110 -3.581 -7.806 -10.497 1.00 0.30 C ATOM 1667 O THR A 110 -3.483 -7.903 -11.723 1.00 0.48 O ATOM 1668 CB THR A 110 -2.635 -10.094 -10.257 1.00 0.40 C ATOM 1669 OG1 THR A 110 -3.337 -10.800 -11.288 1.00 0.77 O ATOM 1670 CG2 THR A 110 -2.113 -11.073 -9.226 1.00 0.61 C ATOM 0 H THR A 110 -5.099 -10.446 -9.843 1.00 0.27 H new ATOM 0 HA THR A 110 -3.157 -8.791 -8.631 1.00 0.30 H new ATOM 0 HB THR A 110 -1.783 -9.571 -10.693 1.00 0.40 H new ATOM 0 HG1 THR A 110 -3.720 -10.158 -11.922 1.00 0.77 H new ATOM 0 HG21 THR A 110 -1.465 -11.803 -9.712 1.00 0.61 H new ATOM 0 HG22 THR A 110 -1.547 -10.534 -8.467 1.00 0.61 H new ATOM 0 HG23 THR A 110 -2.951 -11.588 -8.756 1.00 0.61 H new ATOM 1678 N VAL A 111 -3.735 -6.651 -9.871 1.00 0.26 N ATOM 1679 CA VAL A 111 -3.681 -5.388 -10.580 1.00 0.29 C ATOM 1680 C VAL A 111 -2.269 -5.158 -11.079 1.00 0.29 C ATOM 1681 O VAL A 111 -2.034 -5.000 -12.278 1.00 0.38 O ATOM 1682 CB VAL A 111 -4.109 -4.208 -9.681 1.00 0.32 C ATOM 1683 CG1 VAL A 111 -4.139 -2.911 -10.475 1.00 0.93 C ATOM 1684 CG2 VAL A 111 -5.461 -4.489 -9.047 1.00 0.94 C ATOM 0 H VAL A 111 -3.899 -6.564 -8.868 1.00 0.26 H new ATOM 0 HA VAL A 111 -4.377 -5.438 -11.417 1.00 0.29 H new ATOM 0 HB VAL A 111 -3.375 -4.096 -8.883 1.00 0.32 H new ATOM 0 HG11 VAL A 111 -4.443 -2.092 -9.823 1.00 0.93 H new ATOM 0 HG12 VAL A 111 -3.146 -2.707 -10.875 1.00 0.93 H new ATOM 0 HG13 VAL A 111 -4.849 -3.004 -11.296 1.00 0.93 H new ATOM 0 HG21 VAL A 111 -5.749 -3.648 -8.416 1.00 0.94 H new ATOM 0 HG22 VAL A 111 -6.208 -4.628 -9.829 1.00 0.94 H new ATOM 0 HG23 VAL A 111 -5.398 -5.392 -8.440 1.00 0.94 H new ATOM 1694 N VAL A 112 -1.318 -5.195 -10.159 1.00 0.27 N ATOM 1695 CA VAL A 112 0.072 -5.001 -10.521 1.00 0.28 C ATOM 1696 C VAL A 112 0.839 -6.291 -10.314 1.00 0.28 C ATOM 1697 O VAL A 112 1.361 -6.552 -9.235 1.00 0.27 O ATOM 1698 CB VAL A 112 0.738 -3.864 -9.708 1.00 0.29 C ATOM 1699 CG1 VAL A 112 2.112 -3.533 -10.276 1.00 0.35 C ATOM 1700 CG2 VAL A 112 -0.142 -2.627 -9.693 1.00 0.33 C ATOM 0 H VAL A 112 -1.483 -5.356 -9.165 1.00 0.27 H new ATOM 0 HA VAL A 112 0.098 -4.712 -11.572 1.00 0.28 H new ATOM 0 HB VAL A 112 0.863 -4.208 -8.681 1.00 0.29 H new ATOM 0 HG11 VAL A 112 2.564 -2.732 -9.691 1.00 0.35 H new ATOM 0 HG12 VAL A 112 2.747 -4.418 -10.231 1.00 0.35 H new ATOM 0 HG13 VAL A 112 2.010 -3.212 -11.313 1.00 0.35 H new ATOM 0 HG21 VAL A 112 0.345 -1.841 -9.116 1.00 0.33 H new ATOM 0 HG22 VAL A 112 -0.302 -2.282 -10.714 1.00 0.33 H new ATOM 0 HG23 VAL A 112 -1.102 -2.869 -9.237 1.00 0.33 H new ATOM 1710 N LYS A 113 0.895 -7.101 -11.352 1.00 0.33 N ATOM 1711 CA LYS A 113 1.638 -8.344 -11.294 1.00 0.37 C ATOM 1712 C LYS A 113 2.901 -8.228 -12.132 1.00 0.41 C ATOM 1713 O LYS A 113 3.034 -8.841 -13.194 1.00 0.68 O ATOM 1714 CB LYS A 113 0.753 -9.518 -11.749 1.00 0.44 C ATOM 1715 CG LYS A 113 -0.321 -9.172 -12.790 1.00 1.24 C ATOM 1716 CD LYS A 113 0.234 -9.049 -14.203 1.00 2.09 C ATOM 1717 CE LYS A 113 0.555 -7.610 -14.578 1.00 3.07 C ATOM 1718 NZ LYS A 113 -0.669 -6.779 -14.730 1.00 4.01 N ATOM 0 H LYS A 113 0.436 -6.921 -12.245 1.00 0.33 H new ATOM 0 HA LYS A 113 1.936 -8.543 -10.265 1.00 0.37 H new ATOM 0 HB2 LYS A 113 1.396 -10.296 -12.161 1.00 0.44 H new ATOM 0 HB3 LYS A 113 0.262 -9.941 -10.873 1.00 0.44 H new ATOM 0 HG2 LYS A 113 -1.094 -9.941 -12.775 1.00 1.24 H new ATOM 0 HG3 LYS A 113 -0.800 -8.233 -12.511 1.00 1.24 H new ATOM 0 HD2 LYS A 113 1.137 -9.654 -14.290 1.00 2.09 H new ATOM 0 HD3 LYS A 113 -0.490 -9.453 -14.911 1.00 2.09 H new ATOM 0 HE2 LYS A 113 1.196 -7.172 -13.813 1.00 3.07 H new ATOM 0 HE3 LYS A 113 1.118 -7.597 -15.511 1.00 3.07 H new ATOM 0 HZ1 LYS A 113 -0.513 -6.063 -15.468 1.00 4.01 H new ATOM 0 HZ2 LYS A 113 -1.469 -7.386 -15.001 1.00 4.01 H new ATOM 0 HZ3 LYS A 113 -0.882 -6.307 -13.828 1.00 4.01 H new ATOM 1732 N ASP A 114 3.843 -7.470 -11.588 1.00 0.39 N ATOM 1733 CA ASP A 114 5.071 -7.085 -12.284 1.00 0.45 C ATOM 1734 C ASP A 114 5.719 -5.940 -11.523 1.00 0.38 C ATOM 1735 O ASP A 114 6.366 -5.067 -12.103 1.00 0.45 O ATOM 1736 CB ASP A 114 4.792 -6.642 -13.735 1.00 0.63 C ATOM 1737 CG ASP A 114 3.955 -5.373 -13.840 1.00 1.33 C ATOM 1738 OD1 ASP A 114 2.752 -5.420 -13.501 1.00 1.52 O ATOM 1739 OD2 ASP A 114 4.500 -4.317 -14.227 1.00 1.96 O ATOM 0 H ASP A 114 3.779 -7.099 -10.640 1.00 0.39 H new ATOM 0 HA ASP A 114 5.732 -7.951 -12.324 1.00 0.45 H new ATOM 0 HB2 ASP A 114 5.742 -6.483 -14.246 1.00 0.63 H new ATOM 0 HB3 ASP A 114 4.280 -7.449 -14.259 1.00 0.63 H new ATOM 1744 N LEU A 115 5.548 -5.967 -10.209 1.00 0.33 N ATOM 1745 CA LEU A 115 5.917 -4.843 -9.367 1.00 0.34 C ATOM 1746 C LEU A 115 7.421 -4.785 -9.116 1.00 0.37 C ATOM 1747 O LEU A 115 7.886 -5.062 -8.008 1.00 0.47 O ATOM 1748 CB LEU A 115 5.153 -4.908 -8.040 1.00 0.38 C ATOM 1749 CG LEU A 115 4.436 -3.623 -7.633 1.00 0.45 C ATOM 1750 CD1 LEU A 115 3.792 -3.801 -6.281 1.00 1.18 C ATOM 1751 CD2 LEU A 115 5.391 -2.439 -7.620 1.00 1.07 C ATOM 0 H LEU A 115 5.154 -6.760 -9.703 1.00 0.33 H new ATOM 0 HA LEU A 115 5.644 -3.930 -9.895 1.00 0.34 H new ATOM 0 HB2 LEU A 115 4.418 -5.710 -8.103 1.00 0.38 H new ATOM 0 HB3 LEU A 115 5.853 -5.179 -7.250 1.00 0.38 H new ATOM 0 HG LEU A 115 3.661 -3.413 -8.371 1.00 0.45 H new ATOM 0 HD11 LEU A 115 3.282 -2.880 -5.997 1.00 1.18 H new ATOM 0 HD12 LEU A 115 3.070 -4.616 -6.326 1.00 1.18 H new ATOM 0 HD13 LEU A 115 4.558 -4.035 -5.541 1.00 1.18 H new ATOM 0 HD21 LEU A 115 4.851 -1.539 -7.326 1.00 1.07 H new ATOM 0 HD22 LEU A 115 6.195 -2.628 -6.909 1.00 1.07 H new ATOM 0 HD23 LEU A 115 5.813 -2.301 -8.616 1.00 1.07 H new ATOM 1763 N ASP A 116 8.177 -4.435 -10.152 1.00 0.39 N ATOM 1764 CA ASP A 116 9.581 -4.085 -9.982 1.00 0.44 C ATOM 1765 C ASP A 116 9.647 -2.675 -9.418 1.00 0.43 C ATOM 1766 O ASP A 116 9.602 -1.699 -10.170 1.00 0.48 O ATOM 1767 CB ASP A 116 10.360 -4.097 -11.308 1.00 0.53 C ATOM 1768 CG ASP A 116 10.505 -5.450 -11.965 1.00 1.28 C ATOM 1769 OD1 ASP A 116 11.290 -6.268 -11.448 1.00 1.83 O ATOM 1770 OD2 ASP A 116 9.788 -5.727 -12.950 1.00 1.93 O ATOM 0 H ASP A 116 7.842 -4.387 -11.114 1.00 0.39 H new ATOM 0 HA ASP A 116 10.031 -4.825 -9.320 1.00 0.44 H new ATOM 0 HB2 ASP A 116 9.863 -3.424 -12.007 1.00 0.53 H new ATOM 0 HB3 ASP A 116 11.356 -3.691 -11.128 1.00 0.53 H new ATOM 1775 N ILE A 117 9.723 -2.562 -8.096 1.00 0.44 N ATOM 1776 CA ILE A 117 9.795 -1.255 -7.449 1.00 0.46 C ATOM 1777 C ILE A 117 10.946 -0.441 -8.032 1.00 0.48 C ATOM 1778 O ILE A 117 10.808 0.757 -8.295 1.00 0.51 O ATOM 1779 CB ILE A 117 9.965 -1.378 -5.916 1.00 0.52 C ATOM 1780 CG1 ILE A 117 8.788 -2.147 -5.312 1.00 0.56 C ATOM 1781 CG2 ILE A 117 10.093 0.000 -5.274 1.00 0.58 C ATOM 1782 CD1 ILE A 117 8.877 -2.313 -3.807 1.00 0.82 C ATOM 0 H ILE A 117 9.736 -3.354 -7.454 1.00 0.44 H new ATOM 0 HA ILE A 117 8.851 -0.744 -7.641 1.00 0.46 H new ATOM 0 HB ILE A 117 10.882 -1.932 -5.714 1.00 0.52 H new ATOM 0 HG12 ILE A 117 7.862 -1.628 -5.557 1.00 0.56 H new ATOM 0 HG13 ILE A 117 8.733 -3.132 -5.775 1.00 0.56 H new ATOM 0 HG21 ILE A 117 10.212 -0.110 -4.196 1.00 0.58 H new ATOM 0 HG22 ILE A 117 10.963 0.513 -5.684 1.00 0.58 H new ATOM 0 HG23 ILE A 117 9.196 0.583 -5.482 1.00 0.58 H new ATOM 0 HD11 ILE A 117 8.009 -2.867 -3.450 1.00 0.82 H new ATOM 0 HD12 ILE A 117 9.786 -2.860 -3.554 1.00 0.82 H new ATOM 0 HD13 ILE A 117 8.901 -1.332 -3.333 1.00 0.82 H new ATOM 1794 N PHE A 118 12.057 -1.124 -8.284 1.00 0.54 N ATOM 1795 CA PHE A 118 13.252 -0.497 -8.827 1.00 0.62 C ATOM 1796 C PHE A 118 12.997 0.039 -10.238 1.00 0.65 C ATOM 1797 O PHE A 118 13.463 1.113 -10.596 1.00 0.74 O ATOM 1798 CB PHE A 118 14.400 -1.508 -8.849 1.00 0.70 C ATOM 1799 CG PHE A 118 15.728 -0.910 -9.207 1.00 0.81 C ATOM 1800 CD1 PHE A 118 16.538 -0.345 -8.235 1.00 0.89 C ATOM 1801 CD2 PHE A 118 16.166 -0.914 -10.520 1.00 0.92 C ATOM 1802 CE1 PHE A 118 17.759 0.205 -8.568 1.00 1.02 C ATOM 1803 CE2 PHE A 118 17.384 -0.366 -10.858 1.00 1.06 C ATOM 1804 CZ PHE A 118 18.188 0.200 -9.855 1.00 1.08 C ATOM 0 H PHE A 118 12.153 -2.126 -8.117 1.00 0.54 H new ATOM 0 HA PHE A 118 13.522 0.344 -8.189 1.00 0.62 H new ATOM 0 HB2 PHE A 118 14.476 -1.978 -7.868 1.00 0.70 H new ATOM 0 HB3 PHE A 118 14.163 -2.297 -9.563 1.00 0.70 H new ATOM 0 HD1 PHE A 118 16.210 -0.335 -7.206 1.00 0.89 H new ATOM 0 HD2 PHE A 118 15.546 -1.352 -11.288 1.00 0.92 H new ATOM 0 HE1 PHE A 118 18.378 0.643 -7.798 1.00 1.02 H new ATOM 0 HE2 PHE A 118 17.718 -0.372 -11.885 1.00 1.06 H new ATOM 0 HZ PHE A 118 19.146 0.630 -10.108 1.00 1.08 H new ATOM 1814 N ASP A 119 12.250 -0.716 -11.033 1.00 0.61 N ATOM 1815 CA ASP A 119 11.960 -0.323 -12.414 1.00 0.68 C ATOM 1816 C ASP A 119 10.982 0.845 -12.467 1.00 0.69 C ATOM 1817 O ASP A 119 11.099 1.731 -13.312 1.00 0.81 O ATOM 1818 CB ASP A 119 11.379 -1.508 -13.193 1.00 0.68 C ATOM 1819 CG ASP A 119 10.960 -1.139 -14.604 1.00 0.82 C ATOM 1820 OD1 ASP A 119 9.795 -0.728 -14.800 1.00 0.89 O ATOM 1821 OD2 ASP A 119 11.789 -1.275 -15.528 1.00 0.96 O ATOM 0 H ASP A 119 11.833 -1.603 -10.750 1.00 0.61 H new ATOM 0 HA ASP A 119 12.899 -0.009 -12.870 1.00 0.68 H new ATOM 0 HB2 ASP A 119 12.120 -2.306 -13.237 1.00 0.68 H new ATOM 0 HB3 ASP A 119 10.517 -1.902 -12.655 1.00 0.68 H new ATOM 1826 N ARG A 120 10.029 0.848 -11.544 1.00 0.61 N ATOM 1827 CA ARG A 120 8.927 1.794 -11.595 1.00 0.66 C ATOM 1828 C ARG A 120 9.345 3.178 -11.107 1.00 0.75 C ATOM 1829 O ARG A 120 9.074 4.177 -11.769 1.00 0.97 O ATOM 1830 CB ARG A 120 7.745 1.278 -10.772 1.00 0.63 C ATOM 1831 CG ARG A 120 7.090 0.020 -11.334 1.00 0.59 C ATOM 1832 CD ARG A 120 6.471 0.267 -12.702 1.00 0.72 C ATOM 1833 NE ARG A 120 5.656 -0.866 -13.151 1.00 1.02 N ATOM 1834 CZ ARG A 120 4.402 -0.745 -13.597 1.00 1.31 C ATOM 1835 NH1 ARG A 120 3.831 0.453 -13.668 1.00 1.69 N ATOM 1836 NH2 ARG A 120 3.723 -1.820 -13.982 1.00 1.65 N ATOM 0 H ARG A 120 9.999 0.206 -10.752 1.00 0.61 H new ATOM 0 HA ARG A 120 8.624 1.889 -12.638 1.00 0.66 H new ATOM 0 HB2 ARG A 120 8.086 1.074 -9.757 1.00 0.63 H new ATOM 0 HB3 ARG A 120 6.994 2.065 -10.704 1.00 0.63 H new ATOM 0 HG2 ARG A 120 7.833 -0.774 -11.409 1.00 0.59 H new ATOM 0 HG3 ARG A 120 6.321 -0.328 -10.645 1.00 0.59 H new ATOM 0 HD2 ARG A 120 5.854 1.164 -12.663 1.00 0.72 H new ATOM 0 HD3 ARG A 120 7.261 0.455 -13.429 1.00 0.72 H new ATOM 0 HE ARG A 120 6.069 -1.798 -13.121 1.00 1.02 H new ATOM 0 HH11 ARG A 120 4.350 1.283 -13.382 1.00 1.69 H new ATOM 0 HH12 ARG A 120 2.874 0.542 -14.009 1.00 1.69 H new ATOM 0 HH21 ARG A 120 4.159 -2.741 -13.938 1.00 1.65 H new ATOM 0 HH22 ARG A 120 2.766 -1.724 -14.322 1.00 1.65 H new ATOM 1850 N VAL A 121 9.989 3.246 -9.947 1.00 0.65 N ATOM 1851 CA VAL A 121 10.402 4.542 -9.404 1.00 0.75 C ATOM 1852 C VAL A 121 11.917 4.725 -9.432 1.00 0.80 C ATOM 1853 O VAL A 121 12.412 5.854 -9.459 1.00 0.95 O ATOM 1854 CB VAL A 121 9.891 4.773 -7.964 1.00 0.79 C ATOM 1855 CG1 VAL A 121 8.385 4.969 -7.961 1.00 1.42 C ATOM 1856 CG2 VAL A 121 10.288 3.624 -7.047 1.00 1.49 C ATOM 0 H VAL A 121 10.234 2.440 -9.372 1.00 0.65 H new ATOM 0 HA VAL A 121 9.944 5.284 -10.058 1.00 0.75 H new ATOM 0 HB VAL A 121 10.359 5.680 -7.581 1.00 0.79 H new ATOM 0 HG11 VAL A 121 8.041 5.130 -6.939 1.00 1.42 H new ATOM 0 HG12 VAL A 121 8.130 5.835 -8.571 1.00 1.42 H new ATOM 0 HG13 VAL A 121 7.902 4.082 -8.371 1.00 1.42 H new ATOM 0 HG21 VAL A 121 9.914 3.815 -6.041 1.00 1.49 H new ATOM 0 HG22 VAL A 121 9.860 2.694 -7.422 1.00 1.49 H new ATOM 0 HG23 VAL A 121 11.374 3.538 -7.020 1.00 1.49 H new ATOM 1866 N GLY A 122 12.652 3.626 -9.445 1.00 0.76 N ATOM 1867 CA GLY A 122 14.094 3.710 -9.421 1.00 0.89 C ATOM 1868 C GLY A 122 14.669 3.173 -8.134 1.00 1.00 C ATOM 1869 O GLY A 122 14.170 2.195 -7.578 1.00 1.40 O ATOM 0 H GLY A 122 12.276 2.678 -9.472 1.00 0.76 H new ATOM 0 HA2 GLY A 122 14.504 3.151 -10.262 1.00 0.89 H new ATOM 0 HA3 GLY A 122 14.399 4.749 -9.549 1.00 0.89 H new ATOM 1873 N HIS A 123 15.717 3.811 -7.655 1.00 1.10 N ATOM 1874 CA HIS A 123 16.360 3.386 -6.429 1.00 1.36 C ATOM 1875 C HIS A 123 15.714 4.073 -5.231 1.00 1.08 C ATOM 1876 O HIS A 123 15.852 5.285 -5.054 1.00 1.41 O ATOM 1877 CB HIS A 123 17.857 3.694 -6.488 1.00 2.01 C ATOM 1878 CG HIS A 123 18.650 3.080 -5.375 1.00 2.61 C ATOM 1879 ND1 HIS A 123 19.443 3.811 -4.524 1.00 3.35 N ATOM 1880 CD2 HIS A 123 18.792 1.787 -5.000 1.00 3.26 C ATOM 1881 CE1 HIS A 123 20.040 2.998 -3.675 1.00 4.11 C ATOM 1882 NE2 HIS A 123 19.664 1.760 -3.940 1.00 4.08 N ATOM 0 H HIS A 123 16.142 4.626 -8.097 1.00 1.10 H new ATOM 0 HA HIS A 123 16.234 2.309 -6.316 1.00 1.36 H new ATOM 0 HB2 HIS A 123 18.253 3.341 -7.440 1.00 2.01 H new ATOM 0 HB3 HIS A 123 17.996 4.775 -6.466 1.00 2.01 H new ATOM 0 HD2 HIS A 123 18.308 0.934 -5.452 1.00 3.26 H new ATOM 0 HE1 HIS A 123 20.723 3.295 -2.893 1.00 4.11 H new ATOM 0 HE2 HIS A 123 19.970 0.925 -3.441 1.00 4.08 H new ATOM 1891 N SER A 124 14.997 3.284 -4.432 1.00 1.19 N ATOM 1892 CA SER A 124 14.356 3.761 -3.210 1.00 1.00 C ATOM 1893 C SER A 124 13.207 4.728 -3.535 1.00 1.02 C ATOM 1894 O SER A 124 12.571 4.600 -4.580 1.00 1.97 O ATOM 1895 CB SER A 124 15.397 4.420 -2.286 1.00 1.06 C ATOM 1896 OG SER A 124 14.877 4.632 -0.981 1.00 1.72 O ATOM 0 H SER A 124 14.845 2.292 -4.616 1.00 1.19 H new ATOM 0 HA SER A 124 13.927 2.907 -2.686 1.00 1.00 H new ATOM 0 HB2 SER A 124 16.284 3.789 -2.227 1.00 1.06 H new ATOM 0 HB3 SER A 124 15.712 5.373 -2.712 1.00 1.06 H new ATOM 0 HG SER A 124 15.563 5.050 -0.419 1.00 1.72 H new ATOM 1902 N THR A 125 12.949 5.667 -2.613 1.00 0.66 N ATOM 1903 CA THR A 125 11.846 6.638 -2.697 1.00 0.53 C ATOM 1904 C THR A 125 10.486 5.941 -2.592 1.00 0.48 C ATOM 1905 O THR A 125 10.414 4.719 -2.462 1.00 0.60 O ATOM 1906 CB THR A 125 11.898 7.536 -3.969 1.00 0.60 C ATOM 1907 OG1 THR A 125 11.537 6.812 -5.148 1.00 0.81 O ATOM 1908 CG2 THR A 125 13.283 8.142 -4.148 1.00 0.85 C ATOM 0 H THR A 125 13.513 5.776 -1.770 1.00 0.66 H new ATOM 0 HA THR A 125 11.976 7.303 -1.843 1.00 0.53 H new ATOM 0 HB THR A 125 11.170 8.334 -3.822 1.00 0.60 H new ATOM 0 HG1 THR A 125 12.162 6.068 -5.279 1.00 0.81 H new ATOM 0 HG21 THR A 125 13.295 8.765 -5.042 1.00 0.85 H new ATOM 0 HG22 THR A 125 13.529 8.751 -3.278 1.00 0.85 H new ATOM 0 HG23 THR A 125 14.019 7.344 -4.252 1.00 0.85 H new ATOM 1916 N ALA A 126 9.414 6.723 -2.611 1.00 0.44 N ATOM 1917 CA ALA A 126 8.074 6.179 -2.420 1.00 0.45 C ATOM 1918 C ALA A 126 7.424 5.818 -3.744 1.00 0.40 C ATOM 1919 O ALA A 126 7.224 6.677 -4.604 1.00 0.50 O ATOM 1920 CB ALA A 126 7.199 7.169 -1.668 1.00 0.57 C ATOM 0 H ALA A 126 9.445 7.732 -2.756 1.00 0.44 H new ATOM 0 HA ALA A 126 8.173 5.267 -1.831 1.00 0.45 H new ATOM 0 HB1 ALA A 126 6.203 6.746 -1.535 1.00 0.57 H new ATOM 0 HB2 ALA A 126 7.639 7.376 -0.692 1.00 0.57 H new ATOM 0 HB3 ALA A 126 7.127 8.096 -2.237 1.00 0.57 H new ATOM 1926 N HIS A 127 7.100 4.545 -3.904 1.00 0.33 N ATOM 1927 CA HIS A 127 6.334 4.093 -5.051 1.00 0.32 C ATOM 1928 C HIS A 127 4.857 4.175 -4.713 1.00 0.34 C ATOM 1929 O HIS A 127 4.426 3.685 -3.675 1.00 0.55 O ATOM 1930 CB HIS A 127 6.710 2.661 -5.455 1.00 0.34 C ATOM 1931 CG HIS A 127 5.924 2.146 -6.628 1.00 0.38 C ATOM 1932 ND1 HIS A 127 6.025 2.681 -7.890 1.00 0.44 N ATOM 1933 CD2 HIS A 127 5.004 1.153 -6.720 1.00 0.48 C ATOM 1934 CE1 HIS A 127 5.205 2.045 -8.703 1.00 0.50 C ATOM 1935 NE2 HIS A 127 4.573 1.114 -8.023 1.00 0.51 N ATOM 0 H HIS A 127 7.357 3.805 -3.251 1.00 0.33 H new ATOM 0 HA HIS A 127 6.561 4.736 -5.901 1.00 0.32 H new ATOM 0 HB2 HIS A 127 7.773 2.626 -5.696 1.00 0.34 H new ATOM 0 HB3 HIS A 127 6.554 1.998 -4.604 1.00 0.34 H new ATOM 0 HD2 HIS A 127 4.672 0.512 -5.917 1.00 0.48 H new ATOM 0 HE1 HIS A 127 5.074 2.254 -9.754 1.00 0.50 H new ATOM 0 HE2 HIS A 127 3.878 0.470 -8.401 1.00 0.51 H new ATOM 1944 N ASP A 128 4.089 4.787 -5.586 1.00 0.38 N ATOM 1945 CA ASP A 128 2.692 5.063 -5.301 1.00 0.47 C ATOM 1946 C ASP A 128 1.789 4.418 -6.339 1.00 0.46 C ATOM 1947 O ASP A 128 1.818 4.786 -7.513 1.00 0.61 O ATOM 1948 CB ASP A 128 2.482 6.574 -5.267 1.00 0.66 C ATOM 1949 CG ASP A 128 1.023 6.984 -5.301 1.00 0.99 C ATOM 1950 OD1 ASP A 128 0.390 7.005 -4.225 1.00 1.64 O ATOM 1951 OD2 ASP A 128 0.521 7.322 -6.391 1.00 1.36 O ATOM 0 H ASP A 128 4.405 5.105 -6.502 1.00 0.38 H new ATOM 0 HA ASP A 128 2.432 4.638 -4.332 1.00 0.47 H new ATOM 0 HB2 ASP A 128 2.943 6.976 -4.365 1.00 0.66 H new ATOM 0 HB3 ASP A 128 2.997 7.023 -6.116 1.00 0.66 H new ATOM 1956 N GLU A 129 1.012 3.439 -5.909 1.00 0.40 N ATOM 1957 CA GLU A 129 0.068 2.786 -6.793 1.00 0.41 C ATOM 1958 C GLU A 129 -1.352 3.031 -6.299 1.00 0.33 C ATOM 1959 O GLU A 129 -1.728 2.576 -5.216 1.00 0.39 O ATOM 1960 CB GLU A 129 0.348 1.285 -6.859 1.00 0.53 C ATOM 1961 CG GLU A 129 0.168 0.692 -8.244 1.00 0.97 C ATOM 1962 CD GLU A 129 1.246 1.151 -9.206 1.00 0.72 C ATOM 1963 OE1 GLU A 129 2.349 0.569 -9.177 1.00 0.75 O ATOM 1964 OE2 GLU A 129 1.004 2.103 -9.978 1.00 1.12 O ATOM 0 H GLU A 129 1.018 3.081 -4.954 1.00 0.40 H new ATOM 0 HA GLU A 129 0.177 3.202 -7.794 1.00 0.41 H new ATOM 0 HB2 GLU A 129 1.368 1.100 -6.524 1.00 0.53 H new ATOM 0 HB3 GLU A 129 -0.315 0.770 -6.164 1.00 0.53 H new ATOM 0 HG2 GLU A 129 0.182 -0.396 -8.177 1.00 0.97 H new ATOM 0 HG3 GLU A 129 -0.810 0.974 -8.634 1.00 0.97 H new ATOM 1971 N ILE A 130 -2.124 3.772 -7.080 1.00 0.28 N ATOM 1972 CA ILE A 130 -3.506 4.068 -6.735 1.00 0.24 C ATOM 1973 C ILE A 130 -4.440 3.124 -7.485 1.00 0.25 C ATOM 1974 O ILE A 130 -4.455 3.098 -8.716 1.00 0.31 O ATOM 1975 CB ILE A 130 -3.867 5.533 -7.070 1.00 0.29 C ATOM 1976 CG1 ILE A 130 -2.945 6.491 -6.308 1.00 0.39 C ATOM 1977 CG2 ILE A 130 -5.324 5.816 -6.734 1.00 0.31 C ATOM 1978 CD1 ILE A 130 -3.205 7.954 -6.599 1.00 0.74 C ATOM 0 H ILE A 130 -1.814 4.181 -7.962 1.00 0.28 H new ATOM 0 HA ILE A 130 -3.624 3.926 -5.661 1.00 0.24 H new ATOM 0 HB ILE A 130 -3.727 5.690 -8.140 1.00 0.29 H new ATOM 0 HG12 ILE A 130 -3.061 6.317 -5.238 1.00 0.39 H new ATOM 0 HG13 ILE A 130 -1.910 6.259 -6.558 1.00 0.39 H new ATOM 0 HG21 ILE A 130 -5.559 6.852 -6.977 1.00 0.31 H new ATOM 0 HG22 ILE A 130 -5.966 5.153 -7.313 1.00 0.31 H new ATOM 0 HG23 ILE A 130 -5.492 5.646 -5.671 1.00 0.31 H new ATOM 0 HD11 ILE A 130 -2.513 8.568 -6.023 1.00 0.74 H new ATOM 0 HD12 ILE A 130 -3.060 8.145 -7.662 1.00 0.74 H new ATOM 0 HD13 ILE A 130 -4.229 8.204 -6.322 1.00 0.74 H new ATOM 1990 N ILE A 131 -5.213 2.351 -6.739 1.00 0.24 N ATOM 1991 CA ILE A 131 -6.052 1.311 -7.315 1.00 0.28 C ATOM 1992 C ILE A 131 -7.507 1.494 -6.886 1.00 0.25 C ATOM 1993 O ILE A 131 -7.923 0.990 -5.842 1.00 0.26 O ATOM 1994 CB ILE A 131 -5.565 -0.092 -6.883 1.00 0.35 C ATOM 1995 CG1 ILE A 131 -4.078 -0.266 -7.210 1.00 0.40 C ATOM 1996 CG2 ILE A 131 -6.387 -1.173 -7.570 1.00 0.40 C ATOM 1997 CD1 ILE A 131 -3.485 -1.561 -6.693 1.00 1.25 C ATOM 0 H ILE A 131 -5.277 2.425 -5.724 1.00 0.24 H new ATOM 0 HA ILE A 131 -5.983 1.393 -8.400 1.00 0.28 H new ATOM 0 HB ILE A 131 -5.697 -0.187 -5.805 1.00 0.35 H new ATOM 0 HG12 ILE A 131 -3.946 -0.223 -8.291 1.00 0.40 H new ATOM 0 HG13 ILE A 131 -3.522 0.571 -6.788 1.00 0.40 H new ATOM 0 HG21 ILE A 131 -6.032 -2.155 -7.256 1.00 0.40 H new ATOM 0 HG22 ILE A 131 -7.436 -1.062 -7.296 1.00 0.40 H new ATOM 0 HG23 ILE A 131 -6.282 -1.078 -8.651 1.00 0.40 H new ATOM 0 HD11 ILE A 131 -2.430 -1.612 -6.963 1.00 1.25 H new ATOM 0 HD12 ILE A 131 -3.584 -1.599 -5.608 1.00 1.25 H new ATOM 0 HD13 ILE A 131 -4.014 -2.405 -7.135 1.00 1.25 H new ATOM 2009 N PRO A 132 -8.291 2.259 -7.658 1.00 0.24 N ATOM 2010 CA PRO A 132 -9.719 2.436 -7.400 1.00 0.23 C ATOM 2011 C PRO A 132 -10.532 1.212 -7.816 1.00 0.23 C ATOM 2012 O PRO A 132 -10.430 0.738 -8.950 1.00 0.25 O ATOM 2013 CB PRO A 132 -10.103 3.651 -8.261 1.00 0.26 C ATOM 2014 CG PRO A 132 -8.814 4.200 -8.783 1.00 0.29 C ATOM 2015 CD PRO A 132 -7.859 3.041 -8.818 1.00 0.28 C ATOM 0 HA PRO A 132 -9.924 2.575 -6.339 1.00 0.23 H new ATOM 0 HB2 PRO A 132 -10.764 3.359 -9.077 1.00 0.26 H new ATOM 0 HB3 PRO A 132 -10.636 4.397 -7.671 1.00 0.26 H new ATOM 0 HG2 PRO A 132 -8.945 4.628 -9.777 1.00 0.29 H new ATOM 0 HG3 PRO A 132 -8.439 4.996 -8.140 1.00 0.29 H new ATOM 0 HD2 PRO A 132 -7.939 2.474 -9.745 1.00 0.28 H new ATOM 0 HD3 PRO A 132 -6.822 3.364 -8.730 1.00 0.28 H new ATOM 2023 N ILE A 133 -11.324 0.698 -6.889 1.00 0.21 N ATOM 2024 CA ILE A 133 -12.198 -0.431 -7.160 1.00 0.21 C ATOM 2025 C ILE A 133 -13.644 0.046 -7.148 1.00 0.19 C ATOM 2026 O ILE A 133 -13.953 1.075 -6.554 1.00 0.26 O ATOM 2027 CB ILE A 133 -12.031 -1.566 -6.112 1.00 0.23 C ATOM 2028 CG1 ILE A 133 -12.803 -1.262 -4.827 1.00 0.25 C ATOM 2029 CG2 ILE A 133 -10.566 -1.781 -5.782 1.00 0.26 C ATOM 2030 CD1 ILE A 133 -12.694 -2.359 -3.788 1.00 0.27 C ATOM 0 H ILE A 133 -11.379 1.049 -5.933 1.00 0.21 H new ATOM 0 HA ILE A 133 -11.928 -0.835 -8.136 1.00 0.21 H new ATOM 0 HB ILE A 133 -12.439 -2.475 -6.554 1.00 0.23 H new ATOM 0 HG12 ILE A 133 -12.433 -0.330 -4.401 1.00 0.25 H new ATOM 0 HG13 ILE A 133 -13.854 -1.106 -5.071 1.00 0.25 H new ATOM 0 HG21 ILE A 133 -10.472 -2.580 -5.046 1.00 0.26 H new ATOM 0 HG22 ILE A 133 -10.026 -2.056 -6.688 1.00 0.26 H new ATOM 0 HG23 ILE A 133 -10.146 -0.861 -5.374 1.00 0.26 H new ATOM 0 HD11 ILE A 133 -13.264 -2.079 -2.902 1.00 0.27 H new ATOM 0 HD12 ILE A 133 -13.091 -3.288 -4.197 1.00 0.27 H new ATOM 0 HD13 ILE A 133 -11.648 -2.500 -3.516 1.00 0.27 H new ATOM 2042 N SER A 134 -14.520 -0.682 -7.804 1.00 0.19 N ATOM 2043 CA SER A 134 -15.921 -0.321 -7.830 1.00 0.21 C ATOM 2044 C SER A 134 -16.764 -1.485 -7.321 1.00 0.22 C ATOM 2045 O SER A 134 -16.905 -2.504 -7.996 1.00 0.25 O ATOM 2046 CB SER A 134 -16.328 0.072 -9.253 1.00 0.26 C ATOM 2047 OG SER A 134 -17.630 0.633 -9.291 1.00 1.24 O ATOM 0 H SER A 134 -14.288 -1.527 -8.326 1.00 0.19 H new ATOM 0 HA SER A 134 -16.090 0.535 -7.177 1.00 0.21 H new ATOM 0 HB2 SER A 134 -15.611 0.790 -9.651 1.00 0.26 H new ATOM 0 HB3 SER A 134 -16.291 -0.806 -9.897 1.00 0.26 H new ATOM 0 HG SER A 134 -17.856 0.874 -10.214 1.00 1.24 H new ATOM 2053 N ILE A 135 -17.287 -1.347 -6.113 1.00 0.23 N ATOM 2054 CA ILE A 135 -18.171 -2.357 -5.550 1.00 0.25 C ATOM 2055 C ILE A 135 -19.591 -1.852 -5.603 1.00 0.29 C ATOM 2056 O ILE A 135 -19.822 -0.683 -5.326 1.00 0.34 O ATOM 2057 CB ILE A 135 -17.840 -2.677 -4.079 1.00 0.26 C ATOM 2058 CG1 ILE A 135 -16.346 -2.911 -3.917 1.00 0.28 C ATOM 2059 CG2 ILE A 135 -18.638 -3.880 -3.593 1.00 0.30 C ATOM 2060 CD1 ILE A 135 -15.964 -3.563 -2.605 1.00 0.32 C ATOM 0 H ILE A 135 -17.116 -0.547 -5.504 1.00 0.23 H new ATOM 0 HA ILE A 135 -18.039 -3.265 -6.139 1.00 0.25 H new ATOM 0 HB ILE A 135 -18.123 -1.822 -3.465 1.00 0.26 H new ATOM 0 HG12 ILE A 135 -15.996 -3.537 -4.738 1.00 0.28 H new ATOM 0 HG13 ILE A 135 -15.828 -1.956 -4.001 1.00 0.28 H new ATOM 0 HG21 ILE A 135 -18.387 -4.087 -2.552 1.00 0.30 H new ATOM 0 HG22 ILE A 135 -19.704 -3.666 -3.674 1.00 0.30 H new ATOM 0 HG23 ILE A 135 -18.395 -4.749 -4.204 1.00 0.30 H new ATOM 0 HD11 ILE A 135 -14.883 -3.696 -2.566 1.00 0.32 H new ATOM 0 HD12 ILE A 135 -16.282 -2.929 -1.777 1.00 0.32 H new ATOM 0 HD13 ILE A 135 -16.452 -4.534 -2.526 1.00 0.32 H new ATOM 2072 N LYS A 136 -20.522 -2.715 -5.988 1.00 0.31 N ATOM 2073 CA LYS A 136 -21.941 -2.396 -5.956 1.00 0.37 C ATOM 2074 C LYS A 136 -22.776 -3.645 -5.790 1.00 0.40 C ATOM 2075 O LYS A 136 -22.567 -4.640 -6.484 1.00 0.42 O ATOM 2076 CB LYS A 136 -22.384 -1.624 -7.196 1.00 0.46 C ATOM 2077 CG LYS A 136 -22.094 -0.145 -7.075 1.00 0.66 C ATOM 2078 CD LYS A 136 -22.578 0.652 -8.266 1.00 1.28 C ATOM 2079 CE LYS A 136 -22.489 2.141 -7.980 1.00 1.51 C ATOM 2080 NZ LYS A 136 -23.325 2.530 -6.807 1.00 1.95 N ATOM 0 H LYS A 136 -20.314 -3.653 -6.330 1.00 0.31 H new ATOM 0 HA LYS A 136 -22.099 -1.752 -5.091 1.00 0.37 H new ATOM 0 HB2 LYS A 136 -21.874 -2.023 -8.073 1.00 0.46 H new ATOM 0 HB3 LYS A 136 -23.452 -1.772 -7.353 1.00 0.46 H new ATOM 0 HG2 LYS A 136 -22.567 0.239 -6.171 1.00 0.66 H new ATOM 0 HG3 LYS A 136 -21.020 0.001 -6.960 1.00 0.66 H new ATOM 0 HD2 LYS A 136 -21.978 0.407 -9.143 1.00 1.28 H new ATOM 0 HD3 LYS A 136 -23.608 0.381 -8.498 1.00 1.28 H new ATOM 0 HE2 LYS A 136 -21.450 2.414 -7.793 1.00 1.51 H new ATOM 0 HE3 LYS A 136 -22.812 2.700 -8.858 1.00 1.51 H new ATOM 0 HZ1 LYS A 136 -23.473 3.559 -6.813 1.00 1.95 H new ATOM 0 HZ2 LYS A 136 -24.245 2.047 -6.861 1.00 1.95 H new ATOM 0 HZ3 LYS A 136 -22.840 2.255 -5.929 1.00 1.95 H new ATOM 2094 N LYS A 137 -23.706 -3.581 -4.842 1.00 0.46 N ATOM 2095 CA LYS A 137 -24.642 -4.669 -4.576 1.00 0.54 C ATOM 2096 C LYS A 137 -23.907 -5.968 -4.277 1.00 0.48 C ATOM 2097 O LYS A 137 -24.418 -7.064 -4.517 1.00 0.54 O ATOM 2098 CB LYS A 137 -25.617 -4.845 -5.741 1.00 0.65 C ATOM 2099 CG LYS A 137 -26.638 -3.728 -5.856 1.00 0.81 C ATOM 2100 CD LYS A 137 -25.993 -2.411 -6.254 1.00 1.53 C ATOM 2101 CE LYS A 137 -26.835 -1.227 -5.830 1.00 2.40 C ATOM 2102 NZ LYS A 137 -28.117 -1.152 -6.577 1.00 3.13 N ATOM 0 H LYS A 137 -23.832 -2.771 -4.235 1.00 0.46 H new ATOM 0 HA LYS A 137 -25.219 -4.405 -3.690 1.00 0.54 H new ATOM 0 HB2 LYS A 137 -25.051 -4.905 -6.671 1.00 0.65 H new ATOM 0 HB3 LYS A 137 -26.141 -5.794 -5.625 1.00 0.65 H new ATOM 0 HG2 LYS A 137 -27.393 -4.000 -6.594 1.00 0.81 H new ATOM 0 HG3 LYS A 137 -27.153 -3.607 -4.903 1.00 0.81 H new ATOM 0 HD2 LYS A 137 -25.005 -2.337 -5.799 1.00 1.53 H new ATOM 0 HD3 LYS A 137 -25.849 -2.388 -7.334 1.00 1.53 H new ATOM 0 HE2 LYS A 137 -27.042 -1.295 -4.762 1.00 2.40 H new ATOM 0 HE3 LYS A 137 -26.271 -0.308 -5.987 1.00 2.40 H new ATOM 0 HZ1 LYS A 137 -28.660 -0.326 -6.253 1.00 3.13 H new ATOM 0 HZ2 LYS A 137 -27.921 -1.060 -7.594 1.00 3.13 H new ATOM 0 HZ3 LYS A 137 -28.669 -2.017 -6.407 1.00 3.13 H new ATOM 2116 N GLY A 138 -22.699 -5.835 -3.751 1.00 0.41 N ATOM 2117 CA GLY A 138 -21.930 -6.997 -3.357 1.00 0.40 C ATOM 2118 C GLY A 138 -21.077 -7.555 -4.481 1.00 0.37 C ATOM 2119 O GLY A 138 -20.577 -8.674 -4.388 1.00 0.39 O ATOM 0 H GLY A 138 -22.236 -4.940 -3.590 1.00 0.41 H new ATOM 0 HA2 GLY A 138 -21.287 -6.732 -2.518 1.00 0.40 H new ATOM 0 HA3 GLY A 138 -22.610 -7.773 -3.005 1.00 0.40 H new ATOM 2123 N LYS A 139 -20.915 -6.792 -5.552 1.00 0.37 N ATOM 2124 CA LYS A 139 -20.040 -7.202 -6.639 1.00 0.36 C ATOM 2125 C LYS A 139 -18.868 -6.240 -6.751 1.00 0.32 C ATOM 2126 O LYS A 139 -19.045 -5.030 -6.656 1.00 0.40 O ATOM 2127 CB LYS A 139 -20.806 -7.273 -7.958 1.00 0.44 C ATOM 2128 CG LYS A 139 -21.876 -8.354 -7.976 1.00 0.87 C ATOM 2129 CD LYS A 139 -22.621 -8.393 -9.300 1.00 1.14 C ATOM 2130 CE LYS A 139 -21.695 -8.736 -10.455 1.00 1.64 C ATOM 2131 NZ LYS A 139 -22.422 -8.798 -11.748 1.00 2.23 N ATOM 0 H LYS A 139 -21.375 -5.892 -5.691 1.00 0.37 H new ATOM 0 HA LYS A 139 -19.658 -8.199 -6.421 1.00 0.36 H new ATOM 0 HB2 LYS A 139 -21.272 -6.307 -8.152 1.00 0.44 H new ATOM 0 HB3 LYS A 139 -20.102 -7.455 -8.770 1.00 0.44 H new ATOM 0 HG2 LYS A 139 -21.415 -9.324 -7.790 1.00 0.87 H new ATOM 0 HG3 LYS A 139 -22.584 -8.177 -7.166 1.00 0.87 H new ATOM 0 HD2 LYS A 139 -23.423 -9.129 -9.245 1.00 1.14 H new ATOM 0 HD3 LYS A 139 -23.089 -7.426 -9.483 1.00 1.14 H new ATOM 0 HE2 LYS A 139 -20.903 -7.990 -10.519 1.00 1.64 H new ATOM 0 HE3 LYS A 139 -21.214 -9.695 -10.262 1.00 1.64 H new ATOM 0 HZ1 LYS A 139 -21.755 -9.035 -12.510 1.00 2.23 H new ATOM 0 HZ2 LYS A 139 -23.161 -9.528 -11.696 1.00 2.23 H new ATOM 0 HZ3 LYS A 139 -22.860 -7.875 -11.945 1.00 2.23 H new ATOM 2145 N LEU A 140 -17.681 -6.784 -6.957 1.00 0.33 N ATOM 2146 CA LEU A 140 -16.458 -5.999 -6.914 1.00 0.30 C ATOM 2147 C LEU A 140 -15.796 -5.981 -8.287 1.00 0.31 C ATOM 2148 O LEU A 140 -15.466 -7.029 -8.840 1.00 0.41 O ATOM 2149 CB LEU A 140 -15.503 -6.602 -5.876 1.00 0.32 C ATOM 2150 CG LEU A 140 -14.483 -5.643 -5.255 1.00 0.32 C ATOM 2151 CD1 LEU A 140 -13.829 -6.293 -4.049 1.00 0.39 C ATOM 2152 CD2 LEU A 140 -13.420 -5.234 -6.262 1.00 0.37 C ATOM 0 H LEU A 140 -17.537 -7.774 -7.157 1.00 0.33 H new ATOM 0 HA LEU A 140 -16.698 -4.974 -6.632 1.00 0.30 H new ATOM 0 HB2 LEU A 140 -16.100 -7.034 -5.073 1.00 0.32 H new ATOM 0 HB3 LEU A 140 -14.960 -7.422 -6.346 1.00 0.32 H new ATOM 0 HG LEU A 140 -15.014 -4.744 -4.942 1.00 0.32 H new ATOM 0 HD11 LEU A 140 -13.105 -5.605 -3.613 1.00 0.39 H new ATOM 0 HD12 LEU A 140 -14.591 -6.535 -3.308 1.00 0.39 H new ATOM 0 HD13 LEU A 140 -13.321 -7.206 -4.359 1.00 0.39 H new ATOM 0 HD21 LEU A 140 -12.713 -4.553 -5.788 1.00 0.37 H new ATOM 0 HD22 LEU A 140 -12.891 -6.120 -6.613 1.00 0.37 H new ATOM 0 HD23 LEU A 140 -13.893 -4.735 -7.108 1.00 0.37 H new ATOM 2164 N SER A 141 -15.611 -4.795 -8.831 1.00 0.28 N ATOM 2165 CA SER A 141 -14.944 -4.632 -10.109 1.00 0.31 C ATOM 2166 C SER A 141 -13.667 -3.820 -9.929 1.00 0.28 C ATOM 2167 O SER A 141 -13.719 -2.647 -9.564 1.00 0.36 O ATOM 2168 CB SER A 141 -15.879 -3.932 -11.096 1.00 0.39 C ATOM 2169 OG SER A 141 -17.160 -4.538 -11.090 1.00 1.19 O ATOM 0 H SER A 141 -15.917 -3.921 -8.403 1.00 0.28 H new ATOM 0 HA SER A 141 -14.683 -5.614 -10.504 1.00 0.31 H new ATOM 0 HB2 SER A 141 -15.969 -2.878 -10.834 1.00 0.39 H new ATOM 0 HB3 SER A 141 -15.455 -3.976 -12.099 1.00 0.39 H new ATOM 0 HG SER A 141 -17.744 -4.075 -11.726 1.00 1.19 H new ATOM 2175 N VAL A 142 -12.522 -4.444 -10.159 1.00 0.33 N ATOM 2176 CA VAL A 142 -11.253 -3.747 -10.041 1.00 0.35 C ATOM 2177 C VAL A 142 -10.885 -3.148 -11.403 1.00 0.43 C ATOM 2178 O VAL A 142 -10.634 -3.870 -12.369 1.00 0.48 O ATOM 2179 CB VAL A 142 -10.122 -4.681 -9.495 1.00 0.35 C ATOM 2180 CG1 VAL A 142 -10.590 -5.410 -8.247 1.00 0.92 C ATOM 2181 CG2 VAL A 142 -9.643 -5.675 -10.539 1.00 0.83 C ATOM 0 H VAL A 142 -12.446 -5.425 -10.427 1.00 0.33 H new ATOM 0 HA VAL A 142 -11.358 -2.943 -9.313 1.00 0.35 H new ATOM 0 HB VAL A 142 -9.275 -4.044 -9.241 1.00 0.35 H new ATOM 0 HG11 VAL A 142 -9.791 -6.055 -7.881 1.00 0.92 H new ATOM 0 HG12 VAL A 142 -10.851 -4.683 -7.478 1.00 0.92 H new ATOM 0 HG13 VAL A 142 -11.464 -6.016 -8.486 1.00 0.92 H new ATOM 0 HG21 VAL A 142 -8.859 -6.301 -10.113 1.00 0.83 H new ATOM 0 HG22 VAL A 142 -10.477 -6.303 -10.853 1.00 0.83 H new ATOM 0 HG23 VAL A 142 -9.249 -5.136 -11.401 1.00 0.83 H new ATOM 2191 N GLN A 143 -10.923 -1.820 -11.489 1.00 0.56 N ATOM 2192 CA GLN A 143 -10.647 -1.102 -12.735 1.00 0.70 C ATOM 2193 C GLN A 143 -11.694 -1.452 -13.797 1.00 0.82 C ATOM 2194 O GLN A 143 -12.700 -0.757 -13.952 1.00 1.45 O ATOM 2195 CB GLN A 143 -9.239 -1.414 -13.275 1.00 0.74 C ATOM 2196 CG GLN A 143 -8.081 -0.930 -12.408 1.00 0.83 C ATOM 2197 CD GLN A 143 -7.976 -1.647 -11.075 1.00 1.15 C ATOM 2198 OE1 GLN A 143 -7.353 -2.699 -10.973 1.00 1.88 O ATOM 2199 NE2 GLN A 143 -8.577 -1.080 -10.041 1.00 1.11 N ATOM 0 H GLN A 143 -11.145 -1.212 -10.701 1.00 0.56 H new ATOM 0 HA GLN A 143 -10.696 -0.036 -12.512 1.00 0.70 H new ATOM 0 HB2 GLN A 143 -9.149 -2.493 -13.402 1.00 0.74 H new ATOM 0 HB3 GLN A 143 -9.141 -0.967 -14.264 1.00 0.74 H new ATOM 0 HG2 GLN A 143 -7.148 -1.062 -12.956 1.00 0.83 H new ATOM 0 HG3 GLN A 143 -8.196 0.139 -12.228 1.00 0.83 H new ATOM 0 HE21 GLN A 143 -9.086 -0.205 -10.164 1.00 1.11 H new ATOM 0 HE22 GLN A 143 -8.531 -1.518 -9.121 1.00 1.11 H new ATOM 2208 N GLY A 144 -11.454 -2.546 -14.506 1.00 0.86 N ATOM 2209 CA GLY A 144 -12.390 -3.021 -15.502 1.00 0.96 C ATOM 2210 C GLY A 144 -12.517 -4.531 -15.474 1.00 0.85 C ATOM 2211 O GLY A 144 -12.984 -5.144 -16.434 1.00 1.02 O ATOM 0 H GLY A 144 -10.616 -3.119 -14.406 1.00 0.86 H new ATOM 0 HA2 GLY A 144 -13.367 -2.570 -15.328 1.00 0.96 H new ATOM 0 HA3 GLY A 144 -12.063 -2.701 -16.491 1.00 0.96 H new ATOM 2215 N GLU A 145 -12.082 -5.131 -14.374 1.00 0.66 N ATOM 2216 CA GLU A 145 -12.177 -6.571 -14.192 1.00 0.65 C ATOM 2217 C GLU A 145 -13.246 -6.865 -13.148 1.00 0.52 C ATOM 2218 O GLU A 145 -13.149 -6.409 -12.008 1.00 0.55 O ATOM 2219 CB GLU A 145 -10.818 -7.138 -13.765 1.00 0.74 C ATOM 2220 CG GLU A 145 -10.718 -8.654 -13.839 1.00 1.06 C ATOM 2221 CD GLU A 145 -9.303 -9.148 -13.614 1.00 1.35 C ATOM 2222 OE1 GLU A 145 -8.443 -8.912 -14.485 1.00 1.84 O ATOM 2223 OE2 GLU A 145 -9.038 -9.762 -12.557 1.00 1.95 O ATOM 0 H GLU A 145 -11.657 -4.637 -13.589 1.00 0.66 H new ATOM 0 HA GLU A 145 -12.456 -7.049 -15.131 1.00 0.65 H new ATOM 0 HB2 GLU A 145 -10.042 -6.704 -14.396 1.00 0.74 H new ATOM 0 HB3 GLU A 145 -10.611 -6.822 -12.743 1.00 0.74 H new ATOM 0 HG2 GLU A 145 -11.378 -9.096 -13.093 1.00 1.06 H new ATOM 0 HG3 GLU A 145 -11.068 -8.992 -14.814 1.00 1.06 H new ATOM 2230 N VAL A 146 -14.256 -7.629 -13.528 1.00 0.59 N ATOM 2231 CA VAL A 146 -15.445 -7.774 -12.699 1.00 0.54 C ATOM 2232 C VAL A 146 -15.467 -9.114 -11.960 1.00 0.53 C ATOM 2233 O VAL A 146 -14.960 -10.125 -12.451 1.00 0.67 O ATOM 2234 CB VAL A 146 -16.729 -7.617 -13.551 1.00 0.64 C ATOM 2235 CG1 VAL A 146 -16.834 -8.719 -14.597 1.00 0.92 C ATOM 2236 CG2 VAL A 146 -17.971 -7.589 -12.673 1.00 0.92 C ATOM 0 H VAL A 146 -14.279 -8.157 -14.400 1.00 0.59 H new ATOM 0 HA VAL A 146 -15.413 -6.981 -11.951 1.00 0.54 H new ATOM 0 HB VAL A 146 -16.662 -6.662 -14.072 1.00 0.64 H new ATOM 0 HG11 VAL A 146 -17.745 -8.582 -15.179 1.00 0.92 H new ATOM 0 HG12 VAL A 146 -15.970 -8.675 -15.260 1.00 0.92 H new ATOM 0 HG13 VAL A 146 -16.862 -9.689 -14.102 1.00 0.92 H new ATOM 0 HG21 VAL A 146 -18.857 -7.478 -13.299 1.00 0.92 H new ATOM 0 HG22 VAL A 146 -18.039 -8.520 -12.109 1.00 0.92 H new ATOM 0 HG23 VAL A 146 -17.908 -6.749 -11.981 1.00 0.92 H new ATOM 2246 N SER A 147 -16.034 -9.089 -10.760 1.00 0.47 N ATOM 2247 CA SER A 147 -16.168 -10.270 -9.925 1.00 0.47 C ATOM 2248 C SER A 147 -17.202 -9.997 -8.840 1.00 0.48 C ATOM 2249 O SER A 147 -17.732 -8.891 -8.752 1.00 0.79 O ATOM 2250 CB SER A 147 -14.820 -10.610 -9.294 1.00 0.54 C ATOM 2251 OG SER A 147 -14.267 -9.475 -8.642 1.00 1.27 O ATOM 0 H SER A 147 -16.415 -8.242 -10.339 1.00 0.47 H new ATOM 0 HA SER A 147 -16.494 -11.116 -10.530 1.00 0.47 H new ATOM 0 HB2 SER A 147 -14.943 -11.422 -8.578 1.00 0.54 H new ATOM 0 HB3 SER A 147 -14.133 -10.964 -10.062 1.00 0.54 H new ATOM 0 HG SER A 147 -13.328 -9.649 -8.422 1.00 1.27 H new ATOM 2257 N THR A 148 -17.501 -10.994 -8.031 1.00 0.41 N ATOM 2258 CA THR A 148 -18.393 -10.801 -6.905 1.00 0.40 C ATOM 2259 C THR A 148 -17.592 -10.645 -5.615 1.00 0.39 C ATOM 2260 O THR A 148 -16.616 -11.360 -5.391 1.00 0.46 O ATOM 2261 CB THR A 148 -19.389 -11.967 -6.769 1.00 0.46 C ATOM 2262 OG1 THR A 148 -18.683 -13.205 -6.627 1.00 1.45 O ATOM 2263 CG2 THR A 148 -20.305 -12.037 -7.981 1.00 1.28 C ATOM 0 H THR A 148 -17.141 -11.943 -8.132 1.00 0.41 H new ATOM 0 HA THR A 148 -18.963 -9.890 -7.086 1.00 0.40 H new ATOM 0 HB THR A 148 -19.996 -11.794 -5.881 1.00 0.46 H new ATOM 0 HG1 THR A 148 -19.325 -13.940 -6.540 1.00 1.45 H new ATOM 0 HG21 THR A 148 -21.001 -12.868 -7.864 1.00 1.28 H new ATOM 0 HG22 THR A 148 -20.864 -11.105 -8.069 1.00 1.28 H new ATOM 0 HG23 THR A 148 -19.708 -12.188 -8.880 1.00 1.28 H new ATOM 2271 N PHE A 149 -18.006 -9.709 -4.773 1.00 0.35 N ATOM 2272 CA PHE A 149 -17.322 -9.452 -3.514 1.00 0.32 C ATOM 2273 C PHE A 149 -17.737 -10.486 -2.474 1.00 0.35 C ATOM 2274 O PHE A 149 -18.925 -10.756 -2.298 1.00 0.43 O ATOM 2275 CB PHE A 149 -17.639 -8.031 -3.023 1.00 0.30 C ATOM 2276 CG PHE A 149 -17.290 -7.787 -1.581 1.00 0.30 C ATOM 2277 CD1 PHE A 149 -15.989 -7.466 -1.223 1.00 0.34 C ATOM 2278 CD2 PHE A 149 -18.254 -7.869 -0.589 1.00 0.38 C ATOM 2279 CE1 PHE A 149 -15.657 -7.232 0.094 1.00 0.42 C ATOM 2280 CE2 PHE A 149 -17.926 -7.636 0.729 1.00 0.46 C ATOM 2281 CZ PHE A 149 -16.666 -7.354 1.086 1.00 0.47 C ATOM 0 H PHE A 149 -18.816 -9.112 -4.940 1.00 0.35 H new ATOM 0 HA PHE A 149 -16.246 -9.531 -3.669 1.00 0.32 H new ATOM 0 HB2 PHE A 149 -17.099 -7.315 -3.642 1.00 0.30 H new ATOM 0 HB3 PHE A 149 -18.702 -7.838 -3.166 1.00 0.30 H new ATOM 0 HD1 PHE A 149 -15.227 -7.399 -1.985 1.00 0.34 H new ATOM 0 HD2 PHE A 149 -19.272 -8.118 -0.851 1.00 0.38 H new ATOM 0 HE1 PHE A 149 -14.648 -6.961 0.367 1.00 0.42 H new ATOM 0 HE2 PHE A 149 -18.696 -7.681 1.485 1.00 0.46 H new ATOM 0 HZ PHE A 149 -16.417 -7.219 2.128 1.00 0.47 H new ATOM 2291 N THR A 150 -16.763 -11.074 -1.800 1.00 0.37 N ATOM 2292 CA THR A 150 -17.049 -12.079 -0.793 1.00 0.48 C ATOM 2293 C THR A 150 -16.294 -11.800 0.506 1.00 0.43 C ATOM 2294 O THR A 150 -15.064 -11.876 0.565 1.00 0.82 O ATOM 2295 CB THR A 150 -16.733 -13.506 -1.312 1.00 0.78 C ATOM 2296 OG1 THR A 150 -16.903 -14.471 -0.265 1.00 1.79 O ATOM 2297 CG2 THR A 150 -15.319 -13.600 -1.873 1.00 1.25 C ATOM 0 H THR A 150 -15.772 -10.873 -1.932 1.00 0.37 H new ATOM 0 HA THR A 150 -18.117 -12.025 -0.580 1.00 0.48 H new ATOM 0 HB THR A 150 -17.434 -13.721 -2.119 1.00 0.78 H new ATOM 0 HG1 THR A 150 -16.701 -15.366 -0.609 1.00 1.79 H new ATOM 0 HG21 THR A 150 -15.135 -14.614 -2.227 1.00 1.25 H new ATOM 0 HG22 THR A 150 -15.209 -12.901 -2.702 1.00 1.25 H new ATOM 0 HG23 THR A 150 -14.600 -13.352 -1.092 1.00 1.25 H new ATOM 2305 N GLY A 151 -17.048 -11.434 1.535 1.00 0.42 N ATOM 2306 CA GLY A 151 -16.493 -11.267 2.864 1.00 0.37 C ATOM 2307 C GLY A 151 -15.709 -9.990 3.037 1.00 0.32 C ATOM 2308 O GLY A 151 -16.172 -9.055 3.694 1.00 0.34 O ATOM 0 H GLY A 151 -18.049 -11.248 1.470 1.00 0.42 H new ATOM 0 HA2 GLY A 151 -17.304 -11.287 3.592 1.00 0.37 H new ATOM 0 HA3 GLY A 151 -15.844 -12.114 3.086 1.00 0.37 H new ATOM 2312 N LYS A 152 -14.529 -9.936 2.448 1.00 0.29 N ATOM 2313 CA LYS A 152 -13.655 -8.798 2.628 1.00 0.28 C ATOM 2314 C LYS A 152 -12.693 -8.671 1.457 1.00 0.27 C ATOM 2315 O LYS A 152 -12.586 -9.571 0.625 1.00 0.33 O ATOM 2316 CB LYS A 152 -12.893 -8.911 3.961 1.00 0.36 C ATOM 2317 CG LYS A 152 -11.666 -9.816 3.960 1.00 0.44 C ATOM 2318 CD LYS A 152 -11.997 -11.269 3.660 1.00 0.62 C ATOM 2319 CE LYS A 152 -10.793 -12.161 3.911 1.00 0.77 C ATOM 2320 NZ LYS A 152 -10.496 -12.306 5.364 1.00 1.23 N ATOM 0 H LYS A 152 -14.156 -10.667 1.842 1.00 0.29 H new ATOM 0 HA LYS A 152 -14.264 -7.894 2.661 1.00 0.28 H new ATOM 0 HB2 LYS A 152 -12.581 -7.911 4.263 1.00 0.36 H new ATOM 0 HB3 LYS A 152 -13.585 -9.273 4.722 1.00 0.36 H new ATOM 0 HG2 LYS A 152 -10.954 -9.452 3.220 1.00 0.44 H new ATOM 0 HG3 LYS A 152 -11.176 -9.754 4.932 1.00 0.44 H new ATOM 0 HD2 LYS A 152 -12.831 -11.593 4.283 1.00 0.62 H new ATOM 0 HD3 LYS A 152 -12.317 -11.367 2.623 1.00 0.62 H new ATOM 0 HE2 LYS A 152 -10.975 -13.145 3.479 1.00 0.77 H new ATOM 0 HE3 LYS A 152 -9.923 -11.746 3.403 1.00 0.77 H new ATOM 0 HZ1 LYS A 152 -9.648 -12.894 5.488 1.00 1.23 H new ATOM 0 HZ2 LYS A 152 -10.330 -11.367 5.780 1.00 1.23 H new ATOM 0 HZ3 LYS A 152 -11.303 -12.758 5.840 1.00 1.23 H new ATOM 2334 N LEU A 153 -12.000 -7.550 1.397 1.00 0.23 N ATOM 2335 CA LEU A 153 -11.030 -7.311 0.340 1.00 0.24 C ATOM 2336 C LEU A 153 -9.736 -8.018 0.698 1.00 0.26 C ATOM 2337 O LEU A 153 -9.450 -8.203 1.872 1.00 0.44 O ATOM 2338 CB LEU A 153 -10.779 -5.812 0.180 1.00 0.26 C ATOM 2339 CG LEU A 153 -9.971 -5.418 -1.054 1.00 0.35 C ATOM 2340 CD1 LEU A 153 -10.795 -5.626 -2.308 1.00 1.17 C ATOM 2341 CD2 LEU A 153 -9.502 -3.976 -0.952 1.00 1.16 C ATOM 0 H LEU A 153 -12.089 -6.787 2.068 1.00 0.23 H new ATOM 0 HA LEU A 153 -11.415 -7.697 -0.604 1.00 0.24 H new ATOM 0 HB2 LEU A 153 -11.741 -5.300 0.144 1.00 0.26 H new ATOM 0 HB3 LEU A 153 -10.258 -5.450 1.067 1.00 0.26 H new ATOM 0 HG LEU A 153 -9.089 -6.056 -1.109 1.00 0.35 H new ATOM 0 HD11 LEU A 153 -10.207 -5.341 -3.181 1.00 1.17 H new ATOM 0 HD12 LEU A 153 -11.078 -6.676 -2.388 1.00 1.17 H new ATOM 0 HD13 LEU A 153 -11.693 -5.011 -2.259 1.00 1.17 H new ATOM 0 HD21 LEU A 153 -8.928 -3.716 -1.842 1.00 1.16 H new ATOM 0 HD22 LEU A 153 -10.367 -3.317 -0.872 1.00 1.16 H new ATOM 0 HD23 LEU A 153 -8.874 -3.859 -0.069 1.00 1.16 H new ATOM 2353 N SER A 154 -8.956 -8.443 -0.279 1.00 0.24 N ATOM 2354 CA SER A 154 -7.694 -9.071 0.053 1.00 0.27 C ATOM 2355 C SER A 154 -6.581 -8.490 -0.787 1.00 0.30 C ATOM 2356 O SER A 154 -6.460 -8.799 -1.972 1.00 0.50 O ATOM 2357 CB SER A 154 -7.756 -10.589 -0.141 1.00 0.38 C ATOM 2358 OG SER A 154 -6.695 -11.238 0.540 1.00 1.35 O ATOM 0 H SER A 154 -9.164 -8.369 -1.275 1.00 0.24 H new ATOM 0 HA SER A 154 -7.492 -8.872 1.105 1.00 0.27 H new ATOM 0 HB2 SER A 154 -8.711 -10.966 0.225 1.00 0.38 H new ATOM 0 HB3 SER A 154 -7.707 -10.824 -1.204 1.00 0.38 H new ATOM 0 HG SER A 154 -6.308 -10.626 1.200 1.00 1.35 H new ATOM 2364 N VAL A 155 -5.775 -7.642 -0.184 1.00 0.26 N ATOM 2365 CA VAL A 155 -4.648 -7.079 -0.885 1.00 0.28 C ATOM 2366 C VAL A 155 -3.435 -7.948 -0.617 1.00 0.29 C ATOM 2367 O VAL A 155 -2.773 -7.831 0.417 1.00 0.38 O ATOM 2368 CB VAL A 155 -4.371 -5.619 -0.480 1.00 0.34 C ATOM 2369 CG1 VAL A 155 -3.352 -4.998 -1.418 1.00 0.42 C ATOM 2370 CG2 VAL A 155 -5.660 -4.812 -0.478 1.00 0.39 C ATOM 0 H VAL A 155 -5.880 -7.331 0.782 1.00 0.26 H new ATOM 0 HA VAL A 155 -4.876 -7.061 -1.951 1.00 0.28 H new ATOM 0 HB VAL A 155 -3.962 -5.610 0.530 1.00 0.34 H new ATOM 0 HG11 VAL A 155 -3.165 -3.966 -1.121 1.00 0.42 H new ATOM 0 HG12 VAL A 155 -2.421 -5.564 -1.370 1.00 0.42 H new ATOM 0 HG13 VAL A 155 -3.737 -5.018 -2.438 1.00 0.42 H new ATOM 0 HG21 VAL A 155 -5.445 -3.783 -0.189 1.00 0.39 H new ATOM 0 HG22 VAL A 155 -6.099 -4.825 -1.476 1.00 0.39 H new ATOM 0 HG23 VAL A 155 -6.362 -5.249 0.233 1.00 0.39 H new ATOM 2380 N GLU A 156 -3.186 -8.843 -1.553 1.00 0.32 N ATOM 2381 CA GLU A 156 -2.155 -9.846 -1.410 1.00 0.40 C ATOM 2382 C GLU A 156 -0.991 -9.511 -2.320 1.00 0.36 C ATOM 2383 O GLU A 156 -1.168 -9.381 -3.533 1.00 0.42 O ATOM 2384 CB GLU A 156 -2.722 -11.211 -1.796 1.00 0.61 C ATOM 2385 CG GLU A 156 -2.238 -12.354 -0.927 1.00 0.73 C ATOM 2386 CD GLU A 156 -2.506 -13.706 -1.551 1.00 1.41 C ATOM 2387 OE1 GLU A 156 -3.673 -13.978 -1.918 1.00 1.98 O ATOM 2388 OE2 GLU A 156 -1.547 -14.489 -1.700 1.00 1.92 O ATOM 0 H GLU A 156 -3.695 -8.893 -2.435 1.00 0.32 H new ATOM 0 HA GLU A 156 -1.812 -9.869 -0.376 1.00 0.40 H new ATOM 0 HB2 GLU A 156 -3.810 -11.167 -1.746 1.00 0.61 H new ATOM 0 HB3 GLU A 156 -2.459 -11.421 -2.833 1.00 0.61 H new ATOM 0 HG2 GLU A 156 -1.168 -12.244 -0.750 1.00 0.73 H new ATOM 0 HG3 GLU A 156 -2.729 -12.301 0.045 1.00 0.73 H new ATOM 2395 N PHE A 157 0.190 -9.348 -1.755 1.00 0.41 N ATOM 2396 CA PHE A 157 1.362 -9.107 -2.573 1.00 0.43 C ATOM 2397 C PHE A 157 2.317 -10.284 -2.477 1.00 0.43 C ATOM 2398 O PHE A 157 2.874 -10.573 -1.416 1.00 0.51 O ATOM 2399 CB PHE A 157 2.072 -7.794 -2.223 1.00 0.55 C ATOM 2400 CG PHE A 157 1.337 -6.930 -1.245 1.00 0.88 C ATOM 2401 CD1 PHE A 157 1.504 -7.104 0.114 1.00 1.19 C ATOM 2402 CD2 PHE A 157 0.481 -5.943 -1.688 1.00 1.46 C ATOM 2403 CE1 PHE A 157 0.828 -6.311 1.015 1.00 1.85 C ATOM 2404 CE2 PHE A 157 -0.198 -5.144 -0.792 1.00 2.17 C ATOM 2405 CZ PHE A 157 -0.026 -5.329 0.562 1.00 2.32 C ATOM 0 H PHE A 157 0.362 -9.377 -0.750 1.00 0.41 H new ATOM 0 HA PHE A 157 1.021 -9.005 -3.603 1.00 0.43 H new ATOM 0 HB2 PHE A 157 3.056 -8.026 -1.815 1.00 0.55 H new ATOM 0 HB3 PHE A 157 2.232 -7.227 -3.140 1.00 0.55 H new ATOM 0 HD1 PHE A 157 2.173 -7.871 0.475 1.00 1.19 H new ATOM 0 HD2 PHE A 157 0.341 -5.794 -2.749 1.00 1.46 H new ATOM 0 HE1 PHE A 157 0.967 -6.459 2.076 1.00 1.85 H new ATOM 0 HE2 PHE A 157 -0.864 -4.374 -1.152 1.00 2.17 H new ATOM 0 HZ PHE A 157 -0.558 -4.707 1.266 1.00 2.32 H new ATOM 2415 N VAL A 158 2.502 -10.946 -3.606 1.00 0.44 N ATOM 2416 CA VAL A 158 3.273 -12.174 -3.671 1.00 0.48 C ATOM 2417 C VAL A 158 4.762 -11.872 -3.767 1.00 0.48 C ATOM 2418 O VAL A 158 5.175 -10.933 -4.460 1.00 0.47 O ATOM 2419 CB VAL A 158 2.835 -13.032 -4.877 1.00 0.52 C ATOM 2420 CG1 VAL A 158 3.598 -14.349 -4.927 1.00 0.62 C ATOM 2421 CG2 VAL A 158 1.338 -13.284 -4.825 1.00 0.59 C ATOM 0 H VAL A 158 2.121 -10.647 -4.504 1.00 0.44 H new ATOM 0 HA VAL A 158 3.086 -12.734 -2.755 1.00 0.48 H new ATOM 0 HB VAL A 158 3.068 -12.480 -5.787 1.00 0.52 H new ATOM 0 HG11 VAL A 158 3.266 -14.929 -5.788 1.00 0.62 H new ATOM 0 HG12 VAL A 158 4.666 -14.148 -5.015 1.00 0.62 H new ATOM 0 HG13 VAL A 158 3.409 -14.914 -4.014 1.00 0.62 H new ATOM 0 HG21 VAL A 158 1.041 -13.890 -5.681 1.00 0.59 H new ATOM 0 HG22 VAL A 158 1.089 -13.811 -3.904 1.00 0.59 H new ATOM 0 HG23 VAL A 158 0.808 -12.332 -4.853 1.00 0.59 H new ATOM 2431 N LYS A 159 5.548 -12.686 -3.064 1.00 0.58 N ATOM 2432 CA LYS A 159 6.981 -12.484 -2.925 1.00 0.66 C ATOM 2433 C LYS A 159 7.721 -12.647 -4.250 1.00 0.63 C ATOM 2434 O LYS A 159 7.847 -13.749 -4.785 1.00 0.77 O ATOM 2435 CB LYS A 159 7.547 -13.442 -1.869 1.00 0.93 C ATOM 2436 CG LYS A 159 7.192 -14.908 -2.083 1.00 1.36 C ATOM 2437 CD LYS A 159 7.770 -15.778 -0.975 1.00 1.66 C ATOM 2438 CE LYS A 159 7.563 -17.261 -1.247 1.00 1.99 C ATOM 2439 NZ LYS A 159 6.126 -17.644 -1.248 1.00 2.26 N ATOM 0 H LYS A 159 5.201 -13.510 -2.573 1.00 0.58 H new ATOM 0 HA LYS A 159 7.137 -11.455 -2.600 1.00 0.66 H new ATOM 0 HB2 LYS A 159 8.632 -13.344 -1.854 1.00 0.93 H new ATOM 0 HB3 LYS A 159 7.185 -13.134 -0.888 1.00 0.93 H new ATOM 0 HG2 LYS A 159 6.108 -15.023 -2.112 1.00 1.36 H new ATOM 0 HG3 LYS A 159 7.574 -15.241 -3.048 1.00 1.36 H new ATOM 0 HD2 LYS A 159 8.836 -15.574 -0.872 1.00 1.66 H new ATOM 0 HD3 LYS A 159 7.302 -15.515 -0.026 1.00 1.66 H new ATOM 0 HE2 LYS A 159 8.004 -17.516 -2.211 1.00 1.99 H new ATOM 0 HE3 LYS A 159 8.090 -17.843 -0.491 1.00 1.99 H new ATOM 0 HZ1 LYS A 159 6.039 -18.666 -1.421 1.00 2.26 H new ATOM 0 HZ2 LYS A 159 5.704 -17.412 -0.326 1.00 2.26 H new ATOM 0 HZ3 LYS A 159 5.628 -17.123 -1.998 1.00 2.26 H new ATOM 2564 N VAL A 167 8.595 -2.195 2.611 1.00 0.49 N ATOM 2565 CA VAL A 167 7.698 -1.338 3.367 1.00 0.44 C ATOM 2566 C VAL A 167 6.418 -1.170 2.574 1.00 0.38 C ATOM 2567 O VAL A 167 6.456 -0.993 1.343 1.00 0.39 O ATOM 2568 CB VAL A 167 8.317 0.047 3.717 1.00 0.53 C ATOM 2569 CG1 VAL A 167 9.835 -0.031 3.798 1.00 1.15 C ATOM 2570 CG2 VAL A 167 7.892 1.132 2.739 1.00 1.19 C ATOM 0 HA VAL A 167 7.499 -1.818 4.325 1.00 0.44 H new ATOM 0 HB VAL A 167 7.931 0.321 4.699 1.00 0.53 H new ATOM 0 HG11 VAL A 167 10.237 0.952 4.044 1.00 1.15 H new ATOM 0 HG12 VAL A 167 10.122 -0.744 4.571 1.00 1.15 H new ATOM 0 HG13 VAL A 167 10.234 -0.356 2.837 1.00 1.15 H new ATOM 0 HG21 VAL A 167 8.349 2.079 3.025 1.00 1.19 H new ATOM 0 HG22 VAL A 167 8.215 0.862 1.733 1.00 1.19 H new ATOM 0 HG23 VAL A 167 6.807 1.233 2.757 1.00 1.19 H new ATOM 2580 N CYS A 168 5.288 -1.251 3.262 1.00 0.38 N ATOM 2581 CA CYS A 168 4.020 -1.350 2.560 1.00 0.40 C ATOM 2582 C CYS A 168 2.926 -0.473 3.173 1.00 0.47 C ATOM 2583 O CYS A 168 2.141 -0.924 3.998 1.00 0.94 O ATOM 2584 CB CYS A 168 3.593 -2.808 2.556 1.00 0.48 C ATOM 2585 SG CYS A 168 2.174 -3.165 1.499 1.00 1.36 S ATOM 0 H CYS A 168 5.223 -1.250 4.280 1.00 0.38 H new ATOM 0 HA CYS A 168 4.162 -0.983 1.544 1.00 0.40 H new ATOM 0 HB2 CYS A 168 4.435 -3.420 2.232 1.00 0.48 H new ATOM 0 HB3 CYS A 168 3.355 -3.107 3.577 1.00 0.48 H new ATOM 0 HG CYS A 168 1.840 -4.415 1.628 1.00 1.36 H new ATOM 2591 N ALA A 169 2.857 0.759 2.703 1.00 0.29 N ATOM 2592 CA ALA A 169 1.908 1.775 3.172 1.00 0.28 C ATOM 2593 C ALA A 169 0.480 1.553 2.659 1.00 0.27 C ATOM 2594 O ALA A 169 -0.153 2.491 2.177 1.00 0.28 O ATOM 2595 CB ALA A 169 2.389 3.167 2.835 1.00 0.31 C ATOM 0 H ALA A 169 3.473 1.099 1.964 1.00 0.29 H new ATOM 0 HA ALA A 169 1.866 1.671 4.256 1.00 0.28 H new ATOM 0 HB1 ALA A 169 1.666 3.899 3.195 1.00 0.31 H new ATOM 0 HB2 ALA A 169 3.353 3.344 3.312 1.00 0.31 H new ATOM 0 HB3 ALA A 169 2.496 3.263 1.755 1.00 0.31 H new ATOM 2601 N LEU A 170 0.067 0.292 2.598 1.00 0.28 N ATOM 2602 CA LEU A 170 -1.243 -0.100 2.073 1.00 0.32 C ATOM 2603 C LEU A 170 -2.406 0.636 2.763 1.00 0.32 C ATOM 2604 O LEU A 170 -2.782 0.313 3.884 1.00 0.52 O ATOM 2605 CB LEU A 170 -1.403 -1.614 2.244 1.00 0.48 C ATOM 2606 CG LEU A 170 -2.785 -2.182 1.921 1.00 0.39 C ATOM 2607 CD1 LEU A 170 -3.189 -1.847 0.504 1.00 0.66 C ATOM 2608 CD2 LEU A 170 -2.791 -3.684 2.117 1.00 0.69 C ATOM 0 H LEU A 170 0.634 -0.496 2.913 1.00 0.28 H new ATOM 0 HA LEU A 170 -1.283 0.178 1.020 1.00 0.32 H new ATOM 0 HB2 LEU A 170 -0.670 -2.111 1.608 1.00 0.48 H new ATOM 0 HB3 LEU A 170 -1.158 -1.871 3.274 1.00 0.48 H new ATOM 0 HG LEU A 170 -3.506 -1.728 2.601 1.00 0.39 H new ATOM 0 HD11 LEU A 170 -4.176 -2.262 0.299 1.00 0.66 H new ATOM 0 HD12 LEU A 170 -3.218 -0.764 0.380 1.00 0.66 H new ATOM 0 HD13 LEU A 170 -2.465 -2.272 -0.191 1.00 0.66 H new ATOM 0 HD21 LEU A 170 -3.780 -4.077 1.884 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -2.054 -4.140 1.456 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -2.543 -3.917 3.152 1.00 0.69 H new ATOM 2620 N PHE A 171 -2.983 1.613 2.071 1.00 0.27 N ATOM 2621 CA PHE A 171 -4.123 2.371 2.587 1.00 0.27 C ATOM 2622 C PHE A 171 -5.356 2.182 1.694 1.00 0.27 C ATOM 2623 O PHE A 171 -5.293 2.423 0.489 1.00 0.34 O ATOM 2624 CB PHE A 171 -3.742 3.856 2.673 1.00 0.32 C ATOM 2625 CG PHE A 171 -4.908 4.796 2.809 1.00 0.29 C ATOM 2626 CD1 PHE A 171 -5.926 4.512 3.701 1.00 0.33 C ATOM 2627 CD2 PHE A 171 -4.989 5.954 2.053 1.00 0.38 C ATOM 2628 CE1 PHE A 171 -7.000 5.363 3.842 1.00 0.41 C ATOM 2629 CE2 PHE A 171 -6.061 6.809 2.192 1.00 0.48 C ATOM 2630 CZ PHE A 171 -7.046 6.545 3.031 1.00 0.47 C ATOM 0 H PHE A 171 -2.678 1.902 1.142 1.00 0.27 H new ATOM 0 HA PHE A 171 -4.376 2.002 3.581 1.00 0.27 H new ATOM 0 HB2 PHE A 171 -3.077 3.998 3.525 1.00 0.32 H new ATOM 0 HB3 PHE A 171 -3.178 4.125 1.780 1.00 0.32 H new ATOM 0 HD1 PHE A 171 -5.878 3.611 4.295 1.00 0.33 H new ATOM 0 HD2 PHE A 171 -4.205 6.189 1.348 1.00 0.38 H new ATOM 0 HE1 PHE A 171 -7.789 5.145 4.547 1.00 0.41 H new ATOM 0 HE2 PHE A 171 -6.096 7.713 1.603 1.00 0.48 H new ATOM 0 HZ PHE A 171 -7.886 7.219 3.106 1.00 0.47 H new ATOM 2640 N ILE A 172 -6.475 1.741 2.279 1.00 0.23 N ATOM 2641 CA ILE A 172 -7.726 1.675 1.534 1.00 0.23 C ATOM 2642 C ILE A 172 -8.766 2.652 2.100 1.00 0.23 C ATOM 2643 O ILE A 172 -9.120 2.628 3.298 1.00 0.24 O ATOM 2644 CB ILE A 172 -8.340 0.259 1.456 1.00 0.23 C ATOM 2645 CG1 ILE A 172 -9.600 0.305 0.581 1.00 0.26 C ATOM 2646 CG2 ILE A 172 -8.654 -0.297 2.831 1.00 0.21 C ATOM 2647 CD1 ILE A 172 -10.389 -0.984 0.561 1.00 0.30 C ATOM 0 H ILE A 172 -6.536 1.431 3.249 1.00 0.23 H new ATOM 0 HA ILE A 172 -7.460 1.963 0.517 1.00 0.23 H new ATOM 0 HB ILE A 172 -7.609 -0.413 1.007 1.00 0.23 H new ATOM 0 HG12 ILE A 172 -10.246 1.108 0.936 1.00 0.26 H new ATOM 0 HG13 ILE A 172 -9.311 0.557 -0.439 1.00 0.26 H new ATOM 0 HG21 ILE A 172 -9.084 -1.294 2.731 1.00 0.21 H new ATOM 0 HG22 ILE A 172 -7.738 -0.354 3.418 1.00 0.21 H new ATOM 0 HG23 ILE A 172 -9.367 0.357 3.334 1.00 0.21 H new ATOM 0 HD11 ILE A 172 -11.263 -0.866 -0.080 1.00 0.30 H new ATOM 0 HD12 ILE A 172 -9.762 -1.788 0.176 1.00 0.30 H new ATOM 0 HD13 ILE A 172 -10.712 -1.229 1.573 1.00 0.30 H new ATOM 2659 N MET A 173 -9.248 3.516 1.228 1.00 0.24 N ATOM 2660 CA MET A 173 -10.230 4.517 1.602 1.00 0.25 C ATOM 2661 C MET A 173 -11.539 4.265 0.862 1.00 0.27 C ATOM 2662 O MET A 173 -11.557 3.576 -0.159 1.00 0.31 O ATOM 2663 CB MET A 173 -9.676 5.908 1.309 1.00 0.28 C ATOM 2664 CG MET A 173 -9.389 6.169 -0.156 1.00 0.33 C ATOM 2665 SD MET A 173 -10.843 6.750 -1.026 1.00 0.99 S ATOM 2666 CE MET A 173 -11.281 8.103 0.056 1.00 0.50 C ATOM 0 H MET A 173 -8.973 3.545 0.246 1.00 0.24 H new ATOM 0 HA MET A 173 -10.437 4.452 2.670 1.00 0.25 H new ATOM 0 HB2 MET A 173 -10.388 6.652 1.666 1.00 0.28 H new ATOM 0 HB3 MET A 173 -8.757 6.047 1.878 1.00 0.28 H new ATOM 0 HG2 MET A 173 -8.593 6.908 -0.244 1.00 0.33 H new ATOM 0 HG3 MET A 173 -9.027 5.254 -0.624 1.00 0.33 H new ATOM 0 HE1 MET A 173 -12.337 8.033 0.317 1.00 0.50 H new ATOM 0 HE2 MET A 173 -10.679 8.053 0.963 1.00 0.50 H new ATOM 0 HE3 MET A 173 -11.095 9.050 -0.451 1.00 0.50 H new ATOM 2676 N LYS A 174 -12.635 4.810 1.376 1.00 0.30 N ATOM 2677 CA LYS A 174 -13.944 4.473 0.894 1.00 0.34 C ATOM 2678 C LYS A 174 -14.595 5.563 0.039 1.00 0.30 C ATOM 2679 O LYS A 174 -14.597 6.747 0.378 1.00 0.33 O ATOM 2680 CB LYS A 174 -14.834 4.183 2.094 1.00 0.50 C ATOM 2681 CG LYS A 174 -16.294 4.139 1.743 1.00 0.69 C ATOM 2682 CD LYS A 174 -17.174 4.185 2.966 1.00 0.77 C ATOM 2683 CE LYS A 174 -18.584 4.434 2.519 1.00 0.74 C ATOM 2684 NZ LYS A 174 -19.596 4.064 3.541 1.00 1.22 N ATOM 0 H LYS A 174 -12.629 5.493 2.134 1.00 0.30 H new ATOM 0 HA LYS A 174 -13.832 3.605 0.245 1.00 0.34 H new ATOM 0 HB2 LYS A 174 -14.543 3.229 2.534 1.00 0.50 H new ATOM 0 HB3 LYS A 174 -14.671 4.947 2.854 1.00 0.50 H new ATOM 0 HG2 LYS A 174 -16.535 4.979 1.092 1.00 0.69 H new ATOM 0 HG3 LYS A 174 -16.504 3.229 1.180 1.00 0.69 H new ATOM 0 HD2 LYS A 174 -17.110 3.246 3.516 1.00 0.77 H new ATOM 0 HD3 LYS A 174 -16.844 4.974 3.642 1.00 0.77 H new ATOM 0 HE2 LYS A 174 -18.698 5.489 2.269 1.00 0.74 H new ATOM 0 HE3 LYS A 174 -18.774 3.868 1.607 1.00 0.74 H new ATOM 0 HZ1 LYS A 174 -20.152 3.253 3.202 1.00 1.22 H new ATOM 0 HZ2 LYS A 174 -19.116 3.808 4.428 1.00 1.22 H new ATOM 0 HZ3 LYS A 174 -20.230 4.871 3.710 1.00 1.22 H new ATOM 2698 N GLY A 175 -15.133 5.114 -1.077 1.00 0.28 N ATOM 2699 CA GLY A 175 -16.185 5.820 -1.783 1.00 0.28 C ATOM 2700 C GLY A 175 -15.778 6.521 -3.067 1.00 0.28 C ATOM 2701 O GLY A 175 -16.597 6.568 -3.988 1.00 0.31 O ATOM 0 H GLY A 175 -14.851 4.242 -1.524 1.00 0.28 H new ATOM 0 HA2 GLY A 175 -16.977 5.109 -2.017 1.00 0.28 H new ATOM 0 HA3 GLY A 175 -16.612 6.562 -1.108 1.00 0.28 H new ATOM 2705 N THR A 176 -14.523 6.966 -3.194 1.00 0.27 N ATOM 2706 CA THR A 176 -14.090 7.669 -4.411 1.00 0.32 C ATOM 2707 C THR A 176 -12.604 8.015 -4.415 1.00 0.38 C ATOM 2708 O THR A 176 -11.969 8.135 -3.373 1.00 0.44 O ATOM 2709 CB THR A 176 -14.827 8.996 -4.600 1.00 0.43 C ATOM 2710 OG1 THR A 176 -15.538 9.359 -3.411 1.00 0.57 O ATOM 2711 CG2 THR A 176 -15.778 8.952 -5.787 1.00 0.68 C ATOM 0 H THR A 176 -13.799 6.856 -2.484 1.00 0.27 H new ATOM 0 HA THR A 176 -14.316 6.965 -5.212 1.00 0.32 H new ATOM 0 HB THR A 176 -14.072 9.755 -4.805 1.00 0.43 H new ATOM 0 HG1 THR A 176 -16.001 10.211 -3.554 1.00 0.57 H new ATOM 0 HG21 THR A 176 -16.281 9.914 -5.886 1.00 0.68 H new ATOM 0 HG22 THR A 176 -15.215 8.742 -6.696 1.00 0.68 H new ATOM 0 HG23 THR A 176 -16.520 8.169 -5.630 1.00 0.68 H new ATOM 2719 N ALA A 177 -12.072 8.222 -5.621 1.00 0.50 N ATOM 2720 CA ALA A 177 -10.694 8.669 -5.804 1.00 0.65 C ATOM 2721 C ALA A 177 -10.581 10.186 -5.682 1.00 0.68 C ATOM 2722 O ALA A 177 -9.483 10.734 -5.647 1.00 0.86 O ATOM 2723 CB ALA A 177 -10.165 8.211 -7.156 1.00 0.82 C ATOM 0 H ALA A 177 -12.583 8.085 -6.493 1.00 0.50 H new ATOM 0 HA ALA A 177 -10.090 8.221 -5.014 1.00 0.65 H new ATOM 0 HB1 ALA A 177 -9.137 8.551 -7.279 1.00 0.82 H new ATOM 0 HB2 ALA A 177 -10.196 7.123 -7.209 1.00 0.82 H new ATOM 0 HB3 ALA A 177 -10.783 8.631 -7.950 1.00 0.82 H new ATOM 2729 N ASP A 178 -11.721 10.859 -5.635 1.00 0.61 N ATOM 2730 CA ASP A 178 -11.752 12.316 -5.558 1.00 0.68 C ATOM 2731 C ASP A 178 -11.550 12.798 -4.123 1.00 0.67 C ATOM 2732 O ASP A 178 -11.174 13.948 -3.883 1.00 0.79 O ATOM 2733 CB ASP A 178 -13.085 12.842 -6.104 1.00 0.82 C ATOM 2734 CG ASP A 178 -13.191 14.354 -6.035 1.00 1.38 C ATOM 2735 OD1 ASP A 178 -12.559 15.038 -6.865 1.00 1.60 O ATOM 2736 OD2 ASP A 178 -13.911 14.865 -5.150 1.00 2.16 O ATOM 0 H ASP A 178 -12.641 10.419 -5.649 1.00 0.61 H new ATOM 0 HA ASP A 178 -10.934 12.704 -6.165 1.00 0.68 H new ATOM 0 HB2 ASP A 178 -13.201 12.521 -7.139 1.00 0.82 H new ATOM 0 HB3 ASP A 178 -13.905 12.398 -5.539 1.00 0.82 H new