USER MOD reduce.3.24.130724 H: found=0, std=0, add=1153, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1154 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 64 HIS : no HD1:sc= -1.15 K(o=-1.3,f=-4.7) USER MOD Set 1.2: B 164 HIS : no HE2:sc= -0.101 K(o=-1.3,f=-5.4) USER MOD Set 2.1: B 146 LYS NZ :NH3+ -115:sc= 1.17 (180deg=-0.0539) USER MOD Set 2.2: B 150 GLN : amide:sc= 0.553 K(o=1.7,f=-4.7) USER MOD Set 3.1: A 46 LYS NZ :NH3+ -127:sc= 1.19 (180deg=-0.00686) USER MOD Set 3.2: A 50 GLN : amide:sc= 0.31 K(o=1.5,f=-6!) USER MOD Single : A 1 MET CE :methyl 165:sc= -0.0359 (180deg=-0.329) USER MOD Single : A 1 MET N :NH3+ 133:sc= 0.0162 (180deg=-0.00718) USER MOD Single : A 4 LYS NZ :NH3+ 169:sc= 0.743 (180deg=0.66) USER MOD Single : A 5 GLN : amide:sc= -0.397 K(o=-0.4,f=-2.6) USER MOD Single : A 8 HIS : no HD1:sc= -0.279 K(o=-0.28,f=-1.4) USER MOD Single : A 16 LYS NZ :NH3+ -137:sc= 0.0989 (180deg=-0.609) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -113:sc= 0.671 (180deg=-0.239) USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HE2:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 43 LYS NZ :NH3+ -117:sc= 0.0482 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ -157:sc= 0.848 (180deg=0.0474) USER MOD Single : A 52 THR OG1 : rot -77:sc= 0.865 USER MOD Single : A 55 ASN : amide:sc= -0.641 K(o=-0.64,f=-0.14) USER MOD Single : A 57 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 60 TYR OH : rot -32:sc= 0.093 USER MOD Single : A 66 HIS : no HD1:sc= 0 X(o=0,f=-0.045) USER MOD Single : A 67 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0234) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : B 101 MET CE :methyl 157:sc= -0.189 (180deg=-0.822) USER MOD Single : B 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 105 GLN : amide:sc= -3.13 K(o=-3.1,f=-4.2!) USER MOD Single : B 108 HIS : no HD1:sc= -0.788 K(o=-0.79,f=-2.4) USER MOD Single : B 116 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.024) USER MOD Single : B 127 SER OG : rot 180:sc= 0 USER MOD Single : B 128 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0139) USER MOD Single : B 135 TYR OH : rot 180:sc= 0 USER MOD Single : B 137 SER OG : rot 180:sc= 0 USER MOD Single : B 138 TYR OH : rot 180:sc= 0 USER MOD Single : B 142 HIS : no HE2:sc= -0.294 K(o=-0.29,f=-3!) USER MOD Single : B 143 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0618) USER MOD Single : B 148 LYS NZ :NH3+ -168:sc= 0.0528 (180deg=-0.197) USER MOD Single : B 152 THR OG1 : rot -75:sc= 1.16 USER MOD Single : B 155 ASN : amide:sc= -3.08! C(o=-3.1!,f=-6.5!) USER MOD Single : B 157 HIS : no HE2:sc= 0.0031 X(o=0.0031,f=-0.081) USER MOD Single : B 160 TYR OH : rot -25:sc= 0.362 USER MOD Single : B 166 HIS : no HD1:sc= -0.553 K(o=-0.55,f=-2.5!) USER MOD Single : B 167 LYS NZ :NH3+ 144:sc= 1.03 (180deg=0.27) USER MOD Single : B 172 SER OG : rot -91:sc= 0.157 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.525 -23.383 -12.644 1.00 75.52 N ATOM 2 CA MET A 1 8.871 -22.085 -12.379 1.00 43.00 C ATOM 3 C MET A 1 9.813 -21.166 -11.581 1.00 31.20 C ATOM 4 O MET A 1 10.506 -21.639 -10.670 1.00 2.15 O ATOM 5 CB MET A 1 7.517 -22.290 -11.627 1.00 43.14 C ATOM 6 CG MET A 1 7.610 -22.990 -10.256 1.00 23.43 C ATOM 7 SD MET A 1 5.991 -23.285 -9.499 1.00 12.24 S ATOM 8 CE MET A 1 5.248 -24.474 -10.626 1.00 73.12 C ATOM 0 H1 MET A 1 8.867 -24.156 -12.418 1.00 75.52 H new ATOM 0 H2 MET A 1 9.793 -23.438 -13.647 1.00 75.52 H new ATOM 0 H3 MET A 1 10.376 -23.470 -12.053 1.00 75.52 H new ATOM 0 HA MET A 1 8.652 -21.605 -13.333 1.00 43.00 H new ATOM 0 HB2 MET A 1 7.051 -21.315 -11.485 1.00 43.14 H new ATOM 0 HB3 MET A 1 6.852 -22.871 -12.266 1.00 43.14 H new ATOM 0 HG2 MET A 1 8.128 -23.942 -10.375 1.00 23.43 H new ATOM 0 HG3 MET A 1 8.214 -22.380 -9.583 1.00 23.43 H new ATOM 0 HE1 MET A 1 4.383 -24.935 -10.150 1.00 73.12 H new ATOM 0 HE2 MET A 1 4.933 -23.964 -11.536 1.00 73.12 H new ATOM 0 HE3 MET A 1 5.978 -25.244 -10.876 1.00 73.12 H new ATOM 20 N PRO A 2 9.908 -19.846 -11.940 1.00 25.53 N ATOM 21 CA PRO A 2 10.632 -18.856 -11.123 1.00 70.22 C ATOM 22 C PRO A 2 9.757 -18.337 -9.950 1.00 32.05 C ATOM 23 O PRO A 2 8.666 -17.781 -10.169 1.00 52.23 O ATOM 24 CB PRO A 2 10.970 -17.747 -12.149 1.00 62.23 C ATOM 25 CG PRO A 2 9.853 -17.783 -13.154 1.00 24.32 C ATOM 26 CD PRO A 2 9.360 -19.222 -13.193 1.00 13.12 C ATOM 0 HA PRO A 2 11.519 -19.258 -10.633 1.00 70.22 H new ATOM 0 HB2 PRO A 2 11.034 -16.771 -11.667 1.00 62.23 H new ATOM 0 HB3 PRO A 2 11.933 -17.931 -12.625 1.00 62.23 H new ATOM 0 HG2 PRO A 2 9.050 -17.104 -12.867 1.00 24.32 H new ATOM 0 HG3 PRO A 2 10.203 -17.465 -14.136 1.00 24.32 H new ATOM 0 HD2 PRO A 2 8.271 -19.267 -13.215 1.00 13.12 H new ATOM 0 HD3 PRO A 2 9.718 -19.740 -14.083 1.00 13.12 H new ATOM 34 N ASP A 3 10.227 -18.559 -8.705 1.00 32.44 N ATOM 35 CA ASP A 3 9.581 -18.019 -7.495 1.00 3.53 C ATOM 36 C ASP A 3 9.774 -16.496 -7.454 1.00 61.43 C ATOM 37 O ASP A 3 10.798 -15.997 -6.972 1.00 13.10 O ATOM 38 CB ASP A 3 10.138 -18.679 -6.202 1.00 51.55 C ATOM 39 CG ASP A 3 9.481 -18.125 -4.912 1.00 51.45 C ATOM 40 OD1 ASP A 3 8.334 -18.517 -4.612 1.00 61.43 O ATOM 41 OD2 ASP A 3 10.105 -17.289 -4.208 1.00 64.11 O ATOM 0 H ASP A 3 11.060 -19.115 -8.513 1.00 32.44 H new ATOM 0 HA ASP A 3 8.517 -18.251 -7.538 1.00 3.53 H new ATOM 0 HB2 ASP A 3 9.978 -19.756 -6.252 1.00 51.55 H new ATOM 0 HB3 ASP A 3 11.215 -18.519 -6.153 1.00 51.55 H new ATOM 46 N LYS A 4 8.819 -15.766 -8.039 1.00 13.40 N ATOM 47 CA LYS A 4 8.816 -14.304 -8.025 1.00 22.21 C ATOM 48 C LYS A 4 7.883 -13.849 -6.889 1.00 3.42 C ATOM 49 O LYS A 4 6.679 -13.664 -7.087 1.00 12.33 O ATOM 50 CB LYS A 4 8.400 -13.725 -9.427 1.00 53.24 C ATOM 51 CG LYS A 4 9.367 -12.656 -9.998 1.00 75.54 C ATOM 52 CD LYS A 4 9.597 -11.466 -9.035 1.00 23.34 C ATOM 53 CE LYS A 4 10.507 -10.382 -9.633 1.00 72.42 C ATOM 54 NZ LYS A 4 11.881 -10.880 -9.887 1.00 73.54 N ATOM 0 H LYS A 4 8.027 -16.175 -8.535 1.00 13.40 H new ATOM 0 HA LYS A 4 9.817 -13.917 -7.837 1.00 22.21 H new ATOM 0 HB2 LYS A 4 8.329 -14.548 -10.138 1.00 53.24 H new ATOM 0 HB3 LYS A 4 7.405 -13.288 -9.344 1.00 53.24 H new ATOM 0 HG2 LYS A 4 10.325 -13.125 -10.222 1.00 75.54 H new ATOM 0 HG3 LYS A 4 8.968 -12.281 -10.940 1.00 75.54 H new ATOM 0 HD2 LYS A 4 8.635 -11.024 -8.776 1.00 23.34 H new ATOM 0 HD3 LYS A 4 10.039 -11.834 -8.109 1.00 23.34 H new ATOM 0 HE2 LYS A 4 10.075 -10.022 -10.567 1.00 72.42 H new ATOM 0 HE3 LYS A 4 10.551 -9.531 -8.953 1.00 72.42 H new ATOM 0 HZ1 LYS A 4 12.403 -10.183 -10.456 1.00 73.54 H new ATOM 0 HZ2 LYS A 4 12.371 -11.024 -8.981 1.00 73.54 H new ATOM 0 HZ3 LYS A 4 11.834 -11.782 -10.402 1.00 73.54 H new ATOM 68 N GLN A 5 8.465 -13.741 -5.687 1.00 61.52 N ATOM 69 CA GLN A 5 7.756 -13.347 -4.452 1.00 24.32 C ATOM 70 C GLN A 5 7.286 -11.882 -4.505 1.00 12.05 C ATOM 71 O GLN A 5 6.354 -11.503 -3.798 1.00 60.43 O ATOM 72 CB GLN A 5 8.648 -13.599 -3.188 1.00 22.23 C ATOM 73 CG GLN A 5 10.164 -13.275 -3.317 1.00 22.53 C ATOM 74 CD GLN A 5 10.522 -11.949 -4.001 1.00 1.05 C ATOM 75 OE1 GLN A 5 10.794 -11.910 -5.203 1.00 2.01 O ATOM 76 NE2 GLN A 5 10.398 -10.851 -3.282 1.00 14.23 N ATOM 0 H GLN A 5 9.457 -13.927 -5.538 1.00 61.52 H new ATOM 0 HA GLN A 5 6.867 -13.973 -4.376 1.00 24.32 H new ATOM 0 HB2 GLN A 5 8.244 -13.009 -2.365 1.00 22.23 H new ATOM 0 HB3 GLN A 5 8.548 -14.647 -2.907 1.00 22.23 H new ATOM 0 HG2 GLN A 5 10.599 -13.272 -2.318 1.00 22.53 H new ATOM 0 HG3 GLN A 5 10.641 -14.084 -3.870 1.00 22.53 H new ATOM 0 HE21 GLN A 5 10.172 -10.914 -2.289 1.00 14.23 H new ATOM 0 HE22 GLN A 5 10.528 -9.938 -3.718 1.00 14.23 H new ATOM 85 N LEU A 6 7.982 -11.068 -5.333 1.00 64.22 N ATOM 86 CA LEU A 6 7.658 -9.662 -5.541 1.00 63.01 C ATOM 87 C LEU A 6 6.389 -9.593 -6.393 1.00 14.23 C ATOM 88 O LEU A 6 6.322 -10.181 -7.489 1.00 22.44 O ATOM 89 CB LEU A 6 8.828 -8.907 -6.220 1.00 51.21 C ATOM 90 CG LEU A 6 8.579 -7.389 -6.496 1.00 12.23 C ATOM 91 CD1 LEU A 6 8.463 -6.573 -5.187 1.00 71.32 C ATOM 92 CD2 LEU A 6 9.654 -6.818 -7.429 1.00 22.01 C ATOM 0 H LEU A 6 8.788 -11.384 -5.873 1.00 64.22 H new ATOM 0 HA LEU A 6 7.491 -9.175 -4.580 1.00 63.01 H new ATOM 0 HB2 LEU A 6 9.713 -9.004 -5.591 1.00 51.21 H new ATOM 0 HB3 LEU A 6 9.054 -9.398 -7.166 1.00 51.21 H new ATOM 0 HG LEU A 6 7.618 -7.302 -7.003 1.00 12.23 H new ATOM 0 HD11 LEU A 6 8.290 -5.524 -5.426 1.00 71.32 H new ATOM 0 HD12 LEU A 6 7.630 -6.952 -4.595 1.00 71.32 H new ATOM 0 HD13 LEU A 6 9.387 -6.668 -4.616 1.00 71.32 H new ATOM 0 HD21 LEU A 6 9.458 -5.760 -7.605 1.00 22.01 H new ATOM 0 HD22 LEU A 6 10.635 -6.933 -6.968 1.00 22.01 H new ATOM 0 HD23 LEU A 6 9.634 -7.354 -8.378 1.00 22.01 H new ATOM 104 N LEU A 7 5.402 -8.859 -5.889 1.00 52.24 N ATOM 105 CA LEU A 7 4.033 -8.946 -6.377 1.00 25.55 C ATOM 106 C LEU A 7 3.268 -7.644 -6.122 1.00 65.42 C ATOM 107 O LEU A 7 3.823 -6.650 -5.625 1.00 13.41 O ATOM 108 CB LEU A 7 3.338 -10.207 -5.741 1.00 33.50 C ATOM 109 CG LEU A 7 3.016 -10.251 -4.173 1.00 52.55 C ATOM 110 CD1 LEU A 7 3.959 -9.401 -3.281 1.00 73.33 C ATOM 111 CD2 LEU A 7 1.546 -9.915 -3.866 1.00 34.10 C ATOM 0 H LEU A 7 5.530 -8.188 -5.131 1.00 52.24 H new ATOM 0 HA LEU A 7 4.034 -9.076 -7.459 1.00 25.55 H new ATOM 0 HB2 LEU A 7 2.395 -10.355 -6.268 1.00 33.50 H new ATOM 0 HB3 LEU A 7 3.967 -11.069 -5.965 1.00 33.50 H new ATOM 0 HG LEU A 7 3.208 -11.290 -3.905 1.00 52.55 H new ATOM 0 HD11 LEU A 7 3.658 -9.498 -2.238 1.00 73.33 H new ATOM 0 HD12 LEU A 7 4.984 -9.753 -3.397 1.00 73.33 H new ATOM 0 HD13 LEU A 7 3.898 -8.355 -3.581 1.00 73.33 H new ATOM 0 HD21 LEU A 7 1.380 -9.959 -2.790 1.00 34.10 H new ATOM 0 HD22 LEU A 7 1.319 -8.912 -4.228 1.00 34.10 H new ATOM 0 HD23 LEU A 7 0.897 -10.636 -4.363 1.00 34.10 H new ATOM 123 N HIS A 8 1.996 -7.659 -6.513 1.00 1.13 N ATOM 124 CA HIS A 8 1.074 -6.549 -6.311 1.00 61.41 C ATOM 125 C HIS A 8 0.438 -6.654 -4.914 1.00 24.44 C ATOM 126 O HIS A 8 -0.467 -7.468 -4.718 1.00 64.13 O ATOM 127 CB HIS A 8 -0.008 -6.569 -7.420 1.00 44.25 C ATOM 128 CG HIS A 8 0.516 -6.314 -8.813 1.00 33.25 C ATOM 129 ND1 HIS A 8 -0.295 -6.277 -9.924 1.00 11.40 N ATOM 130 CD2 HIS A 8 1.770 -6.052 -9.268 1.00 53.11 C ATOM 131 CE1 HIS A 8 0.428 -6.013 -10.989 1.00 23.44 C ATOM 132 NE2 HIS A 8 1.682 -5.873 -10.620 1.00 54.04 N ATOM 0 H HIS A 8 1.572 -8.457 -6.987 1.00 1.13 H new ATOM 0 HA HIS A 8 1.612 -5.603 -6.371 1.00 61.41 H new ATOM 0 HB2 HIS A 8 -0.507 -7.538 -7.405 1.00 44.25 H new ATOM 0 HB3 HIS A 8 -0.763 -5.818 -7.187 1.00 44.25 H new ATOM 0 HD2 HIS A 8 2.669 -5.996 -8.672 1.00 53.11 H new ATOM 0 HE1 HIS A 8 0.055 -5.926 -11.999 1.00 23.44 H new ATOM 0 HE2 HIS A 8 2.463 -5.665 -11.242 1.00 54.04 H new ATOM 141 N ILE A 9 0.948 -5.861 -3.944 1.00 10.11 N ATOM 142 CA ILE A 9 0.444 -5.870 -2.549 1.00 13.34 C ATOM 143 C ILE A 9 -1.010 -5.355 -2.489 1.00 51.35 C ATOM 144 O ILE A 9 -1.485 -4.700 -3.417 1.00 32.12 O ATOM 145 CB ILE A 9 1.343 -5.014 -1.577 1.00 62.10 C ATOM 146 CG1 ILE A 9 1.261 -3.491 -1.933 1.00 73.21 C ATOM 147 CG2 ILE A 9 2.803 -5.525 -1.597 1.00 24.22 C ATOM 148 CD1 ILE A 9 2.085 -2.560 -1.051 1.00 53.24 C ATOM 0 H ILE A 9 1.712 -5.204 -4.102 1.00 10.11 H new ATOM 0 HA ILE A 9 0.481 -6.907 -2.214 1.00 13.34 H new ATOM 0 HB ILE A 9 0.963 -5.131 -0.562 1.00 62.10 H new ATOM 0 HG12 ILE A 9 1.582 -3.361 -2.966 1.00 73.21 H new ATOM 0 HG13 ILE A 9 0.217 -3.181 -1.882 1.00 73.21 H new ATOM 0 HG21 ILE A 9 3.409 -4.922 -0.920 1.00 24.22 H new ATOM 0 HG22 ILE A 9 2.828 -6.567 -1.277 1.00 24.22 H new ATOM 0 HG23 ILE A 9 3.202 -5.447 -2.608 1.00 24.22 H new ATOM 0 HD11 ILE A 9 1.954 -1.531 -1.386 1.00 53.24 H new ATOM 0 HD12 ILE A 9 1.753 -2.650 -0.017 1.00 53.24 H new ATOM 0 HD13 ILE A 9 3.138 -2.833 -1.118 1.00 53.24 H new ATOM 160 N VAL A 10 -1.685 -5.616 -1.370 1.00 53.13 N ATOM 161 CA VAL A 10 -3.136 -5.377 -1.225 1.00 31.45 C ATOM 162 C VAL A 10 -3.432 -4.309 -0.162 1.00 65.43 C ATOM 163 O VAL A 10 -2.839 -4.297 0.928 1.00 70.33 O ATOM 164 CB VAL A 10 -3.893 -6.724 -0.918 1.00 53.21 C ATOM 165 CG1 VAL A 10 -4.175 -7.488 -2.219 1.00 12.43 C ATOM 166 CG2 VAL A 10 -3.082 -7.613 0.064 1.00 21.12 C ATOM 0 H VAL A 10 -1.248 -6.000 -0.532 1.00 53.13 H new ATOM 0 HA VAL A 10 -3.507 -4.990 -2.174 1.00 31.45 H new ATOM 0 HB VAL A 10 -4.842 -6.475 -0.443 1.00 53.21 H new ATOM 0 HG11 VAL A 10 -4.698 -8.416 -1.990 1.00 12.43 H new ATOM 0 HG12 VAL A 10 -4.794 -6.875 -2.874 1.00 12.43 H new ATOM 0 HG13 VAL A 10 -3.233 -7.716 -2.718 1.00 12.43 H new ATOM 0 HG21 VAL A 10 -3.630 -8.535 0.257 1.00 21.12 H new ATOM 0 HG22 VAL A 10 -2.114 -7.851 -0.376 1.00 21.12 H new ATOM 0 HG23 VAL A 10 -2.933 -7.077 1.001 1.00 21.12 H new ATOM 176 N VAL A 11 -4.376 -3.421 -0.515 1.00 21.23 N ATOM 177 CA VAL A 11 -4.787 -2.272 0.306 1.00 63.22 C ATOM 178 C VAL A 11 -6.265 -1.943 0.032 1.00 14.41 C ATOM 179 O VAL A 11 -6.788 -2.228 -1.049 1.00 4.00 O ATOM 180 CB VAL A 11 -3.880 -1.012 0.005 1.00 63.12 C ATOM 181 CG1 VAL A 11 -3.952 -0.585 -1.482 1.00 11.43 C ATOM 182 CG2 VAL A 11 -4.203 0.174 0.953 1.00 35.24 C ATOM 0 H VAL A 11 -4.884 -3.484 -1.397 1.00 21.23 H new ATOM 0 HA VAL A 11 -4.665 -2.532 1.357 1.00 63.22 H new ATOM 0 HB VAL A 11 -2.851 -1.314 0.203 1.00 63.12 H new ATOM 0 HG11 VAL A 11 -3.314 0.284 -1.642 1.00 11.43 H new ATOM 0 HG12 VAL A 11 -3.612 -1.406 -2.113 1.00 11.43 H new ATOM 0 HG13 VAL A 11 -4.981 -0.332 -1.738 1.00 11.43 H new ATOM 0 HG21 VAL A 11 -3.558 1.019 0.712 1.00 35.24 H new ATOM 0 HG22 VAL A 11 -5.245 0.467 0.828 1.00 35.24 H new ATOM 0 HG23 VAL A 11 -4.033 -0.129 1.986 1.00 35.24 H new ATOM 192 N GLY A 12 -6.926 -1.368 1.032 1.00 63.25 N ATOM 193 CA GLY A 12 -8.289 -0.885 0.903 1.00 2.40 C ATOM 194 C GLY A 12 -8.687 -0.062 2.110 1.00 24.20 C ATOM 195 O GLY A 12 -7.919 0.793 2.561 1.00 4.24 O ATOM 0 H GLY A 12 -6.525 -1.225 1.959 1.00 63.25 H new ATOM 0 HA2 GLY A 12 -8.381 -0.282 -0.000 1.00 2.40 H new ATOM 0 HA3 GLY A 12 -8.969 -1.729 0.793 1.00 2.40 H new ATOM 199 N GLY A 13 -9.881 -0.336 2.649 1.00 10.42 N ATOM 200 CA GLY A 13 -10.446 0.416 3.772 1.00 23.14 C ATOM 201 C GLY A 13 -11.655 1.196 3.313 1.00 23.30 C ATOM 202 O GLY A 13 -12.079 1.047 2.154 1.00 15.34 O ATOM 0 H GLY A 13 -10.483 -1.089 2.316 1.00 10.42 H new ATOM 0 HA2 GLY A 13 -10.726 -0.267 4.574 1.00 23.14 H new ATOM 0 HA3 GLY A 13 -9.697 1.096 4.179 1.00 23.14 H new ATOM 206 N GLU A 14 -12.213 2.048 4.189 1.00 43.45 N ATOM 207 CA GLU A 14 -13.460 2.764 3.887 1.00 2.00 C ATOM 208 C GLU A 14 -13.183 4.031 3.097 1.00 75.34 C ATOM 209 O GLU A 14 -12.272 4.804 3.414 1.00 44.31 O ATOM 210 CB GLU A 14 -14.324 3.066 5.142 1.00 13.23 C ATOM 211 CG GLU A 14 -15.116 1.837 5.647 1.00 2.22 C ATOM 212 CD GLU A 14 -16.266 2.186 6.598 1.00 22.22 C ATOM 213 OE1 GLU A 14 -16.058 3.008 7.506 1.00 40.22 O ATOM 214 OE2 GLU A 14 -17.396 1.655 6.421 1.00 32.11 O ATOM 0 H GLU A 14 -11.821 2.256 5.107 1.00 43.45 H new ATOM 0 HA GLU A 14 -14.053 2.088 3.271 1.00 2.00 H new ATOM 0 HB2 GLU A 14 -13.677 3.427 5.942 1.00 13.23 H new ATOM 0 HB3 GLU A 14 -15.023 3.870 4.909 1.00 13.23 H new ATOM 0 HG2 GLU A 14 -15.518 1.299 4.789 1.00 2.22 H new ATOM 0 HG3 GLU A 14 -14.430 1.159 6.155 1.00 2.22 H new ATOM 221 N LEU A 15 -13.983 4.190 2.043 1.00 41.00 N ATOM 222 CA LEU A 15 -13.947 5.317 1.119 1.00 35.32 C ATOM 223 C LEU A 15 -15.107 6.274 1.444 1.00 62.31 C ATOM 224 O LEU A 15 -15.907 6.013 2.341 1.00 74.12 O ATOM 225 CB LEU A 15 -14.029 4.778 -0.341 1.00 62.53 C ATOM 226 CG LEU A 15 -12.978 3.677 -0.741 1.00 35.11 C ATOM 227 CD1 LEU A 15 -12.925 3.453 -2.258 1.00 41.31 C ATOM 228 CD2 LEU A 15 -11.577 3.981 -0.203 1.00 20.44 C ATOM 0 H LEU A 15 -14.702 3.508 1.802 1.00 41.00 H new ATOM 0 HA LEU A 15 -13.016 5.874 1.222 1.00 35.32 H new ATOM 0 HB2 LEU A 15 -15.028 4.370 -0.499 1.00 62.53 H new ATOM 0 HB3 LEU A 15 -13.917 5.621 -1.023 1.00 62.53 H new ATOM 0 HG LEU A 15 -13.323 2.756 -0.272 1.00 35.11 H new ATOM 0 HD11 LEU A 15 -12.186 2.685 -2.487 1.00 41.31 H new ATOM 0 HD12 LEU A 15 -13.904 3.132 -2.613 1.00 41.31 H new ATOM 0 HD13 LEU A 15 -12.647 4.383 -2.754 1.00 41.31 H new ATOM 0 HD21 LEU A 15 -10.891 3.191 -0.507 1.00 20.44 H new ATOM 0 HD22 LEU A 15 -11.233 4.935 -0.603 1.00 20.44 H new ATOM 0 HD23 LEU A 15 -11.609 4.035 0.885 1.00 20.44 H new ATOM 240 N LYS A 16 -15.148 7.420 0.777 1.00 43.40 N ATOM 241 CA LYS A 16 -16.302 8.340 0.850 1.00 73.25 C ATOM 242 C LYS A 16 -17.452 7.799 -0.003 1.00 23.14 C ATOM 243 O LYS A 16 -18.630 7.978 0.323 1.00 41.35 O ATOM 244 CB LYS A 16 -15.891 9.759 0.393 1.00 33.11 C ATOM 245 CG LYS A 16 -14.754 10.363 1.233 1.00 54.42 C ATOM 246 CD LYS A 16 -14.459 11.848 0.922 1.00 3.14 C ATOM 247 CE LYS A 16 -13.289 12.365 1.772 1.00 71.34 C ATOM 248 NZ LYS A 16 -13.538 12.196 3.228 1.00 10.05 N ATOM 0 H LYS A 16 -14.395 7.747 0.172 1.00 43.40 H new ATOM 0 HA LYS A 16 -16.641 8.407 1.884 1.00 73.25 H new ATOM 0 HB2 LYS A 16 -15.581 9.721 -0.651 1.00 33.11 H new ATOM 0 HB3 LYS A 16 -16.760 10.416 0.444 1.00 33.11 H new ATOM 0 HG2 LYS A 16 -15.007 10.267 2.289 1.00 54.42 H new ATOM 0 HG3 LYS A 16 -13.847 9.781 1.069 1.00 54.42 H new ATOM 0 HD2 LYS A 16 -14.223 11.962 -0.136 1.00 3.14 H new ATOM 0 HD3 LYS A 16 -15.348 12.448 1.117 1.00 3.14 H new ATOM 0 HE2 LYS A 16 -12.378 11.833 1.496 1.00 71.34 H new ATOM 0 HE3 LYS A 16 -13.121 13.420 1.553 1.00 71.34 H new ATOM 0 HZ1 LYS A 16 -13.241 13.055 3.733 1.00 10.05 H new ATOM 0 HZ2 LYS A 16 -14.552 12.032 3.390 1.00 10.05 H new ATOM 0 HZ3 LYS A 16 -12.995 11.382 3.581 1.00 10.05 H new ATOM 262 N ASP A 17 -17.080 7.124 -1.096 1.00 5.11 N ATOM 263 CA ASP A 17 -18.021 6.476 -2.013 1.00 42.54 C ATOM 264 C ASP A 17 -17.480 5.096 -2.376 1.00 12.24 C ATOM 265 O ASP A 17 -16.282 4.940 -2.587 1.00 45.54 O ATOM 266 CB ASP A 17 -18.230 7.318 -3.301 1.00 75.13 C ATOM 267 CG ASP A 17 -18.859 8.697 -3.022 1.00 73.41 C ATOM 268 OD1 ASP A 17 -20.101 8.790 -2.936 1.00 31.42 O ATOM 269 OD2 ASP A 17 -18.108 9.687 -2.874 1.00 11.02 O ATOM 0 H ASP A 17 -16.104 7.012 -1.371 1.00 5.11 H new ATOM 0 HA ASP A 17 -18.988 6.386 -1.518 1.00 42.54 H new ATOM 0 HB2 ASP A 17 -17.270 7.456 -3.798 1.00 75.13 H new ATOM 0 HB3 ASP A 17 -18.869 6.766 -3.990 1.00 75.13 H new ATOM 274 N VAL A 18 -18.368 4.102 -2.445 1.00 53.04 N ATOM 275 CA VAL A 18 -18.023 2.732 -2.900 1.00 11.02 C ATOM 276 C VAL A 18 -17.571 2.725 -4.386 1.00 53.53 C ATOM 277 O VAL A 18 -16.786 1.876 -4.819 1.00 24.14 O ATOM 278 CB VAL A 18 -19.248 1.771 -2.692 1.00 11.20 C ATOM 279 CG1 VAL A 18 -19.503 1.521 -1.182 1.00 22.12 C ATOM 280 CG2 VAL A 18 -20.522 2.324 -3.380 1.00 45.10 C ATOM 0 H VAL A 18 -19.349 4.213 -2.189 1.00 53.04 H new ATOM 0 HA VAL A 18 -17.186 2.376 -2.299 1.00 11.02 H new ATOM 0 HB VAL A 18 -19.004 0.818 -3.161 1.00 11.20 H new ATOM 0 HG11 VAL A 18 -20.356 0.853 -1.063 1.00 22.12 H new ATOM 0 HG12 VAL A 18 -18.620 1.065 -0.734 1.00 22.12 H new ATOM 0 HG13 VAL A 18 -19.713 2.469 -0.687 1.00 22.12 H new ATOM 0 HG21 VAL A 18 -21.351 1.636 -3.217 1.00 45.10 H new ATOM 0 HG22 VAL A 18 -20.770 3.298 -2.957 1.00 45.10 H new ATOM 0 HG23 VAL A 18 -20.342 2.428 -4.450 1.00 45.10 H new ATOM 290 N ALA A 19 -18.098 3.692 -5.139 1.00 11.44 N ATOM 291 CA ALA A 19 -17.753 3.925 -6.558 1.00 43.45 C ATOM 292 C ALA A 19 -16.684 5.031 -6.742 1.00 52.53 C ATOM 293 O ALA A 19 -16.413 5.430 -7.880 1.00 43.13 O ATOM 294 CB ALA A 19 -19.034 4.283 -7.324 1.00 44.42 C ATOM 0 H ALA A 19 -18.789 4.351 -4.781 1.00 11.44 H new ATOM 0 HA ALA A 19 -17.315 3.009 -6.954 1.00 43.45 H new ATOM 0 HB1 ALA A 19 -18.794 4.458 -8.373 1.00 44.42 H new ATOM 0 HB2 ALA A 19 -19.746 3.461 -7.247 1.00 44.42 H new ATOM 0 HB3 ALA A 19 -19.473 5.185 -6.897 1.00 44.42 H new ATOM 300 N GLY A 20 -16.077 5.504 -5.632 1.00 61.53 N ATOM 301 CA GLY A 20 -15.081 6.598 -5.668 1.00 20.23 C ATOM 302 C GLY A 20 -13.890 6.321 -4.756 1.00 51.24 C ATOM 303 O GLY A 20 -14.068 6.191 -3.548 1.00 40.45 O ATOM 0 H GLY A 20 -16.260 5.143 -4.696 1.00 61.53 H new ATOM 0 HA2 GLY A 20 -14.730 6.734 -6.691 1.00 20.23 H new ATOM 0 HA3 GLY A 20 -15.557 7.531 -5.368 1.00 20.23 H new ATOM 307 N VAL A 21 -12.658 6.327 -5.325 1.00 30.34 N ATOM 308 CA VAL A 21 -11.417 5.844 -4.645 1.00 11.01 C ATOM 309 C VAL A 21 -10.838 6.901 -3.637 1.00 53.11 C ATOM 310 O VAL A 21 -9.715 6.784 -3.131 1.00 35.24 O ATOM 311 CB VAL A 21 -10.355 5.396 -5.743 1.00 3.22 C ATOM 312 CG1 VAL A 21 -9.114 4.697 -5.146 1.00 72.32 C ATOM 313 CG2 VAL A 21 -11.017 4.501 -6.826 1.00 40.13 C ATOM 0 H VAL A 21 -12.491 6.667 -6.272 1.00 30.34 H new ATOM 0 HA VAL A 21 -11.667 4.976 -4.034 1.00 11.01 H new ATOM 0 HB VAL A 21 -9.999 6.315 -6.209 1.00 3.22 H new ATOM 0 HG11 VAL A 21 -8.432 4.418 -5.949 1.00 72.32 H new ATOM 0 HG12 VAL A 21 -8.608 5.377 -4.460 1.00 72.32 H new ATOM 0 HG13 VAL A 21 -9.425 3.802 -4.607 1.00 72.32 H new ATOM 0 HG21 VAL A 21 -10.269 4.209 -7.564 1.00 40.13 H new ATOM 0 HG22 VAL A 21 -11.432 3.609 -6.357 1.00 40.13 H new ATOM 0 HG23 VAL A 21 -11.815 5.056 -7.319 1.00 40.13 H new ATOM 323 N GLU A 22 -11.667 7.889 -3.276 1.00 54.23 N ATOM 324 CA GLU A 22 -11.323 8.917 -2.285 1.00 4.22 C ATOM 325 C GLU A 22 -11.539 8.310 -0.899 1.00 52.53 C ATOM 326 O GLU A 22 -12.670 7.982 -0.557 1.00 63.04 O ATOM 327 CB GLU A 22 -12.202 10.192 -2.445 1.00 44.31 C ATOM 328 CG GLU A 22 -12.060 10.935 -3.790 1.00 51.14 C ATOM 329 CD GLU A 22 -12.645 10.156 -4.982 1.00 71.14 C ATOM 330 OE1 GLU A 22 -13.873 9.946 -5.013 1.00 3.32 O ATOM 331 OE2 GLU A 22 -11.888 9.747 -5.885 1.00 10.23 O ATOM 0 H GLU A 22 -12.603 7.998 -3.667 1.00 54.23 H new ATOM 0 HA GLU A 22 -10.287 9.224 -2.428 1.00 4.22 H new ATOM 0 HB2 GLU A 22 -13.247 9.910 -2.315 1.00 44.31 H new ATOM 0 HB3 GLU A 22 -11.956 10.885 -1.640 1.00 44.31 H new ATOM 0 HG2 GLU A 22 -12.558 11.902 -3.717 1.00 51.14 H new ATOM 0 HG3 GLU A 22 -11.005 11.134 -3.978 1.00 51.14 H new ATOM 338 N PHE A 23 -10.458 8.127 -0.142 1.00 40.54 N ATOM 339 CA PHE A 23 -10.503 7.510 1.192 1.00 40.15 C ATOM 340 C PHE A 23 -11.310 8.383 2.179 1.00 3.45 C ATOM 341 O PHE A 23 -11.087 9.585 2.257 1.00 42.10 O ATOM 342 CB PHE A 23 -9.059 7.283 1.701 1.00 72.21 C ATOM 343 CG PHE A 23 -8.170 6.506 0.714 1.00 45.20 C ATOM 344 CD1 PHE A 23 -8.505 5.211 0.313 1.00 30.30 C ATOM 345 CD2 PHE A 23 -6.999 7.061 0.202 1.00 61.04 C ATOM 346 CE1 PHE A 23 -7.703 4.499 -0.561 1.00 12.44 C ATOM 347 CE2 PHE A 23 -6.201 6.351 -0.672 1.00 55.10 C ATOM 348 CZ PHE A 23 -6.551 5.070 -1.053 1.00 64.42 C ATOM 0 H PHE A 23 -9.520 8.402 -0.434 1.00 40.54 H new ATOM 0 HA PHE A 23 -11.010 6.548 1.123 1.00 40.15 H new ATOM 0 HB2 PHE A 23 -8.599 8.250 1.906 1.00 72.21 H new ATOM 0 HB3 PHE A 23 -9.097 6.741 2.646 1.00 72.21 H new ATOM 0 HD1 PHE A 23 -9.408 4.756 0.693 1.00 30.30 H new ATOM 0 HD2 PHE A 23 -6.712 8.061 0.493 1.00 61.04 H new ATOM 0 HE1 PHE A 23 -7.980 3.498 -0.857 1.00 12.44 H new ATOM 0 HE2 PHE A 23 -5.298 6.799 -1.060 1.00 55.10 H new ATOM 0 HZ PHE A 23 -5.922 4.518 -1.735 1.00 64.42 H new ATOM 358 N ARG A 24 -12.254 7.765 2.905 1.00 73.01 N ATOM 359 CA ARG A 24 -13.071 8.446 3.943 1.00 3.34 C ATOM 360 C ARG A 24 -12.164 9.114 4.977 1.00 65.34 C ATOM 361 O ARG A 24 -12.348 10.286 5.337 1.00 32.14 O ATOM 362 CB ARG A 24 -14.009 7.422 4.629 1.00 52.45 C ATOM 363 CG ARG A 24 -14.825 7.961 5.820 1.00 51.51 C ATOM 364 CD ARG A 24 -15.790 6.920 6.401 1.00 44.02 C ATOM 365 NE ARG A 24 -16.460 7.453 7.604 1.00 14.31 N ATOM 366 CZ ARG A 24 -16.704 6.774 8.733 1.00 45.44 C ATOM 367 NH1 ARG A 24 -16.363 5.497 8.851 1.00 14.21 N ATOM 368 NH2 ARG A 24 -17.278 7.386 9.755 1.00 11.32 N ATOM 0 H ARG A 24 -12.479 6.776 2.795 1.00 73.01 H new ATOM 0 HA ARG A 24 -13.678 9.217 3.468 1.00 3.34 H new ATOM 0 HB2 ARG A 24 -14.702 7.034 3.883 1.00 52.45 H new ATOM 0 HB3 ARG A 24 -13.408 6.580 4.974 1.00 52.45 H new ATOM 0 HG2 ARG A 24 -14.142 8.292 6.602 1.00 51.51 H new ATOM 0 HG3 ARG A 24 -15.391 8.836 5.500 1.00 51.51 H new ATOM 0 HD2 ARG A 24 -16.535 6.648 5.653 1.00 44.02 H new ATOM 0 HD3 ARG A 24 -15.245 6.011 6.654 1.00 44.02 H new ATOM 0 HE ARG A 24 -16.765 8.426 7.573 1.00 14.31 H new ATOM 0 HH11 ARG A 24 -15.907 5.017 8.075 1.00 14.21 H new ATOM 0 HH12 ARG A 24 -16.556 4.996 9.718 1.00 14.21 H new ATOM 0 HH21 ARG A 24 -17.533 8.371 9.682 1.00 11.32 H new ATOM 0 HH22 ARG A 24 -17.466 6.873 10.616 1.00 11.32 H new ATOM 382 N ASP A 25 -11.152 8.346 5.378 1.00 22.30 N ATOM 383 CA ASP A 25 -10.145 8.746 6.350 1.00 44.54 C ATOM 384 C ASP A 25 -8.927 7.828 6.176 1.00 23.44 C ATOM 385 O ASP A 25 -9.076 6.619 5.981 1.00 62.22 O ATOM 386 CB ASP A 25 -10.721 8.671 7.798 1.00 64.32 C ATOM 387 CG ASP A 25 -9.738 9.018 8.934 1.00 51.35 C ATOM 388 OD1 ASP A 25 -8.736 9.731 8.709 1.00 13.23 O ATOM 389 OD2 ASP A 25 -9.972 8.559 10.071 1.00 25.43 O ATOM 0 H ASP A 25 -11.009 7.401 5.023 1.00 22.30 H new ATOM 0 HA ASP A 25 -9.844 9.781 6.185 1.00 44.54 H new ATOM 0 HB2 ASP A 25 -11.574 9.346 7.864 1.00 64.32 H new ATOM 0 HB3 ASP A 25 -11.098 7.662 7.966 1.00 64.32 H new ATOM 394 N LEU A 26 -7.740 8.431 6.230 1.00 45.32 N ATOM 395 CA LEU A 26 -6.448 7.755 6.047 1.00 35.33 C ATOM 396 C LEU A 26 -6.016 6.981 7.309 1.00 60.13 C ATOM 397 O LEU A 26 -4.988 6.298 7.304 1.00 73.12 O ATOM 398 CB LEU A 26 -5.384 8.804 5.636 1.00 74.50 C ATOM 399 CG LEU A 26 -5.570 9.457 4.220 1.00 20.04 C ATOM 400 CD1 LEU A 26 -5.529 8.403 3.099 1.00 1.14 C ATOM 401 CD2 LEU A 26 -6.828 10.356 4.113 1.00 3.33 C ATOM 0 H LEU A 26 -7.644 9.431 6.407 1.00 45.32 H new ATOM 0 HA LEU A 26 -6.550 7.013 5.255 1.00 35.33 H new ATOM 0 HB2 LEU A 26 -5.379 9.598 6.382 1.00 74.50 H new ATOM 0 HB3 LEU A 26 -4.403 8.329 5.669 1.00 74.50 H new ATOM 0 HG LEU A 26 -4.717 10.123 4.086 1.00 20.04 H new ATOM 0 HD11 LEU A 26 -5.661 8.893 2.134 1.00 1.14 H new ATOM 0 HD12 LEU A 26 -4.567 7.890 3.117 1.00 1.14 H new ATOM 0 HD13 LEU A 26 -6.329 7.679 3.251 1.00 1.14 H new ATOM 0 HD21 LEU A 26 -6.893 10.773 3.108 1.00 3.33 H new ATOM 0 HD22 LEU A 26 -7.719 9.761 4.317 1.00 3.33 H new ATOM 0 HD23 LEU A 26 -6.759 11.166 4.839 1.00 3.33 H new ATOM 413 N SER A 27 -6.799 7.126 8.387 1.00 74.14 N ATOM 414 CA SER A 27 -6.679 6.298 9.600 1.00 62.25 C ATOM 415 C SER A 27 -7.636 5.080 9.523 1.00 42.53 C ATOM 416 O SER A 27 -7.507 4.134 10.303 1.00 75.13 O ATOM 417 CB SER A 27 -6.991 7.165 10.844 1.00 13.11 C ATOM 418 OG SER A 27 -6.234 8.372 10.840 1.00 41.33 O ATOM 0 H SER A 27 -7.539 7.825 8.444 1.00 74.14 H new ATOM 0 HA SER A 27 -5.661 5.917 9.678 1.00 62.25 H new ATOM 0 HB2 SER A 27 -8.055 7.401 10.867 1.00 13.11 H new ATOM 0 HB3 SER A 27 -6.770 6.598 11.749 1.00 13.11 H new ATOM 0 HG SER A 27 -6.454 8.899 11.637 1.00 41.33 H new ATOM 424 N LYS A 28 -8.591 5.121 8.567 1.00 41.53 N ATOM 425 CA LYS A 28 -9.596 4.051 8.342 1.00 70.32 C ATOM 426 C LYS A 28 -9.270 3.231 7.082 1.00 72.42 C ATOM 427 O LYS A 28 -10.093 2.414 6.633 1.00 45.01 O ATOM 428 CB LYS A 28 -11.009 4.680 8.235 1.00 1.12 C ATOM 429 CG LYS A 28 -11.494 5.336 9.544 1.00 75.44 C ATOM 430 CD LYS A 28 -12.900 5.947 9.414 1.00 74.44 C ATOM 431 CE LYS A 28 -13.374 6.615 10.714 1.00 21.25 C ATOM 432 NZ LYS A 28 -12.465 7.712 11.145 1.00 12.24 N ATOM 0 H LYS A 28 -8.689 5.905 7.922 1.00 41.53 H new ATOM 0 HA LYS A 28 -9.570 3.368 9.191 1.00 70.32 H new ATOM 0 HB2 LYS A 28 -11.005 5.429 7.443 1.00 1.12 H new ATOM 0 HB3 LYS A 28 -11.720 3.908 7.940 1.00 1.12 H new ATOM 0 HG2 LYS A 28 -11.498 4.591 10.340 1.00 75.44 H new ATOM 0 HG3 LYS A 28 -10.790 6.114 9.839 1.00 75.44 H new ATOM 0 HD2 LYS A 28 -12.900 6.683 8.610 1.00 74.44 H new ATOM 0 HD3 LYS A 28 -13.607 5.167 9.132 1.00 74.44 H new ATOM 0 HE2 LYS A 28 -14.379 7.013 10.571 1.00 21.25 H new ATOM 0 HE3 LYS A 28 -13.437 5.866 11.503 1.00 21.25 H new ATOM 0 HZ1 LYS A 28 -11.991 7.442 12.030 1.00 12.24 H new ATOM 0 HZ2 LYS A 28 -11.751 7.881 10.408 1.00 12.24 H new ATOM 0 HZ3 LYS A 28 -13.017 8.580 11.298 1.00 12.24 H new ATOM 446 N VAL A 29 -8.075 3.454 6.503 1.00 33.53 N ATOM 447 CA VAL A 29 -7.575 2.643 5.381 1.00 72.22 C ATOM 448 C VAL A 29 -6.907 1.387 5.948 1.00 72.01 C ATOM 449 O VAL A 29 -6.087 1.466 6.877 1.00 2.42 O ATOM 450 CB VAL A 29 -6.601 3.440 4.426 1.00 72.42 C ATOM 451 CG1 VAL A 29 -7.335 4.647 3.812 1.00 32.11 C ATOM 452 CG2 VAL A 29 -5.299 3.887 5.132 1.00 75.05 C ATOM 0 H VAL A 29 -7.437 4.193 6.797 1.00 33.53 H new ATOM 0 HA VAL A 29 -8.422 2.364 4.754 1.00 72.22 H new ATOM 0 HB VAL A 29 -6.299 2.758 3.631 1.00 72.42 H new ATOM 0 HG11 VAL A 29 -6.656 5.190 3.155 1.00 32.11 H new ATOM 0 HG12 VAL A 29 -8.193 4.297 3.238 1.00 32.11 H new ATOM 0 HG13 VAL A 29 -7.677 5.309 4.608 1.00 32.11 H new ATOM 0 HG21 VAL A 29 -4.670 4.429 4.426 1.00 75.05 H new ATOM 0 HG22 VAL A 29 -5.545 4.536 5.972 1.00 75.05 H new ATOM 0 HG23 VAL A 29 -4.763 3.010 5.496 1.00 75.05 H new ATOM 462 N GLU A 30 -7.324 0.223 5.450 1.00 0.01 N ATOM 463 CA GLU A 30 -6.797 -1.060 5.893 1.00 11.10 C ATOM 464 C GLU A 30 -5.836 -1.610 4.843 1.00 32.35 C ATOM 465 O GLU A 30 -6.254 -1.981 3.741 1.00 55.00 O ATOM 466 CB GLU A 30 -7.920 -2.091 6.131 1.00 41.24 C ATOM 467 CG GLU A 30 -7.382 -3.445 6.669 1.00 41.55 C ATOM 468 CD GLU A 30 -8.367 -4.614 6.536 1.00 10.10 C ATOM 469 OE1 GLU A 30 -9.473 -4.561 7.124 1.00 13.25 O ATOM 470 OE2 GLU A 30 -8.038 -5.586 5.822 1.00 33.41 O ATOM 0 H GLU A 30 -8.039 0.147 4.726 1.00 0.01 H new ATOM 0 HA GLU A 30 -6.279 -0.894 6.837 1.00 11.10 H new ATOM 0 HB2 GLU A 30 -8.639 -1.682 6.841 1.00 41.24 H new ATOM 0 HB3 GLU A 30 -8.455 -2.262 5.197 1.00 41.24 H new ATOM 0 HG2 GLU A 30 -6.465 -3.696 6.136 1.00 41.55 H new ATOM 0 HG3 GLU A 30 -7.118 -3.326 7.720 1.00 41.55 H new ATOM 477 N PHE A 31 -4.556 -1.654 5.192 1.00 4.44 N ATOM 478 CA PHE A 31 -3.549 -2.355 4.402 1.00 61.45 C ATOM 479 C PHE A 31 -3.719 -3.853 4.664 1.00 43.33 C ATOM 480 O PHE A 31 -3.304 -4.355 5.722 1.00 51.40 O ATOM 481 CB PHE A 31 -2.133 -1.861 4.766 1.00 34.23 C ATOM 482 CG PHE A 31 -1.938 -0.369 4.489 1.00 24.22 C ATOM 483 CD1 PHE A 31 -2.318 0.597 5.426 1.00 72.34 C ATOM 484 CD2 PHE A 31 -1.412 0.067 3.275 1.00 24.32 C ATOM 485 CE1 PHE A 31 -2.170 1.940 5.152 1.00 74.21 C ATOM 486 CE2 PHE A 31 -1.270 1.411 3.004 1.00 51.44 C ATOM 487 CZ PHE A 31 -1.651 2.345 3.940 1.00 0.40 C ATOM 0 H PHE A 31 -4.186 -1.205 6.030 1.00 4.44 H new ATOM 0 HA PHE A 31 -3.680 -2.155 3.339 1.00 61.45 H new ATOM 0 HB2 PHE A 31 -1.944 -2.058 5.821 1.00 34.23 H new ATOM 0 HB3 PHE A 31 -1.397 -2.431 4.199 1.00 34.23 H new ATOM 0 HD1 PHE A 31 -2.732 0.288 6.374 1.00 72.34 H new ATOM 0 HD2 PHE A 31 -1.111 -0.659 2.535 1.00 24.32 H new ATOM 0 HE1 PHE A 31 -2.461 2.676 5.887 1.00 74.21 H new ATOM 0 HE2 PHE A 31 -0.860 1.731 2.057 1.00 51.44 H new ATOM 0 HZ PHE A 31 -1.543 3.398 3.725 1.00 0.40 H new ATOM 497 N VAL A 32 -4.407 -4.523 3.723 1.00 61.14 N ATOM 498 CA VAL A 32 -4.754 -5.955 3.815 1.00 74.15 C ATOM 499 C VAL A 32 -3.481 -6.811 4.008 1.00 71.23 C ATOM 500 O VAL A 32 -3.501 -7.840 4.699 1.00 21.41 O ATOM 501 CB VAL A 32 -5.549 -6.425 2.539 1.00 53.30 C ATOM 502 CG1 VAL A 32 -5.928 -7.929 2.598 1.00 21.45 C ATOM 503 CG2 VAL A 32 -6.799 -5.547 2.307 1.00 41.20 C ATOM 0 H VAL A 32 -4.742 -4.082 2.867 1.00 61.14 H new ATOM 0 HA VAL A 32 -5.398 -6.092 4.684 1.00 74.15 H new ATOM 0 HB VAL A 32 -4.880 -6.300 1.688 1.00 53.30 H new ATOM 0 HG11 VAL A 32 -6.474 -8.202 1.695 1.00 21.45 H new ATOM 0 HG12 VAL A 32 -5.022 -8.530 2.670 1.00 21.45 H new ATOM 0 HG13 VAL A 32 -6.555 -8.112 3.471 1.00 21.45 H new ATOM 0 HG21 VAL A 32 -7.328 -5.894 1.420 1.00 41.20 H new ATOM 0 HG22 VAL A 32 -7.458 -5.616 3.173 1.00 41.20 H new ATOM 0 HG23 VAL A 32 -6.494 -4.510 2.165 1.00 41.20 H new ATOM 513 N GLY A 33 -2.377 -6.348 3.388 1.00 51.30 N ATOM 514 CA GLY A 33 -1.047 -6.908 3.600 1.00 64.22 C ATOM 515 C GLY A 33 -0.324 -7.140 2.285 1.00 65.24 C ATOM 516 O GLY A 33 -0.389 -6.306 1.372 1.00 42.45 O ATOM 0 H GLY A 33 -2.394 -5.572 2.726 1.00 51.30 H new ATOM 0 HA2 GLY A 33 -0.462 -6.232 4.224 1.00 64.22 H new ATOM 0 HA3 GLY A 33 -1.130 -7.850 4.142 1.00 64.22 H new ATOM 520 N ALA A 34 0.377 -8.269 2.206 1.00 32.42 N ATOM 521 CA ALA A 34 1.027 -8.761 0.990 1.00 51.22 C ATOM 522 C ALA A 34 1.068 -10.288 1.063 1.00 75.04 C ATOM 523 O ALA A 34 0.915 -10.866 2.149 1.00 75.02 O ATOM 524 CB ALA A 34 2.441 -8.184 0.843 1.00 35.44 C ATOM 0 H ALA A 34 0.513 -8.885 3.008 1.00 32.42 H new ATOM 0 HA ALA A 34 0.463 -8.441 0.114 1.00 51.22 H new ATOM 0 HB1 ALA A 34 2.898 -8.568 -0.069 1.00 35.44 H new ATOM 0 HB2 ALA A 34 2.387 -7.097 0.792 1.00 35.44 H new ATOM 0 HB3 ALA A 34 3.045 -8.477 1.702 1.00 35.44 H new ATOM 530 N TYR A 35 1.258 -10.935 -0.085 1.00 71.52 N ATOM 531 CA TYR A 35 1.211 -12.403 -0.213 1.00 44.15 C ATOM 532 C TYR A 35 2.450 -12.895 -0.988 1.00 32.41 C ATOM 533 O TYR A 35 3.074 -12.101 -1.676 1.00 62.42 O ATOM 534 CB TYR A 35 -0.121 -12.801 -0.914 1.00 43.40 C ATOM 535 CG TYR A 35 -1.369 -12.600 -0.027 1.00 41.42 C ATOM 536 CD1 TYR A 35 -2.007 -11.359 0.063 1.00 32.43 C ATOM 537 CD2 TYR A 35 -1.888 -13.645 0.747 1.00 1.30 C ATOM 538 CE1 TYR A 35 -3.104 -11.174 0.880 1.00 3.42 C ATOM 539 CE2 TYR A 35 -2.988 -13.455 1.566 1.00 44.22 C ATOM 540 CZ TYR A 35 -3.589 -12.221 1.624 1.00 43.33 C ATOM 541 OH TYR A 35 -4.688 -12.031 2.434 1.00 75.25 O ATOM 0 H TYR A 35 1.451 -10.457 -0.965 1.00 71.52 H new ATOM 0 HA TYR A 35 1.234 -12.879 0.767 1.00 44.15 H new ATOM 0 HB2 TYR A 35 -0.233 -12.212 -1.824 1.00 43.40 H new ATOM 0 HB3 TYR A 35 -0.065 -13.847 -1.216 1.00 43.40 H new ATOM 0 HD1 TYR A 35 -1.634 -10.529 -0.518 1.00 32.43 H new ATOM 0 HD2 TYR A 35 -1.421 -14.618 0.704 1.00 1.30 H new ATOM 0 HE1 TYR A 35 -3.581 -10.206 0.934 1.00 3.42 H new ATOM 0 HE2 TYR A 35 -3.372 -14.273 2.157 1.00 44.22 H new ATOM 0 HH TYR A 35 -4.906 -12.870 2.892 1.00 75.25 H new ATOM 551 N PRO A 36 2.849 -14.210 -0.889 1.00 54.21 N ATOM 552 CA PRO A 36 4.063 -14.732 -1.587 1.00 21.34 C ATOM 553 C PRO A 36 3.945 -14.774 -3.131 1.00 11.02 C ATOM 554 O PRO A 36 4.929 -15.096 -3.807 1.00 50.32 O ATOM 555 CB PRO A 36 4.227 -16.157 -0.994 1.00 31.31 C ATOM 556 CG PRO A 36 2.845 -16.552 -0.576 1.00 5.23 C ATOM 557 CD PRO A 36 2.194 -15.282 -0.074 1.00 41.02 C ATOM 0 HA PRO A 36 4.921 -14.079 -1.425 1.00 21.34 H new ATOM 0 HB2 PRO A 36 4.631 -16.850 -1.732 1.00 31.31 H new ATOM 0 HB3 PRO A 36 4.913 -16.158 -0.147 1.00 31.31 H new ATOM 0 HG2 PRO A 36 2.288 -16.974 -1.412 1.00 5.23 H new ATOM 0 HG3 PRO A 36 2.874 -17.313 0.204 1.00 5.23 H new ATOM 0 HD2 PRO A 36 1.114 -15.298 -0.224 1.00 41.02 H new ATOM 0 HD3 PRO A 36 2.366 -15.137 0.993 1.00 41.02 H new ATOM 565 N SER A 37 2.759 -14.434 -3.681 1.00 20.25 N ATOM 566 CA SER A 37 2.509 -14.492 -5.133 1.00 21.43 C ATOM 567 C SER A 37 1.366 -13.539 -5.515 1.00 34.23 C ATOM 568 O SER A 37 0.530 -13.169 -4.669 1.00 65.54 O ATOM 569 CB SER A 37 2.190 -15.946 -5.574 1.00 1.13 C ATOM 570 OG SER A 37 2.105 -16.061 -6.989 1.00 15.24 O ATOM 0 H SER A 37 1.958 -14.115 -3.136 1.00 20.25 H new ATOM 0 HA SER A 37 3.410 -14.172 -5.656 1.00 21.43 H new ATOM 0 HB2 SER A 37 2.963 -16.617 -5.200 1.00 1.13 H new ATOM 0 HB3 SER A 37 1.248 -16.264 -5.126 1.00 1.13 H new ATOM 0 HG SER A 37 1.905 -16.989 -7.230 1.00 15.24 H new ATOM 576 N TYR A 38 1.353 -13.158 -6.806 1.00 24.42 N ATOM 577 CA TYR A 38 0.402 -12.195 -7.374 1.00 64.10 C ATOM 578 C TYR A 38 -1.056 -12.669 -7.236 1.00 44.22 C ATOM 579 O TYR A 38 -1.887 -11.922 -6.726 1.00 61.14 O ATOM 580 CB TYR A 38 0.749 -11.909 -8.866 1.00 33.24 C ATOM 581 CG TYR A 38 -0.352 -11.158 -9.646 1.00 21.35 C ATOM 582 CD1 TYR A 38 -0.700 -9.842 -9.322 1.00 73.22 C ATOM 583 CD2 TYR A 38 -1.072 -11.783 -10.673 1.00 64.40 C ATOM 584 CE1 TYR A 38 -1.708 -9.184 -9.999 1.00 63.21 C ATOM 585 CE2 TYR A 38 -2.077 -11.119 -11.351 1.00 24.43 C ATOM 586 CZ TYR A 38 -2.395 -9.824 -11.004 1.00 1.13 C ATOM 587 OH TYR A 38 -3.398 -9.162 -11.676 1.00 51.20 O ATOM 0 H TYR A 38 2.016 -13.519 -7.492 1.00 24.42 H new ATOM 0 HA TYR A 38 0.493 -11.270 -6.804 1.00 64.10 H new ATOM 0 HB2 TYR A 38 1.668 -11.325 -8.907 1.00 33.24 H new ATOM 0 HB3 TYR A 38 0.950 -12.856 -9.367 1.00 33.24 H new ATOM 0 HD1 TYR A 38 -0.172 -9.333 -8.530 1.00 73.22 H new ATOM 0 HD2 TYR A 38 -0.837 -12.803 -10.940 1.00 64.40 H new ATOM 0 HE1 TYR A 38 -1.957 -8.166 -9.739 1.00 63.21 H new ATOM 0 HE2 TYR A 38 -2.611 -11.613 -12.149 1.00 24.43 H new ATOM 0 HH TYR A 38 -3.782 -9.754 -12.356 1.00 51.20 H new ATOM 597 N ASP A 39 -1.345 -13.907 -7.700 1.00 31.21 N ATOM 598 CA ASP A 39 -2.721 -14.466 -7.736 1.00 25.42 C ATOM 599 C ASP A 39 -3.332 -14.568 -6.321 1.00 1.14 C ATOM 600 O ASP A 39 -4.549 -14.476 -6.164 1.00 43.45 O ATOM 601 CB ASP A 39 -2.730 -15.852 -8.446 1.00 54.45 C ATOM 602 CG ASP A 39 -4.142 -16.464 -8.611 1.00 64.50 C ATOM 603 OD1 ASP A 39 -4.844 -16.115 -9.586 1.00 43.44 O ATOM 604 OD2 ASP A 39 -4.563 -17.286 -7.762 1.00 63.24 O ATOM 0 H ASP A 39 -0.636 -14.546 -8.059 1.00 31.21 H new ATOM 0 HA ASP A 39 -3.343 -13.779 -8.310 1.00 25.42 H new ATOM 0 HB2 ASP A 39 -2.273 -15.748 -9.430 1.00 54.45 H new ATOM 0 HB3 ASP A 39 -2.109 -16.544 -7.878 1.00 54.45 H new ATOM 609 N GLU A 40 -2.460 -14.729 -5.309 1.00 42.23 N ATOM 610 CA GLU A 40 -2.868 -14.798 -3.892 1.00 41.30 C ATOM 611 C GLU A 40 -3.410 -13.439 -3.411 1.00 42.55 C ATOM 612 O GLU A 40 -4.410 -13.376 -2.687 1.00 43.20 O ATOM 613 CB GLU A 40 -1.672 -15.244 -3.007 1.00 43.15 C ATOM 614 CG GLU A 40 -1.031 -16.585 -3.403 1.00 20.14 C ATOM 615 CD GLU A 40 -2.024 -17.762 -3.386 1.00 14.05 C ATOM 616 OE1 GLU A 40 -2.321 -18.279 -2.294 1.00 30.52 O ATOM 617 OE2 GLU A 40 -2.511 -18.175 -4.457 1.00 44.34 O ATOM 0 H GLU A 40 -1.453 -14.815 -5.449 1.00 42.23 H new ATOM 0 HA GLU A 40 -3.666 -15.535 -3.803 1.00 41.30 H new ATOM 0 HB2 GLU A 40 -0.906 -14.469 -3.041 1.00 43.15 H new ATOM 0 HB3 GLU A 40 -2.011 -15.312 -1.973 1.00 43.15 H new ATOM 0 HG2 GLU A 40 -0.602 -16.494 -4.401 1.00 20.14 H new ATOM 0 HG3 GLU A 40 -0.209 -16.802 -2.721 1.00 20.14 H new ATOM 624 N ALA A 41 -2.733 -12.352 -3.833 1.00 42.11 N ATOM 625 CA ALA A 41 -3.125 -10.978 -3.488 1.00 24.23 C ATOM 626 C ALA A 41 -4.311 -10.519 -4.353 1.00 24.33 C ATOM 627 O ALA A 41 -5.224 -9.825 -3.886 1.00 41.21 O ATOM 628 CB ALA A 41 -1.917 -10.064 -3.662 1.00 44.32 C ATOM 0 H ALA A 41 -1.901 -12.406 -4.421 1.00 42.11 H new ATOM 0 HA ALA A 41 -3.453 -10.936 -2.449 1.00 24.23 H new ATOM 0 HB1 ALA A 41 -2.195 -9.041 -3.409 1.00 44.32 H new ATOM 0 HB2 ALA A 41 -1.113 -10.395 -3.005 1.00 44.32 H new ATOM 0 HB3 ALA A 41 -1.578 -10.102 -4.697 1.00 44.32 H new ATOM 634 N HIS A 42 -4.304 -10.976 -5.608 1.00 34.12 N ATOM 635 CA HIS A 42 -5.358 -10.691 -6.587 1.00 71.25 C ATOM 636 C HIS A 42 -6.665 -11.374 -6.146 1.00 53.24 C ATOM 637 O HIS A 42 -7.753 -10.875 -6.414 1.00 50.31 O ATOM 638 CB HIS A 42 -4.893 -11.164 -7.991 1.00 42.10 C ATOM 639 CG HIS A 42 -5.828 -10.875 -9.143 1.00 51.45 C ATOM 640 ND1 HIS A 42 -5.738 -11.546 -10.340 1.00 33.32 N ATOM 641 CD2 HIS A 42 -6.866 -10.011 -9.286 1.00 22.14 C ATOM 642 CE1 HIS A 42 -6.662 -11.110 -11.165 1.00 11.51 C ATOM 643 NE2 HIS A 42 -7.364 -10.181 -10.554 1.00 2.21 N ATOM 0 H HIS A 42 -3.556 -11.562 -5.978 1.00 34.12 H new ATOM 0 HA HIS A 42 -5.550 -9.620 -6.644 1.00 71.25 H new ATOM 0 HB2 HIS A 42 -3.931 -10.698 -8.207 1.00 42.10 H new ATOM 0 HB3 HIS A 42 -4.724 -12.240 -7.950 1.00 42.10 H new ATOM 0 HD1 HIS A 42 -5.056 -12.273 -10.555 1.00 33.32 H new ATOM 0 HD2 HIS A 42 -7.231 -9.319 -8.541 1.00 22.14 H new ATOM 0 HE1 HIS A 42 -6.819 -11.456 -12.176 1.00 11.51 H new ATOM 652 N LYS A 43 -6.531 -12.504 -5.439 1.00 3.23 N ATOM 653 CA LYS A 43 -7.673 -13.226 -4.865 1.00 35.31 C ATOM 654 C LYS A 43 -8.143 -12.529 -3.578 1.00 13.31 C ATOM 655 O LYS A 43 -9.344 -12.453 -3.310 1.00 51.04 O ATOM 656 CB LYS A 43 -7.275 -14.696 -4.567 1.00 1.44 C ATOM 657 CG LYS A 43 -8.454 -15.689 -4.560 1.00 41.14 C ATOM 658 CD LYS A 43 -9.139 -15.802 -5.945 1.00 24.53 C ATOM 659 CE LYS A 43 -8.177 -16.279 -7.060 1.00 45.02 C ATOM 660 NZ LYS A 43 -7.584 -17.621 -6.794 1.00 55.00 N ATOM 0 H LYS A 43 -5.630 -12.942 -5.249 1.00 3.23 H new ATOM 0 HA LYS A 43 -8.493 -13.224 -5.583 1.00 35.31 H new ATOM 0 HB2 LYS A 43 -6.548 -15.020 -5.312 1.00 1.44 H new ATOM 0 HB3 LYS A 43 -6.778 -14.735 -3.598 1.00 1.44 H new ATOM 0 HG2 LYS A 43 -8.096 -16.672 -4.254 1.00 41.14 H new ATOM 0 HG3 LYS A 43 -9.188 -15.372 -3.819 1.00 41.14 H new ATOM 0 HD2 LYS A 43 -9.976 -16.496 -5.874 1.00 24.53 H new ATOM 0 HD3 LYS A 43 -9.552 -14.831 -6.220 1.00 24.53 H new ATOM 0 HE2 LYS A 43 -8.716 -16.309 -8.007 1.00 45.02 H new ATOM 0 HE3 LYS A 43 -7.374 -15.551 -7.173 1.00 45.02 H new ATOM 0 HZ1 LYS A 43 -6.552 -17.532 -6.700 1.00 55.00 H new ATOM 0 HZ2 LYS A 43 -7.980 -18.007 -5.913 1.00 55.00 H new ATOM 0 HZ3 LYS A 43 -7.806 -18.261 -7.583 1.00 55.00 H new ATOM 674 N ALA A 44 -7.158 -12.014 -2.805 1.00 4.11 N ATOM 675 CA ALA A 44 -7.390 -11.330 -1.516 1.00 21.50 C ATOM 676 C ALA A 44 -8.287 -10.091 -1.661 1.00 43.44 C ATOM 677 O ALA A 44 -8.995 -9.736 -0.722 1.00 12.14 O ATOM 678 CB ALA A 44 -6.058 -10.930 -0.884 1.00 32.44 C ATOM 0 H ALA A 44 -6.172 -12.063 -3.063 1.00 4.11 H new ATOM 0 HA ALA A 44 -7.910 -12.037 -0.870 1.00 21.50 H new ATOM 0 HB1 ALA A 44 -6.242 -10.427 0.065 1.00 32.44 H new ATOM 0 HB2 ALA A 44 -5.455 -11.821 -0.711 1.00 32.44 H new ATOM 0 HB3 ALA A 44 -5.525 -10.256 -1.555 1.00 32.44 H new ATOM 684 N TRP A 45 -8.208 -9.442 -2.839 1.00 14.14 N ATOM 685 CA TRP A 45 -9.069 -8.304 -3.223 1.00 1.01 C ATOM 686 C TRP A 45 -10.579 -8.643 -3.007 1.00 22.13 C ATOM 687 O TRP A 45 -11.295 -7.928 -2.292 1.00 75.15 O ATOM 688 CB TRP A 45 -8.735 -7.898 -4.717 1.00 71.25 C ATOM 689 CG TRP A 45 -9.924 -7.445 -5.553 1.00 42.13 C ATOM 690 CD1 TRP A 45 -10.554 -6.234 -5.520 1.00 21.15 C ATOM 691 CD2 TRP A 45 -10.633 -8.232 -6.527 1.00 25.32 C ATOM 692 NE1 TRP A 45 -11.632 -6.236 -6.371 1.00 0.03 N ATOM 693 CE2 TRP A 45 -11.694 -7.446 -7.008 1.00 23.25 C ATOM 694 CE3 TRP A 45 -10.472 -9.534 -7.033 1.00 35.10 C ATOM 695 CZ2 TRP A 45 -12.596 -7.920 -7.957 1.00 12.22 C ATOM 696 CZ3 TRP A 45 -11.361 -9.995 -7.975 1.00 64.34 C ATOM 697 CH2 TRP A 45 -12.409 -9.193 -8.431 1.00 35.42 C ATOM 0 H TRP A 45 -7.535 -9.697 -3.562 1.00 14.14 H new ATOM 0 HA TRP A 45 -8.866 -7.446 -2.583 1.00 1.01 H new ATOM 0 HB2 TRP A 45 -7.997 -7.096 -4.701 1.00 71.25 H new ATOM 0 HB3 TRP A 45 -8.269 -8.750 -5.211 1.00 71.25 H new ATOM 0 HD1 TRP A 45 -10.249 -5.395 -4.912 1.00 21.15 H new ATOM 0 HE1 TRP A 45 -12.281 -5.461 -6.506 1.00 0.03 H new ATOM 0 HE3 TRP A 45 -9.664 -10.161 -6.687 1.00 35.10 H new ATOM 0 HZ2 TRP A 45 -13.413 -7.307 -8.307 1.00 12.22 H new ATOM 0 HZ3 TRP A 45 -11.247 -10.994 -8.369 1.00 64.34 H new ATOM 0 HH2 TRP A 45 -13.088 -9.584 -9.174 1.00 35.42 H new ATOM 708 N LYS A 46 -11.028 -9.757 -3.612 1.00 71.12 N ATOM 709 CA LYS A 46 -12.448 -10.194 -3.593 1.00 24.41 C ATOM 710 C LYS A 46 -12.765 -11.016 -2.342 1.00 23.43 C ATOM 711 O LYS A 46 -13.909 -11.028 -1.875 1.00 62.05 O ATOM 712 CB LYS A 46 -12.735 -10.977 -4.899 1.00 12.43 C ATOM 713 CG LYS A 46 -14.109 -11.664 -5.042 1.00 62.11 C ATOM 714 CD LYS A 46 -14.297 -12.271 -6.465 1.00 74.42 C ATOM 715 CE LYS A 46 -15.626 -13.020 -6.636 1.00 24.53 C ATOM 716 NZ LYS A 46 -15.686 -14.254 -5.813 1.00 55.30 N ATOM 0 H LYS A 46 -10.418 -10.387 -4.132 1.00 71.12 H new ATOM 0 HA LYS A 46 -13.103 -9.324 -3.549 1.00 24.41 H new ATOM 0 HB2 LYS A 46 -12.617 -10.287 -5.735 1.00 12.43 H new ATOM 0 HB3 LYS A 46 -11.966 -11.742 -5.006 1.00 12.43 H new ATOM 0 HG2 LYS A 46 -14.203 -12.451 -4.294 1.00 62.11 H new ATOM 0 HG3 LYS A 46 -14.901 -10.941 -4.846 1.00 62.11 H new ATOM 0 HD2 LYS A 46 -14.241 -11.471 -7.204 1.00 74.42 H new ATOM 0 HD3 LYS A 46 -13.474 -12.954 -6.672 1.00 74.42 H new ATOM 0 HE2 LYS A 46 -16.450 -12.362 -6.361 1.00 24.53 H new ATOM 0 HE3 LYS A 46 -15.762 -13.279 -7.686 1.00 24.53 H new ATOM 0 HZ1 LYS A 46 -15.935 -15.063 -6.418 1.00 55.30 H new ATOM 0 HZ2 LYS A 46 -14.759 -14.423 -5.373 1.00 55.30 H new ATOM 0 HZ3 LYS A 46 -16.406 -14.142 -5.071 1.00 55.30 H new ATOM 730 N ALA A 47 -11.733 -11.675 -1.789 1.00 60.33 N ATOM 731 CA ALA A 47 -11.846 -12.424 -0.526 1.00 11.12 C ATOM 732 C ALA A 47 -12.181 -11.465 0.635 1.00 74.32 C ATOM 733 O ALA A 47 -12.920 -11.822 1.551 1.00 61.24 O ATOM 734 CB ALA A 47 -10.548 -13.200 -0.250 1.00 61.13 C ATOM 0 H ALA A 47 -10.801 -11.704 -2.203 1.00 60.33 H new ATOM 0 HA ALA A 47 -12.658 -13.146 -0.612 1.00 11.12 H new ATOM 0 HB1 ALA A 47 -10.645 -13.749 0.686 1.00 61.13 H new ATOM 0 HB2 ALA A 47 -10.363 -13.901 -1.064 1.00 61.13 H new ATOM 0 HB3 ALA A 47 -9.715 -12.501 -0.176 1.00 61.13 H new ATOM 740 N LYS A 48 -11.642 -10.230 0.543 1.00 44.54 N ATOM 741 CA LYS A 48 -11.896 -9.143 1.503 1.00 34.45 C ATOM 742 C LYS A 48 -13.240 -8.465 1.226 1.00 65.43 C ATOM 743 O LYS A 48 -14.023 -8.246 2.147 1.00 31.04 O ATOM 744 CB LYS A 48 -10.753 -8.094 1.429 1.00 21.12 C ATOM 745 CG LYS A 48 -9.470 -8.481 2.184 1.00 23.14 C ATOM 746 CD LYS A 48 -9.670 -8.570 3.713 1.00 31.11 C ATOM 747 CE LYS A 48 -10.317 -7.305 4.289 1.00 71.32 C ATOM 748 NZ LYS A 48 -10.274 -7.276 5.768 1.00 73.51 N ATOM 0 H LYS A 48 -11.011 -9.960 -0.211 1.00 44.54 H new ATOM 0 HA LYS A 48 -11.930 -9.575 2.503 1.00 34.45 H new ATOM 0 HB2 LYS A 48 -10.504 -7.923 0.382 1.00 21.12 H new ATOM 0 HB3 LYS A 48 -11.121 -7.148 1.828 1.00 21.12 H new ATOM 0 HG2 LYS A 48 -9.114 -9.442 1.814 1.00 23.14 H new ATOM 0 HG3 LYS A 48 -8.693 -7.748 1.967 1.00 23.14 H new ATOM 0 HD2 LYS A 48 -10.294 -9.433 3.946 1.00 31.11 H new ATOM 0 HD3 LYS A 48 -8.706 -8.734 4.195 1.00 31.11 H new ATOM 0 HE2 LYS A 48 -9.806 -6.427 3.896 1.00 71.32 H new ATOM 0 HE3 LYS A 48 -11.353 -7.246 3.957 1.00 71.32 H new ATOM 0 HZ1 LYS A 48 -11.025 -6.651 6.125 1.00 73.51 H new ATOM 0 HZ2 LYS A 48 -10.418 -8.237 6.138 1.00 73.51 H new ATOM 0 HZ3 LYS A 48 -9.349 -6.920 6.081 1.00 73.51 H new ATOM 762 N ALA A 49 -13.468 -8.131 -0.056 1.00 3.43 N ATOM 763 CA ALA A 49 -14.681 -7.426 -0.524 1.00 43.22 C ATOM 764 C ALA A 49 -15.969 -8.161 -0.085 1.00 75.54 C ATOM 765 O ALA A 49 -16.941 -7.537 0.365 1.00 4.35 O ATOM 766 CB ALA A 49 -14.626 -7.284 -2.052 1.00 62.40 C ATOM 0 H ALA A 49 -12.811 -8.344 -0.806 1.00 3.43 H new ATOM 0 HA ALA A 49 -14.708 -6.436 -0.069 1.00 43.22 H new ATOM 0 HB1 ALA A 49 -15.518 -6.765 -2.402 1.00 62.40 H new ATOM 0 HB2 ALA A 49 -13.741 -6.713 -2.333 1.00 62.40 H new ATOM 0 HB3 ALA A 49 -14.580 -8.273 -2.508 1.00 62.40 H new ATOM 772 N GLN A 50 -15.925 -9.497 -0.201 1.00 53.03 N ATOM 773 CA GLN A 50 -17.024 -10.395 0.194 1.00 73.44 C ATOM 774 C GLN A 50 -17.085 -10.570 1.725 1.00 61.22 C ATOM 775 O GLN A 50 -18.175 -10.647 2.300 1.00 35.52 O ATOM 776 CB GLN A 50 -16.849 -11.772 -0.505 1.00 12.23 C ATOM 777 CG GLN A 50 -17.105 -11.760 -2.033 1.00 0.24 C ATOM 778 CD GLN A 50 -16.695 -13.060 -2.744 1.00 61.43 C ATOM 779 OE1 GLN A 50 -17.346 -13.495 -3.691 1.00 5.44 O ATOM 780 NE2 GLN A 50 -15.566 -13.645 -2.356 1.00 60.11 N ATOM 0 H GLN A 50 -15.116 -9.991 -0.576 1.00 53.03 H new ATOM 0 HA GLN A 50 -17.966 -9.947 -0.122 1.00 73.44 H new ATOM 0 HB2 GLN A 50 -15.836 -12.130 -0.323 1.00 12.23 H new ATOM 0 HB3 GLN A 50 -17.528 -12.488 -0.042 1.00 12.23 H new ATOM 0 HG2 GLN A 50 -18.165 -11.578 -2.212 1.00 0.24 H new ATOM 0 HG3 GLN A 50 -16.559 -10.927 -2.476 1.00 0.24 H new ATOM 0 HE21 GLN A 50 -15.041 -13.267 -1.567 1.00 60.11 H new ATOM 0 HE22 GLN A 50 -15.225 -14.471 -2.847 1.00 60.11 H new ATOM 789 N ALA A 51 -15.904 -10.633 2.372 1.00 72.11 N ATOM 790 CA ALA A 51 -15.791 -10.845 3.839 1.00 32.11 C ATOM 791 C ALA A 51 -16.434 -9.696 4.632 1.00 41.32 C ATOM 792 O ALA A 51 -17.126 -9.915 5.636 1.00 64.22 O ATOM 793 CB ALA A 51 -14.312 -11.005 4.242 1.00 54.14 C ATOM 0 H ALA A 51 -15.004 -10.540 1.901 1.00 72.11 H new ATOM 0 HA ALA A 51 -16.332 -11.759 4.083 1.00 32.11 H new ATOM 0 HB1 ALA A 51 -14.243 -11.160 5.319 1.00 54.14 H new ATOM 0 HB2 ALA A 51 -13.885 -11.864 3.724 1.00 54.14 H new ATOM 0 HB3 ALA A 51 -13.761 -10.105 3.969 1.00 54.14 H new ATOM 799 N THR A 52 -16.218 -8.477 4.135 1.00 52.40 N ATOM 800 CA THR A 52 -16.604 -7.242 4.814 1.00 3.00 C ATOM 801 C THR A 52 -18.032 -6.803 4.404 1.00 3.24 C ATOM 802 O THR A 52 -18.213 -5.919 3.560 1.00 65.11 O ATOM 803 CB THR A 52 -15.528 -6.142 4.514 1.00 5.21 C ATOM 804 OG1 THR A 52 -15.398 -5.931 3.094 1.00 2.01 O ATOM 805 CG2 THR A 52 -14.154 -6.536 5.092 1.00 21.32 C ATOM 0 H THR A 52 -15.763 -8.319 3.236 1.00 52.40 H new ATOM 0 HA THR A 52 -16.638 -7.406 5.891 1.00 3.00 H new ATOM 0 HB THR A 52 -15.863 -5.221 4.990 1.00 5.21 H new ATOM 0 HG1 THR A 52 -14.874 -6.660 2.702 1.00 2.01 H new ATOM 0 HG21 THR A 52 -13.428 -5.755 4.869 1.00 21.32 H new ATOM 0 HG22 THR A 52 -14.235 -6.658 6.172 1.00 21.32 H new ATOM 0 HG23 THR A 52 -13.827 -7.474 4.644 1.00 21.32 H new ATOM 813 N VAL A 53 -19.044 -7.477 4.992 1.00 64.33 N ATOM 814 CA VAL A 53 -20.475 -7.220 4.710 1.00 0.30 C ATOM 815 C VAL A 53 -20.960 -5.972 5.470 1.00 60.53 C ATOM 816 O VAL A 53 -21.582 -5.076 4.884 1.00 3.10 O ATOM 817 CB VAL A 53 -21.363 -8.470 5.086 1.00 20.50 C ATOM 818 CG1 VAL A 53 -22.873 -8.205 4.852 1.00 72.13 C ATOM 819 CG2 VAL A 53 -20.888 -9.729 4.318 1.00 14.10 C ATOM 0 H VAL A 53 -18.892 -8.217 5.678 1.00 64.33 H new ATOM 0 HA VAL A 53 -20.578 -7.040 3.640 1.00 0.30 H new ATOM 0 HB VAL A 53 -21.237 -8.651 6.153 1.00 20.50 H new ATOM 0 HG11 VAL A 53 -23.445 -9.092 5.124 1.00 72.13 H new ATOM 0 HG12 VAL A 53 -23.194 -7.364 5.466 1.00 72.13 H new ATOM 0 HG13 VAL A 53 -23.043 -7.972 3.801 1.00 72.13 H new ATOM 0 HG21 VAL A 53 -21.513 -10.579 4.591 1.00 14.10 H new ATOM 0 HG22 VAL A 53 -20.965 -9.552 3.245 1.00 14.10 H new ATOM 0 HG23 VAL A 53 -19.851 -9.943 4.576 1.00 14.10 H new ATOM 829 N ASP A 54 -20.647 -5.931 6.778 1.00 14.21 N ATOM 830 CA ASP A 54 -21.021 -4.812 7.670 1.00 71.32 C ATOM 831 C ASP A 54 -20.270 -3.525 7.289 1.00 24.01 C ATOM 832 O ASP A 54 -20.811 -2.422 7.401 1.00 72.32 O ATOM 833 CB ASP A 54 -20.723 -5.176 9.150 1.00 52.02 C ATOM 834 CG ASP A 54 -21.690 -6.225 9.732 1.00 22.32 C ATOM 835 OD1 ASP A 54 -21.419 -7.442 9.605 1.00 21.32 O ATOM 836 OD2 ASP A 54 -22.724 -5.834 10.312 1.00 12.44 O ATOM 0 H ASP A 54 -20.128 -6.672 7.249 1.00 14.21 H new ATOM 0 HA ASP A 54 -22.090 -4.635 7.553 1.00 71.32 H new ATOM 0 HB2 ASP A 54 -19.703 -5.553 9.225 1.00 52.02 H new ATOM 0 HB3 ASP A 54 -20.774 -4.271 9.756 1.00 52.02 H new ATOM 841 N ASN A 55 -19.018 -3.699 6.843 1.00 10.25 N ATOM 842 CA ASN A 55 -18.125 -2.601 6.448 1.00 22.13 C ATOM 843 C ASN A 55 -18.710 -1.898 5.193 1.00 3.22 C ATOM 844 O ASN A 55 -18.648 -2.436 4.081 1.00 1.21 O ATOM 845 CB ASN A 55 -16.691 -3.170 6.201 1.00 13.52 C ATOM 846 CG ASN A 55 -15.540 -2.359 6.806 1.00 64.03 C ATOM 847 OD1 ASN A 55 -14.498 -2.919 7.144 1.00 71.23 O ATOM 848 ND2 ASN A 55 -15.695 -1.048 6.933 1.00 2.55 N ATOM 0 H ASN A 55 -18.591 -4.620 6.745 1.00 10.25 H new ATOM 0 HA ASN A 55 -18.049 -1.854 7.239 1.00 22.13 H new ATOM 0 HB2 ASN A 55 -16.648 -4.182 6.603 1.00 13.52 H new ATOM 0 HB3 ASN A 55 -16.531 -3.247 5.126 1.00 13.52 H new ATOM 0 HD21 ASN A 55 -14.940 -0.480 7.318 1.00 2.55 H new ATOM 0 HD22 ASN A 55 -16.569 -0.608 6.645 1.00 2.55 H new ATOM 855 N ALA A 56 -19.287 -0.708 5.418 1.00 34.41 N ATOM 856 CA ALA A 56 -20.187 -0.030 4.462 1.00 2.33 C ATOM 857 C ALA A 56 -19.460 0.512 3.225 1.00 12.24 C ATOM 858 O ALA A 56 -19.788 0.167 2.086 1.00 45.13 O ATOM 859 CB ALA A 56 -20.919 1.114 5.185 1.00 72.13 C ATOM 0 H ALA A 56 -19.142 -0.180 6.278 1.00 34.41 H new ATOM 0 HA ALA A 56 -20.896 -0.775 4.100 1.00 2.33 H new ATOM 0 HB1 ALA A 56 -21.585 1.619 4.486 1.00 72.13 H new ATOM 0 HB2 ALA A 56 -21.501 0.708 6.012 1.00 72.13 H new ATOM 0 HB3 ALA A 56 -20.190 1.827 5.570 1.00 72.13 H new ATOM 865 N HIS A 57 -18.473 1.373 3.480 1.00 33.41 N ATOM 866 CA HIS A 57 -17.763 2.136 2.437 1.00 24.53 C ATOM 867 C HIS A 57 -16.471 1.445 1.991 1.00 22.53 C ATOM 868 O HIS A 57 -15.773 1.936 1.098 1.00 74.40 O ATOM 869 CB HIS A 57 -17.462 3.542 2.986 1.00 54.03 C ATOM 870 CG HIS A 57 -18.666 4.424 3.146 1.00 10.12 C ATOM 871 ND1 HIS A 57 -19.408 4.507 4.308 1.00 4.15 N ATOM 872 CD2 HIS A 57 -19.251 5.273 2.270 1.00 52.55 C ATOM 873 CE1 HIS A 57 -20.392 5.365 4.131 1.00 65.41 C ATOM 874 NE2 HIS A 57 -20.317 5.842 2.907 1.00 70.34 N ATOM 0 H HIS A 57 -18.137 1.566 4.423 1.00 33.41 H new ATOM 0 HA HIS A 57 -18.400 2.199 1.555 1.00 24.53 H new ATOM 0 HB2 HIS A 57 -16.971 3.442 3.954 1.00 54.03 H new ATOM 0 HB3 HIS A 57 -16.754 4.034 2.319 1.00 54.03 H new ATOM 0 HD2 HIS A 57 -18.934 5.465 1.256 1.00 52.55 H new ATOM 0 HE1 HIS A 57 -21.136 5.632 4.867 1.00 65.41 H new ATOM 0 HE2 HIS A 57 -20.953 6.527 2.499 1.00 70.34 H new ATOM 883 N ALA A 58 -16.183 0.310 2.614 1.00 33.35 N ATOM 884 CA ALA A 58 -14.936 -0.440 2.419 1.00 14.23 C ATOM 885 C ALA A 58 -14.856 -1.011 1.006 1.00 2.33 C ATOM 886 O ALA A 58 -15.726 -1.782 0.596 1.00 13.30 O ATOM 887 CB ALA A 58 -14.809 -1.545 3.466 1.00 73.01 C ATOM 0 H ALA A 58 -16.817 -0.128 3.282 1.00 33.35 H new ATOM 0 HA ALA A 58 -14.100 0.247 2.545 1.00 14.23 H new ATOM 0 HB1 ALA A 58 -13.879 -2.091 3.307 1.00 73.01 H new ATOM 0 HB2 ALA A 58 -14.805 -1.103 4.462 1.00 73.01 H new ATOM 0 HB3 ALA A 58 -15.652 -2.230 3.376 1.00 73.01 H new ATOM 893 N ARG A 59 -13.815 -0.614 0.266 1.00 2.43 N ATOM 894 CA ARG A 59 -13.634 -1.001 -1.133 1.00 13.10 C ATOM 895 C ARG A 59 -12.159 -1.356 -1.339 1.00 42.10 C ATOM 896 O ARG A 59 -11.323 -0.497 -1.639 1.00 23.00 O ATOM 897 CB ARG A 59 -14.097 0.154 -2.056 1.00 54.30 C ATOM 898 CG ARG A 59 -14.625 -0.264 -3.438 1.00 20.32 C ATOM 899 CD ARG A 59 -15.939 -1.060 -3.348 1.00 3.53 C ATOM 900 NE ARG A 59 -16.521 -1.318 -4.675 1.00 5.43 N ATOM 901 CZ ARG A 59 -17.475 -2.228 -4.949 1.00 30.00 C ATOM 902 NH1 ARG A 59 -17.988 -3.002 -3.989 1.00 3.40 N ATOM 903 NH2 ARG A 59 -17.922 -2.343 -6.200 1.00 61.13 N ATOM 0 H ARG A 59 -13.073 -0.013 0.624 1.00 2.43 H new ATOM 0 HA ARG A 59 -14.239 -1.872 -1.386 1.00 13.10 H new ATOM 0 HB2 ARG A 59 -14.880 0.712 -1.543 1.00 54.30 H new ATOM 0 HB3 ARG A 59 -13.260 0.837 -2.199 1.00 54.30 H new ATOM 0 HG2 ARG A 59 -14.783 0.626 -4.048 1.00 20.32 H new ATOM 0 HG3 ARG A 59 -13.872 -0.868 -3.944 1.00 20.32 H new ATOM 0 HD2 ARG A 59 -15.754 -2.008 -2.843 1.00 3.53 H new ATOM 0 HD3 ARG A 59 -16.656 -0.509 -2.739 1.00 3.53 H new ATOM 0 HE ARG A 59 -16.172 -0.760 -5.454 1.00 5.43 H new ATOM 0 HH11 ARG A 59 -17.658 -2.909 -3.028 1.00 3.40 H new ATOM 0 HH12 ARG A 59 -18.710 -3.686 -4.216 1.00 3.40 H new ATOM 0 HH21 ARG A 59 -17.542 -1.746 -6.934 1.00 61.13 H new ATOM 0 HH22 ARG A 59 -18.644 -3.028 -6.423 1.00 61.13 H new ATOM 917 N TYR A 60 -11.858 -2.626 -1.092 1.00 74.33 N ATOM 918 CA TYR A 60 -10.501 -3.170 -1.144 1.00 43.54 C ATOM 919 C TYR A 60 -10.092 -3.422 -2.596 1.00 61.54 C ATOM 920 O TYR A 60 -10.812 -4.091 -3.333 1.00 74.11 O ATOM 921 CB TYR A 60 -10.431 -4.477 -0.318 1.00 2.24 C ATOM 922 CG TYR A 60 -10.816 -4.282 1.158 1.00 62.11 C ATOM 923 CD1 TYR A 60 -9.866 -3.913 2.111 1.00 35.30 C ATOM 924 CD2 TYR A 60 -12.134 -4.449 1.589 1.00 41.04 C ATOM 925 CE1 TYR A 60 -10.211 -3.721 3.432 1.00 42.23 C ATOM 926 CE2 TYR A 60 -12.479 -4.256 2.910 1.00 73.02 C ATOM 927 CZ TYR A 60 -11.518 -3.892 3.829 1.00 34.24 C ATOM 928 OH TYR A 60 -11.863 -3.716 5.151 1.00 75.21 O ATOM 0 H TYR A 60 -12.562 -3.322 -0.845 1.00 74.33 H new ATOM 0 HA TYR A 60 -9.806 -2.449 -0.714 1.00 43.54 H new ATOM 0 HB2 TYR A 60 -11.094 -5.218 -0.765 1.00 2.24 H new ATOM 0 HB3 TYR A 60 -9.420 -4.880 -0.373 1.00 2.24 H new ATOM 0 HD1 TYR A 60 -8.839 -3.775 1.807 1.00 35.30 H new ATOM 0 HD2 TYR A 60 -12.894 -4.734 0.877 1.00 41.04 H new ATOM 0 HE1 TYR A 60 -9.458 -3.437 4.153 1.00 42.23 H new ATOM 0 HE2 TYR A 60 -13.503 -4.390 3.225 1.00 73.02 H new ATOM 0 HH TYR A 60 -11.112 -3.979 5.723 1.00 75.21 H new ATOM 938 N PHE A 61 -8.956 -2.837 -2.991 1.00 41.20 N ATOM 939 CA PHE A 61 -8.344 -3.029 -4.317 1.00 42.35 C ATOM 940 C PHE A 61 -6.892 -3.504 -4.133 1.00 13.24 C ATOM 941 O PHE A 61 -6.555 -4.113 -3.102 1.00 34.51 O ATOM 942 CB PHE A 61 -8.418 -1.713 -5.142 1.00 64.25 C ATOM 943 CG PHE A 61 -9.825 -1.281 -5.553 1.00 22.10 C ATOM 944 CD1 PHE A 61 -10.591 -2.079 -6.401 1.00 30.40 C ATOM 945 CD2 PHE A 61 -10.368 -0.074 -5.113 1.00 23.50 C ATOM 946 CE1 PHE A 61 -11.863 -1.689 -6.787 1.00 40.32 C ATOM 947 CE2 PHE A 61 -11.636 0.317 -5.498 1.00 45.02 C ATOM 948 CZ PHE A 61 -12.382 -0.489 -6.337 1.00 75.43 C ATOM 0 H PHE A 61 -8.425 -2.206 -2.391 1.00 41.20 H new ATOM 0 HA PHE A 61 -8.891 -3.790 -4.874 1.00 42.35 H new ATOM 0 HB2 PHE A 61 -7.965 -0.911 -4.559 1.00 64.25 H new ATOM 0 HB3 PHE A 61 -7.815 -1.833 -6.042 1.00 64.25 H new ATOM 0 HD1 PHE A 61 -10.188 -3.014 -6.762 1.00 30.40 H new ATOM 0 HD2 PHE A 61 -9.789 0.564 -4.462 1.00 23.50 H new ATOM 0 HE1 PHE A 61 -12.448 -2.321 -7.438 1.00 40.32 H new ATOM 0 HE2 PHE A 61 -12.044 1.252 -5.143 1.00 45.02 H new ATOM 0 HZ PHE A 61 -13.371 -0.181 -6.641 1.00 75.43 H new ATOM 958 N ILE A 62 -6.034 -3.254 -5.142 1.00 23.54 N ATOM 959 CA ILE A 62 -4.651 -3.760 -5.166 1.00 33.21 C ATOM 960 C ILE A 62 -3.721 -2.597 -5.570 1.00 32.01 C ATOM 961 O ILE A 62 -4.186 -1.571 -6.079 1.00 63.42 O ATOM 962 CB ILE A 62 -4.501 -4.976 -6.184 1.00 32.22 C ATOM 963 CG1 ILE A 62 -5.718 -5.957 -6.109 1.00 62.24 C ATOM 964 CG2 ILE A 62 -3.190 -5.755 -5.928 1.00 23.20 C ATOM 965 CD1 ILE A 62 -5.722 -7.052 -7.158 1.00 63.54 C ATOM 0 H ILE A 62 -6.281 -2.697 -5.960 1.00 23.54 H new ATOM 0 HA ILE A 62 -4.381 -4.133 -4.178 1.00 33.21 H new ATOM 0 HB ILE A 62 -4.473 -4.545 -7.185 1.00 32.22 H new ATOM 0 HG12 ILE A 62 -5.733 -6.420 -5.122 1.00 62.24 H new ATOM 0 HG13 ILE A 62 -6.638 -5.380 -6.204 1.00 62.24 H new ATOM 0 HG21 ILE A 62 -3.113 -6.580 -6.637 1.00 23.20 H new ATOM 0 HG22 ILE A 62 -2.339 -5.086 -6.055 1.00 23.20 H new ATOM 0 HG23 ILE A 62 -3.193 -6.149 -4.912 1.00 23.20 H new ATOM 0 HD11 ILE A 62 -6.603 -7.680 -7.025 1.00 63.54 H new ATOM 0 HD12 ILE A 62 -5.742 -6.604 -8.151 1.00 63.54 H new ATOM 0 HD13 ILE A 62 -4.824 -7.660 -7.053 1.00 63.54 H new ATOM 977 N ILE A 63 -2.417 -2.752 -5.316 1.00 40.23 N ATOM 978 CA ILE A 63 -1.377 -1.788 -5.701 1.00 61.11 C ATOM 979 C ILE A 63 -0.150 -2.552 -6.221 1.00 54.24 C ATOM 980 O ILE A 63 0.276 -3.540 -5.619 1.00 74.14 O ATOM 981 CB ILE A 63 -0.986 -0.823 -4.491 1.00 53.44 C ATOM 982 CG1 ILE A 63 -1.886 0.458 -4.495 1.00 25.54 C ATOM 983 CG2 ILE A 63 0.512 -0.448 -4.480 1.00 44.52 C ATOM 984 CD1 ILE A 63 -1.477 1.557 -3.521 1.00 64.54 C ATOM 0 H ILE A 63 -2.046 -3.567 -4.827 1.00 40.23 H new ATOM 0 HA ILE A 63 -1.768 -1.150 -6.493 1.00 61.11 H new ATOM 0 HB ILE A 63 -1.169 -1.380 -3.572 1.00 53.44 H new ATOM 0 HG12 ILE A 63 -1.889 0.874 -5.503 1.00 25.54 H new ATOM 0 HG13 ILE A 63 -2.910 0.161 -4.269 1.00 25.54 H new ATOM 0 HG21 ILE A 63 0.716 0.209 -3.635 1.00 44.52 H new ATOM 0 HG22 ILE A 63 1.113 -1.353 -4.390 1.00 44.52 H new ATOM 0 HG23 ILE A 63 0.766 0.065 -5.408 1.00 44.52 H new ATOM 0 HD11 ILE A 63 -2.168 2.396 -3.608 1.00 64.54 H new ATOM 0 HD12 ILE A 63 -1.503 1.169 -2.503 1.00 64.54 H new ATOM 0 HD13 ILE A 63 -0.467 1.893 -3.755 1.00 64.54 H new ATOM 996 N HIS A 64 0.397 -2.088 -7.357 1.00 4.23 N ATOM 997 CA HIS A 64 1.655 -2.603 -7.902 1.00 73.24 C ATOM 998 C HIS A 64 2.833 -2.097 -7.050 1.00 24.41 C ATOM 999 O HIS A 64 3.165 -0.912 -7.057 1.00 14.33 O ATOM 1000 CB HIS A 64 1.820 -2.218 -9.397 1.00 45.54 C ATOM 1001 CG HIS A 64 1.694 -0.748 -9.711 1.00 11.31 C ATOM 1002 ND1 HIS A 64 2.725 0.154 -9.543 1.00 63.43 N ATOM 1003 CD2 HIS A 64 0.647 -0.025 -10.190 1.00 21.01 C ATOM 1004 CE1 HIS A 64 2.322 1.352 -9.902 1.00 53.32 C ATOM 1005 NE2 HIS A 64 1.066 1.275 -10.306 1.00 11.24 N ATOM 0 H HIS A 64 -0.023 -1.347 -7.919 1.00 4.23 H new ATOM 0 HA HIS A 64 1.640 -3.692 -7.858 1.00 73.24 H new ATOM 0 HB2 HIS A 64 2.798 -2.561 -9.736 1.00 45.54 H new ATOM 0 HB3 HIS A 64 1.073 -2.760 -9.977 1.00 45.54 H new ATOM 0 HD2 HIS A 64 -0.334 -0.405 -10.434 1.00 21.01 H new ATOM 0 HE1 HIS A 64 2.919 2.252 -9.872 1.00 53.32 H new ATOM 0 HE2 HIS A 64 0.502 2.053 -10.647 1.00 11.24 H new ATOM 1014 N ALA A 65 3.404 -3.005 -6.262 1.00 21.14 N ATOM 1015 CA ALA A 65 4.591 -2.725 -5.428 1.00 1.41 C ATOM 1016 C ALA A 65 5.900 -3.041 -6.180 1.00 40.14 C ATOM 1017 O ALA A 65 6.987 -3.015 -5.594 1.00 15.32 O ATOM 1018 CB ALA A 65 4.478 -3.513 -4.130 1.00 52.41 C ATOM 0 H ALA A 65 3.062 -3.962 -6.177 1.00 21.14 H new ATOM 0 HA ALA A 65 4.625 -1.661 -5.195 1.00 1.41 H new ATOM 0 HB1 ALA A 65 5.349 -3.314 -3.506 1.00 52.41 H new ATOM 0 HB2 ALA A 65 3.575 -3.212 -3.599 1.00 52.41 H new ATOM 0 HB3 ALA A 65 4.428 -4.579 -4.354 1.00 52.41 H new ATOM 1024 N HIS A 66 5.769 -3.343 -7.487 1.00 12.14 N ATOM 1025 CA HIS A 66 6.912 -3.541 -8.388 1.00 72.12 C ATOM 1026 C HIS A 66 7.501 -2.175 -8.768 1.00 61.02 C ATOM 1027 O HIS A 66 8.723 -1.993 -8.777 1.00 51.02 O ATOM 1028 CB HIS A 66 6.475 -4.304 -9.663 1.00 23.00 C ATOM 1029 CG HIS A 66 7.621 -4.751 -10.539 1.00 14.21 C ATOM 1030 ND1 HIS A 66 8.240 -5.971 -10.381 1.00 73.42 N ATOM 1031 CD2 HIS A 66 8.269 -4.139 -11.562 1.00 61.22 C ATOM 1032 CE1 HIS A 66 9.216 -6.086 -11.256 1.00 44.22 C ATOM 1033 NE2 HIS A 66 9.257 -4.990 -11.986 1.00 10.23 N ATOM 0 H HIS A 66 4.864 -3.456 -7.944 1.00 12.14 H new ATOM 0 HA HIS A 66 7.669 -4.136 -7.877 1.00 72.12 H new ATOM 0 HB2 HIS A 66 5.895 -5.178 -9.369 1.00 23.00 H new ATOM 0 HB3 HIS A 66 5.814 -3.664 -10.247 1.00 23.00 H new ATOM 0 HD2 HIS A 66 8.048 -3.163 -11.967 1.00 61.22 H new ATOM 0 HE1 HIS A 66 9.874 -6.937 -11.359 1.00 44.22 H new ATOM 0 HE2 HIS A 66 9.916 -4.805 -12.742 1.00 10.23 H new ATOM 1042 N LYS A 67 6.601 -1.224 -9.114 1.00 13.24 N ATOM 1043 CA LYS A 67 6.983 0.163 -9.422 1.00 30.15 C ATOM 1044 C LYS A 67 6.486 1.093 -8.302 1.00 75.13 C ATOM 1045 O LYS A 67 5.275 1.253 -8.099 1.00 55.23 O ATOM 1046 CB LYS A 67 6.445 0.628 -10.807 1.00 65.53 C ATOM 1047 CG LYS A 67 6.956 2.035 -11.238 1.00 54.43 C ATOM 1048 CD LYS A 67 8.509 2.124 -11.243 1.00 41.33 C ATOM 1049 CE LYS A 67 9.049 3.497 -11.673 1.00 22.33 C ATOM 1050 NZ LYS A 67 8.641 3.862 -13.055 1.00 54.40 N ATOM 0 H LYS A 67 5.599 -1.401 -9.185 1.00 13.24 H new ATOM 0 HA LYS A 67 8.071 0.209 -9.478 1.00 30.15 H new ATOM 0 HB2 LYS A 67 6.736 -0.101 -11.563 1.00 65.53 H new ATOM 0 HB3 LYS A 67 5.355 0.640 -10.778 1.00 65.53 H new ATOM 0 HG2 LYS A 67 6.578 2.267 -12.234 1.00 54.43 H new ATOM 0 HG3 LYS A 67 6.553 2.788 -10.561 1.00 54.43 H new ATOM 0 HD2 LYS A 67 8.880 1.894 -10.244 1.00 41.33 H new ATOM 0 HD3 LYS A 67 8.905 1.362 -11.914 1.00 41.33 H new ATOM 0 HE2 LYS A 67 8.692 4.258 -10.979 1.00 22.33 H new ATOM 0 HE3 LYS A 67 10.137 3.492 -11.608 1.00 22.33 H new ATOM 0 HZ1 LYS A 67 9.099 4.755 -13.328 1.00 54.40 H new ATOM 0 HZ2 LYS A 67 8.930 3.110 -13.712 1.00 54.40 H new ATOM 0 HZ3 LYS A 67 7.608 3.977 -13.093 1.00 54.40 H new ATOM 1064 N LEU A 68 7.450 1.666 -7.581 1.00 22.52 N ATOM 1065 CA LEU A 68 7.240 2.602 -6.487 1.00 74.20 C ATOM 1066 C LEU A 68 7.394 4.051 -6.994 1.00 61.10 C ATOM 1067 O LEU A 68 7.565 4.304 -8.203 1.00 30.21 O ATOM 1068 CB LEU A 68 8.292 2.308 -5.375 1.00 32.54 C ATOM 1069 CG LEU A 68 8.382 0.837 -4.812 1.00 55.21 C ATOM 1070 CD1 LEU A 68 7.021 0.309 -4.334 1.00 22.12 C ATOM 1071 CD2 LEU A 68 9.072 -0.151 -5.788 1.00 63.13 C ATOM 0 H LEU A 68 8.438 1.480 -7.754 1.00 22.52 H new ATOM 0 HA LEU A 68 6.234 2.485 -6.085 1.00 74.20 H new ATOM 0 HB2 LEU A 68 9.274 2.577 -5.764 1.00 32.54 H new ATOM 0 HB3 LEU A 68 8.088 2.974 -4.537 1.00 32.54 H new ATOM 0 HG LEU A 68 9.028 0.900 -3.936 1.00 55.21 H new ATOM 0 HD11 LEU A 68 7.137 -0.707 -3.956 1.00 22.12 H new ATOM 0 HD12 LEU A 68 6.641 0.951 -3.539 1.00 22.12 H new ATOM 0 HD13 LEU A 68 6.318 0.308 -5.167 1.00 22.12 H new ATOM 0 HD21 LEU A 68 9.101 -1.144 -5.340 1.00 63.13 H new ATOM 0 HD22 LEU A 68 8.512 -0.191 -6.722 1.00 63.13 H new ATOM 0 HD23 LEU A 68 10.089 0.186 -5.989 1.00 63.13 H new ATOM 1083 N LEU A 69 7.342 4.986 -6.046 1.00 70.41 N ATOM 1084 CA LEU A 69 7.616 6.413 -6.255 1.00 42.05 C ATOM 1085 C LEU A 69 8.750 6.791 -5.312 1.00 14.22 C ATOM 1086 O LEU A 69 8.510 7.220 -4.173 1.00 75.20 O ATOM 1087 CB LEU A 69 6.357 7.281 -5.971 1.00 44.12 C ATOM 1088 CG LEU A 69 5.122 6.999 -6.869 1.00 44.14 C ATOM 1089 CD1 LEU A 69 3.908 7.820 -6.406 1.00 31.23 C ATOM 1090 CD2 LEU A 69 5.445 7.253 -8.358 1.00 63.41 C ATOM 0 H LEU A 69 7.101 4.767 -5.079 1.00 70.41 H new ATOM 0 HA LEU A 69 7.892 6.595 -7.294 1.00 42.05 H new ATOM 0 HB2 LEU A 69 6.066 7.135 -4.931 1.00 44.12 H new ATOM 0 HB3 LEU A 69 6.630 8.330 -6.082 1.00 44.12 H new ATOM 0 HG LEU A 69 4.865 5.945 -6.768 1.00 44.14 H new ATOM 0 HD11 LEU A 69 3.056 7.605 -7.051 1.00 31.23 H new ATOM 0 HD12 LEU A 69 3.661 7.556 -5.378 1.00 31.23 H new ATOM 0 HD13 LEU A 69 4.145 8.882 -6.461 1.00 31.23 H new ATOM 0 HD21 LEU A 69 4.561 7.047 -8.962 1.00 63.41 H new ATOM 0 HD22 LEU A 69 5.743 8.293 -8.493 1.00 63.41 H new ATOM 0 HD23 LEU A 69 6.259 6.599 -8.671 1.00 63.41 H new ATOM 1102 N ASP A 70 9.983 6.525 -5.752 1.00 65.35 N ATOM 1103 CA ASP A 70 11.187 6.907 -5.000 1.00 35.01 C ATOM 1104 C ASP A 70 11.561 8.357 -5.379 1.00 34.43 C ATOM 1105 O ASP A 70 11.912 8.623 -6.536 1.00 31.32 O ATOM 1106 CB ASP A 70 12.366 5.945 -5.250 1.00 12.11 C ATOM 1107 CG ASP A 70 13.596 6.286 -4.374 1.00 2.41 C ATOM 1108 OD1 ASP A 70 14.430 7.107 -4.804 1.00 74.44 O ATOM 1109 OD2 ASP A 70 13.714 5.765 -3.242 1.00 61.11 O ATOM 0 H ASP A 70 10.177 6.044 -6.630 1.00 65.35 H new ATOM 0 HA ASP A 70 10.969 6.843 -3.934 1.00 35.01 H new ATOM 0 HB2 ASP A 70 12.048 4.923 -5.045 1.00 12.11 H new ATOM 0 HB3 ASP A 70 12.649 5.986 -6.302 1.00 12.11 H new ATOM 1114 N PRO A 71 11.461 9.313 -4.412 1.00 45.50 N ATOM 1115 CA PRO A 71 11.703 10.759 -4.653 1.00 62.44 C ATOM 1116 C PRO A 71 13.166 11.103 -5.006 1.00 54.24 C ATOM 1117 O PRO A 71 13.413 12.112 -5.672 1.00 34.12 O ATOM 1118 CB PRO A 71 11.282 11.415 -3.314 1.00 62.33 C ATOM 1119 CG PRO A 71 10.448 10.380 -2.624 1.00 25.22 C ATOM 1120 CD PRO A 71 11.062 9.072 -3.001 1.00 61.51 C ATOM 0 HA PRO A 71 11.146 11.114 -5.520 1.00 62.44 H new ATOM 0 HB2 PRO A 71 12.152 11.685 -2.715 1.00 62.33 H new ATOM 0 HB3 PRO A 71 10.715 12.331 -3.483 1.00 62.33 H new ATOM 0 HG2 PRO A 71 10.457 10.523 -1.543 1.00 25.22 H new ATOM 0 HG3 PRO A 71 9.408 10.434 -2.944 1.00 25.22 H new ATOM 0 HD2 PRO A 71 11.917 8.826 -2.371 1.00 61.51 H new ATOM 0 HD3 PRO A 71 10.354 8.248 -2.912 1.00 61.51 H new ATOM 1128 N SER A 72 14.121 10.255 -4.566 1.00 13.33 N ATOM 1129 CA SER A 72 15.558 10.469 -4.835 1.00 44.13 C ATOM 1130 C SER A 72 15.854 10.207 -6.329 1.00 2.22 C ATOM 1131 O SER A 72 16.671 10.906 -6.943 1.00 23.41 O ATOM 1132 CB SER A 72 16.436 9.584 -3.915 1.00 1.13 C ATOM 1133 OG SER A 72 17.825 9.806 -4.130 1.00 42.41 O ATOM 0 H SER A 72 13.921 9.415 -4.022 1.00 13.33 H new ATOM 0 HA SER A 72 15.809 11.506 -4.612 1.00 44.13 H new ATOM 0 HB2 SER A 72 16.193 9.791 -2.873 1.00 1.13 H new ATOM 0 HB3 SER A 72 16.205 8.534 -4.094 1.00 1.13 H new ATOM 0 HG SER A 72 18.345 9.231 -3.530 1.00 42.41 H new ATOM 1139 N GLU A 73 15.150 9.208 -6.910 1.00 33.32 N ATOM 1140 CA GLU A 73 15.178 8.943 -8.363 1.00 73.31 C ATOM 1141 C GLU A 73 14.384 10.033 -9.107 1.00 22.31 C ATOM 1142 O GLU A 73 14.812 10.514 -10.164 1.00 62.01 O ATOM 1143 CB GLU A 73 14.582 7.540 -8.696 1.00 4.42 C ATOM 1144 CG GLU A 73 15.264 6.355 -7.984 1.00 23.41 C ATOM 1145 CD GLU A 73 16.791 6.320 -8.169 1.00 42.11 C ATOM 1146 OE1 GLU A 73 17.261 6.026 -9.289 1.00 73.41 O ATOM 1147 OE2 GLU A 73 17.531 6.592 -7.198 1.00 65.54 O ATOM 0 H GLU A 73 14.551 8.569 -6.387 1.00 33.32 H new ATOM 0 HA GLU A 73 16.218 8.957 -8.689 1.00 73.31 H new ATOM 0 HB2 GLU A 73 13.524 7.541 -8.435 1.00 4.42 H new ATOM 0 HB3 GLU A 73 14.645 7.382 -9.773 1.00 4.42 H new ATOM 0 HG2 GLU A 73 15.037 6.403 -6.919 1.00 23.41 H new ATOM 0 HG3 GLU A 73 14.840 5.424 -8.359 1.00 23.41 H new ATOM 1154 N GLY A 74 13.231 10.409 -8.517 1.00 10.13 N ATOM 1155 CA GLY A 74 12.320 11.397 -9.095 1.00 14.51 C ATOM 1156 C GLY A 74 11.407 10.806 -10.158 1.00 14.43 C ATOM 1157 O GLY A 74 10.832 9.728 -9.973 1.00 22.34 O ATOM 0 H GLY A 74 12.912 10.031 -7.625 1.00 10.13 H new ATOM 0 HA2 GLY A 74 11.712 11.832 -8.302 1.00 14.51 H new ATOM 0 HA3 GLY A 74 12.902 12.209 -9.532 1.00 14.51 H new TER 1161 GLY A 74 ATOM 1162 N MET B 101 -8.085 27.020 -1.620 1.00 43.23 N ATOM 1163 CA MET B 101 -7.537 26.067 -2.580 1.00 64.13 C ATOM 1164 C MET B 101 -8.237 24.692 -2.421 1.00 25.34 C ATOM 1165 O MET B 101 -8.569 24.309 -1.289 1.00 11.24 O ATOM 1166 CB MET B 101 -5.992 25.967 -2.406 1.00 2.11 C ATOM 1167 CG MET B 101 -5.524 25.559 -0.996 1.00 30.34 C ATOM 1168 SD MET B 101 -3.736 25.668 -0.784 1.00 43.14 S ATOM 1169 CE MET B 101 -3.432 27.420 -1.067 1.00 22.42 C ATOM 0 HA MET B 101 -7.729 26.414 -3.595 1.00 64.13 H new ATOM 0 HB2 MET B 101 -5.606 25.244 -3.125 1.00 2.11 H new ATOM 0 HB3 MET B 101 -5.550 26.932 -2.655 1.00 2.11 H new ATOM 0 HG2 MET B 101 -6.011 26.198 -0.259 1.00 30.34 H new ATOM 0 HG3 MET B 101 -5.846 24.537 -0.794 1.00 30.34 H new ATOM 0 HE1 MET B 101 -2.497 27.709 -0.587 1.00 22.42 H new ATOM 0 HE2 MET B 101 -3.364 27.609 -2.138 1.00 22.42 H new ATOM 0 HE3 MET B 101 -4.251 28.004 -0.647 1.00 22.42 H new ATOM 1179 N PRO B 102 -8.529 23.956 -3.548 1.00 13.41 N ATOM 1180 CA PRO B 102 -9.174 22.616 -3.486 1.00 51.32 C ATOM 1181 C PRO B 102 -8.288 21.579 -2.768 1.00 44.31 C ATOM 1182 O PRO B 102 -7.279 21.122 -3.321 1.00 44.14 O ATOM 1183 CB PRO B 102 -9.405 22.251 -4.986 1.00 12.03 C ATOM 1184 CG PRO B 102 -9.319 23.563 -5.716 1.00 32.30 C ATOM 1185 CD PRO B 102 -8.292 24.369 -4.962 1.00 44.12 C ATOM 0 HA PRO B 102 -10.099 22.623 -2.909 1.00 51.32 H new ATOM 0 HB2 PRO B 102 -8.652 21.549 -5.343 1.00 12.03 H new ATOM 0 HB3 PRO B 102 -10.376 21.779 -5.134 1.00 12.03 H new ATOM 0 HG2 PRO B 102 -9.020 23.417 -6.754 1.00 32.30 H new ATOM 0 HG3 PRO B 102 -10.284 24.070 -5.730 1.00 32.30 H new ATOM 0 HD2 PRO B 102 -7.277 24.139 -5.287 1.00 44.12 H new ATOM 0 HD3 PRO B 102 -8.436 25.441 -5.101 1.00 44.12 H new ATOM 1193 N ASP B 103 -8.638 21.258 -1.511 1.00 61.43 N ATOM 1194 CA ASP B 103 -7.900 20.286 -0.693 1.00 0.23 C ATOM 1195 C ASP B 103 -8.624 18.943 -0.714 1.00 71.32 C ATOM 1196 O ASP B 103 -9.810 18.866 -0.377 1.00 54.53 O ATOM 1197 CB ASP B 103 -7.742 20.790 0.764 1.00 72.53 C ATOM 1198 CG ASP B 103 -6.897 19.831 1.627 1.00 33.14 C ATOM 1199 OD1 ASP B 103 -5.656 19.884 1.533 1.00 2.35 O ATOM 1200 OD2 ASP B 103 -7.470 18.995 2.365 1.00 42.23 O ATOM 0 H ASP B 103 -9.442 21.667 -1.035 1.00 61.43 H new ATOM 0 HA ASP B 103 -6.902 20.164 -1.115 1.00 0.23 H new ATOM 0 HB2 ASP B 103 -7.275 21.775 0.757 1.00 72.53 H new ATOM 0 HB3 ASP B 103 -8.728 20.907 1.214 1.00 72.53 H new ATOM 1205 N LYS B 104 -7.908 17.894 -1.136 1.00 44.11 N ATOM 1206 CA LYS B 104 -8.393 16.506 -1.165 1.00 1.44 C ATOM 1207 C LYS B 104 -7.452 15.638 -0.318 1.00 12.32 C ATOM 1208 O LYS B 104 -6.234 15.714 -0.469 1.00 41.02 O ATOM 1209 CB LYS B 104 -8.480 15.961 -2.636 1.00 45.25 C ATOM 1210 CG LYS B 104 -9.840 16.197 -3.352 1.00 42.13 C ATOM 1211 CD LYS B 104 -10.167 17.691 -3.596 1.00 60.10 C ATOM 1212 CE LYS B 104 -11.615 17.925 -4.064 1.00 60.01 C ATOM 1213 NZ LYS B 104 -11.900 17.279 -5.369 1.00 10.55 N ATOM 0 H LYS B 104 -6.951 17.988 -1.476 1.00 44.11 H new ATOM 0 HA LYS B 104 -9.401 16.470 -0.751 1.00 1.44 H new ATOM 0 HB2 LYS B 104 -7.691 16.428 -3.226 1.00 45.25 H new ATOM 0 HB3 LYS B 104 -8.276 14.890 -2.622 1.00 45.25 H new ATOM 0 HG2 LYS B 104 -9.831 15.676 -4.309 1.00 42.13 H new ATOM 0 HG3 LYS B 104 -10.636 15.753 -2.754 1.00 42.13 H new ATOM 0 HD2 LYS B 104 -9.994 18.249 -2.676 1.00 60.10 H new ATOM 0 HD3 LYS B 104 -9.481 18.089 -4.344 1.00 60.10 H new ATOM 0 HE2 LYS B 104 -12.304 17.539 -3.313 1.00 60.01 H new ATOM 0 HE3 LYS B 104 -11.799 18.996 -4.144 1.00 60.01 H new ATOM 0 HZ1 LYS B 104 -12.886 17.465 -5.641 1.00 10.55 H new ATOM 0 HZ2 LYS B 104 -11.262 17.665 -6.094 1.00 10.55 H new ATOM 0 HZ3 LYS B 104 -11.751 16.253 -5.288 1.00 10.55 H new ATOM 1227 N GLN B 105 -8.045 14.824 0.560 1.00 73.13 N ATOM 1228 CA GLN B 105 -7.327 13.845 1.409 1.00 61.13 C ATOM 1229 C GLN B 105 -6.619 12.752 0.574 1.00 60.21 C ATOM 1230 O GLN B 105 -5.712 12.081 1.065 1.00 12.44 O ATOM 1231 CB GLN B 105 -8.328 13.209 2.432 1.00 55.23 C ATOM 1232 CG GLN B 105 -9.718 12.823 1.863 1.00 41.54 C ATOM 1233 CD GLN B 105 -9.732 11.739 0.769 1.00 31.52 C ATOM 1234 OE1 GLN B 105 -10.524 11.806 -0.156 1.00 3.30 O ATOM 1235 NE2 GLN B 105 -8.887 10.713 0.887 1.00 24.43 N ATOM 0 H GLN B 105 -9.054 14.820 0.710 1.00 73.13 H new ATOM 0 HA GLN B 105 -6.544 14.376 1.950 1.00 61.13 H new ATOM 0 HB2 GLN B 105 -7.868 12.316 2.854 1.00 55.23 H new ATOM 0 HB3 GLN B 105 -8.474 13.911 3.253 1.00 55.23 H new ATOM 0 HG2 GLN B 105 -10.343 12.483 2.689 1.00 41.54 H new ATOM 0 HG3 GLN B 105 -10.184 13.722 1.459 1.00 41.54 H new ATOM 0 HE21 GLN B 105 -8.233 10.678 1.669 1.00 24.43 H new ATOM 0 HE22 GLN B 105 -8.895 9.964 0.195 1.00 24.43 H new ATOM 1244 N LEU B 106 -7.108 12.563 -0.670 1.00 4.42 N ATOM 1245 CA LEU B 106 -6.596 11.573 -1.619 1.00 1.11 C ATOM 1246 C LEU B 106 -5.185 11.981 -2.085 1.00 43.20 C ATOM 1247 O LEU B 106 -4.968 13.128 -2.495 1.00 74.21 O ATOM 1248 CB LEU B 106 -7.580 11.460 -2.810 1.00 11.44 C ATOM 1249 CG LEU B 106 -7.235 10.401 -3.899 1.00 12.11 C ATOM 1250 CD1 LEU B 106 -7.232 8.962 -3.330 1.00 12.43 C ATOM 1251 CD2 LEU B 106 -8.188 10.538 -5.102 1.00 12.54 C ATOM 0 H LEU B 106 -7.885 13.109 -1.042 1.00 4.42 H new ATOM 0 HA LEU B 106 -6.518 10.596 -1.143 1.00 1.11 H new ATOM 0 HB2 LEU B 106 -8.570 11.232 -2.414 1.00 11.44 H new ATOM 0 HB3 LEU B 106 -7.646 12.436 -3.292 1.00 11.44 H new ATOM 0 HG LEU B 106 -6.220 10.596 -4.245 1.00 12.11 H new ATOM 0 HD11 LEU B 106 -6.987 8.257 -4.124 1.00 12.43 H new ATOM 0 HD12 LEU B 106 -6.489 8.886 -2.536 1.00 12.43 H new ATOM 0 HD13 LEU B 106 -8.218 8.727 -2.929 1.00 12.43 H new ATOM 0 HD21 LEU B 106 -7.934 9.791 -5.854 1.00 12.54 H new ATOM 0 HD22 LEU B 106 -9.215 10.385 -4.772 1.00 12.54 H new ATOM 0 HD23 LEU B 106 -8.090 11.535 -5.532 1.00 12.54 H new ATOM 1263 N LEU B 107 -4.239 11.028 -2.042 1.00 2.22 N ATOM 1264 CA LEU B 107 -2.802 11.329 -2.170 1.00 73.21 C ATOM 1265 C LEU B 107 -1.981 10.053 -2.459 1.00 44.13 C ATOM 1266 O LEU B 107 -2.535 9.011 -2.843 1.00 60.54 O ATOM 1267 CB LEU B 107 -2.307 12.096 -0.878 1.00 54.02 C ATOM 1268 CG LEU B 107 -2.285 11.364 0.550 1.00 55.41 C ATOM 1269 CD1 LEU B 107 -3.191 10.106 0.667 1.00 63.52 C ATOM 1270 CD2 LEU B 107 -0.847 11.033 1.007 1.00 1.32 C ATOM 0 H LEU B 107 -4.445 10.037 -1.919 1.00 2.22 H new ATOM 0 HA LEU B 107 -2.646 11.982 -3.028 1.00 73.21 H new ATOM 0 HB2 LEU B 107 -1.292 12.440 -1.078 1.00 54.02 H new ATOM 0 HB3 LEU B 107 -2.930 12.984 -0.774 1.00 54.02 H new ATOM 0 HG LEU B 107 -2.720 12.102 1.224 1.00 55.41 H new ATOM 0 HD11 LEU B 107 -3.104 9.687 1.669 1.00 63.52 H new ATOM 0 HD12 LEU B 107 -4.228 10.386 0.479 1.00 63.52 H new ATOM 0 HD13 LEU B 107 -2.878 9.362 -0.066 1.00 63.52 H new ATOM 0 HD21 LEU B 107 -0.879 10.539 1.978 1.00 1.32 H new ATOM 0 HD22 LEU B 107 -0.377 10.373 0.278 1.00 1.32 H new ATOM 0 HD23 LEU B 107 -0.270 11.954 1.088 1.00 1.32 H new ATOM 1282 N HIS B 108 -0.649 10.172 -2.314 1.00 44.15 N ATOM 1283 CA HIS B 108 0.300 9.060 -2.470 1.00 44.22 C ATOM 1284 C HIS B 108 0.569 8.426 -1.094 1.00 52.23 C ATOM 1285 O HIS B 108 1.322 8.999 -0.298 1.00 10.43 O ATOM 1286 CB HIS B 108 1.636 9.578 -3.083 1.00 62.02 C ATOM 1287 CG HIS B 108 1.522 10.183 -4.462 1.00 54.23 C ATOM 1288 ND1 HIS B 108 2.613 10.570 -5.214 1.00 42.21 N ATOM 1289 CD2 HIS B 108 0.442 10.496 -5.208 1.00 2.14 C ATOM 1290 CE1 HIS B 108 2.197 11.098 -6.353 1.00 23.43 C ATOM 1291 NE2 HIS B 108 0.883 11.062 -6.371 1.00 64.00 N ATOM 0 H HIS B 108 -0.197 11.057 -2.082 1.00 44.15 H new ATOM 0 HA HIS B 108 -0.127 8.313 -3.140 1.00 44.22 H new ATOM 0 HB2 HIS B 108 2.060 10.324 -2.411 1.00 62.02 H new ATOM 0 HB3 HIS B 108 2.343 8.749 -3.125 1.00 62.02 H new ATOM 0 HD2 HIS B 108 -0.589 10.329 -4.934 1.00 2.14 H new ATOM 0 HE1 HIS B 108 2.829 11.492 -7.135 1.00 23.43 H new ATOM 0 HE2 HIS B 108 0.290 11.401 -7.129 1.00 64.00 H new ATOM 1300 N ILE B 109 -0.072 7.277 -0.800 1.00 32.54 N ATOM 1301 CA ILE B 109 0.116 6.571 0.489 1.00 13.42 C ATOM 1302 C ILE B 109 1.540 5.981 0.582 1.00 42.33 C ATOM 1303 O ILE B 109 2.223 5.810 -0.431 1.00 52.14 O ATOM 1304 CB ILE B 109 -0.950 5.436 0.720 1.00 2.32 C ATOM 1305 CG1 ILE B 109 -0.794 4.290 -0.335 1.00 31.33 C ATOM 1306 CG2 ILE B 109 -2.384 6.026 0.711 1.00 15.22 C ATOM 1307 CD1 ILE B 109 -1.790 3.147 -0.200 1.00 71.43 C ATOM 0 H ILE B 109 -0.724 6.817 -1.435 1.00 32.54 H new ATOM 0 HA ILE B 109 -0.024 7.314 1.275 1.00 13.42 H new ATOM 0 HB ILE B 109 -0.774 4.997 1.702 1.00 2.32 H new ATOM 0 HG12 ILE B 109 -0.891 4.720 -1.332 1.00 31.33 H new ATOM 0 HG13 ILE B 109 0.214 3.883 -0.260 1.00 31.33 H new ATOM 0 HG21 ILE B 109 -3.107 5.227 0.872 1.00 15.22 H new ATOM 0 HG22 ILE B 109 -2.478 6.766 1.506 1.00 15.22 H new ATOM 0 HG23 ILE B 109 -2.576 6.501 -0.251 1.00 15.22 H new ATOM 0 HD11 ILE B 109 -1.600 2.405 -0.975 1.00 71.43 H new ATOM 0 HD12 ILE B 109 -1.681 2.683 0.780 1.00 71.43 H new ATOM 0 HD13 ILE B 109 -2.804 3.533 -0.308 1.00 71.43 H new ATOM 1319 N VAL B 110 1.961 5.642 1.801 1.00 12.21 N ATOM 1320 CA VAL B 110 3.359 5.271 2.103 1.00 12.24 C ATOM 1321 C VAL B 110 3.469 3.816 2.580 1.00 63.51 C ATOM 1322 O VAL B 110 2.680 3.346 3.408 1.00 74.40 O ATOM 1323 CB VAL B 110 3.982 6.263 3.158 1.00 2.14 C ATOM 1324 CG1 VAL B 110 4.483 7.536 2.467 1.00 62.41 C ATOM 1325 CG2 VAL B 110 2.960 6.622 4.269 1.00 0.13 C ATOM 0 H VAL B 110 1.346 5.614 2.615 1.00 12.21 H new ATOM 0 HA VAL B 110 3.930 5.351 1.178 1.00 12.24 H new ATOM 0 HB VAL B 110 4.827 5.760 3.628 1.00 2.14 H new ATOM 0 HG11 VAL B 110 4.910 8.209 3.210 1.00 62.41 H new ATOM 0 HG12 VAL B 110 5.245 7.276 1.733 1.00 62.41 H new ATOM 0 HG13 VAL B 110 3.650 8.030 1.966 1.00 62.41 H new ATOM 0 HG21 VAL B 110 3.421 7.307 4.980 1.00 0.13 H new ATOM 0 HG22 VAL B 110 2.087 7.097 3.821 1.00 0.13 H new ATOM 0 HG23 VAL B 110 2.652 5.714 4.788 1.00 0.13 H new ATOM 1335 N VAL B 111 4.481 3.122 2.038 1.00 44.02 N ATOM 1336 CA VAL B 111 4.777 1.713 2.348 1.00 53.12 C ATOM 1337 C VAL B 111 6.289 1.457 2.205 1.00 23.42 C ATOM 1338 O VAL B 111 6.942 1.994 1.310 1.00 41.43 O ATOM 1339 CB VAL B 111 3.966 0.721 1.420 1.00 61.35 C ATOM 1340 CG1 VAL B 111 4.197 1.019 -0.074 1.00 52.41 C ATOM 1341 CG2 VAL B 111 4.284 -0.761 1.757 1.00 13.22 C ATOM 0 H VAL B 111 5.127 3.529 1.362 1.00 44.02 H new ATOM 0 HA VAL B 111 4.467 1.524 3.376 1.00 53.12 H new ATOM 0 HB VAL B 111 2.908 0.885 1.623 1.00 61.35 H new ATOM 0 HG11 VAL B 111 3.623 0.316 -0.678 1.00 52.41 H new ATOM 0 HG12 VAL B 111 3.875 2.036 -0.296 1.00 52.41 H new ATOM 0 HG13 VAL B 111 5.257 0.915 -0.306 1.00 52.41 H new ATOM 0 HG21 VAL B 111 3.710 -1.415 1.101 1.00 13.22 H new ATOM 0 HG22 VAL B 111 5.348 -0.947 1.613 1.00 13.22 H new ATOM 0 HG23 VAL B 111 4.017 -0.964 2.794 1.00 13.22 H new ATOM 1351 N GLY B 112 6.824 0.630 3.104 1.00 60.22 N ATOM 1352 CA GLY B 112 8.224 0.210 3.073 1.00 50.20 C ATOM 1353 C GLY B 112 8.362 -1.234 3.510 1.00 0.34 C ATOM 1354 O GLY B 112 7.361 -1.960 3.590 1.00 71.51 O ATOM 0 H GLY B 112 6.294 0.231 3.879 1.00 60.22 H new ATOM 0 HA2 GLY B 112 8.622 0.329 2.065 1.00 50.20 H new ATOM 0 HA3 GLY B 112 8.815 0.851 3.727 1.00 50.20 H new ATOM 1358 N GLY B 113 9.597 -1.661 3.777 1.00 25.52 N ATOM 1359 CA GLY B 113 9.865 -3.017 4.258 1.00 62.35 C ATOM 1360 C GLY B 113 11.163 -3.556 3.722 1.00 21.13 C ATOM 1361 O GLY B 113 11.797 -2.908 2.874 1.00 31.34 O ATOM 0 H GLY B 113 10.431 -1.084 3.668 1.00 25.52 H new ATOM 0 HA2 GLY B 113 9.894 -3.016 5.348 1.00 62.35 H new ATOM 0 HA3 GLY B 113 9.048 -3.675 3.962 1.00 62.35 H new ATOM 1365 N GLU B 114 11.562 -4.749 4.209 1.00 12.32 N ATOM 1366 CA GLU B 114 12.852 -5.351 3.856 1.00 23.01 C ATOM 1367 C GLU B 114 12.898 -5.813 2.406 1.00 61.05 C ATOM 1368 O GLU B 114 11.897 -6.256 1.841 1.00 35.20 O ATOM 1369 CB GLU B 114 13.265 -6.493 4.817 1.00 44.21 C ATOM 1370 CG GLU B 114 13.705 -6.004 6.214 1.00 14.14 C ATOM 1371 CD GLU B 114 14.653 -6.988 6.916 1.00 13.30 C ATOM 1372 OE1 GLU B 114 14.175 -7.896 7.623 1.00 2.34 O ATOM 1373 OE2 GLU B 114 15.888 -6.851 6.748 1.00 70.25 O ATOM 0 H GLU B 114 11.003 -5.312 4.850 1.00 12.32 H new ATOM 0 HA GLU B 114 13.588 -4.555 3.971 1.00 23.01 H new ATOM 0 HB2 GLU B 114 12.427 -7.181 4.930 1.00 44.21 H new ATOM 0 HB3 GLU B 114 14.081 -7.057 4.366 1.00 44.21 H new ATOM 0 HG2 GLU B 114 14.199 -5.037 6.117 1.00 14.14 H new ATOM 0 HG3 GLU B 114 12.823 -5.850 6.835 1.00 14.14 H new ATOM 1380 N LEU B 115 14.102 -5.671 1.843 1.00 61.33 N ATOM 1381 CA LEU B 115 14.467 -6.034 0.469 1.00 2.52 C ATOM 1382 C LEU B 115 15.655 -7.009 0.515 1.00 14.12 C ATOM 1383 O LEU B 115 16.473 -6.947 1.434 1.00 5.43 O ATOM 1384 CB LEU B 115 14.833 -4.750 -0.328 1.00 41.13 C ATOM 1385 CG LEU B 115 13.671 -3.727 -0.517 1.00 40.34 C ATOM 1386 CD1 LEU B 115 14.114 -2.490 -1.301 1.00 30.12 C ATOM 1387 CD2 LEU B 115 12.466 -4.378 -1.197 1.00 14.03 C ATOM 0 H LEU B 115 14.889 -5.280 2.360 1.00 61.33 H new ATOM 0 HA LEU B 115 13.629 -6.519 -0.032 1.00 2.52 H new ATOM 0 HB2 LEU B 115 15.656 -4.249 0.181 1.00 41.13 H new ATOM 0 HB3 LEU B 115 15.199 -5.045 -1.312 1.00 41.13 H new ATOM 0 HG LEU B 115 13.377 -3.401 0.481 1.00 40.34 H new ATOM 0 HD11 LEU B 115 13.272 -1.806 -1.408 1.00 30.12 H new ATOM 0 HD12 LEU B 115 14.922 -1.990 -0.766 1.00 30.12 H new ATOM 0 HD13 LEU B 115 14.464 -2.791 -2.288 1.00 30.12 H new ATOM 0 HD21 LEU B 115 11.672 -3.640 -1.315 1.00 14.03 H new ATOM 0 HD22 LEU B 115 12.760 -4.754 -2.177 1.00 14.03 H new ATOM 0 HD23 LEU B 115 12.105 -5.204 -0.585 1.00 14.03 H new ATOM 1399 N LYS B 116 15.723 -7.924 -0.461 1.00 32.32 N ATOM 1400 CA LYS B 116 16.829 -8.911 -0.564 1.00 63.30 C ATOM 1401 C LYS B 116 18.164 -8.192 -0.839 1.00 4.32 C ATOM 1402 O LYS B 116 19.183 -8.439 -0.179 1.00 71.43 O ATOM 1403 CB LYS B 116 16.532 -9.930 -1.696 1.00 11.54 C ATOM 1404 CG LYS B 116 15.198 -10.685 -1.544 1.00 53.11 C ATOM 1405 CD LYS B 116 14.944 -11.670 -2.706 1.00 63.03 C ATOM 1406 CE LYS B 116 13.598 -12.391 -2.582 1.00 42.34 C ATOM 1407 NZ LYS B 116 13.485 -13.215 -1.349 1.00 64.12 N ATOM 0 H LYS B 116 15.025 -8.009 -1.200 1.00 32.32 H new ATOM 0 HA LYS B 116 16.907 -9.446 0.382 1.00 63.30 H new ATOM 0 HB2 LYS B 116 16.530 -9.403 -2.650 1.00 11.54 H new ATOM 0 HB3 LYS B 116 17.343 -10.657 -1.735 1.00 11.54 H new ATOM 0 HG2 LYS B 116 15.198 -11.232 -0.601 1.00 53.11 H new ATOM 0 HG3 LYS B 116 14.380 -9.966 -1.495 1.00 53.11 H new ATOM 0 HD2 LYS B 116 14.976 -11.128 -3.651 1.00 63.03 H new ATOM 0 HD3 LYS B 116 15.746 -12.408 -2.734 1.00 63.03 H new ATOM 0 HE2 LYS B 116 12.796 -11.653 -2.593 1.00 42.34 H new ATOM 0 HE3 LYS B 116 13.454 -13.031 -3.453 1.00 42.34 H new ATOM 0 HZ1 LYS B 116 12.581 -13.729 -1.357 1.00 64.12 H new ATOM 0 HZ2 LYS B 116 14.270 -13.896 -1.313 1.00 64.12 H new ATOM 0 HZ3 LYS B 116 13.524 -12.597 -0.514 1.00 64.12 H new ATOM 1421 N ASP B 117 18.112 -7.276 -1.813 1.00 75.44 N ATOM 1422 CA ASP B 117 19.267 -6.481 -2.269 1.00 60.15 C ATOM 1423 C ASP B 117 18.950 -4.986 -2.051 1.00 14.45 C ATOM 1424 O ASP B 117 17.778 -4.615 -1.929 1.00 45.33 O ATOM 1425 CB ASP B 117 19.539 -6.803 -3.769 1.00 71.33 C ATOM 1426 CG ASP B 117 20.836 -6.182 -4.328 1.00 11.10 C ATOM 1427 OD1 ASP B 117 20.820 -5.008 -4.754 1.00 13.34 O ATOM 1428 OD2 ASP B 117 21.881 -6.867 -4.336 1.00 23.14 O ATOM 0 H ASP B 117 17.252 -7.060 -2.318 1.00 75.44 H new ATOM 0 HA ASP B 117 20.166 -6.727 -1.703 1.00 60.15 H new ATOM 0 HB2 ASP B 117 19.585 -7.885 -3.893 1.00 71.33 H new ATOM 0 HB3 ASP B 117 18.696 -6.450 -4.363 1.00 71.33 H new ATOM 1433 N VAL B 118 19.989 -4.130 -1.983 1.00 74.14 N ATOM 1434 CA VAL B 118 19.807 -2.678 -1.771 1.00 32.04 C ATOM 1435 C VAL B 118 19.180 -2.002 -3.021 1.00 43.45 C ATOM 1436 O VAL B 118 18.177 -1.289 -2.907 1.00 0.53 O ATOM 1437 CB VAL B 118 21.156 -1.977 -1.337 1.00 72.12 C ATOM 1438 CG1 VAL B 118 21.606 -2.469 0.061 1.00 72.22 C ATOM 1439 CG2 VAL B 118 22.285 -2.186 -2.377 1.00 13.13 C ATOM 0 H VAL B 118 20.963 -4.418 -2.072 1.00 74.14 H new ATOM 0 HA VAL B 118 19.106 -2.551 -0.946 1.00 32.04 H new ATOM 0 HB VAL B 118 20.958 -0.906 -1.285 1.00 72.12 H new ATOM 0 HG11 VAL B 118 22.536 -1.973 0.339 1.00 72.22 H new ATOM 0 HG12 VAL B 118 20.836 -2.233 0.795 1.00 72.22 H new ATOM 0 HG13 VAL B 118 21.763 -3.547 0.034 1.00 72.22 H new ATOM 0 HG21 VAL B 118 23.192 -1.686 -2.035 1.00 13.13 H new ATOM 0 HG22 VAL B 118 22.480 -3.252 -2.493 1.00 13.13 H new ATOM 0 HG23 VAL B 118 21.979 -1.767 -3.335 1.00 13.13 H new ATOM 1449 N ALA B 119 19.750 -2.279 -4.206 1.00 33.04 N ATOM 1450 CA ALA B 119 19.251 -1.770 -5.498 1.00 64.44 C ATOM 1451 C ALA B 119 18.123 -2.667 -6.039 1.00 34.35 C ATOM 1452 O ALA B 119 17.297 -2.227 -6.850 1.00 43.33 O ATOM 1453 CB ALA B 119 20.411 -1.689 -6.503 1.00 64.20 C ATOM 0 H ALA B 119 20.578 -2.868 -4.296 1.00 33.04 H new ATOM 0 HA ALA B 119 18.840 -0.771 -5.350 1.00 64.44 H new ATOM 0 HB1 ALA B 119 20.041 -1.313 -7.457 1.00 64.20 H new ATOM 0 HB2 ALA B 119 21.178 -1.015 -6.120 1.00 64.20 H new ATOM 0 HB3 ALA B 119 20.839 -2.681 -6.646 1.00 64.20 H new ATOM 1459 N GLY B 120 18.116 -3.930 -5.582 1.00 15.01 N ATOM 1460 CA GLY B 120 17.105 -4.904 -5.969 1.00 23.40 C ATOM 1461 C GLY B 120 15.875 -4.803 -5.091 1.00 63.53 C ATOM 1462 O GLY B 120 15.861 -5.338 -3.978 1.00 65.04 O ATOM 0 H GLY B 120 18.814 -4.296 -4.935 1.00 15.01 H new ATOM 0 HA2 GLY B 120 16.825 -4.745 -7.010 1.00 23.40 H new ATOM 0 HA3 GLY B 120 17.521 -5.909 -5.901 1.00 23.40 H new ATOM 1466 N VAL B 121 14.838 -4.110 -5.598 1.00 52.54 N ATOM 1467 CA VAL B 121 13.596 -3.837 -4.856 1.00 24.33 C ATOM 1468 C VAL B 121 12.624 -5.031 -4.996 1.00 14.54 C ATOM 1469 O VAL B 121 11.568 -4.950 -5.629 1.00 75.13 O ATOM 1470 CB VAL B 121 12.925 -2.478 -5.308 1.00 24.22 C ATOM 1471 CG1 VAL B 121 11.729 -2.107 -4.393 1.00 73.41 C ATOM 1472 CG2 VAL B 121 13.968 -1.335 -5.349 1.00 22.22 C ATOM 0 H VAL B 121 14.840 -3.722 -6.541 1.00 52.54 H new ATOM 0 HA VAL B 121 13.847 -3.719 -3.802 1.00 24.33 H new ATOM 0 HB VAL B 121 12.537 -2.619 -6.317 1.00 24.22 H new ATOM 0 HG11 VAL B 121 11.290 -1.168 -4.731 1.00 73.41 H new ATOM 0 HG12 VAL B 121 10.978 -2.896 -4.438 1.00 73.41 H new ATOM 0 HG13 VAL B 121 12.077 -1.996 -3.366 1.00 73.41 H new ATOM 0 HG21 VAL B 121 13.483 -0.411 -5.663 1.00 22.22 H new ATOM 0 HG22 VAL B 121 14.399 -1.200 -4.357 1.00 22.22 H new ATOM 0 HG23 VAL B 121 14.758 -1.588 -6.056 1.00 22.22 H new ATOM 1482 N GLU B 122 13.066 -6.173 -4.466 1.00 11.55 N ATOM 1483 CA GLU B 122 12.253 -7.380 -4.287 1.00 50.54 C ATOM 1484 C GLU B 122 12.125 -7.609 -2.791 1.00 43.25 C ATOM 1485 O GLU B 122 13.147 -7.815 -2.122 1.00 62.52 O ATOM 1486 CB GLU B 122 12.920 -8.609 -4.956 1.00 33.31 C ATOM 1487 CG GLU B 122 13.120 -8.477 -6.474 1.00 75.25 C ATOM 1488 CD GLU B 122 13.774 -9.719 -7.095 1.00 52.15 C ATOM 1489 OE1 GLU B 122 13.077 -10.739 -7.266 1.00 12.10 O ATOM 1490 OE2 GLU B 122 14.991 -9.692 -7.389 1.00 74.14 O ATOM 0 H GLU B 122 14.026 -6.288 -4.140 1.00 11.55 H new ATOM 0 HA GLU B 122 11.277 -7.249 -4.754 1.00 50.54 H new ATOM 0 HB2 GLU B 122 13.889 -8.780 -4.488 1.00 33.31 H new ATOM 0 HB3 GLU B 122 12.310 -9.490 -4.758 1.00 33.31 H new ATOM 0 HG2 GLU B 122 12.155 -8.303 -6.950 1.00 75.25 H new ATOM 0 HG3 GLU B 122 13.739 -7.604 -6.680 1.00 75.25 H new ATOM 1497 N PHE B 123 10.890 -7.529 -2.267 1.00 4.41 N ATOM 1498 CA PHE B 123 10.622 -7.655 -0.831 1.00 63.04 C ATOM 1499 C PHE B 123 11.161 -8.983 -0.279 1.00 10.41 C ATOM 1500 O PHE B 123 10.717 -10.053 -0.690 1.00 73.51 O ATOM 1501 CB PHE B 123 9.115 -7.531 -0.541 1.00 14.53 C ATOM 1502 CG PHE B 123 8.472 -6.194 -0.921 1.00 45.00 C ATOM 1503 CD1 PHE B 123 9.154 -4.979 -0.768 1.00 72.33 C ATOM 1504 CD2 PHE B 123 7.168 -6.152 -1.415 1.00 25.02 C ATOM 1505 CE1 PHE B 123 8.547 -3.777 -1.082 1.00 61.14 C ATOM 1506 CE2 PHE B 123 6.569 -4.951 -1.728 1.00 64.03 C ATOM 1507 CZ PHE B 123 7.260 -3.764 -1.574 1.00 22.35 C ATOM 0 H PHE B 123 10.053 -7.375 -2.829 1.00 4.41 H new ATOM 0 HA PHE B 123 11.142 -6.840 -0.327 1.00 63.04 H new ATOM 0 HB2 PHE B 123 8.595 -8.327 -1.073 1.00 14.53 H new ATOM 0 HB3 PHE B 123 8.954 -7.701 0.524 1.00 14.53 H new ATOM 0 HD1 PHE B 123 10.169 -4.982 -0.399 1.00 72.33 H new ATOM 0 HD2 PHE B 123 6.621 -7.073 -1.554 1.00 25.02 H new ATOM 0 HE1 PHE B 123 9.081 -2.849 -0.942 1.00 61.14 H new ATOM 0 HE2 PHE B 123 5.554 -4.937 -2.096 1.00 64.03 H new ATOM 0 HZ PHE B 123 6.792 -2.828 -1.839 1.00 22.35 H new ATOM 1517 N ARG B 124 12.141 -8.865 0.629 1.00 14.51 N ATOM 1518 CA ARG B 124 12.820 -9.990 1.298 1.00 64.12 C ATOM 1519 C ARG B 124 11.811 -11.000 1.856 1.00 61.34 C ATOM 1520 O ARG B 124 11.931 -12.203 1.624 1.00 12.44 O ATOM 1521 CB ARG B 124 13.707 -9.426 2.429 1.00 55.41 C ATOM 1522 CG ARG B 124 14.562 -10.459 3.172 1.00 34.12 C ATOM 1523 CD ARG B 124 15.462 -9.826 4.244 1.00 1.31 C ATOM 1524 NE ARG B 124 16.310 -10.840 4.876 1.00 74.53 N ATOM 1525 CZ ARG B 124 17.023 -10.670 5.992 1.00 35.53 C ATOM 1526 NH1 ARG B 124 17.012 -9.516 6.648 1.00 64.20 N ATOM 1527 NH2 ARG B 124 17.737 -11.677 6.463 1.00 4.10 N ATOM 0 H ARG B 124 12.496 -7.957 0.929 1.00 14.51 H new ATOM 0 HA ARG B 124 13.435 -10.521 0.571 1.00 64.12 H new ATOM 0 HB2 ARG B 124 14.368 -8.669 2.006 1.00 55.41 H new ATOM 0 HB3 ARG B 124 13.067 -8.922 3.153 1.00 55.41 H new ATOM 0 HG2 ARG B 124 13.909 -11.195 3.641 1.00 34.12 H new ATOM 0 HG3 ARG B 124 15.182 -10.995 2.454 1.00 34.12 H new ATOM 0 HD2 ARG B 124 16.085 -9.054 3.793 1.00 1.31 H new ATOM 0 HD3 ARG B 124 14.847 -9.337 5.000 1.00 1.31 H new ATOM 0 HE ARG B 124 16.360 -11.754 4.425 1.00 74.53 H new ATOM 0 HH11 ARG B 124 16.451 -8.738 6.301 1.00 64.20 H new ATOM 0 HH12 ARG B 124 17.564 -9.408 7.499 1.00 64.20 H new ATOM 0 HH21 ARG B 124 17.740 -12.573 5.975 1.00 4.10 H new ATOM 0 HH22 ARG B 124 18.286 -11.559 7.315 1.00 4.10 H new ATOM 1541 N ASP B 125 10.805 -10.464 2.554 1.00 31.34 N ATOM 1542 CA ASP B 125 9.684 -11.234 3.092 1.00 32.24 C ATOM 1543 C ASP B 125 8.450 -10.323 3.141 1.00 43.03 C ATOM 1544 O ASP B 125 8.522 -9.200 3.652 1.00 44.45 O ATOM 1545 CB ASP B 125 10.022 -11.799 4.494 1.00 11.41 C ATOM 1546 CG ASP B 125 8.855 -12.555 5.150 1.00 72.12 C ATOM 1547 OD1 ASP B 125 8.570 -13.701 4.740 1.00 23.12 O ATOM 1548 OD2 ASP B 125 8.223 -12.017 6.074 1.00 72.23 O ATOM 0 H ASP B 125 10.748 -9.467 2.763 1.00 31.34 H new ATOM 0 HA ASP B 125 9.480 -12.089 2.448 1.00 32.24 H new ATOM 0 HB2 ASP B 125 10.877 -12.470 4.410 1.00 11.41 H new ATOM 0 HB3 ASP B 125 10.324 -10.978 5.144 1.00 11.41 H new ATOM 1553 N LEU B 126 7.334 -10.831 2.612 1.00 63.14 N ATOM 1554 CA LEU B 126 6.079 -10.083 2.428 1.00 62.13 C ATOM 1555 C LEU B 126 5.318 -9.818 3.756 1.00 34.33 C ATOM 1556 O LEU B 126 4.278 -9.153 3.747 1.00 75.34 O ATOM 1557 CB LEU B 126 5.175 -10.838 1.411 1.00 1.41 C ATOM 1558 CG LEU B 126 5.782 -11.117 -0.016 1.00 40.35 C ATOM 1559 CD1 LEU B 126 6.406 -9.858 -0.640 1.00 64.33 C ATOM 1560 CD2 LEU B 126 6.759 -12.318 -0.052 1.00 13.13 C ATOM 0 H LEU B 126 7.272 -11.797 2.291 1.00 63.14 H new ATOM 0 HA LEU B 126 6.340 -9.099 2.038 1.00 62.13 H new ATOM 0 HB2 LEU B 126 4.894 -11.794 1.852 1.00 1.41 H new ATOM 0 HB3 LEU B 126 4.257 -10.264 1.282 1.00 1.41 H new ATOM 0 HG LEU B 126 4.933 -11.404 -0.637 1.00 40.35 H new ATOM 0 HD11 LEU B 126 6.811 -10.101 -1.622 1.00 64.33 H new ATOM 0 HD12 LEU B 126 5.643 -9.086 -0.743 1.00 64.33 H new ATOM 0 HD13 LEU B 126 7.207 -9.493 0.002 1.00 64.33 H new ATOM 0 HD21 LEU B 126 7.137 -12.450 -1.066 1.00 13.13 H new ATOM 0 HD22 LEU B 126 7.593 -12.129 0.624 1.00 13.13 H new ATOM 0 HD23 LEU B 126 6.236 -13.222 0.261 1.00 13.13 H new ATOM 1572 N SER B 127 5.823 -10.369 4.879 1.00 4.45 N ATOM 1573 CA SER B 127 5.318 -10.053 6.236 1.00 0.05 C ATOM 1574 C SER B 127 6.271 -9.064 6.942 1.00 54.20 C ATOM 1575 O SER B 127 5.851 -8.323 7.836 1.00 62.24 O ATOM 1576 CB SER B 127 5.158 -11.350 7.065 1.00 52.02 C ATOM 1577 OG SER B 127 4.320 -12.287 6.401 1.00 31.14 O ATOM 0 H SER B 127 6.589 -11.043 4.874 1.00 4.45 H new ATOM 0 HA SER B 127 4.339 -9.582 6.148 1.00 0.05 H new ATOM 0 HB2 SER B 127 6.137 -11.795 7.240 1.00 52.02 H new ATOM 0 HB3 SER B 127 4.737 -11.110 8.042 1.00 52.02 H new ATOM 0 HG SER B 127 4.238 -13.097 6.947 1.00 31.14 H new ATOM 1583 N LYS B 128 7.555 -9.047 6.514 1.00 31.05 N ATOM 1584 CA LYS B 128 8.572 -8.078 7.000 1.00 14.20 C ATOM 1585 C LYS B 128 8.470 -6.722 6.261 1.00 62.11 C ATOM 1586 O LYS B 128 9.380 -5.880 6.365 1.00 3.04 O ATOM 1587 CB LYS B 128 10.001 -8.676 6.857 1.00 4.05 C ATOM 1588 CG LYS B 128 10.299 -9.850 7.819 1.00 72.44 C ATOM 1589 CD LYS B 128 11.746 -10.369 7.670 1.00 54.13 C ATOM 1590 CE LYS B 128 12.097 -11.478 8.674 1.00 33.03 C ATOM 1591 NZ LYS B 128 11.242 -12.681 8.503 1.00 65.31 N ATOM 0 H LYS B 128 7.917 -9.703 5.822 1.00 31.05 H new ATOM 0 HA LYS B 128 8.374 -7.889 8.055 1.00 14.20 H new ATOM 0 HB2 LYS B 128 10.138 -9.018 5.831 1.00 4.05 H new ATOM 0 HB3 LYS B 128 10.732 -7.886 7.029 1.00 4.05 H new ATOM 0 HG2 LYS B 128 10.134 -9.527 8.847 1.00 72.44 H new ATOM 0 HG3 LYS B 128 9.600 -10.664 7.625 1.00 72.44 H new ATOM 0 HD2 LYS B 128 11.887 -10.746 6.657 1.00 54.13 H new ATOM 0 HD3 LYS B 128 12.439 -9.537 7.800 1.00 54.13 H new ATOM 0 HE2 LYS B 128 13.143 -11.758 8.553 1.00 33.03 H new ATOM 0 HE3 LYS B 128 11.985 -11.096 9.689 1.00 33.03 H new ATOM 0 HZ1 LYS B 128 11.547 -13.421 9.167 1.00 65.31 H new ATOM 0 HZ2 LYS B 128 10.250 -12.432 8.694 1.00 65.31 H new ATOM 0 HZ3 LYS B 128 11.329 -13.033 7.528 1.00 65.31 H new ATOM 1605 N VAL B 129 7.369 -6.512 5.507 1.00 5.34 N ATOM 1606 CA VAL B 129 7.054 -5.205 4.911 1.00 34.43 C ATOM 1607 C VAL B 129 6.313 -4.343 5.953 1.00 5.14 C ATOM 1608 O VAL B 129 5.312 -4.777 6.541 1.00 75.23 O ATOM 1609 CB VAL B 129 6.242 -5.321 3.559 1.00 13.25 C ATOM 1610 CG1 VAL B 129 7.069 -6.085 2.503 1.00 42.24 C ATOM 1611 CG2 VAL B 129 4.852 -5.972 3.747 1.00 40.24 C ATOM 0 H VAL B 129 6.683 -7.238 5.299 1.00 5.34 H new ATOM 0 HA VAL B 129 7.992 -4.720 4.639 1.00 34.43 H new ATOM 0 HB VAL B 129 6.061 -4.306 3.207 1.00 13.25 H new ATOM 0 HG11 VAL B 129 6.499 -6.158 1.577 1.00 42.24 H new ATOM 0 HG12 VAL B 129 8.000 -5.551 2.314 1.00 42.24 H new ATOM 0 HG13 VAL B 129 7.293 -7.086 2.871 1.00 42.24 H new ATOM 0 HG21 VAL B 129 4.342 -6.025 2.785 1.00 40.24 H new ATOM 0 HG22 VAL B 129 4.973 -6.978 4.149 1.00 40.24 H new ATOM 0 HG23 VAL B 129 4.260 -5.373 4.439 1.00 40.24 H new ATOM 1621 N GLU B 130 6.857 -3.153 6.238 1.00 32.04 N ATOM 1622 CA GLU B 130 6.273 -2.208 7.197 1.00 53.21 C ATOM 1623 C GLU B 130 5.503 -1.126 6.433 1.00 0.42 C ATOM 1624 O GLU B 130 6.109 -0.229 5.827 1.00 11.03 O ATOM 1625 CB GLU B 130 7.375 -1.576 8.089 1.00 54.53 C ATOM 1626 CG GLU B 130 6.852 -0.499 9.076 1.00 32.31 C ATOM 1627 CD GLU B 130 7.915 0.081 10.026 1.00 24.43 C ATOM 1628 OE1 GLU B 130 9.090 0.191 9.629 1.00 11.25 O ATOM 1629 OE2 GLU B 130 7.565 0.489 11.159 1.00 15.43 O ATOM 0 H GLU B 130 7.719 -2.818 5.807 1.00 32.04 H new ATOM 0 HA GLU B 130 5.585 -2.741 7.853 1.00 53.21 H new ATOM 0 HB2 GLU B 130 7.865 -2.367 8.657 1.00 54.53 H new ATOM 0 HB3 GLU B 130 8.134 -1.128 7.447 1.00 54.53 H new ATOM 0 HG2 GLU B 130 6.415 0.318 8.501 1.00 32.31 H new ATOM 0 HG3 GLU B 130 6.050 -0.933 9.673 1.00 32.31 H new ATOM 1636 N PHE B 131 4.167 -1.240 6.437 1.00 31.11 N ATOM 1637 CA PHE B 131 3.279 -0.229 5.857 1.00 61.31 C ATOM 1638 C PHE B 131 3.359 1.045 6.708 1.00 24.24 C ATOM 1639 O PHE B 131 2.811 1.093 7.816 1.00 13.14 O ATOM 1640 CB PHE B 131 1.823 -0.758 5.784 1.00 75.42 C ATOM 1641 CG PHE B 131 1.673 -2.015 4.929 1.00 51.33 C ATOM 1642 CD1 PHE B 131 1.484 -1.920 3.551 1.00 0.15 C ATOM 1643 CD2 PHE B 131 1.741 -3.288 5.498 1.00 61.24 C ATOM 1644 CE1 PHE B 131 1.363 -3.050 2.770 1.00 53.31 C ATOM 1645 CE2 PHE B 131 1.616 -4.417 4.715 1.00 54.01 C ATOM 1646 CZ PHE B 131 1.434 -4.295 3.352 1.00 75.40 C ATOM 0 H PHE B 131 3.675 -2.036 6.843 1.00 31.11 H new ATOM 0 HA PHE B 131 3.595 -0.003 4.839 1.00 61.31 H new ATOM 0 HB2 PHE B 131 1.471 -0.971 6.793 1.00 75.42 H new ATOM 0 HB3 PHE B 131 1.180 0.025 5.381 1.00 75.42 H new ATOM 0 HD1 PHE B 131 1.432 -0.946 3.088 1.00 0.15 H new ATOM 0 HD2 PHE B 131 1.893 -3.390 6.562 1.00 61.24 H new ATOM 0 HE1 PHE B 131 1.213 -2.958 1.704 1.00 53.31 H new ATOM 0 HE2 PHE B 131 1.661 -5.396 5.168 1.00 54.01 H new ATOM 0 HZ PHE B 131 1.347 -5.180 2.740 1.00 75.40 H new ATOM 1656 N VAL B 132 4.091 2.047 6.196 1.00 11.00 N ATOM 1657 CA VAL B 132 4.294 3.344 6.880 1.00 23.41 C ATOM 1658 C VAL B 132 2.929 4.044 7.126 1.00 41.44 C ATOM 1659 O VAL B 132 2.779 4.858 8.045 1.00 71.55 O ATOM 1660 CB VAL B 132 5.276 4.264 6.052 1.00 53.33 C ATOM 1661 CG1 VAL B 132 5.574 5.608 6.766 1.00 32.33 C ATOM 1662 CG2 VAL B 132 6.588 3.513 5.704 1.00 33.14 C ATOM 0 H VAL B 132 4.562 1.985 5.293 1.00 11.00 H new ATOM 0 HA VAL B 132 4.756 3.160 7.850 1.00 23.41 H new ATOM 0 HB VAL B 132 4.766 4.509 5.120 1.00 53.33 H new ATOM 0 HG11 VAL B 132 6.253 6.202 6.155 1.00 32.33 H new ATOM 0 HG12 VAL B 132 4.644 6.157 6.912 1.00 32.33 H new ATOM 0 HG13 VAL B 132 6.035 5.411 7.734 1.00 32.33 H new ATOM 0 HG21 VAL B 132 7.244 4.171 5.134 1.00 33.14 H new ATOM 0 HG22 VAL B 132 7.088 3.210 6.624 1.00 33.14 H new ATOM 0 HG23 VAL B 132 6.355 2.630 5.109 1.00 33.14 H new ATOM 1672 N GLY B 133 1.936 3.685 6.298 1.00 63.51 N ATOM 1673 CA GLY B 133 0.544 4.053 6.515 1.00 15.21 C ATOM 1674 C GLY B 133 0.040 4.975 5.429 1.00 23.12 C ATOM 1675 O GLY B 133 0.305 4.748 4.242 1.00 74.51 O ATOM 0 H GLY B 133 2.086 3.128 5.457 1.00 63.51 H new ATOM 0 HA2 GLY B 133 -0.071 3.154 6.545 1.00 15.21 H new ATOM 0 HA3 GLY B 133 0.442 4.541 7.484 1.00 15.21 H new ATOM 1679 N ALA B 134 -0.674 6.018 5.830 1.00 25.31 N ATOM 1680 CA ALA B 134 -1.218 7.021 4.917 1.00 2.32 C ATOM 1681 C ALA B 134 -1.459 8.316 5.680 1.00 45.12 C ATOM 1682 O ALA B 134 -1.658 8.302 6.905 1.00 73.44 O ATOM 1683 CB ALA B 134 -2.513 6.512 4.277 1.00 21.24 C ATOM 0 H ALA B 134 -0.896 6.196 6.810 1.00 25.31 H new ATOM 0 HA ALA B 134 -0.504 7.211 4.116 1.00 2.32 H new ATOM 0 HB1 ALA B 134 -2.906 7.270 3.600 1.00 21.24 H new ATOM 0 HB2 ALA B 134 -2.309 5.598 3.720 1.00 21.24 H new ATOM 0 HB3 ALA B 134 -3.247 6.305 5.056 1.00 21.24 H new ATOM 1689 N TYR B 135 -1.440 9.430 4.952 1.00 14.10 N ATOM 1690 CA TYR B 135 -1.527 10.779 5.524 1.00 14.23 C ATOM 1691 C TYR B 135 -2.601 11.585 4.775 1.00 42.40 C ATOM 1692 O TYR B 135 -2.898 11.265 3.635 1.00 24.10 O ATOM 1693 CB TYR B 135 -0.134 11.446 5.432 1.00 40.24 C ATOM 1694 CG TYR B 135 0.892 10.851 6.412 1.00 2.04 C ATOM 1695 CD1 TYR B 135 1.012 11.345 7.714 1.00 64.02 C ATOM 1696 CD2 TYR B 135 1.738 9.800 6.045 1.00 71.41 C ATOM 1697 CE1 TYR B 135 1.930 10.817 8.603 1.00 22.34 C ATOM 1698 CE2 TYR B 135 2.653 9.270 6.938 1.00 11.42 C ATOM 1699 CZ TYR B 135 2.748 9.785 8.211 1.00 61.32 C ATOM 1700 OH TYR B 135 3.676 9.277 9.095 1.00 32.23 O ATOM 0 H TYR B 135 -1.363 9.425 3.935 1.00 14.10 H new ATOM 0 HA TYR B 135 -1.820 10.738 6.573 1.00 14.23 H new ATOM 0 HB2 TYR B 135 0.244 11.343 4.415 1.00 40.24 H new ATOM 0 HB3 TYR B 135 -0.236 12.513 5.628 1.00 40.24 H new ATOM 0 HD1 TYR B 135 0.374 12.156 8.032 1.00 64.02 H new ATOM 0 HD2 TYR B 135 1.676 9.394 5.046 1.00 71.41 H new ATOM 0 HE1 TYR B 135 2.004 11.215 9.604 1.00 22.34 H new ATOM 0 HE2 TYR B 135 3.292 8.453 6.636 1.00 11.42 H new ATOM 0 HH TYR B 135 4.174 8.551 8.665 1.00 32.23 H new ATOM 1710 N PRO B 136 -3.211 12.647 5.395 1.00 74.31 N ATOM 1711 CA PRO B 136 -4.338 13.400 4.770 1.00 25.41 C ATOM 1712 C PRO B 136 -3.898 14.353 3.635 1.00 32.24 C ATOM 1713 O PRO B 136 -4.739 15.027 3.035 1.00 33.21 O ATOM 1714 CB PRO B 136 -4.916 14.183 5.970 1.00 34.34 C ATOM 1715 CG PRO B 136 -3.727 14.447 6.842 1.00 53.24 C ATOM 1716 CD PRO B 136 -2.870 13.202 6.744 1.00 1.23 C ATOM 0 HA PRO B 136 -5.050 12.738 4.277 1.00 25.41 H new ATOM 0 HB2 PRO B 136 -5.389 15.111 5.650 1.00 34.34 H new ATOM 0 HB3 PRO B 136 -5.675 13.603 6.496 1.00 34.34 H new ATOM 0 HG2 PRO B 136 -3.180 15.327 6.504 1.00 53.24 H new ATOM 0 HG3 PRO B 136 -4.030 14.635 7.872 1.00 53.24 H new ATOM 0 HD2 PRO B 136 -1.809 13.438 6.824 1.00 1.23 H new ATOM 0 HD3 PRO B 136 -3.100 12.493 7.539 1.00 1.23 H new ATOM 1724 N SER B 137 -2.589 14.397 3.345 1.00 12.14 N ATOM 1725 CA SER B 137 -2.022 15.319 2.356 1.00 51.04 C ATOM 1726 C SER B 137 -0.705 14.747 1.819 1.00 25.31 C ATOM 1727 O SER B 137 -0.024 13.975 2.523 1.00 2.04 O ATOM 1728 CB SER B 137 -1.811 16.712 2.993 1.00 62.22 C ATOM 1729 OG SER B 137 -1.538 17.698 2.011 1.00 74.15 O ATOM 0 H SER B 137 -1.897 13.794 3.790 1.00 12.14 H new ATOM 0 HA SER B 137 -2.713 15.434 1.521 1.00 51.04 H new ATOM 0 HB2 SER B 137 -2.701 16.994 3.556 1.00 62.22 H new ATOM 0 HB3 SER B 137 -0.986 16.667 3.704 1.00 62.22 H new ATOM 0 HG SER B 137 -1.411 18.567 2.446 1.00 74.15 H new ATOM 1735 N TYR B 138 -0.354 15.144 0.579 1.00 74.25 N ATOM 1736 CA TYR B 138 0.768 14.559 -0.166 1.00 13.13 C ATOM 1737 C TYR B 138 2.112 14.736 0.566 1.00 61.13 C ATOM 1738 O TYR B 138 2.821 13.752 0.763 1.00 72.33 O ATOM 1739 CB TYR B 138 0.847 15.143 -1.601 1.00 22.54 C ATOM 1740 CG TYR B 138 2.039 14.624 -2.438 1.00 43.33 C ATOM 1741 CD1 TYR B 138 2.347 13.257 -2.489 1.00 4.14 C ATOM 1742 CD2 TYR B 138 2.868 15.493 -3.156 1.00 51.03 C ATOM 1743 CE1 TYR B 138 3.424 12.794 -3.214 1.00 10.55 C ATOM 1744 CE2 TYR B 138 3.944 15.020 -3.888 1.00 35.13 C ATOM 1745 CZ TYR B 138 4.215 13.670 -3.906 1.00 10.41 C ATOM 1746 OH TYR B 138 5.278 13.184 -4.627 1.00 34.44 O ATOM 0 H TYR B 138 -0.844 15.880 0.070 1.00 74.25 H new ATOM 0 HA TYR B 138 0.576 13.488 -0.235 1.00 13.13 H new ATOM 0 HB2 TYR B 138 -0.079 14.910 -2.126 1.00 22.54 H new ATOM 0 HB3 TYR B 138 0.911 16.229 -1.535 1.00 22.54 H new ATOM 0 HD1 TYR B 138 1.729 12.554 -1.950 1.00 4.14 H new ATOM 0 HD2 TYR B 138 2.665 16.554 -3.139 1.00 51.03 H new ATOM 0 HE1 TYR B 138 3.644 11.737 -3.236 1.00 10.55 H new ATOM 0 HE2 TYR B 138 4.567 15.706 -4.442 1.00 35.13 H new ATOM 0 HH TYR B 138 5.744 13.927 -5.064 1.00 34.44 H new ATOM 1756 N ASP B 139 2.439 15.986 0.966 1.00 34.23 N ATOM 1757 CA ASP B 139 3.762 16.333 1.545 1.00 5.25 C ATOM 1758 C ASP B 139 4.010 15.600 2.877 1.00 31.44 C ATOM 1759 O ASP B 139 5.152 15.274 3.194 1.00 44.23 O ATOM 1760 CB ASP B 139 3.911 17.872 1.724 1.00 2.53 C ATOM 1761 CG ASP B 139 5.331 18.312 2.148 1.00 72.02 C ATOM 1762 OD1 ASP B 139 5.633 18.355 3.360 1.00 3.34 O ATOM 1763 OD2 ASP B 139 6.153 18.621 1.261 1.00 71.42 O ATOM 0 H ASP B 139 1.801 16.779 0.898 1.00 34.23 H new ATOM 0 HA ASP B 139 4.522 15.998 0.838 1.00 5.25 H new ATOM 0 HB2 ASP B 139 3.652 18.365 0.787 1.00 2.53 H new ATOM 0 HB3 ASP B 139 3.196 18.213 2.472 1.00 2.53 H new ATOM 1768 N GLU B 140 2.925 15.322 3.627 1.00 13.24 N ATOM 1769 CA GLU B 140 3.001 14.572 4.900 1.00 5.24 C ATOM 1770 C GLU B 140 3.522 13.141 4.666 1.00 51.43 C ATOM 1771 O GLU B 140 4.305 12.611 5.467 1.00 0.31 O ATOM 1772 CB GLU B 140 1.613 14.516 5.585 1.00 2.24 C ATOM 1773 CG GLU B 140 1.019 15.875 5.974 1.00 63.22 C ATOM 1774 CD GLU B 140 1.905 16.673 6.951 1.00 43.25 C ATOM 1775 OE1 GLU B 140 1.813 16.435 8.178 1.00 73.53 O ATOM 1776 OE2 GLU B 140 2.692 17.539 6.504 1.00 53.00 O ATOM 0 H GLU B 140 1.979 15.607 3.372 1.00 13.24 H new ATOM 0 HA GLU B 140 3.699 15.096 5.553 1.00 5.24 H new ATOM 0 HB2 GLU B 140 0.916 14.011 4.916 1.00 2.24 H new ATOM 0 HB3 GLU B 140 1.694 13.903 6.483 1.00 2.24 H new ATOM 0 HG2 GLU B 140 0.862 16.466 5.072 1.00 63.22 H new ATOM 0 HG3 GLU B 140 0.040 15.719 6.427 1.00 63.22 H new ATOM 1783 N ALA B 141 3.073 12.526 3.557 1.00 22.42 N ATOM 1784 CA ALA B 141 3.479 11.175 3.170 1.00 21.25 C ATOM 1785 C ALA B 141 4.842 11.211 2.464 1.00 31.02 C ATOM 1786 O ALA B 141 5.710 10.358 2.693 1.00 52.32 O ATOM 1787 CB ALA B 141 2.394 10.581 2.278 1.00 11.53 C ATOM 0 H ALA B 141 2.417 12.958 2.907 1.00 22.42 H new ATOM 0 HA ALA B 141 3.594 10.545 4.052 1.00 21.25 H new ATOM 0 HB1 ALA B 141 2.680 9.573 1.979 1.00 11.53 H new ATOM 0 HB2 ALA B 141 1.452 10.544 2.826 1.00 11.53 H new ATOM 0 HB3 ALA B 141 2.273 11.202 1.390 1.00 11.53 H new ATOM 1793 N HIS B 142 5.032 12.261 1.654 1.00 12.21 N ATOM 1794 CA HIS B 142 6.245 12.469 0.860 1.00 22.12 C ATOM 1795 C HIS B 142 7.444 12.720 1.791 1.00 21.32 C ATOM 1796 O HIS B 142 8.580 12.416 1.446 1.00 50.14 O ATOM 1797 CB HIS B 142 6.031 13.649 -0.129 1.00 25.52 C ATOM 1798 CG HIS B 142 7.121 13.854 -1.156 1.00 1.42 C ATOM 1799 ND1 HIS B 142 7.185 14.975 -1.954 1.00 21.42 N ATOM 1800 CD2 HIS B 142 8.173 13.080 -1.532 1.00 75.33 C ATOM 1801 CE1 HIS B 142 8.214 14.879 -2.765 1.00 44.11 C ATOM 1802 NE2 HIS B 142 8.827 13.743 -2.530 1.00 10.34 N ATOM 0 H HIS B 142 4.337 12.998 1.532 1.00 12.21 H new ATOM 0 HA HIS B 142 6.459 11.575 0.274 1.00 22.12 H new ATOM 0 HB2 HIS B 142 5.089 13.492 -0.654 1.00 25.52 H new ATOM 0 HB3 HIS B 142 5.925 14.567 0.448 1.00 25.52 H new ATOM 0 HD1 HIS B 142 6.534 15.759 -1.920 1.00 21.42 H new ATOM 0 HD2 HIS B 142 8.442 12.119 -1.118 1.00 75.33 H new ATOM 0 HE1 HIS B 142 8.506 15.612 -3.502 1.00 44.11 H new ATOM 1811 N LYS B 143 7.165 13.264 2.979 1.00 74.21 N ATOM 1812 CA LYS B 143 8.185 13.506 4.005 1.00 71.43 C ATOM 1813 C LYS B 143 8.429 12.237 4.834 1.00 23.32 C ATOM 1814 O LYS B 143 9.566 11.970 5.236 1.00 51.31 O ATOM 1815 CB LYS B 143 7.748 14.670 4.928 1.00 2.51 C ATOM 1816 CG LYS B 143 8.871 15.224 5.829 1.00 23.22 C ATOM 1817 CD LYS B 143 10.063 15.800 5.022 1.00 44.34 C ATOM 1818 CE LYS B 143 9.643 16.931 4.054 1.00 52.14 C ATOM 1819 NZ LYS B 143 8.845 17.991 4.729 1.00 3.44 N ATOM 0 H LYS B 143 6.226 13.549 3.257 1.00 74.21 H new ATOM 0 HA LYS B 143 9.116 13.779 3.508 1.00 71.43 H new ATOM 0 HB2 LYS B 143 7.360 15.481 4.311 1.00 2.51 H new ATOM 0 HB3 LYS B 143 6.927 14.329 5.559 1.00 2.51 H new ATOM 0 HG2 LYS B 143 8.463 16.004 6.471 1.00 23.22 H new ATOM 0 HG3 LYS B 143 9.231 14.429 6.482 1.00 23.22 H new ATOM 0 HD2 LYS B 143 10.814 16.181 5.714 1.00 44.34 H new ATOM 0 HD3 LYS B 143 10.532 14.997 4.453 1.00 44.34 H new ATOM 0 HE2 LYS B 143 10.534 17.377 3.613 1.00 52.14 H new ATOM 0 HE3 LYS B 143 9.060 16.507 3.236 1.00 52.14 H new ATOM 0 HZ1 LYS B 143 8.704 18.788 4.076 1.00 3.44 H new ATOM 0 HZ2 LYS B 143 7.921 17.605 5.009 1.00 3.44 H new ATOM 0 HZ3 LYS B 143 9.352 18.322 5.575 1.00 3.44 H new ATOM 1833 N ALA B 144 7.343 11.464 5.069 1.00 33.03 N ATOM 1834 CA ALA B 144 7.364 10.249 5.912 1.00 25.53 C ATOM 1835 C ALA B 144 8.366 9.200 5.411 1.00 75.22 C ATOM 1836 O ALA B 144 8.934 8.467 6.212 1.00 74.50 O ATOM 1837 CB ALA B 144 5.967 9.634 5.995 1.00 70.21 C ATOM 0 H ALA B 144 6.424 11.668 4.676 1.00 33.03 H new ATOM 0 HA ALA B 144 7.688 10.561 6.905 1.00 25.53 H new ATOM 0 HB1 ALA B 144 5.999 8.741 6.619 1.00 70.21 H new ATOM 0 HB2 ALA B 144 5.277 10.356 6.431 1.00 70.21 H new ATOM 0 HB3 ALA B 144 5.628 9.366 4.995 1.00 70.21 H new ATOM 1843 N TRP B 145 8.549 9.145 4.081 1.00 32.34 N ATOM 1844 CA TRP B 145 9.530 8.265 3.412 1.00 3.10 C ATOM 1845 C TRP B 145 10.958 8.468 4.003 1.00 52.35 C ATOM 1846 O TRP B 145 11.618 7.502 4.412 1.00 74.42 O ATOM 1847 CB TRP B 145 9.463 8.525 1.855 1.00 34.21 C ATOM 1848 CG TRP B 145 10.799 8.576 1.128 1.00 60.13 C ATOM 1849 CD1 TRP B 145 11.550 7.527 0.676 1.00 44.41 C ATOM 1850 CD2 TRP B 145 11.539 9.762 0.797 1.00 25.31 C ATOM 1851 NE1 TRP B 145 12.716 7.989 0.116 1.00 5.34 N ATOM 1852 CE2 TRP B 145 12.729 9.355 0.174 1.00 3.44 C ATOM 1853 CE3 TRP B 145 11.305 11.130 0.979 1.00 31.30 C ATOM 1854 CZ2 TRP B 145 13.684 10.270 -0.269 1.00 24.34 C ATOM 1855 CZ3 TRP B 145 12.244 12.031 0.538 1.00 55.55 C ATOM 1856 CH2 TRP B 145 13.419 11.601 -0.075 1.00 11.42 C ATOM 0 H TRP B 145 8.013 9.718 3.429 1.00 32.34 H new ATOM 0 HA TRP B 145 9.283 7.219 3.593 1.00 3.10 H new ATOM 0 HB2 TRP B 145 8.855 7.742 1.402 1.00 34.21 H new ATOM 0 HB3 TRP B 145 8.944 9.469 1.686 1.00 34.21 H new ATOM 0 HD1 TRP B 145 11.268 6.487 0.749 1.00 44.41 H new ATOM 0 HE1 TRP B 145 13.454 7.406 -0.280 1.00 5.34 H new ATOM 0 HE3 TRP B 145 10.400 11.472 1.459 1.00 31.30 H new ATOM 0 HZ2 TRP B 145 14.596 9.943 -0.746 1.00 24.34 H new ATOM 0 HZ3 TRP B 145 12.069 13.089 0.669 1.00 55.55 H new ATOM 0 HH2 TRP B 145 14.139 12.335 -0.406 1.00 11.42 H new ATOM 1867 N LYS B 146 11.407 9.739 4.054 1.00 0.12 N ATOM 1868 CA LYS B 146 12.772 10.105 4.516 1.00 13.30 C ATOM 1869 C LYS B 146 12.837 10.215 6.039 1.00 54.00 C ATOM 1870 O LYS B 146 13.897 9.995 6.630 1.00 42.40 O ATOM 1871 CB LYS B 146 13.206 11.417 3.823 1.00 3.40 C ATOM 1872 CG LYS B 146 14.597 11.974 4.188 1.00 2.11 C ATOM 1873 CD LYS B 146 15.048 13.117 3.232 1.00 61.20 C ATOM 1874 CE LYS B 146 16.384 13.748 3.653 1.00 22.52 C ATOM 1875 NZ LYS B 146 16.255 14.499 4.927 1.00 33.23 N ATOM 0 H LYS B 146 10.840 10.541 3.778 1.00 0.12 H new ATOM 0 HA LYS B 146 13.469 9.315 4.238 1.00 13.30 H new ATOM 0 HB2 LYS B 146 13.177 11.256 2.745 1.00 3.40 H new ATOM 0 HB3 LYS B 146 12.464 12.182 4.051 1.00 3.40 H new ATOM 0 HG2 LYS B 146 14.579 12.347 5.212 1.00 2.11 H new ATOM 0 HG3 LYS B 146 15.329 11.167 4.155 1.00 2.11 H new ATOM 0 HD2 LYS B 146 15.139 12.724 2.220 1.00 61.20 H new ATOM 0 HD3 LYS B 146 14.278 13.888 3.206 1.00 61.20 H new ATOM 0 HE2 LYS B 146 17.137 12.968 3.764 1.00 22.52 H new ATOM 0 HE3 LYS B 146 16.734 14.419 2.868 1.00 22.52 H new ATOM 0 HZ1 LYS B 146 16.422 15.510 4.752 1.00 33.23 H new ATOM 0 HZ2 LYS B 146 15.298 14.368 5.312 1.00 33.23 H new ATOM 0 HZ3 LYS B 146 16.955 14.146 5.611 1.00 33.23 H new ATOM 1889 N ALA B 147 11.692 10.539 6.662 1.00 15.23 N ATOM 1890 CA ALA B 147 11.552 10.535 8.125 1.00 44.31 C ATOM 1891 C ALA B 147 11.791 9.117 8.669 1.00 53.45 C ATOM 1892 O ALA B 147 12.452 8.941 9.688 1.00 44.43 O ATOM 1893 CB ALA B 147 10.168 11.064 8.536 1.00 62.10 C ATOM 0 H ALA B 147 10.842 10.810 6.167 1.00 15.23 H new ATOM 0 HA ALA B 147 12.301 11.199 8.557 1.00 44.31 H new ATOM 0 HB1 ALA B 147 10.083 11.054 9.623 1.00 62.10 H new ATOM 0 HB2 ALA B 147 10.046 12.084 8.172 1.00 62.10 H new ATOM 0 HB3 ALA B 147 9.393 10.430 8.105 1.00 62.10 H new ATOM 1899 N LYS B 148 11.276 8.114 7.928 1.00 45.42 N ATOM 1900 CA LYS B 148 11.455 6.689 8.243 1.00 70.42 C ATOM 1901 C LYS B 148 12.888 6.246 7.950 1.00 51.45 C ATOM 1902 O LYS B 148 13.508 5.605 8.788 1.00 13.24 O ATOM 1903 CB LYS B 148 10.449 5.833 7.426 1.00 25.54 C ATOM 1904 CG LYS B 148 8.999 5.876 7.948 1.00 3.03 C ATOM 1905 CD LYS B 148 8.826 5.205 9.324 1.00 55.10 C ATOM 1906 CE LYS B 148 9.231 3.725 9.300 1.00 12.42 C ATOM 1907 NZ LYS B 148 8.949 3.045 10.588 1.00 42.11 N ATOM 0 H LYS B 148 10.720 8.276 7.088 1.00 45.42 H new ATOM 0 HA LYS B 148 11.263 6.543 9.306 1.00 70.42 H new ATOM 0 HB2 LYS B 148 10.459 6.174 6.391 1.00 25.54 H new ATOM 0 HB3 LYS B 148 10.790 4.798 7.424 1.00 25.54 H new ATOM 0 HG2 LYS B 148 8.675 6.915 8.015 1.00 3.03 H new ATOM 0 HG3 LYS B 148 8.346 5.384 7.227 1.00 3.03 H new ATOM 0 HD2 LYS B 148 9.429 5.733 10.063 1.00 55.10 H new ATOM 0 HD3 LYS B 148 7.786 5.291 9.640 1.00 55.10 H new ATOM 0 HE2 LYS B 148 8.696 3.217 8.498 1.00 12.42 H new ATOM 0 HE3 LYS B 148 10.294 3.645 9.074 1.00 12.42 H new ATOM 0 HZ1 LYS B 148 9.417 2.116 10.600 1.00 42.11 H new ATOM 0 HZ2 LYS B 148 9.310 3.625 11.373 1.00 42.11 H new ATOM 0 HZ3 LYS B 148 7.923 2.917 10.695 1.00 42.11 H new ATOM 1921 N ALA B 149 13.391 6.612 6.756 1.00 72.50 N ATOM 1922 CA ALA B 149 14.739 6.228 6.284 1.00 3.12 C ATOM 1923 C ALA B 149 15.834 6.678 7.279 1.00 63.02 C ATOM 1924 O ALA B 149 16.744 5.906 7.618 1.00 41.23 O ATOM 1925 CB ALA B 149 14.989 6.814 4.883 1.00 4.33 C ATOM 0 H ALA B 149 12.874 7.184 6.088 1.00 72.50 H new ATOM 0 HA ALA B 149 14.787 5.141 6.223 1.00 3.12 H new ATOM 0 HB1 ALA B 149 15.984 6.528 4.541 1.00 4.33 H new ATOM 0 HB2 ALA B 149 14.242 6.429 4.189 1.00 4.33 H new ATOM 0 HB3 ALA B 149 14.919 7.901 4.925 1.00 4.33 H new ATOM 1931 N GLN B 150 15.699 7.927 7.761 1.00 2.10 N ATOM 1932 CA GLN B 150 16.627 8.541 8.736 1.00 21.24 C ATOM 1933 C GLN B 150 16.383 8.013 10.162 1.00 20.12 C ATOM 1934 O GLN B 150 17.318 7.959 10.964 1.00 32.13 O ATOM 1935 CB GLN B 150 16.491 10.088 8.708 1.00 1.03 C ATOM 1936 CG GLN B 150 16.986 10.758 7.410 1.00 14.13 C ATOM 1937 CD GLN B 150 16.795 12.284 7.383 1.00 52.13 C ATOM 1938 OE1 GLN B 150 17.621 13.012 6.835 1.00 73.10 O ATOM 1939 NE2 GLN B 150 15.674 12.774 7.902 1.00 33.31 N ATOM 0 H GLN B 150 14.937 8.546 7.484 1.00 2.10 H new ATOM 0 HA GLN B 150 17.641 8.264 8.447 1.00 21.24 H new ATOM 0 HB2 GLN B 150 15.443 10.349 8.858 1.00 1.03 H new ATOM 0 HB3 GLN B 150 17.047 10.503 9.549 1.00 1.03 H new ATOM 0 HG2 GLN B 150 18.044 10.532 7.277 1.00 14.13 H new ATOM 0 HG3 GLN B 150 16.458 10.321 6.563 1.00 14.13 H new ATOM 0 HE21 GLN B 150 15.004 12.149 8.351 1.00 33.31 H new ATOM 0 HE22 GLN B 150 15.483 13.775 7.851 1.00 33.31 H new ATOM 1948 N ALA B 151 15.125 7.643 10.475 1.00 30.22 N ATOM 1949 CA ALA B 151 14.767 7.073 11.797 1.00 54.14 C ATOM 1950 C ALA B 151 15.371 5.676 11.958 1.00 53.13 C ATOM 1951 O ALA B 151 15.800 5.292 13.046 1.00 61.11 O ATOM 1952 CB ALA B 151 13.239 7.013 11.980 1.00 52.13 C ATOM 0 H ALA B 151 14.337 7.727 9.833 1.00 30.22 H new ATOM 0 HA ALA B 151 15.178 7.727 12.566 1.00 54.14 H new ATOM 0 HB1 ALA B 151 13.006 6.591 12.958 1.00 52.13 H new ATOM 0 HB2 ALA B 151 12.824 8.019 11.911 1.00 52.13 H new ATOM 0 HB3 ALA B 151 12.804 6.387 11.201 1.00 52.13 H new ATOM 1958 N THR B 152 15.417 4.938 10.846 1.00 64.43 N ATOM 1959 CA THR B 152 15.867 3.552 10.815 1.00 60.50 C ATOM 1960 C THR B 152 17.370 3.491 10.437 1.00 54.34 C ATOM 1961 O THR B 152 17.741 3.298 9.273 1.00 41.01 O ATOM 1962 CB THR B 152 14.954 2.732 9.835 1.00 3.30 C ATOM 1963 OG1 THR B 152 14.997 3.287 8.506 1.00 12.25 O ATOM 1964 CG2 THR B 152 13.490 2.705 10.320 1.00 74.21 C ATOM 0 H THR B 152 15.138 5.295 9.932 1.00 64.43 H new ATOM 0 HA THR B 152 15.775 3.098 11.802 1.00 60.50 H new ATOM 0 HB THR B 152 15.341 1.713 9.817 1.00 3.30 H new ATOM 0 HG1 THR B 152 14.465 4.110 8.478 1.00 12.25 H new ATOM 0 HG21 THR B 152 12.885 2.130 9.619 1.00 74.21 H new ATOM 0 HG22 THR B 152 13.442 2.243 11.306 1.00 74.21 H new ATOM 0 HG23 THR B 152 13.107 3.724 10.378 1.00 74.21 H new ATOM 1972 N VAL B 153 18.228 3.742 11.448 1.00 43.51 N ATOM 1973 CA VAL B 153 19.701 3.737 11.305 1.00 14.42 C ATOM 1974 C VAL B 153 20.255 2.326 11.568 1.00 62.51 C ATOM 1975 O VAL B 153 21.092 1.824 10.807 1.00 11.33 O ATOM 1976 CB VAL B 153 20.379 4.775 12.278 1.00 24.12 C ATOM 1977 CG1 VAL B 153 21.912 4.828 12.074 1.00 42.42 C ATOM 1978 CG2 VAL B 153 19.742 6.179 12.126 1.00 5.43 C ATOM 0 H VAL B 153 17.916 3.956 12.395 1.00 43.51 H new ATOM 0 HA VAL B 153 19.938 4.032 10.283 1.00 14.42 H new ATOM 0 HB VAL B 153 20.199 4.436 13.298 1.00 24.12 H new ATOM 0 HG11 VAL B 153 22.346 5.554 12.762 1.00 42.42 H new ATOM 0 HG12 VAL B 153 22.339 3.844 12.268 1.00 42.42 H new ATOM 0 HG13 VAL B 153 22.133 5.123 11.048 1.00 42.42 H new ATOM 0 HG21 VAL B 153 20.229 6.875 12.809 1.00 5.43 H new ATOM 0 HG22 VAL B 153 19.869 6.527 11.101 1.00 5.43 H new ATOM 0 HG23 VAL B 153 18.679 6.124 12.361 1.00 5.43 H new ATOM 1988 N ASP B 154 19.741 1.686 12.641 1.00 74.13 N ATOM 1989 CA ASP B 154 20.097 0.291 13.011 1.00 11.01 C ATOM 1990 C ASP B 154 19.605 -0.711 11.948 1.00 60.14 C ATOM 1991 O ASP B 154 20.045 -1.868 11.917 1.00 75.24 O ATOM 1992 CB ASP B 154 19.470 -0.097 14.375 1.00 1.22 C ATOM 1993 CG ASP B 154 19.888 0.811 15.544 1.00 4.02 C ATOM 1994 OD1 ASP B 154 21.063 0.771 15.958 1.00 12.11 O ATOM 1995 OD2 ASP B 154 19.029 1.562 16.063 1.00 22.00 O ATOM 0 H ASP B 154 19.069 2.117 13.276 1.00 74.13 H new ATOM 0 HA ASP B 154 21.184 0.248 13.077 1.00 11.01 H new ATOM 0 HB2 ASP B 154 18.384 -0.074 14.282 1.00 1.22 H new ATOM 0 HB3 ASP B 154 19.748 -1.124 14.611 1.00 1.22 H new ATOM 2000 N ASN B 155 18.661 -0.235 11.118 1.00 21.15 N ATOM 2001 CA ASN B 155 17.999 -1.005 10.065 1.00 34.52 C ATOM 2002 C ASN B 155 18.998 -1.649 9.089 1.00 42.14 C ATOM 2003 O ASN B 155 19.997 -1.031 8.705 1.00 12.43 O ATOM 2004 CB ASN B 155 17.039 -0.080 9.299 1.00 61.04 C ATOM 2005 CG ASN B 155 16.131 -0.833 8.342 1.00 63.32 C ATOM 2006 OD1 ASN B 155 16.468 -1.051 7.178 1.00 0.11 O ATOM 2007 ND2 ASN B 155 14.979 -1.244 8.846 1.00 52.24 N ATOM 0 H ASN B 155 18.331 0.729 11.168 1.00 21.15 H new ATOM 0 HA ASN B 155 17.451 -1.819 10.539 1.00 34.52 H new ATOM 0 HB2 ASN B 155 16.428 0.473 10.013 1.00 61.04 H new ATOM 0 HB3 ASN B 155 17.619 0.654 8.740 1.00 61.04 H new ATOM 0 HD21 ASN B 155 14.325 -1.766 8.263 1.00 52.24 H new ATOM 0 HD22 ASN B 155 14.745 -1.038 9.817 1.00 52.24 H new ATOM 2014 N ALA B 156 18.695 -2.891 8.694 1.00 23.45 N ATOM 2015 CA ALA B 156 19.528 -3.683 7.785 1.00 60.51 C ATOM 2016 C ALA B 156 19.144 -3.424 6.316 1.00 42.13 C ATOM 2017 O ALA B 156 19.759 -2.598 5.643 1.00 44.14 O ATOM 2018 CB ALA B 156 19.414 -5.179 8.141 1.00 4.02 C ATOM 0 H ALA B 156 17.854 -3.379 9.001 1.00 23.45 H new ATOM 0 HA ALA B 156 20.568 -3.378 7.905 1.00 60.51 H new ATOM 0 HB1 ALA B 156 20.035 -5.763 7.462 1.00 4.02 H new ATOM 0 HB2 ALA B 156 19.750 -5.336 9.166 1.00 4.02 H new ATOM 0 HB3 ALA B 156 18.376 -5.497 8.047 1.00 4.02 H new ATOM 2024 N HIS B 157 18.080 -4.100 5.838 1.00 35.12 N ATOM 2025 CA HIS B 157 17.770 -4.205 4.391 1.00 25.31 C ATOM 2026 C HIS B 157 16.427 -3.570 4.014 1.00 72.13 C ATOM 2027 O HIS B 157 16.006 -3.676 2.858 1.00 13.23 O ATOM 2028 CB HIS B 157 17.823 -5.707 3.965 1.00 12.42 C ATOM 2029 CG HIS B 157 19.201 -6.215 3.617 1.00 14.23 C ATOM 2030 ND1 HIS B 157 19.500 -6.792 2.399 1.00 21.53 N ATOM 2031 CD2 HIS B 157 20.360 -6.230 4.325 1.00 62.32 C ATOM 2032 CE1 HIS B 157 20.772 -7.127 2.373 1.00 2.24 C ATOM 2033 NE2 HIS B 157 21.317 -6.803 3.528 1.00 23.42 N ATOM 0 H HIS B 157 17.413 -4.587 6.437 1.00 35.12 H new ATOM 0 HA HIS B 157 18.525 -3.637 3.847 1.00 25.31 H new ATOM 0 HB2 HIS B 157 17.420 -6.315 4.775 1.00 12.42 H new ATOM 0 HB3 HIS B 157 17.170 -5.850 3.104 1.00 12.42 H new ATOM 0 HD1 HIS B 157 18.837 -6.936 1.637 1.00 21.53 H new ATOM 0 HD2 HIS B 157 20.501 -5.859 5.329 1.00 62.32 H new ATOM 0 HE1 HIS B 157 21.284 -7.591 1.543 1.00 2.24 H new ATOM 2042 N ALA B 158 15.782 -2.884 4.960 1.00 21.25 N ATOM 2043 CA ALA B 158 14.459 -2.272 4.723 1.00 2.43 C ATOM 2044 C ALA B 158 14.598 -0.904 4.063 1.00 21.44 C ATOM 2045 O ALA B 158 15.336 -0.039 4.550 1.00 72.34 O ATOM 2046 CB ALA B 158 13.626 -2.184 6.010 1.00 42.12 C ATOM 0 H ALA B 158 16.149 -2.735 5.900 1.00 21.25 H new ATOM 0 HA ALA B 158 13.920 -2.926 4.037 1.00 2.43 H new ATOM 0 HB1 ALA B 158 12.661 -1.728 5.788 1.00 42.12 H new ATOM 0 HB2 ALA B 158 13.470 -3.185 6.412 1.00 42.12 H new ATOM 0 HB3 ALA B 158 14.155 -1.577 6.745 1.00 42.12 H new ATOM 2052 N ARG B 159 13.882 -0.722 2.948 1.00 64.00 N ATOM 2053 CA ARG B 159 13.857 0.532 2.210 1.00 65.43 C ATOM 2054 C ARG B 159 12.409 1.014 2.118 1.00 3.34 C ATOM 2055 O ARG B 159 11.517 0.254 1.718 1.00 71.11 O ATOM 2056 CB ARG B 159 14.481 0.345 0.804 1.00 21.23 C ATOM 2057 CG ARG B 159 14.818 1.658 0.072 1.00 65.02 C ATOM 2058 CD ARG B 159 15.852 2.487 0.841 1.00 34.51 C ATOM 2059 NE ARG B 159 16.150 3.764 0.186 1.00 32.21 N ATOM 2060 CZ ARG B 159 16.711 4.828 0.785 1.00 21.14 C ATOM 2061 NH1 ARG B 159 17.038 4.785 2.077 1.00 53.11 N ATOM 2062 NH2 ARG B 159 16.974 5.916 0.071 1.00 23.11 N ATOM 0 H ARG B 159 13.301 -1.451 2.534 1.00 64.00 H new ATOM 0 HA ARG B 159 14.451 1.284 2.729 1.00 65.43 H new ATOM 0 HB2 ARG B 159 15.392 -0.246 0.901 1.00 21.23 H new ATOM 0 HB3 ARG B 159 13.791 -0.232 0.188 1.00 21.23 H new ATOM 0 HG2 ARG B 159 15.201 1.432 -0.923 1.00 65.02 H new ATOM 0 HG3 ARG B 159 13.909 2.244 -0.062 1.00 65.02 H new ATOM 0 HD2 ARG B 159 15.483 2.677 1.849 1.00 34.51 H new ATOM 0 HD3 ARG B 159 16.772 1.911 0.942 1.00 34.51 H new ATOM 0 HE ARG B 159 15.913 3.852 -0.802 1.00 32.21 H new ATOM 0 HH11 ARG B 159 16.863 3.939 2.620 1.00 53.11 H new ATOM 0 HH12 ARG B 159 17.463 5.598 2.523 1.00 53.11 H new ATOM 0 HH21 ARG B 159 16.750 5.940 -0.924 1.00 23.11 H new ATOM 0 HH22 ARG B 159 17.400 6.728 0.517 1.00 23.11 H new ATOM 2076 N TYR B 160 12.188 2.265 2.524 1.00 60.34 N ATOM 2077 CA TYR B 160 10.864 2.880 2.584 1.00 43.22 C ATOM 2078 C TYR B 160 10.614 3.685 1.313 1.00 13.23 C ATOM 2079 O TYR B 160 11.505 4.384 0.829 1.00 52.32 O ATOM 2080 CB TYR B 160 10.775 3.746 3.863 1.00 21.53 C ATOM 2081 CG TYR B 160 11.031 2.899 5.122 1.00 22.50 C ATOM 2082 CD1 TYR B 160 10.011 2.125 5.680 1.00 22.43 C ATOM 2083 CD2 TYR B 160 12.303 2.813 5.703 1.00 14.54 C ATOM 2084 CE1 TYR B 160 10.242 1.318 6.770 1.00 62.42 C ATOM 2085 CE2 TYR B 160 12.537 1.993 6.790 1.00 2.25 C ATOM 2086 CZ TYR B 160 11.504 1.249 7.319 1.00 34.14 C ATOM 2087 OH TYR B 160 11.731 0.432 8.402 1.00 44.23 O ATOM 0 H TYR B 160 12.937 2.888 2.825 1.00 60.34 H new ATOM 0 HA TYR B 160 10.084 2.121 2.638 1.00 43.22 H new ATOM 0 HB2 TYR B 160 11.504 4.555 3.810 1.00 21.53 H new ATOM 0 HB3 TYR B 160 9.790 4.208 3.926 1.00 21.53 H new ATOM 0 HD1 TYR B 160 9.022 2.161 5.248 1.00 22.43 H new ATOM 0 HD2 TYR B 160 13.114 3.397 5.294 1.00 14.54 H new ATOM 0 HE1 TYR B 160 9.435 0.739 7.195 1.00 62.42 H new ATOM 0 HE2 TYR B 160 13.525 1.935 7.223 1.00 2.25 H new ATOM 0 HH TYR B 160 10.894 0.303 8.896 1.00 44.23 H new ATOM 2097 N PHE B 161 9.401 3.532 0.768 1.00 4.33 N ATOM 2098 CA PHE B 161 8.973 4.148 -0.498 1.00 42.34 C ATOM 2099 C PHE B 161 7.589 4.798 -0.334 1.00 4.33 C ATOM 2100 O PHE B 161 7.012 4.831 0.766 1.00 30.23 O ATOM 2101 CB PHE B 161 8.910 3.079 -1.625 1.00 50.23 C ATOM 2102 CG PHE B 161 10.254 2.459 -2.017 1.00 61.25 C ATOM 2103 CD1 PHE B 161 11.154 3.162 -2.820 1.00 2.41 C ATOM 2104 CD2 PHE B 161 10.604 1.168 -1.607 1.00 51.42 C ATOM 2105 CE1 PHE B 161 12.358 2.597 -3.202 1.00 41.34 C ATOM 2106 CE2 PHE B 161 11.807 0.611 -1.987 1.00 54.34 C ATOM 2107 CZ PHE B 161 12.683 1.322 -2.785 1.00 21.12 C ATOM 0 H PHE B 161 8.673 2.965 1.202 1.00 4.33 H new ATOM 0 HA PHE B 161 9.700 4.913 -0.769 1.00 42.34 H new ATOM 0 HB2 PHE B 161 8.239 2.280 -1.308 1.00 50.23 H new ATOM 0 HB3 PHE B 161 8.467 3.535 -2.511 1.00 50.23 H new ATOM 0 HD1 PHE B 161 10.907 4.161 -3.148 1.00 2.41 H new ATOM 0 HD2 PHE B 161 9.925 0.602 -0.987 1.00 51.42 H new ATOM 0 HE1 PHE B 161 13.042 3.153 -3.826 1.00 41.34 H new ATOM 0 HE2 PHE B 161 12.066 -0.385 -1.660 1.00 54.34 H new ATOM 0 HZ PHE B 161 13.622 0.880 -3.083 1.00 21.12 H new ATOM 2117 N ILE B 162 7.074 5.319 -1.458 1.00 31.24 N ATOM 2118 CA ILE B 162 5.731 5.915 -1.563 1.00 2.04 C ATOM 2119 C ILE B 162 5.080 5.324 -2.826 1.00 73.30 C ATOM 2120 O ILE B 162 5.797 4.968 -3.758 1.00 54.33 O ATOM 2121 CB ILE B 162 5.806 7.493 -1.701 1.00 40.42 C ATOM 2122 CG1 ILE B 162 6.943 8.097 -0.812 1.00 44.24 C ATOM 2123 CG2 ILE B 162 4.449 8.128 -1.332 1.00 14.11 C ATOM 2124 CD1 ILE B 162 7.248 9.552 -1.083 1.00 22.34 C ATOM 0 H ILE B 162 7.589 5.339 -2.338 1.00 31.24 H new ATOM 0 HA ILE B 162 5.155 5.693 -0.664 1.00 2.04 H new ATOM 0 HB ILE B 162 6.039 7.723 -2.741 1.00 40.42 H new ATOM 0 HG12 ILE B 162 6.664 7.987 0.236 1.00 44.24 H new ATOM 0 HG13 ILE B 162 7.852 7.515 -0.963 1.00 44.24 H new ATOM 0 HG21 ILE B 162 4.515 9.211 -1.431 1.00 14.11 H new ATOM 0 HG22 ILE B 162 3.676 7.749 -2.001 1.00 14.11 H new ATOM 0 HG23 ILE B 162 4.196 7.873 -0.303 1.00 14.11 H new ATOM 0 HD11 ILE B 162 8.048 9.885 -0.422 1.00 22.34 H new ATOM 0 HD12 ILE B 162 7.561 9.671 -2.120 1.00 22.34 H new ATOM 0 HD13 ILE B 162 6.355 10.151 -0.903 1.00 22.34 H new ATOM 2136 N ILE B 163 3.744 5.173 -2.854 1.00 14.13 N ATOM 2137 CA ILE B 163 3.012 4.730 -4.066 1.00 44.41 C ATOM 2138 C ILE B 163 1.724 5.557 -4.203 1.00 70.23 C ATOM 2139 O ILE B 163 1.140 5.982 -3.203 1.00 34.14 O ATOM 2140 CB ILE B 163 2.639 3.186 -4.047 1.00 31.30 C ATOM 2141 CG1 ILE B 163 3.876 2.305 -3.685 1.00 72.03 C ATOM 2142 CG2 ILE B 163 2.045 2.740 -5.418 1.00 63.31 C ATOM 2143 CD1 ILE B 163 3.590 0.822 -3.560 1.00 52.31 C ATOM 0 H ILE B 163 3.142 5.351 -2.050 1.00 14.13 H new ATOM 0 HA ILE B 163 3.677 4.885 -4.915 1.00 44.41 H new ATOM 0 HB ILE B 163 1.883 3.044 -3.275 1.00 31.30 H new ATOM 0 HG12 ILE B 163 4.642 2.449 -4.447 1.00 72.03 H new ATOM 0 HG13 ILE B 163 4.293 2.660 -2.743 1.00 72.03 H new ATOM 0 HG21 ILE B 163 1.798 1.679 -5.380 1.00 63.31 H new ATOM 0 HG22 ILE B 163 1.143 3.315 -5.628 1.00 63.31 H new ATOM 0 HG23 ILE B 163 2.778 2.913 -6.206 1.00 63.31 H new ATOM 0 HD11 ILE B 163 4.509 0.294 -3.307 1.00 52.31 H new ATOM 0 HD12 ILE B 163 2.850 0.659 -2.776 1.00 52.31 H new ATOM 0 HD13 ILE B 163 3.204 0.445 -4.507 1.00 52.31 H new ATOM 2155 N HIS B 164 1.297 5.783 -5.457 1.00 71.11 N ATOM 2156 CA HIS B 164 0.045 6.489 -5.767 1.00 32.32 C ATOM 2157 C HIS B 164 -1.168 5.631 -5.355 1.00 63.11 C ATOM 2158 O HIS B 164 -1.175 4.413 -5.561 1.00 1.40 O ATOM 2159 CB HIS B 164 -0.020 6.845 -7.273 1.00 61.43 C ATOM 2160 CG HIS B 164 0.058 5.668 -8.214 1.00 62.32 C ATOM 2161 ND1 HIS B 164 -1.006 4.829 -8.475 1.00 53.21 N ATOM 2162 CD2 HIS B 164 1.079 5.209 -8.975 1.00 63.21 C ATOM 2163 CE1 HIS B 164 -0.640 3.919 -9.350 1.00 21.15 C ATOM 2164 NE2 HIS B 164 0.618 4.127 -9.680 1.00 51.41 N ATOM 0 H HIS B 164 1.812 5.480 -6.284 1.00 71.11 H new ATOM 0 HA HIS B 164 0.019 7.418 -5.198 1.00 32.32 H new ATOM 0 HB2 HIS B 164 -0.949 7.381 -7.464 1.00 61.43 H new ATOM 0 HB3 HIS B 164 0.796 7.529 -7.504 1.00 61.43 H new ATOM 0 HD1 HIS B 164 -1.932 4.903 -8.054 1.00 53.21 H new ATOM 0 HD2 HIS B 164 2.077 5.621 -9.019 1.00 63.21 H new ATOM 0 HE1 HIS B 164 -1.268 3.130 -9.735 1.00 21.15 H new ATOM 2173 N ALA B 165 -2.179 6.281 -4.774 1.00 4.44 N ATOM 2174 CA ALA B 165 -3.392 5.609 -4.259 1.00 2.20 C ATOM 2175 C ALA B 165 -4.684 6.185 -4.874 1.00 35.30 C ATOM 2176 O ALA B 165 -5.790 5.741 -4.541 1.00 11.11 O ATOM 2177 CB ALA B 165 -3.397 5.725 -2.742 1.00 5.31 C ATOM 0 H ALA B 165 -2.187 7.293 -4.643 1.00 4.44 H new ATOM 0 HA ALA B 165 -3.368 4.559 -4.550 1.00 2.20 H new ATOM 0 HB1 ALA B 165 -4.285 5.235 -2.343 1.00 5.31 H new ATOM 0 HB2 ALA B 165 -2.505 5.246 -2.338 1.00 5.31 H new ATOM 0 HB3 ALA B 165 -3.404 6.777 -2.458 1.00 5.31 H new ATOM 2183 N HIS B 166 -4.522 7.190 -5.757 1.00 55.22 N ATOM 2184 CA HIS B 166 -5.605 7.728 -6.602 1.00 13.33 C ATOM 2185 C HIS B 166 -6.046 6.650 -7.594 1.00 53.04 C ATOM 2186 O HIS B 166 -7.238 6.370 -7.744 1.00 60.35 O ATOM 2187 CB HIS B 166 -5.118 9.002 -7.351 1.00 51.11 C ATOM 2188 CG HIS B 166 -6.042 9.524 -8.428 1.00 73.25 C ATOM 2189 ND1 HIS B 166 -7.401 9.618 -8.271 1.00 24.02 N ATOM 2190 CD2 HIS B 166 -5.788 9.978 -9.682 1.00 2.34 C ATOM 2191 CE1 HIS B 166 -7.947 10.099 -9.366 1.00 41.43 C ATOM 2192 NE2 HIS B 166 -6.992 10.330 -10.241 1.00 34.03 N ATOM 0 H HIS B 166 -3.626 7.655 -5.905 1.00 55.22 H new ATOM 0 HA HIS B 166 -6.454 8.008 -5.979 1.00 13.33 H new ATOM 0 HB2 HIS B 166 -4.960 9.794 -6.618 1.00 51.11 H new ATOM 0 HB3 HIS B 166 -4.149 8.788 -7.802 1.00 51.11 H new ATOM 0 HD2 HIS B 166 -4.819 10.049 -10.153 1.00 2.34 H new ATOM 0 HE1 HIS B 166 -9.001 10.275 -9.521 1.00 41.43 H new ATOM 0 HE2 HIS B 166 -7.124 10.708 -11.179 1.00 34.03 H new ATOM 2201 N LYS B 167 -5.046 6.065 -8.269 1.00 4.33 N ATOM 2202 CA LYS B 167 -5.243 4.945 -9.175 1.00 71.24 C ATOM 2203 C LYS B 167 -4.817 3.648 -8.474 1.00 4.13 C ATOM 2204 O LYS B 167 -3.629 3.453 -8.174 1.00 44.33 O ATOM 2205 CB LYS B 167 -4.448 5.157 -10.495 1.00 43.34 C ATOM 2206 CG LYS B 167 -4.630 4.021 -11.532 1.00 62.14 C ATOM 2207 CD LYS B 167 -6.119 3.739 -11.848 1.00 64.10 C ATOM 2208 CE LYS B 167 -6.305 2.588 -12.837 1.00 11.34 C ATOM 2209 NZ LYS B 167 -7.732 2.203 -12.963 1.00 20.40 N ATOM 0 H LYS B 167 -4.074 6.365 -8.195 1.00 4.33 H new ATOM 0 HA LYS B 167 -6.298 4.875 -9.439 1.00 71.24 H new ATOM 0 HB2 LYS B 167 -4.758 6.099 -10.946 1.00 43.34 H new ATOM 0 HB3 LYS B 167 -3.388 5.251 -10.257 1.00 43.34 H new ATOM 0 HG2 LYS B 167 -4.111 4.287 -12.453 1.00 62.14 H new ATOM 0 HG3 LYS B 167 -4.163 3.111 -11.155 1.00 62.14 H new ATOM 0 HD2 LYS B 167 -6.645 3.505 -10.922 1.00 64.10 H new ATOM 0 HD3 LYS B 167 -6.577 4.640 -12.256 1.00 64.10 H new ATOM 0 HE2 LYS B 167 -5.919 2.880 -13.813 1.00 11.34 H new ATOM 0 HE3 LYS B 167 -5.723 1.727 -12.508 1.00 11.34 H new ATOM 0 HZ1 LYS B 167 -7.933 1.931 -13.947 1.00 20.40 H new ATOM 0 HZ2 LYS B 167 -7.931 1.399 -12.334 1.00 20.40 H new ATOM 0 HZ3 LYS B 167 -8.334 3.008 -12.697 1.00 20.40 H new ATOM 2223 N LEU B 168 -5.809 2.803 -8.170 1.00 2.34 N ATOM 2224 CA LEU B 168 -5.595 1.438 -7.681 1.00 75.02 C ATOM 2225 C LEU B 168 -5.833 0.447 -8.821 1.00 54.24 C ATOM 2226 O LEU B 168 -6.442 0.791 -9.852 1.00 61.12 O ATOM 2227 CB LEU B 168 -6.544 1.132 -6.487 1.00 21.35 C ATOM 2228 CG LEU B 168 -6.424 2.091 -5.262 1.00 3.45 C ATOM 2229 CD1 LEU B 168 -7.402 1.725 -4.125 1.00 14.21 C ATOM 2230 CD2 LEU B 168 -4.988 2.157 -4.740 1.00 10.44 C ATOM 0 H LEU B 168 -6.794 3.052 -8.258 1.00 2.34 H new ATOM 0 HA LEU B 168 -4.568 1.340 -7.330 1.00 75.02 H new ATOM 0 HB2 LEU B 168 -7.572 1.161 -6.848 1.00 21.35 H new ATOM 0 HB3 LEU B 168 -6.354 0.114 -6.148 1.00 21.35 H new ATOM 0 HG LEU B 168 -6.704 3.082 -5.621 1.00 3.45 H new ATOM 0 HD11 LEU B 168 -7.276 2.424 -3.298 1.00 14.21 H new ATOM 0 HD12 LEU B 168 -8.426 1.780 -4.494 1.00 14.21 H new ATOM 0 HD13 LEU B 168 -7.195 0.712 -3.779 1.00 14.21 H new ATOM 0 HD21 LEU B 168 -4.942 2.834 -3.887 1.00 10.44 H new ATOM 0 HD22 LEU B 168 -4.667 1.162 -4.431 1.00 10.44 H new ATOM 0 HD23 LEU B 168 -4.330 2.522 -5.529 1.00 10.44 H new ATOM 2242 N LEU B 169 -5.342 -0.777 -8.630 1.00 52.04 N ATOM 2243 CA LEU B 169 -5.553 -1.881 -9.565 1.00 61.13 C ATOM 2244 C LEU B 169 -6.928 -2.482 -9.258 1.00 45.12 C ATOM 2245 O LEU B 169 -7.095 -3.182 -8.249 1.00 10.14 O ATOM 2246 CB LEU B 169 -4.416 -2.932 -9.432 1.00 5.42 C ATOM 2247 CG LEU B 169 -2.968 -2.390 -9.644 1.00 31.33 C ATOM 2248 CD1 LEU B 169 -1.922 -3.480 -9.352 1.00 11.32 C ATOM 2249 CD2 LEU B 169 -2.782 -1.797 -11.058 1.00 4.11 C ATOM 0 H LEU B 169 -4.783 -1.032 -7.816 1.00 52.04 H new ATOM 0 HA LEU B 169 -5.529 -1.531 -10.597 1.00 61.13 H new ATOM 0 HB2 LEU B 169 -4.475 -3.381 -8.441 1.00 5.42 H new ATOM 0 HB3 LEU B 169 -4.596 -3.729 -10.154 1.00 5.42 H new ATOM 0 HG LEU B 169 -2.814 -1.579 -8.932 1.00 31.33 H new ATOM 0 HD11 LEU B 169 -0.922 -3.075 -9.508 1.00 11.32 H new ATOM 0 HD12 LEU B 169 -2.022 -3.813 -8.319 1.00 11.32 H new ATOM 0 HD13 LEU B 169 -2.080 -4.325 -10.022 1.00 11.32 H new ATOM 0 HD21 LEU B 169 -1.761 -1.430 -11.167 1.00 4.11 H new ATOM 0 HD22 LEU B 169 -2.972 -2.569 -11.804 1.00 4.11 H new ATOM 0 HD23 LEU B 169 -3.481 -0.973 -11.202 1.00 4.11 H new ATOM 2261 N ASP B 170 -7.918 -2.115 -10.085 1.00 23.53 N ATOM 2262 CA ASP B 170 -9.326 -2.522 -9.922 1.00 4.31 C ATOM 2263 C ASP B 170 -9.674 -3.694 -10.871 1.00 35.51 C ATOM 2264 O ASP B 170 -9.832 -3.500 -12.074 1.00 73.32 O ATOM 2265 CB ASP B 170 -10.276 -1.304 -10.138 1.00 24.45 C ATOM 2266 CG ASP B 170 -10.084 -0.592 -11.495 1.00 61.11 C ATOM 2267 OD1 ASP B 170 -9.092 0.151 -11.645 1.00 64.22 O ATOM 2268 OD2 ASP B 170 -10.913 -0.775 -12.415 1.00 75.13 O ATOM 0 H ASP B 170 -7.763 -1.519 -10.898 1.00 23.53 H new ATOM 0 HA ASP B 170 -9.469 -2.877 -8.901 1.00 4.31 H new ATOM 0 HB2 ASP B 170 -11.309 -1.643 -10.060 1.00 24.45 H new ATOM 0 HB3 ASP B 170 -10.116 -0.584 -9.335 1.00 24.45 H new ATOM 2273 N PRO B 171 -9.747 -4.959 -10.345 1.00 42.12 N ATOM 2274 CA PRO B 171 -10.235 -6.135 -11.112 1.00 42.34 C ATOM 2275 C PRO B 171 -11.780 -6.228 -11.110 1.00 14.24 C ATOM 2276 O PRO B 171 -12.347 -7.217 -11.579 1.00 64.14 O ATOM 2277 CB PRO B 171 -9.577 -7.333 -10.354 1.00 10.00 C ATOM 2278 CG PRO B 171 -8.725 -6.721 -9.271 1.00 11.23 C ATOM 2279 CD PRO B 171 -9.325 -5.374 -8.993 1.00 41.21 C ATOM 0 HA PRO B 171 -9.972 -6.098 -12.169 1.00 42.34 H new ATOM 0 HB2 PRO B 171 -10.336 -7.990 -9.929 1.00 10.00 H new ATOM 0 HB3 PRO B 171 -8.973 -7.938 -11.030 1.00 10.00 H new ATOM 0 HG2 PRO B 171 -8.725 -7.342 -8.375 1.00 11.23 H new ATOM 0 HG3 PRO B 171 -7.688 -6.628 -9.594 1.00 11.23 H new ATOM 0 HD2 PRO B 171 -10.165 -5.433 -8.301 1.00 41.21 H new ATOM 0 HD3 PRO B 171 -8.602 -4.684 -8.558 1.00 41.21 H new ATOM 2287 N SER B 172 -12.433 -5.196 -10.543 1.00 2.42 N ATOM 2288 CA SER B 172 -13.891 -5.119 -10.388 1.00 12.24 C ATOM 2289 C SER B 172 -14.535 -4.327 -11.549 1.00 73.32 C ATOM 2290 O SER B 172 -15.565 -4.738 -12.090 1.00 24.22 O ATOM 2291 CB SER B 172 -14.213 -4.453 -9.027 1.00 53.14 C ATOM 2292 OG SER B 172 -15.605 -4.432 -8.764 1.00 51.01 O ATOM 0 H SER B 172 -11.948 -4.378 -10.174 1.00 2.42 H new ATOM 0 HA SER B 172 -14.308 -6.126 -10.413 1.00 12.24 H new ATOM 0 HB2 SER B 172 -13.701 -4.992 -8.229 1.00 53.14 H new ATOM 0 HB3 SER B 172 -13.827 -3.434 -9.022 1.00 53.14 H new ATOM 0 HG SER B 172 -15.990 -3.598 -9.105 1.00 51.01 H new ATOM 2298 N GLU B 173 -13.924 -3.179 -11.922 1.00 2.10 N ATOM 2299 CA GLU B 173 -14.494 -2.263 -12.938 1.00 1.30 C ATOM 2300 C GLU B 173 -13.953 -2.595 -14.335 1.00 42.20 C ATOM 2301 O GLU B 173 -14.707 -2.610 -15.321 1.00 45.23 O ATOM 2302 CB GLU B 173 -14.200 -0.781 -12.569 1.00 73.42 C ATOM 2303 CG GLU B 173 -14.625 -0.385 -11.140 1.00 34.25 C ATOM 2304 CD GLU B 173 -16.095 -0.728 -10.831 1.00 22.41 C ATOM 2305 OE1 GLU B 173 -16.997 -0.080 -11.404 1.00 70.21 O ATOM 2306 OE2 GLU B 173 -16.355 -1.646 -10.012 1.00 11.11 O ATOM 0 H GLU B 173 -13.035 -2.864 -11.534 1.00 2.10 H new ATOM 0 HA GLU B 173 -15.575 -2.401 -12.952 1.00 1.30 H new ATOM 0 HB2 GLU B 173 -13.132 -0.596 -12.682 1.00 73.42 H new ATOM 0 HB3 GLU B 173 -14.713 -0.133 -13.280 1.00 73.42 H new ATOM 0 HG2 GLU B 173 -13.981 -0.892 -10.422 1.00 34.25 H new ATOM 0 HG3 GLU B 173 -14.472 0.686 -11.005 1.00 34.25 H new ATOM 2313 N GLY B 174 -12.637 -2.850 -14.406 1.00 53.13 N ATOM 2314 CA GLY B 174 -11.973 -3.261 -15.652 1.00 63.45 C ATOM 2315 C GLY B 174 -11.606 -4.748 -15.664 1.00 1.45 C ATOM 2316 O GLY B 174 -10.634 -5.125 -16.358 1.00 33.54 O ATOM 2317 OXT GLY B 174 -12.282 -5.546 -14.977 1.00 37.88 O ATOM 0 H GLY B 174 -12.007 -2.778 -13.607 1.00 53.13 H new ATOM 0 HA2 GLY B 174 -12.628 -3.046 -16.496 1.00 63.45 H new ATOM 0 HA3 GLY B 174 -11.070 -2.667 -15.790 1.00 63.45 H new TER 2321 GLY B 174