USER MOD reduce.3.24.130724 H: found=0, std=0, add=1277, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1277 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 99 GLN : amide:sc= -0.525 K(o=-0.81,f=-6.9!) USER MOD Set 1.2: A 139 GLN : amide:sc= -0.274 K(o=-0.81,f=-3.3) USER MOD Set 1.3: A 150 HIS : no HE2:sc= -0.0154 K(o=-0.81,f=-8.3!) USER MOD Set 2.1: A 81 TYR OH : rot 30:sc= 0.401 USER MOD Set 2.2: A 129 GLN : amide:sc= -0.481 K(o=-0.08,f=-0.74!) USER MOD Set 3.1: A 10 SER OG : rot 158:sc= 0.0487 USER MOD Set 3.2: A 37 THR OG1 : rot -79:sc= 0.73 USER MOD Set 3.3: A 38 HIS : no HD1:sc= -0.0732 X(o=0.71,f=0.78) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -174:sc= 0 (180deg=-0.0463) USER MOD Single : A 4 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0505) USER MOD Single : A 8 GLN : amide:sc= -0.548 X(o=-0.55,f=-0.38) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= -0.0263 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot -45:sc= 1.28 USER MOD Single : A 42 LYS NZ :NH3+ -138:sc= -0.648! (180deg=-3.51!) USER MOD Single : A 45 ASN : amide:sc= -0.0536 X(o=-0.054,f=-0.11) USER MOD Single : A 46 LYS NZ :NH3+ 158:sc= 1.08 (180deg=0.719) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= -1.02 K(o=-1,f=-5.1!) USER MOD Single : A 58 HIS : no HD1:sc= -1.17 X(o=-1.2,f=-0.71) USER MOD Single : A 63 LYS NZ :NH3+ -164:sc= 0.0102 (180deg=-0.00331) USER MOD Single : A 67 SER OG : rot 160:sc= -0.0294 USER MOD Single : A 69 SER OG : rot 180:sc= -0.401 USER MOD Single : A 71 SER OG : rot -37:sc= 0.834 USER MOD Single : A 91 HIS : no HD1:sc= -0.0155 X(o=-0.016,f=0) USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=-0.027) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 41:sc= 0.229 USER MOD Single : A 113 GLN : amide:sc= -0.0923 X(o=-0.092,f=-0.49) USER MOD Single : A 117 LYS NZ :NH3+ -165:sc= -5.67! (180deg=-6.35!) USER MOD Single : A 123 MET CE :methyl 175:sc= -0.0334 (180deg=-0.0587) USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ -167:sc= 1.24 (180deg=1.08) USER MOD Single : A 128 MET CE :methyl 167:sc= -0.671 (180deg=-1.31) USER MOD Single : A 130 LYS NZ :NH3+ 161:sc= -2.59! (180deg=-3.44!) USER MOD Single : A 134 GLN : amide:sc= -0.52 X(o=-0.52,f=-0.49) USER MOD Single : A 135 GLN : amide:sc= -0.552 K(o=-0.55,f=-4.7!) USER MOD Single : A 141 SER OG : rot -78:sc= 0.737 USER MOD Single : A 144 THR OG1 : rot -110:sc= -0.142 USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 151 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 152 HIS : no HD1:sc= 0.0756 K(o=0.076,f=-1.3) USER MOD Single : A 153 HIS : no HE2:sc= 0.682 K(o=0.68,f=-3.7!) USER MOD Single : A 154 HIS : no HD1:sc= 0 X(o=0,f=-0.047) USER MOD Single : A 155 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.595 36.564 13.200 1.00 44.45 N ATOM 2 CA MET A 1 -10.536 35.407 13.176 1.00 70.44 C ATOM 3 C MET A 1 -9.964 34.227 12.376 1.00 41.53 C ATOM 4 O MET A 1 -9.870 33.106 12.883 1.00 33.24 O ATOM 5 CB MET A 1 -11.891 35.829 12.587 1.00 24.33 C ATOM 6 CG MET A 1 -12.640 36.834 13.448 1.00 64.32 C ATOM 7 SD MET A 1 -12.963 36.203 15.106 1.00 52.34 S ATOM 8 CE MET A 1 -13.799 37.603 15.851 1.00 63.23 C ATOM 0 H1 MET A 1 -9.968 37.302 13.831 1.00 44.45 H new ATOM 0 H2 MET A 1 -8.666 36.249 13.546 1.00 44.45 H new ATOM 0 H3 MET A 1 -9.494 36.949 12.239 1.00 44.45 H new ATOM 0 HA MET A 1 -10.677 35.080 14.206 1.00 70.44 H new ATOM 0 HB2 MET A 1 -11.730 36.258 11.598 1.00 24.33 H new ATOM 0 HB3 MET A 1 -12.512 34.943 12.453 1.00 24.33 H new ATOM 0 HG2 MET A 1 -12.060 37.754 13.518 1.00 64.32 H new ATOM 0 HG3 MET A 1 -13.585 37.089 12.968 1.00 64.32 H new ATOM 0 HE1 MET A 1 -14.062 37.363 16.881 1.00 63.23 H new ATOM 0 HE2 MET A 1 -13.139 38.470 15.837 1.00 63.23 H new ATOM 0 HE3 MET A 1 -14.705 37.828 15.288 1.00 63.23 H new ATOM 20 N GLY A 2 -9.584 34.476 11.124 1.00 62.50 N ATOM 21 CA GLY A 2 -9.058 33.409 10.276 1.00 22.53 C ATOM 22 C GLY A 2 -10.157 32.581 9.611 1.00 1.05 C ATOM 23 O GLY A 2 -10.953 31.928 10.289 1.00 45.21 O ATOM 0 H GLY A 2 -9.629 35.393 10.680 1.00 62.50 H new ATOM 0 HA2 GLY A 2 -8.422 33.845 9.506 1.00 22.53 H new ATOM 0 HA3 GLY A 2 -8.428 32.752 10.876 1.00 22.53 H new ATOM 27 N PHE A 3 -10.204 32.610 8.283 1.00 42.04 N ATOM 28 CA PHE A 3 -11.225 31.884 7.517 1.00 50.54 C ATOM 29 C PHE A 3 -10.738 30.473 7.148 1.00 12.34 C ATOM 30 O PHE A 3 -9.548 30.261 6.916 1.00 32.00 O ATOM 31 CB PHE A 3 -11.575 32.666 6.243 1.00 20.43 C ATOM 32 CG PHE A 3 -12.084 34.063 6.504 1.00 51.33 C ATOM 33 CD1 PHE A 3 -11.197 35.110 6.719 1.00 12.51 C ATOM 34 CD2 PHE A 3 -13.446 34.328 6.537 1.00 65.11 C ATOM 35 CE1 PHE A 3 -11.659 36.388 6.963 1.00 31.34 C ATOM 36 CE2 PHE A 3 -13.911 35.606 6.781 1.00 23.45 C ATOM 37 CZ PHE A 3 -13.017 36.636 6.993 1.00 14.14 C ATOM 0 H PHE A 3 -9.544 33.131 7.706 1.00 42.04 H new ATOM 0 HA PHE A 3 -12.115 31.786 8.139 1.00 50.54 H new ATOM 0 HB2 PHE A 3 -10.690 32.725 5.610 1.00 20.43 H new ATOM 0 HB3 PHE A 3 -12.330 32.113 5.685 1.00 20.43 H new ATOM 0 HD1 PHE A 3 -10.134 34.922 6.695 1.00 12.51 H new ATOM 0 HD2 PHE A 3 -14.150 33.526 6.370 1.00 65.11 H new ATOM 0 HE1 PHE A 3 -10.959 37.193 7.130 1.00 31.34 H new ATOM 0 HE2 PHE A 3 -14.973 35.799 6.806 1.00 23.45 H new ATOM 0 HZ PHE A 3 -13.380 37.636 7.182 1.00 14.14 H new ATOM 47 N LYS A 4 -11.662 29.512 7.084 1.00 63.21 N ATOM 48 CA LYS A 4 -11.308 28.116 6.778 1.00 40.12 C ATOM 49 C LYS A 4 -11.650 27.749 5.324 1.00 15.21 C ATOM 50 O LYS A 4 -12.786 27.376 5.010 1.00 41.11 O ATOM 51 CB LYS A 4 -12.008 27.141 7.747 1.00 43.33 C ATOM 52 CG LYS A 4 -11.563 27.267 9.208 1.00 65.23 C ATOM 53 CD LYS A 4 -12.110 28.524 9.881 1.00 31.22 C ATOM 54 CE LYS A 4 -11.561 28.701 11.293 1.00 44.25 C ATOM 55 NZ LYS A 4 -11.909 27.563 12.188 1.00 45.44 N ATOM 0 H LYS A 4 -12.658 29.669 7.239 1.00 63.21 H new ATOM 0 HA LYS A 4 -10.229 28.025 6.907 1.00 40.12 H new ATOM 0 HB2 LYS A 4 -13.084 27.305 7.693 1.00 43.33 H new ATOM 0 HB3 LYS A 4 -11.824 26.120 7.411 1.00 43.33 H new ATOM 0 HG2 LYS A 4 -11.894 26.389 9.762 1.00 65.23 H new ATOM 0 HG3 LYS A 4 -10.474 27.280 9.253 1.00 65.23 H new ATOM 0 HD2 LYS A 4 -11.854 29.397 9.281 1.00 31.22 H new ATOM 0 HD3 LYS A 4 -13.198 28.471 9.919 1.00 31.22 H new ATOM 0 HE2 LYS A 4 -10.477 28.804 11.247 1.00 44.25 H new ATOM 0 HE3 LYS A 4 -11.952 29.626 11.718 1.00 44.25 H new ATOM 0 HZ1 LYS A 4 -11.602 27.778 13.158 1.00 45.44 H new ATOM 0 HZ2 LYS A 4 -12.938 27.414 12.176 1.00 45.44 H new ATOM 0 HZ3 LYS A 4 -11.430 26.701 11.856 1.00 45.44 H new ATOM 69 N LEU A 5 -10.661 27.872 4.439 1.00 14.14 N ATOM 70 CA LEU A 5 -10.832 27.533 3.018 1.00 70.01 C ATOM 71 C LEU A 5 -10.072 26.248 2.653 1.00 65.02 C ATOM 72 O LEU A 5 -9.597 25.517 3.527 1.00 25.51 O ATOM 73 CB LEU A 5 -10.356 28.690 2.116 1.00 44.34 C ATOM 74 CG LEU A 5 -11.282 29.918 2.042 1.00 24.20 C ATOM 75 CD1 LEU A 5 -12.686 29.510 1.598 1.00 22.41 C ATOM 76 CD2 LEU A 5 -11.320 30.664 3.375 1.00 41.14 C ATOM 0 H LEU A 5 -9.727 28.205 4.678 1.00 14.14 H new ATOM 0 HA LEU A 5 -11.896 27.366 2.852 1.00 70.01 H new ATOM 0 HB2 LEU A 5 -9.378 29.019 2.468 1.00 44.34 H new ATOM 0 HB3 LEU A 5 -10.218 28.303 1.106 1.00 44.34 H new ATOM 0 HG LEU A 5 -10.876 30.601 1.296 1.00 24.20 H new ATOM 0 HD11 LEU A 5 -13.324 30.393 1.552 1.00 22.41 H new ATOM 0 HD12 LEU A 5 -12.636 29.047 0.612 1.00 22.41 H new ATOM 0 HD13 LEU A 5 -13.101 28.799 2.312 1.00 22.41 H new ATOM 0 HD21 LEU A 5 -11.982 31.526 3.291 1.00 41.14 H new ATOM 0 HD22 LEU A 5 -11.689 29.998 4.155 1.00 41.14 H new ATOM 0 HD23 LEU A 5 -10.316 31.002 3.632 1.00 41.14 H new ATOM 88 N ARG A 6 -9.968 25.971 1.354 1.00 64.25 N ATOM 89 CA ARG A 6 -9.237 24.798 0.870 1.00 40.33 C ATOM 90 C ARG A 6 -8.346 25.159 -0.330 1.00 71.43 C ATOM 91 O ARG A 6 -8.758 25.036 -1.484 1.00 75.54 O ATOM 92 CB ARG A 6 -10.217 23.682 0.478 1.00 63.43 C ATOM 93 CG ARG A 6 -9.543 22.345 0.177 1.00 12.30 C ATOM 94 CD ARG A 6 -10.518 21.340 -0.425 1.00 23.32 C ATOM 95 NE ARG A 6 -11.701 21.140 0.412 1.00 24.03 N ATOM 96 CZ ARG A 6 -12.722 20.410 0.062 1.00 15.35 C ATOM 97 NH1 ARG A 6 -12.736 19.808 -1.082 1.00 41.11 N ATOM 98 NH2 ARG A 6 -13.735 20.293 0.857 1.00 20.24 N ATOM 0 H ARG A 6 -10.380 26.542 0.617 1.00 64.25 H new ATOM 0 HA ARG A 6 -8.598 24.443 1.678 1.00 40.33 H new ATOM 0 HB2 ARG A 6 -10.935 23.542 1.286 1.00 63.43 H new ATOM 0 HB3 ARG A 6 -10.781 23.999 -0.399 1.00 63.43 H new ATOM 0 HG2 ARG A 6 -8.713 22.504 -0.512 1.00 12.30 H new ATOM 0 HG3 ARG A 6 -9.121 21.936 1.095 1.00 12.30 H new ATOM 0 HD2 ARG A 6 -10.828 21.685 -1.411 1.00 23.32 H new ATOM 0 HD3 ARG A 6 -10.011 20.386 -0.566 1.00 23.32 H new ATOM 0 HE ARG A 6 -11.728 21.599 1.323 1.00 24.03 H new ATOM 0 HH11 ARG A 6 -11.944 19.903 -1.718 1.00 41.11 H new ATOM 0 HH12 ARG A 6 -13.539 19.238 -1.349 1.00 41.11 H new ATOM 0 HH21 ARG A 6 -13.735 20.772 1.758 1.00 20.24 H new ATOM 0 HH22 ARG A 6 -14.535 19.722 0.584 1.00 20.24 H new ATOM 112 N GLY A 7 -7.145 25.655 -0.049 1.00 52.44 N ATOM 113 CA GLY A 7 -6.176 25.935 -1.107 1.00 40.33 C ATOM 114 C GLY A 7 -5.258 24.750 -1.382 1.00 0.13 C ATOM 115 O GLY A 7 -4.550 24.716 -2.392 1.00 52.02 O ATOM 0 H GLY A 7 -6.820 25.870 0.893 1.00 52.44 H new ATOM 0 HA2 GLY A 7 -6.707 26.200 -2.021 1.00 40.33 H new ATOM 0 HA3 GLY A 7 -5.575 26.800 -0.826 1.00 40.33 H new ATOM 119 N GLN A 8 -5.278 23.776 -0.476 1.00 45.30 N ATOM 120 CA GLN A 8 -4.443 22.577 -0.590 1.00 42.24 C ATOM 121 C GLN A 8 -5.159 21.447 -1.351 1.00 1.03 C ATOM 122 O GLN A 8 -6.391 21.369 -1.357 1.00 53.11 O ATOM 123 CB GLN A 8 -4.047 22.086 0.810 1.00 21.12 C ATOM 124 CG GLN A 8 -5.234 21.791 1.724 1.00 30.23 C ATOM 125 CD GLN A 8 -4.810 21.235 3.073 1.00 32.42 C ATOM 126 OE1 GLN A 8 -4.559 21.976 4.016 1.00 53.20 O ATOM 127 NE2 GLN A 8 -4.742 19.924 3.175 1.00 73.21 N ATOM 0 H GLN A 8 -5.869 23.792 0.355 1.00 45.30 H new ATOM 0 HA GLN A 8 -3.552 22.847 -1.157 1.00 42.24 H new ATOM 0 HB2 GLN A 8 -3.445 21.183 0.710 1.00 21.12 H new ATOM 0 HB3 GLN A 8 -3.416 22.839 1.283 1.00 21.12 H new ATOM 0 HG2 GLN A 8 -5.807 22.706 1.876 1.00 30.23 H new ATOM 0 HG3 GLN A 8 -5.897 21.078 1.234 1.00 30.23 H new ATOM 0 HE21 GLN A 8 -4.958 19.338 2.369 1.00 73.21 H new ATOM 0 HE22 GLN A 8 -4.473 19.495 4.060 1.00 73.21 H new ATOM 136 N VAL A 9 -4.380 20.572 -1.986 1.00 32.34 N ATOM 137 CA VAL A 9 -4.937 19.422 -2.716 1.00 2.51 C ATOM 138 C VAL A 9 -5.032 18.162 -1.824 1.00 50.41 C ATOM 139 O VAL A 9 -6.083 17.525 -1.744 1.00 12.05 O ATOM 140 CB VAL A 9 -4.113 19.113 -4.000 1.00 4.22 C ATOM 141 CG1 VAL A 9 -2.637 18.882 -3.677 1.00 43.04 C ATOM 142 CG2 VAL A 9 -4.703 17.919 -4.755 1.00 10.34 C ATOM 0 H VAL A 9 -3.362 20.633 -2.013 1.00 32.34 H new ATOM 0 HA VAL A 9 -5.949 19.699 -3.012 1.00 2.51 H new ATOM 0 HB VAL A 9 -4.174 19.987 -4.648 1.00 4.22 H new ATOM 0 HG11 VAL A 9 -2.092 18.669 -4.597 1.00 43.04 H new ATOM 0 HG12 VAL A 9 -2.223 19.775 -3.209 1.00 43.04 H new ATOM 0 HG13 VAL A 9 -2.542 18.037 -2.995 1.00 43.04 H new ATOM 0 HG21 VAL A 9 -4.109 17.724 -5.648 1.00 10.34 H new ATOM 0 HG22 VAL A 9 -4.691 17.039 -4.111 1.00 10.34 H new ATOM 0 HG23 VAL A 9 -5.730 18.143 -5.044 1.00 10.34 H new ATOM 152 N SER A 10 -3.932 17.809 -1.163 1.00 15.14 N ATOM 153 CA SER A 10 -3.888 16.646 -0.254 1.00 5.53 C ATOM 154 C SER A 10 -2.800 16.861 0.805 1.00 73.10 C ATOM 155 O SER A 10 -2.192 15.916 1.301 1.00 22.35 O ATOM 156 CB SER A 10 -3.583 15.356 -1.042 1.00 2.41 C ATOM 157 OG SER A 10 -4.482 15.164 -2.128 1.00 22.31 O ATOM 0 H SER A 10 -3.047 18.311 -1.235 1.00 15.14 H new ATOM 0 HA SER A 10 -4.860 16.545 0.229 1.00 5.53 H new ATOM 0 HB2 SER A 10 -2.562 15.397 -1.421 1.00 2.41 H new ATOM 0 HB3 SER A 10 -3.640 14.500 -0.370 1.00 2.41 H new ATOM 0 HG SER A 10 -4.070 14.574 -2.793 1.00 22.31 H new ATOM 163 N GLU A 11 -2.592 18.122 1.164 1.00 65.30 N ATOM 164 CA GLU A 11 -1.417 18.544 1.931 1.00 74.21 C ATOM 165 C GLU A 11 -1.626 18.512 3.458 1.00 72.40 C ATOM 166 O GLU A 11 -2.749 18.436 3.953 1.00 24.35 O ATOM 167 CB GLU A 11 -1.025 19.944 1.444 1.00 51.24 C ATOM 168 CG GLU A 11 -0.681 19.964 -0.048 1.00 4.14 C ATOM 169 CD GLU A 11 -0.767 21.340 -0.682 1.00 23.21 C ATOM 170 OE1 GLU A 11 -0.006 22.234 -0.276 1.00 4.44 O ATOM 171 OE2 GLU A 11 -1.592 21.522 -1.604 1.00 54.34 O ATOM 0 H GLU A 11 -3.230 18.884 0.934 1.00 65.30 H new ATOM 0 HA GLU A 11 -0.612 17.831 1.755 1.00 74.21 H new ATOM 0 HB2 GLU A 11 -1.845 20.636 1.635 1.00 51.24 H new ATOM 0 HB3 GLU A 11 -0.169 20.299 2.017 1.00 51.24 H new ATOM 0 HG2 GLU A 11 0.328 19.575 -0.183 1.00 4.14 H new ATOM 0 HG3 GLU A 11 -1.356 19.289 -0.575 1.00 4.14 H new ATOM 178 N LEU A 12 -0.511 18.563 4.190 1.00 43.42 N ATOM 179 CA LEU A 12 -0.509 18.497 5.659 1.00 73.15 C ATOM 180 C LEU A 12 0.498 19.507 6.255 1.00 42.41 C ATOM 181 O LEU A 12 1.371 20.003 5.542 1.00 65.45 O ATOM 182 CB LEU A 12 -0.203 17.052 6.115 1.00 45.21 C ATOM 183 CG LEU A 12 0.822 16.276 5.262 1.00 3.54 C ATOM 184 CD1 LEU A 12 2.232 16.822 5.452 1.00 24.32 C ATOM 185 CD2 LEU A 12 0.770 14.782 5.576 1.00 60.52 C ATOM 0 H LEU A 12 0.420 18.651 3.783 1.00 43.42 H new ATOM 0 HA LEU A 12 -1.496 18.772 6.030 1.00 73.15 H new ATOM 0 HB2 LEU A 12 0.160 17.086 7.142 1.00 45.21 H new ATOM 0 HB3 LEU A 12 -1.137 16.490 6.125 1.00 45.21 H new ATOM 0 HG LEU A 12 0.553 16.414 4.215 1.00 3.54 H new ATOM 0 HD11 LEU A 12 2.929 16.253 4.837 1.00 24.32 H new ATOM 0 HD12 LEU A 12 2.259 17.870 5.155 1.00 24.32 H new ATOM 0 HD13 LEU A 12 2.518 16.734 6.500 1.00 24.32 H new ATOM 0 HD21 LEU A 12 1.501 14.256 4.963 1.00 60.52 H new ATOM 0 HD22 LEU A 12 0.999 14.624 6.630 1.00 60.52 H new ATOM 0 HD23 LEU A 12 -0.227 14.399 5.360 1.00 60.52 H new ATOM 197 N PRO A 13 0.391 19.832 7.564 1.00 23.44 N ATOM 198 CA PRO A 13 1.241 20.864 8.200 1.00 52.32 C ATOM 199 C PRO A 13 2.723 20.464 8.365 1.00 4.03 C ATOM 200 O PRO A 13 3.614 21.291 8.160 1.00 1.25 O ATOM 201 CB PRO A 13 0.580 21.064 9.570 1.00 33.14 C ATOM 202 CG PRO A 13 -0.095 19.768 9.855 1.00 3.33 C ATOM 203 CD PRO A 13 -0.572 19.249 8.525 1.00 31.12 C ATOM 0 HA PRO A 13 1.290 21.760 7.581 1.00 52.32 H new ATOM 0 HB2 PRO A 13 1.319 21.303 10.335 1.00 33.14 H new ATOM 0 HB3 PRO A 13 -0.135 21.887 9.549 1.00 33.14 H new ATOM 0 HG2 PRO A 13 0.593 19.065 10.325 1.00 3.33 H new ATOM 0 HG3 PRO A 13 -0.930 19.905 10.543 1.00 3.33 H new ATOM 0 HD2 PRO A 13 -0.563 18.160 8.492 1.00 31.12 H new ATOM 0 HD3 PRO A 13 -1.593 19.566 8.313 1.00 31.12 H new ATOM 211 N PHE A 14 2.999 19.212 8.745 1.00 75.01 N ATOM 212 CA PHE A 14 4.391 18.787 8.970 1.00 61.42 C ATOM 213 C PHE A 14 5.121 18.528 7.640 1.00 63.04 C ATOM 214 O PHE A 14 4.943 17.496 6.997 1.00 10.43 O ATOM 215 CB PHE A 14 4.479 17.571 9.918 1.00 33.52 C ATOM 216 CG PHE A 14 3.497 16.452 9.647 1.00 41.04 C ATOM 217 CD1 PHE A 14 3.789 15.447 8.734 1.00 73.14 C ATOM 218 CD2 PHE A 14 2.288 16.394 10.330 1.00 24.14 C ATOM 219 CE1 PHE A 14 2.897 14.418 8.504 1.00 44.23 C ATOM 220 CE2 PHE A 14 1.395 15.363 10.105 1.00 23.41 C ATOM 221 CZ PHE A 14 1.700 14.376 9.192 1.00 44.34 C ATOM 0 H PHE A 14 2.298 18.488 8.901 1.00 75.01 H new ATOM 0 HA PHE A 14 4.902 19.611 9.468 1.00 61.42 H new ATOM 0 HB2 PHE A 14 5.489 17.164 9.863 1.00 33.52 H new ATOM 0 HB3 PHE A 14 4.331 17.920 10.940 1.00 33.52 H new ATOM 0 HD1 PHE A 14 4.726 15.470 8.197 1.00 73.14 H new ATOM 0 HD2 PHE A 14 2.043 17.165 11.046 1.00 24.14 H new ATOM 0 HE1 PHE A 14 3.135 13.647 7.787 1.00 44.23 H new ATOM 0 HE2 PHE A 14 0.460 15.331 10.644 1.00 23.41 H new ATOM 0 HZ PHE A 14 1.003 13.570 9.015 1.00 44.34 H new ATOM 231 N GLU A 15 5.936 19.501 7.234 1.00 42.52 N ATOM 232 CA GLU A 15 6.613 19.474 5.930 1.00 25.40 C ATOM 233 C GLU A 15 7.739 18.422 5.845 1.00 61.32 C ATOM 234 O GLU A 15 7.805 17.657 4.890 1.00 14.54 O ATOM 235 CB GLU A 15 7.169 20.869 5.605 1.00 54.43 C ATOM 236 CG GLU A 15 8.121 21.413 6.663 1.00 75.21 C ATOM 237 CD GLU A 15 8.693 22.769 6.295 1.00 11.45 C ATOM 238 OE1 GLU A 15 9.574 22.825 5.414 1.00 41.12 O ATOM 239 OE2 GLU A 15 8.271 23.784 6.887 1.00 14.41 O ATOM 0 H GLU A 15 6.147 20.327 7.793 1.00 42.52 H new ATOM 0 HA GLU A 15 5.864 19.184 5.193 1.00 25.40 H new ATOM 0 HB2 GLU A 15 7.689 20.829 4.648 1.00 54.43 H new ATOM 0 HB3 GLU A 15 6.337 21.563 5.487 1.00 54.43 H new ATOM 0 HG2 GLU A 15 7.594 21.492 7.614 1.00 75.21 H new ATOM 0 HG3 GLU A 15 8.938 20.706 6.809 1.00 75.21 H new ATOM 246 N ARG A 16 8.635 18.380 6.825 1.00 54.50 N ATOM 247 CA ARG A 16 9.775 17.454 6.760 1.00 43.30 C ATOM 248 C ARG A 16 9.384 16.064 7.289 1.00 51.15 C ATOM 249 O ARG A 16 9.005 15.915 8.450 1.00 54.24 O ATOM 250 CB ARG A 16 10.969 18.008 7.554 1.00 71.55 C ATOM 251 CG ARG A 16 11.275 19.482 7.281 1.00 20.32 C ATOM 252 CD ARG A 16 11.544 19.766 5.804 1.00 41.53 C ATOM 253 NE ARG A 16 12.781 19.144 5.327 1.00 15.02 N ATOM 254 CZ ARG A 16 13.515 19.631 4.357 1.00 20.13 C ATOM 255 NH1 ARG A 16 13.194 20.743 3.776 1.00 73.14 N ATOM 256 NH2 ARG A 16 14.584 19.011 3.973 1.00 70.34 N ATOM 0 H ARG A 16 8.602 18.962 7.662 1.00 54.50 H new ATOM 0 HA ARG A 16 10.067 17.354 5.715 1.00 43.30 H new ATOM 0 HB2 ARG A 16 10.773 17.880 8.619 1.00 71.55 H new ATOM 0 HB3 ARG A 16 11.853 17.416 7.319 1.00 71.55 H new ATOM 0 HG2 ARG A 16 10.436 20.091 7.617 1.00 20.32 H new ATOM 0 HG3 ARG A 16 12.142 19.783 7.868 1.00 20.32 H new ATOM 0 HD2 ARG A 16 10.706 19.402 5.209 1.00 41.53 H new ATOM 0 HD3 ARG A 16 11.600 20.844 5.649 1.00 41.53 H new ATOM 0 HE ARG A 16 13.089 18.282 5.776 1.00 15.02 H new ATOM 0 HH11 ARG A 16 12.361 21.251 4.072 1.00 73.14 H new ATOM 0 HH12 ARG A 16 13.774 21.111 3.022 1.00 73.14 H new ATOM 0 HH21 ARG A 16 14.858 18.139 4.426 1.00 70.34 H new ATOM 0 HH22 ARG A 16 15.152 19.394 3.217 1.00 70.34 H new ATOM 270 N VAL A 17 9.467 15.046 6.437 1.00 53.10 N ATOM 271 CA VAL A 17 9.107 13.678 6.836 1.00 73.44 C ATOM 272 C VAL A 17 10.211 12.669 6.482 1.00 62.11 C ATOM 273 O VAL A 17 10.872 12.785 5.449 1.00 50.35 O ATOM 274 CB VAL A 17 7.765 13.231 6.193 1.00 72.52 C ATOM 275 CG1 VAL A 17 6.605 14.090 6.701 1.00 4.21 C ATOM 276 CG2 VAL A 17 7.846 13.278 4.667 1.00 41.32 C ATOM 0 H VAL A 17 9.778 15.136 5.470 1.00 53.10 H new ATOM 0 HA VAL A 17 8.989 13.694 7.920 1.00 73.44 H new ATOM 0 HB VAL A 17 7.579 12.199 6.489 1.00 72.52 H new ATOM 0 HG11 VAL A 17 5.676 13.758 6.237 1.00 4.21 H new ATOM 0 HG12 VAL A 17 6.525 13.991 7.784 1.00 4.21 H new ATOM 0 HG13 VAL A 17 6.786 15.134 6.445 1.00 4.21 H new ATOM 0 HG21 VAL A 17 6.894 12.960 4.242 1.00 41.32 H new ATOM 0 HG22 VAL A 17 8.065 14.296 4.345 1.00 41.32 H new ATOM 0 HG23 VAL A 17 8.637 12.611 4.324 1.00 41.32 H new ATOM 286 N TYR A 18 10.416 11.691 7.362 1.00 1.21 N ATOM 287 CA TYR A 18 11.410 10.632 7.147 1.00 3.24 C ATOM 288 C TYR A 18 10.729 9.263 7.007 1.00 40.13 C ATOM 289 O TYR A 18 9.843 8.919 7.788 1.00 42.44 O ATOM 290 CB TYR A 18 12.413 10.613 8.313 1.00 11.22 C ATOM 291 CG TYR A 18 13.398 9.454 8.275 1.00 32.33 C ATOM 292 CD1 TYR A 18 14.463 9.442 7.380 1.00 64.32 C ATOM 293 CD2 TYR A 18 13.261 8.374 9.143 1.00 53.24 C ATOM 294 CE1 TYR A 18 15.360 8.390 7.351 1.00 22.33 C ATOM 295 CE2 TYR A 18 14.153 7.319 9.119 1.00 3.43 C ATOM 296 CZ TYR A 18 15.201 7.330 8.222 1.00 24.42 C ATOM 297 OH TYR A 18 16.095 6.278 8.198 1.00 4.13 O ATOM 0 H TYR A 18 9.903 11.607 8.240 1.00 1.21 H new ATOM 0 HA TYR A 18 11.944 10.840 6.220 1.00 3.24 H new ATOM 0 HB2 TYR A 18 12.972 11.549 8.311 1.00 11.22 H new ATOM 0 HB3 TYR A 18 11.860 10.574 9.252 1.00 11.22 H new ATOM 0 HD1 TYR A 18 14.591 10.268 6.696 1.00 64.32 H new ATOM 0 HD2 TYR A 18 12.443 8.361 9.848 1.00 53.24 H new ATOM 0 HE1 TYR A 18 16.182 8.397 6.650 1.00 22.33 H new ATOM 0 HE2 TYR A 18 14.030 6.489 9.800 1.00 3.43 H new ATOM 0 HH TYR A 18 15.840 5.617 8.875 1.00 4.13 H new ATOM 307 N ILE A 19 11.144 8.490 6.010 1.00 61.45 N ATOM 308 CA ILE A 19 10.586 7.152 5.776 1.00 5.12 C ATOM 309 C ILE A 19 11.575 6.052 6.202 1.00 43.01 C ATOM 310 O ILE A 19 12.786 6.189 6.026 1.00 74.43 O ATOM 311 CB ILE A 19 10.208 6.957 4.280 1.00 31.32 C ATOM 312 CG1 ILE A 19 9.608 5.557 4.044 1.00 14.05 C ATOM 313 CG2 ILE A 19 11.423 7.185 3.380 1.00 22.32 C ATOM 314 CD1 ILE A 19 9.200 5.295 2.607 1.00 4.32 C ATOM 0 H ILE A 19 11.868 8.763 5.345 1.00 61.45 H new ATOM 0 HA ILE A 19 9.685 7.070 6.384 1.00 5.12 H new ATOM 0 HB ILE A 19 9.451 7.697 4.023 1.00 31.32 H new ATOM 0 HG12 ILE A 19 10.337 4.805 4.347 1.00 14.05 H new ATOM 0 HG13 ILE A 19 8.736 5.433 4.687 1.00 14.05 H new ATOM 0 HG21 ILE A 19 11.136 7.043 2.338 1.00 22.32 H new ATOM 0 HG22 ILE A 19 11.794 8.201 3.519 1.00 22.32 H new ATOM 0 HG23 ILE A 19 12.207 6.474 3.640 1.00 22.32 H new ATOM 0 HD11 ILE A 19 8.787 4.290 2.523 1.00 4.32 H new ATOM 0 HD12 ILE A 19 8.447 6.023 2.304 1.00 4.32 H new ATOM 0 HD13 ILE A 19 10.072 5.384 1.959 1.00 4.32 H new ATOM 326 N THR A 20 11.059 4.968 6.779 1.00 64.44 N ATOM 327 CA THR A 20 11.897 3.823 7.161 1.00 62.45 C ATOM 328 C THR A 20 11.216 2.488 6.822 1.00 41.41 C ATOM 329 O THR A 20 10.126 2.179 7.314 1.00 33.34 O ATOM 330 CB THR A 20 12.275 3.857 8.666 1.00 75.43 C ATOM 331 OG1 THR A 20 13.015 2.677 9.026 1.00 34.13 O ATOM 332 CG2 THR A 20 11.044 3.984 9.556 1.00 12.33 C ATOM 0 H THR A 20 10.068 4.855 6.993 1.00 64.44 H new ATOM 0 HA THR A 20 12.815 3.904 6.578 1.00 62.45 H new ATOM 0 HB THR A 20 12.898 4.738 8.823 1.00 75.43 H new ATOM 0 HG1 THR A 20 13.247 2.714 9.977 1.00 34.13 H new ATOM 0 HG21 THR A 20 11.351 4.004 10.602 1.00 12.33 H new ATOM 0 HG22 THR A 20 10.515 4.906 9.315 1.00 12.33 H new ATOM 0 HG23 THR A 20 10.384 3.133 9.388 1.00 12.33 H new ATOM 340 N ALA A 21 11.858 1.709 5.952 1.00 5.40 N ATOM 341 CA ALA A 21 11.345 0.395 5.551 1.00 22.41 C ATOM 342 C ALA A 21 12.264 -0.731 6.050 1.00 24.30 C ATOM 343 O ALA A 21 13.482 -0.651 5.904 1.00 64.13 O ATOM 344 CB ALA A 21 11.194 0.328 4.034 1.00 30.22 C ATOM 0 H ALA A 21 12.740 1.965 5.508 1.00 5.40 H new ATOM 0 HA ALA A 21 10.365 0.257 6.008 1.00 22.41 H new ATOM 0 HB1 ALA A 21 10.812 -0.653 3.749 1.00 30.22 H new ATOM 0 HB2 ALA A 21 10.497 1.098 3.703 1.00 30.22 H new ATOM 0 HB3 ALA A 21 12.164 0.490 3.564 1.00 30.22 H new ATOM 350 N PRO A 22 11.692 -1.803 6.631 1.00 22.01 N ATOM 351 CA PRO A 22 12.477 -2.901 7.226 1.00 4.33 C ATOM 352 C PRO A 22 13.347 -3.649 6.202 1.00 0.41 C ATOM 353 O PRO A 22 14.518 -3.938 6.457 1.00 42.34 O ATOM 354 CB PRO A 22 11.399 -3.835 7.809 1.00 73.43 C ATOM 355 CG PRO A 22 10.155 -3.503 7.052 1.00 4.23 C ATOM 356 CD PRO A 22 10.241 -2.031 6.763 1.00 41.12 C ATOM 0 HA PRO A 22 13.188 -2.529 7.964 1.00 4.33 H new ATOM 0 HB2 PRO A 22 11.672 -4.882 7.681 1.00 73.43 H new ATOM 0 HB3 PRO A 22 11.268 -3.668 8.878 1.00 73.43 H new ATOM 0 HG2 PRO A 22 10.091 -4.081 6.130 1.00 4.23 H new ATOM 0 HG3 PRO A 22 9.266 -3.737 7.637 1.00 4.23 H new ATOM 0 HD2 PRO A 22 9.706 -1.767 5.851 1.00 41.12 H new ATOM 0 HD3 PRO A 22 9.811 -1.436 7.568 1.00 41.12 H new ATOM 364 N ALA A 23 12.771 -3.964 5.043 1.00 5.52 N ATOM 365 CA ALA A 23 13.483 -4.724 4.004 1.00 64.13 C ATOM 366 C ALA A 23 13.597 -3.944 2.683 1.00 11.35 C ATOM 367 O ALA A 23 13.988 -4.505 1.660 1.00 32.24 O ATOM 368 CB ALA A 23 12.780 -6.056 3.773 1.00 21.11 C ATOM 0 H ALA A 23 11.815 -3.708 4.795 1.00 5.52 H new ATOM 0 HA ALA A 23 14.499 -4.898 4.359 1.00 64.13 H new ATOM 0 HB1 ALA A 23 13.309 -6.618 3.003 1.00 21.11 H new ATOM 0 HB2 ALA A 23 12.773 -6.629 4.700 1.00 21.11 H new ATOM 0 HB3 ALA A 23 11.755 -5.875 3.451 1.00 21.11 H new ATOM 374 N GLY A 24 13.279 -2.648 2.717 1.00 13.44 N ATOM 375 CA GLY A 24 13.304 -1.827 1.502 1.00 23.03 C ATOM 376 C GLY A 24 12.334 -2.316 0.425 1.00 13.31 C ATOM 377 O GLY A 24 12.746 -2.899 -0.578 1.00 12.34 O ATOM 0 H GLY A 24 13.004 -2.148 3.562 1.00 13.44 H new ATOM 0 HA2 GLY A 24 13.059 -0.797 1.762 1.00 23.03 H new ATOM 0 HA3 GLY A 24 14.315 -1.821 1.096 1.00 23.03 H new ATOM 381 N LEU A 25 11.039 -2.068 0.633 1.00 74.24 N ATOM 382 CA LEU A 25 9.993 -2.567 -0.274 1.00 4.22 C ATOM 383 C LEU A 25 9.628 -1.526 -1.350 1.00 53.54 C ATOM 384 O LEU A 25 9.865 -0.330 -1.173 1.00 14.50 O ATOM 385 CB LEU A 25 8.724 -2.948 0.517 1.00 43.02 C ATOM 386 CG LEU A 25 8.900 -4.003 1.631 1.00 24.20 C ATOM 387 CD1 LEU A 25 9.629 -3.419 2.840 1.00 21.24 C ATOM 388 CD2 LEU A 25 7.545 -4.572 2.049 1.00 45.41 C ATOM 0 H LEU A 25 10.686 -1.525 1.421 1.00 74.24 H new ATOM 0 HA LEU A 25 10.394 -3.451 -0.770 1.00 4.22 H new ATOM 0 HB2 LEU A 25 8.316 -2.042 0.966 1.00 43.02 H new ATOM 0 HB3 LEU A 25 7.980 -3.317 -0.189 1.00 43.02 H new ATOM 0 HG LEU A 25 9.511 -4.812 1.230 1.00 24.20 H new ATOM 0 HD11 LEU A 25 9.737 -4.187 3.606 1.00 21.24 H new ATOM 0 HD12 LEU A 25 10.615 -3.069 2.536 1.00 21.24 H new ATOM 0 HD13 LEU A 25 9.056 -2.584 3.242 1.00 21.24 H new ATOM 0 HD21 LEU A 25 7.689 -5.314 2.835 1.00 45.41 H new ATOM 0 HD22 LEU A 25 6.912 -3.767 2.421 1.00 45.41 H new ATOM 0 HD23 LEU A 25 7.067 -5.042 1.189 1.00 45.41 H new ATOM 400 N THR A 26 9.033 -1.995 -2.453 1.00 40.33 N ATOM 401 CA THR A 26 8.577 -1.115 -3.549 1.00 64.02 C ATOM 402 C THR A 26 7.736 0.057 -3.031 1.00 61.32 C ATOM 403 O THR A 26 7.951 1.207 -3.418 1.00 32.45 O ATOM 404 CB THR A 26 7.727 -1.890 -4.585 1.00 32.21 C ATOM 405 OG1 THR A 26 6.618 -2.524 -3.928 1.00 75.24 O ATOM 406 CG2 THR A 26 8.559 -2.940 -5.318 1.00 32.23 C ATOM 0 H THR A 26 8.853 -2.986 -2.616 1.00 40.33 H new ATOM 0 HA THR A 26 9.483 -0.734 -4.020 1.00 64.02 H new ATOM 0 HB THR A 26 7.361 -1.175 -5.321 1.00 32.21 H new ATOM 0 HG1 THR A 26 6.082 -3.012 -4.588 1.00 75.24 H new ATOM 0 HG21 THR A 26 7.931 -3.465 -6.037 1.00 32.23 H new ATOM 0 HG22 THR A 26 9.381 -2.452 -5.842 1.00 32.23 H new ATOM 0 HG23 THR A 26 8.960 -3.654 -4.598 1.00 32.23 H new ATOM 414 N ILE A 27 6.790 -0.250 -2.142 1.00 70.34 N ATOM 415 CA ILE A 27 5.907 0.758 -1.532 1.00 11.22 C ATOM 416 C ILE A 27 6.687 1.978 -0.998 1.00 43.24 C ATOM 417 O ILE A 27 6.151 3.086 -0.922 1.00 42.32 O ATOM 418 CB ILE A 27 5.067 0.128 -0.389 1.00 63.50 C ATOM 419 CG1 ILE A 27 4.068 1.150 0.187 1.00 3.22 C ATOM 420 CG2 ILE A 27 5.977 -0.426 0.709 1.00 64.44 C ATOM 421 CD1 ILE A 27 3.158 0.584 1.260 1.00 25.21 C ATOM 0 H ILE A 27 6.611 -1.202 -1.822 1.00 70.34 H new ATOM 0 HA ILE A 27 5.242 1.112 -2.320 1.00 11.22 H new ATOM 0 HB ILE A 27 4.495 -0.701 -0.805 1.00 63.50 H new ATOM 0 HG12 ILE A 27 4.623 1.991 0.602 1.00 3.22 H new ATOM 0 HG13 ILE A 27 3.456 1.542 -0.625 1.00 3.22 H new ATOM 0 HG21 ILE A 27 5.368 -0.863 1.500 1.00 64.44 H new ATOM 0 HG22 ILE A 27 6.630 -1.191 0.289 1.00 64.44 H new ATOM 0 HG23 ILE A 27 6.583 0.381 1.121 1.00 64.44 H new ATOM 0 HD11 ILE A 27 2.485 1.364 1.615 1.00 25.21 H new ATOM 0 HD12 ILE A 27 2.574 -0.238 0.846 1.00 25.21 H new ATOM 0 HD13 ILE A 27 3.760 0.218 2.092 1.00 25.21 H new ATOM 433 N GLY A 28 7.955 1.769 -0.643 1.00 0.40 N ATOM 434 CA GLY A 28 8.799 2.864 -0.178 1.00 70.30 C ATOM 435 C GLY A 28 9.054 3.913 -1.258 1.00 54.51 C ATOM 436 O GLY A 28 9.080 5.112 -0.978 1.00 62.34 O ATOM 0 H GLY A 28 8.415 0.859 -0.669 1.00 0.40 H new ATOM 0 HA2 GLY A 28 8.327 3.341 0.681 1.00 70.30 H new ATOM 0 HA3 GLY A 28 9.753 2.462 0.164 1.00 70.30 H new ATOM 440 N SER A 29 9.247 3.460 -2.497 1.00 44.52 N ATOM 441 CA SER A 29 9.462 4.369 -3.635 1.00 33.52 C ATOM 442 C SER A 29 8.163 5.087 -4.016 1.00 60.12 C ATOM 443 O SER A 29 8.159 6.291 -4.281 1.00 34.41 O ATOM 444 CB SER A 29 10.010 3.599 -4.847 1.00 31.10 C ATOM 445 OG SER A 29 11.287 3.037 -4.573 1.00 73.31 O ATOM 0 H SER A 29 9.260 2.470 -2.743 1.00 44.52 H new ATOM 0 HA SER A 29 10.195 5.116 -3.331 1.00 33.52 H new ATOM 0 HB2 SER A 29 9.314 2.806 -5.121 1.00 31.10 H new ATOM 0 HB3 SER A 29 10.083 4.270 -5.703 1.00 31.10 H new ATOM 0 HG SER A 29 11.607 2.553 -5.362 1.00 73.31 H new ATOM 451 N ASP A 30 7.063 4.338 -4.050 1.00 73.21 N ATOM 452 CA ASP A 30 5.741 4.918 -4.292 1.00 10.34 C ATOM 453 C ASP A 30 5.414 6.007 -3.258 1.00 54.54 C ATOM 454 O ASP A 30 5.013 7.115 -3.615 1.00 21.43 O ATOM 455 CB ASP A 30 4.671 3.821 -4.251 1.00 33.22 C ATOM 456 CG ASP A 30 4.827 2.820 -5.383 1.00 60.01 C ATOM 457 OD1 ASP A 30 5.758 1.992 -5.325 1.00 73.35 O ATOM 458 OD2 ASP A 30 4.020 2.861 -6.338 1.00 13.02 O ATOM 0 H ASP A 30 7.060 3.327 -3.913 1.00 73.21 H new ATOM 0 HA ASP A 30 5.750 5.379 -5.280 1.00 10.34 H new ATOM 0 HB2 ASP A 30 4.727 3.298 -3.296 1.00 33.22 H new ATOM 0 HB3 ASP A 30 3.683 4.278 -4.307 1.00 33.22 H new ATOM 463 N LEU A 31 5.615 5.687 -1.979 1.00 10.43 N ATOM 464 CA LEU A 31 5.270 6.599 -0.880 1.00 64.13 C ATOM 465 C LEU A 31 5.942 7.975 -1.032 1.00 35.20 C ATOM 466 O LEU A 31 5.266 9.003 -0.987 1.00 35.43 O ATOM 467 CB LEU A 31 5.643 5.974 0.474 1.00 12.23 C ATOM 468 CG LEU A 31 5.155 6.751 1.712 1.00 32.10 C ATOM 469 CD1 LEU A 31 3.634 6.897 1.699 1.00 11.53 C ATOM 470 CD2 LEU A 31 5.624 6.072 2.999 1.00 5.53 C ATOM 0 H LEU A 31 6.016 4.800 -1.675 1.00 10.43 H new ATOM 0 HA LEU A 31 4.192 6.756 -0.920 1.00 64.13 H new ATOM 0 HB2 LEU A 31 5.235 4.964 0.515 1.00 12.23 H new ATOM 0 HB3 LEU A 31 6.728 5.882 0.527 1.00 12.23 H new ATOM 0 HG LEU A 31 5.591 7.750 1.677 1.00 32.10 H new ATOM 0 HD11 LEU A 31 3.314 7.449 2.583 1.00 11.53 H new ATOM 0 HD12 LEU A 31 3.328 7.437 0.803 1.00 11.53 H new ATOM 0 HD13 LEU A 31 3.174 5.909 1.702 1.00 11.53 H new ATOM 0 HD21 LEU A 31 5.268 6.638 3.860 1.00 5.53 H new ATOM 0 HD22 LEU A 31 5.226 5.058 3.041 1.00 5.53 H new ATOM 0 HD23 LEU A 31 6.713 6.035 3.015 1.00 5.53 H new ATOM 482 N GLU A 32 7.263 7.995 -1.227 1.00 74.42 N ATOM 483 CA GLU A 32 8.005 9.260 -1.379 1.00 65.21 C ATOM 484 C GLU A 32 7.403 10.142 -2.489 1.00 22.33 C ATOM 485 O GLU A 32 7.184 11.342 -2.298 1.00 62.34 O ATOM 486 CB GLU A 32 9.487 8.996 -1.691 1.00 22.30 C ATOM 487 CG GLU A 32 10.234 8.226 -0.606 1.00 70.04 C ATOM 488 CD GLU A 32 11.723 8.098 -0.905 1.00 34.30 C ATOM 489 OE1 GLU A 32 12.081 7.392 -1.876 1.00 44.44 O ATOM 490 OE2 GLU A 32 12.540 8.709 -0.183 1.00 21.10 O ATOM 0 H GLU A 32 7.843 7.158 -1.284 1.00 74.42 H new ATOM 0 HA GLU A 32 7.924 9.789 -0.429 1.00 65.21 H new ATOM 0 HB2 GLU A 32 9.555 8.440 -2.626 1.00 22.30 H new ATOM 0 HB3 GLU A 32 9.987 9.951 -1.851 1.00 22.30 H new ATOM 0 HG2 GLU A 32 10.100 8.730 0.351 1.00 70.04 H new ATOM 0 HG3 GLU A 32 9.800 7.231 -0.506 1.00 70.04 H new ATOM 497 N ARG A 33 7.135 9.534 -3.644 1.00 61.45 N ATOM 498 CA ARG A 33 6.571 10.256 -4.792 1.00 42.15 C ATOM 499 C ARG A 33 5.139 10.746 -4.510 1.00 61.14 C ATOM 500 O ARG A 33 4.797 11.896 -4.798 1.00 21.55 O ATOM 501 CB ARG A 33 6.581 9.356 -6.035 1.00 34.44 C ATOM 502 CG ARG A 33 7.981 8.929 -6.473 1.00 54.43 C ATOM 503 CD ARG A 33 7.937 7.979 -7.667 1.00 51.42 C ATOM 504 NE ARG A 33 9.276 7.568 -8.100 1.00 62.12 N ATOM 505 CZ ARG A 33 9.576 6.366 -8.524 1.00 23.43 C ATOM 506 NH1 ARG A 33 8.668 5.441 -8.567 1.00 63.11 N ATOM 507 NH2 ARG A 33 10.785 6.091 -8.900 1.00 55.35 N ATOM 0 H ARG A 33 7.298 8.541 -3.813 1.00 61.45 H new ATOM 0 HA ARG A 33 7.194 11.133 -4.971 1.00 42.15 H new ATOM 0 HB2 ARG A 33 5.986 8.466 -5.833 1.00 34.44 H new ATOM 0 HB3 ARG A 33 6.097 9.882 -6.858 1.00 34.44 H new ATOM 0 HG2 ARG A 33 8.566 9.812 -6.732 1.00 54.43 H new ATOM 0 HG3 ARG A 33 8.490 8.443 -5.641 1.00 54.43 H new ATOM 0 HD2 ARG A 33 7.355 7.095 -7.404 1.00 51.42 H new ATOM 0 HD3 ARG A 33 7.422 8.465 -8.496 1.00 51.42 H new ATOM 0 HE ARG A 33 10.022 8.263 -8.069 1.00 62.12 H new ATOM 0 HH11 ARG A 33 7.715 5.648 -8.270 1.00 63.11 H new ATOM 0 HH12 ARG A 33 8.907 4.506 -8.898 1.00 63.11 H new ATOM 0 HH21 ARG A 33 11.506 6.812 -8.866 1.00 55.35 H new ATOM 0 HH22 ARG A 33 11.016 5.154 -9.230 1.00 55.35 H new ATOM 521 N VAL A 34 4.306 9.868 -3.955 1.00 75.45 N ATOM 522 CA VAL A 34 2.921 10.219 -3.611 1.00 2.23 C ATOM 523 C VAL A 34 2.868 11.380 -2.602 1.00 0.32 C ATOM 524 O VAL A 34 2.061 12.303 -2.741 1.00 11.21 O ATOM 525 CB VAL A 34 2.158 8.994 -3.044 1.00 65.42 C ATOM 526 CG1 VAL A 34 0.762 9.384 -2.566 1.00 45.23 C ATOM 527 CG2 VAL A 34 2.072 7.885 -4.091 1.00 1.43 C ATOM 0 H VAL A 34 4.562 8.906 -3.732 1.00 75.45 H new ATOM 0 HA VAL A 34 2.434 10.540 -4.532 1.00 2.23 H new ATOM 0 HB VAL A 34 2.716 8.622 -2.185 1.00 65.42 H new ATOM 0 HG11 VAL A 34 0.252 8.504 -2.174 1.00 45.23 H new ATOM 0 HG12 VAL A 34 0.843 10.136 -1.781 1.00 45.23 H new ATOM 0 HG13 VAL A 34 0.192 9.791 -3.401 1.00 45.23 H new ATOM 0 HG21 VAL A 34 1.533 7.033 -3.676 1.00 1.43 H new ATOM 0 HG22 VAL A 34 1.544 8.255 -4.970 1.00 1.43 H new ATOM 0 HG23 VAL A 34 3.077 7.575 -4.376 1.00 1.43 H new ATOM 537 N ILE A 35 3.742 11.333 -1.599 1.00 5.12 N ATOM 538 CA ILE A 35 3.840 12.401 -0.599 1.00 44.44 C ATOM 539 C ILE A 35 4.246 13.742 -1.240 1.00 52.13 C ATOM 540 O ILE A 35 3.549 14.745 -1.091 1.00 72.34 O ATOM 541 CB ILE A 35 4.856 12.037 0.520 1.00 74.34 C ATOM 542 CG1 ILE A 35 4.362 10.821 1.325 1.00 44.34 C ATOM 543 CG2 ILE A 35 5.106 13.229 1.445 1.00 41.34 C ATOM 544 CD1 ILE A 35 5.321 10.379 2.414 1.00 14.14 C ATOM 0 H ILE A 35 4.397 10.564 -1.454 1.00 5.12 H new ATOM 0 HA ILE A 35 2.849 12.508 -0.158 1.00 44.44 H new ATOM 0 HB ILE A 35 5.801 11.776 0.044 1.00 74.34 H new ATOM 0 HG12 ILE A 35 3.400 11.062 1.777 1.00 44.34 H new ATOM 0 HG13 ILE A 35 4.194 9.989 0.642 1.00 44.34 H new ATOM 0 HG21 ILE A 35 5.820 12.946 2.218 1.00 41.34 H new ATOM 0 HG22 ILE A 35 5.508 14.061 0.866 1.00 41.34 H new ATOM 0 HG23 ILE A 35 4.168 13.531 1.911 1.00 41.34 H new ATOM 0 HD11 ILE A 35 4.905 9.518 2.938 1.00 14.14 H new ATOM 0 HD12 ILE A 35 6.277 10.105 1.968 1.00 14.14 H new ATOM 0 HD13 ILE A 35 5.471 11.196 3.120 1.00 14.14 H new ATOM 556 N SER A 36 5.361 13.748 -1.968 1.00 33.32 N ATOM 557 CA SER A 36 5.903 14.988 -2.556 1.00 44.34 C ATOM 558 C SER A 36 4.926 15.649 -3.545 1.00 25.44 C ATOM 559 O SER A 36 4.883 16.877 -3.663 1.00 14.21 O ATOM 560 CB SER A 36 7.232 14.704 -3.269 1.00 12.43 C ATOM 561 OG SER A 36 7.791 15.890 -3.817 1.00 54.23 O ATOM 0 H SER A 36 5.912 12.913 -2.169 1.00 33.32 H new ATOM 0 HA SER A 36 6.061 15.682 -1.731 1.00 44.34 H new ATOM 0 HB2 SER A 36 7.936 14.260 -2.566 1.00 12.43 H new ATOM 0 HB3 SER A 36 7.072 13.975 -4.063 1.00 12.43 H new ATOM 0 HG SER A 36 8.637 15.677 -4.263 1.00 54.23 H new ATOM 567 N THR A 37 4.146 14.836 -4.258 1.00 15.43 N ATOM 568 CA THR A 37 3.206 15.347 -5.274 1.00 24.14 C ATOM 569 C THR A 37 1.862 15.795 -4.670 1.00 74.41 C ATOM 570 O THR A 37 1.305 16.824 -5.065 1.00 31.34 O ATOM 571 CB THR A 37 2.922 14.287 -6.369 1.00 72.22 C ATOM 572 OG1 THR A 37 2.395 13.089 -5.773 1.00 71.50 O ATOM 573 CG2 THR A 37 4.188 13.956 -7.157 1.00 22.52 C ATOM 0 H THR A 37 4.141 13.821 -4.156 1.00 15.43 H new ATOM 0 HA THR A 37 3.698 16.215 -5.714 1.00 24.14 H new ATOM 0 HB THR A 37 2.187 14.704 -7.058 1.00 72.22 H new ATOM 0 HG1 THR A 37 3.128 12.565 -5.388 1.00 71.50 H new ATOM 0 HG21 THR A 37 3.958 13.210 -7.918 1.00 22.52 H new ATOM 0 HG22 THR A 37 4.565 14.859 -7.637 1.00 22.52 H new ATOM 0 HG23 THR A 37 4.946 13.562 -6.480 1.00 22.52 H new ATOM 581 N HIS A 38 1.334 15.017 -3.727 1.00 3.22 N ATOM 582 CA HIS A 38 0.019 15.302 -3.132 1.00 51.45 C ATOM 583 C HIS A 38 0.095 16.257 -1.925 1.00 70.30 C ATOM 584 O HIS A 38 -0.829 17.039 -1.695 1.00 65.34 O ATOM 585 CB HIS A 38 -0.669 13.994 -2.711 1.00 32.13 C ATOM 586 CG HIS A 38 -1.260 13.218 -3.854 1.00 21.52 C ATOM 587 ND1 HIS A 38 -2.621 13.115 -4.065 1.00 44.53 N ATOM 588 CD2 HIS A 38 -0.677 12.501 -4.846 1.00 63.34 C ATOM 589 CE1 HIS A 38 -2.847 12.373 -5.131 1.00 41.12 C ATOM 590 NE2 HIS A 38 -1.688 11.988 -5.624 1.00 3.04 N ATOM 0 H HIS A 38 1.792 14.185 -3.355 1.00 3.22 H new ATOM 0 HA HIS A 38 -0.566 15.804 -3.903 1.00 51.45 H new ATOM 0 HB2 HIS A 38 0.056 13.365 -2.194 1.00 32.13 H new ATOM 0 HB3 HIS A 38 -1.458 14.225 -1.996 1.00 32.13 H new ATOM 0 HD2 HIS A 38 0.383 12.359 -4.997 1.00 63.34 H new ATOM 0 HE1 HIS A 38 -3.818 12.123 -5.532 1.00 41.12 H new ATOM 0 HE2 HIS A 38 -1.561 11.403 -6.450 1.00 3.04 H new ATOM 599 N THR A 39 1.177 16.195 -1.151 1.00 62.15 N ATOM 600 CA THR A 39 1.268 16.985 0.091 1.00 45.33 C ATOM 601 C THR A 39 2.338 18.075 0.021 1.00 71.24 C ATOM 602 O THR A 39 3.124 18.153 -0.922 1.00 12.31 O ATOM 603 CB THR A 39 1.573 16.110 1.333 1.00 45.12 C ATOM 604 OG1 THR A 39 2.969 15.794 1.388 1.00 24.24 O ATOM 605 CG2 THR A 39 0.763 14.823 1.317 1.00 13.23 C ATOM 0 H THR A 39 1.994 15.618 -1.351 1.00 62.15 H new ATOM 0 HA THR A 39 0.284 17.442 0.193 1.00 45.33 H new ATOM 0 HB THR A 39 1.293 16.684 2.217 1.00 45.12 H new ATOM 0 HG1 THR A 39 3.277 15.516 0.500 1.00 24.24 H new ATOM 0 HG21 THR A 39 1.001 14.232 2.202 1.00 13.23 H new ATOM 0 HG22 THR A 39 -0.300 15.062 1.315 1.00 13.23 H new ATOM 0 HG23 THR A 39 1.007 14.250 0.422 1.00 13.23 H new ATOM 613 N ARG A 40 2.355 18.914 1.052 1.00 64.02 N ATOM 614 CA ARG A 40 3.359 19.966 1.191 1.00 33.55 C ATOM 615 C ARG A 40 4.678 19.384 1.725 1.00 50.43 C ATOM 616 O ARG A 40 5.706 20.062 1.757 1.00 43.32 O ATOM 617 CB ARG A 40 2.832 21.046 2.154 1.00 5.50 C ATOM 618 CG ARG A 40 3.362 22.448 1.877 1.00 51.33 C ATOM 619 CD ARG A 40 2.943 22.924 0.491 1.00 5.34 C ATOM 620 NE ARG A 40 3.120 24.361 0.316 1.00 52.03 N ATOM 621 CZ ARG A 40 2.255 25.132 -0.288 1.00 73.34 C ATOM 622 NH1 ARG A 40 1.130 24.656 -0.716 1.00 15.21 N ATOM 623 NH2 ARG A 40 2.504 26.388 -0.443 1.00 62.25 N ATOM 0 H ARG A 40 1.676 18.885 1.813 1.00 64.02 H new ATOM 0 HA ARG A 40 3.550 20.409 0.213 1.00 33.55 H new ATOM 0 HB2 ARG A 40 1.744 21.065 2.099 1.00 5.50 H new ATOM 0 HB3 ARG A 40 3.095 20.766 3.174 1.00 5.50 H new ATOM 0 HG2 ARG A 40 2.987 23.139 2.632 1.00 51.33 H new ATOM 0 HG3 ARG A 40 4.449 22.452 1.954 1.00 51.33 H new ATOM 0 HD2 ARG A 40 3.526 22.395 -0.263 1.00 5.34 H new ATOM 0 HD3 ARG A 40 1.897 22.667 0.323 1.00 5.34 H new ATOM 0 HE ARG A 40 3.968 24.789 0.687 1.00 52.03 H new ATOM 0 HH11 ARG A 40 0.910 23.669 -0.583 1.00 15.21 H new ATOM 0 HH12 ARG A 40 0.463 25.268 -1.186 1.00 15.21 H new ATOM 0 HH21 ARG A 40 3.378 26.782 -0.094 1.00 62.25 H new ATOM 0 HH22 ARG A 40 1.827 26.988 -0.915 1.00 62.25 H new ATOM 637 N ALA A 41 4.635 18.115 2.133 1.00 4.42 N ATOM 638 CA ALA A 41 5.778 17.460 2.766 1.00 35.33 C ATOM 639 C ALA A 41 6.903 17.152 1.771 1.00 33.22 C ATOM 640 O ALA A 41 6.703 17.128 0.555 1.00 32.11 O ATOM 641 CB ALA A 41 5.333 16.184 3.468 1.00 73.33 C ATOM 0 H ALA A 41 3.814 17.518 2.035 1.00 4.42 H new ATOM 0 HA ALA A 41 6.180 18.158 3.500 1.00 35.33 H new ATOM 0 HB1 ALA A 41 6.194 15.706 3.935 1.00 73.33 H new ATOM 0 HB2 ALA A 41 4.595 16.428 4.232 1.00 73.33 H new ATOM 0 HB3 ALA A 41 4.891 15.503 2.740 1.00 73.33 H new ATOM 647 N LYS A 42 8.092 16.916 2.305 1.00 20.24 N ATOM 648 CA LYS A 42 9.268 16.630 1.491 1.00 34.53 C ATOM 649 C LYS A 42 10.146 15.588 2.204 1.00 13.33 C ATOM 650 O LYS A 42 10.669 15.845 3.291 1.00 21.14 O ATOM 651 CB LYS A 42 10.045 17.935 1.234 1.00 44.14 C ATOM 652 CG LYS A 42 10.873 17.925 -0.048 1.00 72.42 C ATOM 653 CD LYS A 42 10.001 17.768 -1.303 1.00 21.14 C ATOM 654 CE LYS A 42 9.122 18.996 -1.588 1.00 40.13 C ATOM 655 NZ LYS A 42 7.982 19.139 -0.636 1.00 50.53 N ATOM 0 H LYS A 42 8.270 16.917 3.309 1.00 20.24 H new ATOM 0 HA LYS A 42 8.965 16.218 0.528 1.00 34.53 H new ATOM 0 HB2 LYS A 42 9.338 18.764 1.191 1.00 44.14 H new ATOM 0 HB3 LYS A 42 10.706 18.124 2.080 1.00 44.14 H new ATOM 0 HG2 LYS A 42 11.443 18.852 -0.117 1.00 72.42 H new ATOM 0 HG3 LYS A 42 11.595 17.110 -0.005 1.00 72.42 H new ATOM 0 HD2 LYS A 42 10.644 17.582 -2.163 1.00 21.14 H new ATOM 0 HD3 LYS A 42 9.363 16.892 -1.187 1.00 21.14 H new ATOM 0 HE2 LYS A 42 9.738 19.894 -1.543 1.00 40.13 H new ATOM 0 HE3 LYS A 42 8.732 18.927 -2.604 1.00 40.13 H new ATOM 0 HZ1 LYS A 42 7.126 19.414 -1.158 1.00 50.53 H new ATOM 0 HZ2 LYS A 42 7.817 18.233 -0.153 1.00 50.53 H new ATOM 0 HZ3 LYS A 42 8.208 19.870 0.068 1.00 50.53 H new ATOM 669 N VAL A 43 10.290 14.413 1.594 1.00 10.35 N ATOM 670 CA VAL A 43 10.955 13.277 2.245 1.00 61.11 C ATOM 671 C VAL A 43 12.479 13.464 2.348 1.00 12.30 C ATOM 672 O VAL A 43 13.160 13.709 1.350 1.00 34.23 O ATOM 673 CB VAL A 43 10.656 11.951 1.500 1.00 63.21 C ATOM 674 CG1 VAL A 43 11.271 10.763 2.240 1.00 32.40 C ATOM 675 CG2 VAL A 43 9.149 11.760 1.325 1.00 55.22 C ATOM 0 H VAL A 43 9.956 14.219 0.650 1.00 10.35 H new ATOM 0 HA VAL A 43 10.549 13.230 3.255 1.00 61.11 H new ATOM 0 HB VAL A 43 11.110 12.005 0.511 1.00 63.21 H new ATOM 0 HG11 VAL A 43 11.049 9.843 1.699 1.00 32.40 H new ATOM 0 HG12 VAL A 43 12.351 10.894 2.304 1.00 32.40 H new ATOM 0 HG13 VAL A 43 10.852 10.704 3.245 1.00 32.40 H new ATOM 0 HG21 VAL A 43 8.959 10.824 0.800 1.00 55.22 H new ATOM 0 HG22 VAL A 43 8.670 11.731 2.304 1.00 55.22 H new ATOM 0 HG23 VAL A 43 8.742 12.589 0.746 1.00 55.22 H new ATOM 685 N VAL A 44 13.002 13.344 3.567 1.00 65.00 N ATOM 686 CA VAL A 44 14.447 13.412 3.810 1.00 25.05 C ATOM 687 C VAL A 44 15.072 12.010 3.888 1.00 15.10 C ATOM 688 O VAL A 44 14.398 11.029 4.211 1.00 41.20 O ATOM 689 CB VAL A 44 14.773 14.183 5.115 1.00 31.23 C ATOM 690 CG1 VAL A 44 14.385 15.654 4.986 1.00 53.24 C ATOM 691 CG2 VAL A 44 14.079 13.538 6.316 1.00 14.00 C ATOM 0 H VAL A 44 12.445 13.198 4.409 1.00 65.00 H new ATOM 0 HA VAL A 44 14.876 13.949 2.964 1.00 25.05 H new ATOM 0 HB VAL A 44 15.849 14.131 5.280 1.00 31.23 H new ATOM 0 HG11 VAL A 44 14.623 16.176 5.913 1.00 53.24 H new ATOM 0 HG12 VAL A 44 14.939 16.106 4.163 1.00 53.24 H new ATOM 0 HG13 VAL A 44 13.316 15.732 4.789 1.00 53.24 H new ATOM 0 HG21 VAL A 44 14.323 14.096 7.220 1.00 14.00 H new ATOM 0 HG22 VAL A 44 13.000 13.549 6.162 1.00 14.00 H new ATOM 0 HG23 VAL A 44 14.419 12.508 6.423 1.00 14.00 H new ATOM 701 N ASN A 45 16.366 11.929 3.601 1.00 12.52 N ATOM 702 CA ASN A 45 17.088 10.652 3.620 1.00 75.04 C ATOM 703 C ASN A 45 17.605 10.315 5.034 1.00 44.32 C ATOM 704 O ASN A 45 18.045 9.195 5.300 1.00 75.32 O ATOM 705 CB ASN A 45 18.249 10.712 2.618 1.00 50.35 C ATOM 706 CG ASN A 45 18.954 9.380 2.453 1.00 55.41 C ATOM 707 OD1 ASN A 45 19.936 9.095 3.131 1.00 33.03 O ATOM 708 ND2 ASN A 45 18.462 8.556 1.553 1.00 31.45 N ATOM 0 H ASN A 45 16.943 12.732 3.351 1.00 12.52 H new ATOM 0 HA ASN A 45 16.399 9.858 3.332 1.00 75.04 H new ATOM 0 HB2 ASN A 45 17.870 11.040 1.650 1.00 50.35 H new ATOM 0 HB3 ASN A 45 18.969 11.460 2.948 1.00 50.35 H new ATOM 0 HD21 ASN A 45 18.899 7.647 1.401 1.00 31.45 H new ATOM 0 HD22 ASN A 45 17.644 8.826 1.007 1.00 31.45 H new ATOM 715 N LYS A 46 17.537 11.288 5.944 1.00 60.12 N ATOM 716 CA LYS A 46 18.014 11.099 7.322 1.00 32.13 C ATOM 717 C LYS A 46 17.158 11.886 8.331 1.00 13.32 C ATOM 718 O LYS A 46 16.674 12.980 8.035 1.00 42.05 O ATOM 719 CB LYS A 46 19.496 11.493 7.452 1.00 71.11 C ATOM 720 CG LYS A 46 19.809 12.957 7.138 1.00 1.13 C ATOM 721 CD LYS A 46 19.700 13.284 5.649 1.00 42.55 C ATOM 722 CE LYS A 46 20.196 14.692 5.344 1.00 14.53 C ATOM 723 NZ LYS A 46 21.624 14.876 5.721 1.00 63.51 N ATOM 0 H LYS A 46 17.157 12.216 5.755 1.00 60.12 H new ATOM 0 HA LYS A 46 17.916 10.039 7.556 1.00 32.13 H new ATOM 0 HB2 LYS A 46 19.825 11.277 8.468 1.00 71.11 H new ATOM 0 HB3 LYS A 46 20.083 10.861 6.786 1.00 71.11 H new ATOM 0 HG2 LYS A 46 19.125 13.597 7.696 1.00 1.13 H new ATOM 0 HG3 LYS A 46 20.817 13.190 7.483 1.00 1.13 H new ATOM 0 HD2 LYS A 46 20.279 12.561 5.074 1.00 42.55 H new ATOM 0 HD3 LYS A 46 18.662 13.186 5.330 1.00 42.55 H new ATOM 0 HE2 LYS A 46 20.073 14.897 4.281 1.00 14.53 H new ATOM 0 HE3 LYS A 46 19.583 15.416 5.881 1.00 14.53 H new ATOM 0 HZ1 LYS A 46 22.025 15.671 5.184 1.00 63.51 H new ATOM 0 HZ2 LYS A 46 21.691 15.077 6.739 1.00 63.51 H new ATOM 0 HZ3 LYS A 46 22.155 14.008 5.504 1.00 63.51 H new ATOM 737 N ALA A 47 17.005 11.334 9.534 1.00 11.24 N ATOM 738 CA ALA A 47 16.073 11.872 10.538 1.00 0.12 C ATOM 739 C ALA A 47 16.623 13.098 11.296 1.00 12.34 C ATOM 740 O ALA A 47 15.991 13.583 12.237 1.00 52.25 O ATOM 741 CB ALA A 47 15.693 10.772 11.525 1.00 34.53 C ATOM 0 H ALA A 47 17.517 10.508 9.844 1.00 11.24 H new ATOM 0 HA ALA A 47 15.193 12.219 9.996 1.00 0.12 H new ATOM 0 HB1 ALA A 47 15.003 11.172 12.268 1.00 34.53 H new ATOM 0 HB2 ALA A 47 15.214 9.952 10.989 1.00 34.53 H new ATOM 0 HB3 ALA A 47 16.590 10.405 12.024 1.00 34.53 H new ATOM 747 N GLU A 48 17.791 13.604 10.894 1.00 42.31 N ATOM 748 CA GLU A 48 18.358 14.809 11.520 1.00 73.45 C ATOM 749 C GLU A 48 17.459 16.032 11.276 1.00 3.42 C ATOM 750 O GLU A 48 17.379 16.941 12.110 1.00 2.24 O ATOM 751 CB GLU A 48 19.767 15.101 10.977 1.00 11.01 C ATOM 752 CG GLU A 48 19.777 15.606 9.536 1.00 14.40 C ATOM 753 CD GLU A 48 21.169 15.946 9.025 1.00 51.43 C ATOM 754 OE1 GLU A 48 21.856 15.045 8.500 1.00 14.12 O ATOM 755 OE2 GLU A 48 21.574 17.122 9.124 1.00 64.32 O ATOM 0 H GLU A 48 18.360 13.206 10.147 1.00 42.31 H new ATOM 0 HA GLU A 48 18.420 14.619 12.591 1.00 73.45 H new ATOM 0 HB2 GLU A 48 20.246 15.843 11.616 1.00 11.01 H new ATOM 0 HB3 GLU A 48 20.366 14.192 11.038 1.00 11.01 H new ATOM 0 HG2 GLU A 48 19.336 14.847 8.890 1.00 14.40 H new ATOM 0 HG3 GLU A 48 19.145 16.492 9.465 1.00 14.40 H new ATOM 762 N LYS A 49 16.782 16.047 10.126 1.00 62.20 N ATOM 763 CA LYS A 49 15.952 17.185 9.731 1.00 24.32 C ATOM 764 C LYS A 49 14.552 16.725 9.291 1.00 71.33 C ATOM 765 O LYS A 49 14.132 16.937 8.151 1.00 62.14 O ATOM 766 CB LYS A 49 16.646 17.978 8.608 1.00 23.14 C ATOM 767 CG LYS A 49 16.093 19.389 8.423 1.00 22.23 C ATOM 768 CD LYS A 49 16.182 20.187 9.721 1.00 12.31 C ATOM 769 CE LYS A 49 15.661 21.608 9.568 1.00 51.50 C ATOM 770 NZ LYS A 49 15.645 22.321 10.869 1.00 21.24 N ATOM 0 H LYS A 49 16.793 15.282 9.451 1.00 62.20 H new ATOM 0 HA LYS A 49 15.827 17.837 10.596 1.00 24.32 H new ATOM 0 HB2 LYS A 49 17.712 18.040 8.825 1.00 23.14 H new ATOM 0 HB3 LYS A 49 16.543 17.431 7.671 1.00 23.14 H new ATOM 0 HG2 LYS A 49 16.650 19.901 7.638 1.00 22.23 H new ATOM 0 HG3 LYS A 49 15.055 19.336 8.095 1.00 22.23 H new ATOM 0 HD2 LYS A 49 15.612 19.676 10.497 1.00 12.31 H new ATOM 0 HD3 LYS A 49 17.219 20.218 10.054 1.00 12.31 H new ATOM 0 HE2 LYS A 49 16.286 22.152 8.861 1.00 51.50 H new ATOM 0 HE3 LYS A 49 14.654 21.585 9.151 1.00 51.50 H new ATOM 0 HZ1 LYS A 49 15.285 23.287 10.731 1.00 21.24 H new ATOM 0 HZ2 LYS A 49 15.029 21.813 11.535 1.00 21.24 H new ATOM 0 HZ3 LYS A 49 16.610 22.363 11.254 1.00 21.24 H new ATOM 784 N SER A 50 13.841 16.079 10.209 1.00 11.14 N ATOM 785 CA SER A 50 12.472 15.615 9.958 1.00 14.32 C ATOM 786 C SER A 50 11.538 16.035 11.097 1.00 43.42 C ATOM 787 O SER A 50 11.936 16.064 12.259 1.00 21.12 O ATOM 788 CB SER A 50 12.438 14.088 9.804 1.00 32.02 C ATOM 789 OG SER A 50 12.936 13.440 10.965 1.00 45.14 O ATOM 0 H SER A 50 14.190 15.861 11.143 1.00 11.14 H new ATOM 0 HA SER A 50 12.129 16.075 9.031 1.00 14.32 H new ATOM 0 HB2 SER A 50 11.415 13.762 9.614 1.00 32.02 H new ATOM 0 HB3 SER A 50 13.032 13.795 8.938 1.00 32.02 H new ATOM 0 HG SER A 50 12.901 12.469 10.838 1.00 45.14 H new ATOM 795 N GLU A 51 10.300 16.379 10.758 1.00 63.42 N ATOM 796 CA GLU A 51 9.289 16.725 11.762 1.00 42.24 C ATOM 797 C GLU A 51 8.532 15.468 12.237 1.00 12.34 C ATOM 798 O GLU A 51 8.039 15.412 13.365 1.00 41.11 O ATOM 799 CB GLU A 51 8.289 17.746 11.192 1.00 54.11 C ATOM 800 CG GLU A 51 8.928 18.923 10.452 1.00 12.13 C ATOM 801 CD GLU A 51 9.971 19.674 11.272 1.00 14.43 C ATOM 802 OE1 GLU A 51 9.620 20.223 12.338 1.00 42.41 O ATOM 803 OE2 GLU A 51 11.144 19.731 10.848 1.00 12.43 O ATOM 0 H GLU A 51 9.968 16.427 9.795 1.00 63.42 H new ATOM 0 HA GLU A 51 9.804 17.167 12.615 1.00 42.24 H new ATOM 0 HB2 GLU A 51 7.613 17.230 10.510 1.00 54.11 H new ATOM 0 HB3 GLU A 51 7.682 18.135 12.010 1.00 54.11 H new ATOM 0 HG2 GLU A 51 9.394 18.555 9.538 1.00 12.13 H new ATOM 0 HG3 GLU A 51 8.145 19.620 10.152 1.00 12.13 H new ATOM 810 N ALA A 52 8.440 14.464 11.360 1.00 54.12 N ATOM 811 CA ALA A 52 7.762 13.196 11.682 1.00 1.43 C ATOM 812 C ALA A 52 8.395 12.007 10.935 1.00 53.41 C ATOM 813 O ALA A 52 9.133 12.193 9.963 1.00 23.40 O ATOM 814 CB ALA A 52 6.276 13.298 11.350 1.00 71.10 C ATOM 0 H ALA A 52 8.827 14.501 10.417 1.00 54.12 H new ATOM 0 HA ALA A 52 7.881 13.016 12.750 1.00 1.43 H new ATOM 0 HB1 ALA A 52 5.784 12.356 11.591 1.00 71.10 H new ATOM 0 HB2 ALA A 52 5.827 14.102 11.933 1.00 71.10 H new ATOM 0 HB3 ALA A 52 6.154 13.509 10.288 1.00 71.10 H new ATOM 820 N ILE A 53 8.098 10.783 11.387 1.00 25.12 N ATOM 821 CA ILE A 53 8.640 9.564 10.762 1.00 20.14 C ATOM 822 C ILE A 53 7.533 8.557 10.400 1.00 21.42 C ATOM 823 O ILE A 53 6.709 8.190 11.241 1.00 32.14 O ATOM 824 CB ILE A 53 9.679 8.864 11.684 1.00 22.00 C ATOM 825 CG1 ILE A 53 10.942 9.732 11.825 1.00 72.25 C ATOM 826 CG2 ILE A 53 10.039 7.473 11.156 1.00 13.54 C ATOM 827 CD1 ILE A 53 12.045 9.085 12.641 1.00 14.14 C ATOM 0 H ILE A 53 7.485 10.607 12.183 1.00 25.12 H new ATOM 0 HA ILE A 53 9.131 9.888 9.845 1.00 20.14 H new ATOM 0 HB ILE A 53 9.228 8.741 12.669 1.00 22.00 H new ATOM 0 HG12 ILE A 53 11.326 9.962 10.831 1.00 72.25 H new ATOM 0 HG13 ILE A 53 10.669 10.680 12.288 1.00 72.25 H new ATOM 0 HG21 ILE A 53 10.767 7.009 11.821 1.00 13.54 H new ATOM 0 HG22 ILE A 53 9.141 6.856 11.113 1.00 13.54 H new ATOM 0 HG23 ILE A 53 10.466 7.562 10.157 1.00 13.54 H new ATOM 0 HD11 ILE A 53 12.901 9.758 12.695 1.00 14.14 H new ATOM 0 HD12 ILE A 53 11.681 8.880 13.648 1.00 14.14 H new ATOM 0 HD13 ILE A 53 12.347 8.151 12.168 1.00 14.14 H new ATOM 839 N ILE A 54 7.529 8.110 9.143 1.00 31.23 N ATOM 840 CA ILE A 54 6.593 7.081 8.677 1.00 43.42 C ATOM 841 C ILE A 54 7.282 5.707 8.616 1.00 13.50 C ATOM 842 O ILE A 54 8.244 5.513 7.868 1.00 2.53 O ATOM 843 CB ILE A 54 6.019 7.431 7.280 1.00 43.12 C ATOM 844 CG1 ILE A 54 5.333 8.808 7.319 1.00 63.35 C ATOM 845 CG2 ILE A 54 5.039 6.351 6.813 1.00 1.35 C ATOM 846 CD1 ILE A 54 4.748 9.248 5.992 1.00 21.22 C ATOM 0 H ILE A 54 8.168 8.447 8.423 1.00 31.23 H new ATOM 0 HA ILE A 54 5.771 7.042 9.392 1.00 43.42 H new ATOM 0 HB ILE A 54 6.841 7.473 6.566 1.00 43.12 H new ATOM 0 HG12 ILE A 54 4.538 8.784 8.064 1.00 63.35 H new ATOM 0 HG13 ILE A 54 6.057 9.553 7.649 1.00 63.35 H new ATOM 0 HG21 ILE A 54 4.647 6.615 5.831 1.00 1.35 H new ATOM 0 HG22 ILE A 54 5.555 5.393 6.752 1.00 1.35 H new ATOM 0 HG23 ILE A 54 4.216 6.275 7.523 1.00 1.35 H new ATOM 0 HD11 ILE A 54 4.284 10.227 6.106 1.00 21.22 H new ATOM 0 HD12 ILE A 54 5.541 9.307 5.246 1.00 21.22 H new ATOM 0 HD13 ILE A 54 3.998 8.526 5.668 1.00 21.22 H new ATOM 858 N GLN A 55 6.788 4.757 9.406 1.00 70.15 N ATOM 859 CA GLN A 55 7.396 3.424 9.497 1.00 54.41 C ATOM 860 C GLN A 55 6.431 2.350 8.973 1.00 52.10 C ATOM 861 O GLN A 55 5.243 2.379 9.272 1.00 45.51 O ATOM 862 CB GLN A 55 7.785 3.148 10.965 1.00 74.45 C ATOM 863 CG GLN A 55 8.560 1.850 11.212 1.00 23.43 C ATOM 864 CD GLN A 55 7.677 0.614 11.304 1.00 53.00 C ATOM 865 OE1 GLN A 55 6.522 0.681 11.716 1.00 33.32 O ATOM 866 NE2 GLN A 55 8.219 -0.525 10.934 1.00 41.11 N ATOM 0 H GLN A 55 5.965 4.882 9.996 1.00 70.15 H new ATOM 0 HA GLN A 55 8.291 3.390 8.876 1.00 54.41 H new ATOM 0 HB2 GLN A 55 8.386 3.983 11.326 1.00 74.45 H new ATOM 0 HB3 GLN A 55 6.875 3.127 11.565 1.00 74.45 H new ATOM 0 HG2 GLN A 55 9.282 1.710 10.407 1.00 23.43 H new ATOM 0 HG3 GLN A 55 9.129 1.948 12.137 1.00 23.43 H new ATOM 0 HE21 GLN A 55 9.181 -0.546 10.596 1.00 41.11 H new ATOM 0 HE22 GLN A 55 7.677 -1.388 10.985 1.00 41.11 H new ATOM 875 N ILE A 56 6.942 1.410 8.180 1.00 11.15 N ATOM 876 CA ILE A 56 6.125 0.296 7.676 1.00 53.45 C ATOM 877 C ILE A 56 6.586 -1.047 8.267 1.00 0.44 C ATOM 878 O ILE A 56 7.770 -1.375 8.242 1.00 22.42 O ATOM 879 CB ILE A 56 6.143 0.222 6.123 1.00 44.30 C ATOM 880 CG1 ILE A 56 5.391 -1.033 5.635 1.00 42.40 C ATOM 881 CG2 ILE A 56 7.573 0.249 5.581 1.00 11.52 C ATOM 882 CD1 ILE A 56 5.418 -1.225 4.134 1.00 32.31 C ATOM 0 H ILE A 56 7.914 1.393 7.871 1.00 11.15 H new ATOM 0 HA ILE A 56 5.101 0.489 7.997 1.00 53.45 H new ATOM 0 HB ILE A 56 5.630 1.103 5.737 1.00 44.30 H new ATOM 0 HG12 ILE A 56 5.826 -1.912 6.111 1.00 42.40 H new ATOM 0 HG13 ILE A 56 4.354 -0.973 5.964 1.00 42.40 H new ATOM 0 HG21 ILE A 56 7.551 0.196 4.493 1.00 11.52 H new ATOM 0 HG22 ILE A 56 8.062 1.173 5.889 1.00 11.52 H new ATOM 0 HG23 ILE A 56 8.127 -0.603 5.975 1.00 11.52 H new ATOM 0 HD11 ILE A 56 4.867 -2.129 3.873 1.00 32.31 H new ATOM 0 HD12 ILE A 56 4.955 -0.365 3.649 1.00 32.31 H new ATOM 0 HD13 ILE A 56 6.451 -1.319 3.798 1.00 32.31 H new ATOM 894 N VAL A 57 5.643 -1.818 8.803 1.00 21.33 N ATOM 895 CA VAL A 57 5.960 -3.108 9.423 1.00 74.22 C ATOM 896 C VAL A 57 6.012 -4.240 8.378 1.00 54.53 C ATOM 897 O VAL A 57 7.010 -4.952 8.270 1.00 74.10 O ATOM 898 CB VAL A 57 4.929 -3.466 10.526 1.00 64.13 C ATOM 899 CG1 VAL A 57 5.326 -4.753 11.248 1.00 2.43 C ATOM 900 CG2 VAL A 57 4.774 -2.310 11.518 1.00 52.13 C ATOM 0 H VAL A 57 4.653 -1.575 8.822 1.00 21.33 H new ATOM 0 HA VAL A 57 6.946 -3.009 9.877 1.00 74.22 H new ATOM 0 HB VAL A 57 3.965 -3.634 10.046 1.00 64.13 H new ATOM 0 HG11 VAL A 57 4.587 -4.982 12.016 1.00 2.43 H new ATOM 0 HG12 VAL A 57 5.371 -5.573 10.532 1.00 2.43 H new ATOM 0 HG13 VAL A 57 6.304 -4.623 11.712 1.00 2.43 H new ATOM 0 HG21 VAL A 57 4.047 -2.582 12.283 1.00 52.13 H new ATOM 0 HG22 VAL A 57 5.735 -2.103 11.989 1.00 52.13 H new ATOM 0 HG23 VAL A 57 4.430 -1.421 10.990 1.00 52.13 H new ATOM 910 N HIS A 58 4.929 -4.403 7.610 1.00 60.12 N ATOM 911 CA HIS A 58 4.855 -5.444 6.567 1.00 42.41 C ATOM 912 C HIS A 58 3.908 -5.039 5.425 1.00 25.15 C ATOM 913 O HIS A 58 2.946 -4.302 5.637 1.00 62.02 O ATOM 914 CB HIS A 58 4.381 -6.784 7.156 1.00 41.21 C ATOM 915 CG HIS A 58 5.383 -7.455 8.046 1.00 4.52 C ATOM 916 ND1 HIS A 58 6.641 -7.818 7.620 1.00 12.32 N ATOM 917 CD2 HIS A 58 5.309 -7.833 9.343 1.00 24.50 C ATOM 918 CE1 HIS A 58 7.294 -8.386 8.610 1.00 35.52 C ATOM 919 NE2 HIS A 58 6.512 -8.411 9.668 1.00 24.30 N ATOM 0 H HIS A 58 4.089 -3.829 7.688 1.00 60.12 H new ATOM 0 HA HIS A 58 5.863 -5.557 6.167 1.00 42.41 H new ATOM 0 HB2 HIS A 58 3.465 -6.615 7.722 1.00 41.21 H new ATOM 0 HB3 HIS A 58 4.130 -7.459 6.338 1.00 41.21 H new ATOM 0 HD2 HIS A 58 4.462 -7.704 10.000 1.00 24.50 H new ATOM 0 HE1 HIS A 58 8.303 -8.768 8.563 1.00 35.52 H new ATOM 0 HE2 HIS A 58 6.759 -8.796 10.580 1.00 24.30 H new ATOM 928 N ALA A 59 4.191 -5.536 4.219 1.00 2.54 N ATOM 929 CA ALA A 59 3.318 -5.328 3.055 1.00 4.33 C ATOM 930 C ALA A 59 3.464 -6.483 2.050 1.00 63.51 C ATOM 931 O ALA A 59 4.321 -6.448 1.169 1.00 23.44 O ATOM 932 CB ALA A 59 3.620 -3.992 2.383 1.00 11.31 C ATOM 0 H ALA A 59 5.024 -6.090 4.019 1.00 2.54 H new ATOM 0 HA ALA A 59 2.286 -5.308 3.406 1.00 4.33 H new ATOM 0 HB1 ALA A 59 2.962 -3.860 1.524 1.00 11.31 H new ATOM 0 HB2 ALA A 59 3.456 -3.182 3.094 1.00 11.31 H new ATOM 0 HB3 ALA A 59 4.658 -3.978 2.050 1.00 11.31 H new ATOM 938 N ILE A 60 2.637 -7.519 2.207 1.00 4.52 N ATOM 939 CA ILE A 60 2.727 -8.726 1.363 1.00 11.24 C ATOM 940 C ILE A 60 1.458 -8.925 0.516 1.00 54.24 C ATOM 941 O ILE A 60 0.347 -8.967 1.050 1.00 0.42 O ATOM 942 CB ILE A 60 2.959 -10.017 2.208 1.00 23.24 C ATOM 943 CG1 ILE A 60 4.299 -9.961 2.975 1.00 31.40 C ATOM 944 CG2 ILE A 60 2.908 -11.264 1.321 1.00 34.14 C ATOM 945 CD1 ILE A 60 4.285 -9.063 4.198 1.00 61.25 C ATOM 0 H ILE A 60 1.897 -7.552 2.908 1.00 4.52 H new ATOM 0 HA ILE A 60 3.584 -8.565 0.709 1.00 11.24 H new ATOM 0 HB ILE A 60 2.154 -10.075 2.941 1.00 23.24 H new ATOM 0 HG12 ILE A 60 4.569 -10.971 3.284 1.00 31.40 H new ATOM 0 HG13 ILE A 60 5.078 -9.616 2.295 1.00 31.40 H new ATOM 0 HG21 ILE A 60 3.072 -12.152 1.932 1.00 34.14 H new ATOM 0 HG22 ILE A 60 1.932 -11.329 0.841 1.00 34.14 H new ATOM 0 HG23 ILE A 60 3.684 -11.200 0.558 1.00 34.14 H new ATOM 0 HD11 ILE A 60 5.265 -9.083 4.675 1.00 61.25 H new ATOM 0 HD12 ILE A 60 4.049 -8.042 3.897 1.00 61.25 H new ATOM 0 HD13 ILE A 60 3.532 -9.418 4.901 1.00 61.25 H new ATOM 957 N ARG A 61 1.628 -9.050 -0.803 1.00 55.01 N ATOM 958 CA ARG A 61 0.510 -9.360 -1.703 1.00 12.33 C ATOM 959 C ARG A 61 0.605 -10.810 -2.191 1.00 74.44 C ATOM 960 O ARG A 61 1.369 -11.115 -3.110 1.00 12.40 O ATOM 961 CB ARG A 61 0.508 -8.402 -2.913 1.00 55.44 C ATOM 962 CG ARG A 61 -0.837 -8.268 -3.638 1.00 51.43 C ATOM 963 CD ARG A 61 -1.300 -9.551 -4.339 1.00 20.44 C ATOM 964 NE ARG A 61 -0.390 -9.982 -5.408 1.00 70.42 N ATOM 965 CZ ARG A 61 -0.784 -10.430 -6.579 1.00 40.51 C ATOM 966 NH1 ARG A 61 -2.042 -10.476 -6.886 1.00 3.34 N ATOM 967 NH2 ARG A 61 0.086 -10.829 -7.445 1.00 70.02 N ATOM 0 H ARG A 61 2.527 -8.942 -1.272 1.00 55.01 H new ATOM 0 HA ARG A 61 -0.420 -9.231 -1.149 1.00 12.33 H new ATOM 0 HB2 ARG A 61 0.820 -7.414 -2.574 1.00 55.44 H new ATOM 0 HB3 ARG A 61 1.256 -8.744 -3.628 1.00 55.44 H new ATOM 0 HG2 ARG A 61 -1.597 -7.965 -2.918 1.00 51.43 H new ATOM 0 HG3 ARG A 61 -0.762 -7.470 -4.377 1.00 51.43 H new ATOM 0 HD2 ARG A 61 -1.389 -10.349 -3.602 1.00 20.44 H new ATOM 0 HD3 ARG A 61 -2.294 -9.391 -4.758 1.00 20.44 H new ATOM 0 HE ARG A 61 0.613 -9.930 -5.230 1.00 70.42 H new ATOM 0 HH11 ARG A 61 -2.743 -10.162 -6.215 1.00 3.34 H new ATOM 0 HH12 ARG A 61 -2.332 -10.826 -7.799 1.00 3.34 H new ATOM 0 HH21 ARG A 61 1.081 -10.797 -7.221 1.00 70.02 H new ATOM 0 HH22 ARG A 61 -0.221 -11.177 -8.353 1.00 70.02 H new ATOM 981 N GLU A 62 -0.163 -11.702 -1.581 1.00 1.03 N ATOM 982 CA GLU A 62 -0.238 -13.088 -2.048 1.00 15.42 C ATOM 983 C GLU A 62 -1.601 -13.369 -2.692 1.00 75.12 C ATOM 984 O GLU A 62 -2.467 -12.496 -2.759 1.00 1.24 O ATOM 985 CB GLU A 62 0.027 -14.086 -0.909 1.00 15.20 C ATOM 986 CG GLU A 62 -0.966 -14.007 0.247 1.00 64.11 C ATOM 987 CD GLU A 62 -0.981 -15.274 1.090 1.00 12.52 C ATOM 988 OE1 GLU A 62 -0.021 -15.503 1.856 1.00 74.11 O ATOM 989 OE2 GLU A 62 -1.944 -16.062 0.970 1.00 12.42 O ATOM 0 H GLU A 62 -0.741 -11.497 -0.766 1.00 1.03 H new ATOM 0 HA GLU A 62 0.542 -13.222 -2.798 1.00 15.42 H new ATOM 0 HB2 GLU A 62 0.010 -15.096 -1.317 1.00 15.20 H new ATOM 0 HB3 GLU A 62 1.031 -13.916 -0.521 1.00 15.20 H new ATOM 0 HG2 GLU A 62 -0.715 -13.156 0.880 1.00 64.11 H new ATOM 0 HG3 GLU A 62 -1.965 -13.826 -0.148 1.00 64.11 H new ATOM 996 N LYS A 63 -1.788 -14.590 -3.171 1.00 73.23 N ATOM 997 CA LYS A 63 -3.018 -14.959 -3.873 1.00 51.44 C ATOM 998 C LYS A 63 -3.449 -16.393 -3.535 1.00 4.41 C ATOM 999 O LYS A 63 -2.624 -17.304 -3.463 1.00 43.15 O ATOM 1000 CB LYS A 63 -2.814 -14.769 -5.383 1.00 65.51 C ATOM 1001 CG LYS A 63 -1.569 -15.460 -5.944 1.00 11.51 C ATOM 1002 CD LYS A 63 -1.062 -14.775 -7.215 1.00 44.42 C ATOM 1003 CE LYS A 63 -2.094 -14.792 -8.339 1.00 1.05 C ATOM 1004 NZ LYS A 63 -2.308 -16.159 -8.877 1.00 44.43 N ATOM 0 H LYS A 63 -1.107 -15.345 -3.089 1.00 73.23 H new ATOM 0 HA LYS A 63 -3.827 -14.307 -3.542 1.00 51.44 H new ATOM 0 HB2 LYS A 63 -3.692 -15.148 -5.906 1.00 65.51 H new ATOM 0 HB3 LYS A 63 -2.750 -13.702 -5.597 1.00 65.51 H new ATOM 0 HG2 LYS A 63 -0.781 -15.457 -5.191 1.00 11.51 H new ATOM 0 HG3 LYS A 63 -1.799 -16.503 -6.161 1.00 11.51 H new ATOM 0 HD2 LYS A 63 -0.796 -13.743 -6.986 1.00 44.42 H new ATOM 0 HD3 LYS A 63 -0.153 -15.271 -7.553 1.00 44.42 H new ATOM 0 HE2 LYS A 63 -3.040 -14.396 -7.969 1.00 1.05 H new ATOM 0 HE3 LYS A 63 -1.765 -14.133 -9.143 1.00 1.05 H new ATOM 0 HZ1 LYS A 63 -2.794 -16.099 -9.795 1.00 44.43 H new ATOM 0 HZ2 LYS A 63 -1.390 -16.631 -9.002 1.00 44.43 H new ATOM 0 HZ3 LYS A 63 -2.891 -16.707 -8.212 1.00 44.43 H new ATOM 1018 N ARG A 64 -4.749 -16.576 -3.313 1.00 1.41 N ATOM 1019 CA ARG A 64 -5.302 -17.873 -2.902 1.00 14.14 C ATOM 1020 C ARG A 64 -6.713 -18.073 -3.477 1.00 42.12 C ATOM 1021 O ARG A 64 -7.318 -17.132 -3.989 1.00 15.41 O ATOM 1022 CB ARG A 64 -5.331 -17.946 -1.371 1.00 50.11 C ATOM 1023 CG ARG A 64 -6.180 -16.852 -0.726 1.00 11.01 C ATOM 1024 CD ARG A 64 -5.975 -16.777 0.784 1.00 65.14 C ATOM 1025 NE ARG A 64 -6.915 -15.855 1.408 1.00 2.23 N ATOM 1026 CZ ARG A 64 -6.909 -15.521 2.668 1.00 33.24 C ATOM 1027 NH1 ARG A 64 -5.989 -15.953 3.477 1.00 4.32 N ATOM 1028 NH2 ARG A 64 -7.831 -14.733 3.113 1.00 60.43 N ATOM 0 H ARG A 64 -5.447 -15.839 -3.411 1.00 1.41 H new ATOM 0 HA ARG A 64 -4.669 -18.670 -3.291 1.00 14.14 H new ATOM 0 HB2 ARG A 64 -5.716 -18.920 -1.069 1.00 50.11 H new ATOM 0 HB3 ARG A 64 -4.311 -17.875 -0.992 1.00 50.11 H new ATOM 0 HG2 ARG A 64 -5.930 -15.890 -1.173 1.00 11.01 H new ATOM 0 HG3 ARG A 64 -7.233 -17.039 -0.939 1.00 11.01 H new ATOM 0 HD2 ARG A 64 -6.096 -17.770 1.218 1.00 65.14 H new ATOM 0 HD3 ARG A 64 -4.955 -16.458 0.998 1.00 65.14 H new ATOM 0 HE ARG A 64 -7.632 -15.439 0.814 1.00 2.23 H new ATOM 0 HH11 ARG A 64 -5.252 -16.566 3.130 1.00 4.32 H new ATOM 0 HH12 ARG A 64 -6.004 -15.679 4.459 1.00 4.32 H new ATOM 0 HH21 ARG A 64 -8.550 -14.381 2.481 1.00 60.43 H new ATOM 0 HH22 ARG A 64 -7.840 -14.463 4.096 1.00 60.43 H new ATOM 1042 N ILE A 65 -7.235 -19.292 -3.400 1.00 43.35 N ATOM 1043 CA ILE A 65 -8.564 -19.590 -3.946 1.00 64.23 C ATOM 1044 C ILE A 65 -9.683 -18.891 -3.142 1.00 33.52 C ATOM 1045 O ILE A 65 -9.626 -18.801 -1.912 1.00 62.50 O ATOM 1046 CB ILE A 65 -8.812 -21.135 -4.022 1.00 5.12 C ATOM 1047 CG1 ILE A 65 -9.161 -21.557 -5.462 1.00 54.33 C ATOM 1048 CG2 ILE A 65 -9.905 -21.595 -3.052 1.00 41.24 C ATOM 1049 CD1 ILE A 65 -10.380 -20.859 -6.032 1.00 44.33 C ATOM 0 H ILE A 65 -6.766 -20.088 -2.969 1.00 43.35 H new ATOM 0 HA ILE A 65 -8.592 -19.192 -4.961 1.00 64.23 H new ATOM 0 HB ILE A 65 -7.885 -21.624 -3.722 1.00 5.12 H new ATOM 0 HG12 ILE A 65 -8.305 -21.355 -6.106 1.00 54.33 H new ATOM 0 HG13 ILE A 65 -9.329 -22.634 -5.483 1.00 54.33 H new ATOM 0 HG21 ILE A 65 -10.041 -22.673 -3.141 1.00 41.24 H new ATOM 0 HG22 ILE A 65 -9.612 -21.350 -2.031 1.00 41.24 H new ATOM 0 HG23 ILE A 65 -10.841 -21.090 -3.292 1.00 41.24 H new ATOM 0 HD11 ILE A 65 -10.559 -21.211 -7.048 1.00 44.33 H new ATOM 0 HD12 ILE A 65 -11.249 -21.081 -5.413 1.00 44.33 H new ATOM 0 HD13 ILE A 65 -10.210 -19.782 -6.045 1.00 44.33 H new ATOM 1061 N LEU A 66 -10.688 -18.375 -3.852 1.00 74.03 N ATOM 1062 CA LEU A 66 -11.841 -17.724 -3.213 1.00 21.52 C ATOM 1063 C LEU A 66 -13.105 -18.597 -3.316 1.00 12.44 C ATOM 1064 O LEU A 66 -13.715 -18.948 -2.305 1.00 33.40 O ATOM 1065 CB LEU A 66 -12.098 -16.351 -3.853 1.00 52.01 C ATOM 1066 CG LEU A 66 -13.264 -15.550 -3.246 1.00 61.34 C ATOM 1067 CD1 LEU A 66 -12.992 -15.214 -1.781 1.00 3.12 C ATOM 1068 CD2 LEU A 66 -13.525 -14.281 -4.056 1.00 14.32 C ATOM 0 H LEU A 66 -10.730 -18.394 -4.871 1.00 74.03 H new ATOM 0 HA LEU A 66 -11.606 -17.590 -2.157 1.00 21.52 H new ATOM 0 HB2 LEU A 66 -11.189 -15.755 -3.773 1.00 52.01 H new ATOM 0 HB3 LEU A 66 -12.292 -16.495 -4.916 1.00 52.01 H new ATOM 0 HG LEU A 66 -14.159 -16.171 -3.287 1.00 61.34 H new ATOM 0 HD11 LEU A 66 -13.831 -14.648 -1.376 1.00 3.12 H new ATOM 0 HD12 LEU A 66 -12.868 -16.136 -1.213 1.00 3.12 H new ATOM 0 HD13 LEU A 66 -12.083 -14.618 -1.707 1.00 3.12 H new ATOM 0 HD21 LEU A 66 -14.353 -13.729 -3.611 1.00 14.32 H new ATOM 0 HD22 LEU A 66 -12.631 -13.658 -4.054 1.00 14.32 H new ATOM 0 HD23 LEU A 66 -13.778 -14.550 -5.082 1.00 14.32 H new ATOM 1080 N SER A 67 -13.493 -18.944 -4.543 1.00 0.11 N ATOM 1081 CA SER A 67 -14.685 -19.778 -4.773 1.00 11.21 C ATOM 1082 C SER A 67 -14.390 -20.919 -5.750 1.00 22.20 C ATOM 1083 O SER A 67 -13.457 -20.839 -6.554 1.00 63.05 O ATOM 1084 CB SER A 67 -15.848 -18.932 -5.310 1.00 73.11 C ATOM 1085 OG SER A 67 -17.010 -19.725 -5.514 1.00 63.23 O ATOM 0 H SER A 67 -13.005 -18.664 -5.394 1.00 0.11 H new ATOM 0 HA SER A 67 -14.967 -20.208 -3.812 1.00 11.21 H new ATOM 0 HB2 SER A 67 -16.071 -18.129 -4.608 1.00 73.11 H new ATOM 0 HB3 SER A 67 -15.556 -18.462 -6.249 1.00 73.11 H new ATOM 0 HG SER A 67 -17.800 -19.146 -5.541 1.00 63.23 H new ATOM 1091 N LEU A 68 -15.202 -21.972 -5.691 1.00 40.55 N ATOM 1092 CA LEU A 68 -14.998 -23.165 -6.521 1.00 54.30 C ATOM 1093 C LEU A 68 -16.274 -23.568 -7.279 1.00 52.51 C ATOM 1094 O LEU A 68 -17.394 -23.277 -6.850 1.00 32.03 O ATOM 1095 CB LEU A 68 -14.538 -24.343 -5.647 1.00 34.44 C ATOM 1096 CG LEU A 68 -13.172 -24.171 -4.959 1.00 20.04 C ATOM 1097 CD1 LEU A 68 -12.894 -25.335 -4.012 1.00 62.10 C ATOM 1098 CD2 LEU A 68 -12.058 -24.045 -5.997 1.00 15.53 C ATOM 0 H LEU A 68 -16.013 -22.027 -5.075 1.00 40.55 H new ATOM 0 HA LEU A 68 -14.231 -22.918 -7.255 1.00 54.30 H new ATOM 0 HB2 LEU A 68 -15.291 -24.517 -4.879 1.00 34.44 H new ATOM 0 HB3 LEU A 68 -14.502 -25.239 -6.267 1.00 34.44 H new ATOM 0 HG LEU A 68 -13.200 -23.253 -4.372 1.00 20.04 H new ATOM 0 HD11 LEU A 68 -11.924 -25.193 -3.536 1.00 62.10 H new ATOM 0 HD12 LEU A 68 -13.670 -25.376 -3.248 1.00 62.10 H new ATOM 0 HD13 LEU A 68 -12.889 -26.269 -4.575 1.00 62.10 H new ATOM 0 HD21 LEU A 68 -11.101 -23.924 -5.490 1.00 15.53 H new ATOM 0 HD22 LEU A 68 -12.032 -24.944 -6.613 1.00 15.53 H new ATOM 0 HD23 LEU A 68 -12.246 -23.177 -6.629 1.00 15.53 H new ATOM 1110 N SER A 69 -16.082 -24.227 -8.416 1.00 42.41 N ATOM 1111 CA SER A 69 -17.179 -24.856 -9.167 1.00 0.32 C ATOM 1112 C SER A 69 -16.928 -26.359 -9.283 1.00 52.14 C ATOM 1113 O SER A 69 -15.777 -26.797 -9.305 1.00 61.13 O ATOM 1114 CB SER A 69 -17.311 -24.255 -10.573 1.00 40.35 C ATOM 1115 OG SER A 69 -17.716 -22.900 -10.526 1.00 74.30 O ATOM 0 H SER A 69 -15.166 -24.344 -8.848 1.00 42.41 H new ATOM 0 HA SER A 69 -18.107 -24.671 -8.625 1.00 0.32 H new ATOM 0 HB2 SER A 69 -16.356 -24.332 -11.093 1.00 40.35 H new ATOM 0 HB3 SER A 69 -18.035 -24.832 -11.149 1.00 40.35 H new ATOM 0 HG SER A 69 -17.788 -22.548 -11.438 1.00 74.30 H new ATOM 1121 N GLU A 70 -17.997 -27.152 -9.333 1.00 4.23 N ATOM 1122 CA GLU A 70 -17.880 -28.616 -9.451 1.00 40.14 C ATOM 1123 C GLU A 70 -17.106 -29.228 -8.265 1.00 60.40 C ATOM 1124 O GLU A 70 -16.678 -30.381 -8.327 1.00 43.22 O ATOM 1125 CB GLU A 70 -17.183 -28.996 -10.772 1.00 14.35 C ATOM 1126 CG GLU A 70 -17.926 -28.547 -12.025 1.00 41.14 C ATOM 1127 CD GLU A 70 -19.301 -29.183 -12.156 1.00 3.21 C ATOM 1128 OE1 GLU A 70 -19.374 -30.395 -12.448 1.00 13.12 O ATOM 1129 OE2 GLU A 70 -20.313 -28.472 -11.971 1.00 12.22 O ATOM 0 H GLU A 70 -18.958 -26.811 -9.294 1.00 4.23 H new ATOM 0 HA GLU A 70 -18.892 -29.021 -9.441 1.00 40.14 H new ATOM 0 HB2 GLU A 70 -16.184 -28.560 -10.780 1.00 14.35 H new ATOM 0 HB3 GLU A 70 -17.059 -30.078 -10.806 1.00 14.35 H new ATOM 0 HG2 GLU A 70 -18.033 -27.462 -12.009 1.00 41.14 H new ATOM 0 HG3 GLU A 70 -17.331 -28.796 -12.903 1.00 41.14 H new ATOM 1136 N SER A 71 -16.944 -28.449 -7.190 1.00 71.31 N ATOM 1137 CA SER A 71 -16.177 -28.875 -6.003 1.00 44.21 C ATOM 1138 C SER A 71 -14.684 -29.083 -6.330 1.00 60.54 C ATOM 1139 O SER A 71 -13.958 -29.741 -5.583 1.00 3.41 O ATOM 1140 CB SER A 71 -16.780 -30.162 -5.408 1.00 42.25 C ATOM 1141 OG SER A 71 -16.128 -30.547 -4.208 1.00 52.42 O ATOM 0 H SER A 71 -17.336 -27.511 -7.113 1.00 71.31 H new ATOM 0 HA SER A 71 -16.244 -28.076 -5.264 1.00 44.21 H new ATOM 0 HB2 SER A 71 -17.841 -30.008 -5.211 1.00 42.25 H new ATOM 0 HB3 SER A 71 -16.705 -30.969 -6.137 1.00 42.25 H new ATOM 0 HG SER A 71 -15.168 -30.364 -4.284 1.00 52.42 H new ATOM 1147 N GLY A 72 -14.219 -28.492 -7.434 1.00 52.14 N ATOM 1148 CA GLY A 72 -12.824 -28.668 -7.846 1.00 24.55 C ATOM 1149 C GLY A 72 -12.299 -27.557 -8.757 1.00 61.31 C ATOM 1150 O GLY A 72 -11.141 -27.146 -8.644 1.00 33.22 O ATOM 0 H GLY A 72 -14.776 -27.898 -8.049 1.00 52.14 H new ATOM 0 HA2 GLY A 72 -12.197 -28.721 -6.956 1.00 24.55 H new ATOM 0 HA3 GLY A 72 -12.726 -29.623 -8.362 1.00 24.55 H new ATOM 1154 N ARG A 73 -13.144 -27.085 -9.670 1.00 13.05 N ATOM 1155 CA ARG A 73 -12.773 -26.023 -10.616 1.00 13.21 C ATOM 1156 C ARG A 73 -12.504 -24.682 -9.904 1.00 0.31 C ATOM 1157 O ARG A 73 -13.307 -24.227 -9.090 1.00 53.45 O ATOM 1158 CB ARG A 73 -13.887 -25.848 -11.666 1.00 5.33 C ATOM 1159 CG ARG A 73 -13.762 -24.582 -12.513 1.00 11.41 C ATOM 1160 CD ARG A 73 -12.489 -24.563 -13.352 1.00 12.44 C ATOM 1161 NE ARG A 73 -12.287 -23.262 -13.986 1.00 20.44 N ATOM 1162 CZ ARG A 73 -11.567 -23.061 -15.055 1.00 42.23 C ATOM 1163 NH1 ARG A 73 -10.974 -24.039 -15.656 1.00 51.41 N ATOM 1164 NH2 ARG A 73 -11.442 -21.868 -15.529 1.00 72.24 N ATOM 0 H ARG A 73 -14.101 -27.422 -9.779 1.00 13.05 H new ATOM 0 HA ARG A 73 -11.847 -26.324 -11.106 1.00 13.21 H new ATOM 0 HB2 ARG A 73 -13.886 -26.715 -12.327 1.00 5.33 H new ATOM 0 HB3 ARG A 73 -14.851 -25.837 -11.157 1.00 5.33 H new ATOM 0 HG2 ARG A 73 -14.628 -24.502 -13.171 1.00 11.41 H new ATOM 0 HG3 ARG A 73 -13.776 -23.709 -11.860 1.00 11.41 H new ATOM 0 HD2 ARG A 73 -11.632 -24.799 -12.721 1.00 12.44 H new ATOM 0 HD3 ARG A 73 -12.544 -25.337 -14.117 1.00 12.44 H new ATOM 0 HE ARG A 73 -12.742 -22.453 -13.562 1.00 20.44 H new ATOM 0 HH11 ARG A 73 -11.064 -24.989 -15.296 1.00 51.41 H new ATOM 0 HH12 ARG A 73 -10.415 -23.861 -16.491 1.00 51.41 H new ATOM 0 HH21 ARG A 73 -11.905 -21.085 -15.068 1.00 72.24 H new ATOM 0 HH22 ARG A 73 -10.880 -21.708 -16.365 1.00 72.24 H new ATOM 1178 N VAL A 74 -11.375 -24.055 -10.233 1.00 3.12 N ATOM 1179 CA VAL A 74 -11.031 -22.734 -9.698 1.00 21.41 C ATOM 1180 C VAL A 74 -11.892 -21.628 -10.337 1.00 35.22 C ATOM 1181 O VAL A 74 -11.857 -21.423 -11.553 1.00 11.25 O ATOM 1182 CB VAL A 74 -9.528 -22.412 -9.933 1.00 3.44 C ATOM 1183 CG1 VAL A 74 -9.179 -21.003 -9.451 1.00 43.55 C ATOM 1184 CG2 VAL A 74 -8.638 -23.453 -9.252 1.00 53.11 C ATOM 0 H VAL A 74 -10.679 -24.441 -10.870 1.00 3.12 H new ATOM 0 HA VAL A 74 -11.230 -22.762 -8.627 1.00 21.41 H new ATOM 0 HB VAL A 74 -9.344 -22.452 -11.007 1.00 3.44 H new ATOM 0 HG11 VAL A 74 -8.121 -20.809 -9.629 1.00 43.55 H new ATOM 0 HG12 VAL A 74 -9.779 -20.273 -9.995 1.00 43.55 H new ATOM 0 HG13 VAL A 74 -9.388 -20.921 -8.384 1.00 43.55 H new ATOM 0 HG21 VAL A 74 -7.591 -23.208 -9.429 1.00 53.11 H new ATOM 0 HG22 VAL A 74 -8.834 -23.454 -8.180 1.00 53.11 H new ATOM 0 HG23 VAL A 74 -8.854 -24.440 -9.661 1.00 53.11 H new ATOM 1194 N ARG A 75 -12.680 -20.935 -9.515 1.00 31.12 N ATOM 1195 CA ARG A 75 -13.488 -19.800 -9.983 1.00 62.24 C ATOM 1196 C ARG A 75 -12.723 -18.472 -9.859 1.00 2.15 C ATOM 1197 O ARG A 75 -12.024 -18.053 -10.783 1.00 75.41 O ATOM 1198 CB ARG A 75 -14.803 -19.713 -9.196 1.00 0.22 C ATOM 1199 CG ARG A 75 -15.939 -20.555 -9.752 1.00 11.12 C ATOM 1200 CD ARG A 75 -17.220 -20.332 -8.956 1.00 50.43 C ATOM 1201 NE ARG A 75 -17.500 -18.909 -8.759 1.00 62.42 N ATOM 1202 CZ ARG A 75 -18.553 -18.446 -8.143 1.00 23.24 C ATOM 1203 NH1 ARG A 75 -19.466 -19.245 -7.690 1.00 31.25 N ATOM 1204 NH2 ARG A 75 -18.681 -17.175 -7.969 1.00 33.22 N ATOM 0 H ARG A 75 -12.779 -21.137 -8.520 1.00 31.12 H new ATOM 0 HA ARG A 75 -13.708 -19.971 -11.037 1.00 62.24 H new ATOM 0 HB2 ARG A 75 -14.614 -20.018 -8.167 1.00 0.22 H new ATOM 0 HB3 ARG A 75 -15.123 -18.672 -9.166 1.00 0.22 H new ATOM 0 HG2 ARG A 75 -16.107 -20.301 -10.799 1.00 11.12 H new ATOM 0 HG3 ARG A 75 -15.665 -21.610 -9.720 1.00 11.12 H new ATOM 0 HD2 ARG A 75 -18.057 -20.798 -9.477 1.00 50.43 H new ATOM 0 HD3 ARG A 75 -17.135 -20.823 -7.986 1.00 50.43 H new ATOM 0 HE ARG A 75 -16.828 -18.235 -9.127 1.00 62.42 H new ATOM 0 HH11 ARG A 75 -19.368 -20.253 -7.812 1.00 31.25 H new ATOM 0 HH12 ARG A 75 -20.283 -18.866 -7.211 1.00 31.25 H new ATOM 0 HH21 ARG A 75 -17.962 -16.538 -8.312 1.00 33.22 H new ATOM 0 HH22 ARG A 75 -19.502 -16.806 -7.488 1.00 33.22 H new ATOM 1218 N GLU A 76 -12.867 -17.814 -8.709 1.00 3.53 N ATOM 1219 CA GLU A 76 -12.172 -16.556 -8.445 1.00 2.03 C ATOM 1220 C GLU A 76 -11.014 -16.768 -7.467 1.00 44.41 C ATOM 1221 O GLU A 76 -11.097 -17.590 -6.548 1.00 73.30 O ATOM 1222 CB GLU A 76 -13.137 -15.497 -7.882 1.00 63.42 C ATOM 1223 CG GLU A 76 -14.235 -15.056 -8.854 1.00 73.32 C ATOM 1224 CD GLU A 76 -15.375 -16.057 -8.981 1.00 32.53 C ATOM 1225 OE1 GLU A 76 -16.193 -16.148 -8.043 1.00 31.42 O ATOM 1226 OE2 GLU A 76 -15.461 -16.752 -10.013 1.00 43.53 O ATOM 0 H GLU A 76 -13.461 -18.133 -7.944 1.00 3.53 H new ATOM 0 HA GLU A 76 -11.774 -16.197 -9.394 1.00 2.03 H new ATOM 0 HB2 GLU A 76 -13.605 -15.893 -6.981 1.00 63.42 H new ATOM 0 HB3 GLU A 76 -12.561 -14.621 -7.583 1.00 63.42 H new ATOM 0 HG2 GLU A 76 -14.638 -14.099 -8.523 1.00 73.32 H new ATOM 0 HG3 GLU A 76 -13.794 -14.893 -9.838 1.00 73.32 H new ATOM 1233 N PHE A 77 -9.940 -16.021 -7.674 1.00 22.45 N ATOM 1234 CA PHE A 77 -8.751 -16.092 -6.828 1.00 41.22 C ATOM 1235 C PHE A 77 -8.639 -14.821 -5.966 1.00 71.32 C ATOM 1236 O PHE A 77 -8.548 -13.710 -6.492 1.00 42.14 O ATOM 1237 CB PHE A 77 -7.505 -16.261 -7.719 1.00 20.23 C ATOM 1238 CG PHE A 77 -6.561 -17.346 -7.269 1.00 71.22 C ATOM 1239 CD1 PHE A 77 -6.948 -18.678 -7.306 1.00 1.02 C ATOM 1240 CD2 PHE A 77 -5.283 -17.038 -6.828 1.00 22.30 C ATOM 1241 CE1 PHE A 77 -6.083 -19.677 -6.906 1.00 15.31 C ATOM 1242 CE2 PHE A 77 -4.416 -18.034 -6.426 1.00 41.40 C ATOM 1243 CZ PHE A 77 -4.814 -19.354 -6.466 1.00 10.34 C ATOM 0 H PHE A 77 -9.865 -15.346 -8.435 1.00 22.45 H new ATOM 0 HA PHE A 77 -8.827 -16.949 -6.158 1.00 41.22 H new ATOM 0 HB2 PHE A 77 -7.828 -16.477 -8.737 1.00 20.23 H new ATOM 0 HB3 PHE A 77 -6.964 -15.315 -7.750 1.00 20.23 H new ATOM 0 HD1 PHE A 77 -7.938 -18.936 -7.652 1.00 1.02 H new ATOM 0 HD2 PHE A 77 -4.962 -16.007 -6.799 1.00 22.30 H new ATOM 0 HE1 PHE A 77 -6.398 -20.710 -6.937 1.00 15.31 H new ATOM 0 HE2 PHE A 77 -3.425 -17.779 -6.080 1.00 41.40 H new ATOM 0 HZ PHE A 77 -4.135 -20.134 -6.154 1.00 10.34 H new ATOM 1253 N GLU A 78 -8.666 -14.985 -4.648 1.00 54.35 N ATOM 1254 CA GLU A 78 -8.612 -13.849 -3.722 1.00 14.11 C ATOM 1255 C GLU A 78 -7.184 -13.282 -3.614 1.00 41.34 C ATOM 1256 O GLU A 78 -6.295 -13.900 -3.019 1.00 22.24 O ATOM 1257 CB GLU A 78 -9.132 -14.277 -2.337 1.00 74.51 C ATOM 1258 CG GLU A 78 -9.162 -13.153 -1.301 1.00 70.44 C ATOM 1259 CD GLU A 78 -9.785 -13.587 0.021 1.00 15.33 C ATOM 1260 OE1 GLU A 78 -9.189 -14.437 0.712 1.00 65.44 O ATOM 1261 OE2 GLU A 78 -10.875 -13.092 0.372 1.00 74.34 O ATOM 0 H GLU A 78 -8.725 -15.895 -4.191 1.00 54.35 H new ATOM 0 HA GLU A 78 -9.251 -13.057 -4.113 1.00 14.11 H new ATOM 0 HB2 GLU A 78 -10.139 -14.679 -2.448 1.00 74.51 H new ATOM 0 HB3 GLU A 78 -8.505 -15.086 -1.961 1.00 74.51 H new ATOM 0 HG2 GLU A 78 -8.145 -12.803 -1.121 1.00 70.44 H new ATOM 0 HG3 GLU A 78 -9.723 -12.309 -1.703 1.00 70.44 H new ATOM 1268 N LEU A 79 -6.966 -12.116 -4.222 1.00 14.51 N ATOM 1269 CA LEU A 79 -5.674 -11.426 -4.146 1.00 35.45 C ATOM 1270 C LEU A 79 -5.581 -10.605 -2.852 1.00 12.32 C ATOM 1271 O LEU A 79 -6.014 -9.452 -2.805 1.00 12.22 O ATOM 1272 CB LEU A 79 -5.487 -10.502 -5.362 1.00 0.33 C ATOM 1273 CG LEU A 79 -5.707 -11.159 -6.738 1.00 11.43 C ATOM 1274 CD1 LEU A 79 -5.472 -10.150 -7.862 1.00 31.41 C ATOM 1275 CD2 LEU A 79 -4.806 -12.379 -6.910 1.00 3.23 C ATOM 0 H LEU A 79 -7.669 -11.626 -4.775 1.00 14.51 H new ATOM 0 HA LEU A 79 -4.884 -12.177 -4.147 1.00 35.45 H new ATOM 0 HB2 LEU A 79 -6.175 -9.662 -5.266 1.00 0.33 H new ATOM 0 HB3 LEU A 79 -4.477 -10.092 -5.332 1.00 0.33 H new ATOM 0 HG LEU A 79 -6.743 -11.494 -6.791 1.00 11.43 H new ATOM 0 HD11 LEU A 79 -5.633 -10.634 -8.825 1.00 31.41 H new ATOM 0 HD12 LEU A 79 -6.167 -9.317 -7.754 1.00 31.41 H new ATOM 0 HD13 LEU A 79 -4.449 -9.778 -7.809 1.00 31.41 H new ATOM 0 HD21 LEU A 79 -4.980 -12.825 -7.889 1.00 3.23 H new ATOM 0 HD22 LEU A 79 -3.762 -12.075 -6.830 1.00 3.23 H new ATOM 0 HD23 LEU A 79 -5.031 -13.110 -6.133 1.00 3.23 H new ATOM 1287 N VAL A 80 -5.034 -11.211 -1.804 1.00 22.22 N ATOM 1288 CA VAL A 80 -4.964 -10.569 -0.487 1.00 64.05 C ATOM 1289 C VAL A 80 -3.644 -9.800 -0.281 1.00 3.22 C ATOM 1290 O VAL A 80 -2.551 -10.373 -0.317 1.00 3.22 O ATOM 1291 CB VAL A 80 -5.172 -11.603 0.655 1.00 23.52 C ATOM 1292 CG1 VAL A 80 -4.211 -12.783 0.523 1.00 52.40 C ATOM 1293 CG2 VAL A 80 -5.038 -10.937 2.030 1.00 3.15 C ATOM 0 H VAL A 80 -4.631 -12.147 -1.836 1.00 22.22 H new ATOM 0 HA VAL A 80 -5.776 -9.842 -0.451 1.00 64.05 H new ATOM 0 HB VAL A 80 -6.186 -11.993 0.565 1.00 23.52 H new ATOM 0 HG11 VAL A 80 -4.384 -13.486 1.338 1.00 52.40 H new ATOM 0 HG12 VAL A 80 -4.379 -13.284 -0.430 1.00 52.40 H new ATOM 0 HG13 VAL A 80 -3.183 -12.422 0.568 1.00 52.40 H new ATOM 0 HG21 VAL A 80 -5.188 -11.682 2.811 1.00 3.15 H new ATOM 0 HG22 VAL A 80 -4.043 -10.503 2.129 1.00 3.15 H new ATOM 0 HG23 VAL A 80 -5.788 -10.152 2.129 1.00 3.15 H new ATOM 1303 N TYR A 81 -3.764 -8.489 -0.080 1.00 60.03 N ATOM 1304 CA TYR A 81 -2.614 -7.617 0.179 1.00 60.52 C ATOM 1305 C TYR A 81 -2.648 -7.091 1.624 1.00 24.11 C ATOM 1306 O TYR A 81 -3.458 -6.226 1.967 1.00 64.14 O ATOM 1307 CB TYR A 81 -2.616 -6.448 -0.823 1.00 53.11 C ATOM 1308 CG TYR A 81 -1.417 -5.513 -0.727 1.00 73.13 C ATOM 1309 CD1 TYR A 81 -0.153 -5.992 -0.399 1.00 20.23 C ATOM 1310 CD2 TYR A 81 -1.550 -4.151 -0.983 1.00 14.53 C ATOM 1311 CE1 TYR A 81 0.936 -5.146 -0.317 1.00 15.34 C ATOM 1312 CE2 TYR A 81 -0.463 -3.300 -0.905 1.00 61.41 C ATOM 1313 CZ TYR A 81 0.778 -3.803 -0.575 1.00 33.42 C ATOM 1314 OH TYR A 81 1.864 -2.958 -0.500 1.00 61.51 O ATOM 0 H TYR A 81 -4.659 -7.999 -0.092 1.00 60.03 H new ATOM 0 HA TYR A 81 -1.697 -8.192 0.052 1.00 60.52 H new ATOM 0 HB2 TYR A 81 -2.659 -6.856 -1.833 1.00 53.11 H new ATOM 0 HB3 TYR A 81 -3.525 -5.865 -0.675 1.00 53.11 H new ATOM 0 HD1 TYR A 81 -0.020 -7.046 -0.205 1.00 20.23 H new ATOM 0 HD2 TYR A 81 -2.518 -3.752 -1.247 1.00 14.53 H new ATOM 0 HE1 TYR A 81 1.907 -5.537 -0.052 1.00 15.34 H new ATOM 0 HE2 TYR A 81 -0.585 -2.245 -1.102 1.00 61.41 H new ATOM 0 HH TYR A 81 2.679 -3.451 -0.730 1.00 61.51 H new ATOM 1324 N ARG A 82 -1.781 -7.636 2.474 1.00 51.25 N ATOM 1325 CA ARG A 82 -1.723 -7.240 3.887 1.00 32.13 C ATOM 1326 C ARG A 82 -0.695 -6.126 4.136 1.00 20.42 C ATOM 1327 O ARG A 82 0.511 -6.334 3.988 1.00 42.10 O ATOM 1328 CB ARG A 82 -1.412 -8.461 4.777 1.00 11.51 C ATOM 1329 CG ARG A 82 -2.648 -9.072 5.431 1.00 63.32 C ATOM 1330 CD ARG A 82 -3.325 -8.077 6.371 1.00 5.13 C ATOM 1331 NE ARG A 82 -4.525 -8.626 6.992 1.00 43.30 N ATOM 1332 CZ ARG A 82 -5.494 -7.901 7.479 1.00 13.03 C ATOM 1333 NH1 ARG A 82 -5.436 -6.609 7.433 1.00 51.22 N ATOM 1334 NH2 ARG A 82 -6.517 -8.473 8.021 1.00 50.32 N ATOM 0 H ARG A 82 -1.106 -8.355 2.212 1.00 51.25 H new ATOM 0 HA ARG A 82 -2.704 -6.844 4.150 1.00 32.13 H new ATOM 0 HB2 ARG A 82 -0.916 -9.222 4.174 1.00 11.51 H new ATOM 0 HB3 ARG A 82 -0.709 -8.163 5.555 1.00 11.51 H new ATOM 0 HG2 ARG A 82 -3.353 -9.386 4.661 1.00 63.32 H new ATOM 0 HG3 ARG A 82 -2.364 -9.966 5.987 1.00 63.32 H new ATOM 0 HD2 ARG A 82 -2.621 -7.779 7.148 1.00 5.13 H new ATOM 0 HD3 ARG A 82 -3.586 -7.177 5.815 1.00 5.13 H new ATOM 0 HE ARG A 82 -4.612 -9.641 7.049 1.00 43.30 H new ATOM 0 HH11 ARG A 82 -4.628 -6.149 7.013 1.00 51.22 H new ATOM 0 HH12 ARG A 82 -6.198 -6.050 7.816 1.00 51.22 H new ATOM 0 HH21 ARG A 82 -6.567 -9.491 8.068 1.00 50.32 H new ATOM 0 HH22 ARG A 82 -7.275 -7.907 8.402 1.00 50.32 H new ATOM 1348 N VAL A 83 -1.187 -4.948 4.525 1.00 72.11 N ATOM 1349 CA VAL A 83 -0.325 -3.808 4.860 1.00 43.42 C ATOM 1350 C VAL A 83 -0.478 -3.409 6.337 1.00 71.23 C ATOM 1351 O VAL A 83 -1.593 -3.207 6.825 1.00 10.03 O ATOM 1352 CB VAL A 83 -0.643 -2.576 3.975 1.00 4.43 C ATOM 1353 CG1 VAL A 83 0.330 -1.432 4.258 1.00 63.40 C ATOM 1354 CG2 VAL A 83 -0.627 -2.950 2.495 1.00 62.42 C ATOM 0 H VAL A 83 -2.185 -4.756 4.617 1.00 72.11 H new ATOM 0 HA VAL A 83 0.700 -4.127 4.674 1.00 43.42 H new ATOM 0 HB VAL A 83 -1.647 -2.233 4.226 1.00 4.43 H new ATOM 0 HG11 VAL A 83 0.084 -0.580 3.624 1.00 63.40 H new ATOM 0 HG12 VAL A 83 0.253 -1.139 5.305 1.00 63.40 H new ATOM 0 HG13 VAL A 83 1.348 -1.760 4.047 1.00 63.40 H new ATOM 0 HG21 VAL A 83 -0.853 -2.069 1.895 1.00 62.42 H new ATOM 0 HG22 VAL A 83 0.359 -3.329 2.226 1.00 62.42 H new ATOM 0 HG23 VAL A 83 -1.376 -3.719 2.306 1.00 62.42 H new ATOM 1364 N ALA A 84 0.649 -3.303 7.036 1.00 34.12 N ATOM 1365 CA ALA A 84 0.674 -2.863 8.434 1.00 65.05 C ATOM 1366 C ALA A 84 1.821 -1.869 8.659 1.00 64.34 C ATOM 1367 O ALA A 84 2.950 -2.107 8.222 1.00 14.35 O ATOM 1368 CB ALA A 84 0.818 -4.063 9.367 1.00 23.53 C ATOM 0 H ALA A 84 1.570 -3.518 6.654 1.00 34.12 H new ATOM 0 HA ALA A 84 -0.268 -2.362 8.658 1.00 65.05 H new ATOM 0 HB1 ALA A 84 0.835 -3.720 10.401 1.00 23.53 H new ATOM 0 HB2 ALA A 84 -0.025 -4.739 9.223 1.00 23.53 H new ATOM 0 HB3 ALA A 84 1.747 -4.588 9.144 1.00 23.53 H new ATOM 1374 N ALA A 85 1.534 -0.763 9.344 1.00 11.44 N ATOM 1375 CA ALA A 85 2.525 0.305 9.535 1.00 21.42 C ATOM 1376 C ALA A 85 2.349 1.034 10.879 1.00 21.24 C ATOM 1377 O ALA A 85 1.458 0.715 11.662 1.00 32.34 O ATOM 1378 CB ALA A 85 2.430 1.299 8.382 1.00 74.05 C ATOM 0 H ALA A 85 0.628 -0.580 9.776 1.00 11.44 H new ATOM 0 HA ALA A 85 3.512 -0.157 9.550 1.00 21.42 H new ATOM 0 HB1 ALA A 85 3.165 2.091 8.523 1.00 74.05 H new ATOM 0 HB2 ALA A 85 2.627 0.785 7.441 1.00 74.05 H new ATOM 0 HB3 ALA A 85 1.430 1.732 8.356 1.00 74.05 H new ATOM 1384 N ARG A 86 3.223 2.008 11.135 1.00 64.11 N ATOM 1385 CA ARG A 86 3.151 2.852 12.337 1.00 13.21 C ATOM 1386 C ARG A 86 3.509 4.315 12.011 1.00 34.41 C ATOM 1387 O ARG A 86 4.241 4.591 11.058 1.00 61.24 O ATOM 1388 CB ARG A 86 4.089 2.320 13.437 1.00 74.11 C ATOM 1389 CG ARG A 86 3.618 1.024 14.094 1.00 73.45 C ATOM 1390 CD ARG A 86 4.548 0.589 15.225 1.00 50.32 C ATOM 1391 NE ARG A 86 3.986 -0.512 16.005 1.00 12.21 N ATOM 1392 CZ ARG A 86 4.239 -0.715 17.269 1.00 31.42 C ATOM 1393 NH1 ARG A 86 5.095 0.024 17.902 1.00 21.01 N ATOM 1394 NH2 ARG A 86 3.650 -1.678 17.895 1.00 44.22 N ATOM 0 H ARG A 86 4.002 2.237 10.518 1.00 64.11 H new ATOM 0 HA ARG A 86 2.124 2.817 12.700 1.00 13.21 H new ATOM 0 HB2 ARG A 86 5.077 2.157 13.007 1.00 74.11 H new ATOM 0 HB3 ARG A 86 4.198 3.085 14.206 1.00 74.11 H new ATOM 0 HG2 ARG A 86 2.610 1.161 14.485 1.00 73.45 H new ATOM 0 HG3 ARG A 86 3.565 0.235 13.344 1.00 73.45 H new ATOM 0 HD2 ARG A 86 5.508 0.284 14.808 1.00 50.32 H new ATOM 0 HD3 ARG A 86 4.741 1.437 15.882 1.00 50.32 H new ATOM 0 HE ARG A 86 3.357 -1.162 15.532 1.00 12.21 H new ATOM 0 HH11 ARG A 86 5.581 0.775 17.412 1.00 21.01 H new ATOM 0 HH12 ARG A 86 5.283 -0.146 18.890 1.00 21.01 H new ATOM 0 HH21 ARG A 86 2.989 -2.278 17.402 1.00 44.22 H new ATOM 0 HH22 ARG A 86 3.846 -1.839 18.883 1.00 44.22 H new ATOM 1408 N LEU A 87 3.000 5.247 12.815 1.00 73.13 N ATOM 1409 CA LEU A 87 3.243 6.681 12.603 1.00 15.33 C ATOM 1410 C LEU A 87 3.971 7.275 13.826 1.00 4.41 C ATOM 1411 O LEU A 87 3.370 7.490 14.885 1.00 73.43 O ATOM 1412 CB LEU A 87 1.894 7.382 12.338 1.00 4.12 C ATOM 1413 CG LEU A 87 1.946 8.675 11.497 1.00 53.10 C ATOM 1414 CD1 LEU A 87 0.593 8.924 10.830 1.00 32.01 C ATOM 1415 CD2 LEU A 87 2.352 9.878 12.351 1.00 30.54 C ATOM 0 H LEU A 87 2.414 5.038 13.623 1.00 73.13 H new ATOM 0 HA LEU A 87 3.886 6.835 11.736 1.00 15.33 H new ATOM 0 HB2 LEU A 87 1.234 6.674 11.836 1.00 4.12 H new ATOM 0 HB3 LEU A 87 1.437 7.618 13.299 1.00 4.12 H new ATOM 0 HG LEU A 87 2.703 8.546 10.724 1.00 53.10 H new ATOM 0 HD11 LEU A 87 0.641 9.839 10.239 1.00 32.01 H new ATOM 0 HD12 LEU A 87 0.348 8.084 10.179 1.00 32.01 H new ATOM 0 HD13 LEU A 87 -0.176 9.026 11.595 1.00 32.01 H new ATOM 0 HD21 LEU A 87 2.379 10.773 11.729 1.00 30.54 H new ATOM 0 HD22 LEU A 87 1.627 10.016 13.154 1.00 30.54 H new ATOM 0 HD23 LEU A 87 3.339 9.704 12.779 1.00 30.54 H new ATOM 1427 N LEU A 88 5.276 7.522 13.680 1.00 12.24 N ATOM 1428 CA LEU A 88 6.135 7.876 14.821 1.00 54.14 C ATOM 1429 C LEU A 88 6.606 9.339 14.788 1.00 61.30 C ATOM 1430 O LEU A 88 6.442 10.055 13.798 1.00 11.13 O ATOM 1431 CB LEU A 88 7.372 6.955 14.878 1.00 21.13 C ATOM 1432 CG LEU A 88 7.095 5.454 15.098 1.00 41.12 C ATOM 1433 CD1 LEU A 88 6.500 4.813 13.852 1.00 33.43 C ATOM 1434 CD2 LEU A 88 8.370 4.725 15.514 1.00 32.21 C ATOM 0 H LEU A 88 5.763 7.484 12.785 1.00 12.24 H new ATOM 0 HA LEU A 88 5.521 7.742 15.711 1.00 54.14 H new ATOM 0 HB2 LEU A 88 7.926 7.068 13.946 1.00 21.13 H new ATOM 0 HB3 LEU A 88 8.022 7.304 15.680 1.00 21.13 H new ATOM 0 HG LEU A 88 6.365 5.367 15.903 1.00 41.12 H new ATOM 0 HD11 LEU A 88 6.316 3.755 14.039 1.00 33.43 H new ATOM 0 HD12 LEU A 88 5.560 5.306 13.603 1.00 33.43 H new ATOM 0 HD13 LEU A 88 7.197 4.918 13.020 1.00 33.43 H new ATOM 0 HD21 LEU A 88 8.152 3.668 15.664 1.00 32.21 H new ATOM 0 HD22 LEU A 88 9.122 4.833 14.733 1.00 32.21 H new ATOM 0 HD23 LEU A 88 8.747 5.153 16.443 1.00 32.21 H new ATOM 1446 N ASP A 89 7.203 9.758 15.900 1.00 60.12 N ATOM 1447 CA ASP A 89 7.817 11.080 16.030 1.00 44.31 C ATOM 1448 C ASP A 89 9.167 11.138 15.285 1.00 75.32 C ATOM 1449 O ASP A 89 9.730 10.103 14.923 1.00 62.43 O ATOM 1450 CB ASP A 89 8.002 11.392 17.525 1.00 22.42 C ATOM 1451 CG ASP A 89 8.849 12.622 17.781 1.00 42.24 C ATOM 1452 OD1 ASP A 89 8.372 13.742 17.526 1.00 61.15 O ATOM 1453 OD2 ASP A 89 10.014 12.468 18.206 1.00 2.14 O ATOM 0 H ASP A 89 7.276 9.188 16.743 1.00 60.12 H new ATOM 0 HA ASP A 89 7.167 11.829 15.578 1.00 44.31 H new ATOM 0 HB2 ASP A 89 7.023 11.532 17.984 1.00 22.42 H new ATOM 0 HB3 ASP A 89 8.463 10.534 18.014 1.00 22.42 H new ATOM 1458 N ALA A 90 9.687 12.351 15.083 1.00 51.33 N ATOM 1459 CA ALA A 90 10.959 12.561 14.374 1.00 12.40 C ATOM 1460 C ALA A 90 12.125 11.762 14.986 1.00 33.34 C ATOM 1461 O ALA A 90 13.121 11.494 14.315 1.00 72.12 O ATOM 1462 CB ALA A 90 11.296 14.045 14.354 1.00 32.03 C ATOM 0 H ALA A 90 9.244 13.213 15.403 1.00 51.33 H new ATOM 0 HA ALA A 90 10.825 12.193 13.357 1.00 12.40 H new ATOM 0 HB1 ALA A 90 12.239 14.197 13.828 1.00 32.03 H new ATOM 0 HB2 ALA A 90 10.503 14.591 13.843 1.00 32.03 H new ATOM 0 HB3 ALA A 90 11.388 14.411 15.377 1.00 32.03 H new ATOM 1468 N HIS A 91 12.009 11.394 16.262 1.00 71.23 N ATOM 1469 CA HIS A 91 13.036 10.579 16.928 1.00 53.10 C ATOM 1470 C HIS A 91 12.559 9.136 17.176 1.00 63.32 C ATOM 1471 O HIS A 91 12.958 8.501 18.153 1.00 62.00 O ATOM 1472 CB HIS A 91 13.462 11.240 18.245 1.00 30.03 C ATOM 1473 CG HIS A 91 14.288 12.475 18.051 1.00 55.13 C ATOM 1474 ND1 HIS A 91 14.811 13.204 19.094 1.00 61.24 N ATOM 1475 CD2 HIS A 91 14.690 13.106 16.922 1.00 65.14 C ATOM 1476 CE1 HIS A 91 15.495 14.223 18.620 1.00 3.45 C ATOM 1477 NE2 HIS A 91 15.438 14.191 17.305 1.00 24.53 N ATOM 0 H HIS A 91 11.219 11.644 16.857 1.00 71.23 H new ATOM 0 HA HIS A 91 13.896 10.522 16.261 1.00 53.10 H new ATOM 0 HB2 HIS A 91 12.572 11.494 18.820 1.00 30.03 H new ATOM 0 HB3 HIS A 91 14.029 10.522 18.837 1.00 30.03 H new ATOM 0 HD2 HIS A 91 14.464 12.810 15.908 1.00 65.14 H new ATOM 0 HE1 HIS A 91 16.016 14.962 19.211 1.00 3.45 H new ATOM 0 HE2 HIS A 91 15.877 14.862 16.675 1.00 24.53 H new ATOM 1486 N ASN A 92 11.713 8.625 16.277 1.00 70.04 N ATOM 1487 CA ASN A 92 11.279 7.215 16.294 1.00 1.32 C ATOM 1488 C ASN A 92 10.452 6.852 17.545 1.00 14.54 C ATOM 1489 O ASN A 92 10.370 5.684 17.928 1.00 5.21 O ATOM 1490 CB ASN A 92 12.495 6.280 16.179 1.00 43.20 C ATOM 1491 CG ASN A 92 13.333 6.567 14.946 1.00 41.14 C ATOM 1492 OD1 ASN A 92 14.253 7.375 14.982 1.00 0.13 O ATOM 1493 ND2 ASN A 92 13.028 5.908 13.848 1.00 52.21 N ATOM 0 H ASN A 92 11.308 9.171 15.517 1.00 70.04 H new ATOM 0 HA ASN A 92 10.626 7.081 15.432 1.00 1.32 H new ATOM 0 HB2 ASN A 92 13.116 6.385 17.069 1.00 43.20 H new ATOM 0 HB3 ASN A 92 12.153 5.246 16.149 1.00 43.20 H new ATOM 0 HD21 ASN A 92 13.564 6.064 12.994 1.00 52.21 H new ATOM 0 HD22 ASN A 92 12.256 5.242 13.851 1.00 52.21 H new ATOM 1500 N ALA A 93 9.824 7.844 18.169 1.00 64.10 N ATOM 1501 CA ALA A 93 8.930 7.592 19.306 1.00 45.15 C ATOM 1502 C ALA A 93 7.518 7.218 18.817 1.00 31.44 C ATOM 1503 O ALA A 93 6.889 7.980 18.082 1.00 43.02 O ATOM 1504 CB ALA A 93 8.882 8.817 20.217 1.00 2.00 C ATOM 0 H ALA A 93 9.914 8.827 17.912 1.00 64.10 H new ATOM 0 HA ALA A 93 9.321 6.750 19.877 1.00 45.15 H new ATOM 0 HB1 ALA A 93 8.216 8.620 21.057 1.00 2.00 H new ATOM 0 HB2 ALA A 93 9.883 9.032 20.590 1.00 2.00 H new ATOM 0 HB3 ALA A 93 8.512 9.674 19.655 1.00 2.00 H new ATOM 1510 N GLU A 94 7.023 6.042 19.210 1.00 35.14 N ATOM 1511 CA GLU A 94 5.710 5.568 18.748 1.00 4.34 C ATOM 1512 C GLU A 94 4.548 6.270 19.481 1.00 63.34 C ATOM 1513 O GLU A 94 4.128 5.862 20.566 1.00 2.01 O ATOM 1514 CB GLU A 94 5.600 4.034 18.878 1.00 32.45 C ATOM 1515 CG GLU A 94 5.841 3.490 20.286 1.00 25.43 C ATOM 1516 CD GLU A 94 5.774 1.970 20.348 1.00 35.12 C ATOM 1517 OE1 GLU A 94 6.812 1.311 20.122 1.00 22.22 O ATOM 1518 OE2 GLU A 94 4.684 1.421 20.610 1.00 73.11 O ATOM 0 H GLU A 94 7.505 5.403 19.842 1.00 35.14 H new ATOM 0 HA GLU A 94 5.627 5.829 17.693 1.00 4.34 H new ATOM 0 HB2 GLU A 94 4.607 3.726 18.550 1.00 32.45 H new ATOM 0 HB3 GLU A 94 6.317 3.574 18.198 1.00 32.45 H new ATOM 0 HG2 GLU A 94 6.819 3.821 20.637 1.00 25.43 H new ATOM 0 HG3 GLU A 94 5.099 3.910 20.965 1.00 25.43 H new ATOM 1525 N LEU A 95 4.049 7.354 18.885 1.00 1.40 N ATOM 1526 CA LEU A 95 2.882 8.070 19.425 1.00 22.34 C ATOM 1527 C LEU A 95 1.570 7.547 18.821 1.00 41.21 C ATOM 1528 O LEU A 95 0.527 7.564 19.475 1.00 64.24 O ATOM 1529 CB LEU A 95 2.993 9.589 19.180 1.00 53.05 C ATOM 1530 CG LEU A 95 3.948 10.359 20.114 1.00 3.15 C ATOM 1531 CD1 LEU A 95 3.586 10.123 21.578 1.00 33.41 C ATOM 1532 CD2 LEU A 95 5.403 9.984 19.846 1.00 61.23 C ATOM 0 H LEU A 95 4.431 7.758 18.030 1.00 1.40 H new ATOM 0 HA LEU A 95 2.869 7.886 20.499 1.00 22.34 H new ATOM 0 HB2 LEU A 95 3.317 9.748 18.151 1.00 53.05 H new ATOM 0 HB3 LEU A 95 1.998 10.025 19.272 1.00 53.05 H new ATOM 0 HG LEU A 95 3.834 11.422 19.904 1.00 3.15 H new ATOM 0 HD11 LEU A 95 4.274 10.677 22.217 1.00 33.41 H new ATOM 0 HD12 LEU A 95 2.567 10.464 21.760 1.00 33.41 H new ATOM 0 HD13 LEU A 95 3.658 9.059 21.804 1.00 33.41 H new ATOM 0 HD21 LEU A 95 6.053 10.543 20.520 1.00 61.23 H new ATOM 0 HD22 LEU A 95 5.540 8.916 20.013 1.00 61.23 H new ATOM 0 HD23 LEU A 95 5.657 10.225 18.814 1.00 61.23 H new ATOM 1544 N ALA A 96 1.622 7.085 17.573 1.00 31.54 N ATOM 1545 CA ALA A 96 0.423 6.588 16.888 1.00 40.31 C ATOM 1546 C ALA A 96 0.698 5.303 16.091 1.00 11.44 C ATOM 1547 O ALA A 96 1.224 5.349 14.980 1.00 30.02 O ATOM 1548 CB ALA A 96 -0.141 7.670 15.968 1.00 2.32 C ATOM 0 H ALA A 96 2.475 7.043 17.015 1.00 31.54 H new ATOM 0 HA ALA A 96 -0.312 6.341 17.654 1.00 40.31 H new ATOM 0 HB1 ALA A 96 -1.030 7.292 15.464 1.00 2.32 H new ATOM 0 HB2 ALA A 96 -0.404 8.548 16.558 1.00 2.32 H new ATOM 0 HB3 ALA A 96 0.608 7.943 15.225 1.00 2.32 H new ATOM 1554 N SER A 97 0.363 4.153 16.672 1.00 72.11 N ATOM 1555 CA SER A 97 0.428 2.878 15.944 1.00 42.11 C ATOM 1556 C SER A 97 -0.627 2.841 14.832 1.00 55.14 C ATOM 1557 O SER A 97 -1.810 2.606 15.089 1.00 63.21 O ATOM 1558 CB SER A 97 0.234 1.684 16.893 1.00 13.44 C ATOM 1559 OG SER A 97 1.316 1.566 17.804 1.00 62.52 O ATOM 0 H SER A 97 0.045 4.073 17.638 1.00 72.11 H new ATOM 0 HA SER A 97 1.419 2.801 15.497 1.00 42.11 H new ATOM 0 HB2 SER A 97 -0.698 1.804 17.446 1.00 13.44 H new ATOM 0 HB3 SER A 97 0.144 0.766 16.312 1.00 13.44 H new ATOM 0 HG SER A 97 1.164 0.799 18.395 1.00 62.52 H new ATOM 1565 N LEU A 98 -0.187 3.096 13.603 1.00 71.42 N ATOM 1566 CA LEU A 98 -1.082 3.157 12.445 1.00 1.25 C ATOM 1567 C LEU A 98 -1.819 1.819 12.230 1.00 23.31 C ATOM 1568 O LEU A 98 -1.297 0.741 12.527 1.00 35.23 O ATOM 1569 CB LEU A 98 -0.280 3.563 11.192 1.00 33.22 C ATOM 1570 CG LEU A 98 -1.091 3.757 9.897 1.00 40.42 C ATOM 1571 CD1 LEU A 98 -2.220 4.763 10.100 1.00 63.13 C ATOM 1572 CD2 LEU A 98 -0.179 4.212 8.759 1.00 54.53 C ATOM 0 H LEU A 98 0.794 3.266 13.379 1.00 71.42 H new ATOM 0 HA LEU A 98 -1.846 3.912 12.634 1.00 1.25 H new ATOM 0 HB2 LEU A 98 0.246 4.493 11.409 1.00 33.22 H new ATOM 0 HB3 LEU A 98 0.479 2.802 11.010 1.00 33.22 H new ATOM 0 HG LEU A 98 -1.534 2.797 9.633 1.00 40.42 H new ATOM 0 HD11 LEU A 98 -2.775 4.880 9.169 1.00 63.13 H new ATOM 0 HD12 LEU A 98 -2.891 4.404 10.880 1.00 63.13 H new ATOM 0 HD13 LEU A 98 -1.801 5.725 10.396 1.00 63.13 H new ATOM 0 HD21 LEU A 98 -0.768 4.344 7.851 1.00 54.53 H new ATOM 0 HD22 LEU A 98 0.293 5.158 9.027 1.00 54.53 H new ATOM 0 HD23 LEU A 98 0.590 3.459 8.586 1.00 54.53 H new ATOM 1584 N GLN A 99 -3.044 1.907 11.725 1.00 75.25 N ATOM 1585 CA GLN A 99 -3.921 0.743 11.582 1.00 32.23 C ATOM 1586 C GLN A 99 -3.537 -0.149 10.386 1.00 43.24 C ATOM 1587 O GLN A 99 -2.519 0.062 9.728 1.00 10.33 O ATOM 1588 CB GLN A 99 -5.369 1.219 11.430 1.00 33.23 C ATOM 1589 CG GLN A 99 -5.622 2.013 10.151 1.00 73.13 C ATOM 1590 CD GLN A 99 -7.042 2.546 10.044 1.00 65.34 C ATOM 1591 OE1 GLN A 99 -7.285 3.574 9.422 1.00 51.24 O ATOM 1592 NE2 GLN A 99 -7.996 1.855 10.642 1.00 55.43 N ATOM 0 H GLN A 99 -3.459 2.781 11.403 1.00 75.25 H new ATOM 0 HA GLN A 99 -3.809 0.135 12.480 1.00 32.23 H new ATOM 0 HB2 GLN A 99 -6.031 0.353 11.447 1.00 33.23 H new ATOM 0 HB3 GLN A 99 -5.631 1.837 12.289 1.00 33.23 H new ATOM 0 HG2 GLN A 99 -4.924 2.849 10.106 1.00 73.13 H new ATOM 0 HG3 GLN A 99 -5.414 1.378 9.290 1.00 73.13 H new ATOM 0 HE21 GLN A 99 -7.765 1.003 11.153 1.00 55.43 H new ATOM 0 HE22 GLN A 99 -8.964 2.174 10.593 1.00 55.43 H new ATOM 1601 N GLU A 100 -4.377 -1.149 10.116 1.00 34.21 N ATOM 1602 CA GLU A 100 -4.156 -2.085 9.009 1.00 54.54 C ATOM 1603 C GLU A 100 -4.879 -1.627 7.728 1.00 63.32 C ATOM 1604 O GLU A 100 -5.885 -0.910 7.781 1.00 60.54 O ATOM 1605 CB GLU A 100 -4.658 -3.482 9.407 1.00 63.53 C ATOM 1606 CG GLU A 100 -6.154 -3.520 9.706 1.00 63.30 C ATOM 1607 CD GLU A 100 -6.658 -4.900 10.091 1.00 21.31 C ATOM 1608 OE1 GLU A 100 -6.549 -5.273 11.276 1.00 61.54 O ATOM 1609 OE2 GLU A 100 -7.181 -5.615 9.212 1.00 52.03 O ATOM 0 H GLU A 100 -5.224 -1.334 10.653 1.00 34.21 H new ATOM 0 HA GLU A 100 -3.086 -2.115 8.803 1.00 54.54 H new ATOM 0 HB2 GLU A 100 -4.437 -4.183 8.603 1.00 63.53 H new ATOM 0 HB3 GLU A 100 -4.110 -3.822 10.286 1.00 63.53 H new ATOM 0 HG2 GLU A 100 -6.373 -2.823 10.515 1.00 63.30 H new ATOM 0 HG3 GLU A 100 -6.701 -3.173 8.829 1.00 63.30 H new ATOM 1616 N ILE A 101 -4.355 -2.036 6.578 1.00 31.33 N ATOM 1617 CA ILE A 101 -5.026 -1.801 5.296 1.00 73.44 C ATOM 1618 C ILE A 101 -5.510 -3.131 4.693 1.00 73.42 C ATOM 1619 O ILE A 101 -4.707 -4.012 4.382 1.00 34.24 O ATOM 1620 CB ILE A 101 -4.098 -1.078 4.286 1.00 71.22 C ATOM 1621 CG1 ILE A 101 -3.588 0.245 4.884 1.00 34.31 C ATOM 1622 CG2 ILE A 101 -4.826 -0.825 2.962 1.00 72.32 C ATOM 1623 CD1 ILE A 101 -2.683 1.033 3.959 1.00 75.24 C ATOM 0 H ILE A 101 -3.467 -2.533 6.503 1.00 31.33 H new ATOM 0 HA ILE A 101 -5.883 -1.156 5.491 1.00 73.44 H new ATOM 0 HB ILE A 101 -3.242 -1.722 4.083 1.00 71.22 H new ATOM 0 HG12 ILE A 101 -4.444 0.864 5.152 1.00 34.31 H new ATOM 0 HG13 ILE A 101 -3.049 0.030 5.807 1.00 34.31 H new ATOM 0 HG21 ILE A 101 -4.155 -0.317 2.269 1.00 72.32 H new ATOM 0 HG22 ILE A 101 -5.140 -1.776 2.532 1.00 72.32 H new ATOM 0 HG23 ILE A 101 -5.702 -0.202 3.142 1.00 72.32 H new ATOM 0 HD11 ILE A 101 -2.367 1.951 4.454 1.00 75.24 H new ATOM 0 HD12 ILE A 101 -1.807 0.434 3.711 1.00 75.24 H new ATOM 0 HD13 ILE A 101 -3.224 1.281 3.046 1.00 75.24 H new ATOM 1635 N ARG A 102 -6.829 -3.275 4.552 1.00 53.14 N ATOM 1636 CA ARG A 102 -7.429 -4.514 4.041 1.00 35.51 C ATOM 1637 C ARG A 102 -7.735 -4.397 2.540 1.00 3.34 C ATOM 1638 O ARG A 102 -8.727 -3.773 2.153 1.00 41.11 O ATOM 1639 CB ARG A 102 -8.735 -4.814 4.793 1.00 2.32 C ATOM 1640 CG ARG A 102 -8.667 -4.575 6.298 1.00 12.25 C ATOM 1641 CD ARG A 102 -10.058 -4.635 6.930 1.00 10.43 C ATOM 1642 NE ARG A 102 -11.025 -3.821 6.184 1.00 54.42 N ATOM 1643 CZ ARG A 102 -11.779 -2.889 6.704 1.00 73.34 C ATOM 1644 NH1 ARG A 102 -11.746 -2.631 7.971 1.00 40.42 N ATOM 1645 NH2 ARG A 102 -12.582 -2.218 5.948 1.00 55.33 N ATOM 0 H ARG A 102 -7.506 -2.548 4.785 1.00 53.14 H new ATOM 0 HA ARG A 102 -6.715 -5.322 4.197 1.00 35.51 H new ATOM 0 HB2 ARG A 102 -9.530 -4.196 4.375 1.00 2.32 H new ATOM 0 HB3 ARG A 102 -9.012 -5.853 4.615 1.00 2.32 H new ATOM 0 HG2 ARG A 102 -8.022 -5.323 6.759 1.00 12.25 H new ATOM 0 HG3 ARG A 102 -8.217 -3.602 6.495 1.00 12.25 H new ATOM 0 HD2 ARG A 102 -10.400 -5.670 6.962 1.00 10.43 H new ATOM 0 HD3 ARG A 102 -10.005 -4.285 7.961 1.00 10.43 H new ATOM 0 HE ARG A 102 -11.115 -3.996 5.183 1.00 54.42 H new ATOM 0 HH11 ARG A 102 -11.124 -3.159 8.583 1.00 40.42 H new ATOM 0 HH12 ARG A 102 -12.342 -1.900 8.358 1.00 40.42 H new ATOM 0 HH21 ARG A 102 -12.626 -2.416 4.948 1.00 55.33 H new ATOM 0 HH22 ARG A 102 -13.172 -1.490 6.350 1.00 55.33 H new ATOM 1659 N LEU A 103 -6.892 -4.987 1.698 1.00 33.25 N ATOM 1660 CA LEU A 103 -7.109 -4.949 0.246 1.00 10.44 C ATOM 1661 C LEU A 103 -7.167 -6.361 -0.354 1.00 43.32 C ATOM 1662 O LEU A 103 -6.165 -7.073 -0.389 1.00 64.10 O ATOM 1663 CB LEU A 103 -6.003 -4.133 -0.440 1.00 13.01 C ATOM 1664 CG LEU A 103 -5.952 -2.645 -0.053 1.00 15.43 C ATOM 1665 CD1 LEU A 103 -4.834 -1.927 -0.802 1.00 34.33 C ATOM 1666 CD2 LEU A 103 -7.296 -1.970 -0.313 1.00 42.32 C ATOM 0 H LEU A 103 -6.056 -5.495 1.988 1.00 33.25 H new ATOM 0 HA LEU A 103 -8.071 -4.468 0.071 1.00 10.44 H new ATOM 0 HB2 LEU A 103 -5.040 -4.586 -0.205 1.00 13.01 H new ATOM 0 HB3 LEU A 103 -6.135 -4.207 -1.519 1.00 13.01 H new ATOM 0 HG LEU A 103 -5.741 -2.582 1.014 1.00 15.43 H new ATOM 0 HD11 LEU A 103 -4.818 -0.876 -0.512 1.00 34.33 H new ATOM 0 HD12 LEU A 103 -3.877 -2.386 -0.555 1.00 34.33 H new ATOM 0 HD13 LEU A 103 -5.007 -2.004 -1.875 1.00 34.33 H new ATOM 0 HD21 LEU A 103 -7.236 -0.919 -0.032 1.00 42.32 H new ATOM 0 HD22 LEU A 103 -7.544 -2.049 -1.371 1.00 42.32 H new ATOM 0 HD23 LEU A 103 -8.070 -2.460 0.278 1.00 42.32 H new ATOM 1678 N THR A 104 -8.352 -6.767 -0.808 1.00 21.33 N ATOM 1679 CA THR A 104 -8.530 -8.061 -1.485 1.00 5.54 C ATOM 1680 C THR A 104 -9.179 -7.880 -2.863 1.00 21.22 C ATOM 1681 O THR A 104 -10.323 -7.426 -2.976 1.00 72.11 O ATOM 1682 CB THR A 104 -9.383 -9.050 -0.645 1.00 32.21 C ATOM 1683 OG1 THR A 104 -10.649 -8.465 -0.303 1.00 2.41 O ATOM 1684 CG2 THR A 104 -8.651 -9.461 0.627 1.00 62.24 C ATOM 0 H THR A 104 -9.209 -6.220 -0.721 1.00 21.33 H new ATOM 0 HA THR A 104 -7.532 -8.484 -1.605 1.00 5.54 H new ATOM 0 HB THR A 104 -9.553 -9.938 -1.254 1.00 32.21 H new ATOM 0 HG1 THR A 104 -11.004 -7.979 -1.076 1.00 2.41 H new ATOM 0 HG21 THR A 104 -9.271 -10.154 1.196 1.00 62.24 H new ATOM 0 HG22 THR A 104 -7.711 -9.947 0.365 1.00 62.24 H new ATOM 0 HG23 THR A 104 -8.447 -8.577 1.231 1.00 62.24 H new ATOM 1692 N ARG A 105 -8.436 -8.219 -3.914 1.00 12.03 N ATOM 1693 CA ARG A 105 -8.932 -8.092 -5.291 1.00 72.31 C ATOM 1694 C ARG A 105 -9.458 -9.436 -5.821 1.00 74.34 C ATOM 1695 O ARG A 105 -8.990 -10.500 -5.416 1.00 4.24 O ATOM 1696 CB ARG A 105 -7.821 -7.564 -6.214 1.00 72.41 C ATOM 1697 CG ARG A 105 -7.216 -6.230 -5.775 1.00 30.22 C ATOM 1698 CD ARG A 105 -8.270 -5.134 -5.630 1.00 31.34 C ATOM 1699 NE ARG A 105 -9.069 -4.966 -6.846 1.00 3.01 N ATOM 1700 CZ ARG A 105 -9.305 -3.815 -7.422 1.00 23.33 C ATOM 1701 NH1 ARG A 105 -8.793 -2.722 -6.954 1.00 13.03 N ATOM 1702 NH2 ARG A 105 -10.060 -3.760 -8.469 1.00 62.31 N ATOM 0 H ARG A 105 -7.486 -8.585 -3.843 1.00 12.03 H new ATOM 0 HA ARG A 105 -9.758 -7.381 -5.282 1.00 72.31 H new ATOM 0 HB2 ARG A 105 -7.027 -8.309 -6.269 1.00 72.41 H new ATOM 0 HB3 ARG A 105 -8.224 -7.453 -7.221 1.00 72.41 H new ATOM 0 HG2 ARG A 105 -6.701 -6.363 -4.824 1.00 30.22 H new ATOM 0 HG3 ARG A 105 -6.467 -5.917 -6.502 1.00 30.22 H new ATOM 0 HD2 ARG A 105 -8.929 -5.375 -4.796 1.00 31.34 H new ATOM 0 HD3 ARG A 105 -7.780 -4.191 -5.387 1.00 31.34 H new ATOM 0 HE ARG A 105 -9.468 -5.802 -7.272 1.00 3.01 H new ATOM 0 HH11 ARG A 105 -8.197 -2.751 -6.126 1.00 13.03 H new ATOM 0 HH12 ARG A 105 -8.985 -1.832 -7.413 1.00 13.03 H new ATOM 0 HH21 ARG A 105 -10.472 -4.614 -8.846 1.00 62.31 H new ATOM 0 HH22 ARG A 105 -10.244 -2.863 -8.918 1.00 62.31 H new ATOM 1716 N ILE A 106 -10.427 -9.380 -6.732 1.00 12.01 N ATOM 1717 CA ILE A 106 -11.041 -10.592 -7.286 1.00 14.11 C ATOM 1718 C ILE A 106 -10.400 -10.978 -8.632 1.00 62.40 C ATOM 1719 O ILE A 106 -10.585 -10.293 -9.638 1.00 34.15 O ATOM 1720 CB ILE A 106 -12.568 -10.404 -7.483 1.00 62.11 C ATOM 1721 CG1 ILE A 106 -13.225 -9.884 -6.190 1.00 12.02 C ATOM 1722 CG2 ILE A 106 -13.220 -11.712 -7.929 1.00 30.10 C ATOM 1723 CD1 ILE A 106 -13.050 -10.796 -4.991 1.00 30.24 C ATOM 0 H ILE A 106 -10.806 -8.510 -7.105 1.00 12.01 H new ATOM 0 HA ILE A 106 -10.869 -11.394 -6.568 1.00 14.11 H new ATOM 0 HB ILE A 106 -12.721 -9.661 -8.266 1.00 62.11 H new ATOM 0 HG12 ILE A 106 -12.807 -8.906 -5.952 1.00 12.02 H new ATOM 0 HG13 ILE A 106 -14.290 -9.740 -6.370 1.00 12.02 H new ATOM 0 HG21 ILE A 106 -14.291 -11.558 -8.061 1.00 30.10 H new ATOM 0 HG22 ILE A 106 -12.780 -12.034 -8.873 1.00 30.10 H new ATOM 0 HG23 ILE A 106 -13.054 -12.478 -7.171 1.00 30.10 H new ATOM 0 HD11 ILE A 106 -13.542 -10.356 -4.124 1.00 30.24 H new ATOM 0 HD12 ILE A 106 -13.494 -11.768 -5.205 1.00 30.24 H new ATOM 0 HD13 ILE A 106 -11.988 -10.921 -4.781 1.00 30.24 H new ATOM 1735 N LEU A 107 -9.640 -12.070 -8.637 1.00 74.24 N ATOM 1736 CA LEU A 107 -8.967 -12.556 -9.854 1.00 2.55 C ATOM 1737 C LEU A 107 -9.828 -13.622 -10.568 1.00 62.44 C ATOM 1738 O LEU A 107 -9.916 -14.759 -10.108 1.00 31.34 O ATOM 1739 CB LEU A 107 -7.591 -13.143 -9.466 1.00 25.41 C ATOM 1740 CG LEU A 107 -6.545 -13.327 -10.591 1.00 54.43 C ATOM 1741 CD1 LEU A 107 -6.988 -14.352 -11.634 1.00 23.53 C ATOM 1742 CD2 LEU A 107 -6.221 -11.989 -11.246 1.00 51.15 C ATOM 0 H LEU A 107 -9.470 -12.643 -7.810 1.00 74.24 H new ATOM 0 HA LEU A 107 -8.828 -11.725 -10.545 1.00 2.55 H new ATOM 0 HB2 LEU A 107 -7.154 -12.498 -8.704 1.00 25.41 H new ATOM 0 HB3 LEU A 107 -7.760 -14.115 -9.002 1.00 25.41 H new ATOM 0 HG LEU A 107 -5.639 -13.719 -10.128 1.00 54.43 H new ATOM 0 HD11 LEU A 107 -6.220 -14.445 -12.402 1.00 23.53 H new ATOM 0 HD12 LEU A 107 -7.139 -15.318 -11.153 1.00 23.53 H new ATOM 0 HD13 LEU A 107 -7.921 -14.025 -12.092 1.00 23.53 H new ATOM 0 HD21 LEU A 107 -5.484 -12.139 -12.035 1.00 51.15 H new ATOM 0 HD22 LEU A 107 -7.129 -11.564 -11.674 1.00 51.15 H new ATOM 0 HD23 LEU A 107 -5.818 -11.306 -10.498 1.00 51.15 H new ATOM 1754 N PRO A 108 -10.477 -13.276 -11.699 1.00 11.33 N ATOM 1755 CA PRO A 108 -11.287 -14.241 -12.467 1.00 41.44 C ATOM 1756 C PRO A 108 -10.422 -15.266 -13.230 1.00 10.53 C ATOM 1757 O PRO A 108 -9.686 -14.911 -14.157 1.00 13.25 O ATOM 1758 CB PRO A 108 -12.069 -13.344 -13.439 1.00 3.35 C ATOM 1759 CG PRO A 108 -11.198 -12.147 -13.630 1.00 13.31 C ATOM 1760 CD PRO A 108 -10.489 -11.931 -12.315 1.00 41.13 C ATOM 0 HA PRO A 108 -11.924 -14.849 -11.824 1.00 41.44 H new ATOM 0 HB2 PRO A 108 -12.256 -13.853 -14.385 1.00 3.35 H new ATOM 0 HB3 PRO A 108 -13.040 -13.066 -13.029 1.00 3.35 H new ATOM 0 HG2 PRO A 108 -10.483 -12.310 -14.436 1.00 13.31 H new ATOM 0 HG3 PRO A 108 -11.790 -11.273 -13.901 1.00 13.31 H new ATOM 0 HD2 PRO A 108 -9.479 -11.549 -12.463 1.00 41.13 H new ATOM 0 HD3 PRO A 108 -11.015 -11.209 -11.690 1.00 41.13 H new ATOM 1768 N PHE A 109 -10.505 -16.537 -12.834 1.00 0.54 N ATOM 1769 CA PHE A 109 -9.691 -17.595 -13.443 1.00 75.33 C ATOM 1770 C PHE A 109 -10.272 -18.051 -14.795 1.00 64.04 C ATOM 1771 O PHE A 109 -11.338 -18.666 -14.854 1.00 43.11 O ATOM 1772 CB PHE A 109 -9.577 -18.788 -12.485 1.00 63.44 C ATOM 1773 CG PHE A 109 -8.585 -19.835 -12.927 1.00 12.52 C ATOM 1774 CD1 PHE A 109 -7.243 -19.715 -12.597 1.00 23.12 C ATOM 1775 CD2 PHE A 109 -8.992 -20.937 -13.666 1.00 35.13 C ATOM 1776 CE1 PHE A 109 -6.329 -20.669 -13.002 1.00 12.15 C ATOM 1777 CE2 PHE A 109 -8.082 -21.892 -14.072 1.00 73.50 C ATOM 1778 CZ PHE A 109 -6.750 -21.759 -13.737 1.00 2.33 C ATOM 0 H PHE A 109 -11.128 -16.861 -12.094 1.00 0.54 H new ATOM 0 HA PHE A 109 -8.698 -17.187 -13.630 1.00 75.33 H new ATOM 0 HB2 PHE A 109 -9.290 -18.423 -11.499 1.00 63.44 H new ATOM 0 HB3 PHE A 109 -10.558 -19.252 -12.380 1.00 63.44 H new ATOM 0 HD1 PHE A 109 -6.909 -18.867 -12.017 1.00 23.12 H new ATOM 0 HD2 PHE A 109 -10.034 -21.049 -13.927 1.00 35.13 H new ATOM 0 HE1 PHE A 109 -5.286 -20.562 -12.744 1.00 12.15 H new ATOM 0 HE2 PHE A 109 -8.412 -22.742 -14.651 1.00 73.50 H new ATOM 0 HZ PHE A 109 -6.037 -22.508 -14.050 1.00 2.33 H new ATOM 1788 N LEU A 110 -9.551 -17.750 -15.874 1.00 30.34 N ATOM 1789 CA LEU A 110 -9.978 -18.097 -17.238 1.00 3.35 C ATOM 1790 C LEU A 110 -8.830 -18.766 -18.012 1.00 31.13 C ATOM 1791 O LEU A 110 -7.697 -18.289 -17.982 1.00 41.12 O ATOM 1792 CB LEU A 110 -10.437 -16.832 -17.981 1.00 14.34 C ATOM 1793 CG LEU A 110 -11.607 -16.071 -17.332 1.00 12.31 C ATOM 1794 CD1 LEU A 110 -11.867 -14.752 -18.058 1.00 41.31 C ATOM 1795 CD2 LEU A 110 -12.868 -16.934 -17.314 1.00 73.42 C ATOM 0 H LEU A 110 -8.657 -17.261 -15.833 1.00 30.34 H new ATOM 0 HA LEU A 110 -10.809 -18.799 -17.171 1.00 3.35 H new ATOM 0 HB2 LEU A 110 -9.588 -16.154 -18.067 1.00 14.34 H new ATOM 0 HB3 LEU A 110 -10.725 -17.111 -18.994 1.00 14.34 H new ATOM 0 HG LEU A 110 -11.333 -15.843 -16.302 1.00 12.31 H new ATOM 0 HD11 LEU A 110 -12.698 -14.232 -17.581 1.00 41.31 H new ATOM 0 HD12 LEU A 110 -10.974 -14.129 -18.011 1.00 41.31 H new ATOM 0 HD13 LEU A 110 -12.115 -14.953 -19.100 1.00 41.31 H new ATOM 0 HD21 LEU A 110 -13.683 -16.378 -16.851 1.00 73.42 H new ATOM 0 HD22 LEU A 110 -13.143 -17.198 -18.335 1.00 73.42 H new ATOM 0 HD23 LEU A 110 -12.679 -17.843 -16.743 1.00 73.42 H new ATOM 1807 N ASP A 111 -9.130 -19.859 -18.709 1.00 54.24 N ATOM 1808 CA ASP A 111 -8.106 -20.624 -19.437 1.00 63.10 C ATOM 1809 C ASP A 111 -7.890 -20.082 -20.862 1.00 1.04 C ATOM 1810 O ASP A 111 -6.757 -19.975 -21.339 1.00 71.32 O ATOM 1811 CB ASP A 111 -8.511 -22.102 -19.506 1.00 33.44 C ATOM 1812 CG ASP A 111 -8.908 -22.654 -18.150 1.00 4.02 C ATOM 1813 OD1 ASP A 111 -10.079 -22.475 -17.756 1.00 55.42 O ATOM 1814 OD2 ASP A 111 -8.057 -23.271 -17.472 1.00 51.30 O ATOM 0 H ASP A 111 -10.073 -20.240 -18.789 1.00 54.24 H new ATOM 0 HA ASP A 111 -7.167 -20.519 -18.893 1.00 63.10 H new ATOM 0 HB2 ASP A 111 -9.344 -22.216 -20.200 1.00 33.44 H new ATOM 0 HB3 ASP A 111 -7.681 -22.686 -19.905 1.00 33.44 H new ATOM 1819 N ALA A 112 -8.986 -19.750 -21.542 1.00 4.42 N ATOM 1820 CA ALA A 112 -8.925 -19.277 -22.930 1.00 53.21 C ATOM 1821 C ALA A 112 -8.467 -17.813 -23.029 1.00 52.25 C ATOM 1822 O ALA A 112 -7.746 -17.436 -23.957 1.00 63.31 O ATOM 1823 CB ALA A 112 -10.286 -19.449 -23.596 1.00 65.52 C ATOM 0 H ALA A 112 -9.929 -19.799 -21.157 1.00 4.42 H new ATOM 0 HA ALA A 112 -8.182 -19.882 -23.450 1.00 53.21 H new ATOM 0 HB1 ALA A 112 -10.234 -19.096 -24.626 1.00 65.52 H new ATOM 0 HB2 ALA A 112 -10.565 -20.503 -23.587 1.00 65.52 H new ATOM 0 HB3 ALA A 112 -11.033 -18.871 -23.052 1.00 65.52 H new ATOM 1829 N GLN A 113 -8.883 -16.991 -22.069 1.00 74.21 N ATOM 1830 CA GLN A 113 -8.582 -15.555 -22.096 1.00 3.33 C ATOM 1831 C GLN A 113 -7.158 -15.253 -21.603 1.00 42.21 C ATOM 1832 O GLN A 113 -6.961 -14.733 -20.501 1.00 24.21 O ATOM 1833 CB GLN A 113 -9.613 -14.783 -21.263 1.00 4.43 C ATOM 1834 CG GLN A 113 -11.043 -14.951 -21.762 1.00 65.55 C ATOM 1835 CD GLN A 113 -11.239 -14.430 -23.177 1.00 4.33 C ATOM 1836 OE1 GLN A 113 -10.601 -13.467 -23.598 1.00 4.13 O ATOM 1837 NE2 GLN A 113 -12.107 -15.074 -23.927 1.00 35.41 N ATOM 0 H GLN A 113 -9.429 -17.291 -21.262 1.00 74.21 H new ATOM 0 HA GLN A 113 -8.640 -15.227 -23.134 1.00 3.33 H new ATOM 0 HB2 GLN A 113 -9.556 -15.117 -20.227 1.00 4.43 H new ATOM 0 HB3 GLN A 113 -9.356 -13.724 -21.271 1.00 4.43 H new ATOM 0 HG2 GLN A 113 -11.313 -16.006 -21.728 1.00 65.55 H new ATOM 0 HG3 GLN A 113 -11.722 -14.426 -21.089 1.00 65.55 H new ATOM 0 HE21 GLN A 113 -12.619 -15.869 -23.546 1.00 35.41 H new ATOM 0 HE22 GLN A 113 -12.268 -14.778 -24.890 1.00 35.41 H new ATOM 1846 N GLU A 114 -6.168 -15.588 -22.427 1.00 73.41 N ATOM 1847 CA GLU A 114 -4.761 -15.320 -22.104 1.00 41.22 C ATOM 1848 C GLU A 114 -4.489 -13.810 -21.974 1.00 42.33 C ATOM 1849 O GLU A 114 -3.680 -13.384 -21.144 1.00 52.40 O ATOM 1850 CB GLU A 114 -3.845 -15.936 -23.171 1.00 10.50 C ATOM 1851 CG GLU A 114 -4.107 -15.415 -24.579 1.00 34.33 C ATOM 1852 CD GLU A 114 -3.177 -16.017 -25.617 1.00 3.22 C ATOM 1853 OE1 GLU A 114 -3.478 -17.115 -26.126 1.00 55.32 O ATOM 1854 OE2 GLU A 114 -2.144 -15.390 -25.931 1.00 50.23 O ATOM 0 H GLU A 114 -6.311 -16.047 -23.327 1.00 73.41 H new ATOM 0 HA GLU A 114 -4.546 -15.781 -21.140 1.00 41.22 H new ATOM 0 HB2 GLU A 114 -2.807 -15.735 -22.906 1.00 10.50 H new ATOM 0 HB3 GLU A 114 -3.971 -17.019 -23.164 1.00 10.50 H new ATOM 0 HG2 GLU A 114 -5.139 -15.632 -24.855 1.00 34.33 H new ATOM 0 HG3 GLU A 114 -3.997 -14.331 -24.586 1.00 34.33 H new ATOM 1861 N LEU A 115 -5.166 -13.005 -22.799 1.00 15.35 N ATOM 1862 CA LEU A 115 -5.080 -11.540 -22.694 1.00 3.11 C ATOM 1863 C LEU A 115 -5.501 -11.076 -21.294 1.00 53.40 C ATOM 1864 O LEU A 115 -4.753 -10.384 -20.604 1.00 64.44 O ATOM 1865 CB LEU A 115 -5.959 -10.846 -23.754 1.00 72.13 C ATOM 1866 CG LEU A 115 -5.446 -10.901 -25.205 1.00 74.53 C ATOM 1867 CD1 LEU A 115 -4.012 -10.388 -25.292 1.00 35.31 C ATOM 1868 CD2 LEU A 115 -5.557 -12.310 -25.780 1.00 54.30 C ATOM 0 H LEU A 115 -5.777 -13.338 -23.544 1.00 15.35 H new ATOM 0 HA LEU A 115 -4.041 -11.260 -22.871 1.00 3.11 H new ATOM 0 HB2 LEU A 115 -6.951 -11.296 -23.724 1.00 72.13 H new ATOM 0 HB3 LEU A 115 -6.075 -9.800 -23.471 1.00 72.13 H new ATOM 0 HG LEU A 115 -6.078 -10.248 -25.807 1.00 74.53 H new ATOM 0 HD11 LEU A 115 -3.670 -10.436 -26.326 1.00 35.31 H new ATOM 0 HD12 LEU A 115 -3.973 -9.356 -24.945 1.00 35.31 H new ATOM 0 HD13 LEU A 115 -3.366 -11.005 -24.668 1.00 35.31 H new ATOM 0 HD21 LEU A 115 -5.187 -12.315 -26.805 1.00 54.30 H new ATOM 0 HD22 LEU A 115 -4.964 -12.997 -25.177 1.00 54.30 H new ATOM 0 HD23 LEU A 115 -6.600 -12.626 -25.769 1.00 54.30 H new ATOM 1880 N ALA A 116 -6.700 -11.483 -20.880 1.00 51.42 N ATOM 1881 CA ALA A 116 -7.209 -11.175 -19.542 1.00 52.32 C ATOM 1882 C ALA A 116 -6.221 -11.611 -18.446 1.00 43.43 C ATOM 1883 O ALA A 116 -5.970 -10.882 -17.488 1.00 51.24 O ATOM 1884 CB ALA A 116 -8.563 -11.843 -19.339 1.00 53.14 C ATOM 0 H ALA A 116 -7.341 -12.030 -21.455 1.00 51.42 H new ATOM 0 HA ALA A 116 -7.326 -10.094 -19.463 1.00 52.32 H new ATOM 0 HB1 ALA A 116 -8.937 -11.611 -18.342 1.00 53.14 H new ATOM 0 HB2 ALA A 116 -9.266 -11.474 -20.086 1.00 53.14 H new ATOM 0 HB3 ALA A 116 -8.455 -12.923 -19.444 1.00 53.14 H new ATOM 1890 N LYS A 117 -5.652 -12.805 -18.592 1.00 41.31 N ATOM 1891 CA LYS A 117 -4.672 -13.315 -17.622 1.00 64.50 C ATOM 1892 C LYS A 117 -3.393 -12.463 -17.592 1.00 11.35 C ATOM 1893 O LYS A 117 -2.714 -12.382 -16.568 1.00 54.23 O ATOM 1894 CB LYS A 117 -4.350 -14.782 -17.918 1.00 63.34 C ATOM 1895 CG LYS A 117 -5.549 -15.723 -17.761 1.00 2.44 C ATOM 1896 CD LYS A 117 -6.039 -15.836 -16.304 1.00 43.04 C ATOM 1897 CE LYS A 117 -7.339 -15.062 -16.038 1.00 74.03 C ATOM 1898 NZ LYS A 117 -7.146 -13.587 -16.039 1.00 0.35 N ATOM 0 H LYS A 117 -5.848 -13.439 -19.367 1.00 41.31 H new ATOM 0 HA LYS A 117 -5.119 -13.247 -16.630 1.00 64.50 H new ATOM 0 HB2 LYS A 117 -3.968 -14.862 -18.936 1.00 63.34 H new ATOM 0 HB3 LYS A 117 -3.553 -15.111 -17.252 1.00 63.34 H new ATOM 0 HG2 LYS A 117 -6.367 -15.368 -18.387 1.00 2.44 H new ATOM 0 HG3 LYS A 117 -5.276 -16.714 -18.125 1.00 2.44 H new ATOM 0 HD2 LYS A 117 -6.194 -16.887 -16.061 1.00 43.04 H new ATOM 0 HD3 LYS A 117 -5.261 -15.466 -15.637 1.00 43.04 H new ATOM 0 HE2 LYS A 117 -8.075 -15.327 -16.797 1.00 74.03 H new ATOM 0 HE3 LYS A 117 -7.748 -15.369 -15.075 1.00 74.03 H new ATOM 0 HZ1 LYS A 117 -7.976 -13.128 -15.612 1.00 0.35 H new ATOM 0 HZ2 LYS A 117 -6.296 -13.348 -15.489 1.00 0.35 H new ATOM 0 HZ3 LYS A 117 -7.031 -13.253 -17.017 1.00 0.35 H new ATOM 1912 N ALA A 118 -3.074 -11.821 -18.710 1.00 24.54 N ATOM 1913 CA ALA A 118 -1.951 -10.877 -18.767 1.00 51.11 C ATOM 1914 C ALA A 118 -2.398 -9.453 -18.388 1.00 61.55 C ATOM 1915 O ALA A 118 -1.596 -8.519 -18.382 1.00 55.43 O ATOM 1916 CB ALA A 118 -1.329 -10.886 -20.159 1.00 75.22 C ATOM 0 H ALA A 118 -3.574 -11.933 -19.592 1.00 24.54 H new ATOM 0 HA ALA A 118 -1.203 -11.196 -18.041 1.00 51.11 H new ATOM 0 HB1 ALA A 118 -0.497 -10.182 -20.190 1.00 75.22 H new ATOM 0 HB2 ALA A 118 -0.966 -11.888 -20.389 1.00 75.22 H new ATOM 0 HB3 ALA A 118 -2.079 -10.594 -20.894 1.00 75.22 H new ATOM 1922 N ALA A 119 -3.685 -9.301 -18.072 1.00 23.24 N ATOM 1923 CA ALA A 119 -4.264 -7.998 -17.720 1.00 55.34 C ATOM 1924 C ALA A 119 -4.556 -7.878 -16.212 1.00 61.12 C ATOM 1925 O ALA A 119 -3.985 -7.025 -15.533 1.00 61.02 O ATOM 1926 CB ALA A 119 -5.542 -7.761 -18.521 1.00 75.00 C ATOM 0 H ALA A 119 -4.354 -10.071 -18.052 1.00 23.24 H new ATOM 0 HA ALA A 119 -3.527 -7.235 -17.970 1.00 55.34 H new ATOM 0 HB1 ALA A 119 -5.965 -6.793 -18.254 1.00 75.00 H new ATOM 0 HB2 ALA A 119 -5.312 -7.775 -19.586 1.00 75.00 H new ATOM 0 HB3 ALA A 119 -6.264 -8.546 -18.296 1.00 75.00 H new ATOM 1932 N GLU A 120 -5.447 -8.735 -15.693 1.00 11.04 N ATOM 1933 CA GLU A 120 -5.872 -8.669 -14.278 1.00 4.50 C ATOM 1934 C GLU A 120 -4.692 -8.575 -13.291 1.00 14.13 C ATOM 1935 O GLU A 120 -4.646 -7.666 -12.462 1.00 75.22 O ATOM 1936 CB GLU A 120 -6.750 -9.874 -13.894 1.00 11.23 C ATOM 1937 CG GLU A 120 -8.202 -9.788 -14.359 1.00 44.20 C ATOM 1938 CD GLU A 120 -8.390 -10.145 -15.821 1.00 24.41 C ATOM 1939 OE1 GLU A 120 -8.490 -11.354 -16.127 1.00 10.51 O ATOM 1940 OE2 GLU A 120 -8.450 -9.225 -16.667 1.00 21.42 O ATOM 0 H GLU A 120 -5.890 -9.483 -16.227 1.00 11.04 H new ATOM 0 HA GLU A 120 -6.451 -7.749 -14.198 1.00 4.50 H new ATOM 0 HB2 GLU A 120 -6.304 -10.777 -14.310 1.00 11.23 H new ATOM 0 HB3 GLU A 120 -6.737 -9.983 -12.810 1.00 11.23 H new ATOM 0 HG2 GLU A 120 -8.811 -10.455 -13.749 1.00 44.20 H new ATOM 0 HG3 GLU A 120 -8.570 -8.776 -14.190 1.00 44.20 H new ATOM 1947 N GLU A 121 -3.742 -9.510 -13.378 1.00 34.41 N ATOM 1948 CA GLU A 121 -2.603 -9.549 -12.438 1.00 23.43 C ATOM 1949 C GLU A 121 -1.716 -8.287 -12.510 1.00 12.51 C ATOM 1950 O GLU A 121 -0.796 -8.127 -11.705 1.00 62.02 O ATOM 1951 CB GLU A 121 -1.760 -10.819 -12.656 1.00 31.10 C ATOM 1952 CG GLU A 121 -2.159 -11.989 -11.752 1.00 1.14 C ATOM 1953 CD GLU A 121 -1.822 -11.744 -10.280 1.00 21.34 C ATOM 1954 OE1 GLU A 121 -0.640 -11.906 -9.903 1.00 72.40 O ATOM 1955 OE2 GLU A 121 -2.728 -11.396 -9.493 1.00 11.31 O ATOM 0 H GLU A 121 -3.732 -10.248 -14.082 1.00 34.41 H new ATOM 0 HA GLU A 121 -3.030 -9.572 -11.435 1.00 23.43 H new ATOM 0 HB2 GLU A 121 -1.850 -11.129 -13.697 1.00 31.10 H new ATOM 0 HB3 GLU A 121 -0.710 -10.581 -12.484 1.00 31.10 H new ATOM 0 HG2 GLU A 121 -3.230 -12.169 -11.850 1.00 1.14 H new ATOM 0 HG3 GLU A 121 -1.652 -12.893 -12.090 1.00 1.14 H new ATOM 1962 N GLU A 122 -1.980 -7.405 -13.474 1.00 0.10 N ATOM 1963 CA GLU A 122 -1.354 -6.078 -13.489 1.00 0.33 C ATOM 1964 C GLU A 122 -2.360 -5.015 -13.027 1.00 23.42 C ATOM 1965 O GLU A 122 -2.101 -4.274 -12.087 1.00 75.30 O ATOM 1966 CB GLU A 122 -0.833 -5.701 -14.884 1.00 11.30 C ATOM 1967 CG GLU A 122 -0.047 -4.386 -14.885 1.00 71.33 C ATOM 1968 CD GLU A 122 0.168 -3.810 -16.276 1.00 3.44 C ATOM 1969 OE1 GLU A 122 0.858 -4.449 -17.091 1.00 4.13 O ATOM 1970 OE2 GLU A 122 -0.361 -2.712 -16.563 1.00 3.41 O ATOM 0 H GLU A 122 -2.618 -7.581 -14.250 1.00 0.10 H new ATOM 0 HA GLU A 122 -0.505 -6.116 -12.807 1.00 0.33 H new ATOM 0 HB2 GLU A 122 -0.195 -6.502 -15.258 1.00 11.30 H new ATOM 0 HB3 GLU A 122 -1.675 -5.617 -15.572 1.00 11.30 H new ATOM 0 HG2 GLU A 122 -0.577 -3.654 -14.275 1.00 71.33 H new ATOM 0 HG3 GLU A 122 0.922 -4.551 -14.415 1.00 71.33 H new ATOM 1977 N MET A 123 -3.514 -4.961 -13.695 1.00 2.41 N ATOM 1978 CA MET A 123 -4.566 -3.980 -13.384 1.00 23.23 C ATOM 1979 C MET A 123 -4.971 -4.017 -11.900 1.00 30.15 C ATOM 1980 O MET A 123 -4.955 -2.994 -11.215 1.00 2.42 O ATOM 1981 CB MET A 123 -5.796 -4.231 -14.267 1.00 52.05 C ATOM 1982 CG MET A 123 -5.536 -4.042 -15.755 1.00 11.05 C ATOM 1983 SD MET A 123 -6.969 -4.461 -16.769 1.00 12.42 S ATOM 1984 CE MET A 123 -6.376 -4.014 -18.400 1.00 52.51 C ATOM 0 H MET A 123 -3.749 -5.590 -14.463 1.00 2.41 H new ATOM 0 HA MET A 123 -4.160 -2.990 -13.590 1.00 23.23 H new ATOM 0 HB2 MET A 123 -6.152 -5.247 -14.097 1.00 52.05 H new ATOM 0 HB3 MET A 123 -6.596 -3.557 -13.959 1.00 52.05 H new ATOM 0 HG2 MET A 123 -5.254 -3.006 -15.942 1.00 11.05 H new ATOM 0 HG3 MET A 123 -4.690 -4.662 -16.054 1.00 11.05 H new ATOM 0 HE1 MET A 123 -7.117 -4.298 -19.147 1.00 52.51 H new ATOM 0 HE2 MET A 123 -6.210 -2.938 -18.444 1.00 52.51 H new ATOM 0 HE3 MET A 123 -5.440 -4.534 -18.602 1.00 52.51 H new ATOM 1994 N LEU A 124 -5.323 -5.201 -11.408 1.00 42.54 N ATOM 1995 CA LEU A 124 -5.738 -5.367 -10.010 1.00 70.42 C ATOM 1996 C LEU A 124 -4.571 -5.117 -9.042 1.00 34.41 C ATOM 1997 O LEU A 124 -4.777 -4.726 -7.895 1.00 65.24 O ATOM 1998 CB LEU A 124 -6.305 -6.777 -9.788 1.00 4.03 C ATOM 1999 CG LEU A 124 -7.527 -7.140 -10.650 1.00 4.45 C ATOM 2000 CD1 LEU A 124 -7.975 -8.574 -10.378 1.00 74.24 C ATOM 2001 CD2 LEU A 124 -8.675 -6.159 -10.408 1.00 15.11 C ATOM 0 H LEU A 124 -5.331 -6.063 -11.953 1.00 42.54 H new ATOM 0 HA LEU A 124 -6.512 -4.628 -9.805 1.00 70.42 H new ATOM 0 HB2 LEU A 124 -5.515 -7.503 -9.983 1.00 4.03 H new ATOM 0 HB3 LEU A 124 -6.579 -6.879 -8.738 1.00 4.03 H new ATOM 0 HG LEU A 124 -7.235 -7.068 -11.698 1.00 4.45 H new ATOM 0 HD11 LEU A 124 -8.840 -8.809 -10.998 1.00 74.24 H new ATOM 0 HD12 LEU A 124 -7.162 -9.260 -10.615 1.00 74.24 H new ATOM 0 HD13 LEU A 124 -8.243 -8.678 -9.327 1.00 74.24 H new ATOM 0 HD21 LEU A 124 -9.527 -6.436 -11.028 1.00 15.11 H new ATOM 0 HD22 LEU A 124 -8.965 -6.190 -9.358 1.00 15.11 H new ATOM 0 HD23 LEU A 124 -8.352 -5.150 -10.665 1.00 15.11 H new ATOM 2013 N TYR A 125 -3.348 -5.342 -9.515 1.00 64.23 N ATOM 2014 CA TYR A 125 -2.150 -5.175 -8.685 1.00 51.34 C ATOM 2015 C TYR A 125 -1.769 -3.685 -8.561 1.00 2.23 C ATOM 2016 O TYR A 125 -1.552 -3.179 -7.461 1.00 50.35 O ATOM 2017 CB TYR A 125 -0.986 -5.982 -9.291 1.00 51.31 C ATOM 2018 CG TYR A 125 0.054 -6.471 -8.290 1.00 23.43 C ATOM 2019 CD1 TYR A 125 0.251 -5.836 -7.066 1.00 12.25 C ATOM 2020 CD2 TYR A 125 0.843 -7.579 -8.581 1.00 45.40 C ATOM 2021 CE1 TYR A 125 1.195 -6.296 -6.167 1.00 32.40 C ATOM 2022 CE2 TYR A 125 1.789 -8.042 -7.687 1.00 72.44 C ATOM 2023 CZ TYR A 125 1.963 -7.397 -6.483 1.00 42.32 C ATOM 2024 OH TYR A 125 2.902 -7.862 -5.589 1.00 11.53 O ATOM 0 H TYR A 125 -3.156 -5.641 -10.471 1.00 64.23 H new ATOM 0 HA TYR A 125 -2.362 -5.549 -7.683 1.00 51.34 H new ATOM 0 HB2 TYR A 125 -1.397 -6.845 -9.815 1.00 51.31 H new ATOM 0 HB3 TYR A 125 -0.486 -5.364 -10.037 1.00 51.31 H new ATOM 0 HD1 TYR A 125 -0.344 -4.970 -6.815 1.00 12.25 H new ATOM 0 HD2 TYR A 125 0.713 -8.088 -9.525 1.00 45.40 H new ATOM 0 HE1 TYR A 125 1.331 -5.795 -5.220 1.00 32.40 H new ATOM 0 HE2 TYR A 125 2.389 -8.906 -7.931 1.00 72.44 H new ATOM 0 HH TYR A 125 3.354 -8.645 -5.967 1.00 11.53 H new ATOM 2034 N LYS A 126 -1.707 -2.990 -9.699 1.00 61.35 N ATOM 2035 CA LYS A 126 -1.336 -1.567 -9.740 1.00 23.15 C ATOM 2036 C LYS A 126 -2.405 -0.692 -9.061 1.00 5.32 C ATOM 2037 O LYS A 126 -2.082 0.252 -8.337 1.00 4.53 O ATOM 2038 CB LYS A 126 -1.110 -1.126 -11.201 1.00 61.32 C ATOM 2039 CG LYS A 126 -2.373 -1.146 -12.065 1.00 42.22 C ATOM 2040 CD LYS A 126 -2.064 -1.252 -13.560 1.00 75.53 C ATOM 2041 CE LYS A 126 -1.207 -0.098 -14.074 1.00 31.43 C ATOM 2042 NZ LYS A 126 -1.019 -0.172 -15.550 1.00 12.44 N ATOM 0 H LYS A 126 -1.910 -3.391 -10.614 1.00 61.35 H new ATOM 0 HA LYS A 126 -0.407 -1.436 -9.185 1.00 23.15 H new ATOM 0 HB2 LYS A 126 -0.697 -0.117 -11.204 1.00 61.32 H new ATOM 0 HB3 LYS A 126 -0.363 -1.778 -11.654 1.00 61.32 H new ATOM 0 HG2 LYS A 126 -2.999 -1.987 -11.767 1.00 42.22 H new ATOM 0 HG3 LYS A 126 -2.949 -0.239 -11.881 1.00 42.22 H new ATOM 0 HD2 LYS A 126 -1.550 -2.194 -13.754 1.00 75.53 H new ATOM 0 HD3 LYS A 126 -3.000 -1.279 -14.118 1.00 75.53 H new ATOM 0 HE2 LYS A 126 -1.677 0.850 -13.813 1.00 31.43 H new ATOM 0 HE3 LYS A 126 -0.235 -0.118 -13.581 1.00 31.43 H new ATOM 0 HZ1 LYS A 126 -0.265 0.484 -15.837 1.00 12.44 H new ATOM 0 HZ2 LYS A 126 -0.755 -1.142 -15.818 1.00 12.44 H new ATOM 0 HZ3 LYS A 126 -1.906 0.090 -16.026 1.00 12.44 H new ATOM 2056 N ASP A 127 -3.678 -1.029 -9.285 1.00 41.42 N ATOM 2057 CA ASP A 127 -4.798 -0.333 -8.638 1.00 72.32 C ATOM 2058 C ASP A 127 -4.733 -0.514 -7.111 1.00 60.14 C ATOM 2059 O ASP A 127 -4.947 0.426 -6.344 1.00 65.30 O ATOM 2060 CB ASP A 127 -6.128 -0.881 -9.182 1.00 34.51 C ATOM 2061 CG ASP A 127 -7.336 -0.078 -8.722 1.00 42.15 C ATOM 2062 OD1 ASP A 127 -7.770 -0.248 -7.563 1.00 22.35 O ATOM 2063 OD2 ASP A 127 -7.867 0.723 -9.519 1.00 63.40 O ATOM 0 H ASP A 127 -3.961 -1.782 -9.912 1.00 41.42 H new ATOM 0 HA ASP A 127 -4.731 0.732 -8.860 1.00 72.32 H new ATOM 0 HB2 ASP A 127 -6.095 -0.884 -10.271 1.00 34.51 H new ATOM 0 HB3 ASP A 127 -6.245 -1.917 -8.864 1.00 34.51 H new ATOM 2068 N MET A 128 -4.421 -1.737 -6.689 1.00 53.11 N ATOM 2069 CA MET A 128 -4.339 -2.089 -5.269 1.00 21.55 C ATOM 2070 C MET A 128 -3.120 -1.443 -4.583 1.00 14.00 C ATOM 2071 O MET A 128 -3.239 -0.888 -3.491 1.00 23.35 O ATOM 2072 CB MET A 128 -4.303 -3.615 -5.137 1.00 61.21 C ATOM 2073 CG MET A 128 -4.196 -4.133 -3.712 1.00 13.43 C ATOM 2074 SD MET A 128 -4.500 -5.908 -3.614 1.00 42.55 S ATOM 2075 CE MET A 128 -3.459 -6.511 -4.943 1.00 2.10 C ATOM 0 H MET A 128 -4.218 -2.513 -7.319 1.00 53.11 H new ATOM 0 HA MET A 128 -5.220 -1.698 -4.761 1.00 21.55 H new ATOM 0 HB2 MET A 128 -5.205 -4.025 -5.590 1.00 61.21 H new ATOM 0 HB3 MET A 128 -3.457 -3.995 -5.710 1.00 61.21 H new ATOM 0 HG2 MET A 128 -3.203 -3.913 -3.320 1.00 13.43 H new ATOM 0 HG3 MET A 128 -4.912 -3.607 -3.080 1.00 13.43 H new ATOM 0 HE1 MET A 128 -3.358 -7.593 -4.863 1.00 2.10 H new ATOM 0 HE2 MET A 128 -3.911 -6.258 -5.902 1.00 2.10 H new ATOM 0 HE3 MET A 128 -2.475 -6.048 -4.873 1.00 2.10 H new ATOM 2085 N GLN A 129 -1.950 -1.513 -5.221 1.00 43.44 N ATOM 2086 CA GLN A 129 -0.744 -0.861 -4.690 1.00 21.32 C ATOM 2087 C GLN A 129 -0.930 0.659 -4.601 1.00 54.13 C ATOM 2088 O GLN A 129 -0.577 1.282 -3.598 1.00 64.14 O ATOM 2089 CB GLN A 129 0.482 -1.176 -5.562 1.00 2.23 C ATOM 2090 CG GLN A 129 0.970 -2.618 -5.458 1.00 3.21 C ATOM 2091 CD GLN A 129 1.406 -3.008 -4.051 1.00 11.54 C ATOM 2092 OE1 GLN A 129 1.294 -4.162 -3.655 1.00 73.54 O ATOM 2093 NE2 GLN A 129 1.917 -2.058 -3.286 1.00 45.23 N ATOM 0 H GLN A 129 -1.809 -2.010 -6.100 1.00 43.44 H new ATOM 0 HA GLN A 129 -0.578 -1.255 -3.688 1.00 21.32 H new ATOM 0 HB2 GLN A 129 0.239 -0.961 -6.602 1.00 2.23 H new ATOM 0 HB3 GLN A 129 1.296 -0.508 -5.280 1.00 2.23 H new ATOM 0 HG2 GLN A 129 0.174 -3.288 -5.783 1.00 3.21 H new ATOM 0 HG3 GLN A 129 1.806 -2.761 -6.143 1.00 3.21 H new ATOM 0 HE21 GLN A 129 1.998 -1.105 -3.642 1.00 45.23 H new ATOM 0 HE22 GLN A 129 2.230 -2.278 -2.340 1.00 45.23 H new ATOM 2102 N LYS A 130 -1.483 1.246 -5.661 1.00 61.22 N ATOM 2103 CA LYS A 130 -1.761 2.681 -5.688 1.00 62.03 C ATOM 2104 C LYS A 130 -2.769 3.067 -4.595 1.00 51.34 C ATOM 2105 O LYS A 130 -2.589 4.066 -3.904 1.00 13.04 O ATOM 2106 CB LYS A 130 -2.278 3.101 -7.071 1.00 61.12 C ATOM 2107 CG LYS A 130 -2.623 4.586 -7.181 1.00 65.02 C ATOM 2108 CD LYS A 130 -2.945 4.999 -8.619 1.00 52.41 C ATOM 2109 CE LYS A 130 -1.686 5.216 -9.460 1.00 51.13 C ATOM 2110 NZ LYS A 130 -0.813 4.012 -9.524 1.00 73.21 N ATOM 0 H LYS A 130 -1.747 0.750 -6.512 1.00 61.22 H new ATOM 0 HA LYS A 130 -0.829 3.211 -5.490 1.00 62.03 H new ATOM 0 HB2 LYS A 130 -1.523 2.857 -7.819 1.00 61.12 H new ATOM 0 HB3 LYS A 130 -3.165 2.514 -7.310 1.00 61.12 H new ATOM 0 HG2 LYS A 130 -3.477 4.807 -6.541 1.00 65.02 H new ATOM 0 HG3 LYS A 130 -1.787 5.180 -6.813 1.00 65.02 H new ATOM 0 HD2 LYS A 130 -3.562 4.231 -9.085 1.00 52.41 H new ATOM 0 HD3 LYS A 130 -3.533 5.917 -8.607 1.00 52.41 H new ATOM 0 HE2 LYS A 130 -1.976 5.501 -10.471 1.00 51.13 H new ATOM 0 HE3 LYS A 130 -1.118 6.048 -9.045 1.00 51.13 H new ATOM 0 HZ1 LYS A 130 -0.168 4.094 -10.336 1.00 73.21 H new ATOM 0 HZ2 LYS A 130 -0.259 3.938 -8.647 1.00 73.21 H new ATOM 0 HZ3 LYS A 130 -1.402 3.162 -9.634 1.00 73.21 H new ATOM 2124 N ASP A 131 -3.817 2.262 -4.430 1.00 32.20 N ATOM 2125 CA ASP A 131 -4.795 2.494 -3.367 1.00 22.31 C ATOM 2126 C ASP A 131 -4.110 2.476 -1.991 1.00 45.32 C ATOM 2127 O ASP A 131 -4.189 3.446 -1.244 1.00 23.14 O ATOM 2128 CB ASP A 131 -5.909 1.440 -3.424 1.00 34.15 C ATOM 2129 CG ASP A 131 -7.047 1.746 -2.463 1.00 62.22 C ATOM 2130 OD1 ASP A 131 -7.885 2.616 -2.789 1.00 1.41 O ATOM 2131 OD2 ASP A 131 -7.112 1.124 -1.384 1.00 14.21 O ATOM 0 H ASP A 131 -4.011 1.448 -5.014 1.00 32.20 H new ATOM 0 HA ASP A 131 -5.240 3.477 -3.518 1.00 22.31 H new ATOM 0 HB2 ASP A 131 -6.300 1.384 -4.440 1.00 34.15 H new ATOM 0 HB3 ASP A 131 -5.492 0.461 -3.188 1.00 34.15 H new ATOM 2136 N ALA A 132 -3.402 1.384 -1.692 1.00 32.11 N ATOM 2137 CA ALA A 132 -2.705 1.221 -0.406 1.00 34.44 C ATOM 2138 C ALA A 132 -1.847 2.445 -0.039 1.00 54.11 C ATOM 2139 O ALA A 132 -1.935 2.964 1.076 1.00 34.44 O ATOM 2140 CB ALA A 132 -1.836 -0.030 -0.436 1.00 74.24 C ATOM 0 H ALA A 132 -3.294 0.592 -2.326 1.00 32.11 H new ATOM 0 HA ALA A 132 -3.472 1.122 0.362 1.00 34.44 H new ATOM 0 HB1 ALA A 132 -1.325 -0.141 0.520 1.00 74.24 H new ATOM 0 HB2 ALA A 132 -2.462 -0.904 -0.616 1.00 74.24 H new ATOM 0 HB3 ALA A 132 -1.098 0.058 -1.234 1.00 74.24 H new ATOM 2146 N VAL A 133 -1.017 2.902 -0.976 1.00 34.22 N ATOM 2147 CA VAL A 133 -0.141 4.051 -0.723 1.00 24.20 C ATOM 2148 C VAL A 133 -0.951 5.359 -0.569 1.00 12.40 C ATOM 2149 O VAL A 133 -0.602 6.225 0.237 1.00 20.42 O ATOM 2150 CB VAL A 133 0.937 4.205 -1.834 1.00 4.35 C ATOM 2151 CG1 VAL A 133 0.313 4.574 -3.177 1.00 25.40 C ATOM 2152 CG2 VAL A 133 1.996 5.228 -1.423 1.00 74.32 C ATOM 0 H VAL A 133 -0.931 2.500 -1.910 1.00 34.22 H new ATOM 0 HA VAL A 133 0.372 3.857 0.219 1.00 24.20 H new ATOM 0 HB VAL A 133 1.424 3.238 -1.957 1.00 4.35 H new ATOM 0 HG11 VAL A 133 1.097 4.673 -3.928 1.00 25.40 H new ATOM 0 HG12 VAL A 133 -0.384 3.793 -3.481 1.00 25.40 H new ATOM 0 HG13 VAL A 133 -0.220 5.520 -3.083 1.00 25.40 H new ATOM 0 HG21 VAL A 133 2.740 5.320 -2.215 1.00 74.32 H new ATOM 0 HG22 VAL A 133 1.522 6.195 -1.256 1.00 74.32 H new ATOM 0 HG23 VAL A 133 2.482 4.899 -0.505 1.00 74.32 H new ATOM 2162 N GLN A 134 -2.045 5.488 -1.327 1.00 72.43 N ATOM 2163 CA GLN A 134 -2.954 6.638 -1.185 1.00 15.03 C ATOM 2164 C GLN A 134 -3.730 6.570 0.143 1.00 54.30 C ATOM 2165 O GLN A 134 -4.115 7.601 0.702 1.00 1.40 O ATOM 2166 CB GLN A 134 -3.943 6.708 -2.363 1.00 31.31 C ATOM 2167 CG GLN A 134 -3.290 6.947 -3.726 1.00 63.33 C ATOM 2168 CD GLN A 134 -2.565 8.283 -3.831 1.00 72.40 C ATOM 2169 OE1 GLN A 134 -2.926 9.263 -3.184 1.00 44.50 O ATOM 2170 NE2 GLN A 134 -1.545 8.339 -4.662 1.00 1.32 N ATOM 0 H GLN A 134 -2.324 4.816 -2.042 1.00 72.43 H new ATOM 0 HA GLN A 134 -2.342 7.540 -1.186 1.00 15.03 H new ATOM 0 HB2 GLN A 134 -4.507 5.776 -2.403 1.00 31.31 H new ATOM 0 HB3 GLN A 134 -4.660 7.507 -2.172 1.00 31.31 H new ATOM 0 HG2 GLN A 134 -2.582 6.143 -3.926 1.00 63.33 H new ATOM 0 HG3 GLN A 134 -4.056 6.897 -4.500 1.00 63.33 H new ATOM 0 HE21 GLN A 134 -1.268 7.509 -5.186 1.00 1.32 H new ATOM 0 HE22 GLN A 134 -1.032 9.212 -4.782 1.00 1.32 H new ATOM 2179 N GLN A 135 -3.958 5.349 0.638 1.00 64.41 N ATOM 2180 CA GLN A 135 -4.611 5.138 1.938 1.00 42.43 C ATOM 2181 C GLN A 135 -3.706 5.624 3.073 1.00 70.53 C ATOM 2182 O GLN A 135 -4.125 6.419 3.910 1.00 22.12 O ATOM 2183 CB GLN A 135 -4.953 3.653 2.150 1.00 24.22 C ATOM 2184 CG GLN A 135 -5.925 3.074 1.124 1.00 22.04 C ATOM 2185 CD GLN A 135 -7.348 3.593 1.261 1.00 12.04 C ATOM 2186 OE1 GLN A 135 -7.587 4.705 1.722 1.00 34.34 O ATOM 2187 NE2 GLN A 135 -8.305 2.801 0.824 1.00 3.54 N ATOM 0 H GLN A 135 -3.699 4.487 0.157 1.00 64.41 H new ATOM 0 HA GLN A 135 -5.537 5.712 1.944 1.00 42.43 H new ATOM 0 HB2 GLN A 135 -4.030 3.074 2.125 1.00 24.22 H new ATOM 0 HB3 GLN A 135 -5.379 3.530 3.146 1.00 24.22 H new ATOM 0 HG2 GLN A 135 -5.560 3.303 0.123 1.00 22.04 H new ATOM 0 HG3 GLN A 135 -5.934 1.988 1.219 1.00 22.04 H new ATOM 0 HE21 GLN A 135 -8.074 1.882 0.446 1.00 3.54 H new ATOM 0 HE22 GLN A 135 -9.277 3.106 0.863 1.00 3.54 H new ATOM 2196 N ILE A 136 -2.458 5.145 3.082 1.00 31.11 N ATOM 2197 CA ILE A 136 -1.458 5.602 4.057 1.00 52.20 C ATOM 2198 C ILE A 136 -1.351 7.131 4.037 1.00 74.10 C ATOM 2199 O ILE A 136 -1.383 7.783 5.079 1.00 63.03 O ATOM 2200 CB ILE A 136 -0.059 4.994 3.773 1.00 33.31 C ATOM 2201 CG1 ILE A 136 -0.122 3.459 3.822 1.00 63.44 C ATOM 2202 CG2 ILE A 136 0.977 5.522 4.772 1.00 33.12 C ATOM 2203 CD1 ILE A 136 1.195 2.782 3.505 1.00 43.40 C ATOM 0 H ILE A 136 -2.115 4.442 2.427 1.00 31.11 H new ATOM 0 HA ILE A 136 -1.790 5.265 5.039 1.00 52.20 H new ATOM 0 HB ILE A 136 0.249 5.297 2.772 1.00 33.31 H new ATOM 0 HG12 ILE A 136 -0.449 3.150 4.815 1.00 63.44 H new ATOM 0 HG13 ILE A 136 -0.877 3.113 3.116 1.00 63.44 H new ATOM 0 HG21 ILE A 136 1.950 5.082 4.554 1.00 33.12 H new ATOM 0 HG22 ILE A 136 1.042 6.607 4.689 1.00 33.12 H new ATOM 0 HG23 ILE A 136 0.676 5.253 5.785 1.00 33.12 H new ATOM 0 HD11 ILE A 136 1.071 1.701 3.560 1.00 43.40 H new ATOM 0 HD12 ILE A 136 1.515 3.060 2.501 1.00 43.40 H new ATOM 0 HD13 ILE A 136 1.949 3.097 4.226 1.00 43.40 H new ATOM 2215 N LEU A 137 -1.242 7.690 2.832 1.00 42.31 N ATOM 2216 CA LEU A 137 -1.228 9.144 2.638 1.00 40.03 C ATOM 2217 C LEU A 137 -2.444 9.804 3.310 1.00 20.03 C ATOM 2218 O LEU A 137 -2.320 10.788 4.043 1.00 53.05 O ATOM 2219 CB LEU A 137 -1.251 9.462 1.137 1.00 74.34 C ATOM 2220 CG LEU A 137 -1.134 10.950 0.785 1.00 5.43 C ATOM 2221 CD1 LEU A 137 0.298 11.436 0.992 1.00 70.11 C ATOM 2222 CD2 LEU A 137 -1.614 11.215 -0.641 1.00 21.32 C ATOM 0 H LEU A 137 -1.161 7.155 1.968 1.00 42.31 H new ATOM 0 HA LEU A 137 -0.320 9.539 3.094 1.00 40.03 H new ATOM 0 HB2 LEU A 137 -0.434 8.925 0.655 1.00 74.34 H new ATOM 0 HB3 LEU A 137 -2.179 9.076 0.714 1.00 74.34 H new ATOM 0 HG LEU A 137 -1.781 11.515 1.456 1.00 5.43 H new ATOM 0 HD11 LEU A 137 0.364 12.494 0.738 1.00 70.11 H new ATOM 0 HD12 LEU A 137 0.583 11.295 2.035 1.00 70.11 H new ATOM 0 HD13 LEU A 137 0.972 10.867 0.352 1.00 70.11 H new ATOM 0 HD21 LEU A 137 -1.520 12.278 -0.865 1.00 21.32 H new ATOM 0 HD22 LEU A 137 -1.007 10.642 -1.342 1.00 21.32 H new ATOM 0 HD23 LEU A 137 -2.658 10.915 -0.735 1.00 21.32 H new ATOM 2234 N ARG A 138 -3.618 9.239 3.045 1.00 2.11 N ATOM 2235 CA ARG A 138 -4.885 9.759 3.567 1.00 3.41 C ATOM 2236 C ARG A 138 -4.961 9.626 5.101 1.00 53.33 C ATOM 2237 O ARG A 138 -5.548 10.466 5.780 1.00 14.23 O ATOM 2238 CB ARG A 138 -6.041 9.006 2.895 1.00 71.32 C ATOM 2239 CG ARG A 138 -7.417 9.641 3.083 1.00 15.32 C ATOM 2240 CD ARG A 138 -8.477 8.919 2.253 1.00 73.03 C ATOM 2241 NE ARG A 138 -8.081 8.818 0.846 1.00 64.14 N ATOM 2242 CZ ARG A 138 -8.755 8.182 -0.074 1.00 33.54 C ATOM 2243 NH1 ARG A 138 -9.876 7.598 0.206 1.00 71.53 N ATOM 2244 NH2 ARG A 138 -8.299 8.132 -1.283 1.00 53.04 N ATOM 0 H ARG A 138 -3.722 8.408 2.463 1.00 2.11 H new ATOM 0 HA ARG A 138 -4.956 10.822 3.338 1.00 3.41 H new ATOM 0 HB2 ARG A 138 -5.834 8.931 1.827 1.00 71.32 H new ATOM 0 HB3 ARG A 138 -6.070 7.989 3.287 1.00 71.32 H new ATOM 0 HG2 ARG A 138 -7.694 9.610 4.137 1.00 15.32 H new ATOM 0 HG3 ARG A 138 -7.378 10.691 2.794 1.00 15.32 H new ATOM 0 HD2 ARG A 138 -8.640 7.921 2.659 1.00 73.03 H new ATOM 0 HD3 ARG A 138 -9.425 9.452 2.328 1.00 73.03 H new ATOM 0 HE ARG A 138 -7.215 9.278 0.564 1.00 64.14 H new ATOM 0 HH11 ARG A 138 -10.245 7.631 1.157 1.00 71.53 H new ATOM 0 HH12 ARG A 138 -10.391 7.105 -0.524 1.00 71.53 H new ATOM 0 HH21 ARG A 138 -7.417 8.588 -1.514 1.00 53.04 H new ATOM 0 HH22 ARG A 138 -8.822 7.636 -2.005 1.00 53.04 H new ATOM 2258 N GLN A 139 -4.355 8.569 5.634 1.00 62.41 N ATOM 2259 CA GLN A 139 -4.308 8.340 7.083 1.00 13.51 C ATOM 2260 C GLN A 139 -3.348 9.323 7.778 1.00 41.34 C ATOM 2261 O GLN A 139 -3.690 9.928 8.795 1.00 14.15 O ATOM 2262 CB GLN A 139 -3.885 6.892 7.368 1.00 34.24 C ATOM 2263 CG GLN A 139 -4.903 5.850 6.905 1.00 3.24 C ATOM 2264 CD GLN A 139 -4.380 4.426 7.006 1.00 73.42 C ATOM 2265 OE1 GLN A 139 -3.190 4.175 6.860 1.00 3.23 O ATOM 2266 NE2 GLN A 139 -5.261 3.481 7.266 1.00 61.42 N ATOM 0 H GLN A 139 -3.885 7.850 5.083 1.00 62.41 H new ATOM 0 HA GLN A 139 -5.306 8.511 7.486 1.00 13.51 H new ATOM 0 HB2 GLN A 139 -2.932 6.698 6.877 1.00 34.24 H new ATOM 0 HB3 GLN A 139 -3.721 6.775 8.439 1.00 34.24 H new ATOM 0 HG2 GLN A 139 -5.808 5.943 7.505 1.00 3.24 H new ATOM 0 HG3 GLN A 139 -5.183 6.057 5.872 1.00 3.24 H new ATOM 0 HE21 GLN A 139 -6.246 3.720 7.383 1.00 61.42 H new ATOM 0 HE22 GLN A 139 -4.958 2.511 7.351 1.00 61.42 H new ATOM 2275 N VAL A 140 -2.153 9.487 7.215 1.00 15.12 N ATOM 2276 CA VAL A 140 -1.159 10.428 7.750 1.00 54.11 C ATOM 2277 C VAL A 140 -1.701 11.870 7.756 1.00 21.30 C ATOM 2278 O VAL A 140 -1.578 12.590 8.752 1.00 71.40 O ATOM 2279 CB VAL A 140 0.161 10.371 6.935 1.00 23.32 C ATOM 2280 CG1 VAL A 140 1.178 11.385 7.455 1.00 54.52 C ATOM 2281 CG2 VAL A 140 0.747 8.959 6.962 1.00 15.34 C ATOM 0 H VAL A 140 -1.844 8.981 6.385 1.00 15.12 H new ATOM 0 HA VAL A 140 -0.953 10.127 8.777 1.00 54.11 H new ATOM 0 HB VAL A 140 -0.071 10.632 5.902 1.00 23.32 H new ATOM 0 HG11 VAL A 140 2.091 11.320 6.864 1.00 54.52 H new ATOM 0 HG12 VAL A 140 0.764 12.390 7.374 1.00 54.52 H new ATOM 0 HG13 VAL A 140 1.406 11.169 8.499 1.00 54.52 H new ATOM 0 HG21 VAL A 140 1.672 8.938 6.386 1.00 15.34 H new ATOM 0 HG22 VAL A 140 0.955 8.671 7.992 1.00 15.34 H new ATOM 0 HG23 VAL A 140 0.032 8.260 6.527 1.00 15.34 H new ATOM 2291 N SER A 141 -2.317 12.276 6.646 1.00 64.03 N ATOM 2292 CA SER A 141 -2.924 13.613 6.535 1.00 41.22 C ATOM 2293 C SER A 141 -4.166 13.747 7.433 1.00 14.44 C ATOM 2294 O SER A 141 -4.546 14.852 7.817 1.00 5.30 O ATOM 2295 CB SER A 141 -3.297 13.918 5.078 1.00 73.22 C ATOM 2296 OG SER A 141 -4.169 12.932 4.550 1.00 3.32 O ATOM 0 H SER A 141 -2.412 11.702 5.808 1.00 64.03 H new ATOM 0 HA SER A 141 -2.182 14.336 6.873 1.00 41.22 H new ATOM 0 HB2 SER A 141 -3.774 14.896 5.020 1.00 73.22 H new ATOM 0 HB3 SER A 141 -2.392 13.968 4.472 1.00 73.22 H new ATOM 0 HG SER A 141 -3.654 12.133 4.312 1.00 3.32 H new ATOM 2302 N ALA A 142 -4.796 12.621 7.766 1.00 63.14 N ATOM 2303 CA ALA A 142 -5.941 12.616 8.686 1.00 73.01 C ATOM 2304 C ALA A 142 -5.489 12.688 10.156 1.00 0.22 C ATOM 2305 O ALA A 142 -6.139 13.331 10.983 1.00 31.41 O ATOM 2306 CB ALA A 142 -6.801 11.376 8.459 1.00 1.11 C ATOM 0 H ALA A 142 -4.536 11.699 7.415 1.00 63.14 H new ATOM 0 HA ALA A 142 -6.535 13.505 8.476 1.00 73.01 H new ATOM 0 HB1 ALA A 142 -7.645 11.387 9.149 1.00 1.11 H new ATOM 0 HB2 ALA A 142 -7.170 11.372 7.433 1.00 1.11 H new ATOM 0 HB3 ALA A 142 -6.203 10.482 8.633 1.00 1.11 H new ATOM 2312 N PHE A 143 -4.367 12.035 10.475 1.00 2.13 N ATOM 2313 CA PHE A 143 -3.855 11.992 11.857 1.00 64.02 C ATOM 2314 C PHE A 143 -3.557 13.388 12.424 1.00 64.43 C ATOM 2315 O PHE A 143 -3.700 13.614 13.625 1.00 71.43 O ATOM 2316 CB PHE A 143 -2.602 11.099 11.956 1.00 3.52 C ATOM 2317 CG PHE A 143 -2.893 9.717 12.489 1.00 31.12 C ATOM 2318 CD1 PHE A 143 -3.098 9.523 13.847 1.00 64.30 C ATOM 2319 CD2 PHE A 143 -2.968 8.621 11.644 1.00 11.31 C ATOM 2320 CE1 PHE A 143 -3.375 8.266 14.350 1.00 30.53 C ATOM 2321 CE2 PHE A 143 -3.244 7.362 12.143 1.00 2.03 C ATOM 2322 CZ PHE A 143 -3.448 7.184 13.497 1.00 4.33 C ATOM 0 H PHE A 143 -3.794 11.529 9.800 1.00 2.13 H new ATOM 0 HA PHE A 143 -4.650 11.559 12.464 1.00 64.02 H new ATOM 0 HB2 PHE A 143 -2.148 11.012 10.969 1.00 3.52 H new ATOM 0 HB3 PHE A 143 -1.870 11.583 12.602 1.00 3.52 H new ATOM 0 HD1 PHE A 143 -3.040 10.365 14.520 1.00 64.30 H new ATOM 0 HD2 PHE A 143 -2.809 8.752 10.584 1.00 11.31 H new ATOM 0 HE1 PHE A 143 -3.534 8.131 15.410 1.00 30.53 H new ATOM 0 HE2 PHE A 143 -3.300 6.517 11.473 1.00 2.03 H new ATOM 0 HZ PHE A 143 -3.664 6.200 13.887 1.00 4.33 H new ATOM 2332 N THR A 144 -3.145 14.324 11.571 1.00 43.33 N ATOM 2333 CA THR A 144 -2.894 15.699 12.026 1.00 32.43 C ATOM 2334 C THR A 144 -4.185 16.357 12.536 1.00 54.43 C ATOM 2335 O THR A 144 -4.142 17.280 13.348 1.00 3.43 O ATOM 2336 CB THR A 144 -2.279 16.591 10.920 1.00 60.23 C ATOM 2337 OG1 THR A 144 -1.950 17.881 11.460 1.00 1.11 O ATOM 2338 CG2 THR A 144 -3.229 16.766 9.742 1.00 12.31 C ATOM 0 H THR A 144 -2.979 14.165 10.577 1.00 43.33 H new ATOM 0 HA THR A 144 -2.173 15.618 12.839 1.00 32.43 H new ATOM 0 HB THR A 144 -1.378 16.094 10.559 1.00 60.23 H new ATOM 0 HG1 THR A 144 -2.559 18.555 11.091 1.00 1.11 H new ATOM 0 HG21 THR A 144 -2.761 17.398 8.988 1.00 12.31 H new ATOM 0 HG22 THR A 144 -3.455 15.792 9.309 1.00 12.31 H new ATOM 0 HG23 THR A 144 -4.152 17.234 10.085 1.00 12.31 H new ATOM 2346 N SER A 145 -5.330 15.877 12.046 1.00 61.32 N ATOM 2347 CA SER A 145 -6.641 16.335 12.529 1.00 54.22 C ATOM 2348 C SER A 145 -7.105 15.465 13.708 1.00 21.44 C ATOM 2349 O SER A 145 -7.409 15.968 14.789 1.00 3.20 O ATOM 2350 CB SER A 145 -7.685 16.280 11.398 1.00 11.34 C ATOM 2351 OG SER A 145 -7.280 17.043 10.268 1.00 52.41 O ATOM 0 H SER A 145 -5.379 15.169 11.313 1.00 61.32 H new ATOM 0 HA SER A 145 -6.541 17.368 12.863 1.00 54.22 H new ATOM 0 HB2 SER A 145 -7.843 15.244 11.099 1.00 11.34 H new ATOM 0 HB3 SER A 145 -8.640 16.655 11.766 1.00 11.34 H new ATOM 0 HG SER A 145 -7.966 16.983 9.570 1.00 52.41 H new ATOM 2357 N ALA A 146 -7.144 14.151 13.488 1.00 0.52 N ATOM 2358 CA ALA A 146 -7.515 13.189 14.536 1.00 63.11 C ATOM 2359 C ALA A 146 -6.912 11.796 14.258 1.00 11.44 C ATOM 2360 O ALA A 146 -6.104 11.290 15.041 1.00 53.13 O ATOM 2361 CB ALA A 146 -9.032 13.108 14.667 1.00 41.53 C ATOM 0 H ALA A 146 -6.922 13.722 12.589 1.00 0.52 H new ATOM 0 HA ALA A 146 -7.103 13.542 15.481 1.00 63.11 H new ATOM 0 HB1 ALA A 146 -9.292 12.392 15.447 1.00 41.53 H new ATOM 0 HB2 ALA A 146 -9.427 14.089 14.929 1.00 41.53 H new ATOM 0 HB3 ALA A 146 -9.462 12.785 13.719 1.00 41.53 H new ATOM 2367 N GLY A 147 -7.325 11.168 13.154 1.00 71.20 N ATOM 2368 CA GLY A 147 -6.721 9.898 12.733 1.00 34.13 C ATOM 2369 C GLY A 147 -7.376 8.659 13.344 1.00 21.04 C ATOM 2370 O GLY A 147 -7.732 7.720 12.629 1.00 4.24 O ATOM 0 H GLY A 147 -8.065 11.511 12.542 1.00 71.20 H new ATOM 0 HA2 GLY A 147 -6.775 9.825 11.647 1.00 34.13 H new ATOM 0 HA3 GLY A 147 -5.664 9.905 13.000 1.00 34.13 H new ATOM 2374 N LEU A 148 -7.549 8.658 14.667 1.00 13.25 N ATOM 2375 CA LEU A 148 -8.156 7.516 15.385 1.00 44.42 C ATOM 2376 C LEU A 148 -9.603 7.229 14.921 1.00 40.22 C ATOM 2377 O LEU A 148 -10.231 6.260 15.355 1.00 30.22 O ATOM 2378 CB LEU A 148 -8.142 7.766 16.907 1.00 55.45 C ATOM 2379 CG LEU A 148 -9.145 8.818 17.441 1.00 44.44 C ATOM 2380 CD1 LEU A 148 -9.079 8.906 18.962 1.00 43.52 C ATOM 2381 CD2 LEU A 148 -8.899 10.193 16.824 1.00 74.22 C ATOM 0 H LEU A 148 -7.279 9.434 15.272 1.00 13.25 H new ATOM 0 HA LEU A 148 -7.552 6.640 15.149 1.00 44.42 H new ATOM 0 HB2 LEU A 148 -8.339 6.820 17.411 1.00 55.45 H new ATOM 0 HB3 LEU A 148 -7.137 8.076 17.193 1.00 55.45 H new ATOM 0 HG LEU A 148 -10.143 8.491 17.150 1.00 44.44 H new ATOM 0 HD11 LEU A 148 -9.792 9.651 19.315 1.00 43.52 H new ATOM 0 HD12 LEU A 148 -9.325 7.936 19.394 1.00 43.52 H new ATOM 0 HD13 LEU A 148 -8.073 9.194 19.266 1.00 43.52 H new ATOM 0 HD21 LEU A 148 -9.622 10.905 17.222 1.00 74.22 H new ATOM 0 HD22 LEU A 148 -7.890 10.526 17.067 1.00 74.22 H new ATOM 0 HD23 LEU A 148 -9.010 10.131 15.741 1.00 74.22 H new ATOM 2393 N GLU A 149 -10.106 8.077 14.031 1.00 35.04 N ATOM 2394 CA GLU A 149 -11.480 8.012 13.525 1.00 4.35 C ATOM 2395 C GLU A 149 -11.809 6.675 12.823 1.00 50.32 C ATOM 2396 O GLU A 149 -12.951 6.212 12.871 1.00 44.32 O ATOM 2397 CB GLU A 149 -11.685 9.187 12.559 1.00 12.31 C ATOM 2398 CG GLU A 149 -11.362 10.541 13.190 1.00 65.51 C ATOM 2399 CD GLU A 149 -11.198 11.660 12.172 1.00 45.03 C ATOM 2400 OE1 GLU A 149 -12.208 12.316 11.830 1.00 21.03 O ATOM 2401 OE2 GLU A 149 -10.053 11.900 11.727 1.00 54.41 O ATOM 0 H GLU A 149 -9.564 8.844 13.631 1.00 35.04 H new ATOM 0 HA GLU A 149 -12.160 8.076 14.375 1.00 4.35 H new ATOM 0 HB2 GLU A 149 -11.056 9.042 11.681 1.00 12.31 H new ATOM 0 HB3 GLU A 149 -12.719 9.190 12.214 1.00 12.31 H new ATOM 0 HG2 GLU A 149 -12.157 10.808 13.886 1.00 65.51 H new ATOM 0 HG3 GLU A 149 -10.445 10.452 13.772 1.00 65.51 H new ATOM 2408 N HIS A 150 -10.819 6.057 12.172 1.00 50.31 N ATOM 2409 CA HIS A 150 -11.052 4.795 11.444 1.00 25.24 C ATOM 2410 C HIS A 150 -11.003 3.578 12.398 1.00 61.14 C ATOM 2411 O HIS A 150 -11.345 2.458 12.015 1.00 2.50 O ATOM 2412 CB HIS A 150 -10.036 4.645 10.299 1.00 21.41 C ATOM 2413 CG HIS A 150 -10.548 3.855 9.122 1.00 10.54 C ATOM 2414 ND1 HIS A 150 -9.740 3.070 8.328 1.00 62.20 N ATOM 2415 CD2 HIS A 150 -11.789 3.766 8.584 1.00 21.23 C ATOM 2416 CE1 HIS A 150 -10.456 2.537 7.360 1.00 4.03 C ATOM 2417 NE2 HIS A 150 -11.701 2.942 7.489 1.00 71.23 N ATOM 0 H HIS A 150 -9.859 6.400 12.131 1.00 50.31 H new ATOM 0 HA HIS A 150 -12.053 4.829 11.014 1.00 25.24 H new ATOM 0 HB2 HIS A 150 -9.741 5.637 9.957 1.00 21.41 H new ATOM 0 HB3 HIS A 150 -9.139 4.161 10.685 1.00 21.41 H new ATOM 0 HD1 HIS A 150 -8.740 2.924 8.469 1.00 62.20 H new ATOM 0 HD2 HIS A 150 -12.681 4.253 8.949 1.00 21.23 H new ATOM 0 HE1 HIS A 150 -10.084 1.878 6.590 1.00 4.03 H new ATOM 2426 N HIS A 151 -10.551 3.821 13.631 1.00 14.01 N ATOM 2427 CA HIS A 151 -10.665 2.865 14.747 1.00 43.22 C ATOM 2428 C HIS A 151 -9.830 1.572 14.584 1.00 23.43 C ATOM 2429 O HIS A 151 -8.742 1.454 15.152 1.00 31.32 O ATOM 2430 CB HIS A 151 -12.141 2.512 14.991 1.00 5.44 C ATOM 2431 CG HIS A 151 -12.378 1.710 16.239 1.00 44.03 C ATOM 2432 ND1 HIS A 151 -12.557 2.288 17.476 1.00 54.42 N ATOM 2433 CD2 HIS A 151 -12.465 0.371 16.439 1.00 31.31 C ATOM 2434 CE1 HIS A 151 -12.741 1.349 18.379 1.00 72.00 C ATOM 2435 NE2 HIS A 151 -12.691 0.178 17.779 1.00 54.35 N ATOM 0 H HIS A 151 -10.091 4.694 13.890 1.00 14.01 H new ATOM 0 HA HIS A 151 -10.243 3.377 15.612 1.00 43.22 H new ATOM 0 HB2 HIS A 151 -12.720 3.434 15.048 1.00 5.44 H new ATOM 0 HB3 HIS A 151 -12.517 1.952 14.135 1.00 5.44 H new ATOM 0 HD2 HIS A 151 -12.374 -0.398 15.686 1.00 31.31 H new ATOM 0 HE1 HIS A 151 -12.905 1.511 19.434 1.00 72.00 H new ATOM 0 HE2 HIS A 151 -12.802 -0.727 18.236 1.00 54.35 H new ATOM 2444 N HIS A 152 -10.346 0.604 13.822 1.00 11.11 N ATOM 2445 CA HIS A 152 -9.815 -0.774 13.840 1.00 24.20 C ATOM 2446 C HIS A 152 -8.330 -0.880 13.439 1.00 35.35 C ATOM 2447 O HIS A 152 -7.889 -0.298 12.449 1.00 3.41 O ATOM 2448 CB HIS A 152 -10.650 -1.691 12.936 1.00 74.04 C ATOM 2449 CG HIS A 152 -10.113 -3.093 12.863 1.00 13.04 C ATOM 2450 ND1 HIS A 152 -10.251 -4.007 13.883 1.00 12.41 N ATOM 2451 CD2 HIS A 152 -9.391 -3.718 11.905 1.00 44.52 C ATOM 2452 CE1 HIS A 152 -9.637 -5.126 13.559 1.00 45.43 C ATOM 2453 NE2 HIS A 152 -9.106 -4.979 12.365 1.00 2.51 N ATOM 0 H HIS A 152 -11.130 0.742 13.184 1.00 11.11 H new ATOM 0 HA HIS A 152 -9.887 -1.096 14.879 1.00 24.20 H new ATOM 0 HB2 HIS A 152 -11.675 -1.720 13.305 1.00 74.04 H new ATOM 0 HB3 HIS A 152 -10.684 -1.268 11.932 1.00 74.04 H new ATOM 0 HD2 HIS A 152 -9.094 -3.302 10.954 1.00 44.52 H new ATOM 0 HE1 HIS A 152 -9.579 -6.014 14.171 1.00 45.43 H new ATOM 0 HE2 HIS A 152 -8.570 -5.687 11.863 1.00 2.51 H new ATOM 2462 N HIS A 153 -7.583 -1.674 14.208 1.00 2.31 N ATOM 2463 CA HIS A 153 -6.177 -1.982 13.909 1.00 30.01 C ATOM 2464 C HIS A 153 -5.898 -3.480 14.120 1.00 43.34 C ATOM 2465 O HIS A 153 -6.738 -4.199 14.660 1.00 32.41 O ATOM 2466 CB HIS A 153 -5.239 -1.142 14.792 1.00 1.14 C ATOM 2467 CG HIS A 153 -5.498 -1.281 16.264 1.00 73.12 C ATOM 2468 ND1 HIS A 153 -5.249 -2.440 16.970 1.00 24.34 N ATOM 2469 CD2 HIS A 153 -5.998 -0.399 17.165 1.00 11.31 C ATOM 2470 CE1 HIS A 153 -5.587 -2.266 18.232 1.00 54.11 C ATOM 2471 NE2 HIS A 153 -6.039 -1.039 18.376 1.00 64.34 N ATOM 0 H HIS A 153 -7.932 -2.123 15.055 1.00 2.31 H new ATOM 0 HA HIS A 153 -5.988 -1.733 12.865 1.00 30.01 H new ATOM 0 HB2 HIS A 153 -4.208 -1.431 14.586 1.00 1.14 H new ATOM 0 HB3 HIS A 153 -5.338 -0.093 14.514 1.00 1.14 H new ATOM 0 HD1 HIS A 153 -4.863 -3.298 16.576 1.00 24.34 H new ATOM 0 HD2 HIS A 153 -6.306 0.617 16.965 1.00 11.31 H new ATOM 0 HE1 HIS A 153 -5.507 -3.005 19.015 1.00 54.11 H new ATOM 2480 N HIS A 154 -4.720 -3.947 13.702 1.00 61.21 N ATOM 2481 CA HIS A 154 -4.349 -5.364 13.875 1.00 63.11 C ATOM 2482 C HIS A 154 -4.378 -5.776 15.358 1.00 4.12 C ATOM 2483 O HIS A 154 -4.073 -4.968 16.240 1.00 52.34 O ATOM 2484 CB HIS A 154 -2.954 -5.635 13.291 1.00 23.34 C ATOM 2485 CG HIS A 154 -1.832 -5.020 14.078 1.00 40.21 C ATOM 2486 ND1 HIS A 154 -1.101 -5.722 15.011 1.00 30.30 N ATOM 2487 CD2 HIS A 154 -1.321 -3.764 14.079 1.00 54.53 C ATOM 2488 CE1 HIS A 154 -0.197 -4.932 15.550 1.00 51.14 C ATOM 2489 NE2 HIS A 154 -0.306 -3.739 15.005 1.00 74.41 N ATOM 0 H HIS A 154 -4.009 -3.376 13.245 1.00 61.21 H new ATOM 0 HA HIS A 154 -5.085 -5.961 13.337 1.00 63.11 H new ATOM 0 HB2 HIS A 154 -2.798 -6.712 13.236 1.00 23.34 H new ATOM 0 HB3 HIS A 154 -2.919 -5.255 12.270 1.00 23.34 H new ATOM 0 HD2 HIS A 154 -1.650 -2.938 13.466 1.00 54.53 H new ATOM 0 HE1 HIS A 154 0.515 -5.215 16.311 1.00 51.14 H new ATOM 0 HE2 HIS A 154 0.269 -2.928 15.233 1.00 74.41 H new ATOM 2498 N HIS A 155 -4.735 -7.032 15.624 1.00 35.40 N ATOM 2499 CA HIS A 155 -4.820 -7.542 17.002 1.00 4.43 C ATOM 2500 C HIS A 155 -4.065 -8.881 17.161 1.00 13.14 C ATOM 2501 O HIS A 155 -2.891 -8.859 17.597 1.00 36.85 O ATOM 2502 CB HIS A 155 -6.293 -7.700 17.409 1.00 14.10 C ATOM 2503 CG HIS A 155 -6.488 -8.109 18.839 1.00 33.52 C ATOM 2504 ND1 HIS A 155 -6.710 -9.411 19.227 1.00 13.11 N ATOM 2505 CD2 HIS A 155 -6.499 -7.376 19.979 1.00 14.14 C ATOM 2506 CE1 HIS A 155 -6.851 -9.462 20.536 1.00 62.45 C ATOM 2507 NE2 HIS A 155 -6.728 -8.244 21.017 1.00 5.14 N ATOM 2508 OXT HIS A 155 -4.645 -9.943 16.846 1.00 36.85 O ATOM 0 H HIS A 155 -4.971 -7.719 14.908 1.00 35.40 H new ATOM 0 HA HIS A 155 -4.341 -6.819 17.662 1.00 4.43 H new ATOM 0 HB2 HIS A 155 -6.810 -6.756 17.238 1.00 14.10 H new ATOM 0 HB3 HIS A 155 -6.761 -8.442 16.762 1.00 14.10 H new ATOM 0 HD2 HIS A 155 -6.355 -6.308 20.056 1.00 14.14 H new ATOM 0 HE1 HIS A 155 -7.036 -10.354 21.116 1.00 62.45 H new ATOM 0 HE2 HIS A 155 -6.792 -7.986 22.002 1.00 5.14 H new TER 2517 HIS A 155