USER MOD reduce.3.24.130724 H: found=0, std=0, add=1035, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1027 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 83 GLN : amide:sc= -1.6 X(o=-2.5,f=-2.6) USER MOD Set 1.2: A 120 THR OG1 : rot 180:sc= -0.913 USER MOD Set 2.1: A 40 CYS SG : rot 160:sc= -0.188 USER MOD Set 2.2: A 42 GLN : amide:sc= -0.299 K(o=-0.49,f=0.44) USER MOD Single : A 1 GLY N :NH3+ -122:sc= 0.0744 (180deg=0) USER MOD Single : A 3 SER OG : rot 12:sc= 1.16 USER MOD Single : A 8 HIS : no HD1:sc= -2.03 K(o=-2,f=-0.46) USER MOD Single : A 9 THR OG1 : rot 24:sc= 1.03 USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -1.31 K(o=-1.3,f=-0.73) USER MOD Single : A 18 HIS : no HD1:sc= -2.24 K(o=-2.2,f=-1.7) USER MOD Single : A 20 THR OG1 : rot -85:sc= 0.429 USER MOD Single : A 21 THR OG1 : rot -61:sc= 0.958 USER MOD Single : A 23 ASN : amide:sc= -0.12 K(o=-0.12,f=-0.93) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.059) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= -0.0084 USER MOD Single : A 36 GLN : amide:sc= -0.993 K(o=-0.99,f=-3.8!) USER MOD Single : A 47 ASN : amide:sc= -0.0605 K(o=-0.061,f=-1.8!) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 57 CYS SG : rot -33:sc= 0.0272 USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -83:sc= 0.295 USER MOD Single : A 60 SER OG : rot -30:sc= -0.456 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 66 TYR OH : rot 60:sc= -1.33 USER MOD Single : A 71 CYS SG : rot 3:sc= -4.18! USER MOD Single : A 74 HIS : no HE2:sc= -0.682 K(o=-0.68,f=-2.8) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 180:sc= -0.262 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 152:sc= -0.657 (180deg=-2.36!) USER MOD Single : A 88 HIS : no HD1:sc= -0.0374 X(o=-0.037,f=-0.18) USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -3.1 K(o=-3.1,f=-2.1) USER MOD Single : A 100 CYS SG : rot -130:sc= 0.833 USER MOD Single : A 108 LYS NZ :NH3+ -158:sc= -2.41 (180deg=-3.1!) USER MOD Single : A 113 HIS : no HD1:sc= -0.864 K(o=-0.86,f=-5.6!) USER MOD Single : A 126 HIS : no HD1:sc= -2.51 K(o=-2.5,f=-3.6) USER MOD Single : A 130 THR OG1 : rot 180:sc= 0 USER MOD Single : A 135 TYR OH : rot 126:sc= 0.0188 USER MOD Single : A 136 ASN : amide:sc= -1.58 K(o=-1.6,f=-0.93) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 THR OG1 : rot 180:sc= -0.039 USER MOD Single : A 141 SER OG : rot 52:sc= 0.359 USER MOD Single : A 142 GLN : amide:sc= -0.054 K(o=-0.054,f=-1.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 13.331 3.290 0.234 1.00 70.21 N ATOM 2 CA GLY A 1 13.489 3.821 -1.107 1.00 45.03 C ATOM 3 C GLY A 1 12.201 3.777 -1.904 1.00 52.42 C ATOM 4 O GLY A 1 11.182 3.256 -1.450 1.00 22.21 O ATOM 0 H1 GLY A 1 13.597 4.017 0.929 1.00 70.21 H new ATOM 0 H2 GLY A 1 12.339 3.015 0.384 1.00 70.21 H new ATOM 0 H3 GLY A 1 13.943 2.458 0.352 1.00 70.21 H new ATOM 0 HA2 GLY A 1 13.841 4.851 -1.047 1.00 45.03 H new ATOM 0 HA3 GLY A 1 14.257 3.252 -1.631 1.00 45.03 H new ATOM 8 N PRO A 2 12.235 4.337 -3.123 1.00 14.45 N ATOM 9 CA PRO A 2 11.068 4.374 -4.010 1.00 2.14 C ATOM 10 C PRO A 2 10.705 2.994 -4.547 1.00 33.04 C ATOM 11 O PRO A 2 9.592 2.778 -5.028 1.00 25.23 O ATOM 12 CB PRO A 2 11.519 5.290 -5.150 1.00 54.13 C ATOM 13 CG PRO A 2 13.004 5.180 -5.161 1.00 23.44 C ATOM 14 CD PRO A 2 13.414 4.977 -3.728 1.00 45.42 C ATOM 0 HA PRO A 2 10.173 4.722 -3.494 1.00 2.14 H new ATOM 0 HB2 PRO A 2 11.092 4.976 -6.102 1.00 54.13 H new ATOM 0 HB3 PRO A 2 11.200 6.318 -4.981 1.00 54.13 H new ATOM 0 HG2 PRO A 2 13.329 4.345 -5.782 1.00 23.44 H new ATOM 0 HG3 PRO A 2 13.459 6.080 -5.574 1.00 23.44 H new ATOM 0 HD2 PRO A 2 14.299 4.345 -3.649 1.00 45.42 H new ATOM 0 HD3 PRO A 2 13.652 5.922 -3.241 1.00 45.42 H new ATOM 22 N SER A 3 11.649 2.063 -4.461 1.00 24.13 N ATOM 23 CA SER A 3 11.429 0.704 -4.941 1.00 62.13 C ATOM 24 C SER A 3 12.455 -0.256 -4.346 1.00 43.32 C ATOM 25 O SER A 3 13.658 0.005 -4.380 1.00 1.00 O ATOM 26 CB SER A 3 11.501 0.663 -6.469 1.00 24.41 C ATOM 27 OG SER A 3 10.321 1.189 -7.050 1.00 11.13 O ATOM 0 H SER A 3 12.574 2.225 -4.063 1.00 24.13 H new ATOM 0 HA SER A 3 10.436 0.389 -4.622 1.00 62.13 H new ATOM 0 HB2 SER A 3 12.364 1.234 -6.811 1.00 24.41 H new ATOM 0 HB3 SER A 3 11.647 -0.365 -6.802 1.00 24.41 H new ATOM 0 HG SER A 3 9.786 1.633 -6.359 1.00 11.13 H new ATOM 33 N ASP A 4 11.971 -1.366 -3.802 1.00 31.33 N ATOM 34 CA ASP A 4 12.845 -2.367 -3.199 1.00 54.45 C ATOM 35 C ASP A 4 12.092 -3.672 -2.960 1.00 42.03 C ATOM 36 O ASP A 4 10.984 -3.673 -2.423 1.00 11.32 O ATOM 37 CB ASP A 4 13.419 -1.846 -1.881 1.00 41.32 C ATOM 38 CG ASP A 4 14.874 -1.438 -2.005 1.00 10.23 C ATOM 39 OD1 ASP A 4 15.619 -2.114 -2.745 1.00 3.24 O ATOM 40 OD2 ASP A 4 15.267 -0.442 -1.362 1.00 61.01 O ATOM 0 H ASP A 4 10.978 -1.596 -3.766 1.00 31.33 H new ATOM 0 HA ASP A 4 13.664 -2.563 -3.891 1.00 54.45 H new ATOM 0 HB2 ASP A 4 12.832 -0.991 -1.545 1.00 41.32 H new ATOM 0 HB3 ASP A 4 13.325 -2.617 -1.117 1.00 41.32 H new ATOM 45 N LEU A 5 12.701 -4.782 -3.363 1.00 53.15 N ATOM 46 CA LEU A 5 12.088 -6.095 -3.194 1.00 41.01 C ATOM 47 C LEU A 5 13.072 -7.078 -2.567 1.00 52.05 C ATOM 48 O LEU A 5 12.881 -7.528 -1.438 1.00 31.24 O ATOM 49 CB LEU A 5 11.603 -6.631 -4.542 1.00 51.12 C ATOM 50 CG LEU A 5 10.087 -6.707 -4.728 1.00 21.21 C ATOM 51 CD1 LEU A 5 9.460 -7.573 -3.647 1.00 32.52 C ATOM 52 CD2 LEU A 5 9.478 -5.313 -4.717 1.00 54.11 C ATOM 0 H LEU A 5 13.618 -4.799 -3.809 1.00 53.15 H new ATOM 0 HA LEU A 5 11.234 -5.987 -2.525 1.00 41.01 H new ATOM 0 HB2 LEU A 5 12.014 -6.001 -5.330 1.00 51.12 H new ATOM 0 HB3 LEU A 5 12.017 -7.629 -4.684 1.00 51.12 H new ATOM 0 HG LEU A 5 9.881 -7.164 -5.696 1.00 21.21 H new ATOM 0 HD11 LEU A 5 8.381 -7.616 -3.795 1.00 32.52 H new ATOM 0 HD12 LEU A 5 9.874 -8.580 -3.702 1.00 32.52 H new ATOM 0 HD13 LEU A 5 9.675 -7.145 -2.668 1.00 32.52 H new ATOM 0 HD21 LEU A 5 8.399 -5.386 -4.851 1.00 54.11 H new ATOM 0 HD22 LEU A 5 9.694 -4.829 -3.764 1.00 54.11 H new ATOM 0 HD23 LEU A 5 9.905 -4.723 -5.528 1.00 54.11 H new ATOM 64 N PHE A 6 14.126 -7.405 -3.308 1.00 33.43 N ATOM 65 CA PHE A 6 15.141 -8.334 -2.824 1.00 73.23 C ATOM 66 C PHE A 6 16.123 -7.630 -1.892 1.00 75.03 C ATOM 67 O PHE A 6 16.124 -6.404 -1.785 1.00 55.41 O ATOM 68 CB PHE A 6 15.894 -8.957 -4.001 1.00 64.02 C ATOM 69 CG PHE A 6 14.996 -9.408 -5.117 1.00 60.50 C ATOM 70 CD1 PHE A 6 13.836 -10.116 -4.847 1.00 31.33 C ATOM 71 CD2 PHE A 6 15.311 -9.125 -6.436 1.00 2.40 C ATOM 72 CE1 PHE A 6 13.008 -10.534 -5.872 1.00 0.43 C ATOM 73 CE2 PHE A 6 14.487 -9.539 -7.465 1.00 52.12 C ATOM 74 CZ PHE A 6 13.333 -10.243 -7.182 1.00 62.54 C ATOM 0 H PHE A 6 14.299 -7.041 -4.245 1.00 33.43 H new ATOM 0 HA PHE A 6 14.639 -9.123 -2.264 1.00 73.23 H new ATOM 0 HB2 PHE A 6 16.607 -8.231 -4.391 1.00 64.02 H new ATOM 0 HB3 PHE A 6 16.471 -9.810 -3.642 1.00 64.02 H new ATOM 0 HD1 PHE A 6 13.576 -10.344 -3.824 1.00 31.33 H new ATOM 0 HD2 PHE A 6 16.212 -8.574 -6.663 1.00 2.40 H new ATOM 0 HE1 PHE A 6 12.108 -11.088 -5.648 1.00 0.43 H new ATOM 0 HE2 PHE A 6 14.745 -9.312 -8.489 1.00 52.12 H new ATOM 0 HZ PHE A 6 12.686 -10.565 -7.984 1.00 62.54 H new ATOM 84 N VAL A 7 16.957 -8.416 -1.219 1.00 43.51 N ATOM 85 CA VAL A 7 17.945 -7.869 -0.296 1.00 51.23 C ATOM 86 C VAL A 7 19.336 -7.864 -0.920 1.00 21.03 C ATOM 87 O VAL A 7 19.730 -8.817 -1.592 1.00 63.52 O ATOM 88 CB VAL A 7 17.987 -8.668 1.019 1.00 33.54 C ATOM 89 CG1 VAL A 7 19.041 -8.100 1.957 1.00 63.13 C ATOM 90 CG2 VAL A 7 16.618 -8.673 1.683 1.00 0.35 C ATOM 0 H VAL A 7 16.968 -9.433 -1.295 1.00 43.51 H new ATOM 0 HA VAL A 7 17.643 -6.844 -0.080 1.00 51.23 H new ATOM 0 HB VAL A 7 18.258 -9.698 0.789 1.00 33.54 H new ATOM 0 HG11 VAL A 7 19.055 -8.678 2.881 1.00 63.13 H new ATOM 0 HG12 VAL A 7 20.020 -8.154 1.480 1.00 63.13 H new ATOM 0 HG13 VAL A 7 18.804 -7.060 2.183 1.00 63.13 H new ATOM 0 HG21 VAL A 7 16.666 -9.242 2.611 1.00 0.35 H new ATOM 0 HG22 VAL A 7 16.315 -7.649 1.901 1.00 0.35 H new ATOM 0 HG23 VAL A 7 15.890 -9.132 1.013 1.00 0.35 H new ATOM 100 N HIS A 8 20.077 -6.784 -0.692 1.00 21.22 N ATOM 101 CA HIS A 8 21.426 -6.655 -1.230 1.00 65.34 C ATOM 102 C HIS A 8 22.416 -6.281 -0.132 1.00 5.53 C ATOM 103 O HIS A 8 22.174 -5.360 0.650 1.00 23.31 O ATOM 104 CB HIS A 8 21.457 -5.605 -2.341 1.00 11.53 C ATOM 105 CG HIS A 8 20.113 -5.330 -2.943 1.00 23.32 C ATOM 106 ND1 HIS A 8 19.547 -4.074 -2.979 1.00 11.54 N ATOM 107 CD2 HIS A 8 19.223 -6.159 -3.537 1.00 23.43 C ATOM 108 CE1 HIS A 8 18.366 -4.142 -3.567 1.00 0.22 C ATOM 109 NE2 HIS A 8 18.146 -5.397 -3.915 1.00 41.45 N ATOM 0 H HIS A 8 19.766 -5.986 -0.138 1.00 21.22 H new ATOM 0 HA HIS A 8 21.719 -7.620 -1.644 1.00 65.34 H new ATOM 0 HB2 HIS A 8 21.864 -4.676 -1.941 1.00 11.53 H new ATOM 0 HB3 HIS A 8 22.136 -5.938 -3.126 1.00 11.53 H new ATOM 0 HD2 HIS A 8 19.339 -7.222 -3.686 1.00 23.43 H new ATOM 0 HE1 HIS A 8 17.695 -3.313 -3.735 1.00 0.22 H new ATOM 0 HE2 HIS A 8 17.311 -5.744 -4.388 1.00 41.45 H new ATOM 117 N THR A 9 23.533 -7.000 -0.077 1.00 42.02 N ATOM 118 CA THR A 9 24.559 -6.745 0.926 1.00 13.44 C ATOM 119 C THR A 9 25.934 -6.603 0.284 1.00 54.54 C ATOM 120 O THR A 9 26.541 -7.590 -0.128 1.00 74.45 O ATOM 121 CB THR A 9 24.609 -7.870 1.977 1.00 64.02 C ATOM 122 OG1 THR A 9 25.060 -9.086 1.370 1.00 24.34 O ATOM 123 CG2 THR A 9 23.240 -8.087 2.604 1.00 64.23 C ATOM 0 H THR A 9 23.750 -7.764 -0.716 1.00 42.02 H new ATOM 0 HA THR A 9 24.293 -5.809 1.418 1.00 13.44 H new ATOM 0 HB THR A 9 25.306 -7.575 2.761 1.00 64.02 H new ATOM 0 HG1 THR A 9 25.585 -8.877 0.569 1.00 24.34 H new ATOM 0 HG21 THR A 9 23.301 -8.886 3.343 1.00 64.23 H new ATOM 0 HG22 THR A 9 22.912 -7.168 3.090 1.00 64.23 H new ATOM 0 HG23 THR A 9 22.525 -8.363 1.829 1.00 64.23 H new ATOM 131 N GLU A 10 26.419 -5.368 0.202 1.00 1.42 N ATOM 132 CA GLU A 10 27.724 -5.098 -0.391 1.00 55.01 C ATOM 133 C GLU A 10 27.720 -5.420 -1.883 1.00 12.32 C ATOM 134 O GLU A 10 27.667 -4.521 -2.721 1.00 55.53 O ATOM 135 CB GLU A 10 28.808 -5.914 0.315 1.00 23.01 C ATOM 136 CG GLU A 10 28.533 -6.144 1.792 1.00 52.34 C ATOM 137 CD GLU A 10 29.796 -6.419 2.585 1.00 74.03 C ATOM 138 OE1 GLU A 10 30.473 -5.447 2.978 1.00 23.15 O ATOM 139 OE2 GLU A 10 30.106 -7.607 2.812 1.00 74.44 O ATOM 0 H GLU A 10 25.929 -4.539 0.538 1.00 1.42 H new ATOM 0 HA GLU A 10 27.939 -4.037 -0.266 1.00 55.01 H new ATOM 0 HB2 GLU A 10 28.906 -6.879 -0.182 1.00 23.01 H new ATOM 0 HB3 GLU A 10 29.764 -5.402 0.208 1.00 23.01 H new ATOM 0 HG2 GLU A 10 28.033 -5.268 2.205 1.00 52.34 H new ATOM 0 HG3 GLU A 10 27.848 -6.985 1.904 1.00 52.34 H new ATOM 146 N GLN A 11 27.777 -6.708 -2.204 1.00 63.04 N ATOM 147 CA GLN A 11 27.782 -7.148 -3.594 1.00 72.44 C ATOM 148 C GLN A 11 27.053 -8.479 -3.746 1.00 74.22 C ATOM 149 O GLN A 11 27.132 -9.126 -4.790 1.00 52.12 O ATOM 150 CB GLN A 11 29.218 -7.279 -4.105 1.00 53.14 C ATOM 151 CG GLN A 11 29.328 -7.258 -5.621 1.00 62.54 C ATOM 152 CD GLN A 11 30.550 -8.000 -6.128 1.00 34.25 C ATOM 153 OE1 GLN A 11 31.571 -8.078 -5.444 1.00 12.42 O ATOM 154 NE2 GLN A 11 30.451 -8.551 -7.332 1.00 21.23 N ATOM 0 H GLN A 11 27.820 -7.465 -1.521 1.00 63.04 H new ATOM 0 HA GLN A 11 27.260 -6.398 -4.188 1.00 72.44 H new ATOM 0 HB2 GLN A 11 29.817 -6.466 -3.694 1.00 53.14 H new ATOM 0 HB3 GLN A 11 29.645 -8.210 -3.731 1.00 53.14 H new ATOM 0 HG2 GLN A 11 28.432 -7.704 -6.053 1.00 62.54 H new ATOM 0 HG3 GLN A 11 29.367 -6.224 -5.964 1.00 62.54 H new ATOM 0 HE21 GLN A 11 29.585 -8.462 -7.864 1.00 21.23 H new ATOM 0 HE22 GLN A 11 31.240 -9.064 -7.725 1.00 21.23 H new ATOM 163 N ALA A 12 26.343 -8.882 -2.697 1.00 70.53 N ATOM 164 CA ALA A 12 25.598 -10.135 -2.715 1.00 24.41 C ATOM 165 C ALA A 12 24.107 -9.891 -2.512 1.00 0.35 C ATOM 166 O ALA A 12 23.687 -9.394 -1.466 1.00 1.00 O ATOM 167 CB ALA A 12 26.130 -11.081 -1.648 1.00 4.52 C ATOM 0 H ALA A 12 26.268 -8.359 -1.824 1.00 70.53 H new ATOM 0 HA ALA A 12 25.734 -10.595 -3.694 1.00 24.41 H new ATOM 0 HB1 ALA A 12 25.564 -12.012 -1.673 1.00 4.52 H new ATOM 0 HB2 ALA A 12 27.182 -11.290 -1.839 1.00 4.52 H new ATOM 0 HB3 ALA A 12 26.025 -10.619 -0.667 1.00 4.52 H new ATOM 173 N ILE A 13 23.312 -10.241 -3.517 1.00 22.52 N ATOM 174 CA ILE A 13 21.868 -10.060 -3.447 1.00 54.21 C ATOM 175 C ILE A 13 21.173 -11.343 -3.005 1.00 71.21 C ATOM 176 O ILE A 13 21.043 -12.290 -3.781 1.00 71.22 O ATOM 177 CB ILE A 13 21.290 -9.618 -4.804 1.00 54.34 C ATOM 178 CG1 ILE A 13 21.601 -8.142 -5.060 1.00 2.43 C ATOM 179 CG2 ILE A 13 19.789 -9.863 -4.846 1.00 53.30 C ATOM 180 CD1 ILE A 13 23.071 -7.865 -5.285 1.00 2.52 C ATOM 0 H ILE A 13 23.644 -10.652 -4.390 1.00 22.52 H new ATOM 0 HA ILE A 13 21.684 -9.278 -2.710 1.00 54.21 H new ATOM 0 HB ILE A 13 21.758 -10.210 -5.591 1.00 54.34 H new ATOM 0 HG12 ILE A 13 21.039 -7.806 -5.931 1.00 2.43 H new ATOM 0 HG13 ILE A 13 21.254 -7.553 -4.211 1.00 2.43 H new ATOM 0 HG21 ILE A 13 19.395 -9.545 -5.812 1.00 53.30 H new ATOM 0 HG22 ILE A 13 19.590 -10.925 -4.704 1.00 53.30 H new ATOM 0 HG23 ILE A 13 19.305 -9.294 -4.052 1.00 53.30 H new ATOM 0 HD11 ILE A 13 23.218 -6.799 -5.460 1.00 2.52 H new ATOM 0 HD12 ILE A 13 23.637 -8.170 -4.405 1.00 2.52 H new ATOM 0 HD13 ILE A 13 23.418 -8.426 -6.152 1.00 2.52 H new ATOM 192 N TYR A 14 20.727 -11.367 -1.754 1.00 75.02 N ATOM 193 CA TYR A 14 20.045 -12.534 -1.208 1.00 71.50 C ATOM 194 C TYR A 14 18.543 -12.457 -1.462 1.00 14.41 C ATOM 195 O TYR A 14 17.905 -11.441 -1.183 1.00 42.45 O ATOM 196 CB TYR A 14 20.314 -12.652 0.293 1.00 23.51 C ATOM 197 CG TYR A 14 21.766 -12.910 0.629 1.00 12.34 C ATOM 198 CD1 TYR A 14 22.700 -11.882 0.594 1.00 40.31 C ATOM 199 CD2 TYR A 14 22.203 -14.180 0.982 1.00 63.43 C ATOM 200 CE1 TYR A 14 24.027 -12.112 0.900 1.00 44.03 C ATOM 201 CE2 TYR A 14 23.528 -14.420 1.290 1.00 3.45 C ATOM 202 CZ TYR A 14 24.437 -13.382 1.248 1.00 75.41 C ATOM 203 OH TYR A 14 25.758 -13.617 1.553 1.00 14.24 O ATOM 0 H TYR A 14 20.826 -10.591 -1.099 1.00 75.02 H new ATOM 0 HA TYR A 14 20.435 -13.419 -1.711 1.00 71.50 H new ATOM 0 HB2 TYR A 14 19.994 -11.733 0.784 1.00 23.51 H new ATOM 0 HB3 TYR A 14 19.706 -13.460 0.700 1.00 23.51 H new ATOM 0 HD1 TYR A 14 22.383 -10.886 0.323 1.00 40.31 H new ATOM 0 HD2 TYR A 14 21.494 -14.994 1.016 1.00 63.43 H new ATOM 0 HE1 TYR A 14 24.740 -11.301 0.867 1.00 44.03 H new ATOM 0 HE2 TYR A 14 23.851 -15.414 1.562 1.00 3.45 H new ATOM 0 HH TYR A 14 25.879 -14.563 1.778 1.00 14.24 H new ATOM 213 N LYS A 15 17.982 -13.538 -1.992 1.00 61.24 N ATOM 214 CA LYS A 15 16.554 -13.596 -2.283 1.00 65.23 C ATOM 215 C LYS A 15 16.066 -15.041 -2.323 1.00 54.51 C ATOM 216 O LYS A 15 16.824 -15.953 -2.648 1.00 75.23 O ATOM 217 CB LYS A 15 16.257 -12.909 -3.618 1.00 13.22 C ATOM 218 CG LYS A 15 16.837 -13.635 -4.819 1.00 3.01 C ATOM 219 CD LYS A 15 16.845 -12.751 -6.055 1.00 10.02 C ATOM 220 CE LYS A 15 18.027 -13.067 -6.959 1.00 11.35 C ATOM 221 NZ LYS A 15 18.103 -12.136 -8.118 1.00 53.42 N ATOM 0 H LYS A 15 18.495 -14.387 -2.229 1.00 61.24 H new ATOM 0 HA LYS A 15 16.024 -13.074 -1.487 1.00 65.23 H new ATOM 0 HB2 LYS A 15 15.177 -12.825 -3.741 1.00 13.22 H new ATOM 0 HB3 LYS A 15 16.654 -11.894 -3.591 1.00 13.22 H new ATOM 0 HG2 LYS A 15 17.854 -13.957 -4.594 1.00 3.01 H new ATOM 0 HG3 LYS A 15 16.254 -14.535 -5.018 1.00 3.01 H new ATOM 0 HD2 LYS A 15 15.916 -12.889 -6.608 1.00 10.02 H new ATOM 0 HD3 LYS A 15 16.885 -11.704 -5.755 1.00 10.02 H new ATOM 0 HE2 LYS A 15 18.951 -13.007 -6.383 1.00 11.35 H new ATOM 0 HE3 LYS A 15 17.944 -14.092 -7.321 1.00 11.35 H new ATOM 0 HZ1 LYS A 15 18.921 -12.384 -8.710 1.00 53.42 H new ATOM 0 HZ2 LYS A 15 17.232 -12.212 -8.682 1.00 53.42 H new ATOM 0 HZ3 LYS A 15 18.208 -11.160 -7.773 1.00 53.42 H new ATOM 235 N ASN A 16 14.794 -15.239 -1.991 1.00 60.44 N ATOM 236 CA ASN A 16 14.204 -16.573 -1.990 1.00 61.23 C ATOM 237 C ASN A 16 14.149 -17.145 -3.404 1.00 14.41 C ATOM 238 O ASN A 16 13.482 -16.595 -4.281 1.00 30.45 O ATOM 239 CB ASN A 16 12.797 -16.531 -1.390 1.00 5.13 C ATOM 240 CG ASN A 16 12.705 -15.595 -0.200 1.00 73.00 C ATOM 241 OD1 ASN A 16 13.629 -15.507 0.608 1.00 21.23 O ATOM 242 ND2 ASN A 16 11.585 -14.890 -0.088 1.00 32.33 N ATOM 0 H ASN A 16 14.153 -14.494 -1.720 1.00 60.44 H new ATOM 0 HA ASN A 16 14.833 -17.221 -1.379 1.00 61.23 H new ATOM 0 HB2 ASN A 16 12.088 -16.213 -2.155 1.00 5.13 H new ATOM 0 HB3 ASN A 16 12.506 -17.535 -1.083 1.00 5.13 H new ATOM 0 HD21 ASN A 16 11.465 -14.244 0.692 1.00 32.33 H new ATOM 0 HD22 ASN A 16 10.845 -14.995 -0.782 1.00 32.33 H new ATOM 249 N ALA A 17 14.853 -18.251 -3.617 1.00 43.11 N ATOM 250 CA ALA A 17 14.882 -18.898 -4.923 1.00 24.54 C ATOM 251 C ALA A 17 13.496 -19.394 -5.320 1.00 63.44 C ATOM 252 O ALA A 17 13.163 -19.452 -6.504 1.00 54.04 O ATOM 253 CB ALA A 17 15.876 -20.051 -4.918 1.00 42.43 C ATOM 0 H ALA A 17 15.411 -18.718 -2.902 1.00 43.11 H new ATOM 0 HA ALA A 17 15.200 -18.161 -5.660 1.00 24.54 H new ATOM 0 HB1 ALA A 17 15.888 -20.526 -5.899 1.00 42.43 H new ATOM 0 HB2 ALA A 17 16.871 -19.672 -4.686 1.00 42.43 H new ATOM 0 HB3 ALA A 17 15.581 -20.782 -4.165 1.00 42.43 H new ATOM 259 N HIS A 18 12.692 -19.753 -4.324 1.00 45.41 N ATOM 260 CA HIS A 18 11.342 -20.244 -4.571 1.00 34.23 C ATOM 261 C HIS A 18 10.401 -19.096 -4.923 1.00 2.51 C ATOM 262 O HIS A 18 9.289 -19.315 -5.405 1.00 22.21 O ATOM 263 CB HIS A 18 10.816 -20.991 -3.344 1.00 61.14 C ATOM 264 CG HIS A 18 10.745 -20.143 -2.112 1.00 35.21 C ATOM 265 ND1 HIS A 18 11.455 -20.423 -0.964 1.00 1.23 N ATOM 266 CD2 HIS A 18 10.042 -19.016 -1.853 1.00 10.34 C ATOM 267 CE1 HIS A 18 11.191 -19.505 -0.051 1.00 4.01 C ATOM 268 NE2 HIS A 18 10.337 -18.639 -0.565 1.00 72.23 N ATOM 0 H HIS A 18 12.953 -19.713 -3.339 1.00 45.41 H new ATOM 0 HA HIS A 18 11.381 -20.930 -5.417 1.00 34.23 H new ATOM 0 HB2 HIS A 18 9.822 -21.381 -3.565 1.00 61.14 H new ATOM 0 HB3 HIS A 18 11.459 -21.849 -3.148 1.00 61.14 H new ATOM 0 HD2 HIS A 18 9.374 -18.508 -2.532 1.00 10.34 H new ATOM 0 HE1 HIS A 18 11.604 -19.469 0.946 1.00 4.01 H new ATOM 0 HE2 HIS A 18 9.958 -17.823 -0.084 1.00 72.23 H new ATOM 276 N LEU A 19 10.854 -17.871 -4.679 1.00 1.23 N ATOM 277 CA LEU A 19 10.053 -16.687 -4.969 1.00 51.24 C ATOM 278 C LEU A 19 10.732 -15.814 -6.020 1.00 70.55 C ATOM 279 O LEU A 19 10.273 -14.711 -6.319 1.00 23.14 O ATOM 280 CB LEU A 19 9.820 -15.878 -3.692 1.00 61.10 C ATOM 281 CG LEU A 19 8.362 -15.569 -3.349 1.00 63.35 C ATOM 282 CD1 LEU A 19 8.098 -15.813 -1.872 1.00 0.43 C ATOM 283 CD2 LEU A 19 8.018 -14.135 -3.726 1.00 23.44 C ATOM 0 H LEU A 19 11.772 -17.672 -4.281 1.00 1.23 H new ATOM 0 HA LEU A 19 9.092 -17.017 -5.363 1.00 51.24 H new ATOM 0 HB2 LEU A 19 10.262 -16.421 -2.856 1.00 61.10 H new ATOM 0 HB3 LEU A 19 10.359 -14.935 -3.780 1.00 61.10 H new ATOM 0 HG LEU A 19 7.723 -16.238 -3.926 1.00 63.35 H new ATOM 0 HD11 LEU A 19 7.056 -15.588 -1.647 1.00 0.43 H new ATOM 0 HD12 LEU A 19 8.304 -16.856 -1.633 1.00 0.43 H new ATOM 0 HD13 LEU A 19 8.745 -15.170 -1.276 1.00 0.43 H new ATOM 0 HD21 LEU A 19 6.977 -13.933 -3.475 1.00 23.44 H new ATOM 0 HD22 LEU A 19 8.664 -13.450 -3.177 1.00 23.44 H new ATOM 0 HD23 LEU A 19 8.167 -13.995 -4.797 1.00 23.44 H new ATOM 295 N THR A 20 11.827 -16.317 -6.581 1.00 65.15 N ATOM 296 CA THR A 20 12.569 -15.585 -7.600 1.00 43.11 C ATOM 297 C THR A 20 13.017 -16.510 -8.726 1.00 34.10 C ATOM 298 O THR A 20 12.674 -16.300 -9.890 1.00 41.11 O ATOM 299 CB THR A 20 13.806 -14.888 -7.002 1.00 52.31 C ATOM 300 OG1 THR A 20 14.732 -15.865 -6.516 1.00 65.32 O ATOM 301 CG2 THR A 20 13.406 -13.954 -5.870 1.00 12.13 C ATOM 0 H THR A 20 12.220 -17.229 -6.347 1.00 65.15 H new ATOM 0 HA THR A 20 11.893 -14.830 -8.001 1.00 43.11 H new ATOM 0 HB THR A 20 14.279 -14.299 -7.788 1.00 52.31 H new ATOM 0 HG1 THR A 20 14.489 -16.120 -5.602 1.00 65.32 H new ATOM 0 HG21 THR A 20 14.296 -13.473 -5.463 1.00 12.13 H new ATOM 0 HG22 THR A 20 12.724 -13.193 -6.250 1.00 12.13 H new ATOM 0 HG23 THR A 20 12.911 -14.525 -5.085 1.00 12.13 H new ATOM 309 N THR A 21 13.784 -17.537 -8.373 1.00 0.33 N ATOM 310 CA THR A 21 14.279 -18.494 -9.354 1.00 33.33 C ATOM 311 C THR A 21 14.581 -17.813 -10.683 1.00 54.25 C ATOM 312 O THR A 21 14.055 -18.185 -11.733 1.00 14.33 O ATOM 313 CB THR A 21 13.266 -19.630 -9.590 1.00 73.23 C ATOM 314 OG1 THR A 21 13.732 -20.493 -10.633 1.00 61.25 O ATOM 315 CG2 THR A 21 11.901 -19.070 -9.961 1.00 50.32 C ATOM 0 H THR A 21 14.076 -17.727 -7.414 1.00 0.33 H new ATOM 0 HA THR A 21 15.199 -18.915 -8.949 1.00 33.33 H new ATOM 0 HB THR A 21 13.169 -20.198 -8.665 1.00 73.23 H new ATOM 0 HG1 THR A 21 13.816 -19.984 -11.466 1.00 61.25 H new ATOM 0 HG21 THR A 21 11.203 -19.891 -10.123 1.00 50.32 H new ATOM 0 HG22 THR A 21 11.536 -18.437 -9.153 1.00 50.32 H new ATOM 0 HG23 THR A 21 11.985 -18.480 -10.874 1.00 50.32 H new ATOM 323 N PRO A 22 15.449 -16.791 -10.642 1.00 74.01 N ATOM 324 CA PRO A 22 15.841 -16.037 -11.836 1.00 40.13 C ATOM 325 C PRO A 22 16.706 -16.861 -12.784 1.00 74.02 C ATOM 326 O PRO A 22 16.786 -18.082 -12.662 1.00 62.50 O ATOM 327 CB PRO A 22 16.641 -14.863 -11.267 1.00 42.42 C ATOM 328 CG PRO A 22 17.161 -15.356 -9.961 1.00 60.01 C ATOM 329 CD PRO A 22 16.114 -16.294 -9.426 1.00 41.43 C ATOM 0 HA PRO A 22 14.978 -15.735 -12.429 1.00 40.13 H new ATOM 0 HB2 PRO A 22 17.454 -14.578 -11.934 1.00 42.42 H new ATOM 0 HB3 PRO A 22 16.012 -13.982 -11.136 1.00 42.42 H new ATOM 0 HG2 PRO A 22 18.115 -15.868 -10.089 1.00 60.01 H new ATOM 0 HG3 PRO A 22 17.333 -14.529 -9.272 1.00 60.01 H new ATOM 0 HD2 PRO A 22 16.558 -17.106 -8.850 1.00 41.43 H new ATOM 0 HD3 PRO A 22 15.414 -15.781 -8.766 1.00 41.43 H new ATOM 337 N ASN A 23 17.351 -16.184 -13.729 1.00 30.24 N ATOM 338 CA ASN A 23 18.210 -16.855 -14.698 1.00 1.22 C ATOM 339 C ASN A 23 19.357 -17.578 -13.999 1.00 20.41 C ATOM 340 O ASN A 23 19.354 -17.735 -12.778 1.00 13.32 O ATOM 341 CB ASN A 23 18.767 -15.844 -15.702 1.00 53.14 C ATOM 342 CG ASN A 23 18.618 -16.313 -17.137 1.00 12.40 C ATOM 343 OD1 ASN A 23 18.577 -17.513 -17.409 1.00 12.44 O ATOM 344 ND2 ASN A 23 18.536 -15.365 -18.063 1.00 44.34 N ATOM 0 H ASN A 23 17.295 -15.172 -13.844 1.00 30.24 H new ATOM 0 HA ASN A 23 17.609 -17.593 -15.230 1.00 1.22 H new ATOM 0 HB2 ASN A 23 18.252 -14.891 -15.578 1.00 53.14 H new ATOM 0 HB3 ASN A 23 19.821 -15.666 -15.488 1.00 53.14 H new ATOM 0 HD21 ASN A 23 18.435 -15.619 -19.046 1.00 44.34 H new ATOM 0 HD22 ASN A 23 18.574 -14.382 -17.792 1.00 44.34 H new ATOM 351 N ASP A 24 20.337 -18.017 -14.782 1.00 34.23 N ATOM 352 CA ASP A 24 21.491 -18.723 -14.239 1.00 4.15 C ATOM 353 C ASP A 24 22.635 -17.755 -13.954 1.00 4.33 C ATOM 354 O ASP A 24 23.803 -18.082 -14.161 1.00 44.14 O ATOM 355 CB ASP A 24 21.956 -19.809 -15.210 1.00 52.24 C ATOM 356 CG ASP A 24 22.496 -21.032 -14.496 1.00 60.25 C ATOM 357 OD1 ASP A 24 21.698 -21.743 -13.851 1.00 32.53 O ATOM 358 OD2 ASP A 24 23.717 -21.279 -14.584 1.00 52.03 O ATOM 0 H ASP A 24 20.355 -17.896 -15.795 1.00 34.23 H new ATOM 0 HA ASP A 24 21.191 -19.190 -13.301 1.00 4.15 H new ATOM 0 HB2 ASP A 24 21.122 -20.103 -15.848 1.00 52.24 H new ATOM 0 HB3 ASP A 24 22.729 -19.402 -15.862 1.00 52.24 H new ATOM 363 N GLN A 25 22.290 -16.562 -13.478 1.00 63.45 N ATOM 364 CA GLN A 25 23.289 -15.546 -13.167 1.00 71.53 C ATOM 365 C GLN A 25 23.704 -15.622 -11.702 1.00 24.52 C ATOM 366 O GLN A 25 24.606 -14.908 -11.263 1.00 3.03 O ATOM 367 CB GLN A 25 22.745 -14.152 -13.484 1.00 35.43 C ATOM 368 CG GLN A 25 23.132 -13.647 -14.864 1.00 52.10 C ATOM 369 CD GLN A 25 23.202 -12.134 -14.933 1.00 74.12 C ATOM 370 OE1 GLN A 25 23.973 -11.503 -14.210 1.00 63.04 O ATOM 371 NE2 GLN A 25 22.394 -11.543 -15.806 1.00 33.23 N ATOM 0 H GLN A 25 21.327 -16.276 -13.300 1.00 63.45 H new ATOM 0 HA GLN A 25 24.167 -15.734 -13.785 1.00 71.53 H new ATOM 0 HB2 GLN A 25 21.658 -14.169 -13.404 1.00 35.43 H new ATOM 0 HB3 GLN A 25 23.109 -13.450 -12.734 1.00 35.43 H new ATOM 0 HG2 GLN A 25 24.100 -14.065 -15.141 1.00 52.10 H new ATOM 0 HG3 GLN A 25 22.408 -14.007 -15.595 1.00 52.10 H new ATOM 0 HE21 GLN A 25 21.771 -12.105 -16.386 1.00 33.23 H new ATOM 0 HE22 GLN A 25 22.397 -10.527 -15.897 1.00 33.23 H new ATOM 380 N THR A 26 23.041 -16.493 -10.948 1.00 34.41 N ATOM 381 CA THR A 26 23.340 -16.662 -9.531 1.00 53.25 C ATOM 382 C THR A 26 24.824 -16.931 -9.311 1.00 72.11 C ATOM 383 O THR A 26 25.578 -17.121 -10.266 1.00 1.13 O ATOM 384 CB THR A 26 22.524 -17.815 -8.918 1.00 73.53 C ATOM 385 OG1 THR A 26 22.576 -18.962 -9.775 1.00 53.31 O ATOM 386 CG2 THR A 26 21.076 -17.401 -8.705 1.00 53.43 C ATOM 0 H THR A 26 22.293 -17.093 -11.295 1.00 34.41 H new ATOM 0 HA THR A 26 23.065 -15.730 -9.037 1.00 53.25 H new ATOM 0 HB THR A 26 22.960 -18.064 -7.951 1.00 73.53 H new ATOM 0 HG1 THR A 26 22.056 -19.691 -9.377 1.00 53.31 H new ATOM 0 HG21 THR A 26 20.520 -18.232 -8.271 1.00 53.43 H new ATOM 0 HG22 THR A 26 21.037 -16.547 -8.029 1.00 53.43 H new ATOM 0 HG23 THR A 26 20.631 -17.127 -9.662 1.00 53.43 H new ATOM 394 N ILE A 27 25.236 -16.947 -8.048 1.00 43.11 N ATOM 395 CA ILE A 27 26.631 -17.195 -7.704 1.00 33.15 C ATOM 396 C ILE A 27 26.748 -18.263 -6.621 1.00 52.21 C ATOM 397 O ILE A 27 27.378 -19.302 -6.824 1.00 11.42 O ATOM 398 CB ILE A 27 27.328 -15.910 -7.219 1.00 61.21 C ATOM 399 CG1 ILE A 27 27.377 -14.875 -8.345 1.00 13.15 C ATOM 400 CG2 ILE A 27 28.731 -16.225 -6.720 1.00 54.33 C ATOM 401 CD1 ILE A 27 26.513 -13.660 -8.086 1.00 22.12 C ATOM 0 H ILE A 27 24.625 -16.791 -7.247 1.00 43.11 H new ATOM 0 HA ILE A 27 27.123 -17.545 -8.612 1.00 33.15 H new ATOM 0 HB ILE A 27 26.754 -15.492 -6.392 1.00 61.21 H new ATOM 0 HG12 ILE A 27 28.409 -14.554 -8.488 1.00 13.15 H new ATOM 0 HG13 ILE A 27 27.058 -15.346 -9.275 1.00 13.15 H new ATOM 0 HG21 ILE A 27 29.211 -15.307 -6.381 1.00 54.33 H new ATOM 0 HG22 ILE A 27 28.673 -16.932 -5.892 1.00 54.33 H new ATOM 0 HG23 ILE A 27 29.315 -16.662 -7.530 1.00 54.33 H new ATOM 0 HD11 ILE A 27 26.596 -12.969 -8.925 1.00 22.12 H new ATOM 0 HD12 ILE A 27 25.474 -13.970 -7.973 1.00 22.12 H new ATOM 0 HD13 ILE A 27 26.845 -13.165 -7.174 1.00 22.12 H new ATOM 413 N LEU A 28 26.136 -18.001 -5.472 1.00 34.45 N ATOM 414 CA LEU A 28 26.169 -18.941 -4.356 1.00 11.10 C ATOM 415 C LEU A 28 24.772 -19.155 -3.782 1.00 71.15 C ATOM 416 O LEU A 28 24.123 -18.211 -3.331 1.00 52.41 O ATOM 417 CB LEU A 28 27.109 -18.431 -3.262 1.00 60.22 C ATOM 418 CG LEU A 28 28.441 -19.169 -3.125 1.00 22.14 C ATOM 419 CD1 LEU A 28 29.555 -18.198 -2.766 1.00 50.42 C ATOM 420 CD2 LEU A 28 28.335 -20.271 -2.080 1.00 42.31 C ATOM 0 H LEU A 28 25.611 -17.146 -5.288 1.00 34.45 H new ATOM 0 HA LEU A 28 26.539 -19.896 -4.729 1.00 11.10 H new ATOM 0 HB2 LEU A 28 27.318 -17.378 -3.452 1.00 60.22 H new ATOM 0 HB3 LEU A 28 26.586 -18.485 -2.307 1.00 60.22 H new ATOM 0 HG LEU A 28 28.681 -19.627 -4.085 1.00 22.14 H new ATOM 0 HD11 LEU A 28 30.495 -18.741 -2.673 1.00 50.42 H new ATOM 0 HD12 LEU A 28 29.647 -17.445 -3.548 1.00 50.42 H new ATOM 0 HD13 LEU A 28 29.322 -17.711 -1.819 1.00 50.42 H new ATOM 0 HD21 LEU A 28 29.292 -20.786 -1.996 1.00 42.31 H new ATOM 0 HD22 LEU A 28 28.072 -19.835 -1.117 1.00 42.31 H new ATOM 0 HD23 LEU A 28 27.565 -20.983 -2.379 1.00 42.31 H new ATOM 432 N LEU A 29 24.315 -20.402 -3.801 1.00 63.43 N ATOM 433 CA LEU A 29 22.995 -20.742 -3.281 1.00 4.01 C ATOM 434 C LEU A 29 23.051 -22.017 -2.445 1.00 50.22 C ATOM 435 O LEU A 29 23.831 -22.925 -2.731 1.00 40.40 O ATOM 436 CB LEU A 29 22.001 -20.915 -4.431 1.00 23.15 C ATOM 437 CG LEU A 29 21.935 -22.309 -5.056 1.00 54.21 C ATOM 438 CD1 LEU A 29 20.885 -23.158 -4.357 1.00 34.12 C ATOM 439 CD2 LEU A 29 21.639 -22.211 -6.546 1.00 31.24 C ATOM 0 H LEU A 29 24.839 -21.195 -4.171 1.00 63.43 H new ATOM 0 HA LEU A 29 22.662 -19.925 -2.641 1.00 4.01 H new ATOM 0 HB2 LEU A 29 21.007 -20.654 -4.068 1.00 23.15 H new ATOM 0 HB3 LEU A 29 22.253 -20.199 -5.213 1.00 23.15 H new ATOM 0 HG LEU A 29 22.905 -22.790 -4.929 1.00 54.21 H new ATOM 0 HD11 LEU A 29 20.852 -24.146 -4.815 1.00 34.12 H new ATOM 0 HD12 LEU A 29 21.140 -23.256 -3.302 1.00 34.12 H new ATOM 0 HD13 LEU A 29 19.909 -22.681 -4.452 1.00 34.12 H new ATOM 0 HD21 LEU A 29 21.596 -23.212 -6.975 1.00 31.24 H new ATOM 0 HD22 LEU A 29 20.682 -21.711 -6.695 1.00 31.24 H new ATOM 0 HD23 LEU A 29 22.427 -21.640 -7.037 1.00 31.24 H new ATOM 451 N ALA A 30 22.217 -22.078 -1.413 1.00 35.14 N ATOM 452 CA ALA A 30 22.168 -23.243 -0.538 1.00 73.21 C ATOM 453 C ALA A 30 20.794 -23.904 -0.580 1.00 11.20 C ATOM 454 O ALA A 30 19.810 -23.345 -0.093 1.00 30.43 O ATOM 455 CB ALA A 30 22.522 -22.848 0.888 1.00 62.12 C ATOM 0 H ALA A 30 21.566 -21.334 -1.162 1.00 35.14 H new ATOM 0 HA ALA A 30 22.901 -23.966 -0.896 1.00 73.21 H new ATOM 0 HB1 ALA A 30 22.481 -23.728 1.530 1.00 62.12 H new ATOM 0 HB2 ALA A 30 23.528 -22.429 0.910 1.00 62.12 H new ATOM 0 HB3 ALA A 30 21.811 -22.104 1.247 1.00 62.12 H new ATOM 461 N LEU A 31 20.733 -25.095 -1.165 1.00 40.21 N ATOM 462 CA LEU A 31 19.479 -25.832 -1.271 1.00 54.13 C ATOM 463 C LEU A 31 18.848 -26.034 0.103 1.00 55.53 C ATOM 464 O LEU A 31 17.632 -26.194 0.223 1.00 65.51 O ATOM 465 CB LEU A 31 19.716 -27.187 -1.940 1.00 74.11 C ATOM 466 CG LEU A 31 19.491 -27.238 -3.452 1.00 3.22 C ATOM 467 CD1 LEU A 31 18.063 -26.843 -3.793 1.00 50.21 C ATOM 468 CD2 LEU A 31 20.483 -26.333 -4.169 1.00 12.03 C ATOM 0 H LEU A 31 21.537 -25.571 -1.573 1.00 40.21 H new ATOM 0 HA LEU A 31 18.793 -25.247 -1.883 1.00 54.13 H new ATOM 0 HB2 LEU A 31 20.741 -27.497 -1.735 1.00 74.11 H new ATOM 0 HB3 LEU A 31 19.061 -27.921 -1.470 1.00 74.11 H new ATOM 0 HG LEU A 31 19.653 -28.261 -3.790 1.00 3.22 H new ATOM 0 HD11 LEU A 31 17.922 -26.885 -4.873 1.00 50.21 H new ATOM 0 HD12 LEU A 31 17.370 -27.531 -3.309 1.00 50.21 H new ATOM 0 HD13 LEU A 31 17.872 -25.829 -3.442 1.00 50.21 H new ATOM 0 HD21 LEU A 31 20.309 -26.381 -5.244 1.00 12.03 H new ATOM 0 HD22 LEU A 31 20.353 -25.307 -3.826 1.00 12.03 H new ATOM 0 HD23 LEU A 31 21.499 -26.662 -3.951 1.00 12.03 H new ATOM 480 N THR A 32 19.681 -26.022 1.139 1.00 52.44 N ATOM 481 CA THR A 32 19.205 -26.202 2.504 1.00 0.03 C ATOM 482 C THR A 32 18.258 -25.078 2.909 1.00 30.34 C ATOM 483 O THR A 32 17.419 -25.249 3.794 1.00 64.22 O ATOM 484 CB THR A 32 20.375 -26.257 3.504 1.00 24.22 C ATOM 485 OG1 THR A 32 21.319 -25.220 3.212 1.00 34.22 O ATOM 486 CG2 THR A 32 21.069 -27.610 3.451 1.00 31.13 C ATOM 0 H THR A 32 20.689 -25.889 1.058 1.00 52.44 H new ATOM 0 HA THR A 32 18.670 -27.151 2.529 1.00 0.03 H new ATOM 0 HB THR A 32 19.974 -26.111 4.507 1.00 24.22 H new ATOM 0 HG1 THR A 32 22.059 -25.261 3.853 1.00 34.22 H new ATOM 0 HG21 THR A 32 21.892 -27.625 4.166 1.00 31.13 H new ATOM 0 HG22 THR A 32 20.356 -28.395 3.702 1.00 31.13 H new ATOM 0 HG23 THR A 32 21.457 -27.781 2.447 1.00 31.13 H new ATOM 494 N ALA A 33 18.397 -23.929 2.256 1.00 21.25 N ATOM 495 CA ALA A 33 17.551 -22.778 2.547 1.00 25.14 C ATOM 496 C ALA A 33 16.860 -22.272 1.286 1.00 33.30 C ATOM 497 O ALA A 33 16.119 -21.289 1.324 1.00 23.53 O ATOM 498 CB ALA A 33 18.374 -21.666 3.183 1.00 75.44 C ATOM 0 H ALA A 33 19.087 -23.770 1.522 1.00 21.25 H new ATOM 0 HA ALA A 33 16.780 -23.093 3.250 1.00 25.14 H new ATOM 0 HB1 ALA A 33 17.730 -20.813 3.395 1.00 75.44 H new ATOM 0 HB2 ALA A 33 18.816 -22.026 4.112 1.00 75.44 H new ATOM 0 HB3 ALA A 33 19.166 -21.362 2.498 1.00 75.44 H new ATOM 504 N ASP A 34 17.106 -22.949 0.170 1.00 62.31 N ATOM 505 CA ASP A 34 16.506 -22.568 -1.104 1.00 24.44 C ATOM 506 C ASP A 34 16.741 -21.089 -1.394 1.00 62.41 C ATOM 507 O ASP A 34 15.925 -20.436 -2.046 1.00 32.44 O ATOM 508 CB ASP A 34 15.006 -22.867 -1.095 1.00 25.41 C ATOM 509 CG ASP A 34 14.514 -23.395 -2.428 1.00 34.42 C ATOM 510 OD1 ASP A 34 15.275 -24.128 -3.094 1.00 73.03 O ATOM 511 OD2 ASP A 34 13.367 -23.077 -2.804 1.00 55.22 O ATOM 0 H ASP A 34 17.717 -23.765 0.121 1.00 62.31 H new ATOM 0 HA ASP A 34 16.980 -23.154 -1.891 1.00 24.44 H new ATOM 0 HB2 ASP A 34 14.789 -23.597 -0.315 1.00 25.41 H new ATOM 0 HB3 ASP A 34 14.459 -21.959 -0.843 1.00 25.41 H new ATOM 516 N LEU A 35 17.861 -20.566 -0.906 1.00 73.43 N ATOM 517 CA LEU A 35 18.203 -19.163 -1.113 1.00 20.45 C ATOM 518 C LEU A 35 19.349 -19.023 -2.109 1.00 70.44 C ATOM 519 O LEU A 35 20.323 -19.774 -2.059 1.00 33.32 O ATOM 520 CB LEU A 35 18.586 -18.511 0.217 1.00 51.21 C ATOM 521 CG LEU A 35 18.327 -17.008 0.326 1.00 43.43 C ATOM 522 CD1 LEU A 35 18.466 -16.545 1.768 1.00 72.21 C ATOM 523 CD2 LEU A 35 19.279 -16.236 -0.577 1.00 75.14 C ATOM 0 H LEU A 35 18.547 -21.092 -0.365 1.00 73.43 H new ATOM 0 HA LEU A 35 17.328 -18.657 -1.521 1.00 20.45 H new ATOM 0 HB2 LEU A 35 18.039 -19.013 1.015 1.00 51.21 H new ATOM 0 HB3 LEU A 35 19.646 -18.691 0.395 1.00 51.21 H new ATOM 0 HG LEU A 35 17.306 -16.810 -0.001 1.00 43.43 H new ATOM 0 HD11 LEU A 35 18.278 -15.473 1.826 1.00 72.21 H new ATOM 0 HD12 LEU A 35 17.745 -17.074 2.391 1.00 72.21 H new ATOM 0 HD13 LEU A 35 19.475 -16.756 2.122 1.00 72.21 H new ATOM 0 HD21 LEU A 35 19.080 -15.168 -0.487 1.00 75.14 H new ATOM 0 HD22 LEU A 35 20.308 -16.440 -0.280 1.00 75.14 H new ATOM 0 HD23 LEU A 35 19.131 -16.546 -1.611 1.00 75.14 H new ATOM 535 N GLN A 36 19.226 -18.056 -3.013 1.00 31.24 N ATOM 536 CA GLN A 36 20.253 -17.817 -4.020 1.00 74.20 C ATOM 537 C GLN A 36 20.883 -16.440 -3.839 1.00 73.21 C ATOM 538 O GLN A 36 20.265 -15.533 -3.281 1.00 52.23 O ATOM 539 CB GLN A 36 19.657 -17.938 -5.424 1.00 24.41 C ATOM 540 CG GLN A 36 19.130 -19.328 -5.743 1.00 43.14 C ATOM 541 CD GLN A 36 18.418 -19.389 -7.081 1.00 5.15 C ATOM 542 OE1 GLN A 36 18.155 -18.360 -7.704 1.00 62.42 O ATOM 543 NE2 GLN A 36 18.103 -20.598 -7.529 1.00 33.42 N ATOM 0 H GLN A 36 18.426 -17.426 -3.068 1.00 31.24 H new ATOM 0 HA GLN A 36 21.031 -18.571 -3.896 1.00 74.20 H new ATOM 0 HB2 GLN A 36 18.845 -17.218 -5.529 1.00 24.41 H new ATOM 0 HB3 GLN A 36 20.418 -17.670 -6.157 1.00 24.41 H new ATOM 0 HG2 GLN A 36 19.959 -20.035 -5.744 1.00 43.14 H new ATOM 0 HG3 GLN A 36 18.444 -19.642 -4.956 1.00 43.14 H new ATOM 0 HE21 GLN A 36 18.341 -21.424 -6.979 1.00 33.42 H new ATOM 0 HE22 GLN A 36 17.623 -20.702 -8.423 1.00 33.42 H new ATOM 552 N ILE A 37 22.115 -16.292 -4.314 1.00 11.04 N ATOM 553 CA ILE A 37 22.828 -15.025 -4.204 1.00 73.35 C ATOM 554 C ILE A 37 23.289 -14.535 -5.573 1.00 3.45 C ATOM 555 O ILE A 37 23.780 -15.314 -6.390 1.00 11.22 O ATOM 556 CB ILE A 37 24.050 -15.145 -3.275 1.00 62.44 C ATOM 557 CG1 ILE A 37 23.615 -15.596 -1.879 1.00 52.14 C ATOM 558 CG2 ILE A 37 24.792 -13.819 -3.202 1.00 63.35 C ATOM 559 CD1 ILE A 37 24.733 -16.210 -1.067 1.00 30.33 C ATOM 0 H ILE A 37 22.640 -17.033 -4.778 1.00 11.04 H new ATOM 0 HA ILE A 37 22.129 -14.305 -3.779 1.00 73.35 H new ATOM 0 HB ILE A 37 24.726 -15.896 -3.684 1.00 62.44 H new ATOM 0 HG12 ILE A 37 23.212 -14.739 -1.338 1.00 52.14 H new ATOM 0 HG13 ILE A 37 22.807 -16.321 -1.976 1.00 52.14 H new ATOM 0 HG21 ILE A 37 25.653 -13.920 -2.542 1.00 63.35 H new ATOM 0 HG22 ILE A 37 25.130 -13.536 -4.199 1.00 63.35 H new ATOM 0 HG23 ILE A 37 24.125 -13.050 -2.813 1.00 63.35 H new ATOM 0 HD11 ILE A 37 24.352 -16.506 -0.090 1.00 30.33 H new ATOM 0 HD12 ILE A 37 25.121 -17.086 -1.586 1.00 30.33 H new ATOM 0 HD13 ILE A 37 25.533 -15.481 -0.939 1.00 30.33 H new ATOM 571 N ASP A 38 23.130 -13.238 -5.814 1.00 64.13 N ATOM 572 CA ASP A 38 23.534 -12.642 -7.083 1.00 14.24 C ATOM 573 C ASP A 38 24.597 -11.570 -6.865 1.00 52.34 C ATOM 574 O ASP A 38 24.981 -11.282 -5.732 1.00 74.14 O ATOM 575 CB ASP A 38 22.322 -12.039 -7.795 1.00 71.02 C ATOM 576 CG ASP A 38 22.465 -12.067 -9.304 1.00 75.32 C ATOM 577 OD1 ASP A 38 22.218 -13.135 -9.903 1.00 44.11 O ATOM 578 OD2 ASP A 38 22.823 -11.022 -9.886 1.00 41.03 O ATOM 0 H ASP A 38 22.725 -12.580 -5.148 1.00 64.13 H new ATOM 0 HA ASP A 38 23.959 -13.428 -7.707 1.00 14.24 H new ATOM 0 HB2 ASP A 38 21.425 -12.588 -7.508 1.00 71.02 H new ATOM 0 HB3 ASP A 38 22.185 -11.009 -7.465 1.00 71.02 H new ATOM 583 N GLY A 39 25.070 -10.982 -7.960 1.00 50.13 N ATOM 584 CA GLY A 39 26.085 -9.949 -7.868 1.00 24.20 C ATOM 585 C GLY A 39 25.593 -8.606 -8.369 1.00 2.24 C ATOM 586 O GLY A 39 24.732 -8.541 -9.246 1.00 53.44 O ATOM 0 H GLY A 39 24.768 -11.203 -8.909 1.00 50.13 H new ATOM 0 HA2 GLY A 39 26.406 -9.851 -6.831 1.00 24.20 H new ATOM 0 HA3 GLY A 39 26.959 -10.251 -8.445 1.00 24.20 H new ATOM 590 N CYS A 40 26.139 -7.532 -7.809 1.00 41.22 N ATOM 591 CA CYS A 40 25.748 -6.183 -8.203 1.00 3.44 C ATOM 592 C CYS A 40 26.671 -5.144 -7.574 1.00 24.14 C ATOM 593 O CYS A 40 27.309 -5.403 -6.553 1.00 12.34 O ATOM 594 CB CYS A 40 24.300 -5.909 -7.794 1.00 60.33 C ATOM 595 SG CYS A 40 23.338 -5.017 -9.038 1.00 43.42 S ATOM 0 H CYS A 40 26.853 -7.569 -7.081 1.00 41.22 H new ATOM 0 HA CYS A 40 25.832 -6.109 -9.287 1.00 3.44 H new ATOM 0 HB2 CYS A 40 23.808 -6.858 -7.581 1.00 60.33 H new ATOM 0 HB3 CYS A 40 24.298 -5.334 -6.868 1.00 60.33 H new ATOM 0 HG CYS A 40 22.070 -5.197 -8.817 1.00 43.42 H new ATOM 601 N ASP A 41 26.739 -3.970 -8.191 1.00 2.32 N ATOM 602 CA ASP A 41 27.585 -2.892 -7.692 1.00 1.40 C ATOM 603 C ASP A 41 26.749 -1.823 -6.995 1.00 31.25 C ATOM 604 O ASP A 41 27.244 -0.741 -6.681 1.00 64.21 O ATOM 605 CB ASP A 41 28.380 -2.266 -8.839 1.00 64.20 C ATOM 606 CG ASP A 41 29.391 -3.227 -9.434 1.00 52.03 C ATOM 607 OD1 ASP A 41 28.970 -4.173 -10.131 1.00 73.53 O ATOM 608 OD2 ASP A 41 30.603 -3.033 -9.202 1.00 53.03 O ATOM 0 H ASP A 41 26.219 -3.740 -9.038 1.00 2.32 H new ATOM 0 HA ASP A 41 28.280 -3.315 -6.967 1.00 1.40 H new ATOM 0 HB2 ASP A 41 27.692 -1.939 -9.618 1.00 64.20 H new ATOM 0 HB3 ASP A 41 28.897 -1.377 -8.477 1.00 64.20 H new ATOM 613 N GLN A 42 25.479 -2.135 -6.756 1.00 41.11 N ATOM 614 CA GLN A 42 24.574 -1.200 -6.097 1.00 62.35 C ATOM 615 C GLN A 42 24.572 -1.417 -4.588 1.00 4.32 C ATOM 616 O GLN A 42 24.834 -2.513 -4.093 1.00 33.30 O ATOM 617 CB GLN A 42 23.156 -1.357 -6.649 1.00 11.53 C ATOM 618 CG GLN A 42 23.101 -1.473 -8.163 1.00 63.14 C ATOM 619 CD GLN A 42 21.705 -1.766 -8.676 1.00 61.32 C ATOM 620 OE1 GLN A 42 21.205 -1.086 -9.572 1.00 14.40 O ATOM 621 NE2 GLN A 42 21.068 -2.784 -8.110 1.00 33.23 N ATOM 0 H GLN A 42 25.054 -3.027 -7.009 1.00 41.11 H new ATOM 0 HA GLN A 42 24.926 -0.188 -6.299 1.00 62.35 H new ATOM 0 HB2 GLN A 42 22.700 -2.244 -6.208 1.00 11.53 H new ATOM 0 HB3 GLN A 42 22.557 -0.502 -6.337 1.00 11.53 H new ATOM 0 HG2 GLN A 42 23.460 -0.545 -8.608 1.00 63.14 H new ATOM 0 HG3 GLN A 42 23.777 -2.264 -8.488 1.00 63.14 H new ATOM 0 HE21 GLN A 42 21.521 -3.321 -7.370 1.00 33.23 H new ATOM 0 HE22 GLN A 42 20.126 -3.029 -8.415 1.00 33.23 H new ATOM 630 N PRO A 43 24.271 -0.347 -3.837 1.00 4.04 N ATOM 631 CA PRO A 43 24.228 -0.395 -2.372 1.00 62.01 C ATOM 632 C PRO A 43 23.051 -1.213 -1.853 1.00 74.14 C ATOM 633 O PRO A 43 22.127 -1.532 -2.600 1.00 54.24 O ATOM 634 CB PRO A 43 24.075 1.075 -1.973 1.00 61.14 C ATOM 635 CG PRO A 43 23.431 1.722 -3.151 1.00 24.21 C ATOM 636 CD PRO A 43 23.949 0.992 -4.359 1.00 64.41 C ATOM 0 HA PRO A 43 25.113 -0.874 -1.954 1.00 62.01 H new ATOM 0 HB2 PRO A 43 23.461 1.181 -1.078 1.00 61.14 H new ATOM 0 HB3 PRO A 43 25.041 1.528 -1.752 1.00 61.14 H new ATOM 0 HG2 PRO A 43 22.345 1.653 -3.089 1.00 24.21 H new ATOM 0 HG3 PRO A 43 23.680 2.782 -3.199 1.00 24.21 H new ATOM 0 HD2 PRO A 43 23.202 0.945 -5.151 1.00 64.41 H new ATOM 0 HD3 PRO A 43 24.828 1.482 -4.778 1.00 64.41 H new ATOM 644 N GLY A 44 23.090 -1.550 -0.568 1.00 23.03 N ATOM 645 CA GLY A 44 22.020 -2.328 0.029 1.00 42.03 C ATOM 646 C GLY A 44 22.156 -2.442 1.534 1.00 13.32 C ATOM 647 O GLY A 44 22.882 -3.291 2.051 1.00 11.12 O ATOM 0 H GLY A 44 23.844 -1.298 0.071 1.00 23.03 H new ATOM 0 HA2 GLY A 44 21.062 -1.867 -0.212 1.00 42.03 H new ATOM 0 HA3 GLY A 44 22.013 -3.326 -0.409 1.00 42.03 H new ATOM 651 N PRO A 45 21.445 -1.569 2.264 1.00 40.12 N ATOM 652 CA PRO A 45 21.474 -1.554 3.729 1.00 34.34 C ATOM 653 C PRO A 45 20.784 -2.772 4.335 1.00 72.02 C ATOM 654 O PRO A 45 19.607 -2.717 4.691 1.00 74.31 O ATOM 655 CB PRO A 45 20.712 -0.276 4.086 1.00 14.42 C ATOM 656 CG PRO A 45 19.814 -0.032 2.922 1.00 20.24 C ATOM 657 CD PRO A 45 20.559 -0.529 1.714 1.00 35.52 C ATOM 0 HA PRO A 45 22.492 -1.582 4.117 1.00 34.34 H new ATOM 0 HB2 PRO A 45 20.142 -0.399 5.007 1.00 14.42 H new ATOM 0 HB3 PRO A 45 21.393 0.560 4.243 1.00 14.42 H new ATOM 0 HG2 PRO A 45 18.868 -0.560 3.042 1.00 20.24 H new ATOM 0 HG3 PRO A 45 19.578 1.028 2.826 1.00 20.24 H new ATOM 0 HD2 PRO A 45 19.881 -0.934 0.963 1.00 35.52 H new ATOM 0 HD3 PRO A 45 21.126 0.269 1.235 1.00 35.52 H new ATOM 665 N ASP A 46 21.524 -3.869 4.449 1.00 72.41 N ATOM 666 CA ASP A 46 20.983 -5.101 5.013 1.00 3.31 C ATOM 667 C ASP A 46 22.094 -5.954 5.618 1.00 75.40 C ATOM 668 O ASP A 46 23.018 -6.371 4.922 1.00 62.40 O ATOM 669 CB ASP A 46 20.240 -5.896 3.939 1.00 54.33 C ATOM 670 CG ASP A 46 19.211 -5.057 3.206 1.00 33.22 C ATOM 671 OD1 ASP A 46 19.597 -4.331 2.266 1.00 1.13 O ATOM 672 OD2 ASP A 46 18.019 -5.128 3.572 1.00 1.22 O ATOM 0 H ASP A 46 22.500 -3.931 4.159 1.00 72.41 H new ATOM 0 HA ASP A 46 20.283 -4.833 5.804 1.00 3.31 H new ATOM 0 HB2 ASP A 46 20.959 -6.292 3.222 1.00 54.33 H new ATOM 0 HB3 ASP A 46 19.746 -6.751 4.401 1.00 54.33 H new ATOM 677 N ASN A 47 21.995 -6.209 6.919 1.00 61.13 N ATOM 678 CA ASN A 47 22.992 -7.012 7.618 1.00 41.31 C ATOM 679 C ASN A 47 22.324 -8.015 8.554 1.00 41.34 C ATOM 680 O ASN A 47 21.961 -7.680 9.682 1.00 40.04 O ATOM 681 CB ASN A 47 23.939 -6.109 8.412 1.00 55.13 C ATOM 682 CG ASN A 47 25.284 -6.762 8.664 1.00 11.53 C ATOM 683 OD1 ASN A 47 25.562 -7.851 8.162 1.00 10.32 O ATOM 684 ND2 ASN A 47 26.126 -6.097 9.446 1.00 3.43 N ATOM 0 H ASN A 47 21.235 -5.871 7.510 1.00 61.13 H new ATOM 0 HA ASN A 47 23.566 -7.563 6.873 1.00 41.31 H new ATOM 0 HB2 ASN A 47 24.087 -5.176 7.869 1.00 55.13 H new ATOM 0 HB3 ASN A 47 23.478 -5.853 9.366 1.00 55.13 H new ATOM 0 HD21 ASN A 47 27.046 -6.486 9.652 1.00 3.43 H new ATOM 0 HD22 ASN A 47 25.853 -5.197 9.841 1.00 3.43 H new ATOM 691 N ILE A 48 22.166 -9.245 8.078 1.00 62.15 N ATOM 692 CA ILE A 48 21.544 -10.297 8.872 1.00 51.02 C ATOM 693 C ILE A 48 22.206 -10.417 10.240 1.00 23.41 C ATOM 694 O ILE A 48 23.403 -10.681 10.357 1.00 62.21 O ATOM 695 CB ILE A 48 21.616 -11.659 8.157 1.00 21.43 C ATOM 696 CG1 ILE A 48 20.910 -11.587 6.802 1.00 35.21 C ATOM 697 CG2 ILE A 48 20.999 -12.746 9.025 1.00 1.02 C ATOM 698 CD1 ILE A 48 21.601 -12.382 5.717 1.00 43.02 C ATOM 0 H ILE A 48 22.460 -9.538 7.146 1.00 62.15 H new ATOM 0 HA ILE A 48 20.498 -10.019 9.001 1.00 51.02 H new ATOM 0 HB ILE A 48 22.663 -11.908 7.986 1.00 21.43 H new ATOM 0 HG12 ILE A 48 19.889 -11.952 6.914 1.00 35.21 H new ATOM 0 HG13 ILE A 48 20.844 -10.544 6.491 1.00 35.21 H new ATOM 0 HG21 ILE A 48 21.057 -13.703 8.506 1.00 1.02 H new ATOM 0 HG22 ILE A 48 21.542 -12.811 9.968 1.00 1.02 H new ATOM 0 HG23 ILE A 48 19.955 -12.504 9.224 1.00 1.02 H new ATOM 0 HD11 ILE A 48 21.045 -12.285 4.785 1.00 43.02 H new ATOM 0 HD12 ILE A 48 22.613 -12.003 5.577 1.00 43.02 H new ATOM 0 HD13 ILE A 48 21.643 -13.432 6.006 1.00 43.02 H new ATOM 710 N PRO A 49 21.411 -10.222 11.302 1.00 54.40 N ATOM 711 CA PRO A 49 21.897 -10.306 12.682 1.00 4.51 C ATOM 712 C PRO A 49 22.250 -11.733 13.087 1.00 43.25 C ATOM 713 O PRO A 49 22.359 -12.619 12.239 1.00 33.32 O ATOM 714 CB PRO A 49 20.714 -9.793 13.507 1.00 4.03 C ATOM 715 CG PRO A 49 19.518 -10.061 12.661 1.00 11.01 C ATOM 716 CD PRO A 49 19.974 -9.904 11.237 1.00 2.30 C ATOM 0 HA PRO A 49 22.814 -9.735 12.826 1.00 4.51 H new ATOM 0 HB2 PRO A 49 20.645 -10.309 14.464 1.00 4.03 H new ATOM 0 HB3 PRO A 49 20.815 -8.730 13.725 1.00 4.03 H new ATOM 0 HG2 PRO A 49 19.132 -11.065 12.839 1.00 11.01 H new ATOM 0 HG3 PRO A 49 18.713 -9.364 12.892 1.00 11.01 H new ATOM 0 HD2 PRO A 49 19.443 -10.581 10.568 1.00 2.30 H new ATOM 0 HD3 PRO A 49 19.802 -8.892 10.869 1.00 2.30 H new ATOM 724 N ASP A 50 22.428 -11.948 14.385 1.00 11.23 N ATOM 725 CA ASP A 50 22.767 -13.269 14.902 1.00 2.43 C ATOM 726 C ASP A 50 22.112 -13.506 16.260 1.00 44.45 C ATOM 727 O ASP A 50 22.745 -13.343 17.303 1.00 2.52 O ATOM 728 CB ASP A 50 24.285 -13.419 15.021 1.00 13.21 C ATOM 729 CG ASP A 50 24.934 -13.796 13.704 1.00 30.10 C ATOM 730 OD1 ASP A 50 25.036 -15.008 13.418 1.00 54.43 O ATOM 731 OD2 ASP A 50 25.340 -12.880 12.959 1.00 13.22 O ATOM 0 H ASP A 50 22.343 -11.225 15.099 1.00 11.23 H new ATOM 0 HA ASP A 50 22.389 -14.014 14.202 1.00 2.43 H new ATOM 0 HB2 ASP A 50 24.713 -12.482 15.379 1.00 13.21 H new ATOM 0 HB3 ASP A 50 24.515 -14.180 15.767 1.00 13.21 H new ATOM 736 N CYS A 51 20.841 -13.890 16.238 1.00 74.30 N ATOM 737 CA CYS A 51 20.098 -14.148 17.466 1.00 64.41 C ATOM 738 C CYS A 51 18.792 -14.878 17.168 1.00 34.04 C ATOM 739 O CYS A 51 18.528 -15.949 17.715 1.00 21.12 O ATOM 740 CB CYS A 51 19.808 -12.836 18.196 1.00 13.13 C ATOM 741 SG CYS A 51 18.448 -12.943 19.404 1.00 3.43 S ATOM 0 H CYS A 51 20.303 -14.030 15.383 1.00 74.30 H new ATOM 0 HA CYS A 51 20.710 -14.783 18.106 1.00 64.41 H new ATOM 0 HB2 CYS A 51 20.712 -12.511 18.711 1.00 13.13 H new ATOM 0 HB3 CYS A 51 19.567 -12.069 17.460 1.00 13.13 H new ATOM 746 N ASP A 52 17.978 -14.291 16.298 1.00 15.54 N ATOM 747 CA ASP A 52 16.699 -14.884 15.927 1.00 74.55 C ATOM 748 C ASP A 52 15.804 -15.059 17.150 1.00 41.41 C ATOM 749 O ASP A 52 15.827 -16.100 17.806 1.00 61.40 O ATOM 750 CB ASP A 52 16.919 -16.235 15.244 1.00 73.32 C ATOM 751 CG ASP A 52 15.662 -17.084 15.220 1.00 5.35 C ATOM 752 OD1 ASP A 52 14.722 -16.731 14.478 1.00 31.40 O ATOM 753 OD2 ASP A 52 15.620 -18.100 15.944 1.00 62.50 O ATOM 0 H ASP A 52 18.181 -13.405 15.836 1.00 15.54 H new ATOM 0 HA ASP A 52 16.202 -14.209 15.230 1.00 74.55 H new ATOM 0 HB2 ASP A 52 17.262 -16.071 14.223 1.00 73.32 H new ATOM 0 HB3 ASP A 52 17.710 -16.777 15.763 1.00 73.32 H new ATOM 758 N CYS A 53 15.017 -14.031 17.452 1.00 22.31 N ATOM 759 CA CYS A 53 14.116 -14.069 18.597 1.00 12.13 C ATOM 760 C CYS A 53 12.853 -14.860 18.270 1.00 72.34 C ATOM 761 O CYS A 53 12.750 -15.478 17.209 1.00 5.20 O ATOM 762 CB CYS A 53 13.744 -12.648 19.027 1.00 73.42 C ATOM 763 SG CYS A 53 15.165 -11.629 19.536 1.00 21.45 S ATOM 0 H CYS A 53 14.986 -13.162 16.919 1.00 22.31 H new ATOM 0 HA CYS A 53 14.633 -14.567 19.418 1.00 12.13 H new ATOM 0 HB2 CYS A 53 13.232 -12.152 18.202 1.00 73.42 H new ATOM 0 HB3 CYS A 53 13.036 -12.704 19.854 1.00 73.42 H new ATOM 768 N THR A 54 11.892 -14.837 19.188 1.00 73.31 N ATOM 769 CA THR A 54 10.636 -15.552 18.998 1.00 20.32 C ATOM 770 C THR A 54 9.505 -14.593 18.644 1.00 63.41 C ATOM 771 O THR A 54 8.775 -14.810 17.677 1.00 41.21 O ATOM 772 CB THR A 54 10.245 -16.345 20.259 1.00 20.54 C ATOM 773 OG1 THR A 54 10.512 -15.566 21.431 1.00 71.04 O ATOM 774 CG2 THR A 54 11.011 -17.658 20.332 1.00 14.03 C ATOM 0 H THR A 54 11.960 -14.331 20.071 1.00 73.31 H new ATOM 0 HA THR A 54 10.790 -16.248 18.173 1.00 20.32 H new ATOM 0 HB THR A 54 9.179 -16.566 20.205 1.00 20.54 H new ATOM 0 HG1 THR A 54 10.259 -16.077 22.228 1.00 71.04 H new ATOM 0 HG21 THR A 54 10.718 -18.201 21.231 1.00 14.03 H new ATOM 0 HG22 THR A 54 10.783 -18.262 19.453 1.00 14.03 H new ATOM 0 HG23 THR A 54 12.081 -17.454 20.364 1.00 14.03 H new ATOM 782 N SER A 55 9.366 -13.532 19.432 1.00 25.45 N ATOM 783 CA SER A 55 8.322 -12.541 19.203 1.00 32.14 C ATOM 784 C SER A 55 8.851 -11.377 18.371 1.00 12.35 C ATOM 785 O SER A 55 9.581 -10.523 18.872 1.00 10.42 O ATOM 786 CB SER A 55 7.778 -12.024 20.537 1.00 63.51 C ATOM 787 OG SER A 55 7.028 -10.836 20.356 1.00 45.32 O ATOM 0 H SER A 55 9.964 -13.337 20.235 1.00 25.45 H new ATOM 0 HA SER A 55 7.514 -13.022 18.651 1.00 32.14 H new ATOM 0 HB2 SER A 55 7.151 -12.787 20.998 1.00 63.51 H new ATOM 0 HB3 SER A 55 8.605 -11.835 21.222 1.00 63.51 H new ATOM 0 HG SER A 55 6.690 -10.527 21.223 1.00 45.32 H new ATOM 793 N GLY A 56 8.476 -11.350 17.096 1.00 60.31 N ATOM 794 CA GLY A 56 8.921 -10.288 16.214 1.00 44.42 C ATOM 795 C GLY A 56 7.788 -9.699 15.397 1.00 62.33 C ATOM 796 O GLY A 56 6.656 -9.604 15.872 1.00 51.13 O ATOM 0 H GLY A 56 7.872 -12.045 16.658 1.00 60.31 H new ATOM 0 HA2 GLY A 56 9.386 -9.500 16.806 1.00 44.42 H new ATOM 0 HA3 GLY A 56 9.686 -10.675 15.542 1.00 44.42 H new ATOM 800 N CYS A 57 8.093 -9.303 14.166 1.00 15.40 N ATOM 801 CA CYS A 57 7.091 -8.718 13.282 1.00 52.24 C ATOM 802 C CYS A 57 7.389 -9.055 11.824 1.00 34.44 C ATOM 803 O CYS A 57 8.513 -8.882 11.354 1.00 62.53 O ATOM 804 CB CYS A 57 7.041 -7.200 13.466 1.00 32.53 C ATOM 805 SG CYS A 57 8.614 -6.366 13.151 1.00 32.33 S ATOM 0 H CYS A 57 9.025 -9.376 13.758 1.00 15.40 H new ATOM 0 HA CYS A 57 6.121 -9.141 13.544 1.00 52.24 H new ATOM 0 HB2 CYS A 57 6.284 -6.789 12.798 1.00 32.53 H new ATOM 0 HB3 CYS A 57 6.722 -6.979 14.485 1.00 32.53 H new ATOM 0 HG CYS A 57 9.595 -7.141 13.507 1.00 32.33 H new ATOM 811 N TYR A 58 6.375 -9.539 11.116 1.00 73.23 N ATOM 812 CA TYR A 58 6.529 -9.905 9.713 1.00 73.43 C ATOM 813 C TYR A 58 5.598 -9.081 8.829 1.00 11.41 C ATOM 814 O TYR A 58 4.505 -8.698 9.247 1.00 53.44 O ATOM 815 CB TYR A 58 6.246 -11.396 9.519 1.00 31.10 C ATOM 816 CG TYR A 58 4.824 -11.693 9.099 1.00 21.00 C ATOM 817 CD1 TYR A 58 3.825 -11.883 10.046 1.00 72.24 C ATOM 818 CD2 TYR A 58 4.480 -11.785 7.756 1.00 0.51 C ATOM 819 CE1 TYR A 58 2.524 -12.155 9.667 1.00 64.42 C ATOM 820 CE2 TYR A 58 3.182 -12.055 7.368 1.00 1.20 C ATOM 821 CZ TYR A 58 2.208 -12.240 8.327 1.00 40.31 C ATOM 822 OH TYR A 58 0.914 -12.511 7.944 1.00 2.34 O ATOM 0 H TYR A 58 5.438 -9.687 11.490 1.00 73.23 H new ATOM 0 HA TYR A 58 7.558 -9.696 9.421 1.00 73.43 H new ATOM 0 HB2 TYR A 58 6.928 -11.792 8.767 1.00 31.10 H new ATOM 0 HB3 TYR A 58 6.458 -11.922 10.450 1.00 31.10 H new ATOM 0 HD1 TYR A 58 4.069 -11.817 11.096 1.00 72.24 H new ATOM 0 HD2 TYR A 58 5.241 -11.643 7.002 1.00 0.51 H new ATOM 0 HE1 TYR A 58 1.759 -12.300 10.416 1.00 64.42 H new ATOM 0 HE2 TYR A 58 2.931 -12.121 6.320 1.00 1.20 H new ATOM 0 HH TYR A 58 0.861 -12.536 6.966 1.00 2.34 H new ATOM 832 N TYR A 59 6.039 -8.812 7.606 1.00 43.45 N ATOM 833 CA TYR A 59 5.248 -8.031 6.662 1.00 50.11 C ATOM 834 C TYR A 59 4.000 -8.797 6.233 1.00 10.33 C ATOM 835 O TYR A 59 4.067 -9.698 5.397 1.00 3.24 O ATOM 836 CB TYR A 59 6.087 -7.673 5.434 1.00 0.11 C ATOM 837 CG TYR A 59 5.385 -6.742 4.471 1.00 32.23 C ATOM 838 CD1 TYR A 59 4.948 -5.488 4.881 1.00 74.42 C ATOM 839 CD2 TYR A 59 5.158 -7.117 3.153 1.00 53.32 C ATOM 840 CE1 TYR A 59 4.305 -4.635 4.005 1.00 10.20 C ATOM 841 CE2 TYR A 59 4.517 -6.269 2.270 1.00 63.12 C ATOM 842 CZ TYR A 59 4.093 -5.029 2.701 1.00 73.54 C ATOM 843 OH TYR A 59 3.453 -4.183 1.824 1.00 1.13 O ATOM 0 H TYR A 59 6.941 -9.123 7.244 1.00 43.45 H new ATOM 0 HA TYR A 59 4.936 -7.113 7.161 1.00 50.11 H new ATOM 0 HB2 TYR A 59 7.017 -7.209 5.763 1.00 0.11 H new ATOM 0 HB3 TYR A 59 6.357 -8.589 4.909 1.00 0.11 H new ATOM 0 HD1 TYR A 59 5.114 -5.175 5.901 1.00 74.42 H new ATOM 0 HD2 TYR A 59 5.488 -8.087 2.813 1.00 53.32 H new ATOM 0 HE1 TYR A 59 3.970 -3.664 4.340 1.00 10.20 H new ATOM 0 HE2 TYR A 59 4.349 -6.575 1.248 1.00 63.12 H new ATOM 0 HH TYR A 59 2.483 -4.263 1.941 1.00 1.13 H new ATOM 853 N SER A 60 2.861 -8.430 6.812 1.00 31.32 N ATOM 854 CA SER A 60 1.597 -9.084 6.494 1.00 52.33 C ATOM 855 C SER A 60 1.006 -8.524 5.203 1.00 21.02 C ATOM 856 O SER A 60 0.643 -7.350 5.132 1.00 50.21 O ATOM 857 CB SER A 60 0.602 -8.905 7.643 1.00 65.24 C ATOM 858 OG SER A 60 0.061 -7.596 7.649 1.00 14.23 O ATOM 0 H SER A 60 2.788 -7.684 7.503 1.00 31.32 H new ATOM 0 HA SER A 60 1.792 -10.147 6.354 1.00 52.33 H new ATOM 0 HB2 SER A 60 -0.203 -9.634 7.548 1.00 65.24 H new ATOM 0 HB3 SER A 60 1.099 -9.101 8.593 1.00 65.24 H new ATOM 0 HG SER A 60 0.720 -6.968 7.286 1.00 14.23 H new ATOM 864 N ARG A 61 0.913 -9.373 4.185 1.00 23.42 N ATOM 865 CA ARG A 61 0.368 -8.965 2.896 1.00 1.44 C ATOM 866 C ARG A 61 -1.142 -8.761 2.984 1.00 24.44 C ATOM 867 O ARG A 61 -1.719 -7.984 2.224 1.00 22.22 O ATOM 868 CB ARG A 61 0.691 -10.010 1.827 1.00 3.12 C ATOM 869 CG ARG A 61 2.132 -9.962 1.345 1.00 71.42 C ATOM 870 CD ARG A 61 2.350 -8.830 0.353 1.00 23.42 C ATOM 871 NE ARG A 61 1.863 -9.170 -0.981 1.00 41.11 N ATOM 872 CZ ARG A 61 1.717 -8.282 -1.958 1.00 13.20 C ATOM 873 NH1 ARG A 61 2.019 -7.008 -1.751 1.00 11.42 N ATOM 874 NH2 ARG A 61 1.268 -8.668 -3.145 1.00 53.14 N ATOM 0 H ARG A 61 1.208 -10.348 4.228 1.00 23.42 H new ATOM 0 HA ARG A 61 0.830 -8.017 2.618 1.00 1.44 H new ATOM 0 HB2 ARG A 61 0.483 -11.003 2.227 1.00 3.12 H new ATOM 0 HB3 ARG A 61 0.027 -9.864 0.975 1.00 3.12 H new ATOM 0 HG2 ARG A 61 2.798 -9.833 2.198 1.00 71.42 H new ATOM 0 HG3 ARG A 61 2.392 -10.912 0.878 1.00 71.42 H new ATOM 0 HD2 ARG A 61 1.840 -7.934 0.708 1.00 23.42 H new ATOM 0 HD3 ARG A 61 3.413 -8.593 0.301 1.00 23.42 H new ATOM 0 HE ARG A 61 1.622 -10.142 -1.173 1.00 41.11 H new ATOM 0 HH11 ARG A 61 2.365 -6.707 -0.840 1.00 11.42 H new ATOM 0 HH12 ARG A 61 1.906 -6.328 -2.503 1.00 11.42 H new ATOM 0 HH21 ARG A 61 1.035 -9.647 -3.308 1.00 53.14 H new ATOM 0 HH22 ARG A 61 1.156 -7.985 -3.895 1.00 53.14 H new ATOM 888 N SER A 62 -1.775 -9.466 3.917 1.00 60.03 N ATOM 889 CA SER A 62 -3.218 -9.367 4.101 1.00 10.54 C ATOM 890 C SER A 62 -3.606 -7.983 4.615 1.00 22.44 C ATOM 891 O SER A 62 -4.719 -7.510 4.380 1.00 25.24 O ATOM 892 CB SER A 62 -3.704 -10.440 5.077 1.00 62.20 C ATOM 893 OG SER A 62 -5.116 -10.425 5.191 1.00 53.44 O ATOM 0 H SER A 62 -1.311 -10.111 4.557 1.00 60.03 H new ATOM 0 HA SER A 62 -3.694 -9.524 3.133 1.00 10.54 H new ATOM 0 HB2 SER A 62 -3.374 -11.422 4.737 1.00 62.20 H new ATOM 0 HB3 SER A 62 -3.255 -10.275 6.057 1.00 62.20 H new ATOM 0 HG SER A 62 -5.401 -11.121 5.819 1.00 53.44 H new ATOM 899 N LEU A 63 -2.680 -7.340 5.318 1.00 14.32 N ATOM 900 CA LEU A 63 -2.924 -6.010 5.867 1.00 44.14 C ATOM 901 C LEU A 63 -1.976 -4.985 5.251 1.00 30.41 C ATOM 902 O LEU A 63 -2.006 -3.806 5.604 1.00 20.44 O ATOM 903 CB LEU A 63 -2.758 -6.026 7.387 1.00 1.32 C ATOM 904 CG LEU A 63 -3.627 -7.029 8.147 1.00 64.13 C ATOM 905 CD1 LEU A 63 -5.036 -7.055 7.575 1.00 23.12 C ATOM 906 CD2 LEU A 63 -3.004 -8.417 8.099 1.00 11.21 C ATOM 0 H LEU A 63 -1.754 -7.717 5.521 1.00 14.32 H new ATOM 0 HA LEU A 63 -3.947 -5.725 5.623 1.00 44.14 H new ATOM 0 HB2 LEU A 63 -1.713 -6.234 7.616 1.00 1.32 H new ATOM 0 HB3 LEU A 63 -2.974 -5.027 7.767 1.00 1.32 H new ATOM 0 HG LEU A 63 -3.686 -6.714 9.189 1.00 64.13 H new ATOM 0 HD11 LEU A 63 -5.640 -7.774 8.128 1.00 23.12 H new ATOM 0 HD12 LEU A 63 -5.482 -6.064 7.661 1.00 23.12 H new ATOM 0 HD13 LEU A 63 -4.997 -7.345 6.525 1.00 23.12 H new ATOM 0 HD21 LEU A 63 -3.635 -9.118 8.645 1.00 11.21 H new ATOM 0 HD22 LEU A 63 -2.915 -8.740 7.062 1.00 11.21 H new ATOM 0 HD23 LEU A 63 -2.015 -8.388 8.556 1.00 11.21 H new ATOM 918 N ASP A 64 -1.138 -5.443 4.328 1.00 44.33 N ATOM 919 CA ASP A 64 -0.183 -4.565 3.660 1.00 71.41 C ATOM 920 C ASP A 64 0.612 -3.753 4.677 1.00 12.41 C ATOM 921 O ASP A 64 0.679 -2.526 4.590 1.00 21.52 O ATOM 922 CB ASP A 64 -0.909 -3.627 2.694 1.00 31.43 C ATOM 923 CG ASP A 64 0.049 -2.776 1.885 1.00 54.44 C ATOM 924 OD1 ASP A 64 0.804 -3.344 1.069 1.00 62.14 O ATOM 925 OD2 ASP A 64 0.042 -1.540 2.066 1.00 20.34 O ATOM 0 H ASP A 64 -1.100 -6.416 4.025 1.00 44.33 H new ATOM 0 HA ASP A 64 0.512 -5.187 3.096 1.00 71.41 H new ATOM 0 HB2 ASP A 64 -1.528 -4.215 2.017 1.00 31.43 H new ATOM 0 HB3 ASP A 64 -1.580 -2.978 3.257 1.00 31.43 H new ATOM 930 N ARG A 65 1.211 -4.444 5.641 1.00 61.01 N ATOM 931 CA ARG A 65 1.999 -3.786 6.676 1.00 23.21 C ATOM 932 C ARG A 65 2.577 -4.808 7.651 1.00 11.13 C ATOM 933 O ARG A 65 2.108 -5.944 7.726 1.00 14.34 O ATOM 934 CB ARG A 65 1.141 -2.771 7.433 1.00 34.42 C ATOM 935 CG ARG A 65 -0.201 -3.325 7.885 1.00 24.43 C ATOM 936 CD ARG A 65 -0.375 -3.203 9.391 1.00 50.21 C ATOM 937 NE ARG A 65 -1.690 -3.663 9.829 1.00 52.52 N ATOM 938 CZ ARG A 65 -2.805 -2.957 9.674 1.00 43.45 C ATOM 939 NH1 ARG A 65 -2.763 -1.765 9.094 1.00 73.03 N ATOM 940 NH2 ARG A 65 -3.964 -3.443 10.098 1.00 10.33 N ATOM 0 H ARG A 65 1.166 -5.459 5.727 1.00 61.01 H new ATOM 0 HA ARG A 65 2.824 -3.264 6.192 1.00 23.21 H new ATOM 0 HB2 ARG A 65 1.692 -2.421 8.306 1.00 34.42 H new ATOM 0 HB3 ARG A 65 0.970 -1.904 6.795 1.00 34.42 H new ATOM 0 HG2 ARG A 65 -1.005 -2.790 7.380 1.00 24.43 H new ATOM 0 HG3 ARG A 65 -0.281 -4.372 7.592 1.00 24.43 H new ATOM 0 HD2 ARG A 65 0.398 -3.784 9.893 1.00 50.21 H new ATOM 0 HD3 ARG A 65 -0.237 -2.164 9.689 1.00 50.21 H new ATOM 0 HE ARG A 65 -1.756 -4.576 10.279 1.00 52.52 H new ATOM 0 HH11 ARG A 65 -1.874 -1.389 8.766 1.00 73.03 H new ATOM 0 HH12 ARG A 65 -3.620 -1.225 8.976 1.00 73.03 H new ATOM 0 HH21 ARG A 65 -4.000 -4.360 10.544 1.00 10.33 H new ATOM 0 HH22 ARG A 65 -4.819 -2.900 9.978 1.00 10.33 H new ATOM 954 N TYR A 66 3.597 -4.396 8.395 1.00 23.34 N ATOM 955 CA TYR A 66 4.241 -5.276 9.364 1.00 60.24 C ATOM 956 C TYR A 66 3.344 -5.500 10.577 1.00 0.33 C ATOM 957 O TYR A 66 2.750 -4.559 11.105 1.00 34.21 O ATOM 958 CB TYR A 66 5.581 -4.687 9.807 1.00 21.34 C ATOM 959 CG TYR A 66 6.771 -5.281 9.088 1.00 3.30 C ATOM 960 CD1 TYR A 66 7.142 -4.828 7.828 1.00 62.24 C ATOM 961 CD2 TYR A 66 7.524 -6.294 9.668 1.00 62.11 C ATOM 962 CE1 TYR A 66 8.228 -5.368 7.166 1.00 4.21 C ATOM 963 CE2 TYR A 66 8.613 -6.838 9.014 1.00 32.54 C ATOM 964 CZ TYR A 66 8.961 -6.372 7.764 1.00 72.22 C ATOM 965 OH TYR A 66 10.044 -6.913 7.109 1.00 14.10 O ATOM 0 H TYR A 66 3.996 -3.459 8.346 1.00 23.34 H new ATOM 0 HA TYR A 66 4.416 -6.238 8.883 1.00 60.24 H new ATOM 0 HB2 TYR A 66 5.567 -3.610 9.641 1.00 21.34 H new ATOM 0 HB3 TYR A 66 5.700 -4.843 10.879 1.00 21.34 H new ATOM 0 HD1 TYR A 66 6.572 -4.040 7.358 1.00 62.24 H new ATOM 0 HD2 TYR A 66 7.254 -6.663 10.647 1.00 62.11 H new ATOM 0 HE1 TYR A 66 8.501 -5.006 6.186 1.00 4.21 H new ATOM 0 HE2 TYR A 66 9.189 -7.624 9.480 1.00 32.54 H new ATOM 0 HH TYR A 66 10.703 -6.210 6.931 1.00 14.10 H new ATOM 975 N ILE A 67 3.252 -6.751 11.014 1.00 24.05 N ATOM 976 CA ILE A 67 2.430 -7.099 12.167 1.00 40.24 C ATOM 977 C ILE A 67 3.221 -7.922 13.178 1.00 12.41 C ATOM 978 O ILE A 67 4.034 -8.774 12.822 1.00 64.12 O ATOM 979 CB ILE A 67 1.177 -7.890 11.746 1.00 41.51 C ATOM 980 CG1 ILE A 67 1.555 -9.323 11.368 1.00 63.04 C ATOM 981 CG2 ILE A 67 0.478 -7.196 10.586 1.00 63.52 C ATOM 982 CD1 ILE A 67 0.385 -10.148 10.881 1.00 34.44 C ATOM 0 H ILE A 67 3.736 -7.541 10.587 1.00 24.05 H new ATOM 0 HA ILE A 67 2.120 -6.161 12.629 1.00 40.24 H new ATOM 0 HB ILE A 67 0.488 -7.927 12.590 1.00 41.51 H new ATOM 0 HG12 ILE A 67 2.318 -9.296 10.591 1.00 63.04 H new ATOM 0 HG13 ILE A 67 1.999 -9.813 12.234 1.00 63.04 H new ATOM 0 HG21 ILE A 67 -0.405 -7.767 10.300 1.00 63.52 H new ATOM 0 HG22 ILE A 67 0.179 -6.192 10.889 1.00 63.52 H new ATOM 0 HG23 ILE A 67 1.159 -7.131 9.737 1.00 63.52 H new ATOM 0 HD11 ILE A 67 0.727 -11.152 10.631 1.00 34.44 H new ATOM 0 HD12 ILE A 67 -0.370 -10.206 11.665 1.00 34.44 H new ATOM 0 HD13 ILE A 67 -0.046 -9.681 9.996 1.00 34.44 H new ATOM 994 N PRO A 68 2.976 -7.663 14.471 1.00 24.14 N ATOM 995 CA PRO A 68 3.654 -8.371 15.562 1.00 52.21 C ATOM 996 C PRO A 68 3.215 -9.827 15.669 1.00 73.12 C ATOM 997 O PRO A 68 2.024 -10.121 15.777 1.00 0.45 O ATOM 998 CB PRO A 68 3.229 -7.591 16.809 1.00 72.23 C ATOM 999 CG PRO A 68 1.929 -6.964 16.439 1.00 61.13 C ATOM 1000 CD PRO A 68 2.020 -6.660 14.969 1.00 74.33 C ATOM 0 HA PRO A 68 4.733 -8.410 15.414 1.00 52.21 H new ATOM 0 HB2 PRO A 68 3.120 -8.250 17.670 1.00 72.23 H new ATOM 0 HB3 PRO A 68 3.970 -6.838 17.076 1.00 72.23 H new ATOM 0 HG2 PRO A 68 1.098 -7.637 16.648 1.00 61.13 H new ATOM 0 HG3 PRO A 68 1.756 -6.055 17.016 1.00 61.13 H new ATOM 0 HD2 PRO A 68 1.051 -6.751 14.479 1.00 74.33 H new ATOM 0 HD3 PRO A 68 2.373 -5.645 14.790 1.00 74.33 H new ATOM 1008 N VAL A 69 4.184 -10.737 15.638 1.00 53.44 N ATOM 1009 CA VAL A 69 3.897 -12.163 15.733 1.00 51.13 C ATOM 1010 C VAL A 69 4.817 -12.842 16.741 1.00 74.40 C ATOM 1011 O VAL A 69 5.797 -12.254 17.195 1.00 23.33 O ATOM 1012 CB VAL A 69 4.048 -12.858 14.367 1.00 61.14 C ATOM 1013 CG1 VAL A 69 3.029 -12.316 13.376 1.00 72.51 C ATOM 1014 CG2 VAL A 69 5.463 -12.686 13.836 1.00 62.34 C ATOM 0 H VAL A 69 5.175 -10.511 15.548 1.00 53.44 H new ATOM 0 HA VAL A 69 2.864 -12.257 16.067 1.00 51.13 H new ATOM 0 HB VAL A 69 3.860 -13.924 14.498 1.00 61.14 H new ATOM 0 HG11 VAL A 69 3.151 -12.819 12.417 1.00 72.51 H new ATOM 0 HG12 VAL A 69 2.023 -12.495 13.754 1.00 72.51 H new ATOM 0 HG13 VAL A 69 3.182 -11.245 13.246 1.00 72.51 H new ATOM 0 HG21 VAL A 69 5.552 -13.183 12.870 1.00 62.34 H new ATOM 0 HG22 VAL A 69 5.681 -11.624 13.719 1.00 62.34 H new ATOM 0 HG23 VAL A 69 6.171 -13.127 14.538 1.00 62.34 H new ATOM 1024 N GLU A 70 4.493 -14.085 17.086 1.00 54.31 N ATOM 1025 CA GLU A 70 5.290 -14.844 18.041 1.00 25.23 C ATOM 1026 C GLU A 70 5.472 -16.285 17.574 1.00 25.41 C ATOM 1027 O GLU A 70 4.524 -17.071 17.567 1.00 61.24 O ATOM 1028 CB GLU A 70 4.630 -14.823 19.421 1.00 20.54 C ATOM 1029 CG GLU A 70 5.284 -15.760 20.423 1.00 32.42 C ATOM 1030 CD GLU A 70 4.570 -15.774 21.761 1.00 60.20 C ATOM 1031 OE1 GLU A 70 3.476 -15.179 21.855 1.00 31.31 O ATOM 1032 OE2 GLU A 70 5.105 -16.379 22.713 1.00 30.23 O ATOM 0 H GLU A 70 3.685 -14.586 16.718 1.00 54.31 H new ATOM 0 HA GLU A 70 6.272 -14.376 18.109 1.00 25.23 H new ATOM 0 HB2 GLU A 70 4.660 -13.807 19.813 1.00 20.54 H new ATOM 0 HB3 GLU A 70 3.579 -15.093 19.316 1.00 20.54 H new ATOM 0 HG2 GLU A 70 5.300 -16.770 20.013 1.00 32.42 H new ATOM 0 HG3 GLU A 70 6.321 -15.460 20.572 1.00 32.42 H new ATOM 1039 N CYS A 71 6.696 -16.625 17.185 1.00 43.43 N ATOM 1040 CA CYS A 71 7.003 -17.971 16.714 1.00 5.32 C ATOM 1041 C CYS A 71 8.124 -18.593 17.540 1.00 5.34 C ATOM 1042 O CYS A 71 8.792 -17.907 18.314 1.00 50.23 O ATOM 1043 CB CYS A 71 7.399 -17.939 15.237 1.00 21.33 C ATOM 1044 SG CYS A 71 8.568 -16.626 14.814 1.00 71.31 S ATOM 0 H CYS A 71 7.492 -15.987 17.186 1.00 43.43 H new ATOM 0 HA CYS A 71 6.108 -18.583 16.830 1.00 5.32 H new ATOM 0 HB2 CYS A 71 7.836 -18.901 14.968 1.00 21.33 H new ATOM 0 HB3 CYS A 71 6.500 -17.818 14.633 1.00 21.33 H new ATOM 0 HG CYS A 71 8.899 -15.976 15.890 1.00 71.31 H new ATOM 1050 N GLU A 72 8.324 -19.896 17.372 1.00 74.32 N ATOM 1051 CA GLU A 72 9.362 -20.611 18.105 1.00 44.35 C ATOM 1052 C GLU A 72 10.464 -21.087 17.162 1.00 54.04 C ATOM 1053 O GLU A 72 10.188 -21.655 16.105 1.00 22.45 O ATOM 1054 CB GLU A 72 8.762 -21.805 18.850 1.00 44.31 C ATOM 1055 CG GLU A 72 7.760 -22.595 18.026 1.00 32.22 C ATOM 1056 CD GLU A 72 7.110 -23.715 18.816 1.00 54.43 C ATOM 1057 OE1 GLU A 72 7.369 -23.811 20.033 1.00 11.03 O ATOM 1058 OE2 GLU A 72 6.341 -24.494 18.215 1.00 33.41 O ATOM 0 H GLU A 72 7.781 -20.478 16.735 1.00 74.32 H new ATOM 0 HA GLU A 72 9.799 -19.923 18.829 1.00 44.35 H new ATOM 0 HB2 GLU A 72 9.567 -22.470 19.162 1.00 44.31 H new ATOM 0 HB3 GLU A 72 8.273 -21.449 19.757 1.00 44.31 H new ATOM 0 HG2 GLU A 72 6.988 -21.921 17.656 1.00 32.22 H new ATOM 0 HG3 GLU A 72 8.262 -23.014 17.154 1.00 32.22 H new ATOM 1065 N ALA A 73 11.712 -20.850 17.552 1.00 52.15 N ATOM 1066 CA ALA A 73 12.855 -21.255 16.743 1.00 72.21 C ATOM 1067 C ALA A 73 13.284 -22.680 17.075 1.00 61.44 C ATOM 1068 O ALA A 73 13.748 -22.958 18.181 1.00 21.20 O ATOM 1069 CB ALA A 73 14.014 -20.292 16.947 1.00 3.44 C ATOM 0 H ALA A 73 11.957 -20.380 18.423 1.00 52.15 H new ATOM 0 HA ALA A 73 12.555 -21.228 15.695 1.00 72.21 H new ATOM 0 HB1 ALA A 73 14.860 -20.607 16.337 1.00 3.44 H new ATOM 0 HB2 ALA A 73 13.709 -19.288 16.653 1.00 3.44 H new ATOM 0 HB3 ALA A 73 14.305 -20.290 17.997 1.00 3.44 H new ATOM 1075 N HIS A 74 13.126 -23.581 16.110 1.00 52.02 N ATOM 1076 CA HIS A 74 13.497 -24.979 16.300 1.00 3.41 C ATOM 1077 C HIS A 74 14.810 -25.294 15.589 1.00 53.42 C ATOM 1078 O HIS A 74 14.940 -25.081 14.383 1.00 20.41 O ATOM 1079 CB HIS A 74 12.390 -25.898 15.783 1.00 41.51 C ATOM 1080 CG HIS A 74 11.127 -25.823 16.584 1.00 53.31 C ATOM 1081 ND1 HIS A 74 11.071 -26.114 17.930 1.00 30.25 N ATOM 1082 CD2 HIS A 74 9.867 -25.485 16.221 1.00 21.20 C ATOM 1083 CE1 HIS A 74 9.831 -25.961 18.361 1.00 45.01 C ATOM 1084 NE2 HIS A 74 9.081 -25.579 17.343 1.00 22.21 N ATOM 0 H HIS A 74 12.744 -23.368 15.189 1.00 52.02 H new ATOM 0 HA HIS A 74 13.632 -25.151 17.368 1.00 3.41 H new ATOM 0 HB2 HIS A 74 12.169 -25.640 14.747 1.00 41.51 H new ATOM 0 HB3 HIS A 74 12.752 -26.926 15.786 1.00 41.51 H new ATOM 0 HD1 HIS A 74 11.863 -26.403 18.504 1.00 30.25 H new ATOM 0 HD2 HIS A 74 9.541 -25.195 15.233 1.00 21.20 H new ATOM 0 HE1 HIS A 74 9.489 -26.121 19.373 1.00 45.01 H new ATOM 1092 N ASP A 75 15.779 -25.800 16.343 1.00 0.31 N ATOM 1093 CA ASP A 75 17.081 -26.144 15.785 1.00 65.22 C ATOM 1094 C ASP A 75 16.928 -27.042 14.561 1.00 51.31 C ATOM 1095 O ASP A 75 17.780 -27.047 13.672 1.00 12.03 O ATOM 1096 CB ASP A 75 17.944 -26.841 16.839 1.00 52.24 C ATOM 1097 CG ASP A 75 18.138 -25.993 18.080 1.00 31.14 C ATOM 1098 OD1 ASP A 75 17.964 -24.760 17.990 1.00 10.53 O ATOM 1099 OD2 ASP A 75 18.463 -26.563 19.143 1.00 72.44 O ATOM 0 H ASP A 75 15.687 -25.981 17.343 1.00 0.31 H new ATOM 0 HA ASP A 75 17.572 -25.221 15.477 1.00 65.22 H new ATOM 0 HB2 ASP A 75 17.479 -27.787 17.118 1.00 52.24 H new ATOM 0 HB3 ASP A 75 18.917 -27.078 16.409 1.00 52.24 H new ATOM 1104 N TRP A 76 15.838 -27.799 14.523 1.00 70.54 N ATOM 1105 CA TRP A 76 15.574 -28.702 13.408 1.00 73.21 C ATOM 1106 C TRP A 76 14.181 -29.312 13.520 1.00 72.12 C ATOM 1107 O TRP A 76 13.695 -29.576 14.620 1.00 12.50 O ATOM 1108 CB TRP A 76 16.627 -29.810 13.362 1.00 70.44 C ATOM 1109 CG TRP A 76 16.580 -30.725 14.548 1.00 11.43 C ATOM 1110 CD1 TRP A 76 15.703 -31.750 14.759 1.00 72.14 C ATOM 1111 CD2 TRP A 76 17.446 -30.694 15.688 1.00 34.33 C ATOM 1112 NE1 TRP A 76 15.971 -32.359 15.961 1.00 61.13 N ATOM 1113 CE2 TRP A 76 17.036 -31.731 16.550 1.00 41.30 C ATOM 1114 CE3 TRP A 76 18.528 -29.894 16.064 1.00 32.11 C ATOM 1115 CZ2 TRP A 76 17.671 -31.984 17.763 1.00 60.42 C ATOM 1116 CZ3 TRP A 76 19.157 -30.147 17.268 1.00 33.03 C ATOM 1117 CH2 TRP A 76 18.728 -31.185 18.106 1.00 73.43 C ATOM 0 H TRP A 76 15.123 -27.806 15.250 1.00 70.54 H new ATOM 0 HA TRP A 76 15.624 -28.124 12.485 1.00 73.21 H new ATOM 0 HB2 TRP A 76 16.487 -30.397 12.454 1.00 70.44 H new ATOM 0 HB3 TRP A 76 17.617 -29.358 13.300 1.00 70.44 H new ATOM 0 HD1 TRP A 76 14.914 -32.040 14.080 1.00 72.14 H new ATOM 0 HE1 TRP A 76 15.460 -33.151 16.351 1.00 61.13 H new ATOM 0 HE3 TRP A 76 18.867 -29.092 15.425 1.00 32.11 H new ATOM 0 HZ2 TRP A 76 17.341 -32.783 18.411 1.00 60.42 H new ATOM 0 HZ3 TRP A 76 19.994 -29.534 17.568 1.00 33.03 H new ATOM 0 HH2 TRP A 76 19.241 -31.358 19.040 1.00 73.43 H new ATOM 1128 N TYR A 77 13.543 -29.534 12.376 1.00 65.42 N ATOM 1129 CA TYR A 77 12.205 -30.112 12.346 1.00 11.33 C ATOM 1130 C TYR A 77 12.053 -31.075 11.173 1.00 31.44 C ATOM 1131 O TYR A 77 12.629 -30.886 10.102 1.00 25.12 O ATOM 1132 CB TYR A 77 11.152 -29.006 12.252 1.00 30.11 C ATOM 1133 CG TYR A 77 10.172 -29.003 13.404 1.00 64.21 C ATOM 1134 CD1 TYR A 77 10.599 -28.756 14.703 1.00 33.22 C ATOM 1135 CD2 TYR A 77 8.821 -29.248 13.193 1.00 22.24 C ATOM 1136 CE1 TYR A 77 9.708 -28.753 15.759 1.00 74.21 C ATOM 1137 CE2 TYR A 77 7.923 -29.246 14.243 1.00 52.43 C ATOM 1138 CZ TYR A 77 8.371 -28.998 15.524 1.00 53.15 C ATOM 1139 OH TYR A 77 7.479 -28.996 16.572 1.00 41.13 O ATOM 0 H TYR A 77 13.931 -29.322 11.457 1.00 65.42 H new ATOM 0 HA TYR A 77 12.057 -30.669 13.271 1.00 11.33 H new ATOM 0 HB2 TYR A 77 11.655 -28.040 12.211 1.00 30.11 H new ATOM 0 HB3 TYR A 77 10.601 -29.118 11.318 1.00 30.11 H new ATOM 0 HD1 TYR A 77 11.645 -28.563 14.890 1.00 33.22 H new ATOM 0 HD2 TYR A 77 8.467 -29.443 12.192 1.00 22.24 H new ATOM 0 HE1 TYR A 77 10.056 -28.560 16.763 1.00 74.21 H new ATOM 0 HE2 TYR A 77 6.876 -29.438 14.062 1.00 52.43 H new ATOM 0 HH TYR A 77 6.578 -29.184 16.235 1.00 41.13 H new ATOM 1149 N PRO A 78 11.257 -32.135 11.379 1.00 32.12 N ATOM 1150 CA PRO A 78 11.008 -33.150 10.351 1.00 41.11 C ATOM 1151 C PRO A 78 10.163 -32.615 9.201 1.00 54.55 C ATOM 1152 O PRO A 78 9.123 -31.993 9.418 1.00 14.41 O ATOM 1153 CB PRO A 78 10.250 -34.243 11.108 1.00 63.52 C ATOM 1154 CG PRO A 78 9.601 -33.536 12.247 1.00 51.45 C ATOM 1155 CD PRO A 78 10.538 -32.424 12.631 1.00 14.13 C ATOM 0 HA PRO A 78 11.932 -33.496 9.888 1.00 41.11 H new ATOM 0 HB2 PRO A 78 9.511 -34.727 10.469 1.00 63.52 H new ATOM 0 HB3 PRO A 78 10.926 -35.022 11.460 1.00 63.52 H new ATOM 0 HG2 PRO A 78 8.626 -33.143 11.958 1.00 51.45 H new ATOM 0 HG3 PRO A 78 9.436 -34.214 13.084 1.00 51.45 H new ATOM 0 HD2 PRO A 78 9.997 -31.550 12.994 1.00 14.13 H new ATOM 0 HD3 PRO A 78 11.220 -32.729 13.425 1.00 14.13 H new ATOM 1163 N VAL A 79 10.615 -32.860 7.975 1.00 22.30 N ATOM 1164 CA VAL A 79 9.899 -32.404 6.790 1.00 61.12 C ATOM 1165 C VAL A 79 9.538 -33.574 5.881 1.00 23.14 C ATOM 1166 O VAL A 79 10.358 -34.029 5.084 1.00 11.31 O ATOM 1167 CB VAL A 79 10.731 -31.384 5.989 1.00 31.43 C ATOM 1168 CG1 VAL A 79 12.180 -31.836 5.891 1.00 31.54 C ATOM 1169 CG2 VAL A 79 10.133 -31.179 4.606 1.00 62.15 C ATOM 0 H VAL A 79 11.475 -33.372 7.777 1.00 22.30 H new ATOM 0 HA VAL A 79 8.985 -31.923 7.139 1.00 61.12 H new ATOM 0 HB VAL A 79 10.709 -30.429 6.515 1.00 31.43 H new ATOM 0 HG11 VAL A 79 12.752 -31.103 5.322 1.00 31.54 H new ATOM 0 HG12 VAL A 79 12.601 -31.927 6.892 1.00 31.54 H new ATOM 0 HG13 VAL A 79 12.227 -32.802 5.389 1.00 31.54 H new ATOM 0 HG21 VAL A 79 10.733 -30.456 4.054 1.00 62.15 H new ATOM 0 HG22 VAL A 79 10.124 -32.128 4.069 1.00 62.15 H new ATOM 0 HG23 VAL A 79 9.113 -30.806 4.702 1.00 62.15 H new ATOM 1179 N GLU A 80 8.306 -34.056 6.008 1.00 30.50 N ATOM 1180 CA GLU A 80 7.837 -35.175 5.198 1.00 41.41 C ATOM 1181 C GLU A 80 7.556 -34.728 3.766 1.00 74.51 C ATOM 1182 O GLU A 80 6.401 -34.625 3.353 1.00 30.43 O ATOM 1183 CB GLU A 80 6.575 -35.784 5.811 1.00 13.34 C ATOM 1184 CG GLU A 80 6.658 -35.969 7.317 1.00 24.42 C ATOM 1185 CD GLU A 80 5.877 -34.917 8.079 1.00 11.31 C ATOM 1186 OE1 GLU A 80 4.631 -35.002 8.099 1.00 20.40 O ATOM 1187 OE2 GLU A 80 6.510 -34.008 8.655 1.00 43.31 O ATOM 0 H GLU A 80 7.615 -33.690 6.663 1.00 30.50 H new ATOM 0 HA GLU A 80 8.622 -35.931 5.178 1.00 41.41 H new ATOM 0 HB2 GLU A 80 5.723 -35.145 5.578 1.00 13.34 H new ATOM 0 HB3 GLU A 80 6.385 -36.751 5.345 1.00 13.34 H new ATOM 0 HG2 GLU A 80 6.280 -36.957 7.579 1.00 24.42 H new ATOM 0 HG3 GLU A 80 7.703 -35.935 7.626 1.00 24.42 H new ATOM 1194 N GLU A 81 8.620 -34.465 3.014 1.00 11.13 N ATOM 1195 CA GLU A 81 8.487 -34.029 1.629 1.00 1.53 C ATOM 1196 C GLU A 81 7.458 -32.908 1.508 1.00 32.52 C ATOM 1197 O GLU A 81 6.267 -33.161 1.324 1.00 15.20 O ATOM 1198 CB GLU A 81 8.085 -35.205 0.737 1.00 14.41 C ATOM 1199 CG GLU A 81 7.835 -34.813 -0.710 1.00 31.43 C ATOM 1200 CD GLU A 81 6.388 -35.000 -1.123 1.00 71.11 C ATOM 1201 OE1 GLU A 81 5.924 -36.159 -1.156 1.00 24.00 O ATOM 1202 OE2 GLU A 81 5.719 -33.986 -1.414 1.00 21.14 O ATOM 0 H GLU A 81 9.583 -34.546 3.340 1.00 11.13 H new ATOM 0 HA GLU A 81 9.454 -33.648 1.300 1.00 1.53 H new ATOM 0 HB2 GLU A 81 8.870 -35.960 0.770 1.00 14.41 H new ATOM 0 HB3 GLU A 81 7.183 -35.665 1.141 1.00 14.41 H new ATOM 0 HG2 GLU A 81 8.118 -33.770 -0.854 1.00 31.43 H new ATOM 0 HG3 GLU A 81 8.475 -35.410 -1.360 1.00 31.43 H new ATOM 1209 N THR A 82 7.926 -31.669 1.613 1.00 12.55 N ATOM 1210 CA THR A 82 7.048 -30.509 1.518 1.00 74.42 C ATOM 1211 C THR A 82 7.843 -29.210 1.580 1.00 31.44 C ATOM 1212 O THR A 82 9.031 -29.215 1.901 1.00 61.13 O ATOM 1213 CB THR A 82 5.995 -30.508 2.642 1.00 74.10 C ATOM 1214 OG1 THR A 82 5.094 -29.409 2.468 1.00 12.41 O ATOM 1215 CG2 THR A 82 6.660 -30.414 4.007 1.00 61.03 C ATOM 0 H THR A 82 8.909 -31.442 1.764 1.00 12.55 H new ATOM 0 HA THR A 82 6.541 -30.575 0.555 1.00 74.42 H new ATOM 0 HB THR A 82 5.440 -31.444 2.590 1.00 74.10 H new ATOM 0 HG1 THR A 82 4.427 -29.416 3.186 1.00 12.41 H new ATOM 0 HG21 THR A 82 5.896 -30.415 4.785 1.00 61.03 H new ATOM 0 HG22 THR A 82 7.323 -31.268 4.148 1.00 61.03 H new ATOM 0 HG23 THR A 82 7.238 -29.492 4.067 1.00 61.03 H new ATOM 1223 N GLN A 83 7.180 -28.100 1.273 1.00 35.42 N ATOM 1224 CA GLN A 83 7.826 -26.794 1.295 1.00 42.20 C ATOM 1225 C GLN A 83 8.800 -26.649 0.130 1.00 11.21 C ATOM 1226 O GLN A 83 8.555 -25.887 -0.805 1.00 41.34 O ATOM 1227 CB GLN A 83 8.563 -26.588 2.620 1.00 40.04 C ATOM 1228 CG GLN A 83 8.803 -25.126 2.962 1.00 73.42 C ATOM 1229 CD GLN A 83 9.872 -24.492 2.094 1.00 15.53 C ATOM 1230 OE1 GLN A 83 11.045 -24.856 2.169 1.00 4.21 O ATOM 1231 NE2 GLN A 83 9.470 -23.536 1.264 1.00 22.10 N ATOM 0 H GLN A 83 6.196 -28.079 1.006 1.00 35.42 H new ATOM 0 HA GLN A 83 7.053 -26.032 1.195 1.00 42.20 H new ATOM 0 HB2 GLN A 83 7.988 -27.050 3.422 1.00 40.04 H new ATOM 0 HB3 GLN A 83 9.522 -27.105 2.577 1.00 40.04 H new ATOM 0 HG2 GLN A 83 7.871 -24.572 2.847 1.00 73.42 H new ATOM 0 HG3 GLN A 83 9.095 -25.045 4.009 1.00 73.42 H new ATOM 0 HE21 GLN A 83 8.487 -23.266 1.235 1.00 22.10 H new ATOM 0 HE22 GLN A 83 10.144 -23.072 0.656 1.00 22.10 H new ATOM 1240 N TYR A 84 9.904 -27.384 0.194 1.00 63.02 N ATOM 1241 CA TYR A 84 10.917 -27.335 -0.854 1.00 74.15 C ATOM 1242 C TYR A 84 12.017 -28.361 -0.598 1.00 13.53 C ATOM 1243 O TYR A 84 13.174 -28.150 -0.960 1.00 44.12 O ATOM 1244 CB TYR A 84 11.521 -25.933 -0.943 1.00 65.04 C ATOM 1245 CG TYR A 84 11.756 -25.464 -2.361 1.00 41.44 C ATOM 1246 CD1 TYR A 84 12.847 -25.917 -3.093 1.00 12.01 C ATOM 1247 CD2 TYR A 84 10.886 -24.567 -2.970 1.00 62.20 C ATOM 1248 CE1 TYR A 84 13.065 -25.490 -4.388 1.00 64.03 C ATOM 1249 CE2 TYR A 84 11.096 -24.136 -4.266 1.00 10.04 C ATOM 1250 CZ TYR A 84 12.187 -24.600 -4.970 1.00 42.23 C ATOM 1251 OH TYR A 84 12.401 -24.173 -6.261 1.00 74.21 O ATOM 0 H TYR A 84 10.121 -28.021 0.961 1.00 63.02 H new ATOM 0 HA TYR A 84 10.435 -27.576 -1.801 1.00 74.15 H new ATOM 0 HB2 TYR A 84 10.858 -25.228 -0.441 1.00 65.04 H new ATOM 0 HB3 TYR A 84 12.468 -25.919 -0.403 1.00 65.04 H new ATOM 0 HD1 TYR A 84 13.536 -26.615 -2.641 1.00 12.01 H new ATOM 0 HD2 TYR A 84 10.031 -24.201 -2.421 1.00 62.20 H new ATOM 0 HE1 TYR A 84 13.919 -25.851 -4.942 1.00 64.03 H new ATOM 0 HE2 TYR A 84 10.410 -23.440 -4.725 1.00 10.04 H new ATOM 0 HH TYR A 84 11.691 -23.549 -6.521 1.00 74.21 H new ATOM 1261 N TYR A 85 11.646 -29.471 0.030 1.00 61.25 N ATOM 1262 CA TYR A 85 12.600 -30.530 0.337 1.00 3.22 C ATOM 1263 C TYR A 85 11.880 -31.835 0.662 1.00 61.03 C ATOM 1264 O TYR A 85 10.840 -31.853 1.321 1.00 62.15 O ATOM 1265 CB TYR A 85 13.489 -30.119 1.513 1.00 54.34 C ATOM 1266 CG TYR A 85 14.959 -30.382 1.281 1.00 24.23 C ATOM 1267 CD1 TYR A 85 15.692 -29.608 0.390 1.00 40.11 C ATOM 1268 CD2 TYR A 85 15.616 -31.406 1.953 1.00 43.21 C ATOM 1269 CE1 TYR A 85 17.036 -29.845 0.175 1.00 72.34 C ATOM 1270 CE2 TYR A 85 16.960 -31.649 1.745 1.00 20.41 C ATOM 1271 CZ TYR A 85 17.665 -30.867 0.855 1.00 44.31 C ATOM 1272 OH TYR A 85 19.004 -31.107 0.644 1.00 72.10 O ATOM 0 H TYR A 85 10.692 -29.661 0.336 1.00 61.25 H new ATOM 0 HA TYR A 85 13.223 -30.689 -0.543 1.00 3.22 H new ATOM 0 HB2 TYR A 85 13.345 -29.057 1.712 1.00 54.34 H new ATOM 0 HB3 TYR A 85 13.169 -30.657 2.405 1.00 54.34 H new ATOM 0 HD1 TYR A 85 15.203 -28.807 -0.144 1.00 40.11 H new ATOM 0 HD2 TYR A 85 15.067 -32.022 2.649 1.00 43.21 H new ATOM 0 HE1 TYR A 85 17.591 -29.234 -0.521 1.00 72.34 H new ATOM 0 HE2 TYR A 85 17.456 -32.448 2.277 1.00 20.41 H new ATOM 0 HH TYR A 85 19.293 -31.860 1.201 1.00 72.10 H new ATOM 1282 N PRO A 86 12.446 -32.955 0.189 1.00 61.33 N ATOM 1283 CA PRO A 86 11.877 -34.287 0.416 1.00 12.22 C ATOM 1284 C PRO A 86 11.993 -34.726 1.872 1.00 50.02 C ATOM 1285 O PRO A 86 12.458 -33.969 2.724 1.00 24.44 O ATOM 1286 CB PRO A 86 12.721 -35.192 -0.484 1.00 71.14 C ATOM 1287 CG PRO A 86 14.018 -34.475 -0.634 1.00 11.42 C ATOM 1288 CD PRO A 86 13.686 -33.008 -0.604 1.00 72.32 C ATOM 0 HA PRO A 86 10.810 -34.318 0.194 1.00 12.22 H new ATOM 0 HB2 PRO A 86 12.862 -36.175 -0.036 1.00 71.14 H new ATOM 0 HB3 PRO A 86 12.241 -35.348 -1.450 1.00 71.14 H new ATOM 0 HG2 PRO A 86 14.704 -34.736 0.172 1.00 11.42 H new ATOM 0 HG3 PRO A 86 14.507 -34.745 -1.570 1.00 11.42 H new ATOM 0 HD2 PRO A 86 14.483 -32.425 -0.143 1.00 72.32 H new ATOM 0 HD3 PRO A 86 13.539 -32.609 -1.607 1.00 72.32 H new ATOM 1296 N LYS A 87 11.567 -35.953 2.150 1.00 24.54 N ATOM 1297 CA LYS A 87 11.625 -36.495 3.503 1.00 71.21 C ATOM 1298 C LYS A 87 13.021 -36.331 4.096 1.00 72.54 C ATOM 1299 O LYS A 87 13.986 -36.919 3.607 1.00 25.11 O ATOM 1300 CB LYS A 87 11.231 -37.974 3.499 1.00 21.02 C ATOM 1301 CG LYS A 87 10.290 -38.356 4.629 1.00 52.45 C ATOM 1302 CD LYS A 87 8.934 -38.795 4.100 1.00 3.54 C ATOM 1303 CE LYS A 87 8.274 -37.697 3.280 1.00 34.04 C ATOM 1304 NZ LYS A 87 8.018 -38.130 1.879 1.00 52.44 N ATOM 0 H LYS A 87 11.178 -36.592 1.456 1.00 24.54 H new ATOM 0 HA LYS A 87 10.920 -35.939 4.121 1.00 71.21 H new ATOM 0 HB2 LYS A 87 10.757 -38.213 2.547 1.00 21.02 H new ATOM 0 HB3 LYS A 87 12.133 -38.582 3.567 1.00 21.02 H new ATOM 0 HG2 LYS A 87 10.732 -39.162 5.215 1.00 52.45 H new ATOM 0 HG3 LYS A 87 10.162 -37.507 5.300 1.00 52.45 H new ATOM 0 HD2 LYS A 87 9.053 -39.688 3.486 1.00 3.54 H new ATOM 0 HD3 LYS A 87 8.287 -39.066 4.934 1.00 3.54 H new ATOM 0 HE2 LYS A 87 7.333 -37.409 3.749 1.00 34.04 H new ATOM 0 HE3 LYS A 87 8.912 -36.813 3.276 1.00 34.04 H new ATOM 0 HZ1 LYS A 87 7.199 -37.613 1.500 1.00 52.44 H new ATOM 0 HZ2 LYS A 87 8.855 -37.928 1.295 1.00 52.44 H new ATOM 0 HZ3 LYS A 87 7.822 -39.151 1.862 1.00 52.44 H new ATOM 1318 N HIS A 88 13.120 -35.531 5.152 1.00 41.40 N ATOM 1319 CA HIS A 88 14.398 -35.292 5.813 1.00 43.33 C ATOM 1320 C HIS A 88 14.230 -34.341 6.994 1.00 50.21 C ATOM 1321 O HIS A 88 13.111 -34.079 7.437 1.00 5.24 O ATOM 1322 CB HIS A 88 15.410 -34.717 4.821 1.00 72.15 C ATOM 1323 CG HIS A 88 16.765 -35.348 4.914 1.00 70.04 C ATOM 1324 ND1 HIS A 88 16.978 -36.701 4.751 1.00 43.53 N ATOM 1325 CD2 HIS A 88 17.981 -34.803 5.153 1.00 73.02 C ATOM 1326 CE1 HIS A 88 18.266 -36.961 4.887 1.00 2.54 C ATOM 1327 NE2 HIS A 88 18.897 -35.826 5.131 1.00 13.25 N ATOM 0 H HIS A 88 12.331 -35.037 5.569 1.00 41.40 H new ATOM 0 HA HIS A 88 14.769 -36.246 6.187 1.00 43.33 H new ATOM 0 HB2 HIS A 88 15.027 -34.846 3.809 1.00 72.15 H new ATOM 0 HB3 HIS A 88 15.505 -33.645 4.992 1.00 72.15 H new ATOM 0 HD2 HIS A 88 18.192 -33.758 5.328 1.00 73.02 H new ATOM 0 HE1 HIS A 88 18.725 -37.936 4.812 1.00 2.54 H new ATOM 0 HE2 HIS A 88 19.901 -35.726 5.279 1.00 13.25 H new ATOM 1335 N ILE A 89 15.347 -33.828 7.499 1.00 62.35 N ATOM 1336 CA ILE A 89 15.322 -32.907 8.628 1.00 44.35 C ATOM 1337 C ILE A 89 15.983 -31.580 8.269 1.00 63.11 C ATOM 1338 O ILE A 89 17.101 -31.552 7.754 1.00 75.03 O ATOM 1339 CB ILE A 89 16.031 -33.504 9.858 1.00 73.34 C ATOM 1340 CG1 ILE A 89 15.538 -34.930 10.115 1.00 51.23 C ATOM 1341 CG2 ILE A 89 15.798 -32.629 11.080 1.00 32.01 C ATOM 1342 CD1 ILE A 89 14.044 -35.022 10.334 1.00 21.42 C ATOM 0 H ILE A 89 16.281 -34.035 7.144 1.00 62.35 H new ATOM 0 HA ILE A 89 14.274 -32.735 8.871 1.00 44.35 H new ATOM 0 HB ILE A 89 17.102 -33.540 9.660 1.00 73.34 H new ATOM 0 HG12 ILE A 89 15.812 -35.559 9.268 1.00 51.23 H new ATOM 0 HG13 ILE A 89 16.051 -35.331 10.989 1.00 51.23 H new ATOM 0 HG21 ILE A 89 16.305 -33.064 11.941 1.00 32.01 H new ATOM 0 HG22 ILE A 89 16.192 -31.630 10.893 1.00 32.01 H new ATOM 0 HG23 ILE A 89 14.729 -32.565 11.283 1.00 32.01 H new ATOM 0 HD11 ILE A 89 13.765 -36.061 10.510 1.00 21.42 H new ATOM 0 HD12 ILE A 89 13.765 -34.420 11.199 1.00 21.42 H new ATOM 0 HD13 ILE A 89 13.523 -34.651 9.451 1.00 21.42 H new ATOM 1354 N GLN A 90 15.286 -30.483 8.547 1.00 74.52 N ATOM 1355 CA GLN A 90 15.806 -29.153 8.254 1.00 31.12 C ATOM 1356 C GLN A 90 16.448 -28.535 9.492 1.00 31.40 C ATOM 1357 O GLN A 90 16.433 -29.126 10.572 1.00 34.40 O ATOM 1358 CB GLN A 90 14.686 -28.247 7.739 1.00 5.44 C ATOM 1359 CG GLN A 90 14.456 -28.356 6.241 1.00 50.42 C ATOM 1360 CD GLN A 90 14.487 -27.009 5.546 1.00 3.40 C ATOM 1361 OE1 GLN A 90 15.416 -26.222 5.733 1.00 61.11 O ATOM 1362 NE2 GLN A 90 13.469 -26.735 4.738 1.00 24.02 N ATOM 0 H GLN A 90 14.360 -30.489 8.975 1.00 74.52 H new ATOM 0 HA GLN A 90 16.569 -29.250 7.482 1.00 31.12 H new ATOM 0 HB2 GLN A 90 13.761 -28.495 8.259 1.00 5.44 H new ATOM 0 HB3 GLN A 90 14.924 -27.213 7.987 1.00 5.44 H new ATOM 0 HG2 GLN A 90 15.218 -29.002 5.806 1.00 50.42 H new ATOM 0 HG3 GLN A 90 13.493 -28.832 6.059 1.00 50.42 H new ATOM 0 HE21 GLN A 90 12.720 -27.416 4.612 1.00 24.02 H new ATOM 0 HE22 GLN A 90 13.436 -25.844 4.243 1.00 24.02 H new ATOM 1371 N TYR A 91 17.012 -27.344 9.328 1.00 54.14 N ATOM 1372 CA TYR A 91 17.662 -26.647 10.431 1.00 32.21 C ATOM 1373 C TYR A 91 17.312 -25.162 10.419 1.00 22.23 C ATOM 1374 O TYR A 91 17.104 -24.571 9.361 1.00 43.41 O ATOM 1375 CB TYR A 91 19.179 -26.826 10.352 1.00 72.12 C ATOM 1376 CG TYR A 91 19.605 -28.228 9.979 1.00 35.21 C ATOM 1377 CD1 TYR A 91 19.317 -29.306 10.808 1.00 52.13 C ATOM 1378 CD2 TYR A 91 20.295 -28.475 8.799 1.00 21.42 C ATOM 1379 CE1 TYR A 91 19.704 -30.589 10.472 1.00 43.32 C ATOM 1380 CE2 TYR A 91 20.685 -29.755 8.454 1.00 2.14 C ATOM 1381 CZ TYR A 91 20.388 -30.808 9.294 1.00 73.10 C ATOM 1382 OH TYR A 91 20.776 -32.084 8.955 1.00 72.02 O ATOM 0 H TYR A 91 17.032 -26.841 8.441 1.00 54.14 H new ATOM 0 HA TYR A 91 17.300 -27.079 11.364 1.00 32.21 H new ATOM 0 HB2 TYR A 91 19.581 -26.126 9.620 1.00 72.12 H new ATOM 0 HB3 TYR A 91 19.618 -26.566 11.315 1.00 72.12 H new ATOM 0 HD1 TYR A 91 18.781 -29.138 11.731 1.00 52.13 H new ATOM 0 HD2 TYR A 91 20.531 -27.653 8.140 1.00 21.42 H new ATOM 0 HE1 TYR A 91 19.472 -31.416 11.128 1.00 43.32 H new ATOM 0 HE2 TYR A 91 21.219 -29.930 7.532 1.00 2.14 H new ATOM 0 HH TYR A 91 21.246 -32.065 8.095 1.00 72.02 H new ATOM 1392 N ASN A 92 17.250 -24.566 11.606 1.00 62.14 N ATOM 1393 CA ASN A 92 16.926 -23.150 11.733 1.00 1.14 C ATOM 1394 C ASN A 92 15.561 -22.847 11.123 1.00 61.00 C ATOM 1395 O ASN A 92 15.464 -22.176 10.095 1.00 54.23 O ATOM 1396 CB ASN A 92 18.001 -22.296 11.057 1.00 74.43 C ATOM 1397 CG ASN A 92 19.364 -22.960 11.077 1.00 71.44 C ATOM 1398 OD1 ASN A 92 20.065 -22.933 12.088 1.00 22.11 O ATOM 1399 ND2 ASN A 92 19.746 -23.561 9.956 1.00 73.14 N ATOM 0 H ASN A 92 17.420 -25.041 12.492 1.00 62.14 H new ATOM 0 HA ASN A 92 16.892 -22.905 12.795 1.00 1.14 H new ATOM 0 HB2 ASN A 92 17.710 -22.101 10.025 1.00 74.43 H new ATOM 0 HB3 ASN A 92 18.063 -21.330 11.559 1.00 74.43 H new ATOM 0 HD21 ASN A 92 20.653 -24.025 9.910 1.00 73.14 H new ATOM 0 HD22 ASN A 92 19.132 -23.559 9.141 1.00 73.14 H new ATOM 1406 N LEU A 93 14.509 -23.346 11.763 1.00 3.52 N ATOM 1407 CA LEU A 93 13.149 -23.128 11.284 1.00 35.13 C ATOM 1408 C LEU A 93 12.277 -22.520 12.378 1.00 11.14 C ATOM 1409 O LEU A 93 12.421 -22.849 13.557 1.00 74.44 O ATOM 1410 CB LEU A 93 12.539 -24.446 10.805 1.00 71.54 C ATOM 1411 CG LEU A 93 13.315 -25.188 9.716 1.00 41.03 C ATOM 1412 CD1 LEU A 93 12.464 -26.295 9.114 1.00 62.52 C ATOM 1413 CD2 LEU A 93 13.775 -24.220 8.636 1.00 44.24 C ATOM 0 H LEU A 93 14.572 -23.904 12.615 1.00 3.52 H new ATOM 0 HA LEU A 93 13.192 -22.429 10.449 1.00 35.13 H new ATOM 0 HB2 LEU A 93 12.435 -25.108 11.664 1.00 71.54 H new ATOM 0 HB3 LEU A 93 11.534 -24.245 10.434 1.00 71.54 H new ATOM 0 HG LEU A 93 14.196 -25.641 10.170 1.00 41.03 H new ATOM 0 HD11 LEU A 93 13.033 -26.812 8.341 1.00 62.52 H new ATOM 0 HD12 LEU A 93 12.184 -27.004 9.894 1.00 62.52 H new ATOM 0 HD13 LEU A 93 11.564 -25.864 8.675 1.00 62.52 H new ATOM 0 HD21 LEU A 93 14.326 -24.765 7.869 1.00 44.24 H new ATOM 0 HD22 LEU A 93 12.907 -23.738 8.186 1.00 44.24 H new ATOM 0 HD23 LEU A 93 14.422 -23.463 9.078 1.00 44.24 H new ATOM 1425 N LEU A 94 11.372 -21.632 11.981 1.00 32.44 N ATOM 1426 CA LEU A 94 10.474 -20.979 12.928 1.00 61.31 C ATOM 1427 C LEU A 94 9.035 -21.440 12.720 1.00 51.52 C ATOM 1428 O LEU A 94 8.682 -21.944 11.653 1.00 3.22 O ATOM 1429 CB LEU A 94 10.562 -19.459 12.779 1.00 62.41 C ATOM 1430 CG LEU A 94 11.692 -18.774 13.548 1.00 43.03 C ATOM 1431 CD1 LEU A 94 11.315 -18.603 15.011 1.00 2.20 C ATOM 1432 CD2 LEU A 94 12.984 -19.568 13.417 1.00 1.33 C ATOM 0 H LEU A 94 11.240 -21.348 11.010 1.00 32.44 H new ATOM 0 HA LEU A 94 10.783 -21.257 13.936 1.00 61.31 H new ATOM 0 HB2 LEU A 94 10.675 -19.224 11.721 1.00 62.41 H new ATOM 0 HB3 LEU A 94 9.615 -19.027 13.103 1.00 62.41 H new ATOM 0 HG LEU A 94 11.851 -17.785 13.118 1.00 43.03 H new ATOM 0 HD11 LEU A 94 12.131 -18.114 15.542 1.00 2.20 H new ATOM 0 HD12 LEU A 94 10.416 -17.992 15.086 1.00 2.20 H new ATOM 0 HD13 LEU A 94 11.127 -19.581 15.455 1.00 2.20 H new ATOM 0 HD21 LEU A 94 13.777 -19.066 13.971 1.00 1.33 H new ATOM 0 HD22 LEU A 94 12.838 -20.570 13.821 1.00 1.33 H new ATOM 0 HD23 LEU A 94 13.263 -19.638 12.366 1.00 1.33 H new ATOM 1444 N ILE A 95 8.208 -21.261 13.744 1.00 1.35 N ATOM 1445 CA ILE A 95 6.807 -21.655 13.672 1.00 14.43 C ATOM 1446 C ILE A 95 5.939 -20.764 14.556 1.00 61.25 C ATOM 1447 O ILE A 95 6.225 -20.577 15.737 1.00 2.42 O ATOM 1448 CB ILE A 95 6.612 -23.123 14.094 1.00 10.13 C ATOM 1449 CG1 ILE A 95 6.755 -24.048 12.884 1.00 50.43 C ATOM 1450 CG2 ILE A 95 5.253 -23.309 14.752 1.00 20.24 C ATOM 1451 CD1 ILE A 95 5.609 -23.939 11.902 1.00 22.30 C ATOM 0 H ILE A 95 8.484 -20.845 14.634 1.00 1.35 H new ATOM 0 HA ILE A 95 6.501 -21.541 12.632 1.00 14.43 H new ATOM 0 HB ILE A 95 7.384 -23.382 14.819 1.00 10.13 H new ATOM 0 HG12 ILE A 95 7.688 -23.818 12.369 1.00 50.43 H new ATOM 0 HG13 ILE A 95 6.829 -25.079 13.231 1.00 50.43 H new ATOM 0 HG21 ILE A 95 5.130 -24.352 15.045 1.00 20.24 H new ATOM 0 HG22 ILE A 95 5.186 -22.674 15.635 1.00 20.24 H new ATOM 0 HG23 ILE A 95 4.467 -23.035 14.048 1.00 20.24 H new ATOM 0 HD11 ILE A 95 5.777 -24.623 11.070 1.00 22.30 H new ATOM 0 HD12 ILE A 95 4.676 -24.198 12.402 1.00 22.30 H new ATOM 0 HD13 ILE A 95 5.548 -22.918 11.526 1.00 22.30 H new ATOM 1463 N GLY A 96 4.875 -20.219 13.973 1.00 2.25 N ATOM 1464 CA GLY A 96 3.981 -19.356 14.723 1.00 54.14 C ATOM 1465 C GLY A 96 2.552 -19.428 14.222 1.00 53.41 C ATOM 1466 O GLY A 96 2.290 -19.971 13.150 1.00 61.54 O ATOM 0 H GLY A 96 4.617 -20.360 12.996 1.00 2.25 H new ATOM 0 HA2 GLY A 96 4.008 -19.636 15.776 1.00 54.14 H new ATOM 0 HA3 GLY A 96 4.334 -18.327 14.658 1.00 54.14 H new ATOM 1470 N GLU A 97 1.625 -18.879 15.001 1.00 11.40 N ATOM 1471 CA GLU A 97 0.215 -18.886 14.631 1.00 54.44 C ATOM 1472 C GLU A 97 -0.132 -17.664 13.784 1.00 3.02 C ATOM 1473 O GLU A 97 -0.425 -16.592 14.312 1.00 24.23 O ATOM 1474 CB GLU A 97 -0.664 -18.918 15.883 1.00 73.03 C ATOM 1475 CG GLU A 97 -2.070 -19.433 15.626 1.00 34.51 C ATOM 1476 CD GLU A 97 -3.026 -19.111 16.759 1.00 64.31 C ATOM 1477 OE1 GLU A 97 -2.554 -18.642 17.816 1.00 33.21 O ATOM 1478 OE2 GLU A 97 -4.243 -19.328 16.589 1.00 74.22 O ATOM 0 H GLU A 97 1.825 -18.424 15.892 1.00 11.40 H new ATOM 0 HA GLU A 97 0.026 -19.782 14.040 1.00 54.44 H new ATOM 0 HB2 GLU A 97 -0.188 -19.547 16.635 1.00 73.03 H new ATOM 0 HB3 GLU A 97 -0.725 -17.913 16.300 1.00 73.03 H new ATOM 0 HG2 GLU A 97 -2.449 -18.998 14.701 1.00 34.51 H new ATOM 0 HG3 GLU A 97 -2.036 -20.513 15.480 1.00 34.51 H new ATOM 1485 N GLY A 98 -0.095 -17.835 12.466 1.00 11.30 N ATOM 1486 CA GLY A 98 -0.406 -16.739 11.567 1.00 11.42 C ATOM 1487 C GLY A 98 -1.147 -17.198 10.327 1.00 33.13 C ATOM 1488 O GLY A 98 -1.187 -18.386 10.006 1.00 21.02 O ATOM 0 H GLY A 98 0.145 -18.713 12.005 1.00 11.30 H new ATOM 0 HA2 GLY A 98 -1.010 -16.001 12.095 1.00 11.42 H new ATOM 0 HA3 GLY A 98 0.518 -16.243 11.271 1.00 11.42 H new ATOM 1492 N PRO A 99 -1.754 -16.243 9.608 1.00 42.54 N ATOM 1493 CA PRO A 99 -2.510 -16.532 8.385 1.00 5.32 C ATOM 1494 C PRO A 99 -1.607 -16.963 7.234 1.00 11.01 C ATOM 1495 O PRO A 99 -0.398 -16.730 7.260 1.00 21.42 O ATOM 1496 CB PRO A 99 -3.187 -15.197 8.063 1.00 63.42 C ATOM 1497 CG PRO A 99 -2.314 -14.168 8.693 1.00 1.40 C ATOM 1498 CD PRO A 99 -1.748 -14.806 9.931 1.00 30.03 C ATOM 0 HA PRO A 99 -3.208 -17.357 8.523 1.00 5.32 H new ATOM 0 HB2 PRO A 99 -3.267 -15.043 6.987 1.00 63.42 H new ATOM 0 HB3 PRO A 99 -4.199 -15.159 8.467 1.00 63.42 H new ATOM 0 HG2 PRO A 99 -1.519 -13.862 8.013 1.00 1.40 H new ATOM 0 HG3 PRO A 99 -2.883 -13.272 8.941 1.00 1.40 H new ATOM 0 HD2 PRO A 99 -0.741 -14.446 10.144 1.00 30.03 H new ATOM 0 HD3 PRO A 99 -2.356 -14.589 10.809 1.00 30.03 H new ATOM 1506 N CYS A 100 -2.202 -17.591 6.226 1.00 63.10 N ATOM 1507 CA CYS A 100 -1.451 -18.055 5.065 1.00 64.21 C ATOM 1508 C CYS A 100 -2.210 -17.765 3.775 1.00 52.05 C ATOM 1509 O CYS A 100 -3.434 -17.885 3.722 1.00 54.31 O ATOM 1510 CB CYS A 100 -1.169 -19.554 5.179 1.00 34.13 C ATOM 1511 SG CYS A 100 -2.627 -20.599 4.945 1.00 3.43 S ATOM 0 H CYS A 100 -3.202 -17.790 6.189 1.00 63.10 H new ATOM 0 HA CYS A 100 -0.504 -17.516 5.037 1.00 64.21 H new ATOM 0 HB2 CYS A 100 -0.416 -19.828 4.440 1.00 34.13 H new ATOM 0 HB3 CYS A 100 -0.742 -19.759 6.161 1.00 34.13 H new ATOM 0 HG CYS A 100 -2.710 -21.453 5.922 1.00 3.43 H new ATOM 1517 N VAL A 101 -1.476 -17.381 2.735 1.00 21.11 N ATOM 1518 CA VAL A 101 -2.080 -17.073 1.444 1.00 1.25 C ATOM 1519 C VAL A 101 -1.069 -17.227 0.314 1.00 40.52 C ATOM 1520 O VAL A 101 0.144 -17.168 0.520 1.00 75.35 O ATOM 1521 CB VAL A 101 -2.649 -15.642 1.419 1.00 41.34 C ATOM 1522 CG1 VAL A 101 -4.026 -15.603 2.062 1.00 15.23 C ATOM 1523 CG2 VAL A 101 -1.699 -14.678 2.114 1.00 21.52 C ATOM 0 H VAL A 101 -0.462 -17.276 2.762 1.00 21.11 H new ATOM 0 HA VAL A 101 -2.894 -17.782 1.297 1.00 1.25 H new ATOM 0 HB VAL A 101 -2.751 -15.329 0.380 1.00 41.34 H new ATOM 0 HG11 VAL A 101 -4.411 -14.584 2.035 1.00 15.23 H new ATOM 0 HG12 VAL A 101 -4.702 -16.261 1.516 1.00 15.23 H new ATOM 0 HG13 VAL A 101 -3.954 -15.936 3.097 1.00 15.23 H new ATOM 0 HG21 VAL A 101 -2.117 -13.672 2.087 1.00 21.52 H new ATOM 0 HG22 VAL A 101 -1.562 -14.986 3.151 1.00 21.52 H new ATOM 0 HG23 VAL A 101 -0.736 -14.685 1.603 1.00 21.52 H new ATOM 1533 N PRO A 102 -1.577 -17.427 -0.911 1.00 73.41 N ATOM 1534 CA PRO A 102 -0.736 -17.593 -2.100 1.00 42.30 C ATOM 1535 C PRO A 102 -0.033 -16.299 -2.497 1.00 63.21 C ATOM 1536 O PRO A 102 -0.440 -15.624 -3.441 1.00 75.23 O ATOM 1537 CB PRO A 102 -1.732 -18.014 -3.183 1.00 65.45 C ATOM 1538 CG PRO A 102 -3.039 -17.461 -2.733 1.00 0.34 C ATOM 1539 CD PRO A 102 -3.013 -17.508 -1.230 1.00 24.12 C ATOM 0 HA PRO A 102 0.065 -18.313 -1.935 1.00 42.30 H new ATOM 0 HB2 PRO A 102 -1.449 -17.616 -4.157 1.00 65.45 H new ATOM 0 HB3 PRO A 102 -1.774 -19.099 -3.282 1.00 65.45 H new ATOM 0 HG2 PRO A 102 -3.174 -16.440 -3.089 1.00 0.34 H new ATOM 0 HG3 PRO A 102 -3.868 -18.049 -3.128 1.00 0.34 H new ATOM 0 HD2 PRO A 102 -3.569 -16.679 -0.792 1.00 24.12 H new ATOM 0 HD3 PRO A 102 -3.458 -18.427 -0.849 1.00 24.12 H new ATOM 1547 N GLY A 103 1.027 -15.959 -1.769 1.00 61.44 N ATOM 1548 CA GLY A 103 1.770 -14.748 -2.062 1.00 10.42 C ATOM 1549 C GLY A 103 2.397 -14.139 -0.823 1.00 52.43 C ATOM 1550 O GLY A 103 3.290 -13.297 -0.921 1.00 62.21 O ATOM 0 H GLY A 103 1.384 -16.501 -0.982 1.00 61.44 H new ATOM 0 HA2 GLY A 103 2.551 -14.971 -2.789 1.00 10.42 H new ATOM 0 HA3 GLY A 103 1.104 -14.019 -2.524 1.00 10.42 H new ATOM 1554 N ASP A 104 1.927 -14.563 0.345 1.00 42.32 N ATOM 1555 CA ASP A 104 2.447 -14.053 1.608 1.00 21.14 C ATOM 1556 C ASP A 104 3.901 -14.471 1.806 1.00 71.11 C ATOM 1557 O ASP A 104 4.656 -13.810 2.518 1.00 51.53 O ATOM 1558 CB ASP A 104 1.596 -14.557 2.775 1.00 53.41 C ATOM 1559 CG ASP A 104 2.314 -14.446 4.106 1.00 74.34 C ATOM 1560 OD1 ASP A 104 2.868 -13.365 4.392 1.00 25.00 O ATOM 1561 OD2 ASP A 104 2.321 -15.441 4.860 1.00 23.54 O ATOM 0 H ASP A 104 1.187 -15.258 0.443 1.00 42.32 H new ATOM 0 HA ASP A 104 2.401 -12.964 1.578 1.00 21.14 H new ATOM 0 HB2 ASP A 104 0.668 -13.986 2.817 1.00 53.41 H new ATOM 0 HB3 ASP A 104 1.323 -15.597 2.599 1.00 53.41 H new ATOM 1566 N ALA A 105 4.286 -15.574 1.172 1.00 54.23 N ATOM 1567 CA ALA A 105 5.649 -16.079 1.277 1.00 73.40 C ATOM 1568 C ALA A 105 6.666 -14.979 0.995 1.00 12.34 C ATOM 1569 O ALA A 105 6.548 -14.247 0.013 1.00 34.33 O ATOM 1570 CB ALA A 105 5.854 -17.247 0.323 1.00 53.20 C ATOM 0 H ALA A 105 3.673 -16.135 0.580 1.00 54.23 H new ATOM 0 HA ALA A 105 5.803 -16.427 2.299 1.00 73.40 H new ATOM 0 HB1 ALA A 105 6.876 -17.614 0.412 1.00 53.20 H new ATOM 0 HB2 ALA A 105 5.158 -18.048 0.573 1.00 53.20 H new ATOM 0 HB3 ALA A 105 5.675 -16.917 -0.700 1.00 53.20 H new ATOM 1576 N GLY A 106 7.666 -14.866 1.865 1.00 74.42 N ATOM 1577 CA GLY A 106 8.688 -13.851 1.692 1.00 24.50 C ATOM 1578 C GLY A 106 8.643 -12.792 2.775 1.00 32.12 C ATOM 1579 O GLY A 106 9.510 -11.922 2.839 1.00 51.31 O ATOM 0 H GLY A 106 7.786 -15.459 2.686 1.00 74.42 H new ATOM 0 HA2 GLY A 106 9.670 -14.325 1.692 1.00 24.50 H new ATOM 0 HA3 GLY A 106 8.563 -13.376 0.719 1.00 24.50 H new ATOM 1583 N GLY A 107 7.626 -12.864 3.630 1.00 65.54 N ATOM 1584 CA GLY A 107 7.489 -11.897 4.703 1.00 61.14 C ATOM 1585 C GLY A 107 8.688 -11.886 5.630 1.00 33.34 C ATOM 1586 O GLY A 107 8.957 -12.869 6.321 1.00 32.15 O ATOM 0 H GLY A 107 6.895 -13.575 3.598 1.00 65.54 H new ATOM 0 HA2 GLY A 107 7.354 -10.903 4.277 1.00 61.14 H new ATOM 0 HA3 GLY A 107 6.591 -12.122 5.278 1.00 61.14 H new ATOM 1590 N LYS A 108 9.412 -10.772 5.646 1.00 72.40 N ATOM 1591 CA LYS A 108 10.589 -10.636 6.495 1.00 23.41 C ATOM 1592 C LYS A 108 10.189 -10.459 7.956 1.00 32.43 C ATOM 1593 O LYS A 108 9.408 -9.568 8.293 1.00 23.02 O ATOM 1594 CB LYS A 108 11.437 -9.446 6.040 1.00 61.41 C ATOM 1595 CG LYS A 108 12.311 -9.748 4.835 1.00 4.01 C ATOM 1596 CD LYS A 108 13.478 -8.780 4.736 1.00 1.54 C ATOM 1597 CE LYS A 108 14.789 -9.509 4.485 1.00 74.43 C ATOM 1598 NZ LYS A 108 15.963 -8.709 4.928 1.00 24.03 N ATOM 0 H LYS A 108 9.204 -9.950 5.080 1.00 72.40 H new ATOM 0 HA LYS A 108 11.177 -11.549 6.406 1.00 23.41 H new ATOM 0 HB2 LYS A 108 10.778 -8.611 5.800 1.00 61.41 H new ATOM 0 HB3 LYS A 108 12.071 -9.125 6.867 1.00 61.41 H new ATOM 0 HG2 LYS A 108 12.688 -10.768 4.905 1.00 4.01 H new ATOM 0 HG3 LYS A 108 11.712 -9.691 3.926 1.00 4.01 H new ATOM 0 HD2 LYS A 108 13.295 -8.070 3.929 1.00 1.54 H new ATOM 0 HD3 LYS A 108 13.552 -8.203 5.658 1.00 1.54 H new ATOM 0 HE2 LYS A 108 14.780 -10.463 5.012 1.00 74.43 H new ATOM 0 HE3 LYS A 108 14.882 -9.733 3.422 1.00 74.43 H new ATOM 0 HZ1 LYS A 108 16.814 -9.035 4.428 1.00 24.03 H new ATOM 0 HZ2 LYS A 108 15.799 -7.705 4.714 1.00 24.03 H new ATOM 0 HZ3 LYS A 108 16.097 -8.827 5.953 1.00 24.03 H new ATOM 1612 N LEU A 109 10.728 -11.312 8.820 1.00 25.12 N ATOM 1613 CA LEU A 109 10.429 -11.249 10.246 1.00 15.15 C ATOM 1614 C LEU A 109 11.525 -10.503 11.001 1.00 75.02 C ATOM 1615 O LEU A 109 12.634 -11.011 11.168 1.00 62.01 O ATOM 1616 CB LEU A 109 10.270 -12.659 10.817 1.00 32.23 C ATOM 1617 CG LEU A 109 9.861 -12.746 12.288 1.00 13.21 C ATOM 1618 CD1 LEU A 109 8.686 -11.823 12.571 1.00 55.24 C ATOM 1619 CD2 LEU A 109 9.517 -14.180 12.662 1.00 33.14 C ATOM 0 H LEU A 109 11.375 -12.056 8.558 1.00 25.12 H new ATOM 0 HA LEU A 109 9.493 -10.705 10.371 1.00 15.15 H new ATOM 0 HB2 LEU A 109 9.526 -13.188 10.222 1.00 32.23 H new ATOM 0 HB3 LEU A 109 11.214 -13.189 10.691 1.00 32.23 H new ATOM 0 HG LEU A 109 10.704 -12.425 12.899 1.00 13.21 H new ATOM 0 HD11 LEU A 109 8.409 -11.898 13.623 1.00 55.24 H new ATOM 0 HD12 LEU A 109 8.968 -10.795 12.343 1.00 55.24 H new ATOM 0 HD13 LEU A 109 7.838 -12.113 11.951 1.00 55.24 H new ATOM 0 HD21 LEU A 109 9.228 -14.223 13.712 1.00 33.14 H new ATOM 0 HD22 LEU A 109 8.690 -14.529 12.044 1.00 33.14 H new ATOM 0 HD23 LEU A 109 10.386 -14.817 12.498 1.00 33.14 H new ATOM 1631 N LEU A 110 11.206 -9.297 11.456 1.00 11.44 N ATOM 1632 CA LEU A 110 12.163 -8.481 12.196 1.00 52.31 C ATOM 1633 C LEU A 110 11.951 -8.622 13.700 1.00 64.22 C ATOM 1634 O LEU A 110 10.817 -8.650 14.178 1.00 21.23 O ATOM 1635 CB LEU A 110 12.034 -7.012 11.787 1.00 20.22 C ATOM 1636 CG LEU A 110 12.730 -6.614 10.485 1.00 73.41 C ATOM 1637 CD1 LEU A 110 11.705 -6.237 9.426 1.00 22.02 C ATOM 1638 CD2 LEU A 110 13.698 -5.465 10.727 1.00 74.43 C ATOM 0 H LEU A 110 10.293 -8.862 11.326 1.00 11.44 H new ATOM 0 HA LEU A 110 13.166 -8.833 11.955 1.00 52.31 H new ATOM 0 HB2 LEU A 110 10.974 -6.772 11.697 1.00 20.22 H new ATOM 0 HB3 LEU A 110 12.433 -6.395 12.592 1.00 20.22 H new ATOM 0 HG LEU A 110 13.298 -7.470 10.122 1.00 73.41 H new ATOM 0 HD11 LEU A 110 12.218 -5.957 8.506 1.00 22.02 H new ATOM 0 HD12 LEU A 110 11.052 -7.088 9.232 1.00 22.02 H new ATOM 0 HD13 LEU A 110 11.109 -5.396 9.780 1.00 22.02 H new ATOM 0 HD21 LEU A 110 14.184 -5.195 9.789 1.00 74.43 H new ATOM 0 HD22 LEU A 110 13.152 -4.604 11.113 1.00 74.43 H new ATOM 0 HD23 LEU A 110 14.452 -5.771 11.452 1.00 74.43 H new ATOM 1650 N CYS A 111 13.051 -8.709 14.441 1.00 32.10 N ATOM 1651 CA CYS A 111 12.987 -8.846 15.891 1.00 3.31 C ATOM 1652 C CYS A 111 13.687 -7.677 16.579 1.00 41.02 C ATOM 1653 O CYS A 111 14.004 -6.670 15.945 1.00 22.21 O ATOM 1654 CB CYS A 111 13.626 -10.166 16.328 1.00 12.54 C ATOM 1655 SG CYS A 111 15.446 -10.169 16.260 1.00 22.35 S ATOM 0 H CYS A 111 13.997 -8.687 14.061 1.00 32.10 H new ATOM 0 HA CYS A 111 11.938 -8.843 16.186 1.00 3.31 H new ATOM 0 HB2 CYS A 111 13.311 -10.390 17.347 1.00 12.54 H new ATOM 0 HB3 CYS A 111 13.248 -10.968 15.694 1.00 12.54 H new ATOM 1660 N ARG A 112 13.925 -7.819 17.879 1.00 51.14 N ATOM 1661 CA ARG A 112 14.586 -6.775 18.653 1.00 60.33 C ATOM 1662 C ARG A 112 15.640 -6.060 17.813 1.00 63.45 C ATOM 1663 O ARG A 112 15.733 -4.833 17.827 1.00 50.51 O ATOM 1664 CB ARG A 112 15.234 -7.372 19.904 1.00 52.42 C ATOM 1665 CG ARG A 112 14.243 -8.037 20.845 1.00 53.23 C ATOM 1666 CD ARG A 112 13.169 -7.062 21.303 1.00 63.00 C ATOM 1667 NE ARG A 112 12.785 -7.285 22.694 1.00 24.13 N ATOM 1668 CZ ARG A 112 13.568 -6.997 23.728 1.00 64.00 C ATOM 1669 NH1 ARG A 112 14.771 -6.477 23.528 1.00 44.11 N ATOM 1670 NH2 ARG A 112 13.148 -7.229 24.965 1.00 1.20 N ATOM 0 H ARG A 112 13.670 -8.646 18.418 1.00 51.14 H new ATOM 0 HA ARG A 112 13.832 -6.048 18.954 1.00 60.33 H new ATOM 0 HB2 ARG A 112 15.982 -8.105 19.601 1.00 52.42 H new ATOM 0 HB3 ARG A 112 15.760 -6.583 20.442 1.00 52.42 H new ATOM 0 HG2 ARG A 112 13.776 -8.885 20.344 1.00 53.23 H new ATOM 0 HG3 ARG A 112 14.772 -8.431 21.713 1.00 53.23 H new ATOM 0 HD2 ARG A 112 13.533 -6.041 21.187 1.00 63.00 H new ATOM 0 HD3 ARG A 112 12.292 -7.163 20.664 1.00 63.00 H new ATOM 0 HE ARG A 112 11.865 -7.684 22.882 1.00 24.13 H new ATOM 0 HH11 ARG A 112 15.097 -6.297 22.579 1.00 44.11 H new ATOM 0 HH12 ARG A 112 15.370 -6.257 24.324 1.00 44.11 H new ATOM 0 HH21 ARG A 112 12.223 -7.629 25.123 1.00 1.20 H new ATOM 0 HH22 ARG A 112 13.750 -7.007 25.758 1.00 1.20 H new ATOM 1684 N HIS A 113 16.434 -6.837 17.081 1.00 35.25 N ATOM 1685 CA HIS A 113 17.481 -6.278 16.235 1.00 65.33 C ATOM 1686 C HIS A 113 16.949 -5.980 14.836 1.00 32.05 C ATOM 1687 O HIS A 113 16.970 -4.836 14.385 1.00 54.05 O ATOM 1688 CB HIS A 113 18.664 -7.243 16.147 1.00 24.14 C ATOM 1689 CG HIS A 113 18.777 -8.161 17.326 1.00 43.33 C ATOM 1690 ND1 HIS A 113 18.706 -7.722 18.631 1.00 44.30 N ATOM 1691 CD2 HIS A 113 18.955 -9.501 17.390 1.00 3.13 C ATOM 1692 CE1 HIS A 113 18.838 -8.752 19.447 1.00 13.14 C ATOM 1693 NE2 HIS A 113 18.990 -9.844 18.720 1.00 54.44 N ATOM 0 H HIS A 113 16.371 -7.855 17.058 1.00 35.25 H new ATOM 0 HA HIS A 113 17.816 -5.343 16.684 1.00 65.33 H new ATOM 0 HB2 HIS A 113 18.569 -7.840 15.240 1.00 24.14 H new ATOM 0 HB3 HIS A 113 19.585 -6.668 16.055 1.00 24.14 H new ATOM 0 HD2 HIS A 113 19.052 -10.175 16.552 1.00 3.13 H new ATOM 0 HE1 HIS A 113 18.824 -8.709 20.526 1.00 13.14 H new ATOM 0 HE2 HIS A 113 19.113 -10.788 19.086 1.00 54.44 H new ATOM 1701 N GLY A 114 16.472 -7.018 14.156 1.00 64.13 N ATOM 1702 CA GLY A 114 15.942 -6.846 12.816 1.00 61.22 C ATOM 1703 C GLY A 114 15.548 -8.162 12.175 1.00 33.22 C ATOM 1704 O GLY A 114 15.237 -9.130 12.869 1.00 34.31 O ATOM 0 H GLY A 114 16.443 -7.975 14.509 1.00 64.13 H new ATOM 0 HA2 GLY A 114 15.073 -6.189 12.854 1.00 61.22 H new ATOM 0 HA3 GLY A 114 16.688 -6.352 12.194 1.00 61.22 H new ATOM 1708 N VAL A 115 15.559 -8.198 10.846 1.00 34.54 N ATOM 1709 CA VAL A 115 15.199 -9.405 10.112 1.00 73.33 C ATOM 1710 C VAL A 115 15.981 -10.611 10.619 1.00 31.51 C ATOM 1711 O VAL A 115 17.199 -10.548 10.787 1.00 62.04 O ATOM 1712 CB VAL A 115 15.454 -9.240 8.602 1.00 73.13 C ATOM 1713 CG1 VAL A 115 15.182 -10.545 7.868 1.00 15.52 C ATOM 1714 CG2 VAL A 115 14.601 -8.114 8.038 1.00 53.22 C ATOM 0 H VAL A 115 15.813 -7.406 10.256 1.00 34.54 H new ATOM 0 HA VAL A 115 14.134 -9.570 10.278 1.00 73.33 H new ATOM 0 HB VAL A 115 16.502 -8.980 8.455 1.00 73.13 H new ATOM 0 HG11 VAL A 115 15.368 -10.409 6.803 1.00 15.52 H new ATOM 0 HG12 VAL A 115 15.840 -11.324 8.254 1.00 15.52 H new ATOM 0 HG13 VAL A 115 14.143 -10.839 8.021 1.00 15.52 H new ATOM 0 HG21 VAL A 115 14.794 -8.011 6.970 1.00 53.22 H new ATOM 0 HG22 VAL A 115 13.547 -8.342 8.196 1.00 53.22 H new ATOM 0 HG23 VAL A 115 14.850 -7.181 8.543 1.00 53.22 H new ATOM 1724 N ILE A 116 15.273 -11.709 10.862 1.00 71.45 N ATOM 1725 CA ILE A 116 15.902 -12.931 11.348 1.00 35.14 C ATOM 1726 C ILE A 116 15.403 -14.150 10.580 1.00 54.12 C ATOM 1727 O ILE A 116 15.819 -15.277 10.845 1.00 74.03 O ATOM 1728 CB ILE A 116 15.635 -13.141 12.851 1.00 62.13 C ATOM 1729 CG1 ILE A 116 14.141 -13.000 13.151 1.00 45.33 C ATOM 1730 CG2 ILE A 116 16.443 -12.150 13.675 1.00 32.14 C ATOM 1731 CD1 ILE A 116 13.790 -13.254 14.600 1.00 54.22 C ATOM 0 H ILE A 116 14.264 -11.777 10.730 1.00 71.45 H new ATOM 0 HA ILE A 116 16.974 -12.819 11.189 1.00 35.14 H new ATOM 0 HB ILE A 116 15.947 -14.149 13.123 1.00 62.13 H new ATOM 0 HG12 ILE A 116 13.817 -11.996 12.878 1.00 45.33 H new ATOM 0 HG13 ILE A 116 13.585 -13.696 12.523 1.00 45.33 H new ATOM 0 HG21 ILE A 116 16.244 -12.310 14.735 1.00 32.14 H new ATOM 0 HG22 ILE A 116 17.505 -12.295 13.479 1.00 32.14 H new ATOM 0 HG23 ILE A 116 16.159 -11.133 13.402 1.00 32.14 H new ATOM 0 HD11 ILE A 116 12.715 -13.137 14.740 1.00 54.22 H new ATOM 0 HD12 ILE A 116 14.083 -14.268 14.873 1.00 54.22 H new ATOM 0 HD13 ILE A 116 14.318 -12.541 15.233 1.00 54.22 H new ATOM 1743 N GLY A 117 14.509 -13.915 9.624 1.00 75.10 N ATOM 1744 CA GLY A 117 13.969 -15.003 8.830 1.00 75.12 C ATOM 1745 C GLY A 117 12.733 -14.595 8.051 1.00 25.23 C ATOM 1746 O GLY A 117 12.048 -13.640 8.418 1.00 44.24 O ATOM 0 H GLY A 117 14.149 -12.991 9.385 1.00 75.10 H new ATOM 0 HA2 GLY A 117 14.732 -15.356 8.136 1.00 75.12 H new ATOM 0 HA3 GLY A 117 13.723 -15.839 9.485 1.00 75.12 H new ATOM 1750 N ILE A 118 12.449 -15.319 6.974 1.00 22.21 N ATOM 1751 CA ILE A 118 11.289 -15.027 6.142 1.00 13.50 C ATOM 1752 C ILE A 118 10.330 -16.212 6.099 1.00 43.22 C ATOM 1753 O ILE A 118 10.675 -17.317 6.519 1.00 14.21 O ATOM 1754 CB ILE A 118 11.704 -14.664 4.704 1.00 41.10 C ATOM 1755 CG1 ILE A 118 12.290 -15.887 3.996 1.00 43.25 C ATOM 1756 CG2 ILE A 118 12.707 -13.520 4.715 1.00 50.01 C ATOM 1757 CD1 ILE A 118 11.397 -16.442 2.909 1.00 55.55 C ATOM 0 H ILE A 118 13.007 -16.112 6.657 1.00 22.21 H new ATOM 0 HA ILE A 118 10.785 -14.172 6.593 1.00 13.50 H new ATOM 0 HB ILE A 118 10.819 -14.340 4.156 1.00 41.10 H new ATOM 0 HG12 ILE A 118 13.253 -15.618 3.562 1.00 43.25 H new ATOM 0 HG13 ILE A 118 12.479 -16.667 4.733 1.00 43.25 H new ATOM 0 HG21 ILE A 118 12.991 -13.275 3.691 1.00 50.01 H new ATOM 0 HG22 ILE A 118 12.257 -12.646 5.186 1.00 50.01 H new ATOM 0 HG23 ILE A 118 13.593 -13.818 5.276 1.00 50.01 H new ATOM 0 HD11 ILE A 118 11.876 -17.307 2.451 1.00 55.55 H new ATOM 0 HD12 ILE A 118 10.442 -16.742 3.341 1.00 55.55 H new ATOM 0 HD13 ILE A 118 11.228 -15.677 2.151 1.00 55.55 H new ATOM 1769 N ILE A 119 9.128 -15.975 5.587 1.00 55.44 N ATOM 1770 CA ILE A 119 8.120 -17.023 5.486 1.00 64.43 C ATOM 1771 C ILE A 119 8.515 -18.067 4.446 1.00 5.31 C ATOM 1772 O ILE A 119 8.754 -17.741 3.282 1.00 21.55 O ATOM 1773 CB ILE A 119 6.741 -16.446 5.118 1.00 12.31 C ATOM 1774 CG1 ILE A 119 6.503 -15.126 5.856 1.00 63.34 C ATOM 1775 CG2 ILE A 119 5.643 -17.447 5.446 1.00 41.15 C ATOM 1776 CD1 ILE A 119 5.075 -14.636 5.771 1.00 12.25 C ATOM 0 H ILE A 119 8.828 -15.066 5.235 1.00 55.44 H new ATOM 0 HA ILE A 119 8.057 -17.495 6.467 1.00 64.43 H new ATOM 0 HB ILE A 119 6.720 -16.251 4.046 1.00 12.31 H new ATOM 0 HG12 ILE A 119 6.774 -15.251 6.904 1.00 63.34 H new ATOM 0 HG13 ILE A 119 7.165 -14.364 5.444 1.00 63.34 H new ATOM 0 HG21 ILE A 119 4.674 -17.024 5.180 1.00 41.15 H new ATOM 0 HG22 ILE A 119 5.806 -18.364 4.880 1.00 41.15 H new ATOM 0 HG23 ILE A 119 5.661 -17.670 6.513 1.00 41.15 H new ATOM 0 HD11 ILE A 119 4.980 -13.697 6.316 1.00 12.25 H new ATOM 0 HD12 ILE A 119 4.806 -14.478 4.727 1.00 12.25 H new ATOM 0 HD13 ILE A 119 4.409 -15.379 6.209 1.00 12.25 H new ATOM 1788 N THR A 120 8.581 -19.324 4.873 1.00 64.22 N ATOM 1789 CA THR A 120 8.947 -20.416 3.980 1.00 74.34 C ATOM 1790 C THR A 120 7.788 -21.391 3.800 1.00 1.40 C ATOM 1791 O THR A 120 7.673 -22.049 2.767 1.00 62.30 O ATOM 1792 CB THR A 120 10.173 -21.186 4.505 1.00 10.14 C ATOM 1793 OG1 THR A 120 10.568 -22.184 3.558 1.00 32.51 O ATOM 1794 CG2 THR A 120 9.867 -21.842 5.844 1.00 44.35 C ATOM 0 H THR A 120 8.386 -19.611 5.832 1.00 64.22 H new ATOM 0 HA THR A 120 9.194 -19.967 3.018 1.00 74.34 H new ATOM 0 HB THR A 120 10.988 -20.476 4.644 1.00 10.14 H new ATOM 0 HG1 THR A 120 11.349 -22.668 3.899 1.00 32.51 H new ATOM 0 HG21 THR A 120 10.747 -22.380 6.195 1.00 44.35 H new ATOM 0 HG22 THR A 120 9.596 -21.076 6.571 1.00 44.35 H new ATOM 0 HG23 THR A 120 9.038 -22.540 5.726 1.00 44.35 H new ATOM 1802 N ALA A 121 6.931 -21.477 4.812 1.00 1.41 N ATOM 1803 CA ALA A 121 5.779 -22.369 4.764 1.00 4.22 C ATOM 1804 C ALA A 121 4.628 -21.825 5.603 1.00 40.41 C ATOM 1805 O ALA A 121 4.842 -21.096 6.570 1.00 4.44 O ATOM 1806 CB ALA A 121 6.170 -23.760 5.240 1.00 72.31 C ATOM 0 H ALA A 121 7.013 -20.940 5.675 1.00 1.41 H new ATOM 0 HA ALA A 121 5.441 -22.432 3.729 1.00 4.22 H new ATOM 0 HB1 ALA A 121 5.301 -24.416 5.199 1.00 72.31 H new ATOM 0 HB2 ALA A 121 6.955 -24.157 4.597 1.00 72.31 H new ATOM 0 HB3 ALA A 121 6.535 -23.704 6.266 1.00 72.31 H new ATOM 1812 N GLY A 122 3.405 -22.183 5.225 1.00 71.44 N ATOM 1813 CA GLY A 122 2.238 -21.721 5.952 1.00 13.14 C ATOM 1814 C GLY A 122 1.038 -22.627 5.760 1.00 54.34 C ATOM 1815 O GLY A 122 0.649 -22.922 4.630 1.00 24.43 O ATOM 0 H GLY A 122 3.202 -22.785 4.427 1.00 71.44 H new ATOM 0 HA2 GLY A 122 2.476 -21.659 7.014 1.00 13.14 H new ATOM 0 HA3 GLY A 122 1.985 -20.713 5.623 1.00 13.14 H new ATOM 1819 N GLY A 123 0.449 -23.070 6.866 1.00 32.31 N ATOM 1820 CA GLY A 123 -0.707 -23.945 6.792 1.00 41.01 C ATOM 1821 C GLY A 123 -1.914 -23.372 7.508 1.00 73.45 C ATOM 1822 O GLY A 123 -2.095 -22.156 7.559 1.00 45.40 O ATOM 0 H GLY A 123 0.751 -22.839 7.812 1.00 32.31 H new ATOM 0 HA2 GLY A 123 -0.959 -24.122 5.746 1.00 41.01 H new ATOM 0 HA3 GLY A 123 -0.455 -24.912 7.227 1.00 41.01 H new ATOM 1826 N ASP A 124 -2.744 -24.251 8.060 1.00 51.54 N ATOM 1827 CA ASP A 124 -3.942 -23.826 8.775 1.00 5.44 C ATOM 1828 C ASP A 124 -3.578 -23.185 10.111 1.00 24.44 C ATOM 1829 O ASP A 124 -3.128 -23.864 11.034 1.00 0.52 O ATOM 1830 CB ASP A 124 -4.875 -25.016 9.003 1.00 4.24 C ATOM 1831 CG ASP A 124 -5.496 -25.520 7.715 1.00 1.54 C ATOM 1832 OD1 ASP A 124 -4.838 -25.415 6.659 1.00 74.14 O ATOM 1833 OD2 ASP A 124 -6.639 -26.019 7.764 1.00 12.14 O ATOM 0 H ASP A 124 -2.609 -25.261 8.026 1.00 51.54 H new ATOM 0 HA ASP A 124 -4.456 -23.084 8.164 1.00 5.44 H new ATOM 0 HB2 ASP A 124 -4.318 -25.825 9.475 1.00 4.24 H new ATOM 0 HB3 ASP A 124 -5.666 -24.727 9.695 1.00 4.24 H new ATOM 1838 N GLY A 125 -3.774 -21.874 10.207 1.00 55.13 N ATOM 1839 CA GLY A 125 -3.461 -21.164 11.433 1.00 44.11 C ATOM 1840 C GLY A 125 -2.014 -21.340 11.851 1.00 34.31 C ATOM 1841 O GLY A 125 -1.668 -21.138 13.015 1.00 1.33 O ATOM 0 H GLY A 125 -4.144 -21.290 9.457 1.00 55.13 H new ATOM 0 HA2 GLY A 125 -3.671 -20.103 11.299 1.00 44.11 H new ATOM 0 HA3 GLY A 125 -4.113 -21.519 12.231 1.00 44.11 H new ATOM 1845 N HIS A 126 -1.167 -21.721 10.900 1.00 11.30 N ATOM 1846 CA HIS A 126 0.250 -21.926 11.176 1.00 4.23 C ATOM 1847 C HIS A 126 1.113 -21.305 10.081 1.00 34.13 C ATOM 1848 O HIS A 126 0.745 -21.316 8.906 1.00 0.14 O ATOM 1849 CB HIS A 126 0.557 -23.419 11.298 1.00 0.33 C ATOM 1850 CG HIS A 126 1.496 -23.925 10.247 1.00 24.03 C ATOM 1851 ND1 HIS A 126 1.095 -24.735 9.206 1.00 31.33 N ATOM 1852 CD2 HIS A 126 2.825 -23.730 10.080 1.00 63.44 C ATOM 1853 CE1 HIS A 126 2.136 -25.019 8.445 1.00 45.53 C ATOM 1854 NE2 HIS A 126 3.199 -24.420 8.953 1.00 71.43 N ATOM 0 H HIS A 126 -1.437 -21.894 9.932 1.00 11.30 H new ATOM 0 HA HIS A 126 0.485 -21.436 12.121 1.00 4.23 H new ATOM 0 HB2 HIS A 126 0.986 -23.614 12.281 1.00 0.33 H new ATOM 0 HB3 HIS A 126 -0.376 -23.979 11.240 1.00 0.33 H new ATOM 0 HD2 HIS A 126 3.471 -23.141 10.715 1.00 63.44 H new ATOM 0 HE1 HIS A 126 2.121 -25.636 7.558 1.00 45.53 H new ATOM 0 HE2 HIS A 126 4.143 -24.463 8.570 1.00 71.43 H new ATOM 1862 N VAL A 127 2.261 -20.764 10.475 1.00 42.43 N ATOM 1863 CA VAL A 127 3.176 -20.138 9.527 1.00 71.51 C ATOM 1864 C VAL A 127 4.623 -20.274 9.988 1.00 14.04 C ATOM 1865 O VAL A 127 5.015 -19.710 11.009 1.00 15.33 O ATOM 1866 CB VAL A 127 2.848 -18.646 9.332 1.00 64.11 C ATOM 1867 CG1 VAL A 127 2.792 -17.932 10.674 1.00 41.24 C ATOM 1868 CG2 VAL A 127 3.870 -17.993 8.413 1.00 13.31 C ATOM 0 H VAL A 127 2.580 -20.746 11.444 1.00 42.43 H new ATOM 0 HA VAL A 127 3.051 -20.657 8.576 1.00 71.51 H new ATOM 0 HB VAL A 127 1.867 -18.565 8.864 1.00 64.11 H new ATOM 0 HG11 VAL A 127 2.559 -16.879 10.516 1.00 41.24 H new ATOM 0 HG12 VAL A 127 2.020 -18.385 11.295 1.00 41.24 H new ATOM 0 HG13 VAL A 127 3.757 -18.019 11.173 1.00 41.24 H new ATOM 0 HG21 VAL A 127 3.624 -16.939 8.286 1.00 13.31 H new ATOM 0 HG22 VAL A 127 4.864 -18.083 8.852 1.00 13.31 H new ATOM 0 HG23 VAL A 127 3.856 -18.489 7.442 1.00 13.31 H new ATOM 1878 N ALA A 128 5.412 -21.026 9.229 1.00 42.03 N ATOM 1879 CA ALA A 128 6.817 -21.234 9.558 1.00 12.21 C ATOM 1880 C ALA A 128 7.708 -20.253 8.804 1.00 4.12 C ATOM 1881 O ALA A 128 7.298 -19.670 7.801 1.00 74.25 O ATOM 1882 CB ALA A 128 7.225 -22.666 9.248 1.00 21.45 C ATOM 0 H ALA A 128 5.102 -21.502 8.382 1.00 42.03 H new ATOM 0 HA ALA A 128 6.945 -21.054 10.625 1.00 12.21 H new ATOM 0 HB1 ALA A 128 8.276 -22.807 9.498 1.00 21.45 H new ATOM 0 HB2 ALA A 128 6.617 -23.353 9.836 1.00 21.45 H new ATOM 0 HB3 ALA A 128 7.075 -22.866 8.187 1.00 21.45 H new ATOM 1888 N PHE A 129 8.931 -20.074 9.295 1.00 74.34 N ATOM 1889 CA PHE A 129 9.880 -19.162 8.668 1.00 60.13 C ATOM 1890 C PHE A 129 11.286 -19.754 8.671 1.00 63.32 C ATOM 1891 O PHE A 129 11.618 -20.594 9.509 1.00 51.24 O ATOM 1892 CB PHE A 129 9.880 -17.815 9.393 1.00 2.10 C ATOM 1893 CG PHE A 129 8.510 -17.350 9.795 1.00 74.14 C ATOM 1894 CD1 PHE A 129 7.934 -17.786 10.977 1.00 24.32 C ATOM 1895 CD2 PHE A 129 7.796 -16.477 8.989 1.00 30.30 C ATOM 1896 CE1 PHE A 129 6.673 -17.360 11.350 1.00 64.31 C ATOM 1897 CE2 PHE A 129 6.535 -16.047 9.357 1.00 71.53 C ATOM 1898 CZ PHE A 129 5.972 -16.490 10.538 1.00 65.51 C ATOM 0 H PHE A 129 9.287 -20.549 10.125 1.00 74.34 H new ATOM 0 HA PHE A 129 9.571 -19.010 7.634 1.00 60.13 H new ATOM 0 HB2 PHE A 129 10.505 -17.891 10.283 1.00 2.10 H new ATOM 0 HB3 PHE A 129 10.335 -17.064 8.747 1.00 2.10 H new ATOM 0 HD1 PHE A 129 8.477 -18.467 11.615 1.00 24.32 H new ATOM 0 HD2 PHE A 129 8.230 -16.129 8.063 1.00 30.30 H new ATOM 0 HE1 PHE A 129 6.237 -17.707 12.275 1.00 64.31 H new ATOM 0 HE2 PHE A 129 5.990 -15.365 8.721 1.00 71.53 H new ATOM 0 HZ PHE A 129 4.986 -16.157 10.826 1.00 65.51 H new ATOM 1908 N THR A 130 12.111 -19.311 7.727 1.00 73.25 N ATOM 1909 CA THR A 130 13.480 -19.797 7.618 1.00 24.41 C ATOM 1910 C THR A 130 14.466 -18.804 8.223 1.00 32.34 C ATOM 1911 O THR A 130 14.533 -17.649 7.805 1.00 45.45 O ATOM 1912 CB THR A 130 13.869 -20.059 6.151 1.00 60.23 C ATOM 1913 OG1 THR A 130 15.210 -20.555 6.080 1.00 24.43 O ATOM 1914 CG2 THR A 130 13.749 -18.788 5.324 1.00 1.20 C ATOM 0 H THR A 130 11.854 -18.616 7.027 1.00 73.25 H new ATOM 0 HA THR A 130 13.527 -20.735 8.171 1.00 24.41 H new ATOM 0 HB THR A 130 13.185 -20.804 5.745 1.00 60.23 H new ATOM 0 HG1 THR A 130 15.448 -20.720 5.144 1.00 24.43 H new ATOM 0 HG21 THR A 130 14.029 -18.998 4.292 1.00 1.20 H new ATOM 0 HG22 THR A 130 12.720 -18.429 5.355 1.00 1.20 H new ATOM 0 HG23 THR A 130 14.412 -18.025 5.732 1.00 1.20 H new ATOM 1922 N ASP A 131 15.229 -19.262 9.210 1.00 15.11 N ATOM 1923 CA ASP A 131 16.213 -18.413 9.872 1.00 34.43 C ATOM 1924 C ASP A 131 17.299 -17.976 8.895 1.00 71.34 C ATOM 1925 O ASP A 131 17.962 -18.808 8.274 1.00 71.41 O ATOM 1926 CB ASP A 131 16.841 -19.152 11.055 1.00 33.02 C ATOM 1927 CG ASP A 131 17.049 -18.251 12.256 1.00 11.52 C ATOM 1928 OD1 ASP A 131 17.291 -17.042 12.056 1.00 4.32 O ATOM 1929 OD2 ASP A 131 16.968 -18.754 13.396 1.00 4.41 O ATOM 0 H ASP A 131 15.185 -20.216 9.569 1.00 15.11 H new ATOM 0 HA ASP A 131 15.701 -17.523 10.239 1.00 34.43 H new ATOM 0 HB2 ASP A 131 16.202 -19.988 11.338 1.00 33.02 H new ATOM 0 HB3 ASP A 131 17.799 -19.573 10.750 1.00 33.02 H new ATOM 1934 N LEU A 132 17.475 -16.666 8.761 1.00 25.45 N ATOM 1935 CA LEU A 132 18.481 -16.118 7.858 1.00 0.11 C ATOM 1936 C LEU A 132 19.851 -16.077 8.528 1.00 33.31 C ATOM 1937 O LEU A 132 20.860 -15.790 7.884 1.00 73.34 O ATOM 1938 CB LEU A 132 18.079 -14.712 7.409 1.00 73.25 C ATOM 1939 CG LEU A 132 17.825 -14.533 5.911 1.00 30.33 C ATOM 1940 CD1 LEU A 132 16.844 -15.580 5.407 1.00 34.13 C ATOM 1941 CD2 LEU A 132 17.308 -13.132 5.622 1.00 50.33 C ATOM 0 H LEU A 132 16.934 -15.964 9.266 1.00 25.45 H new ATOM 0 HA LEU A 132 18.543 -16.769 6.986 1.00 0.11 H new ATOM 0 HB2 LEU A 132 17.176 -14.425 7.947 1.00 73.25 H new ATOM 0 HB3 LEU A 132 18.864 -14.018 7.710 1.00 73.25 H new ATOM 0 HG LEU A 132 18.769 -14.666 5.383 1.00 30.33 H new ATOM 0 HD11 LEU A 132 16.676 -15.437 4.340 1.00 34.13 H new ATOM 0 HD12 LEU A 132 17.254 -16.575 5.579 1.00 34.13 H new ATOM 0 HD13 LEU A 132 15.899 -15.479 5.940 1.00 34.13 H new ATOM 0 HD21 LEU A 132 17.133 -13.022 4.552 1.00 50.33 H new ATOM 0 HD22 LEU A 132 16.374 -12.970 6.161 1.00 50.33 H new ATOM 0 HD23 LEU A 132 18.046 -12.398 5.946 1.00 50.33 H new ATOM 1953 N ARG A 133 19.878 -16.368 9.825 1.00 65.45 N ATOM 1954 CA ARG A 133 21.124 -16.366 10.582 1.00 64.14 C ATOM 1955 C ARG A 133 22.215 -17.130 9.836 1.00 33.54 C ATOM 1956 O ARG A 133 23.281 -16.598 9.529 1.00 41.52 O ATOM 1957 CB ARG A 133 20.907 -16.984 11.964 1.00 61.20 C ATOM 1958 CG ARG A 133 20.594 -15.963 13.045 1.00 30.03 C ATOM 1959 CD ARG A 133 20.617 -16.593 14.429 1.00 13.44 C ATOM 1960 NE ARG A 133 19.938 -17.886 14.454 1.00 45.33 N ATOM 1961 CZ ARG A 133 20.106 -18.785 15.417 1.00 72.43 C ATOM 1962 NH1 ARG A 133 20.924 -18.533 16.429 1.00 63.52 N ATOM 1963 NH2 ARG A 133 19.453 -19.940 15.369 1.00 41.44 N ATOM 0 H ARG A 133 19.052 -16.608 10.373 1.00 65.45 H new ATOM 0 HA ARG A 133 21.446 -15.331 10.701 1.00 64.14 H new ATOM 0 HB2 ARG A 133 20.089 -17.703 11.907 1.00 61.20 H new ATOM 0 HB3 ARG A 133 21.800 -17.540 12.249 1.00 61.20 H new ATOM 0 HG2 ARG A 133 21.320 -15.151 13.001 1.00 30.03 H new ATOM 0 HG3 ARG A 133 19.614 -15.524 12.860 1.00 30.03 H new ATOM 0 HD2 ARG A 133 21.650 -16.720 14.752 1.00 13.44 H new ATOM 0 HD3 ARG A 133 20.141 -15.920 15.142 1.00 13.44 H new ATOM 0 HE ARG A 133 19.300 -18.111 13.690 1.00 45.33 H new ATOM 0 HH11 ARG A 133 21.427 -17.646 16.470 1.00 63.52 H new ATOM 0 HH12 ARG A 133 21.051 -19.226 17.167 1.00 63.52 H new ATOM 0 HH21 ARG A 133 18.822 -20.137 14.592 1.00 41.44 H new ATOM 0 HH22 ARG A 133 19.582 -20.630 16.109 1.00 41.44 H new ATOM 1977 N PRO A 134 21.943 -18.410 9.539 1.00 2.13 N ATOM 1978 CA PRO A 134 22.888 -19.275 8.827 1.00 43.11 C ATOM 1979 C PRO A 134 23.058 -18.870 7.367 1.00 51.52 C ATOM 1980 O PRO A 134 22.739 -19.637 6.458 1.00 11.13 O ATOM 1981 CB PRO A 134 22.245 -20.660 8.926 1.00 70.40 C ATOM 1982 CG PRO A 134 20.789 -20.391 9.093 1.00 24.12 C ATOM 1983 CD PRO A 134 20.692 -19.111 9.875 1.00 3.54 C ATOM 0 HA PRO A 134 23.889 -19.223 9.255 1.00 43.11 H new ATOM 0 HB2 PRO A 134 22.438 -21.251 8.031 1.00 70.40 H new ATOM 0 HB3 PRO A 134 22.643 -21.222 9.771 1.00 70.40 H new ATOM 0 HG2 PRO A 134 20.296 -20.296 8.125 1.00 24.12 H new ATOM 0 HG3 PRO A 134 20.299 -21.209 9.621 1.00 24.12 H new ATOM 0 HD2 PRO A 134 19.816 -18.530 9.587 1.00 3.54 H new ATOM 0 HD3 PRO A 134 20.612 -19.299 10.946 1.00 3.54 H new ATOM 1991 N TYR A 135 23.562 -17.660 7.148 1.00 21.23 N ATOM 1992 CA TYR A 135 23.772 -17.152 5.798 1.00 63.32 C ATOM 1993 C TYR A 135 24.330 -15.733 5.830 1.00 3.23 C ATOM 1994 O TYR A 135 24.019 -14.912 4.968 1.00 5.14 O ATOM 1995 CB TYR A 135 22.461 -17.179 5.011 1.00 41.14 C ATOM 1996 CG TYR A 135 22.595 -17.784 3.631 1.00 0.33 C ATOM 1997 CD1 TYR A 135 23.186 -19.028 3.451 1.00 33.21 C ATOM 1998 CD2 TYR A 135 22.130 -17.111 2.508 1.00 12.42 C ATOM 1999 CE1 TYR A 135 23.311 -19.584 2.193 1.00 72.03 C ATOM 2000 CE2 TYR A 135 22.249 -17.659 1.246 1.00 24.40 C ATOM 2001 CZ TYR A 135 22.841 -18.896 1.093 1.00 30.04 C ATOM 2002 OH TYR A 135 22.962 -19.447 -0.162 1.00 4.03 O ATOM 0 H TYR A 135 23.833 -17.013 7.889 1.00 21.23 H new ATOM 0 HA TYR A 135 24.498 -17.797 5.304 1.00 63.32 H new ATOM 0 HB2 TYR A 135 21.720 -17.744 5.576 1.00 41.14 H new ATOM 0 HB3 TYR A 135 22.082 -16.161 4.917 1.00 41.14 H new ATOM 0 HD1 TYR A 135 23.554 -19.570 4.310 1.00 33.21 H new ATOM 0 HD2 TYR A 135 21.667 -16.142 2.624 1.00 12.42 H new ATOM 0 HE1 TYR A 135 23.774 -20.552 2.071 1.00 72.03 H new ATOM 0 HE2 TYR A 135 21.881 -17.123 0.384 1.00 24.40 H new ATOM 0 HH TYR A 135 22.083 -19.473 -0.594 1.00 4.03 H new ATOM 2012 N ASN A 136 25.158 -15.452 6.832 1.00 35.01 N ATOM 2013 CA ASN A 136 25.760 -14.132 6.978 1.00 22.15 C ATOM 2014 C ASN A 136 27.145 -14.233 7.611 1.00 32.43 C ATOM 2015 O ASN A 136 27.691 -15.327 7.760 1.00 5.35 O ATOM 2016 CB ASN A 136 24.863 -13.230 7.829 1.00 62.40 C ATOM 2017 CG ASN A 136 25.136 -13.378 9.313 1.00 4.24 C ATOM 2018 OD1 ASN A 136 25.330 -12.389 10.021 1.00 21.44 O ATOM 2019 ND2 ASN A 136 25.153 -14.617 9.792 1.00 43.45 N ATOM 0 H ASN A 136 25.427 -16.121 7.554 1.00 35.01 H new ATOM 0 HA ASN A 136 25.864 -13.696 5.984 1.00 22.15 H new ATOM 0 HB2 ASN A 136 25.015 -12.191 7.536 1.00 62.40 H new ATOM 0 HB3 ASN A 136 23.818 -13.468 7.629 1.00 62.40 H new ATOM 0 HD21 ASN A 136 25.332 -14.778 10.783 1.00 43.45 H new ATOM 0 HD22 ASN A 136 24.987 -15.407 9.169 1.00 43.45 H new ATOM 2026 N ILE A 137 27.705 -13.087 7.982 1.00 63.13 N ATOM 2027 CA ILE A 137 29.025 -13.047 8.600 1.00 73.12 C ATOM 2028 C ILE A 137 28.929 -12.673 10.075 1.00 25.42 C ATOM 2029 O ILE A 137 29.192 -11.533 10.457 1.00 51.55 O ATOM 2030 CB ILE A 137 29.950 -12.044 7.886 1.00 25.15 C ATOM 2031 CG1 ILE A 137 30.019 -12.355 6.390 1.00 73.01 C ATOM 2032 CG2 ILE A 137 31.341 -12.075 8.503 1.00 32.34 C ATOM 2033 CD1 ILE A 137 28.914 -11.704 5.587 1.00 64.44 C ATOM 0 H ILE A 137 27.266 -12.174 7.866 1.00 63.13 H new ATOM 0 HA ILE A 137 29.448 -14.047 8.508 1.00 73.12 H new ATOM 0 HB ILE A 137 29.540 -11.042 8.011 1.00 25.15 H new ATOM 0 HG12 ILE A 137 30.982 -12.024 6.002 1.00 73.01 H new ATOM 0 HG13 ILE A 137 29.972 -13.435 6.249 1.00 73.01 H new ATOM 0 HG21 ILE A 137 31.984 -11.361 7.988 1.00 32.34 H new ATOM 0 HG22 ILE A 137 31.277 -11.810 9.558 1.00 32.34 H new ATOM 0 HG23 ILE A 137 31.760 -13.076 8.405 1.00 32.34 H new ATOM 0 HD11 ILE A 137 29.025 -11.967 4.535 1.00 64.44 H new ATOM 0 HD12 ILE A 137 27.947 -12.054 5.949 1.00 64.44 H new ATOM 0 HD13 ILE A 137 28.973 -10.621 5.698 1.00 64.44 H new ATOM 2045 N LYS A 138 28.554 -13.643 10.902 1.00 12.03 N ATOM 2046 CA LYS A 138 28.426 -13.419 12.337 1.00 5.54 C ATOM 2047 C LYS A 138 29.689 -12.775 12.902 1.00 63.44 C ATOM 2048 O LYS A 138 29.619 -11.890 13.753 1.00 33.15 O ATOM 2049 CB LYS A 138 28.148 -14.739 13.058 1.00 22.53 C ATOM 2050 CG LYS A 138 29.232 -15.784 12.854 1.00 1.22 C ATOM 2051 CD LYS A 138 30.226 -15.788 14.004 1.00 40.24 C ATOM 2052 CE LYS A 138 29.968 -16.943 14.959 1.00 2.43 C ATOM 2053 NZ LYS A 138 30.959 -18.041 14.783 1.00 54.44 N ATOM 0 H LYS A 138 28.333 -14.593 10.603 1.00 12.03 H new ATOM 0 HA LYS A 138 27.589 -12.740 12.500 1.00 5.54 H new ATOM 0 HB2 LYS A 138 28.039 -14.544 14.125 1.00 22.53 H new ATOM 0 HB3 LYS A 138 27.197 -15.141 12.708 1.00 22.53 H new ATOM 0 HG2 LYS A 138 28.776 -16.770 12.763 1.00 1.22 H new ATOM 0 HG3 LYS A 138 29.757 -15.588 11.919 1.00 1.22 H new ATOM 0 HD2 LYS A 138 31.240 -15.860 13.610 1.00 40.24 H new ATOM 0 HD3 LYS A 138 30.161 -14.845 14.546 1.00 40.24 H new ATOM 0 HE2 LYS A 138 30.007 -16.580 15.986 1.00 2.43 H new ATOM 0 HE3 LYS A 138 28.963 -17.332 14.796 1.00 2.43 H new ATOM 0 HZ1 LYS A 138 30.749 -18.809 15.452 1.00 54.44 H new ATOM 0 HZ2 LYS A 138 30.905 -18.405 13.810 1.00 54.44 H new ATOM 0 HZ3 LYS A 138 31.916 -17.677 14.964 1.00 54.44 H new ATOM 2067 N ALA A 139 30.843 -13.226 12.420 1.00 42.20 N ATOM 2068 CA ALA A 139 32.121 -12.692 12.874 1.00 41.40 C ATOM 2069 C ALA A 139 33.282 -13.330 12.119 1.00 2.40 C ATOM 2070 O ALA A 139 33.878 -12.711 11.236 1.00 11.03 O ATOM 2071 CB ALA A 139 32.281 -12.907 14.372 1.00 51.23 C ATOM 0 H ALA A 139 30.919 -13.960 11.715 1.00 42.20 H new ATOM 0 HA ALA A 139 32.133 -11.622 12.669 1.00 41.40 H new ATOM 0 HB1 ALA A 139 33.240 -12.503 14.697 1.00 51.23 H new ATOM 0 HB2 ALA A 139 31.475 -12.398 14.901 1.00 51.23 H new ATOM 0 HB3 ALA A 139 32.243 -13.974 14.593 1.00 51.23 H new ATOM 2077 N THR A 140 33.601 -14.571 12.472 1.00 74.32 N ATOM 2078 CA THR A 140 34.692 -15.292 11.829 1.00 72.41 C ATOM 2079 C THR A 140 34.669 -16.770 12.202 1.00 62.30 C ATOM 2080 O THR A 140 34.558 -17.637 11.335 1.00 23.44 O ATOM 2081 CB THR A 140 36.060 -14.699 12.212 1.00 4.34 C ATOM 2082 OG1 THR A 140 35.941 -13.928 13.413 1.00 30.14 O ATOM 2083 CG2 THR A 140 36.603 -13.823 11.093 1.00 11.54 C ATOM 0 H THR A 140 33.119 -15.098 13.200 1.00 74.32 H new ATOM 0 HA THR A 140 34.548 -15.189 10.753 1.00 72.41 H new ATOM 0 HB THR A 140 36.755 -15.523 12.377 1.00 4.34 H new ATOM 0 HG1 THR A 140 36.816 -13.556 13.651 1.00 30.14 H new ATOM 0 HG21 THR A 140 37.570 -13.415 11.387 1.00 11.54 H new ATOM 0 HG22 THR A 140 36.720 -14.420 10.188 1.00 11.54 H new ATOM 0 HG23 THR A 140 35.908 -13.006 10.901 1.00 11.54 H new ATOM 2091 N SER A 141 34.774 -17.051 13.497 1.00 3.30 N ATOM 2092 CA SER A 141 34.769 -18.425 13.984 1.00 10.05 C ATOM 2093 C SER A 141 34.690 -18.461 15.508 1.00 42.23 C ATOM 2094 O SER A 141 34.801 -17.429 16.169 1.00 22.13 O ATOM 2095 CB SER A 141 36.023 -19.162 13.510 1.00 40.31 C ATOM 2096 OG SER A 141 35.724 -20.041 12.439 1.00 12.44 O ATOM 0 H SER A 141 34.864 -16.345 14.228 1.00 3.30 H new ATOM 0 HA SER A 141 33.888 -18.924 13.579 1.00 10.05 H new ATOM 0 HB2 SER A 141 36.775 -18.440 13.193 1.00 40.31 H new ATOM 0 HB3 SER A 141 36.452 -19.726 14.338 1.00 40.31 H new ATOM 0 HG SER A 141 35.235 -19.554 11.743 1.00 12.44 H new ATOM 2102 N GLN A 142 34.498 -19.656 16.056 1.00 74.10 N ATOM 2103 CA GLN A 142 34.403 -19.827 17.501 1.00 40.10 C ATOM 2104 C GLN A 142 35.480 -20.781 18.008 1.00 55.10 C ATOM 2105 O GLN A 142 35.748 -20.803 19.208 1.00 15.13 O ATOM 2106 CB GLN A 142 33.018 -20.352 17.884 1.00 2.42 C ATOM 2107 CG GLN A 142 32.765 -21.782 17.438 1.00 72.53 C ATOM 2108 CD GLN A 142 31.294 -22.148 17.458 1.00 32.43 C ATOM 2109 OE1 GLN A 142 30.432 -21.292 17.660 1.00 60.32 O ATOM 2110 NE2 GLN A 142 30.998 -23.426 17.249 1.00 23.02 N ATOM 0 H GLN A 142 34.405 -20.520 15.522 1.00 74.10 H new ATOM 0 HA GLN A 142 34.556 -18.854 17.968 1.00 40.10 H new ATOM 0 HB2 GLN A 142 32.902 -20.292 18.966 1.00 2.42 H new ATOM 0 HB3 GLN A 142 32.259 -19.704 17.446 1.00 2.42 H new ATOM 0 HG2 GLN A 142 33.156 -21.919 16.430 1.00 72.53 H new ATOM 0 HG3 GLN A 142 33.314 -22.464 18.088 1.00 72.53 H new ATOM 0 HE21 GLN A 142 31.744 -24.102 17.086 1.00 23.02 H new ATOM 0 HE22 GLN A 142 30.025 -23.731 17.252 1.00 23.02 H new TER 2119 GLN A 142 HETATM 2120 ZN ZN A 201 17.045 -11.084 18.201 1.00 3.54 ZN