USER MOD reduce.3.24.130724 H: found=0, std=0, add=1396, rem=0, adj=53 USER MOD reduce.3.24.130724 removed 1396 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 53 GLN :FLIP amide:sc= -0.828 F(o=-4.4!,f=0.62) USER MOD Set 1.2: A 55 TYR OH : rot 55:sc= 1.38 USER MOD Set 1.3: A 72 SER OG : rot -16:sc= 0.0701 USER MOD Set 2.1: A 45 TYR OH : rot 28:sc= 0.179 USER MOD Set 2.2: A 79 CYS SG : rot 112:sc= -2.28! USER MOD Single : A 1 GLY N :NH3+ 154:sc= 0.0151 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -0.459 X(o=-0.46,f=-0.19) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 TYR OH : rot 75:sc= 0.145 USER MOD Single : A 18 THR OG1 : rot -123:sc= 0.789 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 CYS SG : rot 120:sc= -0.578 USER MOD Single : A 24 ASN : amide:sc= -0.222 K(o=-0.22,f=-1.5) USER MOD Single : A 26 GLN : amide:sc= -1.38 X(o=-1.4,f=-1.2) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 32 CYS SG : rot 3:sc= 0.143 USER MOD Single : A 33 ASN :FLIP amide:sc= -1.17 F(o=-2.7,f=-1.2) USER MOD Single : A 34 SER OG : rot -78:sc= 0.765 USER MOD Single : A 39 SER OG : rot 180:sc= -0.751 USER MOD Single : A 41 CYS SG : rot 136:sc= 0.11 USER MOD Single : A 43 MET CE :methyl -109:sc= -2.04! (180deg=-3.97!) USER MOD Single : A 49 ASN : amide:sc= -0.0108 X(o=-0.011,f=0) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 GLN :FLIP amide:sc= -0.0336 F(o=-0.94,f=-0.034) USER MOD Single : A 54 GLN : amide:sc= 0.455 K(o=0.46,f=-5!) USER MOD Single : A 62 TYR OH : rot -90:sc= 0.372 USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 GLN : amide:sc= -0.0215 X(o=-0.021,f=-0.083) USER MOD Single : A 69 MET CE :methyl 160:sc= -0.112 (180deg=-0.565) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot -53:sc= -1.24! USER MOD Single : A 78 CYS SG : rot 120:sc= -2.75! USER MOD Single : A 83 GLN :FLIP amide:sc= -0.254 F(o=-4.5!,f=-0.25) USER MOD Single : A 84 THR OG1 : rot 104:sc= 0.53 USER MOD Single : A 86 SER OG : rot 3:sc= -0.0679 USER MOD Single : A 87 HIS : no HD1:sc= -0.278 K(o=-0.28,f=-1.1) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 HIS : no HD1:sc= -1.27 K(o=-1.3,f=-2.9) USER MOD Single : A 98 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00993) USER MOD Single : A 101 MET CE :methyl -118:sc= -1.53 (180deg=-2.18!) USER MOD Single : A 102 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot 15:sc= 0.37 USER MOD Single : A 108 CYS SG : rot 180:sc= -0.607 USER MOD Single : A 110 SER OG : rot 180:sc= -1.36 USER MOD Single : A 112 GLN :FLIP amide:sc= -0.0593 F(o=-0.78,f=-0.059) USER MOD Single : A 116 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0.0102 USER MOD Single : A 122 SER OG : rot -88:sc= -0.0358 USER MOD Single : A 124 HIS :FLIP no HD1:sc= -1.13 F(o=-2.1,f=-1.1) USER MOD Single : A 129 CYS SG : rot 180:sc= -1.13 USER MOD Single : A 133 TYR OH : rot 30:sc= 0 USER MOD Single : A 137 ASN : amide:sc= -0.0575 K(o=-0.057,f=-0.9) USER MOD Single : A 138 TYR OH : rot 180:sc= -0.0727 USER MOD Single : A 142 GLN : amide:sc= -1 K(o=-1,f=-4.4!) USER MOD Single : A 143 TYR OH : rot 30:sc= -0.225 USER MOD Single : A 148 GLN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 150 TYR OH : rot 70:sc= -0.892! USER MOD Single : A 153 CYS SG : rot -77:sc= -2.57! USER MOD Single : A 154 GLN : amide:sc= -2.52! X(o=-2.5!,f=-2.1) USER MOD Single : A 159 MET CE :methyl -166:sc= -0.041 (180deg=-0.29) USER MOD Single : A 162 LYS NZ :NH3+ -145:sc= 0.565 (180deg=0.00307) USER MOD Single : A 165 SER OG : rot -77:sc= -1.05 USER MOD Single : A 173 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.361 11.701 6.056 1.00 22.35 N ATOM 2 CA GLY A 1 10.037 10.421 6.720 1.00 23.31 C ATOM 3 C GLY A 1 11.271 9.594 7.005 1.00 22.54 C ATOM 4 O GLY A 1 12.268 9.705 6.283 1.00 60.33 O ATOM 0 H1 GLY A 1 9.543 12.020 5.499 1.00 22.35 H new ATOM 0 H2 GLY A 1 10.591 12.417 6.775 1.00 22.35 H new ATOM 0 H3 GLY A 1 11.178 11.568 5.426 1.00 22.35 H new ATOM 0 HA2 GLY A 1 9.513 10.621 7.654 1.00 23.31 H new ATOM 0 HA3 GLY A 1 9.357 9.849 6.089 1.00 23.31 H new ATOM 10 N LYS A 2 11.205 8.761 8.054 1.00 34.23 N ATOM 11 CA LYS A 2 12.320 7.893 8.473 1.00 33.21 C ATOM 12 C LYS A 2 11.769 6.516 8.848 1.00 63.33 C ATOM 13 O LYS A 2 10.641 6.414 9.351 1.00 50.02 O ATOM 14 CB LYS A 2 13.081 8.527 9.671 1.00 23.32 C ATOM 15 CG LYS A 2 14.359 7.766 10.112 1.00 4.11 C ATOM 16 CD LYS A 2 15.064 8.418 11.324 1.00 74.25 C ATOM 17 CE LYS A 2 15.461 9.885 11.082 1.00 25.02 C ATOM 18 NZ LYS A 2 16.177 10.471 12.248 1.00 41.14 N ATOM 0 H LYS A 2 10.375 8.669 8.639 1.00 34.23 H new ATOM 0 HA LYS A 2 13.026 7.784 7.650 1.00 33.21 H new ATOM 0 HB2 LYS A 2 13.357 9.548 9.407 1.00 23.32 H new ATOM 0 HB3 LYS A 2 12.402 8.590 10.521 1.00 23.32 H new ATOM 0 HG2 LYS A 2 14.095 6.738 10.362 1.00 4.11 H new ATOM 0 HG3 LYS A 2 15.055 7.721 9.275 1.00 4.11 H new ATOM 0 HD2 LYS A 2 14.404 8.366 12.190 1.00 74.25 H new ATOM 0 HD3 LYS A 2 15.957 7.843 11.568 1.00 74.25 H new ATOM 0 HE2 LYS A 2 16.096 9.947 10.198 1.00 25.02 H new ATOM 0 HE3 LYS A 2 14.567 10.472 10.874 1.00 25.02 H new ATOM 0 HZ1 LYS A 2 16.425 11.460 12.042 1.00 41.14 H new ATOM 0 HZ2 LYS A 2 15.562 10.436 13.086 1.00 41.14 H new ATOM 0 HZ3 LYS A 2 17.044 9.927 12.432 1.00 41.14 H new ATOM 32 N ILE A 3 12.564 5.468 8.600 1.00 54.43 N ATOM 33 CA ILE A 3 12.175 4.081 8.872 1.00 54.41 C ATOM 34 C ILE A 3 13.427 3.238 9.192 1.00 53.15 C ATOM 35 O ILE A 3 14.514 3.502 8.667 1.00 43.22 O ATOM 36 CB ILE A 3 11.382 3.495 7.643 1.00 45.22 C ATOM 37 CG1 ILE A 3 10.704 2.131 7.962 1.00 53.41 C ATOM 38 CG2 ILE A 3 12.286 3.375 6.393 1.00 21.23 C ATOM 39 CD1 ILE A 3 9.768 1.641 6.863 1.00 51.14 C ATOM 0 H ILE A 3 13.499 5.560 8.203 1.00 54.43 H new ATOM 0 HA ILE A 3 11.518 4.049 9.741 1.00 54.41 H new ATOM 0 HB ILE A 3 10.585 4.207 7.427 1.00 45.22 H new ATOM 0 HG12 ILE A 3 11.477 1.381 8.130 1.00 53.41 H new ATOM 0 HG13 ILE A 3 10.142 2.223 8.892 1.00 53.41 H new ATOM 0 HG21 ILE A 3 11.708 2.968 5.564 1.00 21.23 H new ATOM 0 HG22 ILE A 3 12.665 4.361 6.122 1.00 21.23 H new ATOM 0 HG23 ILE A 3 13.123 2.712 6.612 1.00 21.23 H new ATOM 0 HD11 ILE A 3 9.332 0.686 7.155 1.00 51.14 H new ATOM 0 HD12 ILE A 3 8.973 2.371 6.710 1.00 51.14 H new ATOM 0 HD13 ILE A 3 10.329 1.516 5.937 1.00 51.14 H new ATOM 51 N THR A 4 13.263 2.236 10.069 1.00 25.34 N ATOM 52 CA THR A 4 14.330 1.298 10.456 1.00 44.44 C ATOM 53 C THR A 4 13.757 -0.127 10.493 1.00 53.01 C ATOM 54 O THR A 4 12.674 -0.351 11.028 1.00 12.24 O ATOM 55 CB THR A 4 14.950 1.666 11.846 1.00 52.42 C ATOM 56 OG1 THR A 4 15.385 3.028 11.821 1.00 65.32 O ATOM 57 CG2 THR A 4 16.149 0.768 12.223 1.00 3.21 C ATOM 0 H THR A 4 12.375 2.051 10.536 1.00 25.34 H new ATOM 0 HA THR A 4 15.129 1.361 9.717 1.00 44.44 H new ATOM 0 HB THR A 4 14.174 1.512 12.596 1.00 52.42 H new ATOM 0 HG1 THR A 4 15.773 3.264 12.690 1.00 65.32 H new ATOM 0 HG21 THR A 4 16.538 1.069 13.196 1.00 3.21 H new ATOM 0 HG22 THR A 4 15.825 -0.272 12.268 1.00 3.21 H new ATOM 0 HG23 THR A 4 16.932 0.872 11.472 1.00 3.21 H new ATOM 65 N PHE A 5 14.516 -1.072 9.937 1.00 0.33 N ATOM 66 CA PHE A 5 14.100 -2.464 9.723 1.00 62.35 C ATOM 67 C PHE A 5 14.873 -3.373 10.667 1.00 52.24 C ATOM 68 O PHE A 5 15.992 -3.040 11.060 1.00 71.51 O ATOM 69 CB PHE A 5 14.403 -2.873 8.258 1.00 21.44 C ATOM 70 CG PHE A 5 13.835 -1.905 7.231 1.00 45.13 C ATOM 71 CD1 PHE A 5 12.491 -1.934 6.909 1.00 62.54 C ATOM 72 CD2 PHE A 5 14.644 -0.957 6.596 1.00 61.04 C ATOM 73 CE1 PHE A 5 11.973 -1.056 5.993 1.00 60.02 C ATOM 74 CE2 PHE A 5 14.121 -0.078 5.672 1.00 41.24 C ATOM 75 CZ PHE A 5 12.782 -0.127 5.368 1.00 35.15 C ATOM 0 H PHE A 5 15.465 -0.888 9.613 1.00 0.33 H new ATOM 0 HA PHE A 5 13.031 -2.558 9.916 1.00 62.35 H new ATOM 0 HB2 PHE A 5 15.482 -2.942 8.124 1.00 21.44 H new ATOM 0 HB3 PHE A 5 13.995 -3.867 8.074 1.00 21.44 H new ATOM 0 HD1 PHE A 5 11.843 -2.656 7.384 1.00 62.54 H new ATOM 0 HD2 PHE A 5 15.697 -0.913 6.834 1.00 61.04 H new ATOM 0 HE1 PHE A 5 10.920 -1.091 5.757 1.00 60.02 H new ATOM 0 HE2 PHE A 5 14.761 0.646 5.189 1.00 41.24 H new ATOM 0 HZ PHE A 5 12.364 0.557 4.644 1.00 35.15 H new ATOM 85 N TYR A 6 14.264 -4.504 11.032 1.00 50.34 N ATOM 86 CA TYR A 6 14.895 -5.560 11.845 1.00 15.52 C ATOM 87 C TYR A 6 14.404 -6.909 11.311 1.00 32.04 C ATOM 88 O TYR A 6 13.189 -7.167 11.332 1.00 70.01 O ATOM 89 CB TYR A 6 14.516 -5.402 13.347 1.00 40.12 C ATOM 90 CG TYR A 6 14.999 -4.097 13.991 1.00 23.45 C ATOM 91 CD1 TYR A 6 14.173 -2.970 14.056 1.00 23.51 C ATOM 92 CD2 TYR A 6 16.293 -3.986 14.506 1.00 52.41 C ATOM 93 CE1 TYR A 6 14.625 -1.787 14.605 1.00 25.23 C ATOM 94 CE2 TYR A 6 16.740 -2.807 15.062 1.00 31.00 C ATOM 95 CZ TYR A 6 15.907 -1.713 15.106 1.00 14.34 C ATOM 96 OH TYR A 6 16.366 -0.534 15.643 1.00 41.14 O ATOM 0 H TYR A 6 13.302 -4.720 10.769 1.00 50.34 H new ATOM 0 HA TYR A 6 15.981 -5.491 11.774 1.00 15.52 H new ATOM 0 HB2 TYR A 6 13.432 -5.460 13.443 1.00 40.12 H new ATOM 0 HB3 TYR A 6 14.931 -6.242 13.904 1.00 40.12 H new ATOM 0 HD1 TYR A 6 13.166 -3.026 13.671 1.00 23.51 H new ATOM 0 HD2 TYR A 6 16.954 -4.839 14.468 1.00 52.41 H new ATOM 0 HE1 TYR A 6 13.977 -0.924 14.642 1.00 25.23 H new ATOM 0 HE2 TYR A 6 17.741 -2.742 15.462 1.00 31.00 H new ATOM 0 HH TYR A 6 17.289 -0.652 15.952 1.00 41.14 H new ATOM 106 N GLU A 7 15.337 -7.755 10.819 1.00 73.21 N ATOM 107 CA GLU A 7 14.990 -9.041 10.172 1.00 23.00 C ATOM 108 C GLU A 7 14.205 -9.982 11.096 1.00 63.31 C ATOM 109 O GLU A 7 13.281 -10.648 10.643 1.00 14.41 O ATOM 110 CB GLU A 7 16.235 -9.768 9.609 1.00 0.40 C ATOM 111 CG GLU A 7 16.896 -9.063 8.400 1.00 43.25 C ATOM 112 CD GLU A 7 17.667 -10.028 7.479 1.00 74.35 C ATOM 113 OE1 GLU A 7 18.722 -10.537 7.894 1.00 63.13 O ATOM 114 OE2 GLU A 7 17.215 -10.280 6.336 1.00 14.13 O ATOM 0 H GLU A 7 16.339 -7.569 10.858 1.00 73.21 H new ATOM 0 HA GLU A 7 14.339 -8.776 9.339 1.00 23.00 H new ATOM 0 HB2 GLU A 7 16.974 -9.867 10.405 1.00 0.40 H new ATOM 0 HB3 GLU A 7 15.948 -10.777 9.313 1.00 0.40 H new ATOM 0 HG2 GLU A 7 16.126 -8.555 7.819 1.00 43.25 H new ATOM 0 HG3 GLU A 7 17.579 -8.296 8.764 1.00 43.25 H new ATOM 121 N ASP A 8 14.577 -10.027 12.378 1.00 5.44 N ATOM 122 CA ASP A 8 13.876 -10.839 13.395 1.00 42.31 C ATOM 123 C ASP A 8 12.908 -9.957 14.187 1.00 41.25 C ATOM 124 O ASP A 8 12.964 -8.728 14.087 1.00 34.12 O ATOM 125 CB ASP A 8 14.897 -11.502 14.351 1.00 55.10 C ATOM 126 CG ASP A 8 15.793 -12.523 13.635 1.00 50.33 C ATOM 127 OD1 ASP A 8 16.830 -12.125 13.076 1.00 3.32 O ATOM 128 OD2 ASP A 8 15.453 -13.718 13.611 1.00 65.34 O ATOM 0 H ASP A 8 15.371 -9.504 12.747 1.00 5.44 H new ATOM 0 HA ASP A 8 13.312 -11.624 12.892 1.00 42.31 H new ATOM 0 HB2 ASP A 8 15.520 -10.731 14.804 1.00 55.10 H new ATOM 0 HB3 ASP A 8 14.363 -11.997 15.162 1.00 55.10 H new ATOM 133 N ARG A 9 12.030 -10.600 14.989 1.00 13.22 N ATOM 134 CA ARG A 9 11.098 -9.893 15.893 1.00 61.25 C ATOM 135 C ARG A 9 11.863 -9.339 17.108 1.00 31.11 C ATOM 136 O ARG A 9 13.085 -9.518 17.225 1.00 23.43 O ATOM 137 CB ARG A 9 9.922 -10.813 16.364 1.00 34.32 C ATOM 138 CG ARG A 9 8.998 -11.350 15.236 1.00 74.44 C ATOM 139 CD ARG A 9 9.500 -12.653 14.590 1.00 33.30 C ATOM 140 NE ARG A 9 9.346 -13.813 15.489 1.00 4.23 N ATOM 141 CZ ARG A 9 9.603 -15.096 15.164 1.00 75.11 C ATOM 142 NH1 ARG A 9 10.043 -15.425 13.954 1.00 71.45 N ATOM 143 NH2 ARG A 9 9.406 -16.046 16.066 1.00 63.11 N ATOM 0 H ARG A 9 11.948 -11.616 15.027 1.00 13.22 H new ATOM 0 HA ARG A 9 10.658 -9.068 15.333 1.00 61.25 H new ATOM 0 HB2 ARG A 9 10.342 -11.663 16.901 1.00 34.32 H new ATOM 0 HB3 ARG A 9 9.312 -10.257 17.075 1.00 34.32 H new ATOM 0 HG2 ARG A 9 8.002 -11.518 15.645 1.00 74.44 H new ATOM 0 HG3 ARG A 9 8.901 -10.587 14.464 1.00 74.44 H new ATOM 0 HD2 ARG A 9 8.950 -12.835 13.667 1.00 33.30 H new ATOM 0 HD3 ARG A 9 10.550 -12.542 14.319 1.00 33.30 H new ATOM 0 HE ARG A 9 9.017 -13.629 16.437 1.00 4.23 H new ATOM 0 HH11 ARG A 9 10.192 -14.701 13.251 1.00 71.45 H new ATOM 0 HH12 ARG A 9 10.232 -16.402 13.728 1.00 71.45 H new ATOM 0 HH21 ARG A 9 9.063 -15.803 16.996 1.00 63.11 H new ATOM 0 HH22 ARG A 9 9.597 -17.020 15.831 1.00 63.11 H new ATOM 157 N ALA A 10 11.120 -8.638 17.990 1.00 41.04 N ATOM 158 CA ALA A 10 11.649 -8.063 19.243 1.00 32.12 C ATOM 159 C ALA A 10 12.757 -7.020 18.979 1.00 10.44 C ATOM 160 O ALA A 10 13.604 -6.781 19.846 1.00 35.42 O ATOM 161 CB ALA A 10 12.112 -9.182 20.210 1.00 73.12 C ATOM 0 H ALA A 10 10.127 -8.454 17.850 1.00 41.04 H new ATOM 0 HA ALA A 10 10.837 -7.525 19.731 1.00 32.12 H new ATOM 0 HB1 ALA A 10 12.498 -8.735 21.126 1.00 73.12 H new ATOM 0 HB2 ALA A 10 11.268 -9.828 20.449 1.00 73.12 H new ATOM 0 HB3 ALA A 10 12.897 -9.771 19.736 1.00 73.12 H new ATOM 167 N PHE A 11 12.693 -6.382 17.783 1.00 5.44 N ATOM 168 CA PHE A 11 13.668 -5.373 17.320 1.00 13.34 C ATOM 169 C PHE A 11 15.093 -5.956 17.306 1.00 34.22 C ATOM 170 O PHE A 11 16.026 -5.408 17.905 1.00 43.23 O ATOM 171 CB PHE A 11 13.553 -4.055 18.142 1.00 22.44 C ATOM 172 CG PHE A 11 12.185 -3.374 18.002 1.00 32.30 C ATOM 173 CD1 PHE A 11 11.903 -2.558 16.903 1.00 1.32 C ATOM 174 CD2 PHE A 11 11.181 -3.562 18.952 1.00 32.44 C ATOM 175 CE1 PHE A 11 10.665 -1.963 16.758 1.00 41.31 C ATOM 176 CE2 PHE A 11 9.946 -2.961 18.805 1.00 31.14 C ATOM 177 CZ PHE A 11 9.692 -2.161 17.712 1.00 64.21 C ATOM 0 H PHE A 11 11.950 -6.560 17.107 1.00 5.44 H new ATOM 0 HA PHE A 11 13.431 -5.106 16.290 1.00 13.34 H new ATOM 0 HB2 PHE A 11 13.737 -4.273 19.194 1.00 22.44 H new ATOM 0 HB3 PHE A 11 14.331 -3.363 17.819 1.00 22.44 H new ATOM 0 HD1 PHE A 11 12.665 -2.390 16.156 1.00 1.32 H new ATOM 0 HD2 PHE A 11 11.372 -4.185 19.813 1.00 32.44 H new ATOM 0 HE1 PHE A 11 10.460 -1.343 15.897 1.00 41.31 H new ATOM 0 HE2 PHE A 11 9.178 -3.118 19.548 1.00 31.14 H new ATOM 0 HZ PHE A 11 8.727 -1.688 17.603 1.00 64.21 H new ATOM 187 N GLN A 12 15.233 -7.087 16.592 1.00 1.34 N ATOM 188 CA GLN A 12 16.489 -7.856 16.513 1.00 43.41 C ATOM 189 C GLN A 12 16.743 -8.300 15.058 1.00 54.51 C ATOM 190 O GLN A 12 15.882 -8.133 14.195 1.00 52.20 O ATOM 191 CB GLN A 12 16.432 -9.077 17.502 1.00 32.41 C ATOM 192 CG GLN A 12 17.806 -9.576 18.001 1.00 51.54 C ATOM 193 CD GLN A 12 18.638 -8.521 18.745 1.00 35.44 C ATOM 194 OE1 GLN A 12 19.866 -8.523 18.668 1.00 31.22 O ATOM 195 NE2 GLN A 12 17.989 -7.634 19.493 1.00 2.13 N ATOM 0 H GLN A 12 14.473 -7.497 16.049 1.00 1.34 H new ATOM 0 HA GLN A 12 17.326 -7.227 16.815 1.00 43.41 H new ATOM 0 HB2 GLN A 12 15.828 -8.798 18.365 1.00 32.41 H new ATOM 0 HB3 GLN A 12 15.920 -9.902 17.008 1.00 32.41 H new ATOM 0 HG2 GLN A 12 17.650 -10.429 18.662 1.00 51.54 H new ATOM 0 HG3 GLN A 12 18.379 -9.936 17.147 1.00 51.54 H new ATOM 0 HE21 GLN A 12 16.970 -7.654 19.539 1.00 2.13 H new ATOM 0 HE22 GLN A 12 18.510 -6.933 20.020 1.00 2.13 H new ATOM 204 N GLY A 13 17.927 -8.870 14.795 1.00 75.31 N ATOM 205 CA GLY A 13 18.337 -9.253 13.442 1.00 1.41 C ATOM 206 C GLY A 13 19.075 -8.132 12.732 1.00 43.04 C ATOM 207 O GLY A 13 19.485 -7.156 13.377 1.00 14.33 O ATOM 0 H GLY A 13 18.623 -9.077 15.512 1.00 75.31 H new ATOM 0 HA2 GLY A 13 18.978 -10.133 13.493 1.00 1.41 H new ATOM 0 HA3 GLY A 13 17.457 -9.532 12.862 1.00 1.41 H new ATOM 211 N ARG A 14 19.253 -8.267 11.408 1.00 54.21 N ATOM 212 CA ARG A 14 19.969 -7.269 10.599 1.00 15.11 C ATOM 213 C ARG A 14 19.134 -5.975 10.519 1.00 62.41 C ATOM 214 O ARG A 14 17.994 -5.988 10.035 1.00 12.14 O ATOM 215 CB ARG A 14 20.267 -7.826 9.183 1.00 45.31 C ATOM 216 CG ARG A 14 21.111 -6.909 8.269 1.00 25.42 C ATOM 217 CD ARG A 14 22.524 -6.667 8.824 1.00 74.43 C ATOM 218 NE ARG A 14 23.400 -5.989 7.854 1.00 20.40 N ATOM 219 CZ ARG A 14 24.628 -5.509 8.136 1.00 63.21 C ATOM 220 NH1 ARG A 14 25.139 -5.620 9.365 1.00 21.30 N ATOM 221 NH2 ARG A 14 25.357 -4.945 7.179 1.00 21.00 N ATOM 0 H ARG A 14 18.908 -9.064 10.873 1.00 54.21 H new ATOM 0 HA ARG A 14 20.924 -7.042 11.073 1.00 15.11 H new ATOM 0 HB2 ARG A 14 20.785 -8.779 9.289 1.00 45.31 H new ATOM 0 HB3 ARG A 14 19.319 -8.031 8.686 1.00 45.31 H new ATOM 0 HG2 ARG A 14 21.185 -7.357 7.278 1.00 25.42 H new ATOM 0 HG3 ARG A 14 20.602 -5.953 8.149 1.00 25.42 H new ATOM 0 HD2 ARG A 14 22.457 -6.066 9.731 1.00 74.43 H new ATOM 0 HD3 ARG A 14 22.969 -7.621 9.106 1.00 74.43 H new ATOM 0 HE ARG A 14 23.053 -5.874 6.902 1.00 20.40 H new ATOM 0 HH11 ARG A 14 24.599 -6.072 10.103 1.00 21.30 H new ATOM 0 HH12 ARG A 14 26.069 -5.253 9.566 1.00 21.30 H new ATOM 0 HH21 ARG A 14 24.988 -4.875 6.231 1.00 21.00 H new ATOM 0 HH22 ARG A 14 26.286 -4.582 7.393 1.00 21.00 H new ATOM 235 N SER A 15 19.711 -4.877 11.023 1.00 45.42 N ATOM 236 CA SER A 15 19.055 -3.569 11.074 1.00 13.43 C ATOM 237 C SER A 15 19.519 -2.697 9.898 1.00 3.13 C ATOM 238 O SER A 15 20.706 -2.691 9.559 1.00 13.23 O ATOM 239 CB SER A 15 19.362 -2.888 12.427 1.00 31.34 C ATOM 240 OG SER A 15 20.763 -2.786 12.663 1.00 74.03 O ATOM 0 H SER A 15 20.655 -4.874 11.410 1.00 45.42 H new ATOM 0 HA SER A 15 17.976 -3.700 10.989 1.00 13.43 H new ATOM 0 HB2 SER A 15 18.918 -1.893 12.442 1.00 31.34 H new ATOM 0 HB3 SER A 15 18.898 -3.456 13.233 1.00 31.34 H new ATOM 0 HG SER A 15 20.918 -2.349 13.526 1.00 74.03 H new ATOM 246 N TYR A 16 18.573 -1.984 9.276 1.00 70.31 N ATOM 247 CA TYR A 16 18.855 -1.016 8.200 1.00 24.21 C ATOM 248 C TYR A 16 17.938 0.198 8.369 1.00 5.15 C ATOM 249 O TYR A 16 16.753 0.036 8.605 1.00 40.53 O ATOM 250 CB TYR A 16 18.646 -1.661 6.796 1.00 63.11 C ATOM 251 CG TYR A 16 18.795 -0.668 5.618 1.00 64.32 C ATOM 252 CD1 TYR A 16 20.003 -0.003 5.382 1.00 74.14 C ATOM 253 CD2 TYR A 16 17.726 -0.382 4.760 1.00 71.41 C ATOM 254 CE1 TYR A 16 20.137 0.899 4.345 1.00 50.14 C ATOM 255 CE2 TYR A 16 17.860 0.518 3.721 1.00 1.52 C ATOM 256 CZ TYR A 16 19.065 1.158 3.518 1.00 54.42 C ATOM 257 OH TYR A 16 19.204 2.052 2.478 1.00 1.41 O ATOM 0 H TYR A 16 17.582 -2.060 9.504 1.00 70.31 H new ATOM 0 HA TYR A 16 19.897 -0.704 8.268 1.00 24.21 H new ATOM 0 HB2 TYR A 16 19.365 -2.470 6.669 1.00 63.11 H new ATOM 0 HB3 TYR A 16 17.653 -2.108 6.757 1.00 63.11 H new ATOM 0 HD1 TYR A 16 20.849 -0.199 6.024 1.00 74.14 H new ATOM 0 HD2 TYR A 16 16.778 -0.875 4.914 1.00 71.41 H new ATOM 0 HE1 TYR A 16 21.080 1.400 4.182 1.00 50.14 H new ATOM 0 HE2 TYR A 16 17.023 0.720 3.069 1.00 1.52 H new ATOM 0 HH TYR A 16 19.721 1.636 1.756 1.00 1.41 H new ATOM 267 N GLU A 17 18.489 1.405 8.239 1.00 31.22 N ATOM 268 CA GLU A 17 17.708 2.653 8.267 1.00 62.14 C ATOM 269 C GLU A 17 17.805 3.354 6.906 1.00 11.44 C ATOM 270 O GLU A 17 18.885 3.403 6.304 1.00 51.05 O ATOM 271 CB GLU A 17 18.219 3.589 9.397 1.00 64.34 C ATOM 272 CG GLU A 17 17.471 4.941 9.487 1.00 64.24 C ATOM 273 CD GLU A 17 17.995 5.851 10.609 1.00 4.53 C ATOM 274 OE1 GLU A 17 18.978 6.587 10.382 1.00 43.14 O ATOM 275 OE2 GLU A 17 17.432 5.823 11.725 1.00 14.13 O ATOM 0 H GLU A 17 19.490 1.551 8.111 1.00 31.22 H new ATOM 0 HA GLU A 17 16.664 2.413 8.470 1.00 62.14 H new ATOM 0 HB2 GLU A 17 18.127 3.071 10.352 1.00 64.34 H new ATOM 0 HB3 GLU A 17 19.280 3.783 9.241 1.00 64.34 H new ATOM 0 HG2 GLU A 17 17.561 5.462 8.534 1.00 64.24 H new ATOM 0 HG3 GLU A 17 16.410 4.751 9.648 1.00 64.24 H new ATOM 282 N THR A 18 16.672 3.884 6.421 1.00 54.54 N ATOM 283 CA THR A 18 16.634 4.744 5.235 1.00 21.42 C ATOM 284 C THR A 18 15.607 5.868 5.447 1.00 1.23 C ATOM 285 O THR A 18 14.606 5.700 6.159 1.00 34.01 O ATOM 286 CB THR A 18 16.339 3.945 3.913 1.00 53.13 C ATOM 287 OG1 THR A 18 16.451 4.814 2.776 1.00 52.10 O ATOM 288 CG2 THR A 18 14.957 3.273 3.907 1.00 24.43 C ATOM 0 H THR A 18 15.757 3.726 6.843 1.00 54.54 H new ATOM 0 HA THR A 18 17.625 5.179 5.108 1.00 21.42 H new ATOM 0 HB THR A 18 17.084 3.151 3.861 1.00 53.13 H new ATOM 0 HG1 THR A 18 15.611 4.802 2.271 1.00 52.10 H new ATOM 0 HG21 THR A 18 14.816 2.739 2.967 1.00 24.43 H new ATOM 0 HG22 THR A 18 14.890 2.570 4.738 1.00 24.43 H new ATOM 0 HG23 THR A 18 14.183 4.033 4.012 1.00 24.43 H new ATOM 296 N THR A 19 15.907 7.027 4.864 1.00 62.51 N ATOM 297 CA THR A 19 15.037 8.210 4.882 1.00 11.35 C ATOM 298 C THR A 19 14.582 8.538 3.449 1.00 70.32 C ATOM 299 O THR A 19 14.033 9.613 3.190 1.00 22.23 O ATOM 300 CB THR A 19 15.806 9.416 5.515 1.00 1.05 C ATOM 301 OG1 THR A 19 17.049 9.610 4.822 1.00 54.20 O ATOM 302 CG2 THR A 19 16.093 9.202 7.012 1.00 52.35 C ATOM 0 H THR A 19 16.778 7.177 4.355 1.00 62.51 H new ATOM 0 HA THR A 19 14.152 8.010 5.487 1.00 11.35 H new ATOM 0 HB THR A 19 15.170 10.296 5.418 1.00 1.05 H new ATOM 0 HG1 THR A 19 17.530 10.367 5.218 1.00 54.20 H new ATOM 0 HG21 THR A 19 16.628 10.065 7.407 1.00 52.35 H new ATOM 0 HG22 THR A 19 15.152 9.081 7.549 1.00 52.35 H new ATOM 0 HG23 THR A 19 16.702 8.307 7.141 1.00 52.35 H new ATOM 310 N THR A 20 14.786 7.576 2.524 1.00 71.31 N ATOM 311 CA THR A 20 14.475 7.735 1.094 1.00 31.20 C ATOM 312 C THR A 20 13.953 6.409 0.505 1.00 43.23 C ATOM 313 O THR A 20 14.195 5.326 1.064 1.00 54.03 O ATOM 314 CB THR A 20 15.744 8.226 0.301 1.00 31.21 C ATOM 315 OG1 THR A 20 16.360 9.319 1.003 1.00 54.40 O ATOM 316 CG2 THR A 20 15.429 8.694 -1.137 1.00 4.02 C ATOM 0 H THR A 20 15.174 6.661 2.754 1.00 71.31 H new ATOM 0 HA THR A 20 13.695 8.490 0.995 1.00 31.20 H new ATOM 0 HB THR A 20 16.410 7.366 0.231 1.00 31.21 H new ATOM 0 HG1 THR A 20 17.150 9.622 0.508 1.00 54.40 H new ATOM 0 HG21 THR A 20 16.349 9.018 -1.624 1.00 4.02 H new ATOM 0 HG22 THR A 20 14.991 7.870 -1.700 1.00 4.02 H new ATOM 0 HG23 THR A 20 14.724 9.525 -1.103 1.00 4.02 H new ATOM 324 N ASP A 21 13.223 6.525 -0.614 1.00 62.13 N ATOM 325 CA ASP A 21 12.689 5.393 -1.390 1.00 73.43 C ATOM 326 C ASP A 21 13.850 4.541 -1.964 1.00 70.35 C ATOM 327 O ASP A 21 14.863 5.097 -2.412 1.00 54.02 O ATOM 328 CB ASP A 21 11.800 5.929 -2.561 1.00 71.12 C ATOM 329 CG ASP A 21 10.665 6.883 -2.113 1.00 15.52 C ATOM 330 OD1 ASP A 21 9.478 6.585 -2.345 1.00 64.13 O ATOM 331 OD2 ASP A 21 10.964 7.944 -1.527 1.00 42.23 O ATOM 0 H ASP A 21 12.981 7.431 -1.016 1.00 62.13 H new ATOM 0 HA ASP A 21 12.085 4.768 -0.732 1.00 73.43 H new ATOM 0 HB2 ASP A 21 12.437 6.451 -3.276 1.00 71.12 H new ATOM 0 HB3 ASP A 21 11.360 5.081 -3.086 1.00 71.12 H new ATOM 336 N CYS A 22 13.695 3.207 -1.938 1.00 33.12 N ATOM 337 CA CYS A 22 14.695 2.263 -2.479 1.00 65.10 C ATOM 338 C CYS A 22 13.983 1.034 -3.090 1.00 14.11 C ATOM 339 O CYS A 22 13.336 0.280 -2.357 1.00 2.11 O ATOM 340 CB CYS A 22 15.675 1.811 -1.370 1.00 13.25 C ATOM 341 SG CYS A 22 16.870 0.560 -1.903 1.00 24.11 S ATOM 0 H CYS A 22 12.874 2.750 -1.542 1.00 33.12 H new ATOM 0 HA CYS A 22 15.265 2.770 -3.257 1.00 65.10 H new ATOM 0 HB2 CYS A 22 16.217 2.682 -1.002 1.00 13.25 H new ATOM 0 HB3 CYS A 22 15.101 1.416 -0.532 1.00 13.25 H new ATOM 0 HG CYS A 22 18.076 1.021 -1.755 1.00 24.11 H new ATOM 347 N PRO A 23 14.083 0.809 -4.448 1.00 72.21 N ATOM 348 CA PRO A 23 13.412 -0.330 -5.123 1.00 43.23 C ATOM 349 C PRO A 23 14.193 -1.659 -5.011 1.00 71.53 C ATOM 350 O PRO A 23 13.707 -2.706 -5.456 1.00 41.40 O ATOM 351 CB PRO A 23 13.345 0.155 -6.589 1.00 22.52 C ATOM 352 CG PRO A 23 14.574 0.997 -6.771 1.00 22.34 C ATOM 353 CD PRO A 23 14.851 1.644 -5.422 1.00 23.40 C ATOM 0 HA PRO A 23 12.445 -0.564 -4.677 1.00 43.23 H new ATOM 0 HB2 PRO A 23 13.335 -0.685 -7.283 1.00 22.52 H new ATOM 0 HB3 PRO A 23 12.439 0.732 -6.774 1.00 22.52 H new ATOM 0 HG2 PRO A 23 15.419 0.388 -7.091 1.00 22.34 H new ATOM 0 HG3 PRO A 23 14.417 1.753 -7.540 1.00 22.34 H new ATOM 0 HD2 PRO A 23 15.917 1.645 -5.192 1.00 23.40 H new ATOM 0 HD3 PRO A 23 14.520 2.682 -5.403 1.00 23.40 H new ATOM 361 N ASN A 24 15.407 -1.609 -4.431 1.00 34.20 N ATOM 362 CA ASN A 24 16.307 -2.771 -4.330 1.00 51.02 C ATOM 363 C ASN A 24 16.953 -2.795 -2.934 1.00 60.32 C ATOM 364 O ASN A 24 17.993 -2.165 -2.701 1.00 62.42 O ATOM 365 CB ASN A 24 17.399 -2.731 -5.444 1.00 11.15 C ATOM 366 CG ASN A 24 16.822 -2.759 -6.866 1.00 54.44 C ATOM 367 OD1 ASN A 24 16.546 -1.718 -7.462 1.00 53.14 O ATOM 368 ND2 ASN A 24 16.616 -3.948 -7.409 1.00 61.41 N ATOM 0 H ASN A 24 15.791 -0.759 -4.019 1.00 34.20 H new ATOM 0 HA ASN A 24 15.726 -3.682 -4.473 1.00 51.02 H new ATOM 0 HB2 ASN A 24 17.999 -1.830 -5.321 1.00 11.15 H new ATOM 0 HB3 ASN A 24 18.070 -3.581 -5.315 1.00 11.15 H new ATOM 0 HD21 ASN A 24 16.219 -4.019 -8.346 1.00 61.41 H new ATOM 0 HD22 ASN A 24 16.855 -4.794 -6.891 1.00 61.41 H new ATOM 375 N LEU A 25 16.301 -3.511 -1.994 1.00 13.22 N ATOM 376 CA LEU A 25 16.799 -3.692 -0.611 1.00 61.32 C ATOM 377 C LEU A 25 17.692 -4.948 -0.494 1.00 12.21 C ATOM 378 O LEU A 25 18.012 -5.366 0.617 1.00 45.13 O ATOM 379 CB LEU A 25 15.601 -3.747 0.384 1.00 2.22 C ATOM 380 CG LEU A 25 14.763 -2.429 0.495 1.00 72.43 C ATOM 381 CD1 LEU A 25 13.506 -2.620 1.365 1.00 4.22 C ATOM 382 CD2 LEU A 25 15.631 -1.260 1.017 1.00 54.03 C ATOM 0 H LEU A 25 15.413 -3.981 -2.171 1.00 13.22 H new ATOM 0 HA LEU A 25 17.421 -2.835 -0.352 1.00 61.32 H new ATOM 0 HB2 LEU A 25 14.936 -4.556 0.082 1.00 2.22 H new ATOM 0 HB3 LEU A 25 15.983 -4.000 1.373 1.00 2.22 H new ATOM 0 HG LEU A 25 14.424 -2.175 -0.509 1.00 72.43 H new ATOM 0 HD11 LEU A 25 12.953 -1.682 1.416 1.00 4.22 H new ATOM 0 HD12 LEU A 25 12.873 -3.391 0.926 1.00 4.22 H new ATOM 0 HD13 LEU A 25 13.801 -2.922 2.370 1.00 4.22 H new ATOM 0 HD21 LEU A 25 15.024 -0.357 1.084 1.00 54.03 H new ATOM 0 HD22 LEU A 25 16.021 -1.509 2.004 1.00 54.03 H new ATOM 0 HD23 LEU A 25 16.461 -1.089 0.331 1.00 54.03 H new ATOM 394 N GLN A 26 18.136 -5.474 -1.665 1.00 52.23 N ATOM 395 CA GLN A 26 19.052 -6.638 -1.791 1.00 13.32 C ATOM 396 C GLN A 26 20.348 -6.509 -0.937 1.00 51.53 C ATOM 397 O GLN A 26 20.604 -7.391 -0.110 1.00 32.22 O ATOM 398 CB GLN A 26 19.432 -6.883 -3.283 1.00 32.32 C ATOM 399 CG GLN A 26 18.279 -7.353 -4.186 1.00 55.21 C ATOM 400 CD GLN A 26 17.825 -8.792 -3.907 1.00 21.53 C ATOM 401 OE1 GLN A 26 18.606 -9.630 -3.459 1.00 71.42 O ATOM 402 NE2 GLN A 26 16.573 -9.099 -4.218 1.00 4.14 N ATOM 0 H GLN A 26 17.860 -5.091 -2.569 1.00 52.23 H new ATOM 0 HA GLN A 26 18.498 -7.492 -1.401 1.00 13.32 H new ATOM 0 HB2 GLN A 26 19.840 -5.959 -3.693 1.00 32.32 H new ATOM 0 HB3 GLN A 26 20.228 -7.627 -3.321 1.00 32.32 H new ATOM 0 HG2 GLN A 26 17.430 -6.682 -4.056 1.00 55.21 H new ATOM 0 HG3 GLN A 26 18.590 -7.275 -5.228 1.00 55.21 H new ATOM 0 HE21 GLN A 26 15.949 -8.382 -4.588 1.00 4.14 H new ATOM 0 HE22 GLN A 26 16.234 -10.052 -4.087 1.00 4.14 H new ATOM 411 N PRO A 27 21.174 -5.396 -1.059 1.00 41.41 N ATOM 412 CA PRO A 27 22.465 -5.298 -0.327 1.00 2.55 C ATOM 413 C PRO A 27 22.303 -4.866 1.149 1.00 2.02 C ATOM 414 O PRO A 27 23.285 -4.489 1.803 1.00 63.25 O ATOM 415 CB PRO A 27 23.222 -4.229 -1.152 1.00 64.20 C ATOM 416 CG PRO A 27 22.155 -3.290 -1.622 1.00 41.13 C ATOM 417 CD PRO A 27 20.935 -4.155 -1.879 1.00 32.41 C ATOM 0 HA PRO A 27 22.978 -6.257 -0.252 1.00 2.55 H new ATOM 0 HB2 PRO A 27 23.965 -3.713 -0.545 1.00 64.20 H new ATOM 0 HB3 PRO A 27 23.753 -4.678 -1.991 1.00 64.20 H new ATOM 0 HG2 PRO A 27 21.944 -2.528 -0.871 1.00 41.13 H new ATOM 0 HG3 PRO A 27 22.463 -2.768 -2.528 1.00 41.13 H new ATOM 0 HD2 PRO A 27 20.018 -3.649 -1.576 1.00 32.41 H new ATOM 0 HD3 PRO A 27 20.832 -4.392 -2.938 1.00 32.41 H new ATOM 425 N TYR A 28 21.067 -4.932 1.671 1.00 4.14 N ATOM 426 CA TYR A 28 20.723 -4.447 3.018 1.00 51.42 C ATOM 427 C TYR A 28 20.163 -5.598 3.870 1.00 53.22 C ATOM 428 O TYR A 28 20.711 -5.925 4.929 1.00 72.54 O ATOM 429 CB TYR A 28 19.692 -3.288 2.902 1.00 32.51 C ATOM 430 CG TYR A 28 20.153 -2.141 1.993 1.00 75.35 C ATOM 431 CD1 TYR A 28 21.412 -1.560 2.161 1.00 44.53 C ATOM 432 CD2 TYR A 28 19.338 -1.640 0.977 1.00 75.22 C ATOM 433 CE1 TYR A 28 21.831 -0.533 1.351 1.00 72.22 C ATOM 434 CE2 TYR A 28 19.759 -0.611 0.164 1.00 34.12 C ATOM 435 CZ TYR A 28 21.008 -0.062 0.357 1.00 42.24 C ATOM 436 OH TYR A 28 21.432 0.972 -0.443 1.00 13.15 O ATOM 0 H TYR A 28 20.273 -5.326 1.167 1.00 4.14 H new ATOM 0 HA TYR A 28 21.620 -4.071 3.510 1.00 51.42 H new ATOM 0 HB2 TYR A 28 18.752 -3.687 2.521 1.00 32.51 H new ATOM 0 HB3 TYR A 28 19.490 -2.892 3.897 1.00 32.51 H new ATOM 0 HD1 TYR A 28 22.066 -1.924 2.940 1.00 44.53 H new ATOM 0 HD2 TYR A 28 18.358 -2.068 0.825 1.00 75.22 H new ATOM 0 HE1 TYR A 28 22.808 -0.096 1.496 1.00 72.22 H new ATOM 0 HE2 TYR A 28 19.115 -0.237 -0.619 1.00 34.12 H new ATOM 0 HH TYR A 28 20.735 1.187 -1.097 1.00 13.15 H new ATOM 446 N PHE A 29 19.058 -6.196 3.384 1.00 25.13 N ATOM 447 CA PHE A 29 18.373 -7.328 4.048 1.00 24.02 C ATOM 448 C PHE A 29 17.459 -8.060 3.042 1.00 11.22 C ATOM 449 O PHE A 29 17.381 -7.679 1.870 1.00 53.34 O ATOM 450 CB PHE A 29 17.562 -6.839 5.289 1.00 11.33 C ATOM 451 CG PHE A 29 16.451 -5.834 4.977 1.00 45.13 C ATOM 452 CD1 PHE A 29 16.725 -4.474 4.871 1.00 62.22 C ATOM 453 CD2 PHE A 29 15.131 -6.250 4.786 1.00 31.34 C ATOM 454 CE1 PHE A 29 15.723 -3.574 4.589 1.00 72.13 C ATOM 455 CE2 PHE A 29 14.131 -5.349 4.506 1.00 65.41 C ATOM 456 CZ PHE A 29 14.428 -4.012 4.408 1.00 55.15 C ATOM 0 H PHE A 29 18.611 -5.907 2.514 1.00 25.13 H new ATOM 0 HA PHE A 29 19.127 -8.030 4.403 1.00 24.02 H new ATOM 0 HB2 PHE A 29 17.120 -7.706 5.781 1.00 11.33 H new ATOM 0 HB3 PHE A 29 18.252 -6.386 6.001 1.00 11.33 H new ATOM 0 HD1 PHE A 29 17.736 -4.121 5.012 1.00 62.22 H new ATOM 0 HD2 PHE A 29 14.891 -7.300 4.860 1.00 31.34 H new ATOM 0 HE1 PHE A 29 15.951 -2.521 4.509 1.00 72.13 H new ATOM 0 HE2 PHE A 29 13.117 -5.691 4.364 1.00 65.41 H new ATOM 0 HZ PHE A 29 13.645 -3.301 4.188 1.00 55.15 H new ATOM 466 N SER A 30 16.775 -9.118 3.511 1.00 72.44 N ATOM 467 CA SER A 30 15.800 -9.888 2.703 1.00 3.31 C ATOM 468 C SER A 30 14.404 -9.862 3.353 1.00 33.55 C ATOM 469 O SER A 30 13.384 -9.996 2.664 1.00 75.51 O ATOM 470 CB SER A 30 16.302 -11.341 2.555 1.00 15.33 C ATOM 471 OG SER A 30 16.556 -11.927 3.821 1.00 44.41 O ATOM 0 H SER A 30 16.880 -9.468 4.463 1.00 72.44 H new ATOM 0 HA SER A 30 15.713 -9.431 1.717 1.00 3.31 H new ATOM 0 HB2 SER A 30 15.559 -11.933 2.020 1.00 15.33 H new ATOM 0 HB3 SER A 30 17.212 -11.355 1.956 1.00 15.33 H new ATOM 0 HG SER A 30 16.871 -12.847 3.698 1.00 44.41 H new ATOM 477 N ARG A 31 14.375 -9.674 4.685 1.00 31.21 N ATOM 478 CA ARG A 31 13.150 -9.769 5.500 1.00 62.23 C ATOM 479 C ARG A 31 13.151 -8.705 6.609 1.00 54.32 C ATOM 480 O ARG A 31 14.197 -8.151 6.945 1.00 5.42 O ATOM 481 CB ARG A 31 13.030 -11.192 6.118 1.00 73.24 C ATOM 482 CG ARG A 31 14.209 -11.597 7.032 1.00 73.22 C ATOM 483 CD ARG A 31 14.061 -12.980 7.687 1.00 44.54 C ATOM 484 NE ARG A 31 15.212 -13.289 8.572 1.00 51.34 N ATOM 485 CZ ARG A 31 15.167 -13.439 9.918 1.00 31.14 C ATOM 486 NH1 ARG A 31 14.035 -13.312 10.590 1.00 21.43 N ATOM 487 NH2 ARG A 31 16.274 -13.710 10.588 1.00 14.44 N ATOM 0 H ARG A 31 15.208 -9.450 5.230 1.00 31.21 H new ATOM 0 HA ARG A 31 12.290 -9.589 4.855 1.00 62.23 H new ATOM 0 HB2 ARG A 31 12.106 -11.248 6.693 1.00 73.24 H new ATOM 0 HB3 ARG A 31 12.947 -11.919 5.310 1.00 73.24 H new ATOM 0 HG2 ARG A 31 15.128 -11.583 6.446 1.00 73.22 H new ATOM 0 HG3 ARG A 31 14.319 -10.848 7.816 1.00 73.22 H new ATOM 0 HD2 ARG A 31 13.137 -13.013 8.265 1.00 44.54 H new ATOM 0 HD3 ARG A 31 13.980 -13.743 6.913 1.00 44.54 H new ATOM 0 HE ARG A 31 16.122 -13.399 8.125 1.00 51.34 H new ATOM 0 HH11 ARG A 31 13.170 -13.096 10.095 1.00 21.43 H new ATOM 0 HH12 ARG A 31 14.027 -13.430 11.603 1.00 21.43 H new ATOM 0 HH21 ARG A 31 17.160 -13.806 10.092 1.00 14.44 H new ATOM 0 HH22 ARG A 31 16.242 -13.823 11.601 1.00 14.44 H new ATOM 501 N CYS A 32 11.972 -8.443 7.184 1.00 71.22 N ATOM 502 CA CYS A 32 11.800 -7.490 8.285 1.00 44.05 C ATOM 503 C CYS A 32 10.587 -7.926 9.119 1.00 70.10 C ATOM 504 O CYS A 32 9.438 -7.651 8.753 1.00 1.31 O ATOM 505 CB CYS A 32 11.637 -6.044 7.750 1.00 42.53 C ATOM 506 SG CYS A 32 11.457 -4.786 9.034 1.00 15.51 S ATOM 0 H CYS A 32 11.102 -8.891 6.895 1.00 71.22 H new ATOM 0 HA CYS A 32 12.689 -7.489 8.916 1.00 44.05 H new ATOM 0 HB2 CYS A 32 12.503 -5.797 7.136 1.00 42.53 H new ATOM 0 HB3 CYS A 32 10.764 -6.007 7.098 1.00 42.53 H new ATOM 0 HG CYS A 32 11.555 -5.343 10.204 1.00 15.51 H new ATOM 512 N ASN A 33 10.857 -8.666 10.218 1.00 1.13 N ATOM 513 CA ASN A 33 9.798 -9.226 11.094 1.00 30.32 C ATOM 514 C ASN A 33 9.427 -8.256 12.225 1.00 43.20 C ATOM 515 O ASN A 33 8.435 -8.470 12.892 1.00 14.43 O ATOM 516 CB ASN A 33 10.212 -10.592 11.705 1.00 51.32 C ATOM 517 CG ASN A 33 10.320 -11.750 10.707 1.00 10.32 C ATOM 518 OD1 ASN A 33 10.956 -11.526 9.569 1.00 3.11 O flip ATOM 519 ND2 ASN A 33 9.883 -12.872 10.995 1.00 22.35 N flip ATOM 0 H ASN A 33 11.804 -8.891 10.522 1.00 1.13 H new ATOM 0 HA ASN A 33 8.927 -9.379 10.457 1.00 30.32 H new ATOM 0 HB2 ASN A 33 11.174 -10.472 12.203 1.00 51.32 H new ATOM 0 HB3 ASN A 33 9.487 -10.862 12.473 1.00 51.32 H new ATOM 0 HD21 ASN A 33 9.396 -13.018 11.879 1.00 22.35 H new ATOM 0 HD22 ASN A 33 10.010 -13.650 10.348 1.00 22.35 H new ATOM 526 N SER A 34 10.259 -7.233 12.465 1.00 41.03 N ATOM 527 CA SER A 34 9.908 -6.099 13.347 1.00 61.33 C ATOM 528 C SER A 34 10.470 -4.820 12.731 1.00 10.24 C ATOM 529 O SER A 34 11.504 -4.861 12.053 1.00 12.54 O ATOM 530 CB SER A 34 10.426 -6.307 14.791 1.00 52.42 C ATOM 531 OG SER A 34 11.834 -6.382 14.851 1.00 4.24 O ATOM 0 H SER A 34 11.192 -7.163 12.058 1.00 41.03 H new ATOM 0 HA SER A 34 8.823 -6.026 13.424 1.00 61.33 H new ATOM 0 HB2 SER A 34 10.081 -5.486 15.420 1.00 52.42 H new ATOM 0 HB3 SER A 34 9.998 -7.223 15.199 1.00 52.42 H new ATOM 0 HG SER A 34 12.127 -7.269 14.556 1.00 4.24 H new ATOM 537 N ILE A 35 9.802 -3.687 12.964 1.00 72.15 N ATOM 538 CA ILE A 35 10.081 -2.459 12.217 1.00 14.01 C ATOM 539 C ILE A 35 9.718 -1.236 13.073 1.00 34.25 C ATOM 540 O ILE A 35 8.876 -1.322 13.976 1.00 71.45 O ATOM 541 CB ILE A 35 9.284 -2.487 10.851 1.00 22.20 C ATOM 542 CG1 ILE A 35 9.756 -1.395 9.850 1.00 22.23 C ATOM 543 CG2 ILE A 35 7.761 -2.377 11.085 1.00 23.13 C ATOM 544 CD1 ILE A 35 9.110 -1.505 8.473 1.00 71.41 C ATOM 0 H ILE A 35 9.065 -3.595 13.663 1.00 72.15 H new ATOM 0 HA ILE A 35 11.144 -2.390 11.984 1.00 14.01 H new ATOM 0 HB ILE A 35 9.502 -3.454 10.397 1.00 22.20 H new ATOM 0 HG12 ILE A 35 9.536 -0.412 10.267 1.00 22.23 H new ATOM 0 HG13 ILE A 35 10.839 -1.459 9.740 1.00 22.23 H new ATOM 0 HG21 ILE A 35 7.243 -2.399 10.126 1.00 23.13 H new ATOM 0 HG22 ILE A 35 7.426 -3.214 11.698 1.00 23.13 H new ATOM 0 HG23 ILE A 35 7.538 -1.440 11.596 1.00 23.13 H new ATOM 0 HD11 ILE A 35 9.488 -0.710 7.829 1.00 71.41 H new ATOM 0 HD12 ILE A 35 9.351 -2.473 8.034 1.00 71.41 H new ATOM 0 HD13 ILE A 35 8.028 -1.410 8.570 1.00 71.41 H new ATOM 556 N ARG A 36 10.363 -0.104 12.790 1.00 44.53 N ATOM 557 CA ARG A 36 10.190 1.141 13.537 1.00 30.15 C ATOM 558 C ARG A 36 10.194 2.317 12.554 1.00 43.10 C ATOM 559 O ARG A 36 11.251 2.708 12.048 1.00 3.21 O ATOM 560 CB ARG A 36 11.323 1.296 14.593 1.00 44.25 C ATOM 561 CG ARG A 36 11.290 2.629 15.370 1.00 23.32 C ATOM 562 CD ARG A 36 12.469 2.790 16.336 1.00 24.44 C ATOM 563 NE ARG A 36 12.454 4.112 16.973 1.00 24.03 N ATOM 564 CZ ARG A 36 13.457 4.658 17.675 1.00 74.12 C ATOM 565 NH1 ARG A 36 14.599 4.009 17.874 1.00 53.13 N ATOM 566 NH2 ARG A 36 13.326 5.890 18.133 1.00 24.21 N ATOM 0 H ARG A 36 11.031 -0.026 12.023 1.00 44.53 H new ATOM 0 HA ARG A 36 9.238 1.124 14.068 1.00 30.15 H new ATOM 0 HB2 ARG A 36 11.256 0.473 15.304 1.00 44.25 H new ATOM 0 HB3 ARG A 36 12.286 1.205 14.091 1.00 44.25 H new ATOM 0 HG2 ARG A 36 11.293 3.457 14.661 1.00 23.32 H new ATOM 0 HG3 ARG A 36 10.357 2.693 15.930 1.00 23.32 H new ATOM 0 HD2 ARG A 36 12.425 2.014 17.100 1.00 24.44 H new ATOM 0 HD3 ARG A 36 13.406 2.654 15.797 1.00 24.44 H new ATOM 0 HE ARG A 36 11.603 4.666 16.872 1.00 24.03 H new ATOM 0 HH11 ARG A 36 14.728 3.073 17.489 1.00 53.13 H new ATOM 0 HH12 ARG A 36 15.347 4.446 18.412 1.00 53.13 H new ATOM 0 HH21 ARG A 36 12.470 6.413 17.951 1.00 24.21 H new ATOM 0 HH22 ARG A 36 14.081 6.318 18.669 1.00 24.21 H new ATOM 580 N VAL A 37 9.004 2.835 12.242 1.00 24.41 N ATOM 581 CA VAL A 37 8.845 4.018 11.390 1.00 25.45 C ATOM 582 C VAL A 37 8.822 5.269 12.294 1.00 13.42 C ATOM 583 O VAL A 37 7.923 5.401 13.125 1.00 23.13 O ATOM 584 CB VAL A 37 7.527 3.932 10.532 1.00 22.42 C ATOM 585 CG1 VAL A 37 7.402 5.134 9.564 1.00 33.24 C ATOM 586 CG2 VAL A 37 7.425 2.577 9.784 1.00 3.41 C ATOM 0 H VAL A 37 8.121 2.446 12.573 1.00 24.41 H new ATOM 0 HA VAL A 37 9.680 4.075 10.692 1.00 25.45 H new ATOM 0 HB VAL A 37 6.683 3.984 11.220 1.00 22.42 H new ATOM 0 HG11 VAL A 37 6.481 5.043 8.988 1.00 33.24 H new ATOM 0 HG12 VAL A 37 7.381 6.061 10.136 1.00 33.24 H new ATOM 0 HG13 VAL A 37 8.255 5.145 8.886 1.00 33.24 H new ATOM 0 HG21 VAL A 37 6.504 2.551 9.202 1.00 3.41 H new ATOM 0 HG22 VAL A 37 8.279 2.465 9.117 1.00 3.41 H new ATOM 0 HG23 VAL A 37 7.420 1.762 10.507 1.00 3.41 H new ATOM 596 N GLU A 38 9.838 6.145 12.150 1.00 42.14 N ATOM 597 CA GLU A 38 9.970 7.384 12.951 1.00 53.42 C ATOM 598 C GLU A 38 9.080 8.518 12.430 1.00 54.43 C ATOM 599 O GLU A 38 8.679 9.394 13.205 1.00 4.13 O ATOM 600 CB GLU A 38 11.455 7.828 13.028 1.00 14.10 C ATOM 601 CG GLU A 38 12.281 7.083 14.090 1.00 64.33 C ATOM 602 CD GLU A 38 11.767 7.333 15.520 1.00 62.31 C ATOM 603 OE1 GLU A 38 11.060 6.467 16.079 1.00 44.10 O ATOM 604 OE2 GLU A 38 12.040 8.416 16.078 1.00 2.32 O ATOM 0 H GLU A 38 10.592 6.015 11.475 1.00 42.14 H new ATOM 0 HA GLU A 38 9.622 7.154 13.958 1.00 53.42 H new ATOM 0 HB2 GLU A 38 11.918 7.679 12.053 1.00 14.10 H new ATOM 0 HB3 GLU A 38 11.493 8.897 13.238 1.00 14.10 H new ATOM 0 HG2 GLU A 38 12.256 6.014 13.880 1.00 64.33 H new ATOM 0 HG3 GLU A 38 13.322 7.397 14.022 1.00 64.33 H new ATOM 611 N SER A 39 8.787 8.505 11.122 1.00 12.02 N ATOM 612 CA SER A 39 7.901 9.506 10.496 1.00 55.21 C ATOM 613 C SER A 39 7.422 9.032 9.117 1.00 33.44 C ATOM 614 O SER A 39 8.145 8.317 8.407 1.00 14.14 O ATOM 615 CB SER A 39 8.612 10.883 10.406 1.00 14.33 C ATOM 616 OG SER A 39 9.933 10.755 9.893 1.00 2.52 O ATOM 0 H SER A 39 9.151 7.809 10.471 1.00 12.02 H new ATOM 0 HA SER A 39 7.019 9.624 11.125 1.00 55.21 H new ATOM 0 HB2 SER A 39 8.035 11.550 9.766 1.00 14.33 H new ATOM 0 HB3 SER A 39 8.647 11.341 11.395 1.00 14.33 H new ATOM 0 HG SER A 39 10.353 11.639 9.847 1.00 2.52 H new ATOM 622 N GLY A 40 6.193 9.445 8.760 1.00 25.42 N ATOM 623 CA GLY A 40 5.592 9.124 7.471 1.00 71.03 C ATOM 624 C GLY A 40 4.871 7.784 7.445 1.00 31.51 C ATOM 625 O GLY A 40 4.784 7.084 8.466 1.00 75.20 O ATOM 0 H GLY A 40 5.595 10.010 9.363 1.00 25.42 H new ATOM 0 HA2 GLY A 40 4.886 9.911 7.204 1.00 71.03 H new ATOM 0 HA3 GLY A 40 6.371 9.122 6.708 1.00 71.03 H new ATOM 629 N CYS A 41 4.321 7.456 6.270 1.00 53.14 N ATOM 630 CA CYS A 41 3.716 6.150 5.984 1.00 42.41 C ATOM 631 C CYS A 41 4.434 5.537 4.774 1.00 31.12 C ATOM 632 O CYS A 41 4.385 6.085 3.665 1.00 33.35 O ATOM 633 CB CYS A 41 2.204 6.304 5.723 1.00 72.01 C ATOM 634 SG CYS A 41 1.286 6.964 7.135 1.00 53.04 S ATOM 0 H CYS A 41 4.283 8.100 5.480 1.00 53.14 H new ATOM 0 HA CYS A 41 3.829 5.486 6.841 1.00 42.41 H new ATOM 0 HB2 CYS A 41 2.057 6.962 4.866 1.00 72.01 H new ATOM 0 HB3 CYS A 41 1.790 5.332 5.454 1.00 72.01 H new ATOM 0 HG CYS A 41 0.446 7.866 6.723 1.00 53.04 H new ATOM 640 N TRP A 42 5.136 4.420 5.007 1.00 64.10 N ATOM 641 CA TRP A 42 5.968 3.755 4.002 1.00 72.25 C ATOM 642 C TRP A 42 5.268 2.501 3.462 1.00 0.53 C ATOM 643 O TRP A 42 4.720 1.713 4.232 1.00 3.01 O ATOM 644 CB TRP A 42 7.336 3.355 4.614 1.00 51.44 C ATOM 645 CG TRP A 42 8.217 4.515 5.036 1.00 62.21 C ATOM 646 CD1 TRP A 42 8.020 5.370 6.085 1.00 33.33 C ATOM 647 CD2 TRP A 42 9.455 4.920 4.428 1.00 53.45 C ATOM 648 NE1 TRP A 42 9.044 6.277 6.162 1.00 20.24 N ATOM 649 CE2 TRP A 42 9.940 6.024 5.155 1.00 34.43 C ATOM 650 CE3 TRP A 42 10.197 4.454 3.335 1.00 52.20 C ATOM 651 CZ2 TRP A 42 11.130 6.666 4.826 1.00 51.32 C ATOM 652 CZ3 TRP A 42 11.379 5.092 3.011 1.00 4.21 C ATOM 653 CH2 TRP A 42 11.834 6.187 3.754 1.00 40.51 C ATOM 0 H TRP A 42 5.140 3.949 5.912 1.00 64.10 H new ATOM 0 HA TRP A 42 6.128 4.454 3.181 1.00 72.25 H new ATOM 0 HB2 TRP A 42 7.156 2.721 5.482 1.00 51.44 H new ATOM 0 HB3 TRP A 42 7.880 2.752 3.886 1.00 51.44 H new ATOM 0 HD1 TRP A 42 7.176 5.335 6.758 1.00 33.33 H new ATOM 0 HE1 TRP A 42 9.127 7.020 6.856 1.00 20.24 H new ATOM 0 HE3 TRP A 42 9.851 3.611 2.756 1.00 52.20 H new ATOM 0 HZ2 TRP A 42 11.485 7.512 5.396 1.00 51.32 H new ATOM 0 HZ3 TRP A 42 11.960 4.740 2.172 1.00 4.21 H new ATOM 0 HH2 TRP A 42 12.762 6.665 3.475 1.00 40.51 H new ATOM 664 N MET A 43 5.284 2.334 2.137 1.00 50.51 N ATOM 665 CA MET A 43 4.910 1.082 1.472 1.00 45.20 C ATOM 666 C MET A 43 6.123 0.153 1.388 1.00 35.41 C ATOM 667 O MET A 43 7.128 0.488 0.758 1.00 24.15 O ATOM 668 CB MET A 43 4.323 1.358 0.064 1.00 60.22 C ATOM 669 CG MET A 43 2.820 1.581 0.071 1.00 64.31 C ATOM 670 SD MET A 43 1.929 0.090 0.558 1.00 3.30 S ATOM 671 CE MET A 43 0.235 0.622 0.377 1.00 73.32 C ATOM 0 H MET A 43 5.560 3.072 1.489 1.00 50.51 H new ATOM 0 HA MET A 43 4.136 0.591 2.061 1.00 45.20 H new ATOM 0 HB2 MET A 43 4.811 2.236 -0.360 1.00 60.22 H new ATOM 0 HB3 MET A 43 4.555 0.517 -0.590 1.00 60.22 H new ATOM 0 HG2 MET A 43 2.575 2.392 0.757 1.00 64.31 H new ATOM 0 HG3 MET A 43 2.493 1.893 -0.921 1.00 64.31 H new ATOM 0 HE1 MET A 43 -0.219 0.732 1.362 1.00 73.32 H new ATOM 0 HE2 MET A 43 0.208 1.579 -0.144 1.00 73.32 H new ATOM 0 HE3 MET A 43 -0.320 -0.120 -0.197 1.00 73.32 H new ATOM 681 N LEU A 44 6.017 -0.989 2.066 1.00 53.32 N ATOM 682 CA LEU A 44 7.002 -2.060 2.026 1.00 63.44 C ATOM 683 C LEU A 44 6.505 -3.144 1.077 1.00 71.21 C ATOM 684 O LEU A 44 5.450 -3.737 1.297 1.00 72.40 O ATOM 685 CB LEU A 44 7.245 -2.623 3.459 1.00 70.12 C ATOM 686 CG LEU A 44 8.062 -1.702 4.427 1.00 23.44 C ATOM 687 CD1 LEU A 44 9.400 -1.303 3.787 1.00 61.11 C ATOM 688 CD2 LEU A 44 7.270 -0.453 4.868 1.00 63.22 C ATOM 0 H LEU A 44 5.223 -1.197 2.672 1.00 53.32 H new ATOM 0 HA LEU A 44 7.956 -1.681 1.661 1.00 63.44 H new ATOM 0 HB2 LEU A 44 6.277 -2.830 3.916 1.00 70.12 H new ATOM 0 HB3 LEU A 44 7.766 -3.576 3.370 1.00 70.12 H new ATOM 0 HG LEU A 44 8.259 -2.281 5.329 1.00 23.44 H new ATOM 0 HD11 LEU A 44 9.955 -0.663 4.473 1.00 61.11 H new ATOM 0 HD12 LEU A 44 9.983 -2.199 3.574 1.00 61.11 H new ATOM 0 HD13 LEU A 44 9.213 -0.763 2.859 1.00 61.11 H new ATOM 0 HD21 LEU A 44 7.884 0.149 5.538 1.00 63.22 H new ATOM 0 HD22 LEU A 44 7.003 0.137 3.991 1.00 63.22 H new ATOM 0 HD23 LEU A 44 6.363 -0.762 5.387 1.00 63.22 H new ATOM 700 N TYR A 45 7.271 -3.372 0.019 1.00 71.22 N ATOM 701 CA TYR A 45 6.932 -4.319 -1.038 1.00 2.13 C ATOM 702 C TYR A 45 7.693 -5.620 -0.785 1.00 73.02 C ATOM 703 O TYR A 45 8.891 -5.579 -0.465 1.00 71.00 O ATOM 704 CB TYR A 45 7.320 -3.732 -2.416 1.00 61.14 C ATOM 705 CG TYR A 45 6.764 -2.318 -2.693 1.00 2.13 C ATOM 706 CD1 TYR A 45 7.424 -1.171 -2.234 1.00 22.10 C ATOM 707 CD2 TYR A 45 5.588 -2.128 -3.412 1.00 11.34 C ATOM 708 CE1 TYR A 45 6.929 0.092 -2.481 1.00 44.01 C ATOM 709 CE2 TYR A 45 5.093 -0.863 -3.662 1.00 34.13 C ATOM 710 CZ TYR A 45 5.765 0.241 -3.194 1.00 72.33 C ATOM 711 OH TYR A 45 5.257 1.501 -3.434 1.00 2.13 O ATOM 0 H TYR A 45 8.161 -2.897 -0.133 1.00 71.22 H new ATOM 0 HA TYR A 45 5.859 -4.513 -1.037 1.00 2.13 H new ATOM 0 HB2 TYR A 45 8.407 -3.701 -2.490 1.00 61.14 H new ATOM 0 HB3 TYR A 45 6.966 -4.406 -3.196 1.00 61.14 H new ATOM 0 HD1 TYR A 45 8.341 -1.278 -1.674 1.00 22.10 H new ATOM 0 HD2 TYR A 45 5.051 -2.988 -3.783 1.00 11.34 H new ATOM 0 HE1 TYR A 45 7.455 0.961 -2.115 1.00 44.01 H new ATOM 0 HE2 TYR A 45 4.179 -0.741 -4.224 1.00 34.13 H new ATOM 0 HH TYR A 45 5.990 2.151 -3.451 1.00 2.13 H new ATOM 721 N GLU A 46 6.985 -6.739 -0.931 1.00 2.04 N ATOM 722 CA GLU A 46 7.530 -8.093 -0.787 1.00 10.25 C ATOM 723 C GLU A 46 8.751 -8.302 -1.702 1.00 70.53 C ATOM 724 O GLU A 46 9.853 -8.630 -1.247 1.00 21.50 O ATOM 725 CB GLU A 46 6.400 -9.099 -1.128 1.00 13.41 C ATOM 726 CG GLU A 46 6.816 -10.580 -1.227 1.00 1.14 C ATOM 727 CD GLU A 46 5.658 -11.494 -1.672 1.00 20.24 C ATOM 728 OE1 GLU A 46 5.260 -12.391 -0.901 1.00 50.20 O ATOM 729 OE2 GLU A 46 5.128 -11.293 -2.792 1.00 53.00 O ATOM 0 H GLU A 46 5.991 -6.731 -1.159 1.00 2.04 H new ATOM 0 HA GLU A 46 7.875 -8.249 0.235 1.00 10.25 H new ATOM 0 HB2 GLU A 46 5.622 -9.011 -0.369 1.00 13.41 H new ATOM 0 HB3 GLU A 46 5.953 -8.804 -2.078 1.00 13.41 H new ATOM 0 HG2 GLU A 46 7.641 -10.675 -1.933 1.00 1.14 H new ATOM 0 HG3 GLU A 46 7.186 -10.915 -0.258 1.00 1.14 H new ATOM 736 N ARG A 47 8.533 -8.051 -2.991 1.00 61.54 N ATOM 737 CA ARG A 47 9.504 -8.300 -4.062 1.00 44.22 C ATOM 738 C ARG A 47 10.134 -6.969 -4.547 1.00 4.21 C ATOM 739 O ARG A 47 9.527 -5.904 -4.375 1.00 53.21 O ATOM 740 CB ARG A 47 8.769 -9.032 -5.210 1.00 24.20 C ATOM 741 CG ARG A 47 8.343 -10.482 -4.872 1.00 72.52 C ATOM 742 CD ARG A 47 7.265 -11.027 -5.823 1.00 61.25 C ATOM 743 NE ARG A 47 7.596 -10.824 -7.246 1.00 30.11 N ATOM 744 CZ ARG A 47 6.699 -10.726 -8.241 1.00 41.00 C ATOM 745 NH1 ARG A 47 5.389 -10.823 -7.995 1.00 3.33 N ATOM 746 NH2 ARG A 47 7.120 -10.515 -9.481 1.00 34.13 N ATOM 0 H ARG A 47 7.655 -7.659 -3.331 1.00 61.54 H new ATOM 0 HA ARG A 47 10.322 -8.922 -3.698 1.00 44.22 H new ATOM 0 HB2 ARG A 47 7.882 -8.459 -5.481 1.00 24.20 H new ATOM 0 HB3 ARG A 47 9.417 -9.051 -6.086 1.00 24.20 H new ATOM 0 HG2 ARG A 47 9.218 -11.131 -4.913 1.00 72.52 H new ATOM 0 HG3 ARG A 47 7.968 -10.516 -3.849 1.00 72.52 H new ATOM 0 HD2 ARG A 47 7.128 -12.092 -5.636 1.00 61.25 H new ATOM 0 HD3 ARG A 47 6.315 -10.540 -5.604 1.00 61.25 H new ATOM 0 HE ARG A 47 8.583 -10.752 -7.494 1.00 30.11 H new ATOM 0 HH11 ARG A 47 5.059 -10.973 -7.042 1.00 3.33 H new ATOM 0 HH12 ARG A 47 4.719 -10.747 -8.761 1.00 3.33 H new ATOM 0 HH21 ARG A 47 8.118 -10.428 -9.673 1.00 34.13 H new ATOM 0 HH22 ARG A 47 6.446 -10.439 -10.243 1.00 34.13 H new ATOM 760 N PRO A 48 11.376 -7.009 -5.157 1.00 54.01 N ATOM 761 CA PRO A 48 12.017 -5.808 -5.744 1.00 61.35 C ATOM 762 C PRO A 48 11.232 -5.251 -6.945 1.00 44.13 C ATOM 763 O PRO A 48 10.314 -5.910 -7.457 1.00 72.41 O ATOM 764 CB PRO A 48 13.430 -6.299 -6.174 1.00 74.24 C ATOM 765 CG PRO A 48 13.626 -7.614 -5.479 1.00 71.02 C ATOM 766 CD PRO A 48 12.245 -8.206 -5.324 1.00 1.51 C ATOM 0 HA PRO A 48 12.054 -4.984 -5.031 1.00 61.35 H new ATOM 0 HB2 PRO A 48 13.493 -6.414 -7.256 1.00 74.24 H new ATOM 0 HB3 PRO A 48 14.199 -5.583 -5.884 1.00 74.24 H new ATOM 0 HG2 PRO A 48 14.271 -8.272 -6.062 1.00 71.02 H new ATOM 0 HG3 PRO A 48 14.104 -7.477 -4.509 1.00 71.02 H new ATOM 0 HD2 PRO A 48 11.958 -8.792 -6.197 1.00 1.51 H new ATOM 0 HD3 PRO A 48 12.186 -8.869 -4.461 1.00 1.51 H new ATOM 774 N ASN A 49 11.626 -4.036 -7.384 1.00 0.34 N ATOM 775 CA ASN A 49 10.997 -3.324 -8.524 1.00 25.10 C ATOM 776 C ASN A 49 9.518 -3.003 -8.213 1.00 43.53 C ATOM 777 O ASN A 49 8.682 -2.962 -9.119 1.00 62.34 O ATOM 778 CB ASN A 49 11.141 -4.136 -9.853 1.00 13.32 C ATOM 779 CG ASN A 49 12.599 -4.444 -10.226 1.00 65.21 C ATOM 780 OD1 ASN A 49 13.258 -3.656 -10.908 1.00 33.21 O ATOM 781 ND2 ASN A 49 13.107 -5.592 -9.782 1.00 44.33 N ATOM 0 H ASN A 49 12.393 -3.517 -6.957 1.00 0.34 H new ATOM 0 HA ASN A 49 11.523 -2.380 -8.667 1.00 25.10 H new ATOM 0 HB2 ASN A 49 10.592 -5.073 -9.759 1.00 13.32 H new ATOM 0 HB3 ASN A 49 10.677 -3.575 -10.664 1.00 13.32 H new ATOM 0 HD21 ASN A 49 14.070 -5.843 -10.004 1.00 44.33 H new ATOM 0 HD22 ASN A 49 12.533 -6.220 -9.220 1.00 44.33 H new ATOM 788 N TYR A 50 9.226 -2.779 -6.903 1.00 3.44 N ATOM 789 CA TYR A 50 7.892 -2.368 -6.391 1.00 64.25 C ATOM 790 C TYR A 50 6.822 -3.477 -6.601 1.00 22.23 C ATOM 791 O TYR A 50 5.614 -3.193 -6.595 1.00 41.33 O ATOM 792 CB TYR A 50 7.422 -1.014 -7.025 1.00 14.54 C ATOM 793 CG TYR A 50 8.462 0.130 -6.977 1.00 41.23 C ATOM 794 CD1 TYR A 50 8.965 0.609 -5.762 1.00 44.43 C ATOM 795 CD2 TYR A 50 8.936 0.733 -8.153 1.00 12.02 C ATOM 796 CE1 TYR A 50 9.890 1.641 -5.728 1.00 62.03 C ATOM 797 CE2 TYR A 50 9.860 1.761 -8.114 1.00 52.35 C ATOM 798 CZ TYR A 50 10.334 2.211 -6.901 1.00 1.20 C ATOM 799 OH TYR A 50 11.255 3.241 -6.865 1.00 14.15 O ATOM 0 H TYR A 50 9.921 -2.881 -6.164 1.00 3.44 H new ATOM 0 HA TYR A 50 8.002 -2.216 -5.317 1.00 64.25 H new ATOM 0 HB2 TYR A 50 7.150 -1.193 -8.065 1.00 14.54 H new ATOM 0 HB3 TYR A 50 6.519 -0.685 -6.511 1.00 14.54 H new ATOM 0 HD1 TYR A 50 8.627 0.168 -4.836 1.00 44.43 H new ATOM 0 HD2 TYR A 50 8.571 0.386 -9.109 1.00 12.02 H new ATOM 0 HE1 TYR A 50 10.263 1.999 -4.780 1.00 62.03 H new ATOM 0 HE2 TYR A 50 10.209 2.210 -9.032 1.00 52.35 H new ATOM 0 HH TYR A 50 11.462 3.527 -7.779 1.00 14.15 H new ATOM 809 N GLN A 51 7.274 -4.739 -6.736 1.00 24.52 N ATOM 810 CA GLN A 51 6.390 -5.884 -7.057 1.00 14.22 C ATOM 811 C GLN A 51 5.964 -6.649 -5.788 1.00 12.22 C ATOM 812 O GLN A 51 6.433 -6.368 -4.677 1.00 72.33 O ATOM 813 CB GLN A 51 7.105 -6.858 -8.034 1.00 32.24 C ATOM 814 CG GLN A 51 7.525 -6.236 -9.374 1.00 54.45 C ATOM 815 CD GLN A 51 8.259 -7.230 -10.273 1.00 12.04 C ATOM 816 OE1 GLN A 51 9.569 -7.338 -10.096 1.00 4.02 O flip ATOM 817 NE2 GLN A 51 7.645 -7.923 -11.085 1.00 61.51 N flip ATOM 0 H GLN A 51 8.255 -4.996 -6.627 1.00 24.52 H new ATOM 0 HA GLN A 51 5.494 -5.482 -7.529 1.00 14.22 H new ATOM 0 HB2 GLN A 51 7.992 -7.258 -7.542 1.00 32.24 H new ATOM 0 HB3 GLN A 51 6.443 -7.701 -8.233 1.00 32.24 H new ATOM 0 HG2 GLN A 51 6.641 -5.866 -9.893 1.00 54.45 H new ATOM 0 HG3 GLN A 51 8.168 -5.376 -9.187 1.00 54.45 H new ATOM 0 HE21 GLN A 51 6.637 -7.810 -11.192 1.00 61.51 H new ATOM 0 HE22 GLN A 51 8.145 -8.610 -11.650 1.00 61.51 H new ATOM 826 N GLY A 52 5.077 -7.646 -5.997 1.00 14.33 N ATOM 827 CA GLY A 52 4.602 -8.521 -4.927 1.00 15.14 C ATOM 828 C GLY A 52 3.476 -7.907 -4.120 1.00 62.44 C ATOM 829 O GLY A 52 2.796 -6.982 -4.589 1.00 72.35 O ATOM 0 H GLY A 52 4.678 -7.858 -6.911 1.00 14.33 H new ATOM 0 HA2 GLY A 52 4.262 -9.462 -5.358 1.00 15.14 H new ATOM 0 HA3 GLY A 52 5.433 -8.757 -4.262 1.00 15.14 H new ATOM 833 N GLN A 53 3.251 -8.448 -2.915 1.00 14.04 N ATOM 834 CA GLN A 53 2.274 -7.885 -1.975 1.00 30.15 C ATOM 835 C GLN A 53 2.902 -6.720 -1.201 1.00 44.21 C ATOM 836 O GLN A 53 4.042 -6.803 -0.732 1.00 0.43 O ATOM 837 CB GLN A 53 1.719 -8.958 -1.015 1.00 52.12 C ATOM 838 CG GLN A 53 2.767 -9.811 -0.278 1.00 71.23 C ATOM 839 CD GLN A 53 2.161 -10.755 0.768 1.00 63.43 C ATOM 840 OE1 GLN A 53 1.165 -10.277 1.499 1.00 33.21 O flip ATOM 841 NE2 GLN A 53 2.623 -11.874 0.968 1.00 61.22 N flip ATOM 0 H GLN A 53 3.734 -9.277 -2.568 1.00 14.04 H new ATOM 0 HA GLN A 53 1.428 -7.508 -2.550 1.00 30.15 H new ATOM 0 HB2 GLN A 53 1.094 -8.463 -0.271 1.00 52.12 H new ATOM 0 HB3 GLN A 53 1.071 -9.625 -1.583 1.00 52.12 H new ATOM 0 HG2 GLN A 53 3.324 -10.399 -1.008 1.00 71.23 H new ATOM 0 HG3 GLN A 53 3.483 -9.150 0.211 1.00 71.23 H new ATOM 0 HE21 GLN A 53 3.390 -12.220 0.391 1.00 61.22 H new ATOM 0 HE22 GLN A 53 2.240 -12.459 1.711 1.00 61.22 H new ATOM 850 N GLN A 54 2.138 -5.634 -1.081 1.00 73.21 N ATOM 851 CA GLN A 54 2.621 -4.351 -0.563 1.00 4.42 C ATOM 852 C GLN A 54 2.029 -4.140 0.846 1.00 11.10 C ATOM 853 O GLN A 54 1.005 -4.751 1.181 1.00 33.02 O ATOM 854 CB GLN A 54 2.231 -3.228 -1.582 1.00 11.15 C ATOM 855 CG GLN A 54 2.354 -3.687 -3.067 1.00 41.21 C ATOM 856 CD GLN A 54 2.119 -2.600 -4.119 1.00 55.15 C ATOM 857 OE1 GLN A 54 1.410 -1.634 -3.891 1.00 33.22 O ATOM 858 NE2 GLN A 54 2.708 -2.772 -5.295 1.00 62.14 N ATOM 0 H GLN A 54 1.153 -5.619 -1.344 1.00 73.21 H new ATOM 0 HA GLN A 54 3.706 -4.327 -0.460 1.00 4.42 H new ATOM 0 HB2 GLN A 54 1.207 -2.909 -1.389 1.00 11.15 H new ATOM 0 HB3 GLN A 54 2.871 -2.360 -1.421 1.00 11.15 H new ATOM 0 HG2 GLN A 54 3.350 -4.104 -3.218 1.00 41.21 H new ATOM 0 HG3 GLN A 54 1.641 -4.494 -3.239 1.00 41.21 H new ATOM 0 HE21 GLN A 54 3.296 -3.590 -5.456 1.00 62.14 H new ATOM 0 HE22 GLN A 54 2.573 -2.086 -6.038 1.00 62.14 H new ATOM 867 N TYR A 55 2.694 -3.327 1.687 1.00 32.03 N ATOM 868 CA TYR A 55 2.327 -3.154 3.112 1.00 30.05 C ATOM 869 C TYR A 55 2.419 -1.679 3.512 1.00 62.31 C ATOM 870 O TYR A 55 3.490 -1.087 3.422 1.00 33.15 O ATOM 871 CB TYR A 55 3.272 -3.979 4.034 1.00 41.30 C ATOM 872 CG TYR A 55 3.214 -5.497 3.859 1.00 1.42 C ATOM 873 CD1 TYR A 55 2.194 -6.247 4.449 1.00 21.43 C ATOM 874 CD2 TYR A 55 4.190 -6.186 3.126 1.00 65.22 C ATOM 875 CE1 TYR A 55 2.151 -7.615 4.315 1.00 45.42 C ATOM 876 CE2 TYR A 55 4.140 -7.554 2.989 1.00 14.12 C ATOM 877 CZ TYR A 55 3.122 -8.259 3.588 1.00 42.40 C ATOM 878 OH TYR A 55 3.082 -9.618 3.465 1.00 20.41 O ATOM 0 H TYR A 55 3.500 -2.771 1.402 1.00 32.03 H new ATOM 0 HA TYR A 55 1.303 -3.508 3.233 1.00 30.05 H new ATOM 0 HB2 TYR A 55 4.297 -3.651 3.859 1.00 41.30 H new ATOM 0 HB3 TYR A 55 3.034 -3.742 5.071 1.00 41.30 H new ATOM 0 HD1 TYR A 55 1.427 -5.745 5.020 1.00 21.43 H new ATOM 0 HD2 TYR A 55 4.994 -5.634 2.661 1.00 65.22 H new ATOM 0 HE1 TYR A 55 1.357 -8.181 4.780 1.00 45.42 H new ATOM 0 HE2 TYR A 55 4.895 -8.071 2.415 1.00 14.12 H new ATOM 0 HH TYR A 55 2.211 -9.889 3.107 1.00 20.41 H new ATOM 888 N LEU A 56 1.313 -1.093 3.980 1.00 51.23 N ATOM 889 CA LEU A 56 1.314 0.288 4.475 1.00 64.44 C ATOM 890 C LEU A 56 1.711 0.263 5.965 1.00 74.02 C ATOM 891 O LEU A 56 0.884 -0.028 6.840 1.00 24.12 O ATOM 892 CB LEU A 56 -0.070 0.978 4.224 1.00 15.33 C ATOM 893 CG LEU A 56 -0.119 2.558 4.292 1.00 63.22 C ATOM 894 CD1 LEU A 56 -0.061 3.111 5.737 1.00 62.54 C ATOM 895 CD2 LEU A 56 0.984 3.197 3.400 1.00 44.12 C ATOM 0 H LEU A 56 0.404 -1.554 4.027 1.00 51.23 H new ATOM 0 HA LEU A 56 2.042 0.889 3.930 1.00 64.44 H new ATOM 0 HB2 LEU A 56 -0.425 0.672 3.240 1.00 15.33 H new ATOM 0 HB3 LEU A 56 -0.779 0.587 4.954 1.00 15.33 H new ATOM 0 HG LEU A 56 -1.092 2.847 3.895 1.00 63.22 H new ATOM 0 HD11 LEU A 56 -0.099 4.200 5.712 1.00 62.54 H new ATOM 0 HD12 LEU A 56 -0.910 2.732 6.306 1.00 62.54 H new ATOM 0 HD13 LEU A 56 0.866 2.791 6.212 1.00 62.54 H new ATOM 0 HD21 LEU A 56 0.924 4.283 3.469 1.00 44.12 H new ATOM 0 HD22 LEU A 56 1.965 2.866 3.741 1.00 44.12 H new ATOM 0 HD23 LEU A 56 0.837 2.890 2.364 1.00 44.12 H new ATOM 907 N LEU A 57 3.005 0.503 6.224 1.00 44.13 N ATOM 908 CA LEU A 57 3.546 0.664 7.580 1.00 62.10 C ATOM 909 C LEU A 57 3.460 2.137 7.972 1.00 41.15 C ATOM 910 O LEU A 57 4.071 2.996 7.338 1.00 73.20 O ATOM 911 CB LEU A 57 5.019 0.146 7.675 1.00 41.42 C ATOM 912 CG LEU A 57 5.202 -1.373 8.008 1.00 44.01 C ATOM 913 CD1 LEU A 57 4.573 -1.713 9.370 1.00 0.05 C ATOM 914 CD2 LEU A 57 4.651 -2.291 6.892 1.00 43.31 C ATOM 0 H LEU A 57 3.710 0.591 5.492 1.00 44.13 H new ATOM 0 HA LEU A 57 2.955 0.065 8.273 1.00 62.10 H new ATOM 0 HB2 LEU A 57 5.515 0.350 6.726 1.00 41.42 H new ATOM 0 HB3 LEU A 57 5.537 0.728 8.437 1.00 41.42 H new ATOM 0 HG LEU A 57 6.274 -1.562 8.067 1.00 44.01 H new ATOM 0 HD11 LEU A 57 4.712 -2.773 9.580 1.00 0.05 H new ATOM 0 HD12 LEU A 57 5.053 -1.122 10.150 1.00 0.05 H new ATOM 0 HD13 LEU A 57 3.507 -1.485 9.346 1.00 0.05 H new ATOM 0 HD21 LEU A 57 4.802 -3.334 7.171 1.00 43.31 H new ATOM 0 HD22 LEU A 57 3.586 -2.102 6.758 1.00 43.31 H new ATOM 0 HD23 LEU A 57 5.176 -2.085 5.959 1.00 43.31 H new ATOM 926 N ARG A 58 2.691 2.400 9.023 1.00 72.42 N ATOM 927 CA ARG A 58 2.490 3.747 9.572 1.00 61.21 C ATOM 928 C ARG A 58 3.604 4.037 10.594 1.00 70.52 C ATOM 929 O ARG A 58 4.363 3.124 10.948 1.00 43.21 O ATOM 930 CB ARG A 58 1.110 3.791 10.278 1.00 51.11 C ATOM 931 CG ARG A 58 -0.061 3.146 9.494 1.00 24.34 C ATOM 932 CD ARG A 58 -1.206 2.714 10.429 1.00 30.14 C ATOM 933 NE ARG A 58 -0.705 1.827 11.501 1.00 72.41 N ATOM 934 CZ ARG A 58 -1.304 1.600 12.684 1.00 25.05 C ATOM 935 NH1 ARG A 58 -2.469 2.167 12.988 1.00 44.30 N ATOM 936 NH2 ARG A 58 -0.701 0.815 13.572 1.00 71.34 N ATOM 0 H ARG A 58 2.180 1.677 9.529 1.00 72.42 H new ATOM 0 HA ARG A 58 2.521 4.493 8.778 1.00 61.21 H new ATOM 0 HB2 ARG A 58 1.198 3.290 11.242 1.00 51.11 H new ATOM 0 HB3 ARG A 58 0.858 4.832 10.481 1.00 51.11 H new ATOM 0 HG2 ARG A 58 -0.440 3.855 8.759 1.00 24.34 H new ATOM 0 HG3 ARG A 58 0.304 2.280 8.942 1.00 24.34 H new ATOM 0 HD2 ARG A 58 -1.674 3.595 10.869 1.00 30.14 H new ATOM 0 HD3 ARG A 58 -1.975 2.198 9.854 1.00 30.14 H new ATOM 0 HE ARG A 58 0.176 1.343 11.327 1.00 72.41 H new ATOM 0 HH11 ARG A 58 -2.925 2.787 12.318 1.00 44.30 H new ATOM 0 HH12 ARG A 58 -2.906 1.982 13.891 1.00 44.30 H new ATOM 0 HH21 ARG A 58 0.202 0.395 13.351 1.00 71.34 H new ATOM 0 HH22 ARG A 58 -1.142 0.633 14.474 1.00 71.34 H new ATOM 950 N ARG A 59 3.672 5.279 11.081 1.00 15.53 N ATOM 951 CA ARG A 59 4.633 5.673 12.129 1.00 4.15 C ATOM 952 C ARG A 59 4.328 4.905 13.428 1.00 14.42 C ATOM 953 O ARG A 59 3.197 4.963 13.932 1.00 54.12 O ATOM 954 CB ARG A 59 4.580 7.210 12.330 1.00 14.41 C ATOM 955 CG ARG A 59 5.730 7.849 13.144 1.00 23.44 C ATOM 956 CD ARG A 59 5.640 7.665 14.671 1.00 21.43 C ATOM 957 NE ARG A 59 6.791 8.273 15.363 1.00 10.44 N ATOM 958 CZ ARG A 59 7.835 7.599 15.884 1.00 71.41 C ATOM 959 NH1 ARG A 59 7.902 6.279 15.805 1.00 74.00 N ATOM 960 NH2 ARG A 59 8.814 8.271 16.469 1.00 25.51 N ATOM 0 H ARG A 59 3.069 6.039 10.766 1.00 15.53 H new ATOM 0 HA ARG A 59 5.648 5.414 11.827 1.00 4.15 H new ATOM 0 HB2 ARG A 59 4.558 7.680 11.347 1.00 14.41 H new ATOM 0 HB3 ARG A 59 3.639 7.456 12.822 1.00 14.41 H new ATOM 0 HG2 ARG A 59 6.674 7.428 12.799 1.00 23.44 H new ATOM 0 HG3 ARG A 59 5.758 8.916 12.925 1.00 23.44 H new ATOM 0 HD2 ARG A 59 4.717 8.114 15.038 1.00 21.43 H new ATOM 0 HD3 ARG A 59 5.594 6.602 14.907 1.00 21.43 H new ATOM 0 HE ARG A 59 6.798 9.289 15.455 1.00 10.44 H new ATOM 0 HH11 ARG A 59 7.156 5.757 15.345 1.00 74.00 H new ATOM 0 HH12 ARG A 59 8.699 5.784 16.205 1.00 74.00 H new ATOM 0 HH21 ARG A 59 8.773 9.289 16.522 1.00 25.51 H new ATOM 0 HH22 ARG A 59 9.609 7.771 16.867 1.00 25.51 H new ATOM 974 N GLY A 60 5.329 4.166 13.934 1.00 43.22 N ATOM 975 CA GLY A 60 5.207 3.446 15.193 1.00 45.12 C ATOM 976 C GLY A 60 6.242 2.353 15.344 1.00 34.52 C ATOM 977 O GLY A 60 6.969 2.023 14.395 1.00 1.41 O ATOM 0 H GLY A 60 6.235 4.057 13.479 1.00 43.22 H new ATOM 0 HA2 GLY A 60 5.304 4.149 16.020 1.00 45.12 H new ATOM 0 HA3 GLY A 60 4.211 3.009 15.262 1.00 45.12 H new ATOM 981 N GLU A 61 6.302 1.801 16.559 1.00 64.04 N ATOM 982 CA GLU A 61 7.179 0.688 16.931 1.00 31.45 C ATOM 983 C GLU A 61 6.377 -0.629 16.859 1.00 50.33 C ATOM 984 O GLU A 61 5.588 -0.934 17.760 1.00 41.33 O ATOM 985 CB GLU A 61 7.759 0.900 18.370 1.00 0.20 C ATOM 986 CG GLU A 61 8.820 2.018 18.521 1.00 75.44 C ATOM 987 CD GLU A 61 8.305 3.433 18.205 1.00 51.14 C ATOM 988 OE1 GLU A 61 8.836 4.085 17.279 1.00 73.42 O ATOM 989 OE2 GLU A 61 7.357 3.891 18.882 1.00 62.42 O ATOM 0 H GLU A 61 5.724 2.126 17.334 1.00 64.04 H new ATOM 0 HA GLU A 61 8.018 0.641 16.237 1.00 31.45 H new ATOM 0 HB2 GLU A 61 6.931 1.120 19.044 1.00 0.20 H new ATOM 0 HB3 GLU A 61 8.201 -0.039 18.703 1.00 0.20 H new ATOM 0 HG2 GLU A 61 9.202 2.004 19.542 1.00 75.44 H new ATOM 0 HG3 GLU A 61 9.660 1.795 17.863 1.00 75.44 H new ATOM 996 N TYR A 62 6.561 -1.377 15.760 1.00 32.31 N ATOM 997 CA TYR A 62 5.937 -2.695 15.550 1.00 11.15 C ATOM 998 C TYR A 62 6.917 -3.783 16.043 1.00 34.35 C ATOM 999 O TYR A 62 7.953 -4.002 15.408 1.00 11.41 O ATOM 1000 CB TYR A 62 5.597 -2.904 14.047 1.00 33.22 C ATOM 1001 CG TYR A 62 4.659 -1.839 13.443 1.00 43.30 C ATOM 1002 CD1 TYR A 62 5.107 -0.539 13.190 1.00 61.54 C ATOM 1003 CD2 TYR A 62 3.330 -2.133 13.121 1.00 13.24 C ATOM 1004 CE1 TYR A 62 4.271 0.416 12.650 1.00 72.31 C ATOM 1005 CE2 TYR A 62 2.491 -1.180 12.579 1.00 31.52 C ATOM 1006 CZ TYR A 62 2.965 0.091 12.348 1.00 54.51 C ATOM 1007 OH TYR A 62 2.131 1.040 11.805 1.00 34.04 O ATOM 0 H TYR A 62 7.153 -1.082 14.984 1.00 32.31 H new ATOM 0 HA TYR A 62 5.005 -2.757 16.111 1.00 11.15 H new ATOM 0 HB2 TYR A 62 6.526 -2.915 13.477 1.00 33.22 H new ATOM 0 HB3 TYR A 62 5.137 -3.885 13.926 1.00 33.22 H new ATOM 0 HD1 TYR A 62 6.129 -0.277 13.422 1.00 61.54 H new ATOM 0 HD2 TYR A 62 2.951 -3.128 13.301 1.00 13.24 H new ATOM 0 HE1 TYR A 62 4.638 1.415 12.464 1.00 72.31 H new ATOM 0 HE2 TYR A 62 1.469 -1.431 12.338 1.00 31.52 H new ATOM 0 HH TYR A 62 1.672 1.522 12.524 1.00 34.04 H new ATOM 1017 N PRO A 63 6.624 -4.476 17.192 1.00 60.41 N ATOM 1018 CA PRO A 63 7.559 -5.456 17.797 1.00 61.35 C ATOM 1019 C PRO A 63 7.552 -6.823 17.082 1.00 61.51 C ATOM 1020 O PRO A 63 8.356 -7.706 17.415 1.00 50.41 O ATOM 1021 CB PRO A 63 7.042 -5.557 19.249 1.00 21.42 C ATOM 1022 CG PRO A 63 5.563 -5.335 19.140 1.00 3.32 C ATOM 1023 CD PRO A 63 5.363 -4.366 17.988 1.00 53.05 C ATOM 0 HA PRO A 63 8.601 -5.143 17.723 1.00 61.35 H new ATOM 0 HB2 PRO A 63 7.266 -6.532 19.683 1.00 21.42 H new ATOM 0 HB3 PRO A 63 7.509 -4.809 19.889 1.00 21.42 H new ATOM 0 HG2 PRO A 63 5.041 -6.274 18.954 1.00 3.32 H new ATOM 0 HG3 PRO A 63 5.162 -4.926 20.067 1.00 3.32 H new ATOM 0 HD2 PRO A 63 4.491 -4.632 17.391 1.00 53.05 H new ATOM 0 HD3 PRO A 63 5.206 -3.349 18.346 1.00 53.05 H new ATOM 1031 N ASP A 64 6.656 -6.969 16.091 1.00 33.32 N ATOM 1032 CA ASP A 64 6.496 -8.201 15.307 1.00 71.40 C ATOM 1033 C ASP A 64 5.676 -7.924 14.036 1.00 75.22 C ATOM 1034 O ASP A 64 5.013 -6.888 13.922 1.00 43.43 O ATOM 1035 CB ASP A 64 5.827 -9.310 16.156 1.00 63.21 C ATOM 1036 CG ASP A 64 4.417 -8.928 16.619 1.00 51.24 C ATOM 1037 OD1 ASP A 64 4.283 -8.215 17.631 1.00 10.00 O ATOM 1038 OD2 ASP A 64 3.448 -9.317 15.963 1.00 21.44 O ATOM 0 H ASP A 64 6.017 -6.226 15.810 1.00 33.32 H new ATOM 0 HA ASP A 64 7.485 -8.551 15.012 1.00 71.40 H new ATOM 0 HB2 ASP A 64 5.777 -10.229 15.572 1.00 63.21 H new ATOM 0 HB3 ASP A 64 6.447 -9.519 17.027 1.00 63.21 H new ATOM 1043 N TYR A 65 5.735 -8.884 13.098 1.00 10.14 N ATOM 1044 CA TYR A 65 5.075 -8.791 11.783 1.00 65.14 C ATOM 1045 C TYR A 65 3.554 -8.955 11.901 1.00 65.22 C ATOM 1046 O TYR A 65 2.802 -8.322 11.158 1.00 73.32 O ATOM 1047 CB TYR A 65 5.694 -9.810 10.774 1.00 21.22 C ATOM 1048 CG TYR A 65 5.644 -11.281 11.220 1.00 32.31 C ATOM 1049 CD1 TYR A 65 4.659 -12.151 10.749 1.00 71.51 C ATOM 1050 CD2 TYR A 65 6.573 -11.792 12.129 1.00 31.24 C ATOM 1051 CE1 TYR A 65 4.604 -13.462 11.173 1.00 72.53 C ATOM 1052 CE2 TYR A 65 6.519 -13.105 12.550 1.00 62.03 C ATOM 1053 CZ TYR A 65 5.535 -13.934 12.074 1.00 41.01 C ATOM 1054 OH TYR A 65 5.480 -15.244 12.502 1.00 51.51 O ATOM 0 H TYR A 65 6.247 -9.756 13.232 1.00 10.14 H new ATOM 0 HA TYR A 65 5.254 -7.790 11.390 1.00 65.14 H new ATOM 0 HB2 TYR A 65 5.172 -9.717 9.822 1.00 21.22 H new ATOM 0 HB3 TYR A 65 6.734 -9.535 10.596 1.00 21.22 H new ATOM 0 HD1 TYR A 65 3.928 -11.791 10.040 1.00 71.51 H new ATOM 0 HD2 TYR A 65 7.350 -11.146 12.510 1.00 31.24 H new ATOM 0 HE1 TYR A 65 3.832 -14.119 10.800 1.00 72.53 H new ATOM 0 HE2 TYR A 65 7.249 -13.479 13.252 1.00 62.03 H new ATOM 0 HH TYR A 65 6.210 -15.412 13.134 1.00 51.51 H new ATOM 1064 N GLN A 66 3.116 -9.759 12.887 1.00 63.13 N ATOM 1065 CA GLN A 66 1.682 -10.041 13.135 1.00 2.21 C ATOM 1066 C GLN A 66 0.947 -8.779 13.629 1.00 2.34 C ATOM 1067 O GLN A 66 -0.289 -8.717 13.579 1.00 62.43 O ATOM 1068 CB GLN A 66 1.541 -11.178 14.180 1.00 13.03 C ATOM 1069 CG GLN A 66 2.351 -12.447 13.859 1.00 34.12 C ATOM 1070 CD GLN A 66 2.338 -13.475 14.994 1.00 41.14 C ATOM 1071 OE1 GLN A 66 3.200 -13.463 15.872 1.00 73.45 O ATOM 1072 NE2 GLN A 66 1.354 -14.362 14.993 1.00 43.42 N ATOM 0 H GLN A 66 3.743 -10.234 13.537 1.00 63.13 H new ATOM 0 HA GLN A 66 1.228 -10.354 12.195 1.00 2.21 H new ATOM 0 HB2 GLN A 66 1.853 -10.800 15.153 1.00 13.03 H new ATOM 0 HB3 GLN A 66 0.488 -11.447 14.265 1.00 13.03 H new ATOM 0 HG2 GLN A 66 1.950 -12.907 12.956 1.00 34.12 H new ATOM 0 HG3 GLN A 66 3.382 -12.167 13.643 1.00 34.12 H new ATOM 0 HE21 GLN A 66 0.654 -14.346 14.251 1.00 43.42 H new ATOM 0 HE22 GLN A 66 1.296 -15.060 15.734 1.00 43.42 H new ATOM 1081 N GLN A 67 1.729 -7.784 14.101 1.00 63.45 N ATOM 1082 CA GLN A 67 1.221 -6.469 14.512 1.00 44.34 C ATOM 1083 C GLN A 67 0.471 -5.768 13.347 1.00 75.31 C ATOM 1084 O GLN A 67 -0.608 -5.210 13.560 1.00 35.23 O ATOM 1085 CB GLN A 67 2.380 -5.578 15.043 1.00 65.54 C ATOM 1086 CG GLN A 67 1.948 -4.199 15.592 1.00 21.43 C ATOM 1087 CD GLN A 67 1.096 -4.277 16.856 1.00 61.04 C ATOM 1088 OE1 GLN A 67 1.616 -4.221 17.970 1.00 45.21 O ATOM 1089 NE2 GLN A 67 -0.206 -4.476 16.693 1.00 13.00 N ATOM 0 H GLN A 67 2.739 -7.878 14.206 1.00 63.45 H new ATOM 0 HA GLN A 67 0.507 -6.620 15.321 1.00 44.34 H new ATOM 0 HB2 GLN A 67 2.901 -6.119 15.833 1.00 65.54 H new ATOM 0 HB3 GLN A 67 3.097 -5.422 14.237 1.00 65.54 H new ATOM 0 HG2 GLN A 67 2.839 -3.607 15.802 1.00 21.43 H new ATOM 0 HG3 GLN A 67 1.388 -3.670 14.820 1.00 21.43 H new ATOM 0 HE21 GLN A 67 -0.602 -4.517 15.754 1.00 13.00 H new ATOM 0 HE22 GLN A 67 -0.811 -4.588 17.507 1.00 13.00 H new ATOM 1098 N TRP A 68 1.045 -5.808 12.115 1.00 24.11 N ATOM 1099 CA TRP A 68 0.356 -5.295 10.900 1.00 35.12 C ATOM 1100 C TRP A 68 -0.220 -6.455 10.055 1.00 23.31 C ATOM 1101 O TRP A 68 -0.785 -6.224 8.976 1.00 62.13 O ATOM 1102 CB TRP A 68 1.307 -4.387 10.055 1.00 5.34 C ATOM 1103 CG TRP A 68 2.461 -5.081 9.334 1.00 52.02 C ATOM 1104 CD1 TRP A 68 2.453 -5.602 8.064 1.00 2.04 C ATOM 1105 CD2 TRP A 68 3.801 -5.274 9.822 1.00 62.54 C ATOM 1106 NE1 TRP A 68 3.689 -6.111 7.748 1.00 55.10 N ATOM 1107 CE2 TRP A 68 4.534 -5.917 8.806 1.00 24.25 C ATOM 1108 CE3 TRP A 68 4.448 -4.967 11.020 1.00 4.44 C ATOM 1109 CZ2 TRP A 68 5.881 -6.250 8.950 1.00 23.02 C ATOM 1110 CZ3 TRP A 68 5.784 -5.296 11.162 1.00 14.11 C ATOM 1111 CH2 TRP A 68 6.491 -5.929 10.132 1.00 13.43 C ATOM 0 H TRP A 68 1.975 -6.187 11.938 1.00 24.11 H new ATOM 0 HA TRP A 68 -0.482 -4.679 11.224 1.00 35.12 H new ATOM 0 HB2 TRP A 68 0.706 -3.866 9.310 1.00 5.34 H new ATOM 0 HB3 TRP A 68 1.726 -3.627 10.715 1.00 5.34 H new ATOM 0 HD1 TRP A 68 1.596 -5.610 7.406 1.00 2.04 H new ATOM 0 HE1 TRP A 68 3.937 -6.561 6.867 1.00 55.10 H new ATOM 0 HE3 TRP A 68 3.914 -4.481 11.823 1.00 4.44 H new ATOM 0 HZ2 TRP A 68 6.423 -6.744 8.157 1.00 23.02 H new ATOM 0 HZ3 TRP A 68 6.292 -5.060 12.085 1.00 14.11 H new ATOM 0 HH2 TRP A 68 7.535 -6.168 10.273 1.00 13.43 H new ATOM 1122 N MET A 69 -0.089 -7.686 10.596 1.00 65.33 N ATOM 1123 CA MET A 69 -0.490 -8.945 9.946 1.00 65.05 C ATOM 1124 C MET A 69 0.219 -9.126 8.593 1.00 21.41 C ATOM 1125 O MET A 69 -0.421 -9.182 7.532 1.00 12.22 O ATOM 1126 CB MET A 69 -2.044 -9.092 9.834 1.00 34.52 C ATOM 1127 CG MET A 69 -2.769 -9.176 11.186 1.00 13.24 C ATOM 1128 SD MET A 69 -4.531 -9.550 11.017 1.00 0.04 S ATOM 1129 CE MET A 69 -4.505 -11.200 10.304 1.00 15.15 C ATOM 0 H MET A 69 0.310 -7.831 11.523 1.00 65.33 H new ATOM 0 HA MET A 69 -0.161 -9.760 10.591 1.00 65.05 H new ATOM 0 HB2 MET A 69 -2.438 -8.243 9.275 1.00 34.52 H new ATOM 0 HB3 MET A 69 -2.272 -9.988 9.256 1.00 34.52 H new ATOM 0 HG2 MET A 69 -2.297 -9.944 11.799 1.00 13.24 H new ATOM 0 HG3 MET A 69 -2.652 -8.230 11.715 1.00 13.24 H new ATOM 0 HE1 MET A 69 -5.466 -11.685 10.473 1.00 15.15 H new ATOM 0 HE2 MET A 69 -4.317 -11.130 9.233 1.00 15.15 H new ATOM 0 HE3 MET A 69 -3.715 -11.787 10.773 1.00 15.15 H new ATOM 1139 N GLY A 70 1.560 -9.189 8.655 1.00 34.30 N ATOM 1140 CA GLY A 70 2.376 -9.485 7.491 1.00 75.23 C ATOM 1141 C GLY A 70 2.227 -10.945 7.080 1.00 53.04 C ATOM 1142 O GLY A 70 2.562 -11.842 7.863 1.00 24.54 O ATOM 0 H GLY A 70 2.094 -9.036 9.510 1.00 34.30 H new ATOM 0 HA2 GLY A 70 2.084 -8.838 6.663 1.00 75.23 H new ATOM 0 HA3 GLY A 70 3.422 -9.270 7.711 1.00 75.23 H new ATOM 1146 N LEU A 71 1.711 -11.174 5.859 1.00 33.34 N ATOM 1147 CA LEU A 71 1.480 -12.533 5.324 1.00 31.04 C ATOM 1148 C LEU A 71 2.840 -13.156 4.993 1.00 30.21 C ATOM 1149 O LEU A 71 3.101 -14.329 5.282 1.00 63.10 O ATOM 1150 CB LEU A 71 0.568 -12.512 4.058 1.00 73.51 C ATOM 1151 CG LEU A 71 -0.902 -11.980 4.234 1.00 13.25 C ATOM 1152 CD1 LEU A 71 -0.963 -10.453 4.479 1.00 52.22 C ATOM 1153 CD2 LEU A 71 -1.776 -12.372 3.027 1.00 70.11 C ATOM 0 H LEU A 71 1.443 -10.428 5.217 1.00 33.34 H new ATOM 0 HA LEU A 71 0.961 -13.127 6.076 1.00 31.04 H new ATOM 0 HB2 LEU A 71 1.059 -11.902 3.300 1.00 73.51 H new ATOM 0 HB3 LEU A 71 0.514 -13.527 3.665 1.00 73.51 H new ATOM 0 HG LEU A 71 -1.300 -12.458 5.129 1.00 13.25 H new ATOM 0 HD11 LEU A 71 -2.002 -10.144 4.593 1.00 52.22 H new ATOM 0 HD12 LEU A 71 -0.410 -10.208 5.386 1.00 52.22 H new ATOM 0 HD13 LEU A 71 -0.520 -9.930 3.631 1.00 52.22 H new ATOM 0 HD21 LEU A 71 -2.788 -11.993 3.172 1.00 70.11 H new ATOM 0 HD22 LEU A 71 -1.355 -11.943 2.118 1.00 70.11 H new ATOM 0 HD23 LEU A 71 -1.805 -13.458 2.936 1.00 70.11 H new ATOM 1165 N SER A 72 3.691 -12.325 4.376 1.00 33.23 N ATOM 1166 CA SER A 72 5.115 -12.586 4.194 1.00 30.51 C ATOM 1167 C SER A 72 5.902 -11.490 4.933 1.00 2.22 C ATOM 1168 O SER A 72 5.523 -10.311 4.915 1.00 11.11 O ATOM 1169 CB SER A 72 5.487 -12.598 2.689 1.00 50.21 C ATOM 1170 OG SER A 72 5.195 -11.358 2.059 1.00 44.13 O ATOM 0 H SER A 72 3.395 -11.432 3.982 1.00 33.23 H new ATOM 0 HA SER A 72 5.364 -13.567 4.600 1.00 30.51 H new ATOM 0 HB2 SER A 72 6.549 -12.819 2.580 1.00 50.21 H new ATOM 0 HB3 SER A 72 4.942 -13.397 2.187 1.00 50.21 H new ATOM 0 HG SER A 72 4.587 -10.838 2.626 1.00 44.13 H new ATOM 1176 N ASP A 73 6.975 -11.904 5.604 1.00 61.21 N ATOM 1177 CA ASP A 73 7.900 -10.990 6.302 1.00 61.31 C ATOM 1178 C ASP A 73 9.003 -10.503 5.346 1.00 44.24 C ATOM 1179 O ASP A 73 9.687 -9.518 5.633 1.00 62.41 O ATOM 1180 CB ASP A 73 8.510 -11.715 7.526 1.00 31.45 C ATOM 1181 CG ASP A 73 9.265 -13.011 7.153 1.00 64.14 C ATOM 1182 OD1 ASP A 73 8.613 -14.051 6.956 1.00 21.12 O ATOM 1183 OD2 ASP A 73 10.503 -12.993 7.044 1.00 73.12 O ATOM 0 H ASP A 73 7.236 -12.887 5.684 1.00 61.21 H new ATOM 0 HA ASP A 73 7.350 -10.114 6.647 1.00 61.31 H new ATOM 0 HB2 ASP A 73 9.194 -11.038 8.037 1.00 31.45 H new ATOM 0 HB3 ASP A 73 7.714 -11.956 8.231 1.00 31.45 H new ATOM 1188 N SER A 74 9.151 -11.208 4.209 1.00 21.01 N ATOM 1189 CA SER A 74 10.163 -10.914 3.190 1.00 2.11 C ATOM 1190 C SER A 74 9.837 -9.587 2.469 1.00 73.45 C ATOM 1191 O SER A 74 8.784 -9.462 1.847 1.00 44.03 O ATOM 1192 CB SER A 74 10.233 -12.095 2.200 1.00 65.43 C ATOM 1193 OG SER A 74 10.505 -13.314 2.886 1.00 74.41 O ATOM 0 H SER A 74 8.562 -12.007 3.974 1.00 21.01 H new ATOM 0 HA SER A 74 11.138 -10.792 3.661 1.00 2.11 H new ATOM 0 HB2 SER A 74 9.290 -12.179 1.660 1.00 65.43 H new ATOM 0 HB3 SER A 74 11.010 -11.908 1.458 1.00 65.43 H new ATOM 0 HG SER A 74 10.544 -14.051 2.241 1.00 74.41 H new ATOM 1199 N ILE A 75 10.745 -8.597 2.602 1.00 41.52 N ATOM 1200 CA ILE A 75 10.592 -7.234 2.059 1.00 10.13 C ATOM 1201 C ILE A 75 11.869 -6.865 1.283 1.00 35.50 C ATOM 1202 O ILE A 75 12.976 -6.967 1.828 1.00 31.23 O ATOM 1203 CB ILE A 75 10.336 -6.183 3.213 1.00 13.44 C ATOM 1204 CG1 ILE A 75 9.025 -6.519 4.007 1.00 13.52 C ATOM 1205 CG2 ILE A 75 10.303 -4.736 2.657 1.00 21.42 C ATOM 1206 CD1 ILE A 75 8.755 -5.634 5.217 1.00 25.31 C ATOM 0 H ILE A 75 11.624 -8.728 3.102 1.00 41.52 H new ATOM 0 HA ILE A 75 9.728 -7.212 1.395 1.00 10.13 H new ATOM 0 HB ILE A 75 11.170 -6.249 3.912 1.00 13.44 H new ATOM 0 HG12 ILE A 75 8.177 -6.444 3.326 1.00 13.52 H new ATOM 0 HG13 ILE A 75 9.076 -7.556 4.339 1.00 13.52 H new ATOM 0 HG21 ILE A 75 10.125 -4.036 3.474 1.00 21.42 H new ATOM 0 HG22 ILE A 75 11.258 -4.506 2.184 1.00 21.42 H new ATOM 0 HG23 ILE A 75 9.503 -4.647 1.922 1.00 21.42 H new ATOM 0 HD11 ILE A 75 7.827 -5.947 5.697 1.00 25.31 H new ATOM 0 HD12 ILE A 75 9.578 -5.725 5.925 1.00 25.31 H new ATOM 0 HD13 ILE A 75 8.666 -4.596 4.896 1.00 25.31 H new ATOM 1218 N ARG A 76 11.715 -6.449 0.007 1.00 73.25 N ATOM 1219 CA ARG A 76 12.852 -6.121 -0.885 1.00 21.44 C ATOM 1220 C ARG A 76 12.629 -4.815 -1.694 1.00 4.21 C ATOM 1221 O ARG A 76 13.417 -4.510 -2.604 1.00 31.10 O ATOM 1222 CB ARG A 76 13.160 -7.334 -1.810 1.00 25.41 C ATOM 1223 CG ARG A 76 13.948 -8.481 -1.120 1.00 62.14 C ATOM 1224 CD ARG A 76 14.175 -9.694 -2.030 1.00 13.03 C ATOM 1225 NE ARG A 76 15.088 -10.675 -1.411 1.00 34.31 N ATOM 1226 CZ ARG A 76 14.792 -11.950 -1.101 1.00 12.20 C ATOM 1227 NH1 ARG A 76 13.585 -12.457 -1.334 1.00 72.13 N ATOM 1228 NH2 ARG A 76 15.724 -12.716 -0.555 1.00 63.45 N ATOM 0 H ARG A 76 10.803 -6.331 -0.434 1.00 73.25 H new ATOM 0 HA ARG A 76 13.722 -5.926 -0.258 1.00 21.44 H new ATOM 0 HB2 ARG A 76 12.220 -7.733 -2.191 1.00 25.41 H new ATOM 0 HB3 ARG A 76 13.730 -6.984 -2.671 1.00 25.41 H new ATOM 0 HG2 ARG A 76 14.913 -8.100 -0.787 1.00 62.14 H new ATOM 0 HG3 ARG A 76 13.406 -8.800 -0.229 1.00 62.14 H new ATOM 0 HD2 ARG A 76 13.219 -10.171 -2.246 1.00 13.03 H new ATOM 0 HD3 ARG A 76 14.588 -9.363 -2.983 1.00 13.03 H new ATOM 0 HE ARG A 76 16.033 -10.356 -1.198 1.00 34.31 H new ATOM 0 HH11 ARG A 76 12.861 -11.876 -1.756 1.00 72.13 H new ATOM 0 HH12 ARG A 76 13.384 -13.427 -1.090 1.00 72.13 H new ATOM 0 HH21 ARG A 76 16.654 -12.337 -0.374 1.00 63.45 H new ATOM 0 HH22 ARG A 76 15.512 -13.685 -0.315 1.00 63.45 H new ATOM 1242 N SER A 77 11.584 -4.032 -1.348 1.00 61.42 N ATOM 1243 CA SER A 77 11.436 -2.626 -1.806 1.00 14.55 C ATOM 1244 C SER A 77 10.756 -1.782 -0.703 1.00 64.30 C ATOM 1245 O SER A 77 10.060 -2.320 0.167 1.00 0.20 O ATOM 1246 CB SER A 77 10.643 -2.517 -3.137 1.00 1.03 C ATOM 1247 OG SER A 77 11.295 -3.161 -4.209 1.00 3.12 O ATOM 0 H SER A 77 10.823 -4.350 -0.748 1.00 61.42 H new ATOM 0 HA SER A 77 12.436 -2.238 -1.999 1.00 14.55 H new ATOM 0 HB2 SER A 77 9.653 -2.954 -3.003 1.00 1.03 H new ATOM 0 HB3 SER A 77 10.497 -1.465 -3.384 1.00 1.03 H new ATOM 0 HG SER A 77 12.213 -2.826 -4.282 1.00 3.12 H new ATOM 1253 N CYS A 78 10.989 -0.457 -0.743 1.00 43.40 N ATOM 1254 CA CYS A 78 10.415 0.512 0.204 1.00 33.20 C ATOM 1255 C CYS A 78 10.137 1.838 -0.526 1.00 44.11 C ATOM 1256 O CYS A 78 10.892 2.219 -1.435 1.00 11.23 O ATOM 1257 CB CYS A 78 11.379 0.751 1.396 1.00 65.31 C ATOM 1258 SG CYS A 78 13.014 1.352 0.914 1.00 55.45 S ATOM 0 H CYS A 78 11.590 -0.025 -1.445 1.00 43.40 H new ATOM 0 HA CYS A 78 9.481 0.110 0.597 1.00 33.20 H new ATOM 0 HB2 CYS A 78 10.925 1.471 2.077 1.00 65.31 H new ATOM 0 HB3 CYS A 78 11.495 -0.182 1.948 1.00 65.31 H new ATOM 0 HG CYS A 78 13.230 2.510 1.464 1.00 55.45 H new ATOM 1264 N CYS A 79 9.050 2.524 -0.137 1.00 64.35 N ATOM 1265 CA CYS A 79 8.665 3.839 -0.684 1.00 11.31 C ATOM 1266 C CYS A 79 8.005 4.683 0.402 1.00 74.32 C ATOM 1267 O CYS A 79 7.132 4.189 1.109 1.00 64.50 O ATOM 1268 CB CYS A 79 7.694 3.690 -1.879 1.00 44.11 C ATOM 1269 SG CYS A 79 8.441 2.930 -3.320 1.00 10.43 S ATOM 0 H CYS A 79 8.405 2.179 0.574 1.00 64.35 H new ATOM 0 HA CYS A 79 9.571 4.332 -1.036 1.00 11.31 H new ATOM 0 HB2 CYS A 79 6.837 3.094 -1.567 1.00 44.11 H new ATOM 0 HB3 CYS A 79 7.315 4.674 -2.153 1.00 44.11 H new ATOM 0 HG CYS A 79 7.920 1.754 -3.510 1.00 10.43 H new ATOM 1275 N LEU A 80 8.426 5.947 0.538 1.00 12.00 N ATOM 1276 CA LEU A 80 7.768 6.911 1.433 1.00 4.43 C ATOM 1277 C LEU A 80 6.650 7.623 0.669 1.00 34.25 C ATOM 1278 O LEU A 80 6.840 8.036 -0.480 1.00 13.34 O ATOM 1279 CB LEU A 80 8.788 7.953 1.976 1.00 13.22 C ATOM 1280 CG LEU A 80 8.192 9.133 2.820 1.00 43.51 C ATOM 1281 CD1 LEU A 80 7.460 8.634 4.090 1.00 44.32 C ATOM 1282 CD2 LEU A 80 9.279 10.173 3.159 1.00 53.43 C ATOM 0 H LEU A 80 9.227 6.330 0.035 1.00 12.00 H new ATOM 0 HA LEU A 80 7.351 6.373 2.284 1.00 4.43 H new ATOM 0 HB2 LEU A 80 9.519 7.428 2.590 1.00 13.22 H new ATOM 0 HB3 LEU A 80 9.328 8.376 1.129 1.00 13.22 H new ATOM 0 HG LEU A 80 7.440 9.625 2.203 1.00 43.51 H new ATOM 0 HD11 LEU A 80 7.065 9.487 4.641 1.00 44.32 H new ATOM 0 HD12 LEU A 80 6.640 7.976 3.802 1.00 44.32 H new ATOM 0 HD13 LEU A 80 8.160 8.087 4.722 1.00 44.32 H new ATOM 0 HD21 LEU A 80 8.840 10.981 3.745 1.00 53.43 H new ATOM 0 HD22 LEU A 80 10.072 9.696 3.736 1.00 53.43 H new ATOM 0 HD23 LEU A 80 9.695 10.578 2.237 1.00 53.43 H new ATOM 1294 N ILE A 81 5.477 7.741 1.297 1.00 74.45 N ATOM 1295 CA ILE A 81 4.360 8.525 0.764 1.00 10.24 C ATOM 1296 C ILE A 81 4.146 9.729 1.706 1.00 75.10 C ATOM 1297 O ILE A 81 3.665 9.543 2.825 1.00 52.15 O ATOM 1298 CB ILE A 81 3.027 7.692 0.619 1.00 73.45 C ATOM 1299 CG1 ILE A 81 3.192 6.448 -0.341 1.00 31.30 C ATOM 1300 CG2 ILE A 81 1.878 8.618 0.132 1.00 75.35 C ATOM 1301 CD1 ILE A 81 3.934 5.240 0.242 1.00 53.34 C ATOM 0 H ILE A 81 5.275 7.294 2.191 1.00 74.45 H new ATOM 0 HA ILE A 81 4.613 8.849 -0.246 1.00 10.24 H new ATOM 0 HB ILE A 81 2.779 7.293 1.603 1.00 73.45 H new ATOM 0 HG12 ILE A 81 2.200 6.123 -0.655 1.00 31.30 H new ATOM 0 HG13 ILE A 81 3.719 6.774 -1.238 1.00 31.30 H new ATOM 0 HG21 ILE A 81 0.960 8.038 0.034 1.00 75.35 H new ATOM 0 HG22 ILE A 81 1.725 9.419 0.855 1.00 75.35 H new ATOM 0 HG23 ILE A 81 2.141 9.047 -0.835 1.00 75.35 H new ATOM 0 HD11 ILE A 81 3.986 4.449 -0.506 1.00 53.34 H new ATOM 0 HD12 ILE A 81 4.943 5.536 0.528 1.00 53.34 H new ATOM 0 HD13 ILE A 81 3.401 4.875 1.120 1.00 53.34 H new ATOM 1313 N PRO A 82 4.567 10.968 1.295 1.00 15.35 N ATOM 1314 CA PRO A 82 4.380 12.184 2.103 1.00 52.13 C ATOM 1315 C PRO A 82 3.019 12.886 1.860 1.00 44.10 C ATOM 1316 O PRO A 82 2.292 12.555 0.910 1.00 44.21 O ATOM 1317 CB PRO A 82 5.587 13.047 1.671 1.00 21.43 C ATOM 1318 CG PRO A 82 5.856 12.677 0.238 1.00 32.32 C ATOM 1319 CD PRO A 82 5.300 11.272 0.028 1.00 43.55 C ATOM 0 HA PRO A 82 4.347 11.983 3.174 1.00 52.13 H new ATOM 0 HB2 PRO A 82 5.363 14.110 1.766 1.00 21.43 H new ATOM 0 HB3 PRO A 82 6.456 12.847 2.297 1.00 21.43 H new ATOM 0 HG2 PRO A 82 5.379 13.386 -0.439 1.00 32.32 H new ATOM 0 HG3 PRO A 82 6.925 12.704 0.027 1.00 32.32 H new ATOM 0 HD2 PRO A 82 4.635 11.233 -0.835 1.00 43.55 H new ATOM 0 HD3 PRO A 82 6.098 10.552 -0.152 1.00 43.55 H new ATOM 1327 N GLN A 83 2.695 13.838 2.770 1.00 11.00 N ATOM 1328 CA GLN A 83 1.457 14.652 2.732 1.00 52.14 C ATOM 1329 C GLN A 83 1.262 15.328 1.368 1.00 72.15 C ATOM 1330 O GLN A 83 2.184 15.971 0.850 1.00 41.22 O ATOM 1331 CB GLN A 83 1.492 15.743 3.835 1.00 73.35 C ATOM 1332 CG GLN A 83 1.328 15.237 5.283 1.00 35.33 C ATOM 1333 CD GLN A 83 -0.065 14.663 5.589 1.00 11.53 C ATOM 1334 OE1 GLN A 83 -0.149 13.803 6.591 1.00 62.24 O flip ATOM 1335 NE2 GLN A 83 -1.065 15.037 4.974 1.00 15.01 N flip ATOM 0 H GLN A 83 3.296 14.064 3.562 1.00 11.00 H new ATOM 0 HA GLN A 83 0.622 13.973 2.906 1.00 52.14 H new ATOM 0 HB2 GLN A 83 2.439 16.277 3.762 1.00 73.35 H new ATOM 0 HB3 GLN A 83 0.702 16.466 3.631 1.00 73.35 H new ATOM 0 HG2 GLN A 83 2.077 14.469 5.476 1.00 35.33 H new ATOM 0 HG3 GLN A 83 1.530 16.059 5.970 1.00 35.33 H new ATOM 0 HE21 GLN A 83 -0.972 15.701 4.205 1.00 15.01 H new ATOM 0 HE22 GLN A 83 -1.986 14.683 5.234 1.00 15.01 H new ATOM 1344 N THR A 84 0.047 15.207 0.831 1.00 34.40 N ATOM 1345 CA THR A 84 -0.333 15.727 -0.485 1.00 70.40 C ATOM 1346 C THR A 84 -1.437 16.788 -0.310 1.00 62.10 C ATOM 1347 O THR A 84 -2.169 16.758 0.689 1.00 1.21 O ATOM 1348 CB THR A 84 -0.841 14.555 -1.382 1.00 31.12 C ATOM 1349 OG1 THR A 84 -1.889 13.841 -0.699 1.00 32.45 O ATOM 1350 CG2 THR A 84 0.278 13.562 -1.752 1.00 31.13 C ATOM 0 H THR A 84 -0.719 14.733 1.310 1.00 34.40 H new ATOM 0 HA THR A 84 0.530 16.187 -0.967 1.00 70.40 H new ATOM 0 HB THR A 84 -1.211 15.000 -2.306 1.00 31.12 H new ATOM 0 HG1 THR A 84 -2.757 14.088 -1.082 1.00 32.45 H new ATOM 0 HG21 THR A 84 -0.132 12.768 -2.376 1.00 31.13 H new ATOM 0 HG22 THR A 84 1.062 14.085 -2.299 1.00 31.13 H new ATOM 0 HG23 THR A 84 0.696 13.130 -0.843 1.00 31.13 H new ATOM 1358 N VAL A 85 -1.571 17.697 -1.293 1.00 23.43 N ATOM 1359 CA VAL A 85 -2.448 18.896 -1.193 1.00 24.32 C ATOM 1360 C VAL A 85 -3.958 18.536 -1.219 1.00 71.34 C ATOM 1361 O VAL A 85 -4.809 19.343 -0.818 1.00 33.43 O ATOM 1362 CB VAL A 85 -2.106 19.933 -2.328 1.00 43.21 C ATOM 1363 CG1 VAL A 85 -0.618 20.360 -2.256 1.00 44.51 C ATOM 1364 CG2 VAL A 85 -2.470 19.394 -3.735 1.00 12.43 C ATOM 0 H VAL A 85 -1.077 17.628 -2.183 1.00 23.43 H new ATOM 0 HA VAL A 85 -2.247 19.352 -0.224 1.00 24.32 H new ATOM 0 HB VAL A 85 -2.721 20.817 -2.158 1.00 43.21 H new ATOM 0 HG11 VAL A 85 -0.406 21.076 -3.050 1.00 44.51 H new ATOM 0 HG12 VAL A 85 -0.418 20.821 -1.289 1.00 44.51 H new ATOM 0 HG13 VAL A 85 0.018 19.484 -2.379 1.00 44.51 H new ATOM 0 HG21 VAL A 85 -2.218 20.141 -4.487 1.00 12.43 H new ATOM 0 HG22 VAL A 85 -1.911 18.479 -3.930 1.00 12.43 H new ATOM 0 HG23 VAL A 85 -3.538 19.182 -3.778 1.00 12.43 H new ATOM 1374 N SER A 86 -4.254 17.313 -1.683 1.00 14.14 N ATOM 1375 CA SER A 86 -5.618 16.770 -1.781 1.00 54.54 C ATOM 1376 C SER A 86 -5.558 15.226 -1.868 1.00 24.44 C ATOM 1377 O SER A 86 -4.470 14.641 -1.846 1.00 34.11 O ATOM 1378 CB SER A 86 -6.330 17.381 -3.011 1.00 14.10 C ATOM 1379 OG SER A 86 -5.548 17.226 -4.178 1.00 30.41 O ATOM 0 H SER A 86 -3.539 16.661 -2.007 1.00 14.14 H new ATOM 0 HA SER A 86 -6.191 17.035 -0.892 1.00 54.54 H new ATOM 0 HB2 SER A 86 -7.298 16.900 -3.151 1.00 14.10 H new ATOM 0 HB3 SER A 86 -6.522 18.440 -2.836 1.00 14.10 H new ATOM 0 HG SER A 86 -4.736 16.721 -3.963 1.00 30.41 H new ATOM 1385 N HIS A 87 -6.738 14.583 -1.942 1.00 42.22 N ATOM 1386 CA HIS A 87 -6.892 13.114 -2.071 1.00 0.31 C ATOM 1387 C HIS A 87 -8.179 12.831 -2.854 1.00 14.14 C ATOM 1388 O HIS A 87 -9.287 13.010 -2.327 1.00 41.10 O ATOM 1389 CB HIS A 87 -6.947 12.395 -0.689 1.00 22.43 C ATOM 1390 CG HIS A 87 -5.634 12.325 0.043 1.00 0.03 C ATOM 1391 ND1 HIS A 87 -5.245 13.251 0.986 1.00 34.43 N ATOM 1392 CD2 HIS A 87 -4.628 11.421 -0.027 1.00 75.13 C ATOM 1393 CE1 HIS A 87 -4.064 12.922 1.460 1.00 41.13 C ATOM 1394 NE2 HIS A 87 -3.667 11.814 0.866 1.00 42.12 N ATOM 0 H HIS A 87 -7.631 15.075 -1.914 1.00 42.22 H new ATOM 0 HA HIS A 87 -6.019 12.724 -2.595 1.00 0.31 H new ATOM 0 HB2 HIS A 87 -7.671 12.909 -0.057 1.00 22.43 H new ATOM 0 HB3 HIS A 87 -7.317 11.381 -0.838 1.00 22.43 H new ATOM 0 HD2 HIS A 87 -4.591 10.552 -0.668 1.00 75.13 H new ATOM 0 HE1 HIS A 87 -3.511 13.468 2.210 1.00 41.13 H new ATOM 0 HE2 HIS A 87 -2.787 11.329 1.043 1.00 42.12 H new ATOM 1403 N ARG A 88 -8.025 12.402 -4.114 1.00 32.03 N ATOM 1404 CA ARG A 88 -9.146 12.203 -5.042 1.00 44.04 C ATOM 1405 C ARG A 88 -8.794 11.085 -6.041 1.00 0.24 C ATOM 1406 O ARG A 88 -7.754 11.149 -6.714 1.00 51.34 O ATOM 1407 CB ARG A 88 -9.468 13.539 -5.768 1.00 2.03 C ATOM 1408 CG ARG A 88 -10.731 13.514 -6.653 1.00 62.22 C ATOM 1409 CD ARG A 88 -11.036 14.888 -7.273 1.00 41.33 C ATOM 1410 NE ARG A 88 -12.247 14.870 -8.109 1.00 23.41 N ATOM 1411 CZ ARG A 88 -12.473 15.695 -9.150 1.00 21.22 C ATOM 1412 NH1 ARG A 88 -11.580 16.615 -9.505 1.00 45.34 N ATOM 1413 NH2 ARG A 88 -13.605 15.602 -9.822 1.00 31.54 N ATOM 0 H ARG A 88 -7.115 12.182 -4.520 1.00 32.03 H new ATOM 0 HA ARG A 88 -10.037 11.898 -4.493 1.00 44.04 H new ATOM 0 HB2 ARG A 88 -9.583 14.323 -5.019 1.00 2.03 H new ATOM 0 HB3 ARG A 88 -8.614 13.813 -6.388 1.00 2.03 H new ATOM 0 HG2 ARG A 88 -10.600 12.780 -7.448 1.00 62.22 H new ATOM 0 HG3 ARG A 88 -11.584 13.190 -6.057 1.00 62.22 H new ATOM 0 HD2 ARG A 88 -11.158 15.623 -6.478 1.00 41.33 H new ATOM 0 HD3 ARG A 88 -10.186 15.208 -7.876 1.00 41.33 H new ATOM 0 HE ARG A 88 -12.967 14.184 -7.884 1.00 23.41 H new ATOM 0 HH11 ARG A 88 -10.706 16.705 -8.986 1.00 45.34 H new ATOM 0 HH12 ARG A 88 -11.769 17.231 -10.296 1.00 45.34 H new ATOM 0 HH21 ARG A 88 -14.303 14.909 -9.552 1.00 31.54 H new ATOM 0 HH22 ARG A 88 -13.782 16.224 -10.611 1.00 31.54 H new ATOM 1427 N LEU A 89 -9.679 10.086 -6.133 1.00 32.14 N ATOM 1428 CA LEU A 89 -9.478 8.861 -6.929 1.00 24.11 C ATOM 1429 C LEU A 89 -10.783 8.510 -7.661 1.00 62.04 C ATOM 1430 O LEU A 89 -11.872 8.799 -7.164 1.00 53.15 O ATOM 1431 CB LEU A 89 -8.992 7.721 -5.970 1.00 4.03 C ATOM 1432 CG LEU A 89 -8.967 6.233 -6.494 1.00 25.43 C ATOM 1433 CD1 LEU A 89 -7.844 5.418 -5.819 1.00 31.32 C ATOM 1434 CD2 LEU A 89 -10.325 5.528 -6.260 1.00 44.42 C ATOM 0 H LEU A 89 -10.576 10.103 -5.647 1.00 32.14 H new ATOM 0 HA LEU A 89 -8.714 9.003 -7.693 1.00 24.11 H new ATOM 0 HB2 LEU A 89 -7.982 7.972 -5.647 1.00 4.03 H new ATOM 0 HB3 LEU A 89 -9.625 7.746 -5.083 1.00 4.03 H new ATOM 0 HG LEU A 89 -8.774 6.280 -7.566 1.00 25.43 H new ATOM 0 HD11 LEU A 89 -7.854 4.398 -6.202 1.00 31.32 H new ATOM 0 HD12 LEU A 89 -6.880 5.878 -6.036 1.00 31.32 H new ATOM 0 HD13 LEU A 89 -8.003 5.402 -4.741 1.00 31.32 H new ATOM 0 HD21 LEU A 89 -10.273 4.505 -6.633 1.00 44.42 H new ATOM 0 HD22 LEU A 89 -10.549 5.515 -5.193 1.00 44.42 H new ATOM 0 HD23 LEU A 89 -11.111 6.067 -6.789 1.00 44.42 H new ATOM 1446 N ARG A 90 -10.666 7.896 -8.851 1.00 42.21 N ATOM 1447 CA ARG A 90 -11.826 7.458 -9.656 1.00 72.11 C ATOM 1448 C ARG A 90 -11.740 5.939 -9.902 1.00 72.34 C ATOM 1449 O ARG A 90 -10.757 5.462 -10.472 1.00 2.31 O ATOM 1450 CB ARG A 90 -11.881 8.238 -11.005 1.00 40.51 C ATOM 1451 CG ARG A 90 -11.809 9.772 -10.857 1.00 30.22 C ATOM 1452 CD ARG A 90 -11.949 10.528 -12.188 1.00 41.33 C ATOM 1453 NE ARG A 90 -13.335 10.511 -12.680 1.00 71.23 N ATOM 1454 CZ ARG A 90 -13.782 11.143 -13.777 1.00 62.44 C ATOM 1455 NH1 ARG A 90 -12.955 11.843 -14.558 1.00 40.43 N ATOM 1456 NH2 ARG A 90 -15.075 11.111 -14.051 1.00 50.44 N ATOM 0 H ARG A 90 -9.766 7.688 -9.284 1.00 42.21 H new ATOM 0 HA ARG A 90 -12.744 7.673 -9.109 1.00 72.11 H new ATOM 0 HB2 ARG A 90 -11.056 7.907 -11.636 1.00 40.51 H new ATOM 0 HB3 ARG A 90 -12.804 7.978 -11.524 1.00 40.51 H new ATOM 0 HG2 ARG A 90 -12.596 10.100 -10.178 1.00 30.22 H new ATOM 0 HG3 ARG A 90 -10.858 10.040 -10.396 1.00 30.22 H new ATOM 0 HD2 ARG A 90 -11.622 11.559 -12.057 1.00 41.33 H new ATOM 0 HD3 ARG A 90 -11.293 10.078 -12.933 1.00 41.33 H new ATOM 0 HE ARG A 90 -14.014 9.973 -12.142 1.00 71.23 H new ATOM 0 HH11 ARG A 90 -11.964 11.905 -14.325 1.00 40.43 H new ATOM 0 HH12 ARG A 90 -13.315 12.316 -15.387 1.00 40.43 H new ATOM 0 HH21 ARG A 90 -15.715 10.612 -13.433 1.00 50.44 H new ATOM 0 HH22 ARG A 90 -15.433 11.586 -14.880 1.00 50.44 H new ATOM 1470 N LEU A 91 -12.763 5.195 -9.442 1.00 21.31 N ATOM 1471 CA LEU A 91 -12.899 3.739 -9.651 1.00 24.10 C ATOM 1472 C LEU A 91 -13.477 3.481 -11.055 1.00 61.22 C ATOM 1473 O LEU A 91 -14.392 4.196 -11.484 1.00 14.24 O ATOM 1474 CB LEU A 91 -13.848 3.084 -8.580 1.00 71.23 C ATOM 1475 CG LEU A 91 -13.510 3.313 -7.056 1.00 51.13 C ATOM 1476 CD1 LEU A 91 -13.857 4.741 -6.594 1.00 33.31 C ATOM 1477 CD2 LEU A 91 -14.211 2.267 -6.150 1.00 23.10 C ATOM 0 H LEU A 91 -13.533 5.595 -8.905 1.00 21.31 H new ATOM 0 HA LEU A 91 -11.910 3.291 -9.551 1.00 24.10 H new ATOM 0 HB2 LEU A 91 -14.858 3.453 -8.758 1.00 71.23 H new ATOM 0 HB3 LEU A 91 -13.865 2.009 -8.761 1.00 71.23 H new ATOM 0 HG LEU A 91 -12.432 3.183 -6.957 1.00 51.13 H new ATOM 0 HD11 LEU A 91 -13.608 4.853 -5.539 1.00 33.31 H new ATOM 0 HD12 LEU A 91 -13.287 5.462 -7.180 1.00 33.31 H new ATOM 0 HD13 LEU A 91 -14.923 4.920 -6.736 1.00 33.31 H new ATOM 0 HD21 LEU A 91 -13.954 2.458 -5.108 1.00 23.10 H new ATOM 0 HD22 LEU A 91 -15.291 2.341 -6.277 1.00 23.10 H new ATOM 0 HD23 LEU A 91 -13.881 1.266 -6.428 1.00 23.10 H new ATOM 1489 N TYR A 92 -12.931 2.482 -11.767 1.00 35.10 N ATOM 1490 CA TYR A 92 -13.455 2.035 -13.076 1.00 75.22 C ATOM 1491 C TYR A 92 -13.679 0.520 -13.042 1.00 41.02 C ATOM 1492 O TYR A 92 -12.777 -0.248 -12.666 1.00 63.44 O ATOM 1493 CB TYR A 92 -12.496 2.420 -14.228 1.00 22.21 C ATOM 1494 CG TYR A 92 -12.297 3.931 -14.379 1.00 41.44 C ATOM 1495 CD1 TYR A 92 -11.309 4.604 -13.665 1.00 63.03 C ATOM 1496 CD2 TYR A 92 -13.117 4.685 -15.217 1.00 43.10 C ATOM 1497 CE1 TYR A 92 -11.152 5.964 -13.776 1.00 14.44 C ATOM 1498 CE2 TYR A 92 -12.951 6.045 -15.334 1.00 72.34 C ATOM 1499 CZ TYR A 92 -11.971 6.681 -14.610 1.00 33.34 C ATOM 1500 OH TYR A 92 -11.818 8.045 -14.712 1.00 60.33 O ATOM 0 H TYR A 92 -12.113 1.959 -11.455 1.00 35.10 H new ATOM 0 HA TYR A 92 -14.404 2.537 -13.263 1.00 75.22 H new ATOM 0 HB2 TYR A 92 -11.528 1.950 -14.057 1.00 22.21 H new ATOM 0 HB3 TYR A 92 -12.885 2.018 -15.163 1.00 22.21 H new ATOM 0 HD1 TYR A 92 -10.654 4.046 -13.012 1.00 63.03 H new ATOM 0 HD2 TYR A 92 -13.895 4.194 -15.783 1.00 43.10 H new ATOM 0 HE1 TYR A 92 -10.385 6.468 -13.207 1.00 14.44 H new ATOM 0 HE2 TYR A 92 -13.590 6.613 -15.994 1.00 72.34 H new ATOM 0 HH TYR A 92 -12.475 8.401 -15.345 1.00 60.33 H new ATOM 1510 N GLU A 93 -14.889 0.125 -13.446 1.00 54.12 N ATOM 1511 CA GLU A 93 -15.373 -1.262 -13.426 1.00 62.34 C ATOM 1512 C GLU A 93 -14.610 -2.160 -14.427 1.00 63.33 C ATOM 1513 O GLU A 93 -14.364 -3.338 -14.152 1.00 4.35 O ATOM 1514 CB GLU A 93 -16.882 -1.234 -13.749 1.00 63.50 C ATOM 1515 CG GLU A 93 -17.570 -2.604 -13.900 1.00 60.13 C ATOM 1516 CD GLU A 93 -18.997 -2.476 -14.445 1.00 44.13 C ATOM 1517 OE1 GLU A 93 -19.968 -2.740 -13.704 1.00 61.31 O ATOM 1518 OE2 GLU A 93 -19.145 -2.084 -15.625 1.00 13.20 O ATOM 0 H GLU A 93 -15.582 0.780 -13.808 1.00 54.12 H new ATOM 0 HA GLU A 93 -15.198 -1.694 -12.441 1.00 62.34 H new ATOM 0 HB2 GLU A 93 -17.391 -0.680 -12.960 1.00 63.50 H new ATOM 0 HB3 GLU A 93 -17.024 -0.675 -14.674 1.00 63.50 H new ATOM 0 HG2 GLU A 93 -16.982 -3.233 -14.569 1.00 60.13 H new ATOM 0 HG3 GLU A 93 -17.596 -3.105 -12.932 1.00 60.13 H new ATOM 1525 N ARG A 94 -14.243 -1.590 -15.589 1.00 45.01 N ATOM 1526 CA ARG A 94 -13.501 -2.305 -16.653 1.00 25.15 C ATOM 1527 C ARG A 94 -12.165 -1.598 -16.903 1.00 14.02 C ATOM 1528 O ARG A 94 -12.011 -0.413 -16.567 1.00 74.12 O ATOM 1529 CB ARG A 94 -14.338 -2.380 -17.960 1.00 62.20 C ATOM 1530 CG ARG A 94 -15.712 -3.070 -17.802 1.00 13.13 C ATOM 1531 CD ARG A 94 -16.519 -3.139 -19.115 1.00 41.15 C ATOM 1532 NE ARG A 94 -15.900 -4.019 -20.124 1.00 21.52 N ATOM 1533 CZ ARG A 94 -16.520 -4.502 -21.220 1.00 43.35 C ATOM 1534 NH1 ARG A 94 -17.797 -4.203 -21.482 1.00 52.44 N ATOM 1535 NH2 ARG A 94 -15.853 -5.293 -22.049 1.00 1.12 N ATOM 0 H ARG A 94 -14.451 -0.619 -15.821 1.00 45.01 H new ATOM 0 HA ARG A 94 -13.310 -3.327 -16.327 1.00 25.15 H new ATOM 0 HB2 ARG A 94 -14.494 -1.369 -18.335 1.00 62.20 H new ATOM 0 HB3 ARG A 94 -13.762 -2.914 -18.715 1.00 62.20 H new ATOM 0 HG2 ARG A 94 -15.561 -4.081 -17.424 1.00 13.13 H new ATOM 0 HG3 ARG A 94 -16.295 -2.534 -17.054 1.00 13.13 H new ATOM 0 HD2 ARG A 94 -17.526 -3.495 -18.898 1.00 41.15 H new ATOM 0 HD3 ARG A 94 -16.618 -2.135 -19.528 1.00 41.15 H new ATOM 0 HE ARG A 94 -14.925 -4.283 -19.981 1.00 21.52 H new ATOM 0 HH11 ARG A 94 -18.320 -3.599 -20.847 1.00 52.44 H new ATOM 0 HH12 ARG A 94 -18.248 -4.578 -22.316 1.00 52.44 H new ATOM 0 HH21 ARG A 94 -14.880 -5.531 -21.855 1.00 1.12 H new ATOM 0 HH22 ARG A 94 -16.313 -5.664 -22.881 1.00 1.12 H new ATOM 1549 N GLU A 95 -11.206 -2.335 -17.492 1.00 1.33 N ATOM 1550 CA GLU A 95 -9.835 -1.843 -17.744 1.00 64.10 C ATOM 1551 C GLU A 95 -9.823 -0.742 -18.828 1.00 41.34 C ATOM 1552 O GLU A 95 -10.820 -0.510 -19.518 1.00 2.40 O ATOM 1553 CB GLU A 95 -8.886 -3.017 -18.138 1.00 32.24 C ATOM 1554 CG GLU A 95 -8.731 -4.101 -17.043 1.00 45.53 C ATOM 1555 CD GLU A 95 -7.867 -5.303 -17.472 1.00 31.41 C ATOM 1556 OE1 GLU A 95 -6.715 -5.439 -16.999 1.00 75.05 O ATOM 1557 OE2 GLU A 95 -8.343 -6.123 -18.284 1.00 62.15 O ATOM 0 H GLU A 95 -11.359 -3.293 -17.809 1.00 1.33 H new ATOM 0 HA GLU A 95 -9.467 -1.402 -16.818 1.00 64.10 H new ATOM 0 HB2 GLU A 95 -9.264 -3.486 -19.047 1.00 32.24 H new ATOM 0 HB3 GLU A 95 -7.902 -2.611 -18.374 1.00 32.24 H new ATOM 0 HG2 GLU A 95 -8.289 -3.647 -16.156 1.00 45.53 H new ATOM 0 HG3 GLU A 95 -9.720 -4.460 -16.758 1.00 45.53 H new ATOM 1564 N ASP A 96 -8.657 -0.093 -18.950 1.00 54.13 N ATOM 1565 CA ASP A 96 -8.407 1.084 -19.813 1.00 60.10 C ATOM 1566 C ASP A 96 -9.395 2.237 -19.543 1.00 25.43 C ATOM 1567 O ASP A 96 -9.678 3.045 -20.437 1.00 3.14 O ATOM 1568 CB ASP A 96 -8.365 0.669 -21.305 1.00 33.44 C ATOM 1569 CG ASP A 96 -7.301 -0.410 -21.569 1.00 53.25 C ATOM 1570 OD1 ASP A 96 -6.100 -0.075 -21.646 1.00 41.42 O ATOM 1571 OD2 ASP A 96 -7.652 -1.599 -21.674 1.00 31.13 O ATOM 0 H ASP A 96 -7.826 -0.380 -18.433 1.00 54.13 H new ATOM 0 HA ASP A 96 -7.425 1.480 -19.555 1.00 60.10 H new ATOM 0 HB2 ASP A 96 -9.344 0.295 -21.606 1.00 33.44 H new ATOM 0 HB3 ASP A 96 -8.155 1.544 -21.920 1.00 33.44 H new ATOM 1576 N HIS A 97 -9.844 2.324 -18.266 1.00 34.22 N ATOM 1577 CA HIS A 97 -10.744 3.384 -17.751 1.00 62.22 C ATOM 1578 C HIS A 97 -12.143 3.302 -18.386 1.00 13.04 C ATOM 1579 O HIS A 97 -12.802 4.328 -18.607 1.00 43.00 O ATOM 1580 CB HIS A 97 -10.112 4.795 -17.918 1.00 60.44 C ATOM 1581 CG HIS A 97 -8.741 4.918 -17.304 1.00 74.53 C ATOM 1582 ND1 HIS A 97 -7.586 4.908 -18.054 1.00 4.35 N ATOM 1583 CD2 HIS A 97 -8.340 5.019 -16.014 1.00 64.00 C ATOM 1584 CE1 HIS A 97 -6.546 5.006 -17.260 1.00 23.44 C ATOM 1585 NE2 HIS A 97 -6.971 5.074 -16.015 1.00 1.21 N ATOM 0 H HIS A 97 -9.584 1.644 -17.551 1.00 34.22 H new ATOM 0 HA HIS A 97 -10.872 3.212 -16.682 1.00 62.22 H new ATOM 0 HB2 HIS A 97 -10.048 5.032 -18.980 1.00 60.44 H new ATOM 0 HB3 HIS A 97 -10.772 5.535 -17.465 1.00 60.44 H new ATOM 0 HD2 HIS A 97 -8.981 5.050 -15.145 1.00 64.00 H new ATOM 0 HE1 HIS A 97 -5.513 5.027 -17.575 1.00 23.44 H new ATOM 0 HE2 HIS A 97 -6.379 5.154 -15.188 1.00 1.21 H new ATOM 1594 N LYS A 98 -12.609 2.069 -18.631 1.00 22.43 N ATOM 1595 CA LYS A 98 -13.924 1.813 -19.245 1.00 52.34 C ATOM 1596 C LYS A 98 -14.905 1.239 -18.206 1.00 30.45 C ATOM 1597 O LYS A 98 -14.583 1.136 -17.011 1.00 55.41 O ATOM 1598 CB LYS A 98 -13.768 0.856 -20.470 1.00 1.32 C ATOM 1599 CG LYS A 98 -12.713 1.303 -21.518 1.00 74.42 C ATOM 1600 CD LYS A 98 -12.918 2.757 -22.012 1.00 60.11 C ATOM 1601 CE LYS A 98 -11.861 3.191 -23.042 1.00 60.24 C ATOM 1602 NZ LYS A 98 -11.996 2.449 -24.322 1.00 23.23 N ATOM 0 H LYS A 98 -12.087 1.221 -18.410 1.00 22.43 H new ATOM 0 HA LYS A 98 -14.337 2.756 -19.602 1.00 52.34 H new ATOM 0 HB2 LYS A 98 -13.500 -0.136 -20.106 1.00 1.32 H new ATOM 0 HB3 LYS A 98 -14.734 0.763 -20.965 1.00 1.32 H new ATOM 0 HG2 LYS A 98 -11.718 1.211 -21.083 1.00 74.42 H new ATOM 0 HG3 LYS A 98 -12.751 0.627 -22.373 1.00 74.42 H new ATOM 0 HD2 LYS A 98 -13.910 2.849 -22.455 1.00 60.11 H new ATOM 0 HD3 LYS A 98 -12.886 3.434 -21.158 1.00 60.11 H new ATOM 0 HE2 LYS A 98 -11.956 4.260 -23.231 1.00 60.24 H new ATOM 0 HE3 LYS A 98 -10.865 3.027 -22.631 1.00 60.24 H new ATOM 0 HZ1 LYS A 98 -11.298 2.806 -25.006 1.00 23.23 H new ATOM 0 HZ2 LYS A 98 -11.830 1.436 -24.155 1.00 23.23 H new ATOM 0 HZ3 LYS A 98 -12.954 2.585 -24.702 1.00 23.23 H new ATOM 1616 N GLY A 99 -16.107 0.871 -18.681 1.00 13.43 N ATOM 1617 CA GLY A 99 -17.171 0.347 -17.828 1.00 31.50 C ATOM 1618 C GLY A 99 -17.878 1.447 -17.066 1.00 63.01 C ATOM 1619 O GLY A 99 -18.126 2.527 -17.618 1.00 5.34 O ATOM 0 H GLY A 99 -16.362 0.931 -19.667 1.00 13.43 H new ATOM 0 HA2 GLY A 99 -17.894 -0.193 -18.440 1.00 31.50 H new ATOM 0 HA3 GLY A 99 -16.751 -0.370 -17.123 1.00 31.50 H new ATOM 1623 N LEU A 100 -18.216 1.166 -15.805 1.00 63.25 N ATOM 1624 CA LEU A 100 -18.852 2.135 -14.902 1.00 12.22 C ATOM 1625 C LEU A 100 -17.753 3.025 -14.268 1.00 22.44 C ATOM 1626 O LEU A 100 -16.759 2.514 -13.740 1.00 61.11 O ATOM 1627 CB LEU A 100 -19.704 1.370 -13.828 1.00 32.44 C ATOM 1628 CG LEU A 100 -20.837 2.180 -13.091 1.00 74.23 C ATOM 1629 CD1 LEU A 100 -21.799 1.239 -12.327 1.00 31.14 C ATOM 1630 CD2 LEU A 100 -20.275 3.258 -12.140 1.00 11.33 C ATOM 0 H LEU A 100 -18.056 0.254 -15.377 1.00 63.25 H new ATOM 0 HA LEU A 100 -19.535 2.787 -15.447 1.00 12.22 H new ATOM 0 HB2 LEU A 100 -20.166 0.511 -14.314 1.00 32.44 H new ATOM 0 HB3 LEU A 100 -19.022 0.980 -13.072 1.00 32.44 H new ATOM 0 HG LEU A 100 -21.398 2.695 -13.871 1.00 74.23 H new ATOM 0 HD11 LEU A 100 -22.568 1.830 -11.830 1.00 31.14 H new ATOM 0 HD12 LEU A 100 -22.268 0.550 -13.029 1.00 31.14 H new ATOM 0 HD13 LEU A 100 -21.239 0.673 -11.583 1.00 31.14 H new ATOM 0 HD21 LEU A 100 -21.099 3.785 -11.659 1.00 11.33 H new ATOM 0 HD22 LEU A 100 -19.654 2.784 -11.379 1.00 11.33 H new ATOM 0 HD23 LEU A 100 -19.674 3.967 -12.709 1.00 11.33 H new ATOM 1642 N MET A 101 -17.962 4.348 -14.333 1.00 61.33 N ATOM 1643 CA MET A 101 -17.045 5.372 -13.792 1.00 73.21 C ATOM 1644 C MET A 101 -17.632 5.948 -12.491 1.00 3.15 C ATOM 1645 O MET A 101 -18.799 6.364 -12.467 1.00 64.03 O ATOM 1646 CB MET A 101 -16.864 6.494 -14.851 1.00 63.44 C ATOM 1647 CG MET A 101 -16.000 7.690 -14.434 1.00 53.22 C ATOM 1648 SD MET A 101 -15.980 8.998 -15.689 1.00 31.41 S ATOM 1649 CE MET A 101 -15.357 8.142 -17.140 1.00 61.21 C ATOM 0 H MET A 101 -18.791 4.749 -14.772 1.00 61.33 H new ATOM 0 HA MET A 101 -16.074 4.930 -13.570 1.00 73.21 H new ATOM 0 HB2 MET A 101 -16.427 6.052 -15.746 1.00 63.44 H new ATOM 0 HB3 MET A 101 -17.851 6.865 -15.128 1.00 63.44 H new ATOM 0 HG2 MET A 101 -16.376 8.097 -13.495 1.00 53.22 H new ATOM 0 HG3 MET A 101 -14.980 7.352 -14.249 1.00 53.22 H new ATOM 0 HE1 MET A 101 -14.414 8.592 -17.451 1.00 61.21 H new ATOM 0 HE2 MET A 101 -15.196 7.091 -16.901 1.00 61.21 H new ATOM 0 HE3 MET A 101 -16.082 8.223 -17.950 1.00 61.21 H new ATOM 1659 N MET A 102 -16.831 5.961 -11.419 1.00 60.45 N ATOM 1660 CA MET A 102 -17.252 6.462 -10.101 1.00 22.44 C ATOM 1661 C MET A 102 -16.105 7.247 -9.461 1.00 34.32 C ATOM 1662 O MET A 102 -14.967 6.798 -9.497 1.00 51.10 O ATOM 1663 CB MET A 102 -17.682 5.275 -9.188 1.00 61.31 C ATOM 1664 CG MET A 102 -18.121 5.689 -7.775 1.00 64.33 C ATOM 1665 SD MET A 102 -19.482 6.884 -7.809 1.00 31.41 S ATOM 1666 CE MET A 102 -19.825 7.123 -6.066 1.00 13.54 C ATOM 0 H MET A 102 -15.869 5.624 -11.439 1.00 60.45 H new ATOM 0 HA MET A 102 -18.108 7.126 -10.223 1.00 22.44 H new ATOM 0 HB2 MET A 102 -18.502 4.741 -9.668 1.00 61.31 H new ATOM 0 HB3 MET A 102 -16.850 4.575 -9.107 1.00 61.31 H new ATOM 0 HG2 MET A 102 -18.429 4.804 -7.218 1.00 64.33 H new ATOM 0 HG3 MET A 102 -17.273 6.121 -7.244 1.00 64.33 H new ATOM 0 HE1 MET A 102 -20.642 7.835 -5.950 1.00 13.54 H new ATOM 0 HE2 MET A 102 -20.108 6.171 -5.617 1.00 13.54 H new ATOM 0 HE3 MET A 102 -18.934 7.508 -5.569 1.00 13.54 H new ATOM 1676 N GLU A 103 -16.403 8.432 -8.900 1.00 34.44 N ATOM 1677 CA GLU A 103 -15.416 9.228 -8.145 1.00 20.11 C ATOM 1678 C GLU A 103 -15.522 8.908 -6.645 1.00 24.42 C ATOM 1679 O GLU A 103 -16.566 8.442 -6.164 1.00 21.43 O ATOM 1680 CB GLU A 103 -15.602 10.755 -8.395 1.00 2.04 C ATOM 1681 CG GLU A 103 -15.300 11.252 -9.832 1.00 5.43 C ATOM 1682 CD GLU A 103 -16.319 10.789 -10.897 1.00 22.33 C ATOM 1683 OE1 GLU A 103 -16.057 9.802 -11.618 1.00 63.45 O ATOM 1684 OE2 GLU A 103 -17.388 11.421 -11.019 1.00 14.23 O ATOM 0 H GLU A 103 -17.326 8.863 -8.955 1.00 34.44 H new ATOM 0 HA GLU A 103 -14.421 8.958 -8.498 1.00 20.11 H new ATOM 0 HB2 GLU A 103 -16.630 11.020 -8.149 1.00 2.04 H new ATOM 0 HB3 GLU A 103 -14.959 11.297 -7.702 1.00 2.04 H new ATOM 0 HG2 GLU A 103 -15.268 12.342 -9.827 1.00 5.43 H new ATOM 0 HG3 GLU A 103 -14.308 10.906 -10.122 1.00 5.43 H new ATOM 1691 N LEU A 104 -14.435 9.176 -5.917 1.00 32.51 N ATOM 1692 CA LEU A 104 -14.320 8.902 -4.478 1.00 64.30 C ATOM 1693 C LEU A 104 -13.256 9.832 -3.888 1.00 1.40 C ATOM 1694 O LEU A 104 -12.158 9.952 -4.441 1.00 1.32 O ATOM 1695 CB LEU A 104 -13.931 7.412 -4.244 1.00 31.22 C ATOM 1696 CG LEU A 104 -13.894 6.914 -2.764 1.00 5.10 C ATOM 1697 CD1 LEU A 104 -15.294 6.905 -2.115 1.00 42.34 C ATOM 1698 CD2 LEU A 104 -13.226 5.528 -2.663 1.00 4.35 C ATOM 0 H LEU A 104 -13.595 9.596 -6.315 1.00 32.51 H new ATOM 0 HA LEU A 104 -15.277 9.082 -3.988 1.00 64.30 H new ATOM 0 HB2 LEU A 104 -14.635 6.787 -4.794 1.00 31.22 H new ATOM 0 HB3 LEU A 104 -12.947 7.246 -4.682 1.00 31.22 H new ATOM 0 HG LEU A 104 -13.289 7.626 -2.203 1.00 5.10 H new ATOM 0 HD11 LEU A 104 -15.216 6.551 -1.087 1.00 42.34 H new ATOM 0 HD12 LEU A 104 -15.704 7.915 -2.121 1.00 42.34 H new ATOM 0 HD13 LEU A 104 -15.952 6.243 -2.678 1.00 42.34 H new ATOM 0 HD21 LEU A 104 -13.213 5.205 -1.622 1.00 4.35 H new ATOM 0 HD22 LEU A 104 -13.788 4.809 -3.259 1.00 4.35 H new ATOM 0 HD23 LEU A 104 -12.204 5.589 -3.036 1.00 4.35 H new ATOM 1710 N SER A 105 -13.590 10.506 -2.789 1.00 22.31 N ATOM 1711 CA SER A 105 -12.638 11.344 -2.033 1.00 4.31 C ATOM 1712 C SER A 105 -12.813 11.085 -0.518 1.00 22.33 C ATOM 1713 O SER A 105 -12.376 11.877 0.318 1.00 25.34 O ATOM 1714 CB SER A 105 -12.844 12.833 -2.410 1.00 1.03 C ATOM 1715 OG SER A 105 -14.195 13.230 -2.244 1.00 2.15 O ATOM 0 H SER A 105 -14.529 10.492 -2.390 1.00 22.31 H new ATOM 0 HA SER A 105 -11.611 11.084 -2.291 1.00 4.31 H new ATOM 0 HB2 SER A 105 -12.201 13.458 -1.790 1.00 1.03 H new ATOM 0 HB3 SER A 105 -12.542 12.992 -3.445 1.00 1.03 H new ATOM 0 HG SER A 105 -14.667 12.564 -1.702 1.00 2.15 H new ATOM 1721 N GLU A 106 -13.427 9.922 -0.194 1.00 2.42 N ATOM 1722 CA GLU A 106 -13.745 9.488 1.183 1.00 50.41 C ATOM 1723 C GLU A 106 -13.007 8.169 1.462 1.00 33.43 C ATOM 1724 O GLU A 106 -12.821 7.372 0.538 1.00 41.21 O ATOM 1725 CB GLU A 106 -15.285 9.247 1.355 1.00 71.14 C ATOM 1726 CG GLU A 106 -16.221 10.450 1.057 1.00 73.32 C ATOM 1727 CD GLU A 106 -16.326 10.851 -0.430 1.00 70.33 C ATOM 1728 OE1 GLU A 106 -16.333 9.960 -1.310 1.00 72.51 O ATOM 1729 OE2 GLU A 106 -16.418 12.057 -0.729 1.00 24.35 O ATOM 0 H GLU A 106 -13.720 9.246 -0.900 1.00 2.42 H new ATOM 0 HA GLU A 106 -13.434 10.268 1.878 1.00 50.41 H new ATOM 0 HB2 GLU A 106 -15.574 8.422 0.704 1.00 71.14 H new ATOM 0 HB3 GLU A 106 -15.465 8.922 2.380 1.00 71.14 H new ATOM 0 HG2 GLU A 106 -17.220 10.212 1.424 1.00 73.32 H new ATOM 0 HG3 GLU A 106 -15.870 11.312 1.625 1.00 73.32 H new ATOM 1736 N ASP A 107 -12.602 7.928 2.727 1.00 2.42 N ATOM 1737 CA ASP A 107 -12.054 6.621 3.145 1.00 74.34 C ATOM 1738 C ASP A 107 -13.163 5.557 3.049 1.00 13.51 C ATOM 1739 O ASP A 107 -14.093 5.549 3.867 1.00 32.13 O ATOM 1740 CB ASP A 107 -11.480 6.657 4.593 1.00 74.20 C ATOM 1741 CG ASP A 107 -10.343 7.668 4.795 1.00 34.21 C ATOM 1742 OD1 ASP A 107 -9.364 7.622 4.042 1.00 22.51 O ATOM 1743 OD2 ASP A 107 -10.427 8.509 5.719 1.00 2.33 O ATOM 0 H ASP A 107 -12.644 8.620 3.475 1.00 2.42 H new ATOM 0 HA ASP A 107 -11.228 6.373 2.478 1.00 74.34 H new ATOM 0 HB2 ASP A 107 -12.288 6.893 5.286 1.00 74.20 H new ATOM 0 HB3 ASP A 107 -11.117 5.663 4.853 1.00 74.20 H new ATOM 1748 N CYS A 108 -13.067 4.677 2.042 1.00 52.54 N ATOM 1749 CA CYS A 108 -14.082 3.640 1.781 1.00 41.31 C ATOM 1750 C CYS A 108 -13.756 2.387 2.623 1.00 73.44 C ATOM 1751 O CYS A 108 -12.781 1.693 2.335 1.00 72.03 O ATOM 1752 CB CYS A 108 -14.115 3.290 0.279 1.00 63.50 C ATOM 1753 SG CYS A 108 -15.327 2.025 -0.178 1.00 11.55 S ATOM 0 H CYS A 108 -12.286 4.662 1.386 1.00 52.54 H new ATOM 0 HA CYS A 108 -15.066 4.015 2.063 1.00 41.31 H new ATOM 0 HB2 CYS A 108 -14.327 4.197 -0.287 1.00 63.50 H new ATOM 0 HB3 CYS A 108 -13.124 2.950 -0.023 1.00 63.50 H new ATOM 0 HG CYS A 108 -15.270 1.812 -1.459 1.00 11.55 H new ATOM 1759 N PRO A 109 -14.569 2.078 3.690 1.00 51.22 N ATOM 1760 CA PRO A 109 -14.254 1.002 4.663 1.00 2.34 C ATOM 1761 C PRO A 109 -14.382 -0.406 4.065 1.00 11.21 C ATOM 1762 O PRO A 109 -13.685 -1.329 4.492 1.00 11.32 O ATOM 1763 CB PRO A 109 -15.287 1.236 5.788 1.00 3.52 C ATOM 1764 CG PRO A 109 -16.456 1.857 5.095 1.00 12.41 C ATOM 1765 CD PRO A 109 -15.861 2.744 4.025 1.00 31.51 C ATOM 0 HA PRO A 109 -13.219 1.046 5.003 1.00 2.34 H new ATOM 0 HB2 PRO A 109 -15.564 0.301 6.274 1.00 3.52 H new ATOM 0 HB3 PRO A 109 -14.890 1.892 6.562 1.00 3.52 H new ATOM 0 HG2 PRO A 109 -17.104 1.097 4.660 1.00 12.41 H new ATOM 0 HG3 PRO A 109 -17.064 2.434 5.791 1.00 12.41 H new ATOM 0 HD2 PRO A 109 -16.513 2.813 3.154 1.00 31.51 H new ATOM 0 HD3 PRO A 109 -15.705 3.760 4.388 1.00 31.51 H new ATOM 1773 N SER A 110 -15.276 -0.534 3.077 1.00 43.13 N ATOM 1774 CA SER A 110 -15.600 -1.794 2.418 1.00 12.34 C ATOM 1775 C SER A 110 -16.242 -1.478 1.062 1.00 21.55 C ATOM 1776 O SER A 110 -17.418 -1.106 1.012 1.00 30.45 O ATOM 1777 CB SER A 110 -16.575 -2.628 3.288 1.00 20.15 C ATOM 1778 OG SER A 110 -16.062 -2.885 4.586 1.00 40.24 O ATOM 0 H SER A 110 -15.804 0.257 2.709 1.00 43.13 H new ATOM 0 HA SER A 110 -14.692 -2.380 2.276 1.00 12.34 H new ATOM 0 HB2 SER A 110 -17.524 -2.098 3.374 1.00 20.15 H new ATOM 0 HB3 SER A 110 -16.783 -3.575 2.789 1.00 20.15 H new ATOM 0 HG SER A 110 -16.712 -3.412 5.096 1.00 40.24 H new ATOM 1784 N ILE A 111 -15.460 -1.596 -0.028 1.00 72.43 N ATOM 1785 CA ILE A 111 -15.927 -1.310 -1.407 1.00 51.50 C ATOM 1786 C ILE A 111 -17.105 -2.233 -1.781 1.00 32.54 C ATOM 1787 O ILE A 111 -18.070 -1.800 -2.414 1.00 63.20 O ATOM 1788 CB ILE A 111 -14.773 -1.485 -2.469 1.00 60.30 C ATOM 1789 CG1 ILE A 111 -13.481 -0.732 -2.026 1.00 22.52 C ATOM 1790 CG2 ILE A 111 -15.226 -1.004 -3.873 1.00 34.23 C ATOM 1791 CD1 ILE A 111 -12.271 -0.998 -2.905 1.00 51.33 C ATOM 0 H ILE A 111 -14.485 -1.892 0.018 1.00 72.43 H new ATOM 0 HA ILE A 111 -16.253 -0.270 -1.423 1.00 51.50 H new ATOM 0 HB ILE A 111 -14.544 -2.549 -2.530 1.00 60.30 H new ATOM 0 HG12 ILE A 111 -13.683 0.339 -2.020 1.00 22.52 H new ATOM 0 HG13 ILE A 111 -13.241 -1.017 -1.002 1.00 22.52 H new ATOM 0 HG21 ILE A 111 -14.410 -1.137 -4.584 1.00 34.23 H new ATOM 0 HG22 ILE A 111 -16.088 -1.587 -4.197 1.00 34.23 H new ATOM 0 HG23 ILE A 111 -15.498 0.050 -3.826 1.00 34.23 H new ATOM 0 HD11 ILE A 111 -11.416 -0.436 -2.527 1.00 51.33 H new ATOM 0 HD12 ILE A 111 -12.039 -2.063 -2.893 1.00 51.33 H new ATOM 0 HD13 ILE A 111 -12.488 -0.686 -3.927 1.00 51.33 H new ATOM 1803 N GLN A 112 -17.016 -3.498 -1.340 1.00 34.04 N ATOM 1804 CA GLN A 112 -18.051 -4.517 -1.585 1.00 13.53 C ATOM 1805 C GLN A 112 -19.371 -4.190 -0.835 1.00 43.22 C ATOM 1806 O GLN A 112 -20.461 -4.537 -1.304 1.00 70.22 O ATOM 1807 CB GLN A 112 -17.502 -5.922 -1.205 1.00 22.32 C ATOM 1808 CG GLN A 112 -18.464 -7.107 -1.480 1.00 63.34 C ATOM 1809 CD GLN A 112 -18.918 -7.252 -2.943 1.00 14.22 C ATOM 1810 OE1 GLN A 112 -18.065 -6.902 -3.889 1.00 12.12 O flip ATOM 1811 NE2 GLN A 112 -20.034 -7.694 -3.217 1.00 40.21 N flip ATOM 0 H GLN A 112 -16.222 -3.845 -0.802 1.00 34.04 H new ATOM 0 HA GLN A 112 -18.295 -4.516 -2.647 1.00 13.53 H new ATOM 0 HB2 GLN A 112 -16.576 -6.093 -1.754 1.00 22.32 H new ATOM 0 HB3 GLN A 112 -17.248 -5.920 -0.145 1.00 22.32 H new ATOM 0 HG2 GLN A 112 -17.974 -8.031 -1.174 1.00 63.34 H new ATOM 0 HG3 GLN A 112 -19.347 -6.992 -0.851 1.00 63.34 H new ATOM 0 HE21 GLN A 112 -20.676 -7.958 -2.469 1.00 40.21 H new ATOM 0 HE22 GLN A 112 -20.317 -7.796 -4.192 1.00 40.21 H new ATOM 1820 N ASP A 113 -19.266 -3.496 0.309 1.00 22.04 N ATOM 1821 CA ASP A 113 -20.447 -3.022 1.070 1.00 21.34 C ATOM 1822 C ASP A 113 -20.911 -1.639 0.587 1.00 12.24 C ATOM 1823 O ASP A 113 -22.046 -1.236 0.878 1.00 43.52 O ATOM 1824 CB ASP A 113 -20.150 -2.989 2.596 1.00 74.12 C ATOM 1825 CG ASP A 113 -20.027 -4.396 3.207 1.00 31.30 C ATOM 1826 OD1 ASP A 113 -21.060 -4.976 3.602 1.00 43.15 O ATOM 1827 OD2 ASP A 113 -18.902 -4.933 3.278 1.00 41.05 O ATOM 0 H ASP A 113 -18.373 -3.246 0.734 1.00 22.04 H new ATOM 0 HA ASP A 113 -21.255 -3.731 0.889 1.00 21.34 H new ATOM 0 HB2 ASP A 113 -19.225 -2.439 2.770 1.00 74.12 H new ATOM 0 HB3 ASP A 113 -20.945 -2.444 3.105 1.00 74.12 H new ATOM 1832 N ARG A 114 -20.040 -0.901 -0.135 1.00 74.42 N ATOM 1833 CA ARG A 114 -20.371 0.441 -0.646 1.00 42.22 C ATOM 1834 C ARG A 114 -20.898 0.353 -2.080 1.00 31.14 C ATOM 1835 O ARG A 114 -22.108 0.430 -2.302 1.00 0.22 O ATOM 1836 CB ARG A 114 -19.162 1.420 -0.523 1.00 20.42 C ATOM 1837 CG ARG A 114 -18.726 1.765 0.930 1.00 2.54 C ATOM 1838 CD ARG A 114 -19.854 2.352 1.821 1.00 3.00 C ATOM 1839 NE ARG A 114 -20.819 1.320 2.275 1.00 63.04 N ATOM 1840 CZ ARG A 114 -20.965 0.882 3.537 1.00 74.21 C ATOM 1841 NH1 ARG A 114 -20.236 1.385 4.535 1.00 33.54 N ATOM 1842 NH2 ARG A 114 -21.822 -0.100 3.786 1.00 72.34 N ATOM 0 H ARG A 114 -19.100 -1.216 -0.376 1.00 74.42 H new ATOM 0 HA ARG A 114 -21.166 0.855 -0.025 1.00 42.22 H new ATOM 0 HB2 ARG A 114 -18.310 0.985 -1.046 1.00 20.42 H new ATOM 0 HB3 ARG A 114 -19.413 2.347 -1.038 1.00 20.42 H new ATOM 0 HG2 ARG A 114 -18.340 0.862 1.403 1.00 2.54 H new ATOM 0 HG3 ARG A 114 -17.904 2.480 0.889 1.00 2.54 H new ATOM 0 HD2 ARG A 114 -19.410 2.836 2.691 1.00 3.00 H new ATOM 0 HD3 ARG A 114 -20.387 3.123 1.265 1.00 3.00 H new ATOM 0 HE ARG A 114 -21.425 0.907 1.566 1.00 63.04 H new ATOM 0 HH11 ARG A 114 -19.551 2.117 4.348 1.00 33.54 H new ATOM 0 HH12 ARG A 114 -20.364 1.037 5.485 1.00 33.54 H new ATOM 0 HH21 ARG A 114 -22.360 -0.513 3.024 1.00 72.34 H new ATOM 0 HH22 ARG A 114 -21.943 -0.442 4.739 1.00 72.34 H new ATOM 1856 N PHE A 115 -19.995 0.148 -3.045 1.00 34.22 N ATOM 1857 CA PHE A 115 -20.352 0.145 -4.479 1.00 31.03 C ATOM 1858 C PHE A 115 -20.440 -1.303 -5.024 1.00 20.45 C ATOM 1859 O PHE A 115 -20.647 -1.506 -6.220 1.00 21.43 O ATOM 1860 CB PHE A 115 -19.330 1.017 -5.278 1.00 10.22 C ATOM 1861 CG PHE A 115 -19.946 1.700 -6.506 1.00 2.34 C ATOM 1862 CD1 PHE A 115 -20.649 2.902 -6.369 1.00 70.53 C ATOM 1863 CD2 PHE A 115 -19.843 1.143 -7.778 1.00 54.24 C ATOM 1864 CE1 PHE A 115 -21.221 3.519 -7.465 1.00 54.42 C ATOM 1865 CE2 PHE A 115 -20.412 1.758 -8.870 1.00 44.41 C ATOM 1866 CZ PHE A 115 -21.101 2.949 -8.715 1.00 0.02 C ATOM 0 H PHE A 115 -19.005 -0.019 -2.864 1.00 34.22 H new ATOM 0 HA PHE A 115 -21.341 0.586 -4.606 1.00 31.03 H new ATOM 0 HB2 PHE A 115 -18.917 1.778 -4.616 1.00 10.22 H new ATOM 0 HB3 PHE A 115 -18.499 0.389 -5.599 1.00 10.22 H new ATOM 0 HD1 PHE A 115 -20.746 3.354 -5.393 1.00 70.53 H new ATOM 0 HD2 PHE A 115 -19.308 0.214 -7.910 1.00 54.24 H new ATOM 0 HE1 PHE A 115 -21.761 4.446 -7.343 1.00 54.42 H new ATOM 0 HE2 PHE A 115 -20.321 1.311 -9.849 1.00 44.41 H new ATOM 0 HZ PHE A 115 -21.545 3.432 -9.573 1.00 0.02 H new ATOM 1876 N HIS A 116 -20.278 -2.296 -4.116 1.00 65.22 N ATOM 1877 CA HIS A 116 -20.384 -3.747 -4.419 1.00 43.41 C ATOM 1878 C HIS A 116 -19.296 -4.239 -5.396 1.00 74.11 C ATOM 1879 O HIS A 116 -19.411 -5.335 -5.949 1.00 22.35 O ATOM 1880 CB HIS A 116 -21.823 -4.144 -4.896 1.00 1.44 C ATOM 1881 CG HIS A 116 -22.878 -4.089 -3.816 1.00 42.10 C ATOM 1882 ND1 HIS A 116 -23.516 -5.211 -3.325 1.00 5.44 N ATOM 1883 CD2 HIS A 116 -23.418 -3.039 -3.142 1.00 55.32 C ATOM 1884 CE1 HIS A 116 -24.388 -4.861 -2.405 1.00 42.45 C ATOM 1885 NE2 HIS A 116 -24.355 -3.552 -2.276 1.00 75.42 N ATOM 0 H HIS A 116 -20.066 -2.109 -3.136 1.00 65.22 H new ATOM 0 HA HIS A 116 -20.202 -4.266 -3.478 1.00 43.41 H new ATOM 0 HB2 HIS A 116 -22.118 -3.481 -5.709 1.00 1.44 H new ATOM 0 HB3 HIS A 116 -21.791 -5.154 -5.304 1.00 1.44 H new ATOM 0 HD2 HIS A 116 -23.160 -1.997 -3.264 1.00 55.32 H new ATOM 0 HE1 HIS A 116 -25.024 -5.534 -1.849 1.00 42.45 H new ATOM 0 HE2 HIS A 116 -24.932 -3.006 -1.636 1.00 75.42 H new ATOM 1894 N LEU A 117 -18.207 -3.463 -5.560 1.00 2.45 N ATOM 1895 CA LEU A 117 -17.080 -3.854 -6.424 1.00 14.42 C ATOM 1896 C LEU A 117 -16.129 -4.778 -5.635 1.00 52.33 C ATOM 1897 O LEU A 117 -15.488 -4.348 -4.669 1.00 35.43 O ATOM 1898 CB LEU A 117 -16.331 -2.598 -6.964 1.00 40.13 C ATOM 1899 CG LEU A 117 -17.173 -1.616 -7.851 1.00 22.14 C ATOM 1900 CD1 LEU A 117 -16.378 -0.333 -8.200 1.00 22.53 C ATOM 1901 CD2 LEU A 117 -17.681 -2.321 -9.129 1.00 33.42 C ATOM 0 H LEU A 117 -18.086 -2.559 -5.103 1.00 2.45 H new ATOM 0 HA LEU A 117 -17.462 -4.397 -7.289 1.00 14.42 H new ATOM 0 HB2 LEU A 117 -15.940 -2.041 -6.113 1.00 40.13 H new ATOM 0 HB3 LEU A 117 -15.473 -2.935 -7.546 1.00 40.13 H new ATOM 0 HG LEU A 117 -18.040 -1.310 -7.266 1.00 22.14 H new ATOM 0 HD11 LEU A 117 -16.995 0.322 -8.815 1.00 22.53 H new ATOM 0 HD12 LEU A 117 -16.103 0.186 -7.282 1.00 22.53 H new ATOM 0 HD13 LEU A 117 -15.476 -0.602 -8.749 1.00 22.53 H new ATOM 0 HD21 LEU A 117 -18.262 -1.618 -9.726 1.00 33.42 H new ATOM 0 HD22 LEU A 117 -16.831 -2.676 -9.711 1.00 33.42 H new ATOM 0 HD23 LEU A 117 -18.309 -3.167 -8.852 1.00 33.42 H new ATOM 1913 N SER A 118 -16.106 -6.065 -6.026 1.00 70.52 N ATOM 1914 CA SER A 118 -15.217 -7.087 -5.435 1.00 54.42 C ATOM 1915 C SER A 118 -13.799 -6.980 -6.013 1.00 50.51 C ATOM 1916 O SER A 118 -12.843 -7.461 -5.403 1.00 52.23 O ATOM 1917 CB SER A 118 -15.818 -8.490 -5.691 1.00 51.54 C ATOM 1918 OG SER A 118 -16.130 -8.667 -7.067 1.00 51.14 O ATOM 0 H SER A 118 -16.707 -6.429 -6.765 1.00 70.52 H new ATOM 0 HA SER A 118 -15.142 -6.921 -4.360 1.00 54.42 H new ATOM 0 HB2 SER A 118 -15.111 -9.256 -5.373 1.00 51.54 H new ATOM 0 HB3 SER A 118 -16.719 -8.619 -5.091 1.00 51.54 H new ATOM 0 HG SER A 118 -16.507 -9.561 -7.205 1.00 51.14 H new ATOM 1924 N GLU A 119 -13.691 -6.364 -7.206 1.00 45.54 N ATOM 1925 CA GLU A 119 -12.417 -6.115 -7.901 1.00 33.00 C ATOM 1926 C GLU A 119 -12.454 -4.739 -8.584 1.00 74.54 C ATOM 1927 O GLU A 119 -13.505 -4.314 -9.090 1.00 2.10 O ATOM 1928 CB GLU A 119 -12.141 -7.211 -8.973 1.00 44.22 C ATOM 1929 CG GLU A 119 -11.854 -8.622 -8.420 1.00 55.01 C ATOM 1930 CD GLU A 119 -11.754 -9.687 -9.521 1.00 35.22 C ATOM 1931 OE1 GLU A 119 -10.696 -9.792 -10.170 1.00 40.42 O ATOM 1932 OE2 GLU A 119 -12.747 -10.417 -9.754 1.00 60.11 O ATOM 0 H GLU A 119 -14.502 -6.020 -7.721 1.00 45.54 H new ATOM 0 HA GLU A 119 -11.618 -6.141 -7.160 1.00 33.00 H new ATOM 0 HB2 GLU A 119 -13.002 -7.269 -9.639 1.00 44.22 H new ATOM 0 HB3 GLU A 119 -11.291 -6.897 -9.578 1.00 44.22 H new ATOM 0 HG2 GLU A 119 -10.922 -8.602 -7.855 1.00 55.01 H new ATOM 0 HG3 GLU A 119 -12.644 -8.901 -7.723 1.00 55.01 H new ATOM 1939 N ILE A 120 -11.299 -4.047 -8.585 1.00 74.20 N ATOM 1940 CA ILE A 120 -11.081 -2.831 -9.383 1.00 61.14 C ATOM 1941 C ILE A 120 -10.185 -3.184 -10.571 1.00 35.14 C ATOM 1942 O ILE A 120 -9.107 -3.759 -10.385 1.00 4.14 O ATOM 1943 CB ILE A 120 -10.420 -1.671 -8.549 1.00 53.34 C ATOM 1944 CG1 ILE A 120 -11.345 -1.201 -7.379 1.00 53.13 C ATOM 1945 CG2 ILE A 120 -10.042 -0.482 -9.459 1.00 51.54 C ATOM 1946 CD1 ILE A 120 -12.720 -0.711 -7.800 1.00 15.23 C ATOM 0 H ILE A 120 -10.489 -4.319 -8.029 1.00 74.20 H new ATOM 0 HA ILE A 120 -12.053 -2.468 -9.718 1.00 61.14 H new ATOM 0 HB ILE A 120 -9.506 -2.069 -8.107 1.00 53.34 H new ATOM 0 HG12 ILE A 120 -11.470 -2.028 -6.681 1.00 53.13 H new ATOM 0 HG13 ILE A 120 -10.841 -0.400 -6.838 1.00 53.13 H new ATOM 0 HG21 ILE A 120 -9.587 0.306 -8.858 1.00 51.54 H new ATOM 0 HG22 ILE A 120 -9.333 -0.815 -10.217 1.00 51.54 H new ATOM 0 HG23 ILE A 120 -10.938 -0.096 -9.945 1.00 51.54 H new ATOM 0 HD11 ILE A 120 -13.284 -0.408 -6.918 1.00 15.23 H new ATOM 0 HD12 ILE A 120 -12.613 0.140 -8.472 1.00 15.23 H new ATOM 0 HD13 ILE A 120 -13.251 -1.513 -8.312 1.00 15.23 H new ATOM 1958 N ARG A 121 -10.623 -2.811 -11.781 1.00 1.11 N ATOM 1959 CA ARG A 121 -9.921 -3.151 -13.027 1.00 22.11 C ATOM 1960 C ARG A 121 -9.015 -2.008 -13.516 1.00 72.54 C ATOM 1961 O ARG A 121 -8.005 -2.272 -14.163 1.00 61.31 O ATOM 1962 CB ARG A 121 -10.947 -3.582 -14.103 1.00 74.54 C ATOM 1963 CG ARG A 121 -11.502 -5.010 -13.888 1.00 51.52 C ATOM 1964 CD ARG A 121 -10.385 -6.075 -13.906 1.00 24.34 C ATOM 1965 NE ARG A 121 -10.876 -7.428 -13.610 1.00 71.32 N ATOM 1966 CZ ARG A 121 -10.098 -8.527 -13.567 1.00 71.32 C ATOM 1967 NH1 ARG A 121 -8.786 -8.454 -13.800 1.00 11.10 N ATOM 1968 NH2 ARG A 121 -10.642 -9.693 -13.275 1.00 24.10 N ATOM 0 H ARG A 121 -11.473 -2.266 -11.924 1.00 1.11 H new ATOM 0 HA ARG A 121 -9.256 -3.991 -12.827 1.00 22.11 H new ATOM 0 HB2 ARG A 121 -11.777 -2.875 -14.107 1.00 74.54 H new ATOM 0 HB3 ARG A 121 -10.477 -3.527 -15.085 1.00 74.54 H new ATOM 0 HG2 ARG A 121 -12.029 -5.054 -12.935 1.00 51.52 H new ATOM 0 HG3 ARG A 121 -12.231 -5.236 -14.666 1.00 51.52 H new ATOM 0 HD2 ARG A 121 -9.906 -6.075 -14.885 1.00 24.34 H new ATOM 0 HD3 ARG A 121 -9.621 -5.804 -13.177 1.00 24.34 H new ATOM 0 HE ARG A 121 -11.872 -7.543 -13.425 1.00 71.32 H new ATOM 0 HH11 ARG A 121 -8.356 -7.555 -14.015 1.00 11.10 H new ATOM 0 HH12 ARG A 121 -8.214 -9.298 -13.763 1.00 11.10 H new ATOM 0 HH21 ARG A 121 -11.642 -9.756 -13.085 1.00 24.10 H new ATOM 0 HH22 ARG A 121 -10.062 -10.532 -13.240 1.00 24.10 H new ATOM 1982 N SER A 122 -9.385 -0.753 -13.206 1.00 54.00 N ATOM 1983 CA SER A 122 -8.547 0.430 -13.493 1.00 52.34 C ATOM 1984 C SER A 122 -8.952 1.615 -12.594 1.00 30.25 C ATOM 1985 O SER A 122 -10.068 1.652 -12.061 1.00 35.32 O ATOM 1986 CB SER A 122 -8.617 0.811 -14.994 1.00 3.42 C ATOM 1987 OG SER A 122 -9.938 1.054 -15.428 1.00 43.24 O ATOM 0 H SER A 122 -10.270 -0.528 -12.751 1.00 54.00 H new ATOM 0 HA SER A 122 -7.511 0.177 -13.267 1.00 52.34 H new ATOM 0 HB2 SER A 122 -8.011 1.700 -15.169 1.00 3.42 H new ATOM 0 HB3 SER A 122 -8.184 0.008 -15.590 1.00 3.42 H new ATOM 0 HG SER A 122 -10.346 0.212 -15.720 1.00 43.24 H new ATOM 1993 N LEU A 123 -8.023 2.577 -12.419 1.00 22.02 N ATOM 1994 CA LEU A 123 -8.204 3.763 -11.554 1.00 72.55 C ATOM 1995 C LEU A 123 -7.681 5.019 -12.255 1.00 54.11 C ATOM 1996 O LEU A 123 -6.844 4.941 -13.154 1.00 40.13 O ATOM 1997 CB LEU A 123 -7.439 3.573 -10.210 1.00 12.02 C ATOM 1998 CG LEU A 123 -8.007 2.501 -9.238 1.00 41.22 C ATOM 1999 CD1 LEU A 123 -7.029 2.198 -8.094 1.00 75.22 C ATOM 2000 CD2 LEU A 123 -9.388 2.921 -8.693 1.00 71.11 C ATOM 0 H LEU A 123 -7.114 2.552 -12.880 1.00 22.02 H new ATOM 0 HA LEU A 123 -9.269 3.878 -11.353 1.00 72.55 H new ATOM 0 HB2 LEU A 123 -6.405 3.314 -10.439 1.00 12.02 H new ATOM 0 HB3 LEU A 123 -7.420 4.530 -9.689 1.00 12.02 H new ATOM 0 HG LEU A 123 -8.136 1.581 -9.808 1.00 41.22 H new ATOM 0 HD11 LEU A 123 -7.461 1.444 -7.436 1.00 75.22 H new ATOM 0 HD12 LEU A 123 -6.091 1.825 -8.506 1.00 75.22 H new ATOM 0 HD13 LEU A 123 -6.839 3.109 -7.527 1.00 75.22 H new ATOM 0 HD21 LEU A 123 -9.761 2.153 -8.016 1.00 71.11 H new ATOM 0 HD22 LEU A 123 -9.295 3.865 -8.155 1.00 71.11 H new ATOM 0 HD23 LEU A 123 -10.085 3.043 -9.522 1.00 71.11 H new ATOM 2012 N HIS A 124 -8.175 6.185 -11.831 1.00 0.50 N ATOM 2013 CA HIS A 124 -7.597 7.477 -12.195 1.00 31.32 C ATOM 2014 C HIS A 124 -7.460 8.294 -10.916 1.00 13.03 C ATOM 2015 O HIS A 124 -8.404 8.981 -10.504 1.00 32.13 O ATOM 2016 CB HIS A 124 -8.450 8.221 -13.259 1.00 63.05 C ATOM 2017 CG HIS A 124 -7.842 9.519 -13.725 1.00 72.41 C ATOM 2018 ND1 HIS A 124 -7.093 9.800 -14.810 1.00 33.31 N flip ATOM 2019 CD2 HIS A 124 -7.924 10.696 -13.013 1.00 72.41 C flip ATOM 2020 CE1 HIS A 124 -6.746 11.119 -14.742 1.00 51.12 C flip ATOM 2021 NE2 HIS A 124 -7.255 11.636 -13.648 1.00 33.53 N flip ATOM 0 H HIS A 124 -8.991 6.258 -11.223 1.00 0.50 H new ATOM 0 HA HIS A 124 -6.621 7.327 -12.656 1.00 31.32 H new ATOM 0 HB2 HIS A 124 -8.592 7.567 -14.120 1.00 63.05 H new ATOM 0 HB3 HIS A 124 -9.438 8.421 -12.844 1.00 63.05 H new ATOM 0 HD2 HIS A 124 -8.454 10.827 -12.081 1.00 72.41 H new ATOM 0 HE1 HIS A 124 -6.150 11.650 -15.469 1.00 51.12 H new ATOM 0 HE2 HIS A 124 -7.150 12.603 -13.341 1.00 33.53 H new ATOM 2030 N VAL A 125 -6.309 8.154 -10.254 1.00 10.34 N ATOM 2031 CA VAL A 125 -5.974 8.952 -9.075 1.00 42.43 C ATOM 2032 C VAL A 125 -5.471 10.316 -9.582 1.00 54.01 C ATOM 2033 O VAL A 125 -4.441 10.374 -10.253 1.00 21.32 O ATOM 2034 CB VAL A 125 -4.877 8.254 -8.175 1.00 53.02 C ATOM 2035 CG1 VAL A 125 -4.748 8.952 -6.798 1.00 15.24 C ATOM 2036 CG2 VAL A 125 -5.148 6.736 -8.025 1.00 51.44 C ATOM 0 H VAL A 125 -5.586 7.486 -10.520 1.00 10.34 H new ATOM 0 HA VAL A 125 -6.856 9.065 -8.444 1.00 42.43 H new ATOM 0 HB VAL A 125 -3.919 8.361 -8.683 1.00 53.02 H new ATOM 0 HG11 VAL A 125 -3.986 8.447 -6.204 1.00 15.24 H new ATOM 0 HG12 VAL A 125 -4.464 9.994 -6.944 1.00 15.24 H new ATOM 0 HG13 VAL A 125 -5.704 8.906 -6.276 1.00 15.24 H new ATOM 0 HG21 VAL A 125 -4.375 6.288 -7.401 1.00 51.44 H new ATOM 0 HG22 VAL A 125 -6.122 6.585 -7.561 1.00 51.44 H new ATOM 0 HG23 VAL A 125 -5.138 6.266 -9.008 1.00 51.44 H new ATOM 2046 N LEU A 126 -6.236 11.387 -9.320 1.00 12.22 N ATOM 2047 CA LEU A 126 -5.883 12.744 -9.788 1.00 12.43 C ATOM 2048 C LEU A 126 -4.739 13.298 -8.943 1.00 73.45 C ATOM 2049 O LEU A 126 -3.755 13.840 -9.464 1.00 14.11 O ATOM 2050 CB LEU A 126 -7.096 13.723 -9.720 1.00 13.10 C ATOM 2051 CG LEU A 126 -8.349 13.372 -10.598 1.00 23.33 C ATOM 2052 CD1 LEU A 126 -9.210 12.262 -9.961 1.00 22.23 C ATOM 2053 CD2 LEU A 126 -9.185 14.633 -10.900 1.00 34.12 C ATOM 0 H LEU A 126 -7.104 11.343 -8.787 1.00 12.22 H new ATOM 0 HA LEU A 126 -5.578 12.661 -10.831 1.00 12.43 H new ATOM 0 HB2 LEU A 126 -7.419 13.790 -8.681 1.00 13.10 H new ATOM 0 HB3 LEU A 126 -6.747 14.714 -10.009 1.00 13.10 H new ATOM 0 HG LEU A 126 -7.981 12.980 -11.546 1.00 23.33 H new ATOM 0 HD11 LEU A 126 -10.066 12.052 -10.603 1.00 22.23 H new ATOM 0 HD12 LEU A 126 -8.612 11.358 -9.846 1.00 22.23 H new ATOM 0 HD13 LEU A 126 -9.562 12.591 -8.983 1.00 22.23 H new ATOM 0 HD21 LEU A 126 -10.047 14.361 -11.510 1.00 34.12 H new ATOM 0 HD22 LEU A 126 -9.528 15.075 -9.964 1.00 34.12 H new ATOM 0 HD23 LEU A 126 -8.572 15.355 -11.440 1.00 34.12 H new ATOM 2065 N GLU A 127 -4.887 13.121 -7.630 1.00 4.20 N ATOM 2066 CA GLU A 127 -3.994 13.711 -6.638 1.00 55.33 C ATOM 2067 C GLU A 127 -4.153 12.935 -5.325 1.00 21.11 C ATOM 2068 O GLU A 127 -5.255 12.466 -5.009 1.00 71.32 O ATOM 2069 CB GLU A 127 -4.344 15.221 -6.441 1.00 5.52 C ATOM 2070 CG GLU A 127 -3.155 16.172 -6.174 1.00 34.41 C ATOM 2071 CD GLU A 127 -2.272 15.771 -4.982 1.00 4.32 C ATOM 2072 OE1 GLU A 127 -1.214 15.133 -5.194 1.00 73.21 O ATOM 2073 OE2 GLU A 127 -2.631 16.078 -3.827 1.00 23.10 O ATOM 0 H GLU A 127 -5.636 12.560 -7.224 1.00 4.20 H new ATOM 0 HA GLU A 127 -2.958 13.649 -6.972 1.00 55.33 H new ATOM 0 HB2 GLU A 127 -4.867 15.570 -7.331 1.00 5.52 H new ATOM 0 HB3 GLU A 127 -5.042 15.304 -5.608 1.00 5.52 H new ATOM 0 HG2 GLU A 127 -2.535 16.218 -7.069 1.00 34.41 H new ATOM 0 HG3 GLU A 127 -3.541 17.177 -6.002 1.00 34.41 H new ATOM 2080 N GLY A 128 -3.044 12.804 -4.588 1.00 32.22 N ATOM 2081 CA GLY A 128 -3.043 12.179 -3.278 1.00 51.31 C ATOM 2082 C GLY A 128 -3.072 10.672 -3.356 1.00 0.22 C ATOM 2083 O GLY A 128 -4.037 10.108 -3.860 1.00 4.32 O ATOM 0 H GLY A 128 -2.127 13.131 -4.891 1.00 32.22 H new ATOM 0 HA2 GLY A 128 -2.155 12.494 -2.729 1.00 51.31 H new ATOM 0 HA3 GLY A 128 -3.907 12.527 -2.712 1.00 51.31 H new ATOM 2087 N CYS A 129 -2.016 10.022 -2.851 1.00 41.54 N ATOM 2088 CA CYS A 129 -1.920 8.564 -2.848 1.00 2.31 C ATOM 2089 C CYS A 129 -2.977 7.952 -1.912 1.00 54.50 C ATOM 2090 O CYS A 129 -3.228 8.460 -0.807 1.00 73.02 O ATOM 2091 CB CYS A 129 -0.504 8.124 -2.428 1.00 23.33 C ATOM 2092 SG CYS A 129 0.825 8.906 -3.374 1.00 11.12 S ATOM 0 H CYS A 129 -1.211 10.492 -2.436 1.00 41.54 H new ATOM 0 HA CYS A 129 -2.111 8.202 -3.858 1.00 2.31 H new ATOM 0 HB2 CYS A 129 -0.364 8.350 -1.371 1.00 23.33 H new ATOM 0 HB3 CYS A 129 -0.424 7.042 -2.536 1.00 23.33 H new ATOM 0 HG CYS A 129 1.974 8.474 -2.946 1.00 11.12 H new ATOM 2098 N TRP A 130 -3.641 6.909 -2.408 1.00 64.53 N ATOM 2099 CA TRP A 130 -4.550 6.065 -1.632 1.00 51.20 C ATOM 2100 C TRP A 130 -3.881 4.712 -1.367 1.00 54.15 C ATOM 2101 O TRP A 130 -2.760 4.452 -1.827 1.00 40.32 O ATOM 2102 CB TRP A 130 -5.881 5.846 -2.401 1.00 72.15 C ATOM 2103 CG TRP A 130 -6.716 7.087 -2.597 1.00 3.34 C ATOM 2104 CD1 TRP A 130 -6.365 8.229 -3.259 1.00 34.12 C ATOM 2105 CD2 TRP A 130 -8.063 7.284 -2.163 1.00 65.21 C ATOM 2106 NE1 TRP A 130 -7.395 9.128 -3.233 1.00 74.44 N ATOM 2107 CE2 TRP A 130 -8.454 8.570 -2.572 1.00 10.05 C ATOM 2108 CE3 TRP A 130 -8.972 6.494 -1.454 1.00 63.11 C ATOM 2109 CZ2 TRP A 130 -9.714 9.081 -2.308 1.00 63.00 C ATOM 2110 CZ3 TRP A 130 -10.223 7.001 -1.194 1.00 45.13 C ATOM 2111 CH2 TRP A 130 -10.586 8.285 -1.620 1.00 1.43 C ATOM 0 H TRP A 130 -3.560 6.620 -3.383 1.00 64.53 H new ATOM 0 HA TRP A 130 -4.772 6.561 -0.687 1.00 51.20 H new ATOM 0 HB2 TRP A 130 -5.653 5.422 -3.379 1.00 72.15 H new ATOM 0 HB3 TRP A 130 -6.476 5.107 -1.864 1.00 72.15 H new ATOM 0 HD1 TRP A 130 -5.410 8.398 -3.735 1.00 34.12 H new ATOM 0 HE1 TRP A 130 -7.376 10.063 -3.640 1.00 74.44 H new ATOM 0 HE3 TRP A 130 -8.697 5.505 -1.117 1.00 63.11 H new ATOM 0 HZ2 TRP A 130 -9.997 10.071 -2.634 1.00 63.00 H new ATOM 0 HZ3 TRP A 130 -10.938 6.399 -0.652 1.00 45.13 H new ATOM 0 HH2 TRP A 130 -11.577 8.654 -1.400 1.00 1.43 H new ATOM 2122 N VAL A 131 -4.577 3.857 -0.618 1.00 73.14 N ATOM 2123 CA VAL A 131 -4.170 2.480 -0.352 1.00 20.30 C ATOM 2124 C VAL A 131 -5.378 1.581 -0.582 1.00 55.33 C ATOM 2125 O VAL A 131 -6.410 1.747 0.074 1.00 44.24 O ATOM 2126 CB VAL A 131 -3.636 2.260 1.118 1.00 60.53 C ATOM 2127 CG1 VAL A 131 -3.228 0.785 1.355 1.00 40.41 C ATOM 2128 CG2 VAL A 131 -2.476 3.215 1.450 1.00 62.13 C ATOM 0 H VAL A 131 -5.458 4.109 -0.170 1.00 73.14 H new ATOM 0 HA VAL A 131 -3.346 2.240 -1.024 1.00 20.30 H new ATOM 0 HB VAL A 131 -4.456 2.493 1.797 1.00 60.53 H new ATOM 0 HG11 VAL A 131 -2.865 0.667 2.376 1.00 40.41 H new ATOM 0 HG12 VAL A 131 -4.092 0.139 1.201 1.00 40.41 H new ATOM 0 HG13 VAL A 131 -2.439 0.509 0.655 1.00 40.41 H new ATOM 0 HG21 VAL A 131 -2.136 3.033 2.469 1.00 62.13 H new ATOM 0 HG22 VAL A 131 -1.653 3.043 0.757 1.00 62.13 H new ATOM 0 HG23 VAL A 131 -2.817 4.246 1.359 1.00 62.13 H new ATOM 2138 N LEU A 132 -5.262 0.673 -1.549 1.00 53.15 N ATOM 2139 CA LEU A 132 -6.200 -0.432 -1.718 1.00 63.25 C ATOM 2140 C LEU A 132 -5.824 -1.516 -0.691 1.00 34.22 C ATOM 2141 O LEU A 132 -4.649 -1.702 -0.380 1.00 61.34 O ATOM 2142 CB LEU A 132 -6.131 -0.934 -3.201 1.00 52.13 C ATOM 2143 CG LEU A 132 -7.306 -1.838 -3.733 1.00 63.01 C ATOM 2144 CD1 LEU A 132 -7.388 -1.808 -5.283 1.00 72.24 C ATOM 2145 CD2 LEU A 132 -7.180 -3.288 -3.237 1.00 22.12 C ATOM 0 H LEU A 132 -4.511 0.684 -2.239 1.00 53.15 H new ATOM 0 HA LEU A 132 -7.233 -0.136 -1.537 1.00 63.25 H new ATOM 0 HB2 LEU A 132 -6.065 -0.058 -3.847 1.00 52.13 H new ATOM 0 HB3 LEU A 132 -5.201 -1.490 -3.322 1.00 52.13 H new ATOM 0 HG LEU A 132 -8.229 -1.421 -3.330 1.00 63.01 H new ATOM 0 HD11 LEU A 132 -8.209 -2.442 -5.616 1.00 72.24 H new ATOM 0 HD12 LEU A 132 -7.560 -0.785 -5.619 1.00 72.24 H new ATOM 0 HD13 LEU A 132 -6.452 -2.175 -5.704 1.00 72.24 H new ATOM 0 HD21 LEU A 132 -8.009 -3.879 -3.626 1.00 22.12 H new ATOM 0 HD22 LEU A 132 -6.238 -3.711 -3.586 1.00 22.12 H new ATOM 0 HD23 LEU A 132 -7.203 -3.303 -2.147 1.00 22.12 H new ATOM 2157 N TYR A 133 -6.829 -2.209 -0.169 1.00 44.14 N ATOM 2158 CA TYR A 133 -6.660 -3.305 0.795 1.00 1.12 C ATOM 2159 C TYR A 133 -7.437 -4.507 0.265 1.00 73.24 C ATOM 2160 O TYR A 133 -8.554 -4.339 -0.244 1.00 34.24 O ATOM 2161 CB TYR A 133 -7.197 -2.913 2.191 1.00 35.22 C ATOM 2162 CG TYR A 133 -6.569 -1.663 2.833 1.00 3.03 C ATOM 2163 CD1 TYR A 133 -5.467 -1.759 3.685 1.00 41.11 C ATOM 2164 CD2 TYR A 133 -7.116 -0.393 2.622 1.00 72.01 C ATOM 2165 CE1 TYR A 133 -4.937 -0.639 4.301 1.00 14.42 C ATOM 2166 CE2 TYR A 133 -6.581 0.724 3.228 1.00 64.33 C ATOM 2167 CZ TYR A 133 -5.499 0.599 4.069 1.00 64.03 C ATOM 2168 OH TYR A 133 -4.972 1.717 4.682 1.00 65.44 O ATOM 0 H TYR A 133 -7.805 -2.027 -0.404 1.00 44.14 H new ATOM 0 HA TYR A 133 -5.600 -3.536 0.905 1.00 1.12 H new ATOM 0 HB2 TYR A 133 -8.273 -2.754 2.112 1.00 35.22 H new ATOM 0 HB3 TYR A 133 -7.048 -3.756 2.865 1.00 35.22 H new ATOM 0 HD1 TYR A 133 -5.020 -2.725 3.867 1.00 41.11 H new ATOM 0 HD2 TYR A 133 -7.973 -0.285 1.973 1.00 72.01 H new ATOM 0 HE1 TYR A 133 -4.087 -0.734 4.961 1.00 14.42 H new ATOM 0 HE2 TYR A 133 -7.011 1.697 3.043 1.00 64.33 H new ATOM 0 HH TYR A 133 -4.012 1.588 4.829 1.00 65.44 H new ATOM 2178 N GLU A 134 -6.837 -5.693 0.375 1.00 32.52 N ATOM 2179 CA GLU A 134 -7.417 -6.953 -0.113 1.00 21.54 C ATOM 2180 C GLU A 134 -8.742 -7.270 0.606 1.00 72.55 C ATOM 2181 O GLU A 134 -9.750 -7.585 -0.031 1.00 71.55 O ATOM 2182 CB GLU A 134 -6.398 -8.089 0.104 1.00 12.20 C ATOM 2183 CG GLU A 134 -6.892 -9.500 -0.285 1.00 3.12 C ATOM 2184 CD GLU A 134 -5.927 -10.625 0.111 1.00 51.22 C ATOM 2185 OE1 GLU A 134 -5.163 -10.466 1.093 1.00 2.41 O ATOM 2186 OE2 GLU A 134 -5.932 -11.684 -0.547 1.00 31.13 O ATOM 0 H GLU A 134 -5.922 -5.811 0.811 1.00 32.52 H new ATOM 0 HA GLU A 134 -7.638 -6.856 -1.176 1.00 21.54 H new ATOM 0 HB2 GLU A 134 -5.500 -7.865 -0.472 1.00 12.20 H new ATOM 0 HB3 GLU A 134 -6.109 -8.100 1.155 1.00 12.20 H new ATOM 0 HG2 GLU A 134 -7.858 -9.680 0.187 1.00 3.12 H new ATOM 0 HG3 GLU A 134 -7.053 -9.534 -1.363 1.00 3.12 H new ATOM 2193 N LEU A 135 -8.706 -7.204 1.946 1.00 3.20 N ATOM 2194 CA LEU A 135 -9.890 -7.400 2.804 1.00 62.05 C ATOM 2195 C LEU A 135 -10.544 -6.035 3.113 1.00 10.00 C ATOM 2196 O LEU A 135 -9.879 -4.993 3.055 1.00 73.41 O ATOM 2197 CB LEU A 135 -9.520 -8.121 4.148 1.00 14.22 C ATOM 2198 CG LEU A 135 -9.281 -9.669 4.091 1.00 24.42 C ATOM 2199 CD1 LEU A 135 -8.103 -10.057 3.180 1.00 14.20 C ATOM 2200 CD2 LEU A 135 -9.102 -10.255 5.513 1.00 31.42 C ATOM 0 H LEU A 135 -7.852 -7.012 2.469 1.00 3.20 H new ATOM 0 HA LEU A 135 -10.591 -8.035 2.263 1.00 62.05 H new ATOM 0 HB2 LEU A 135 -8.618 -7.655 4.544 1.00 14.22 H new ATOM 0 HB3 LEU A 135 -10.319 -7.929 4.865 1.00 14.22 H new ATOM 0 HG LEU A 135 -10.175 -10.107 3.646 1.00 24.42 H new ATOM 0 HD11 LEU A 135 -7.985 -11.141 3.180 1.00 14.20 H new ATOM 0 HD12 LEU A 135 -8.300 -9.713 2.165 1.00 14.20 H new ATOM 0 HD13 LEU A 135 -7.189 -9.593 3.550 1.00 14.20 H new ATOM 0 HD21 LEU A 135 -8.938 -11.330 5.445 1.00 31.42 H new ATOM 0 HD22 LEU A 135 -8.244 -9.786 5.994 1.00 31.42 H new ATOM 0 HD23 LEU A 135 -9.999 -10.061 6.102 1.00 31.42 H new ATOM 2212 N PRO A 136 -11.882 -6.018 3.416 1.00 11.32 N ATOM 2213 CA PRO A 136 -12.553 -4.855 4.058 1.00 23.23 C ATOM 2214 C PRO A 136 -11.932 -4.461 5.427 1.00 25.15 C ATOM 2215 O PRO A 136 -10.974 -5.091 5.905 1.00 23.22 O ATOM 2216 CB PRO A 136 -14.017 -5.354 4.225 1.00 65.04 C ATOM 2217 CG PRO A 136 -14.192 -6.386 3.154 1.00 2.04 C ATOM 2218 CD PRO A 136 -12.862 -7.093 3.086 1.00 61.03 C ATOM 0 HA PRO A 136 -12.456 -3.947 3.462 1.00 23.23 H new ATOM 0 HB2 PRO A 136 -14.180 -5.780 5.215 1.00 65.04 H new ATOM 0 HB3 PRO A 136 -14.729 -4.537 4.108 1.00 65.04 H new ATOM 0 HG2 PRO A 136 -14.997 -7.079 3.399 1.00 2.04 H new ATOM 0 HG3 PRO A 136 -14.446 -5.927 2.199 1.00 2.04 H new ATOM 0 HD2 PRO A 136 -12.808 -7.918 3.797 1.00 61.03 H new ATOM 0 HD3 PRO A 136 -12.680 -7.513 2.097 1.00 61.03 H new ATOM 2226 N ASN A 137 -12.500 -3.399 6.035 1.00 34.44 N ATOM 2227 CA ASN A 137 -12.063 -2.832 7.338 1.00 44.33 C ATOM 2228 C ASN A 137 -10.566 -2.410 7.315 1.00 42.33 C ATOM 2229 O ASN A 137 -9.906 -2.356 8.363 1.00 34.50 O ATOM 2230 CB ASN A 137 -12.364 -3.832 8.503 1.00 15.50 C ATOM 2231 CG ASN A 137 -12.385 -3.172 9.893 1.00 11.45 C ATOM 2232 OD1 ASN A 137 -12.752 -2.005 10.038 1.00 15.34 O ATOM 2233 ND2 ASN A 137 -11.987 -3.899 10.922 1.00 32.44 N ATOM 0 H ASN A 137 -13.291 -2.898 5.630 1.00 34.44 H new ATOM 0 HA ASN A 137 -12.640 -1.924 7.516 1.00 44.33 H new ATOM 0 HB2 ASN A 137 -13.328 -4.308 8.322 1.00 15.50 H new ATOM 0 HB3 ASN A 137 -11.612 -4.621 8.496 1.00 15.50 H new ATOM 0 HD21 ASN A 137 -11.980 -3.496 11.859 1.00 32.44 H new ATOM 0 HD22 ASN A 137 -11.687 -4.863 10.779 1.00 32.44 H new ATOM 2240 N TYR A 138 -10.064 -2.091 6.098 1.00 25.33 N ATOM 2241 CA TYR A 138 -8.684 -1.624 5.859 1.00 11.41 C ATOM 2242 C TYR A 138 -7.648 -2.709 6.241 1.00 3.22 C ATOM 2243 O TYR A 138 -6.600 -2.411 6.826 1.00 21.23 O ATOM 2244 CB TYR A 138 -8.414 -0.268 6.589 1.00 13.12 C ATOM 2245 CG TYR A 138 -9.488 0.806 6.335 1.00 44.13 C ATOM 2246 CD1 TYR A 138 -9.665 1.364 5.069 1.00 42.03 C ATOM 2247 CD2 TYR A 138 -10.332 1.250 7.361 1.00 72.12 C ATOM 2248 CE1 TYR A 138 -10.631 2.321 4.840 1.00 53.32 C ATOM 2249 CE2 TYR A 138 -11.298 2.206 7.130 1.00 21.34 C ATOM 2250 CZ TYR A 138 -11.439 2.737 5.870 1.00 3.35 C ATOM 2251 OH TYR A 138 -12.402 3.692 5.644 1.00 51.12 O ATOM 0 H TYR A 138 -10.618 -2.153 5.244 1.00 25.33 H new ATOM 0 HA TYR A 138 -8.571 -1.441 4.790 1.00 11.41 H new ATOM 0 HB2 TYR A 138 -8.346 -0.452 7.661 1.00 13.12 H new ATOM 0 HB3 TYR A 138 -7.446 0.118 6.269 1.00 13.12 H new ATOM 0 HD1 TYR A 138 -9.034 1.041 4.254 1.00 42.03 H new ATOM 0 HD2 TYR A 138 -10.224 0.835 8.352 1.00 72.12 H new ATOM 0 HE1 TYR A 138 -10.752 2.743 3.853 1.00 53.32 H new ATOM 0 HE2 TYR A 138 -11.940 2.536 7.934 1.00 21.34 H new ATOM 0 HH TYR A 138 -12.886 3.872 6.477 1.00 51.12 H new ATOM 2261 N ARG A 139 -7.930 -3.975 5.862 1.00 51.14 N ATOM 2262 CA ARG A 139 -7.095 -5.143 6.243 1.00 25.54 C ATOM 2263 C ARG A 139 -6.654 -5.955 5.007 1.00 32.34 C ATOM 2264 O ARG A 139 -7.059 -5.664 3.880 1.00 25.22 O ATOM 2265 CB ARG A 139 -7.874 -6.039 7.253 1.00 32.15 C ATOM 2266 CG ARG A 139 -8.177 -5.351 8.603 1.00 15.11 C ATOM 2267 CD ARG A 139 -8.929 -6.250 9.599 1.00 11.13 C ATOM 2268 NE ARG A 139 -8.150 -7.443 9.996 1.00 31.10 N ATOM 2269 CZ ARG A 139 -8.206 -8.045 11.206 1.00 4.31 C ATOM 2270 NH1 ARG A 139 -9.002 -7.582 12.170 1.00 33.03 N ATOM 2271 NH2 ARG A 139 -7.462 -9.117 11.438 1.00 42.13 N ATOM 0 H ARG A 139 -8.737 -4.218 5.287 1.00 51.14 H new ATOM 0 HA ARG A 139 -6.188 -4.775 6.722 1.00 25.54 H new ATOM 0 HB2 ARG A 139 -8.814 -6.350 6.797 1.00 32.15 H new ATOM 0 HB3 ARG A 139 -7.296 -6.944 7.440 1.00 32.15 H new ATOM 0 HG2 ARG A 139 -7.239 -5.028 9.055 1.00 15.11 H new ATOM 0 HG3 ARG A 139 -8.768 -4.454 8.419 1.00 15.11 H new ATOM 0 HD2 ARG A 139 -9.177 -5.671 10.489 1.00 11.13 H new ATOM 0 HD3 ARG A 139 -9.871 -6.569 9.154 1.00 11.13 H new ATOM 0 HE ARG A 139 -7.520 -7.844 9.301 1.00 31.10 H new ATOM 0 HH11 ARG A 139 -9.582 -6.760 12.001 1.00 33.03 H new ATOM 0 HH12 ARG A 139 -9.031 -8.049 13.076 1.00 33.03 H new ATOM 0 HH21 ARG A 139 -6.852 -9.483 10.707 1.00 42.13 H new ATOM 0 HH22 ARG A 139 -7.499 -9.576 12.348 1.00 42.13 H new ATOM 2285 N GLY A 140 -5.813 -6.978 5.241 1.00 73.13 N ATOM 2286 CA GLY A 140 -5.307 -7.851 4.176 1.00 61.41 C ATOM 2287 C GLY A 140 -4.020 -7.333 3.553 1.00 22.22 C ATOM 2288 O GLY A 140 -3.249 -6.638 4.217 1.00 41.24 O ATOM 0 H GLY A 140 -5.468 -7.219 6.170 1.00 73.13 H new ATOM 0 HA2 GLY A 140 -5.134 -8.848 4.581 1.00 61.41 H new ATOM 0 HA3 GLY A 140 -6.067 -7.949 3.401 1.00 61.41 H new ATOM 2292 N ARG A 141 -3.776 -7.700 2.284 1.00 1.40 N ATOM 2293 CA ARG A 141 -2.637 -7.184 1.506 1.00 45.24 C ATOM 2294 C ARG A 141 -2.939 -5.771 0.985 1.00 12.13 C ATOM 2295 O ARG A 141 -3.996 -5.534 0.398 1.00 52.22 O ATOM 2296 CB ARG A 141 -2.318 -8.129 0.324 1.00 75.13 C ATOM 2297 CG ARG A 141 -1.846 -9.525 0.758 1.00 13.44 C ATOM 2298 CD ARG A 141 -1.606 -10.474 -0.425 1.00 44.12 C ATOM 2299 NE ARG A 141 -2.856 -10.788 -1.120 1.00 34.43 N ATOM 2300 CZ ARG A 141 -3.083 -10.662 -2.430 1.00 34.25 C ATOM 2301 NH1 ARG A 141 -2.136 -10.225 -3.264 1.00 51.21 N ATOM 2302 NH2 ARG A 141 -4.282 -10.955 -2.887 1.00 24.41 N ATOM 0 H ARG A 141 -4.360 -8.360 1.770 1.00 1.40 H new ATOM 0 HA ARG A 141 -1.767 -7.137 2.161 1.00 45.24 H new ATOM 0 HB2 ARG A 141 -3.208 -8.233 -0.297 1.00 75.13 H new ATOM 0 HB3 ARG A 141 -1.548 -7.672 -0.297 1.00 75.13 H new ATOM 0 HG2 ARG A 141 -0.924 -9.428 1.331 1.00 13.44 H new ATOM 0 HG3 ARG A 141 -2.590 -9.963 1.423 1.00 13.44 H new ATOM 0 HD2 ARG A 141 -0.905 -10.017 -1.123 1.00 44.12 H new ATOM 0 HD3 ARG A 141 -1.146 -11.395 -0.067 1.00 44.12 H new ATOM 0 HE ARG A 141 -3.627 -11.136 -0.549 1.00 34.43 H new ATOM 0 HH11 ARG A 141 -1.214 -9.979 -2.904 1.00 51.21 H new ATOM 0 HH12 ARG A 141 -2.335 -10.138 -4.261 1.00 51.21 H new ATOM 0 HH21 ARG A 141 -5.010 -11.269 -2.245 1.00 24.41 H new ATOM 0 HH22 ARG A 141 -4.483 -10.868 -3.883 1.00 24.41 H new ATOM 2316 N GLN A 142 -1.987 -4.859 1.184 1.00 63.50 N ATOM 2317 CA GLN A 142 -2.113 -3.454 0.768 1.00 72.23 C ATOM 2318 C GLN A 142 -1.608 -3.287 -0.676 1.00 11.13 C ATOM 2319 O GLN A 142 -0.883 -4.146 -1.198 1.00 3.53 O ATOM 2320 CB GLN A 142 -1.328 -2.512 1.734 1.00 20.13 C ATOM 2321 CG GLN A 142 -1.877 -2.437 3.182 1.00 72.05 C ATOM 2322 CD GLN A 142 -1.698 -3.716 4.014 1.00 14.15 C ATOM 2323 OE1 GLN A 142 -0.736 -4.464 3.839 1.00 5.21 O ATOM 2324 NE2 GLN A 142 -2.631 -3.979 4.917 1.00 23.11 N ATOM 0 H GLN A 142 -1.100 -5.071 1.641 1.00 63.50 H new ATOM 0 HA GLN A 142 -3.166 -3.175 0.810 1.00 72.23 H new ATOM 0 HB2 GLN A 142 -0.290 -2.843 1.774 1.00 20.13 H new ATOM 0 HB3 GLN A 142 -1.326 -1.507 1.312 1.00 20.13 H new ATOM 0 HG2 GLN A 142 -1.384 -1.614 3.699 1.00 72.05 H new ATOM 0 HG3 GLN A 142 -2.939 -2.196 3.139 1.00 72.05 H new ATOM 0 HE21 GLN A 142 -3.417 -3.340 5.039 1.00 23.11 H new ATOM 0 HE22 GLN A 142 -2.564 -4.820 5.490 1.00 23.11 H new ATOM 2333 N TYR A 143 -2.033 -2.183 -1.307 1.00 12.23 N ATOM 2334 CA TYR A 143 -1.645 -1.784 -2.669 1.00 31.12 C ATOM 2335 C TYR A 143 -1.609 -0.247 -2.715 1.00 45.21 C ATOM 2336 O TYR A 143 -2.529 0.400 -2.219 1.00 70.51 O ATOM 2337 CB TYR A 143 -2.650 -2.330 -3.724 1.00 5.33 C ATOM 2338 CG TYR A 143 -2.598 -3.851 -3.976 1.00 73.40 C ATOM 2339 CD1 TYR A 143 -1.506 -4.430 -4.627 1.00 44.24 C ATOM 2340 CD2 TYR A 143 -3.653 -4.700 -3.606 1.00 3.23 C ATOM 2341 CE1 TYR A 143 -1.465 -5.783 -4.903 1.00 0.23 C ATOM 2342 CE2 TYR A 143 -3.608 -6.059 -3.873 1.00 12.23 C ATOM 2343 CZ TYR A 143 -2.518 -6.593 -4.528 1.00 60.12 C ATOM 2344 OH TYR A 143 -2.487 -7.940 -4.830 1.00 22.11 O ATOM 0 H TYR A 143 -2.676 -1.522 -0.871 1.00 12.23 H new ATOM 0 HA TYR A 143 -0.667 -2.200 -2.909 1.00 31.12 H new ATOM 0 HB2 TYR A 143 -3.659 -2.068 -3.407 1.00 5.33 H new ATOM 0 HB3 TYR A 143 -2.470 -1.818 -4.669 1.00 5.33 H new ATOM 0 HD1 TYR A 143 -0.675 -3.806 -4.921 1.00 44.24 H new ATOM 0 HD2 TYR A 143 -4.515 -4.286 -3.104 1.00 3.23 H new ATOM 0 HE1 TYR A 143 -0.611 -6.206 -5.411 1.00 0.23 H new ATOM 0 HE2 TYR A 143 -4.424 -6.698 -3.569 1.00 12.23 H new ATOM 0 HH TYR A 143 -1.557 -8.249 -4.850 1.00 22.11 H new ATOM 2354 N LEU A 144 -0.546 0.332 -3.286 1.00 61.42 N ATOM 2355 CA LEU A 144 -0.332 1.787 -3.310 1.00 13.53 C ATOM 2356 C LEU A 144 -0.952 2.377 -4.581 1.00 53.22 C ATOM 2357 O LEU A 144 -0.715 1.877 -5.685 1.00 70.52 O ATOM 2358 CB LEU A 144 1.192 2.109 -3.190 1.00 72.24 C ATOM 2359 CG LEU A 144 1.600 3.600 -2.872 1.00 53.34 C ATOM 2360 CD1 LEU A 144 1.688 4.477 -4.138 1.00 32.34 C ATOM 2361 CD2 LEU A 144 0.642 4.237 -1.822 1.00 42.35 C ATOM 0 H LEU A 144 0.194 -0.197 -3.747 1.00 61.42 H new ATOM 0 HA LEU A 144 -0.826 2.249 -2.455 1.00 13.53 H new ATOM 0 HB2 LEU A 144 1.610 1.473 -2.410 1.00 72.24 H new ATOM 0 HB3 LEU A 144 1.671 1.822 -4.126 1.00 72.24 H new ATOM 0 HG LEU A 144 2.602 3.560 -2.445 1.00 53.34 H new ATOM 0 HD11 LEU A 144 1.972 5.492 -3.859 1.00 32.34 H new ATOM 0 HD12 LEU A 144 2.436 4.064 -4.815 1.00 32.34 H new ATOM 0 HD13 LEU A 144 0.718 4.496 -4.636 1.00 32.34 H new ATOM 0 HD21 LEU A 144 0.950 5.264 -1.625 1.00 42.35 H new ATOM 0 HD22 LEU A 144 -0.377 4.232 -2.209 1.00 42.35 H new ATOM 0 HD23 LEU A 144 0.682 3.662 -0.897 1.00 42.35 H new ATOM 2373 N LEU A 145 -1.742 3.451 -4.405 1.00 14.15 N ATOM 2374 CA LEU A 145 -2.507 4.086 -5.484 1.00 32.04 C ATOM 2375 C LEU A 145 -2.080 5.558 -5.627 1.00 2.44 C ATOM 2376 O LEU A 145 -2.757 6.473 -5.152 1.00 65.03 O ATOM 2377 CB LEU A 145 -4.030 3.952 -5.198 1.00 3.21 C ATOM 2378 CG LEU A 145 -4.544 2.520 -4.837 1.00 30.15 C ATOM 2379 CD1 LEU A 145 -6.058 2.548 -4.544 1.00 22.12 C ATOM 2380 CD2 LEU A 145 -4.190 1.481 -5.934 1.00 31.31 C ATOM 0 H LEU A 145 -1.866 3.904 -3.500 1.00 14.15 H new ATOM 0 HA LEU A 145 -2.301 3.585 -6.430 1.00 32.04 H new ATOM 0 HB2 LEU A 145 -4.284 4.624 -4.378 1.00 3.21 H new ATOM 0 HB3 LEU A 145 -4.575 4.300 -6.076 1.00 3.21 H new ATOM 0 HG LEU A 145 -4.029 2.200 -3.931 1.00 30.15 H new ATOM 0 HD11 LEU A 145 -6.399 1.543 -4.295 1.00 22.12 H new ATOM 0 HD12 LEU A 145 -6.254 3.216 -3.706 1.00 22.12 H new ATOM 0 HD13 LEU A 145 -6.592 2.904 -5.425 1.00 22.12 H new ATOM 0 HD21 LEU A 145 -4.566 0.501 -5.642 1.00 31.31 H new ATOM 0 HD22 LEU A 145 -4.647 1.778 -6.878 1.00 31.31 H new ATOM 0 HD23 LEU A 145 -3.108 1.433 -6.054 1.00 31.31 H new ATOM 2392 N ARG A 146 -0.936 5.758 -6.291 1.00 22.21 N ATOM 2393 CA ARG A 146 -0.299 7.080 -6.448 1.00 74.45 C ATOM 2394 C ARG A 146 -1.002 7.918 -7.551 1.00 52.01 C ATOM 2395 O ARG A 146 -1.620 7.341 -8.450 1.00 74.32 O ATOM 2396 CB ARG A 146 1.215 6.881 -6.754 1.00 63.32 C ATOM 2397 CG ARG A 146 1.526 6.032 -8.008 1.00 62.12 C ATOM 2398 CD ARG A 146 2.973 5.509 -8.036 1.00 41.15 C ATOM 2399 NE ARG A 146 3.954 6.602 -7.962 1.00 32.31 N ATOM 2400 CZ ARG A 146 5.123 6.565 -7.303 1.00 22.14 C ATOM 2401 NH1 ARG A 146 5.504 5.479 -6.628 1.00 3.31 N ATOM 2402 NH2 ARG A 146 5.915 7.627 -7.336 1.00 22.43 N ATOM 0 H ARG A 146 -0.418 5.003 -6.740 1.00 22.21 H new ATOM 0 HA ARG A 146 -0.401 7.642 -5.519 1.00 74.45 H new ATOM 0 HB2 ARG A 146 1.677 7.861 -6.874 1.00 63.32 H new ATOM 0 HB3 ARG A 146 1.685 6.411 -5.890 1.00 63.32 H new ATOM 0 HG2 ARG A 146 0.839 5.187 -8.047 1.00 62.12 H new ATOM 0 HG3 ARG A 146 1.345 6.632 -8.900 1.00 62.12 H new ATOM 0 HD2 ARG A 146 3.128 4.825 -7.201 1.00 41.15 H new ATOM 0 HD3 ARG A 146 3.135 4.938 -8.950 1.00 41.15 H new ATOM 0 HE ARG A 146 3.726 7.465 -8.455 1.00 32.31 H new ATOM 0 HH11 ARG A 146 4.903 4.655 -6.606 1.00 3.31 H new ATOM 0 HH12 ARG A 146 6.396 5.472 -6.134 1.00 3.31 H new ATOM 0 HH21 ARG A 146 5.633 8.457 -7.857 1.00 22.43 H new ATOM 0 HH22 ARG A 146 6.806 7.614 -6.840 1.00 22.43 H new ATOM 2416 N PRO A 147 -0.949 9.300 -7.461 1.00 11.20 N ATOM 2417 CA PRO A 147 -1.574 10.220 -8.454 1.00 11.51 C ATOM 2418 C PRO A 147 -1.116 9.963 -9.913 1.00 35.23 C ATOM 2419 O PRO A 147 -0.086 10.485 -10.368 1.00 63.42 O ATOM 2420 CB PRO A 147 -1.168 11.638 -7.952 1.00 54.03 C ATOM 2421 CG PRO A 147 -0.038 11.409 -6.992 1.00 60.15 C ATOM 2422 CD PRO A 147 -0.317 10.075 -6.358 1.00 3.32 C ATOM 0 HA PRO A 147 -2.654 10.079 -8.506 1.00 11.51 H new ATOM 0 HB2 PRO A 147 -0.857 12.275 -8.780 1.00 54.03 H new ATOM 0 HB3 PRO A 147 -2.005 12.137 -7.463 1.00 54.03 H new ATOM 0 HG2 PRO A 147 0.922 11.405 -7.509 1.00 60.15 H new ATOM 0 HG3 PRO A 147 0.007 12.199 -6.242 1.00 60.15 H new ATOM 0 HD2 PRO A 147 0.597 9.599 -6.003 1.00 3.32 H new ATOM 0 HD3 PRO A 147 -0.982 10.168 -5.499 1.00 3.32 H new ATOM 2430 N GLN A 148 -1.888 9.106 -10.606 1.00 0.02 N ATOM 2431 CA GLN A 148 -1.699 8.758 -12.024 1.00 64.00 C ATOM 2432 C GLN A 148 -2.919 7.972 -12.533 1.00 52.22 C ATOM 2433 O GLN A 148 -3.735 7.468 -11.734 1.00 23.15 O ATOM 2434 CB GLN A 148 -0.407 7.917 -12.245 1.00 33.05 C ATOM 2435 CG GLN A 148 -0.371 6.565 -11.507 1.00 22.04 C ATOM 2436 CD GLN A 148 0.824 5.700 -11.913 1.00 0.22 C ATOM 2437 OE1 GLN A 148 1.905 5.799 -11.335 1.00 42.04 O ATOM 2438 NE2 GLN A 148 0.632 4.836 -12.909 1.00 43.53 N ATOM 0 H GLN A 148 -2.681 8.624 -10.183 1.00 0.02 H new ATOM 0 HA GLN A 148 -1.594 9.688 -12.583 1.00 64.00 H new ATOM 0 HB2 GLN A 148 -0.290 7.733 -13.313 1.00 33.05 H new ATOM 0 HB3 GLN A 148 0.452 8.509 -11.928 1.00 33.05 H new ATOM 0 HG2 GLN A 148 -0.336 6.744 -10.432 1.00 22.04 H new ATOM 0 HG3 GLN A 148 -1.293 6.021 -11.710 1.00 22.04 H new ATOM 0 HE21 GLN A 148 -0.278 4.780 -13.367 1.00 43.53 H new ATOM 0 HE22 GLN A 148 1.395 4.231 -13.213 1.00 43.53 H new ATOM 2447 N GLU A 149 -3.036 7.864 -13.863 1.00 24.32 N ATOM 2448 CA GLU A 149 -4.085 7.065 -14.498 1.00 53.30 C ATOM 2449 C GLU A 149 -3.639 5.595 -14.632 1.00 5.10 C ATOM 2450 O GLU A 149 -2.894 5.224 -15.547 1.00 10.53 O ATOM 2451 CB GLU A 149 -4.510 7.660 -15.875 1.00 5.25 C ATOM 2452 CG GLU A 149 -3.375 7.901 -16.906 1.00 0.32 C ATOM 2453 CD GLU A 149 -3.859 7.757 -18.360 1.00 13.04 C ATOM 2454 OE1 GLU A 149 -3.965 6.603 -18.839 1.00 53.42 O ATOM 2455 OE2 GLU A 149 -4.161 8.775 -19.014 1.00 55.13 O ATOM 0 H GLU A 149 -2.410 8.326 -14.523 1.00 24.32 H new ATOM 0 HA GLU A 149 -4.965 7.096 -13.855 1.00 53.30 H new ATOM 0 HB2 GLU A 149 -5.243 6.990 -16.325 1.00 5.25 H new ATOM 0 HB3 GLU A 149 -5.015 8.609 -15.695 1.00 5.25 H new ATOM 0 HG2 GLU A 149 -2.963 8.900 -16.761 1.00 0.32 H new ATOM 0 HG3 GLU A 149 -2.567 7.193 -16.724 1.00 0.32 H new ATOM 2462 N TYR A 150 -4.068 4.767 -13.672 1.00 43.44 N ATOM 2463 CA TYR A 150 -3.893 3.312 -13.750 1.00 4.32 C ATOM 2464 C TYR A 150 -4.794 2.747 -14.849 1.00 51.12 C ATOM 2465 O TYR A 150 -6.019 2.731 -14.705 1.00 23.25 O ATOM 2466 CB TYR A 150 -4.232 2.646 -12.399 1.00 24.11 C ATOM 2467 CG TYR A 150 -3.253 2.957 -11.264 1.00 21.31 C ATOM 2468 CD1 TYR A 150 -3.693 3.340 -9.996 1.00 64.15 C ATOM 2469 CD2 TYR A 150 -1.883 2.805 -11.446 1.00 50.31 C ATOM 2470 CE1 TYR A 150 -2.804 3.546 -8.968 1.00 2.13 C ATOM 2471 CE2 TYR A 150 -0.992 3.024 -10.426 1.00 44.22 C ATOM 2472 CZ TYR A 150 -1.456 3.387 -9.188 1.00 22.41 C ATOM 2473 OH TYR A 150 -0.566 3.567 -8.159 1.00 4.30 O ATOM 0 H TYR A 150 -4.542 5.083 -12.826 1.00 43.44 H new ATOM 0 HA TYR A 150 -2.851 3.098 -13.985 1.00 4.32 H new ATOM 0 HB2 TYR A 150 -5.230 2.962 -12.095 1.00 24.11 H new ATOM 0 HB3 TYR A 150 -4.269 1.566 -12.542 1.00 24.11 H new ATOM 0 HD1 TYR A 150 -4.750 3.477 -9.820 1.00 64.15 H new ATOM 0 HD2 TYR A 150 -1.511 2.507 -12.415 1.00 50.31 H new ATOM 0 HE1 TYR A 150 -3.163 3.832 -7.990 1.00 2.13 H new ATOM 0 HE2 TYR A 150 0.068 2.911 -10.597 1.00 44.22 H new ATOM 0 HH TYR A 150 -0.660 2.836 -7.513 1.00 4.30 H new ATOM 2483 N ARG A 151 -4.184 2.338 -15.967 1.00 21.21 N ATOM 2484 CA ARG A 151 -4.917 1.785 -17.119 1.00 31.31 C ATOM 2485 C ARG A 151 -5.492 0.406 -16.790 1.00 5.41 C ATOM 2486 O ARG A 151 -6.479 0.005 -17.361 1.00 31.11 O ATOM 2487 CB ARG A 151 -4.010 1.694 -18.362 1.00 62.33 C ATOM 2488 CG ARG A 151 -3.307 3.014 -18.742 1.00 25.04 C ATOM 2489 CD ARG A 151 -2.560 2.905 -20.081 1.00 32.53 C ATOM 2490 NE ARG A 151 -1.676 1.717 -20.124 1.00 44.31 N ATOM 2491 CZ ARG A 151 -1.502 0.908 -21.189 1.00 63.44 C ATOM 2492 NH1 ARG A 151 -2.143 1.135 -22.333 1.00 73.21 N ATOM 2493 NH2 ARG A 151 -0.705 -0.145 -21.088 1.00 74.42 N ATOM 0 H ARG A 151 -3.174 2.379 -16.102 1.00 21.21 H new ATOM 0 HA ARG A 151 -5.741 2.464 -17.340 1.00 31.31 H new ATOM 0 HB2 ARG A 151 -3.252 0.931 -18.187 1.00 62.33 H new ATOM 0 HB3 ARG A 151 -4.609 1.360 -19.209 1.00 62.33 H new ATOM 0 HG2 ARG A 151 -4.046 3.813 -18.803 1.00 25.04 H new ATOM 0 HG3 ARG A 151 -2.604 3.289 -17.956 1.00 25.04 H new ATOM 0 HD2 ARG A 151 -3.282 2.851 -20.896 1.00 32.53 H new ATOM 0 HD3 ARG A 151 -1.967 3.805 -20.240 1.00 32.53 H new ATOM 0 HE ARG A 151 -1.155 1.492 -19.277 1.00 44.31 H new ATOM 0 HH11 ARG A 151 -2.777 1.930 -22.413 1.00 73.21 H new ATOM 0 HH12 ARG A 151 -2.001 0.514 -23.129 1.00 73.21 H new ATOM 0 HH21 ARG A 151 -0.227 -0.340 -20.208 1.00 74.42 H new ATOM 0 HH22 ARG A 151 -0.569 -0.761 -21.890 1.00 74.42 H new ATOM 2507 N ARG A 152 -4.864 -0.299 -15.846 1.00 3.22 N ATOM 2508 CA ARG A 152 -5.261 -1.652 -15.444 1.00 63.23 C ATOM 2509 C ARG A 152 -4.595 -2.032 -14.114 1.00 13.12 C ATOM 2510 O ARG A 152 -3.839 -1.236 -13.536 1.00 61.41 O ATOM 2511 CB ARG A 152 -4.962 -2.682 -16.578 1.00 31.24 C ATOM 2512 CG ARG A 152 -3.510 -2.707 -17.101 1.00 43.45 C ATOM 2513 CD ARG A 152 -3.356 -3.516 -18.400 1.00 23.44 C ATOM 2514 NE ARG A 152 -4.223 -3.013 -19.492 1.00 64.35 N ATOM 2515 CZ ARG A 152 -4.152 -3.397 -20.783 1.00 33.15 C ATOM 2516 NH1 ARG A 152 -3.252 -4.293 -21.190 1.00 12.22 N ATOM 2517 NH2 ARG A 152 -4.999 -2.887 -21.666 1.00 33.12 N ATOM 0 H ARG A 152 -4.057 0.057 -15.333 1.00 3.22 H new ATOM 0 HA ARG A 152 -6.339 -1.670 -15.282 1.00 63.23 H new ATOM 0 HB2 ARG A 152 -5.213 -3.678 -16.213 1.00 31.24 H new ATOM 0 HB3 ARG A 152 -5.626 -2.473 -17.417 1.00 31.24 H new ATOM 0 HG2 ARG A 152 -3.174 -1.685 -17.273 1.00 43.45 H new ATOM 0 HG3 ARG A 152 -2.861 -3.131 -16.335 1.00 43.45 H new ATOM 0 HD2 ARG A 152 -2.315 -3.483 -18.723 1.00 23.44 H new ATOM 0 HD3 ARG A 152 -3.596 -4.561 -18.203 1.00 23.44 H new ATOM 0 HE ARG A 152 -4.931 -2.320 -19.247 1.00 64.35 H new ATOM 0 HH11 ARG A 152 -2.600 -4.702 -20.520 1.00 12.22 H new ATOM 0 HH12 ARG A 152 -3.215 -4.570 -22.171 1.00 12.22 H new ATOM 0 HH21 ARG A 152 -5.699 -2.208 -21.368 1.00 33.12 H new ATOM 0 HH22 ARG A 152 -4.950 -3.173 -22.644 1.00 33.12 H new ATOM 2531 N CYS A 153 -4.910 -3.246 -13.627 1.00 30.53 N ATOM 2532 CA CYS A 153 -4.402 -3.776 -12.347 1.00 61.52 C ATOM 2533 C CYS A 153 -2.864 -3.956 -12.381 1.00 64.42 C ATOM 2534 O CYS A 153 -2.177 -3.801 -11.362 1.00 23.02 O ATOM 2535 CB CYS A 153 -5.117 -5.110 -12.049 1.00 43.02 C ATOM 2536 SG CYS A 153 -6.907 -5.037 -12.324 1.00 64.34 S ATOM 0 H CYS A 153 -5.530 -3.893 -14.115 1.00 30.53 H new ATOM 0 HA CYS A 153 -4.614 -3.064 -11.550 1.00 61.52 H new ATOM 0 HB2 CYS A 153 -4.691 -5.892 -12.678 1.00 43.02 H new ATOM 0 HB3 CYS A 153 -4.926 -5.394 -11.014 1.00 43.02 H new ATOM 0 HG CYS A 153 -7.475 -4.426 -11.327 1.00 64.34 H new ATOM 2542 N GLN A 154 -2.347 -4.217 -13.594 1.00 51.02 N ATOM 2543 CA GLN A 154 -0.925 -4.508 -13.841 1.00 53.03 C ATOM 2544 C GLN A 154 -0.039 -3.267 -13.588 1.00 34.11 C ATOM 2545 O GLN A 154 1.147 -3.411 -13.279 1.00 31.21 O ATOM 2546 CB GLN A 154 -0.727 -5.037 -15.298 1.00 32.41 C ATOM 2547 CG GLN A 154 -1.302 -6.454 -15.590 1.00 75.11 C ATOM 2548 CD GLN A 154 -2.829 -6.567 -15.452 1.00 34.53 C ATOM 2549 OE1 GLN A 154 -3.355 -6.895 -14.385 1.00 75.43 O ATOM 2550 NE2 GLN A 154 -3.544 -6.294 -16.529 1.00 15.42 N ATOM 0 H GLN A 154 -2.914 -4.232 -14.442 1.00 51.02 H new ATOM 0 HA GLN A 154 -0.614 -5.282 -13.139 1.00 53.03 H new ATOM 0 HB2 GLN A 154 -1.189 -4.330 -15.987 1.00 32.41 H new ATOM 0 HB3 GLN A 154 0.340 -5.046 -15.519 1.00 32.41 H new ATOM 0 HG2 GLN A 154 -1.019 -6.745 -16.602 1.00 75.11 H new ATOM 0 HG3 GLN A 154 -0.835 -7.168 -14.911 1.00 75.11 H new ATOM 0 HE21 GLN A 154 -3.078 -6.026 -17.396 1.00 15.42 H new ATOM 0 HE22 GLN A 154 -4.562 -6.351 -16.494 1.00 15.42 H new ATOM 2559 N ASP A 155 -0.640 -2.060 -13.694 1.00 40.24 N ATOM 2560 CA ASP A 155 0.071 -0.769 -13.511 1.00 35.43 C ATOM 2561 C ASP A 155 0.773 -0.665 -12.138 1.00 31.03 C ATOM 2562 O ASP A 155 1.976 -0.369 -12.079 1.00 33.34 O ATOM 2563 CB ASP A 155 -0.899 0.430 -13.698 1.00 64.30 C ATOM 2564 CG ASP A 155 -1.380 0.631 -15.142 1.00 63.02 C ATOM 2565 OD1 ASP A 155 -1.971 -0.292 -15.700 1.00 51.10 O ATOM 2566 OD2 ASP A 155 -1.186 1.724 -15.715 1.00 15.44 O ATOM 0 H ASP A 155 -1.631 -1.951 -13.909 1.00 40.24 H new ATOM 0 HA ASP A 155 0.844 -0.733 -14.279 1.00 35.43 H new ATOM 0 HB2 ASP A 155 -1.767 0.284 -13.055 1.00 64.30 H new ATOM 0 HB3 ASP A 155 -0.402 1.340 -13.362 1.00 64.30 H new ATOM 2571 N TRP A 156 0.032 -0.919 -11.031 1.00 2.01 N ATOM 2572 CA TRP A 156 0.613 -0.845 -9.662 1.00 72.34 C ATOM 2573 C TRP A 156 1.150 -2.216 -9.191 1.00 21.43 C ATOM 2574 O TRP A 156 1.529 -2.377 -8.023 1.00 22.21 O ATOM 2575 CB TRP A 156 -0.397 -0.214 -8.645 1.00 12.03 C ATOM 2576 CG TRP A 156 -1.629 -1.028 -8.285 1.00 20.42 C ATOM 2577 CD1 TRP A 156 -1.752 -1.902 -7.239 1.00 10.33 C ATOM 2578 CD2 TRP A 156 -2.920 -1.007 -8.928 1.00 71.04 C ATOM 2579 NE1 TRP A 156 -3.018 -2.420 -7.197 1.00 51.21 N ATOM 2580 CE2 TRP A 156 -3.755 -1.890 -8.218 1.00 33.34 C ATOM 2581 CE3 TRP A 156 -3.450 -0.336 -10.030 1.00 45.10 C ATOM 2582 CZ2 TRP A 156 -5.085 -2.112 -8.569 1.00 43.31 C ATOM 2583 CZ3 TRP A 156 -4.772 -0.556 -10.381 1.00 74.35 C ATOM 2584 CH2 TRP A 156 -5.578 -1.436 -9.652 1.00 41.32 C ATOM 0 H TRP A 156 -0.955 -1.174 -11.055 1.00 2.01 H new ATOM 0 HA TRP A 156 1.473 -0.177 -9.705 1.00 72.34 H new ATOM 0 HB2 TRP A 156 0.144 0.003 -7.724 1.00 12.03 H new ATOM 0 HB3 TRP A 156 -0.731 0.741 -9.051 1.00 12.03 H new ATOM 0 HD1 TRP A 156 -0.962 -2.148 -6.545 1.00 10.33 H new ATOM 0 HE1 TRP A 156 -3.358 -3.095 -6.512 1.00 51.21 H new ATOM 0 HE3 TRP A 156 -2.838 0.346 -10.602 1.00 45.10 H new ATOM 0 HZ2 TRP A 156 -5.705 -2.794 -8.006 1.00 43.31 H new ATOM 0 HZ3 TRP A 156 -5.188 -0.039 -11.233 1.00 74.35 H new ATOM 0 HH2 TRP A 156 -6.606 -1.585 -9.948 1.00 41.32 H new ATOM 2595 N GLY A 157 1.214 -3.182 -10.132 1.00 4.31 N ATOM 2596 CA GLY A 157 1.792 -4.505 -9.879 1.00 30.42 C ATOM 2597 C GLY A 157 0.890 -5.398 -9.037 1.00 53.01 C ATOM 2598 O GLY A 157 1.377 -6.201 -8.232 1.00 41.21 O ATOM 0 H GLY A 157 0.866 -3.060 -11.083 1.00 4.31 H new ATOM 0 HA2 GLY A 157 1.993 -4.996 -10.831 1.00 30.42 H new ATOM 0 HA3 GLY A 157 2.750 -4.386 -9.373 1.00 30.42 H new ATOM 2602 N ALA A 158 -0.439 -5.236 -9.219 1.00 62.22 N ATOM 2603 CA ALA A 158 -1.441 -6.044 -8.518 1.00 72.24 C ATOM 2604 C ALA A 158 -1.434 -7.469 -9.071 1.00 61.21 C ATOM 2605 O ALA A 158 -1.834 -7.687 -10.221 1.00 3.31 O ATOM 2606 CB ALA A 158 -2.842 -5.416 -8.643 1.00 21.13 C ATOM 0 H ALA A 158 -0.838 -4.544 -9.853 1.00 62.22 H new ATOM 0 HA ALA A 158 -1.186 -6.075 -7.459 1.00 72.24 H new ATOM 0 HB1 ALA A 158 -3.567 -6.035 -8.114 1.00 21.13 H new ATOM 0 HB2 ALA A 158 -2.833 -4.416 -8.208 1.00 21.13 H new ATOM 0 HB3 ALA A 158 -3.119 -5.351 -9.695 1.00 21.13 H new ATOM 2612 N MET A 159 -0.973 -8.425 -8.239 1.00 44.42 N ATOM 2613 CA MET A 159 -0.972 -9.871 -8.569 1.00 65.34 C ATOM 2614 C MET A 159 -2.410 -10.373 -8.848 1.00 11.14 C ATOM 2615 O MET A 159 -2.614 -11.364 -9.557 1.00 43.40 O ATOM 2616 CB MET A 159 -0.330 -10.672 -7.401 1.00 42.14 C ATOM 2617 CG MET A 159 1.150 -10.341 -7.148 1.00 14.13 C ATOM 2618 SD MET A 159 2.215 -10.695 -8.571 1.00 3.10 S ATOM 2619 CE MET A 159 2.013 -12.473 -8.769 1.00 72.14 C ATOM 0 H MET A 159 -0.589 -8.219 -7.317 1.00 44.42 H new ATOM 0 HA MET A 159 -0.383 -10.026 -9.473 1.00 65.34 H new ATOM 0 HB2 MET A 159 -0.895 -10.479 -6.489 1.00 42.14 H new ATOM 0 HB3 MET A 159 -0.421 -11.737 -7.613 1.00 42.14 H new ATOM 0 HG2 MET A 159 1.240 -9.286 -6.888 1.00 14.13 H new ATOM 0 HG3 MET A 159 1.501 -10.912 -6.289 1.00 14.13 H new ATOM 0 HE1 MET A 159 2.788 -12.856 -9.433 1.00 72.14 H new ATOM 0 HE2 MET A 159 2.096 -12.959 -7.797 1.00 72.14 H new ATOM 0 HE3 MET A 159 1.033 -12.682 -9.197 1.00 72.14 H new ATOM 2629 N ASP A 160 -3.379 -9.641 -8.284 1.00 31.31 N ATOM 2630 CA ASP A 160 -4.816 -9.852 -8.485 1.00 24.44 C ATOM 2631 C ASP A 160 -5.553 -8.524 -8.207 1.00 32.11 C ATOM 2632 O ASP A 160 -5.068 -7.686 -7.435 1.00 35.13 O ATOM 2633 CB ASP A 160 -5.325 -10.992 -7.566 1.00 63.00 C ATOM 2634 CG ASP A 160 -4.990 -10.756 -6.087 1.00 45.20 C ATOM 2635 OD1 ASP A 160 -5.900 -10.450 -5.296 1.00 23.34 O ATOM 2636 OD2 ASP A 160 -3.799 -10.856 -5.712 1.00 22.41 O ATOM 0 H ASP A 160 -3.177 -8.862 -7.657 1.00 31.31 H new ATOM 0 HA ASP A 160 -5.013 -10.156 -9.513 1.00 24.44 H new ATOM 0 HB2 ASP A 160 -6.405 -11.089 -7.679 1.00 63.00 H new ATOM 0 HB3 ASP A 160 -4.885 -11.936 -7.888 1.00 63.00 H new ATOM 2641 N ALA A 161 -6.734 -8.363 -8.824 1.00 60.31 N ATOM 2642 CA ALA A 161 -7.492 -7.090 -8.840 1.00 61.31 C ATOM 2643 C ALA A 161 -8.411 -6.924 -7.610 1.00 72.25 C ATOM 2644 O ALA A 161 -9.224 -5.992 -7.583 1.00 65.34 O ATOM 2645 CB ALA A 161 -8.315 -7.031 -10.141 1.00 22.13 C ATOM 0 H ALA A 161 -7.199 -9.116 -9.332 1.00 60.31 H new ATOM 0 HA ALA A 161 -6.779 -6.267 -8.797 1.00 61.31 H new ATOM 0 HB1 ALA A 161 -8.881 -6.100 -10.172 1.00 22.13 H new ATOM 0 HB2 ALA A 161 -7.644 -7.076 -10.999 1.00 22.13 H new ATOM 0 HB3 ALA A 161 -9.004 -7.875 -10.175 1.00 22.13 H new ATOM 2651 N LYS A 162 -8.245 -7.809 -6.596 1.00 11.52 N ATOM 2652 CA LYS A 162 -9.116 -7.872 -5.400 1.00 32.24 C ATOM 2653 C LYS A 162 -9.206 -6.519 -4.679 1.00 2.30 C ATOM 2654 O LYS A 162 -8.189 -5.963 -4.272 1.00 44.25 O ATOM 2655 CB LYS A 162 -8.614 -8.958 -4.412 1.00 24.22 C ATOM 2656 CG LYS A 162 -9.416 -9.069 -3.096 1.00 34.31 C ATOM 2657 CD LYS A 162 -10.897 -9.460 -3.311 1.00 61.54 C ATOM 2658 CE LYS A 162 -11.713 -9.313 -2.021 1.00 63.32 C ATOM 2659 NZ LYS A 162 -11.095 -10.048 -0.881 1.00 52.42 N ATOM 0 H LYS A 162 -7.497 -8.503 -6.587 1.00 11.52 H new ATOM 0 HA LYS A 162 -10.115 -8.134 -5.750 1.00 32.24 H new ATOM 0 HB2 LYS A 162 -8.637 -9.924 -4.916 1.00 24.22 H new ATOM 0 HB3 LYS A 162 -7.572 -8.751 -4.168 1.00 24.22 H new ATOM 0 HG2 LYS A 162 -8.942 -9.810 -2.452 1.00 34.31 H new ATOM 0 HG3 LYS A 162 -9.372 -8.115 -2.571 1.00 34.31 H new ATOM 0 HD2 LYS A 162 -11.330 -8.832 -4.090 1.00 61.54 H new ATOM 0 HD3 LYS A 162 -10.955 -10.490 -3.663 1.00 61.54 H new ATOM 0 HE2 LYS A 162 -11.801 -8.257 -1.766 1.00 63.32 H new ATOM 0 HE3 LYS A 162 -12.724 -9.686 -2.187 1.00 63.32 H new ATOM 0 HZ1 LYS A 162 -11.843 -10.434 -0.271 1.00 52.42 H new ATOM 0 HZ2 LYS A 162 -10.510 -10.826 -1.246 1.00 52.42 H new ATOM 0 HZ3 LYS A 162 -10.500 -9.397 -0.330 1.00 52.42 H new ATOM 2673 N ALA A 163 -10.446 -6.041 -4.504 1.00 24.23 N ATOM 2674 CA ALA A 163 -10.762 -4.739 -3.915 1.00 73.13 C ATOM 2675 C ALA A 163 -11.670 -4.921 -2.683 1.00 43.24 C ATOM 2676 O ALA A 163 -12.882 -5.159 -2.817 1.00 23.12 O ATOM 2677 CB ALA A 163 -11.426 -3.859 -4.980 1.00 42.23 C ATOM 0 H ALA A 163 -11.277 -6.566 -4.777 1.00 24.23 H new ATOM 0 HA ALA A 163 -9.849 -4.248 -3.578 1.00 73.13 H new ATOM 0 HB1 ALA A 163 -11.665 -2.886 -4.551 1.00 42.23 H new ATOM 0 HB2 ALA A 163 -10.744 -3.727 -5.820 1.00 42.23 H new ATOM 0 HB3 ALA A 163 -12.342 -4.337 -5.328 1.00 42.23 H new ATOM 2683 N GLY A 164 -11.064 -4.845 -1.489 1.00 60.05 N ATOM 2684 CA GLY A 164 -11.788 -4.943 -0.218 1.00 73.03 C ATOM 2685 C GLY A 164 -12.142 -3.580 0.367 1.00 4.31 C ATOM 2686 O GLY A 164 -13.283 -3.361 0.780 1.00 42.22 O ATOM 0 H GLY A 164 -10.058 -4.714 -1.380 1.00 60.05 H new ATOM 0 HA2 GLY A 164 -12.702 -5.517 -0.369 1.00 73.03 H new ATOM 0 HA3 GLY A 164 -11.180 -5.495 0.499 1.00 73.03 H new ATOM 2690 N SER A 165 -11.145 -2.665 0.404 1.00 1.10 N ATOM 2691 CA SER A 165 -11.324 -1.283 0.929 1.00 21.21 C ATOM 2692 C SER A 165 -10.294 -0.291 0.330 1.00 71.01 C ATOM 2693 O SER A 165 -9.289 -0.707 -0.246 1.00 61.12 O ATOM 2694 CB SER A 165 -11.258 -1.299 2.478 1.00 33.14 C ATOM 2695 OG SER A 165 -10.137 -2.015 2.953 1.00 63.12 O ATOM 0 H SER A 165 -10.199 -2.858 0.074 1.00 1.10 H new ATOM 0 HA SER A 165 -12.307 -0.928 0.620 1.00 21.21 H new ATOM 0 HB2 SER A 165 -11.218 -0.275 2.850 1.00 33.14 H new ATOM 0 HB3 SER A 165 -12.169 -1.747 2.875 1.00 33.14 H new ATOM 0 HG SER A 165 -10.308 -2.977 2.879 1.00 63.12 H new ATOM 2701 N LEU A 166 -10.595 1.032 0.441 1.00 72.14 N ATOM 2702 CA LEU A 166 -9.711 2.145 -0.008 1.00 53.32 C ATOM 2703 C LEU A 166 -9.541 3.167 1.130 1.00 60.50 C ATOM 2704 O LEU A 166 -10.514 3.485 1.815 1.00 32.31 O ATOM 2705 CB LEU A 166 -10.305 2.884 -1.257 1.00 40.34 C ATOM 2706 CG LEU A 166 -10.427 2.062 -2.575 1.00 25.42 C ATOM 2707 CD1 LEU A 166 -11.013 2.899 -3.727 1.00 23.54 C ATOM 2708 CD2 LEU A 166 -9.081 1.441 -2.979 1.00 73.21 C ATOM 0 H LEU A 166 -11.470 1.360 0.850 1.00 72.14 H new ATOM 0 HA LEU A 166 -8.749 1.711 -0.281 1.00 53.32 H new ATOM 0 HB2 LEU A 166 -11.297 3.250 -0.993 1.00 40.34 H new ATOM 0 HB3 LEU A 166 -9.686 3.758 -1.459 1.00 40.34 H new ATOM 0 HG LEU A 166 -11.126 1.250 -2.374 1.00 25.42 H new ATOM 0 HD11 LEU A 166 -11.080 2.285 -4.625 1.00 23.54 H new ATOM 0 HD12 LEU A 166 -12.008 3.250 -3.452 1.00 23.54 H new ATOM 0 HD13 LEU A 166 -10.367 3.755 -3.920 1.00 23.54 H new ATOM 0 HD21 LEU A 166 -9.204 0.875 -3.902 1.00 73.21 H new ATOM 0 HD22 LEU A 166 -8.347 2.232 -3.133 1.00 73.21 H new ATOM 0 HD23 LEU A 166 -8.736 0.775 -2.188 1.00 73.21 H new ATOM 2720 N ARG A 167 -8.320 3.704 1.311 1.00 42.24 N ATOM 2721 CA ARG A 167 -8.049 4.757 2.312 1.00 45.14 C ATOM 2722 C ARG A 167 -6.986 5.747 1.813 1.00 72.12 C ATOM 2723 O ARG A 167 -5.942 5.352 1.299 1.00 71.23 O ATOM 2724 CB ARG A 167 -7.640 4.143 3.685 1.00 21.14 C ATOM 2725 CG ARG A 167 -7.011 5.138 4.698 1.00 4.24 C ATOM 2726 CD ARG A 167 -7.169 4.703 6.164 1.00 2.14 C ATOM 2727 NE ARG A 167 -8.562 4.875 6.633 1.00 75.15 N ATOM 2728 CZ ARG A 167 -8.950 4.902 7.919 1.00 4.32 C ATOM 2729 NH1 ARG A 167 -8.069 4.753 8.904 1.00 61.41 N ATOM 2730 NH2 ARG A 167 -10.229 5.095 8.212 1.00 65.00 N ATOM 0 H ARG A 167 -7.499 3.425 0.774 1.00 42.24 H new ATOM 0 HA ARG A 167 -8.976 5.312 2.458 1.00 45.14 H new ATOM 0 HB2 ARG A 167 -8.523 3.696 4.141 1.00 21.14 H new ATOM 0 HB3 ARG A 167 -6.930 3.336 3.506 1.00 21.14 H new ATOM 0 HG2 ARG A 167 -5.950 5.251 4.473 1.00 4.24 H new ATOM 0 HG3 ARG A 167 -7.471 6.117 4.566 1.00 4.24 H new ATOM 0 HD2 ARG A 167 -6.875 3.659 6.269 1.00 2.14 H new ATOM 0 HD3 ARG A 167 -6.497 5.288 6.793 1.00 2.14 H new ATOM 0 HE ARG A 167 -9.286 4.982 5.923 1.00 75.15 H new ATOM 0 HH11 ARG A 167 -7.082 4.616 8.689 1.00 61.41 H new ATOM 0 HH12 ARG A 167 -8.381 4.776 9.875 1.00 61.41 H new ATOM 0 HH21 ARG A 167 -10.910 5.222 7.463 1.00 65.00 H new ATOM 0 HH22 ARG A 167 -10.531 5.117 9.186 1.00 65.00 H new ATOM 2744 N ARG A 168 -7.287 7.031 2.004 1.00 60.52 N ATOM 2745 CA ARG A 168 -6.402 8.167 1.724 1.00 12.22 C ATOM 2746 C ARG A 168 -5.197 8.136 2.691 1.00 41.13 C ATOM 2747 O ARG A 168 -5.402 8.114 3.913 1.00 33.43 O ATOM 2748 CB ARG A 168 -7.231 9.466 1.942 1.00 43.21 C ATOM 2749 CG ARG A 168 -8.558 9.504 1.152 1.00 50.32 C ATOM 2750 CD ARG A 168 -9.485 10.659 1.559 1.00 23.03 C ATOM 2751 NE ARG A 168 -9.959 10.534 2.952 1.00 10.43 N ATOM 2752 CZ ARG A 168 -10.846 11.353 3.543 1.00 21.14 C ATOM 2753 NH1 ARG A 168 -11.375 12.378 2.884 1.00 52.51 N ATOM 2754 NH2 ARG A 168 -11.200 11.139 4.800 1.00 24.13 N ATOM 0 H ARG A 168 -8.192 7.323 2.374 1.00 60.52 H new ATOM 0 HA ARG A 168 -6.022 8.124 0.703 1.00 12.22 H new ATOM 0 HB2 ARG A 168 -7.449 9.571 3.005 1.00 43.21 H new ATOM 0 HB3 ARG A 168 -6.624 10.325 1.655 1.00 43.21 H new ATOM 0 HG2 ARG A 168 -8.335 9.586 0.088 1.00 50.32 H new ATOM 0 HG3 ARG A 168 -9.084 8.560 1.296 1.00 50.32 H new ATOM 0 HD2 ARG A 168 -8.956 11.605 1.441 1.00 23.03 H new ATOM 0 HD3 ARG A 168 -10.343 10.687 0.887 1.00 23.03 H new ATOM 0 HE ARG A 168 -9.584 9.766 3.509 1.00 10.43 H new ATOM 0 HH11 ARG A 168 -11.109 12.553 1.915 1.00 52.51 H new ATOM 0 HH12 ARG A 168 -12.047 12.990 3.347 1.00 52.51 H new ATOM 0 HH21 ARG A 168 -10.800 10.355 5.316 1.00 24.13 H new ATOM 0 HH22 ARG A 168 -11.873 11.758 5.253 1.00 24.13 H new ATOM 2768 N VAL A 169 -3.957 8.113 2.149 1.00 4.03 N ATOM 2769 CA VAL A 169 -2.728 8.106 2.973 1.00 53.31 C ATOM 2770 C VAL A 169 -2.592 9.436 3.748 1.00 10.22 C ATOM 2771 O VAL A 169 -2.686 10.515 3.155 1.00 61.24 O ATOM 2772 CB VAL A 169 -1.414 7.881 2.125 1.00 30.43 C ATOM 2773 CG1 VAL A 169 -0.160 7.835 3.037 1.00 72.00 C ATOM 2774 CG2 VAL A 169 -1.500 6.609 1.251 1.00 10.20 C ATOM 0 H VAL A 169 -3.782 8.099 1.144 1.00 4.03 H new ATOM 0 HA VAL A 169 -2.831 7.267 3.660 1.00 53.31 H new ATOM 0 HB VAL A 169 -1.319 8.734 1.453 1.00 30.43 H new ATOM 0 HG11 VAL A 169 0.729 7.679 2.426 1.00 72.00 H new ATOM 0 HG12 VAL A 169 -0.068 8.777 3.577 1.00 72.00 H new ATOM 0 HG13 VAL A 169 -0.258 7.016 3.750 1.00 72.00 H new ATOM 0 HG21 VAL A 169 -0.576 6.493 0.685 1.00 10.20 H new ATOM 0 HG22 VAL A 169 -1.646 5.738 1.890 1.00 10.20 H new ATOM 0 HG23 VAL A 169 -2.339 6.698 0.561 1.00 10.20 H new ATOM 2784 N VAL A 170 -2.383 9.331 5.064 1.00 52.35 N ATOM 2785 CA VAL A 170 -2.112 10.472 5.940 1.00 24.20 C ATOM 2786 C VAL A 170 -0.907 10.130 6.844 1.00 61.42 C ATOM 2787 O VAL A 170 -0.923 9.120 7.561 1.00 41.22 O ATOM 2788 CB VAL A 170 -3.392 10.874 6.777 1.00 63.12 C ATOM 2789 CG1 VAL A 170 -3.979 9.684 7.579 1.00 0.33 C ATOM 2790 CG2 VAL A 170 -3.095 12.092 7.678 1.00 43.52 C ATOM 0 H VAL A 170 -2.398 8.438 5.556 1.00 52.35 H new ATOM 0 HA VAL A 170 -1.861 11.345 5.337 1.00 24.20 H new ATOM 0 HB VAL A 170 -4.167 11.163 6.067 1.00 63.12 H new ATOM 0 HG11 VAL A 170 -4.856 10.017 8.135 1.00 0.33 H new ATOM 0 HG12 VAL A 170 -4.266 8.888 6.892 1.00 0.33 H new ATOM 0 HG13 VAL A 170 -3.229 9.309 8.275 1.00 0.33 H new ATOM 0 HG21 VAL A 170 -3.989 12.352 8.245 1.00 43.52 H new ATOM 0 HG22 VAL A 170 -2.287 11.846 8.367 1.00 43.52 H new ATOM 0 HG23 VAL A 170 -2.799 12.939 7.059 1.00 43.52 H new ATOM 2800 N ASP A 171 0.160 10.942 6.741 1.00 41.11 N ATOM 2801 CA ASP A 171 1.419 10.741 7.483 1.00 65.43 C ATOM 2802 C ASP A 171 1.226 10.933 8.987 1.00 53.13 C ATOM 2803 O ASP A 171 0.738 11.980 9.437 1.00 52.30 O ATOM 2804 CB ASP A 171 2.517 11.719 6.993 1.00 25.24 C ATOM 2805 CG ASP A 171 2.945 11.482 5.547 1.00 13.35 C ATOM 2806 OD1 ASP A 171 2.080 11.585 4.656 1.00 61.41 O ATOM 2807 OD2 ASP A 171 4.154 11.239 5.299 1.00 13.03 O ATOM 0 H ASP A 171 0.174 11.763 6.136 1.00 41.11 H new ATOM 0 HA ASP A 171 1.731 9.714 7.293 1.00 65.43 H new ATOM 0 HB2 ASP A 171 2.152 12.741 7.092 1.00 25.24 H new ATOM 0 HB3 ASP A 171 3.389 11.628 7.641 1.00 25.24 H new ATOM 2812 N LEU A 172 1.609 9.910 9.745 1.00 61.54 N ATOM 2813 CA LEU A 172 1.731 9.979 11.200 1.00 73.12 C ATOM 2814 C LEU A 172 3.182 10.390 11.533 1.00 4.05 C ATOM 2815 O LEU A 172 4.095 10.170 10.723 1.00 43.05 O ATOM 2816 CB LEU A 172 1.348 8.607 11.817 1.00 54.12 C ATOM 2817 CG LEU A 172 -0.050 8.031 11.412 1.00 43.43 C ATOM 2818 CD1 LEU A 172 -0.293 6.662 12.072 1.00 71.30 C ATOM 2819 CD2 LEU A 172 -1.193 9.021 11.731 1.00 33.33 C ATOM 0 H LEU A 172 1.847 8.995 9.361 1.00 61.54 H new ATOM 0 HA LEU A 172 1.053 10.719 11.625 1.00 73.12 H new ATOM 0 HB2 LEU A 172 2.111 7.881 11.537 1.00 54.12 H new ATOM 0 HB3 LEU A 172 1.379 8.699 12.903 1.00 54.12 H new ATOM 0 HG LEU A 172 -0.045 7.887 10.332 1.00 43.43 H new ATOM 0 HD11 LEU A 172 -1.271 6.283 11.775 1.00 71.30 H new ATOM 0 HD12 LEU A 172 0.479 5.962 11.753 1.00 71.30 H new ATOM 0 HD13 LEU A 172 -0.260 6.770 13.156 1.00 71.30 H new ATOM 0 HD21 LEU A 172 -2.146 8.584 11.435 1.00 33.33 H new ATOM 0 HD22 LEU A 172 -1.206 9.229 12.801 1.00 33.33 H new ATOM 0 HD23 LEU A 172 -1.034 9.949 11.183 1.00 33.33 H new ATOM 2831 N TYR A 173 3.392 10.991 12.709 1.00 62.32 N ATOM 2832 CA TYR A 173 4.689 11.587 13.109 1.00 11.31 C ATOM 2833 C TYR A 173 4.889 11.458 14.637 1.00 24.41 C ATOM 2834 O TYR A 173 6.021 11.181 15.083 1.00 23.11 O ATOM 2835 CB TYR A 173 4.771 13.074 12.643 1.00 71.33 C ATOM 2836 CG TYR A 173 3.539 13.938 12.990 1.00 15.42 C ATOM 2837 CD1 TYR A 173 2.450 14.020 12.113 1.00 71.55 C ATOM 2838 CD2 TYR A 173 3.463 14.673 14.182 1.00 70.43 C ATOM 2839 CE1 TYR A 173 1.343 14.794 12.410 1.00 3.32 C ATOM 2840 CE2 TYR A 173 2.353 15.445 14.480 1.00 34.32 C ATOM 2841 CZ TYR A 173 1.297 15.503 13.592 1.00 13.30 C ATOM 2842 OH TYR A 173 0.190 16.271 13.888 1.00 41.44 O ATOM 2843 OXT TYR A 173 3.895 11.602 15.382 1.00 37.97 O ATOM 0 H TYR A 173 2.667 11.083 13.421 1.00 62.32 H new ATOM 0 HA TYR A 173 5.497 11.042 12.620 1.00 11.31 H new ATOM 0 HB2 TYR A 173 5.654 13.531 13.091 1.00 71.33 H new ATOM 0 HB3 TYR A 173 4.916 13.093 11.563 1.00 71.33 H new ATOM 0 HD1 TYR A 173 2.475 13.467 11.185 1.00 71.55 H new ATOM 0 HD2 TYR A 173 4.286 14.636 14.881 1.00 70.43 H new ATOM 0 HE1 TYR A 173 0.516 14.843 11.717 1.00 3.32 H new ATOM 0 HE2 TYR A 173 2.313 16.001 15.405 1.00 34.32 H new ATOM 0 HH TYR A 173 0.316 16.705 14.758 1.00 41.44 H new TER 2853 TYR A 173