USER MOD reduce.3.24.130724 H: found=0, std=0, add=945, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 945 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 68 CYS SG : rot 63:sc= -1.45! USER MOD Set 1.2: A 119 HIS : no HD1:sc= 0.832 K(o=2.3,f=-8.7!) USER MOD Set 1.3: A 131 HIS : no HD1:sc= 1.52 K(o=2.3,f=-13!) USER MOD Set 1.4: A 141 SER OG : rot 5:sc= 1.37 USER MOD Set 2.1: A 135 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 136 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 47 GLN : amide:sc= 1.02 K(o=1.5,f=-1.5!) USER MOD Set 3.2: A 75 THR OG1 : rot 75:sc= 0.43 USER MOD Set 4.1: A 69 SER OG : rot -104:sc= 1.24 USER MOD Set 4.2: A 91 GLN : amide:sc= -0.508 K(o=0.73,f=-1.6) USER MOD Single : A 41 LYS NZ :NH3+ -171:sc=-6.5e-05 (180deg=-0.0851) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 45 MET CE :methyl -120:sc= 0 (180deg=-0.96) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot 150:sc= 0.935 USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.401 USER MOD Single : A 63 LYS NZ :NH3+ -137:sc= 1.21 (180deg=0.0527) USER MOD Single : A 64 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0346) USER MOD Single : A 73 GLN : amide:sc= -0.447 K(o=-0.45,f=-2.7!) USER MOD Single : A 79 GLN : amide:sc= 0.133 K(o=0.13,f=-6.2!) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot -163:sc= -0.0551 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 GLN : amide:sc= -2.51! C(o=-2.5!,f=-5.1!) USER MOD Single : A 94 MET CE :methyl -161:sc= -0.138 (180deg=-0.63) USER MOD Single : A 96 LYS NZ :NH3+ -165:sc= -0.0438 (180deg=-0.274) USER MOD Single : A 97 SER OG : rot 44:sc= 0.32 USER MOD Single : A 99 SER OG : rot 180:sc= 0.0893 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 105 THR OG1 : rot -88:sc= 0.92 USER MOD Single : A 123 TYR OH : rot 180:sc= 0.414 USER MOD Single : A 126 ASN :FLIP amide:sc= 0 F(o=-0.6,f=0) USER MOD Single : A 127 ASN : amide:sc= -0.0449 K(o=-0.045,f=-2.8!) USER MOD Single : A 128 GLN :FLIP amide:sc= 0 F(o=-0.9,f=0) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 143 MET CE :methyl -126:sc= -1.5 (180deg=-2.69!) USER MOD Single : A 144 ASN :FLIP amide:sc= 0 F(o=-0.71,f=0) USER MOD Single : A 147 TYR OH : rot 180:sc=-0.00501 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 LYS NZ :NH3+ 167:sc=-0.00127 (180deg=-0.123) USER MOD Single : A 152 TYR OH : rot 180:sc= -0.0794 USER MOD Single : A 153 ASN : amide:sc= -1.33 X(o=-1.3,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 50 N ASP A 39 -10.211 -13.791 3.359 1.00 73.23 N ATOM 51 CA ASP A 39 -10.166 -12.945 2.166 1.00 32.14 C ATOM 52 C ASP A 39 -9.243 -11.734 2.372 1.00 33.42 C ATOM 53 O ASP A 39 -9.679 -10.686 2.851 1.00 65.22 O ATOM 54 CB ASP A 39 -11.573 -12.463 1.799 1.00 43.42 C ATOM 55 CG ASP A 39 -12.493 -13.598 1.400 1.00 64.43 C ATOM 56 OD1 ASP A 39 -13.165 -14.167 2.285 1.00 32.05 O ATOM 57 OD2 ASP A 39 -12.549 -13.925 0.199 1.00 63.33 O ATOM 0 HA ASP A 39 -9.766 -13.548 1.351 1.00 32.14 H new ATOM 0 HB2 ASP A 39 -12.004 -11.932 2.648 1.00 43.42 H new ATOM 0 HB3 ASP A 39 -11.506 -11.749 0.978 1.00 43.42 H new ATOM 62 N VAL A 40 -7.968 -11.889 2.020 1.00 4.34 N ATOM 63 CA VAL A 40 -6.988 -10.803 2.149 1.00 30.15 C ATOM 64 C VAL A 40 -7.497 -9.512 1.482 1.00 31.22 C ATOM 65 O VAL A 40 -7.469 -8.439 2.079 1.00 33.44 O ATOM 66 CB VAL A 40 -5.623 -11.202 1.527 1.00 72.31 C ATOM 67 CG1 VAL A 40 -4.602 -10.069 1.654 1.00 15.31 C ATOM 68 CG2 VAL A 40 -5.092 -12.486 2.164 1.00 11.13 C ATOM 0 H VAL A 40 -7.585 -12.756 1.642 1.00 4.34 H new ATOM 0 HA VAL A 40 -6.851 -10.620 3.215 1.00 30.15 H new ATOM 0 HB VAL A 40 -5.782 -11.388 0.465 1.00 72.31 H new ATOM 0 HG11 VAL A 40 -3.657 -10.380 1.209 1.00 15.31 H new ATOM 0 HG12 VAL A 40 -4.974 -9.185 1.136 1.00 15.31 H new ATOM 0 HG13 VAL A 40 -4.448 -9.835 2.707 1.00 15.31 H new ATOM 0 HG21 VAL A 40 -4.135 -12.747 1.713 1.00 11.13 H new ATOM 0 HG22 VAL A 40 -4.959 -12.333 3.235 1.00 11.13 H new ATOM 0 HG23 VAL A 40 -5.803 -13.295 1.999 1.00 11.13 H new ATOM 78 N LYS A 41 -7.992 -9.644 0.251 1.00 41.12 N ATOM 79 CA LYS A 41 -8.546 -8.508 -0.502 1.00 13.12 C ATOM 80 C LYS A 41 -9.681 -7.811 0.271 1.00 24.25 C ATOM 81 O LYS A 41 -9.687 -6.587 0.420 1.00 45.54 O ATOM 82 CB LYS A 41 -9.050 -8.999 -1.870 1.00 54.43 C ATOM 83 CG LYS A 41 -9.714 -7.922 -2.728 1.00 23.23 C ATOM 84 CD LYS A 41 -10.084 -8.459 -4.110 1.00 61.44 C ATOM 85 CE LYS A 41 -10.882 -7.449 -4.927 1.00 10.44 C ATOM 86 NZ LYS A 41 -12.241 -7.222 -4.365 1.00 22.34 N ATOM 0 H LYS A 41 -8.022 -10.531 -0.252 1.00 41.12 H new ATOM 0 HA LYS A 41 -7.754 -7.773 -0.645 1.00 13.12 H new ATOM 0 HB2 LYS A 41 -8.209 -9.418 -2.423 1.00 54.43 H new ATOM 0 HB3 LYS A 41 -9.762 -9.808 -1.711 1.00 54.43 H new ATOM 0 HG2 LYS A 41 -10.610 -7.556 -2.226 1.00 23.23 H new ATOM 0 HG3 LYS A 41 -9.039 -7.073 -2.835 1.00 23.23 H new ATOM 0 HD2 LYS A 41 -9.175 -8.723 -4.650 1.00 61.44 H new ATOM 0 HD3 LYS A 41 -10.666 -9.374 -3.998 1.00 61.44 H new ATOM 0 HE2 LYS A 41 -10.342 -6.503 -4.961 1.00 10.44 H new ATOM 0 HE3 LYS A 41 -10.970 -7.803 -5.954 1.00 10.44 H new ATOM 0 HZ1 LYS A 41 -12.801 -6.650 -5.030 1.00 22.34 H new ATOM 0 HZ2 LYS A 41 -12.712 -8.137 -4.214 1.00 22.34 H new ATOM 0 HZ3 LYS A 41 -12.162 -6.720 -3.458 1.00 22.34 H new ATOM 100 N SER A 42 -10.628 -8.598 0.780 1.00 73.02 N ATOM 101 CA SER A 42 -11.771 -8.050 1.530 1.00 44.45 C ATOM 102 C SER A 42 -11.335 -7.469 2.885 1.00 31.51 C ATOM 103 O SER A 42 -11.914 -6.497 3.363 1.00 51.23 O ATOM 104 CB SER A 42 -12.839 -9.130 1.748 1.00 2.31 C ATOM 105 OG SER A 42 -14.021 -8.586 2.321 1.00 52.41 O ATOM 0 H SER A 42 -10.632 -9.614 0.690 1.00 73.02 H new ATOM 0 HA SER A 42 -12.193 -7.241 0.934 1.00 44.45 H new ATOM 0 HB2 SER A 42 -13.079 -9.603 0.796 1.00 2.31 H new ATOM 0 HB3 SER A 42 -12.443 -9.909 2.400 1.00 2.31 H new ATOM 0 HG SER A 42 -14.682 -9.299 2.446 1.00 52.41 H new ATOM 111 N ARG A 43 -10.310 -8.067 3.496 1.00 20.04 N ATOM 112 CA ARG A 43 -9.757 -7.574 4.767 1.00 15.10 C ATOM 113 C ARG A 43 -9.096 -6.197 4.590 1.00 71.44 C ATOM 114 O ARG A 43 -9.284 -5.297 5.408 1.00 4.50 O ATOM 115 CB ARG A 43 -8.739 -8.580 5.331 1.00 20.04 C ATOM 116 CG ARG A 43 -9.364 -9.888 5.824 1.00 73.34 C ATOM 117 CD ARG A 43 -9.696 -9.857 7.316 1.00 51.10 C ATOM 118 NE ARG A 43 -10.504 -8.698 7.700 1.00 23.23 N ATOM 119 CZ ARG A 43 -11.541 -8.755 8.495 1.00 24.14 C ATOM 120 NH1 ARG A 43 -11.996 -9.893 8.916 1.00 33.23 N ATOM 121 NH2 ARG A 43 -12.136 -7.669 8.858 1.00 0.33 N ATOM 0 H ARG A 43 -9.842 -8.897 3.132 1.00 20.04 H new ATOM 0 HA ARG A 43 -10.581 -7.466 5.472 1.00 15.10 H new ATOM 0 HB2 ARG A 43 -8.004 -8.809 4.559 1.00 20.04 H new ATOM 0 HB3 ARG A 43 -8.201 -8.113 6.156 1.00 20.04 H new ATOM 0 HG2 ARG A 43 -10.274 -10.088 5.258 1.00 73.34 H new ATOM 0 HG3 ARG A 43 -8.678 -10.711 5.626 1.00 73.34 H new ATOM 0 HD2 ARG A 43 -10.230 -10.769 7.582 1.00 51.10 H new ATOM 0 HD3 ARG A 43 -8.769 -9.852 7.889 1.00 51.10 H new ATOM 0 HE ARG A 43 -10.241 -7.787 7.323 1.00 23.23 H new ATOM 0 HH11 ARG A 43 -11.544 -10.761 8.628 1.00 33.23 H new ATOM 0 HH12 ARG A 43 -12.806 -9.921 9.536 1.00 33.23 H new ATOM 0 HH21 ARG A 43 -11.798 -6.766 8.525 1.00 0.33 H new ATOM 0 HH22 ARG A 43 -12.945 -7.713 9.478 1.00 0.33 H new ATOM 135 N ILE A 44 -8.326 -6.037 3.515 1.00 70.41 N ATOM 136 CA ILE A 44 -7.700 -4.748 3.205 1.00 51.31 C ATOM 137 C ILE A 44 -8.767 -3.686 2.887 1.00 31.34 C ATOM 138 O ILE A 44 -8.629 -2.523 3.264 1.00 42.22 O ATOM 139 CB ILE A 44 -6.702 -4.874 2.022 1.00 74.12 C ATOM 140 CG1 ILE A 44 -5.662 -5.969 2.321 1.00 73.53 C ATOM 141 CG2 ILE A 44 -6.006 -3.535 1.757 1.00 34.40 C ATOM 142 CD1 ILE A 44 -4.741 -6.288 1.159 1.00 32.34 C ATOM 0 H ILE A 44 -8.120 -6.778 2.846 1.00 70.41 H new ATOM 0 HA ILE A 44 -7.143 -4.433 4.087 1.00 51.31 H new ATOM 0 HB ILE A 44 -7.259 -5.153 1.127 1.00 74.12 H new ATOM 0 HG12 ILE A 44 -5.058 -5.657 3.173 1.00 73.53 H new ATOM 0 HG13 ILE A 44 -6.184 -6.879 2.616 1.00 73.53 H new ATOM 0 HG21 ILE A 44 -5.311 -3.645 0.925 1.00 34.40 H new ATOM 0 HG22 ILE A 44 -6.752 -2.780 1.510 1.00 34.40 H new ATOM 0 HG23 ILE A 44 -5.459 -3.227 2.648 1.00 34.40 H new ATOM 0 HD11 ILE A 44 -4.040 -7.069 1.454 1.00 32.34 H new ATOM 0 HD12 ILE A 44 -5.332 -6.633 0.310 1.00 32.34 H new ATOM 0 HD13 ILE A 44 -4.188 -5.392 0.876 1.00 32.34 H new ATOM 154 N MET A 45 -9.838 -4.099 2.203 1.00 64.20 N ATOM 155 CA MET A 45 -10.995 -3.222 1.962 1.00 31.41 C ATOM 156 C MET A 45 -11.697 -2.846 3.278 1.00 35.13 C ATOM 157 O MET A 45 -12.066 -1.689 3.491 1.00 64.14 O ATOM 158 CB MET A 45 -11.993 -3.899 1.010 1.00 31.04 C ATOM 159 CG MET A 45 -11.629 -3.760 -0.463 1.00 30.50 C ATOM 160 SD MET A 45 -11.744 -2.048 -1.028 1.00 43.51 S ATOM 161 CE MET A 45 -11.233 -2.204 -2.737 1.00 61.24 C ATOM 0 H MET A 45 -9.931 -5.034 1.805 1.00 64.20 H new ATOM 0 HA MET A 45 -10.625 -2.307 1.500 1.00 31.41 H new ATOM 0 HB2 MET A 45 -12.058 -4.958 1.260 1.00 31.04 H new ATOM 0 HB3 MET A 45 -12.983 -3.472 1.172 1.00 31.04 H new ATOM 0 HG2 MET A 45 -10.615 -4.127 -0.622 1.00 30.50 H new ATOM 0 HG3 MET A 45 -12.292 -4.385 -1.061 1.00 30.50 H new ATOM 0 HE1 MET A 45 -10.346 -1.594 -2.909 1.00 61.24 H new ATOM 0 HE2 MET A 45 -11.003 -3.247 -2.954 1.00 61.24 H new ATOM 0 HE3 MET A 45 -12.038 -1.866 -3.390 1.00 61.24 H new ATOM 171 N ASP A 46 -11.877 -3.833 4.151 1.00 71.14 N ATOM 172 CA ASP A 46 -12.480 -3.611 5.468 1.00 22.33 C ATOM 173 C ASP A 46 -11.666 -2.591 6.286 1.00 30.05 C ATOM 174 O ASP A 46 -12.228 -1.714 6.946 1.00 61.24 O ATOM 175 CB ASP A 46 -12.585 -4.949 6.214 1.00 15.31 C ATOM 176 CG ASP A 46 -13.163 -4.801 7.610 1.00 31.52 C ATOM 177 OD1 ASP A 46 -14.349 -4.437 7.736 1.00 71.22 O ATOM 178 OD2 ASP A 46 -12.433 -5.042 8.591 1.00 51.23 O ATOM 0 H ASP A 46 -11.613 -4.802 3.971 1.00 71.14 H new ATOM 0 HA ASP A 46 -13.479 -3.198 5.332 1.00 22.33 H new ATOM 0 HB2 ASP A 46 -13.209 -5.633 5.638 1.00 15.31 H new ATOM 0 HB3 ASP A 46 -11.595 -5.401 6.282 1.00 15.31 H new ATOM 183 N GLN A 47 -10.343 -2.709 6.231 1.00 31.24 N ATOM 184 CA GLN A 47 -9.450 -1.743 6.879 1.00 63.21 C ATOM 185 C GLN A 47 -9.571 -0.367 6.191 1.00 32.25 C ATOM 186 O GLN A 47 -9.796 0.653 6.844 1.00 51.43 O ATOM 187 CB GLN A 47 -7.997 -2.252 6.809 1.00 32.03 C ATOM 188 CG GLN A 47 -7.138 -1.910 8.026 1.00 13.42 C ATOM 189 CD GLN A 47 -7.100 -0.429 8.353 1.00 31.12 C ATOM 190 OE1 GLN A 47 -7.902 0.064 9.140 1.00 0.41 O ATOM 191 NE2 GLN A 47 -6.179 0.296 7.745 1.00 64.11 N ATOM 0 H GLN A 47 -9.861 -3.464 5.744 1.00 31.24 H new ATOM 0 HA GLN A 47 -9.736 -1.634 7.925 1.00 63.21 H new ATOM 0 HB2 GLN A 47 -8.012 -3.335 6.685 1.00 32.03 H new ATOM 0 HB3 GLN A 47 -7.524 -1.836 5.920 1.00 32.03 H new ATOM 0 HG2 GLN A 47 -7.518 -2.454 8.891 1.00 13.42 H new ATOM 0 HG3 GLN A 47 -6.121 -2.260 7.851 1.00 13.42 H new ATOM 0 HE21 GLN A 47 -5.528 -0.146 7.096 1.00 64.11 H new ATOM 0 HE22 GLN A 47 -6.119 1.298 7.924 1.00 64.11 H new ATOM 200 N TYR A 48 -9.442 -0.363 4.861 1.00 32.21 N ATOM 201 CA TYR A 48 -9.582 0.856 4.052 1.00 25.02 C ATOM 202 C TYR A 48 -10.911 1.571 4.338 1.00 61.22 C ATOM 203 O TYR A 48 -10.979 2.801 4.324 1.00 55.03 O ATOM 204 CB TYR A 48 -9.467 0.509 2.556 1.00 63.44 C ATOM 205 CG TYR A 48 -9.825 1.648 1.612 1.00 44.23 C ATOM 206 CD1 TYR A 48 -9.158 2.869 1.671 1.00 3.23 C ATOM 207 CD2 TYR A 48 -10.836 1.500 0.665 1.00 44.14 C ATOM 208 CE1 TYR A 48 -9.488 3.906 0.817 1.00 1.45 C ATOM 209 CE2 TYR A 48 -11.170 2.532 -0.190 1.00 71.44 C ATOM 210 CZ TYR A 48 -10.492 3.733 -0.112 1.00 72.15 C ATOM 211 OH TYR A 48 -10.826 4.766 -0.959 1.00 14.03 O ATOM 0 H TYR A 48 -9.238 -1.200 4.315 1.00 32.21 H new ATOM 0 HA TYR A 48 -8.777 1.538 4.324 1.00 25.02 H new ATOM 0 HB2 TYR A 48 -8.446 0.190 2.348 1.00 63.44 H new ATOM 0 HB3 TYR A 48 -10.116 -0.340 2.342 1.00 63.44 H new ATOM 0 HD1 TYR A 48 -8.370 3.009 2.396 1.00 3.23 H new ATOM 0 HD2 TYR A 48 -11.368 0.562 0.598 1.00 44.14 H new ATOM 0 HE1 TYR A 48 -8.961 4.847 0.878 1.00 1.45 H new ATOM 0 HE2 TYR A 48 -11.958 2.401 -0.917 1.00 71.44 H new ATOM 0 HH TYR A 48 -11.551 4.481 -1.553 1.00 14.03 H new ATOM 221 N ALA A 49 -11.958 0.797 4.612 1.00 4.31 N ATOM 222 CA ALA A 49 -13.272 1.351 4.944 1.00 13.43 C ATOM 223 C ALA A 49 -13.188 2.362 6.101 1.00 20.12 C ATOM 224 O ALA A 49 -13.939 3.336 6.144 1.00 12.35 O ATOM 225 CB ALA A 49 -14.243 0.230 5.287 1.00 62.55 C ATOM 0 H ALA A 49 -11.923 -0.222 4.611 1.00 4.31 H new ATOM 0 HA ALA A 49 -13.639 1.886 4.068 1.00 13.43 H new ATOM 0 HB1 ALA A 49 -15.217 0.654 5.532 1.00 62.55 H new ATOM 0 HB2 ALA A 49 -14.343 -0.439 4.432 1.00 62.55 H new ATOM 0 HB3 ALA A 49 -13.865 -0.329 6.143 1.00 62.55 H new ATOM 231 N ASP A 50 -12.263 2.125 7.031 1.00 31.32 N ATOM 232 CA ASP A 50 -12.021 3.044 8.149 1.00 12.22 C ATOM 233 C ASP A 50 -11.277 4.315 7.703 1.00 13.41 C ATOM 234 O ASP A 50 -11.478 5.391 8.266 1.00 53.14 O ATOM 235 CB ASP A 50 -11.211 2.337 9.248 1.00 44.21 C ATOM 236 CG ASP A 50 -12.087 1.744 10.330 1.00 73.33 C ATOM 237 OD1 ASP A 50 -12.508 2.505 11.228 1.00 25.44 O ATOM 238 OD2 ASP A 50 -12.356 0.526 10.293 1.00 2.15 O ATOM 0 H ASP A 50 -11.664 1.299 7.034 1.00 31.32 H new ATOM 0 HA ASP A 50 -12.995 3.344 8.537 1.00 12.22 H new ATOM 0 HB2 ASP A 50 -10.610 1.546 8.799 1.00 44.21 H new ATOM 0 HB3 ASP A 50 -10.518 3.048 9.697 1.00 44.21 H new ATOM 243 N TRP A 51 -10.425 4.178 6.693 1.00 2.33 N ATOM 244 CA TRP A 51 -9.535 5.267 6.274 1.00 71.51 C ATOM 245 C TRP A 51 -9.983 5.925 4.954 1.00 22.30 C ATOM 246 O TRP A 51 -9.232 6.699 4.355 1.00 13.14 O ATOM 247 CB TRP A 51 -8.104 4.730 6.130 1.00 53.14 C ATOM 248 CG TRP A 51 -7.553 4.133 7.396 1.00 42.14 C ATOM 249 CD1 TRP A 51 -7.887 2.932 7.946 1.00 21.44 C ATOM 250 CD2 TRP A 51 -6.564 4.705 8.260 1.00 53.44 C ATOM 251 NE1 TRP A 51 -7.172 2.723 9.102 1.00 42.14 N ATOM 252 CE2 TRP A 51 -6.353 3.795 9.315 1.00 64.12 C ATOM 253 CE3 TRP A 51 -5.840 5.896 8.246 1.00 30.13 C ATOM 254 CZ2 TRP A 51 -5.442 4.040 10.341 1.00 22.52 C ATOM 255 CZ3 TRP A 51 -4.939 6.139 9.263 1.00 1.33 C ATOM 256 CH2 TRP A 51 -4.746 5.216 10.299 1.00 52.12 C ATOM 0 H TRP A 51 -10.328 3.323 6.145 1.00 2.33 H new ATOM 0 HA TRP A 51 -9.576 6.037 7.044 1.00 71.51 H new ATOM 0 HB2 TRP A 51 -8.086 3.975 5.344 1.00 53.14 H new ATOM 0 HB3 TRP A 51 -7.452 5.541 5.807 1.00 53.14 H new ATOM 0 HD1 TRP A 51 -8.609 2.243 7.533 1.00 21.44 H new ATOM 0 HE1 TRP A 51 -7.242 1.901 9.702 1.00 42.14 H new ATOM 0 HE3 TRP A 51 -5.982 6.616 7.453 1.00 30.13 H new ATOM 0 HZ2 TRP A 51 -5.292 3.328 11.139 1.00 22.52 H new ATOM 0 HZ3 TRP A 51 -4.372 7.058 9.260 1.00 1.33 H new ATOM 0 HH2 TRP A 51 -4.033 5.438 11.080 1.00 52.12 H new ATOM 267 N LYS A 52 -11.208 5.636 4.509 1.00 3.45 N ATOM 268 CA LYS A 52 -11.723 6.198 3.250 1.00 13.22 C ATOM 269 C LYS A 52 -11.739 7.738 3.266 1.00 34.01 C ATOM 270 O LYS A 52 -12.680 8.357 3.767 1.00 22.55 O ATOM 271 CB LYS A 52 -13.135 5.673 2.947 1.00 22.34 C ATOM 272 CG LYS A 52 -13.192 4.186 2.611 1.00 24.24 C ATOM 273 CD LYS A 52 -14.582 3.760 2.131 1.00 23.55 C ATOM 274 CE LYS A 52 -15.649 3.936 3.208 1.00 40.50 C ATOM 275 NZ LYS A 52 -17.002 3.568 2.713 1.00 41.12 N ATOM 0 H LYS A 52 -11.861 5.021 4.995 1.00 3.45 H new ATOM 0 HA LYS A 52 -11.042 5.873 2.464 1.00 13.22 H new ATOM 0 HB2 LYS A 52 -13.774 5.864 3.809 1.00 22.34 H new ATOM 0 HB3 LYS A 52 -13.549 6.239 2.112 1.00 22.34 H new ATOM 0 HG2 LYS A 52 -12.457 3.960 1.839 1.00 24.24 H new ATOM 0 HG3 LYS A 52 -12.918 3.605 3.491 1.00 24.24 H new ATOM 0 HD2 LYS A 52 -14.856 4.346 1.253 1.00 23.55 H new ATOM 0 HD3 LYS A 52 -14.552 2.716 1.821 1.00 23.55 H new ATOM 0 HE2 LYS A 52 -15.398 3.320 4.072 1.00 40.50 H new ATOM 0 HE3 LYS A 52 -15.656 4.972 3.547 1.00 40.50 H new ATOM 0 HZ1 LYS A 52 -17.698 3.701 3.474 1.00 41.12 H new ATOM 0 HZ2 LYS A 52 -17.252 4.173 1.905 1.00 41.12 H new ATOM 0 HZ3 LYS A 52 -17.003 2.572 2.413 1.00 41.12 H new ATOM 289 N GLY A 53 -10.691 8.348 2.717 1.00 74.13 N ATOM 290 CA GLY A 53 -10.635 9.803 2.613 1.00 4.34 C ATOM 291 C GLY A 53 -9.877 10.477 3.757 1.00 52.42 C ATOM 292 O GLY A 53 -10.156 11.628 4.099 1.00 10.51 O ATOM 0 H GLY A 53 -9.877 7.863 2.341 1.00 74.13 H new ATOM 0 HA2 GLY A 53 -10.162 10.072 1.669 1.00 4.34 H new ATOM 0 HA3 GLY A 53 -11.652 10.195 2.583 1.00 4.34 H new ATOM 296 N VAL A 54 -8.926 9.767 4.361 1.00 13.55 N ATOM 297 CA VAL A 54 -8.058 10.363 5.388 1.00 70.53 C ATOM 298 C VAL A 54 -6.967 11.232 4.743 1.00 24.10 C ATOM 299 O VAL A 54 -6.240 10.775 3.858 1.00 64.13 O ATOM 300 CB VAL A 54 -7.401 9.279 6.283 1.00 15.43 C ATOM 301 CG1 VAL A 54 -6.384 9.900 7.241 1.00 23.44 C ATOM 302 CG2 VAL A 54 -8.469 8.512 7.060 1.00 74.23 C ATOM 0 H VAL A 54 -8.734 8.785 4.163 1.00 13.55 H new ATOM 0 HA VAL A 54 -8.690 10.989 6.018 1.00 70.53 H new ATOM 0 HB VAL A 54 -6.871 8.581 5.636 1.00 15.43 H new ATOM 0 HG11 VAL A 54 -5.939 9.118 7.856 1.00 23.44 H new ATOM 0 HG12 VAL A 54 -5.603 10.400 6.668 1.00 23.44 H new ATOM 0 HG13 VAL A 54 -6.884 10.626 7.882 1.00 23.44 H new ATOM 0 HG21 VAL A 54 -7.992 7.755 7.683 1.00 74.23 H new ATOM 0 HG22 VAL A 54 -9.027 9.204 7.692 1.00 74.23 H new ATOM 0 HG23 VAL A 54 -9.151 8.029 6.361 1.00 74.23 H new ATOM 312 N ARG A 55 -6.861 12.486 5.195 1.00 71.12 N ATOM 313 CA ARG A 55 -5.899 13.448 4.633 1.00 43.21 C ATOM 314 C ARG A 55 -4.440 12.999 4.833 1.00 62.41 C ATOM 315 O ARG A 55 -4.136 12.174 5.696 1.00 20.22 O ATOM 316 CB ARG A 55 -6.109 14.834 5.263 1.00 74.34 C ATOM 317 CG ARG A 55 -5.882 14.870 6.772 1.00 13.23 C ATOM 318 CD ARG A 55 -6.199 16.243 7.359 1.00 11.53 C ATOM 319 NE ARG A 55 -7.588 16.637 7.114 1.00 54.32 N ATOM 320 CZ ARG A 55 -8.441 16.965 8.052 1.00 31.52 C ATOM 321 NH1 ARG A 55 -8.078 17.007 9.293 1.00 74.54 N ATOM 322 NH2 ARG A 55 -9.657 17.276 7.743 1.00 62.22 N ATOM 0 H ARG A 55 -7.431 12.863 5.952 1.00 71.12 H new ATOM 0 HA ARG A 55 -6.082 13.498 3.560 1.00 43.21 H new ATOM 0 HB2 ARG A 55 -5.433 15.544 4.787 1.00 74.34 H new ATOM 0 HB3 ARG A 55 -7.124 15.169 5.050 1.00 74.34 H new ATOM 0 HG2 ARG A 55 -6.506 14.116 7.252 1.00 13.23 H new ATOM 0 HG3 ARG A 55 -4.846 14.612 6.990 1.00 13.23 H new ATOM 0 HD2 ARG A 55 -6.010 16.231 8.432 1.00 11.53 H new ATOM 0 HD3 ARG A 55 -5.530 16.986 6.925 1.00 11.53 H new ATOM 0 HE ARG A 55 -7.913 16.657 6.147 1.00 54.32 H new ATOM 0 HH11 ARG A 55 -7.117 16.783 9.551 1.00 74.54 H new ATOM 0 HH12 ARG A 55 -8.753 17.264 10.013 1.00 74.54 H new ATOM 0 HH21 ARG A 55 -9.954 17.266 6.767 1.00 62.22 H new ATOM 0 HH22 ARG A 55 -10.320 17.531 8.475 1.00 62.22 H new ATOM 336 N TYR A 56 -3.537 13.570 4.040 1.00 51.12 N ATOM 337 CA TYR A 56 -2.127 13.170 4.056 1.00 50.42 C ATOM 338 C TYR A 56 -1.333 13.900 5.157 1.00 50.32 C ATOM 339 O TYR A 56 -1.296 15.130 5.203 1.00 15.14 O ATOM 340 CB TYR A 56 -1.498 13.441 2.682 1.00 75.32 C ATOM 341 CG TYR A 56 -0.144 12.783 2.482 1.00 45.13 C ATOM 342 CD1 TYR A 56 -0.054 11.484 1.990 1.00 62.02 C ATOM 343 CD2 TYR A 56 1.038 13.451 2.783 1.00 23.01 C ATOM 344 CE1 TYR A 56 1.170 10.876 1.799 1.00 74.21 C ATOM 345 CE2 TYR A 56 2.267 12.847 2.596 1.00 3.53 C ATOM 346 CZ TYR A 56 2.327 11.559 2.104 1.00 41.51 C ATOM 347 OH TYR A 56 3.547 10.949 1.918 1.00 73.22 O ATOM 0 H TYR A 56 -3.754 14.313 3.376 1.00 51.12 H new ATOM 0 HA TYR A 56 -2.084 12.104 4.277 1.00 50.42 H new ATOM 0 HB2 TYR A 56 -2.179 13.090 1.907 1.00 75.32 H new ATOM 0 HB3 TYR A 56 -1.391 14.518 2.549 1.00 75.32 H new ATOM 0 HD1 TYR A 56 -0.958 10.942 1.754 1.00 62.02 H new ATOM 0 HD2 TYR A 56 0.995 14.459 3.169 1.00 23.01 H new ATOM 0 HE1 TYR A 56 1.221 9.869 1.412 1.00 74.21 H new ATOM 0 HE2 TYR A 56 3.176 13.380 2.834 1.00 3.53 H new ATOM 0 HH TYR A 56 4.264 11.564 2.179 1.00 73.22 H new ATOM 357 N ARG A 57 -0.700 13.130 6.041 1.00 12.11 N ATOM 358 CA ARG A 57 0.160 13.684 7.099 1.00 72.12 C ATOM 359 C ARG A 57 1.451 12.860 7.231 1.00 44.14 C ATOM 360 O ARG A 57 1.407 11.638 7.339 1.00 64.21 O ATOM 361 CB ARG A 57 -0.580 13.714 8.446 1.00 35.12 C ATOM 362 CG ARG A 57 0.264 14.243 9.606 1.00 24.31 C ATOM 363 CD ARG A 57 -0.497 14.214 10.926 1.00 64.11 C ATOM 364 NE ARG A 57 0.318 14.692 12.043 1.00 13.34 N ATOM 365 CZ ARG A 57 -0.117 14.829 13.267 1.00 11.03 C ATOM 366 NH1 ARG A 57 -1.335 14.508 13.573 1.00 34.14 N ATOM 367 NH2 ARG A 57 0.673 15.275 14.188 1.00 42.43 N ATOM 0 H ARG A 57 -0.764 12.112 6.049 1.00 12.11 H new ATOM 0 HA ARG A 57 0.419 14.706 6.821 1.00 72.12 H new ATOM 0 HB2 ARG A 57 -1.471 14.334 8.346 1.00 35.12 H new ATOM 0 HB3 ARG A 57 -0.918 12.706 8.686 1.00 35.12 H new ATOM 0 HG2 ARG A 57 1.171 13.645 9.697 1.00 24.31 H new ATOM 0 HG3 ARG A 57 0.577 15.265 9.390 1.00 24.31 H new ATOM 0 HD2 ARG A 57 -1.392 14.830 10.841 1.00 64.11 H new ATOM 0 HD3 ARG A 57 -0.829 13.196 11.130 1.00 64.11 H new ATOM 0 HE ARG A 57 1.290 14.934 11.853 1.00 13.34 H new ATOM 0 HH11 ARG A 57 -1.962 14.145 12.855 1.00 34.14 H new ATOM 0 HH12 ARG A 57 -1.666 14.618 14.531 1.00 34.14 H new ATOM 0 HH21 ARG A 57 1.636 15.520 13.959 1.00 42.43 H new ATOM 0 HH22 ARG A 57 0.333 15.382 15.144 1.00 42.43 H new ATOM 381 N LEU A 58 2.592 13.538 7.240 1.00 5.34 N ATOM 382 CA LEU A 58 3.894 12.861 7.261 1.00 21.34 C ATOM 383 C LEU A 58 4.272 12.412 8.685 1.00 54.54 C ATOM 384 O LEU A 58 4.500 13.244 9.566 1.00 61.32 O ATOM 385 CB LEU A 58 4.995 13.784 6.700 1.00 71.43 C ATOM 386 CG LEU A 58 4.830 14.230 5.231 1.00 23.04 C ATOM 387 CD1 LEU A 58 3.662 15.205 5.067 1.00 21.01 C ATOM 388 CD2 LEU A 58 6.125 14.851 4.709 1.00 14.12 C ATOM 0 H LEU A 58 2.648 14.556 7.233 1.00 5.34 H new ATOM 0 HA LEU A 58 3.811 11.975 6.631 1.00 21.34 H new ATOM 0 HB2 LEU A 58 5.045 14.676 7.325 1.00 71.43 H new ATOM 0 HB3 LEU A 58 5.953 13.273 6.797 1.00 71.43 H new ATOM 0 HG LEU A 58 4.605 13.342 4.640 1.00 23.04 H new ATOM 0 HD11 LEU A 58 3.576 15.497 4.020 1.00 21.01 H new ATOM 0 HD12 LEU A 58 2.738 14.723 5.386 1.00 21.01 H new ATOM 0 HD13 LEU A 58 3.839 16.090 5.678 1.00 21.01 H new ATOM 0 HD21 LEU A 58 5.989 15.159 3.672 1.00 14.12 H new ATOM 0 HD22 LEU A 58 6.382 15.720 5.315 1.00 14.12 H new ATOM 0 HD23 LEU A 58 6.929 14.118 4.767 1.00 14.12 H new ATOM 400 N GLY A 59 4.317 11.099 8.914 1.00 40.42 N ATOM 401 CA GLY A 59 4.781 10.573 10.197 1.00 33.44 C ATOM 402 C GLY A 59 3.678 10.411 11.242 1.00 61.11 C ATOM 403 O GLY A 59 3.582 9.372 11.898 1.00 14.54 O ATOM 0 H GLY A 59 4.041 10.388 8.236 1.00 40.42 H new ATOM 0 HA2 GLY A 59 5.254 9.605 10.031 1.00 33.44 H new ATOM 0 HA3 GLY A 59 5.548 11.238 10.594 1.00 33.44 H new ATOM 407 N GLY A 60 2.863 11.449 11.426 1.00 42.23 N ATOM 408 CA GLY A 60 1.748 11.372 12.369 1.00 3.01 C ATOM 409 C GLY A 60 0.633 10.447 11.891 1.00 74.43 C ATOM 410 O GLY A 60 -0.439 10.905 11.506 1.00 52.22 O ATOM 0 H GLY A 60 2.951 12.342 10.942 1.00 42.23 H new ATOM 0 HA2 GLY A 60 2.117 11.021 13.333 1.00 3.01 H new ATOM 0 HA3 GLY A 60 1.342 12.371 12.527 1.00 3.01 H new ATOM 414 N SER A 61 0.892 9.142 11.933 1.00 51.31 N ATOM 415 CA SER A 61 -0.039 8.132 11.409 1.00 65.45 C ATOM 416 C SER A 61 -1.311 8.010 12.266 1.00 71.50 C ATOM 417 O SER A 61 -1.308 7.373 13.323 1.00 13.00 O ATOM 418 CB SER A 61 0.664 6.769 11.318 1.00 12.41 C ATOM 419 OG SER A 61 -0.213 5.756 10.852 1.00 45.12 O ATOM 0 H SER A 61 1.747 8.751 12.328 1.00 51.31 H new ATOM 0 HA SER A 61 -0.346 8.457 10.415 1.00 65.45 H new ATOM 0 HB2 SER A 61 1.520 6.845 10.648 1.00 12.41 H new ATOM 0 HB3 SER A 61 1.050 6.493 12.299 1.00 12.41 H new ATOM 0 HG SER A 61 0.300 5.080 10.362 1.00 45.12 H new ATOM 425 N THR A 62 -2.395 8.629 11.793 1.00 14.24 N ATOM 426 CA THR A 62 -3.699 8.586 12.476 1.00 20.42 C ATOM 427 C THR A 62 -4.858 8.756 11.479 1.00 41.34 C ATOM 428 O THR A 62 -4.654 9.163 10.336 1.00 73.11 O ATOM 429 CB THR A 62 -3.808 9.680 13.567 1.00 21.00 C ATOM 430 OG1 THR A 62 -5.146 9.736 14.089 1.00 1.33 O ATOM 431 CG2 THR A 62 -3.410 11.050 13.021 1.00 43.44 C ATOM 0 H THR A 62 -2.399 9.173 10.930 1.00 14.24 H new ATOM 0 HA THR A 62 -3.770 7.606 12.948 1.00 20.42 H new ATOM 0 HB THR A 62 -3.119 9.416 14.369 1.00 21.00 H new ATOM 0 HG1 THR A 62 -5.199 10.430 14.778 1.00 1.33 H new ATOM 0 HG21 THR A 62 -3.497 11.796 13.811 1.00 43.44 H new ATOM 0 HG22 THR A 62 -2.380 11.015 12.667 1.00 43.44 H new ATOM 0 HG23 THR A 62 -4.069 11.318 12.195 1.00 43.44 H new ATOM 439 N LYS A 63 -6.082 8.462 11.918 1.00 20.14 N ATOM 440 CA LYS A 63 -7.262 8.551 11.043 1.00 55.34 C ATOM 441 C LYS A 63 -7.626 10.008 10.704 1.00 50.40 C ATOM 442 O LYS A 63 -8.515 10.260 9.890 1.00 61.52 O ATOM 443 CB LYS A 63 -8.462 7.841 11.685 1.00 40.24 C ATOM 444 CG LYS A 63 -8.334 6.318 11.696 1.00 12.31 C ATOM 445 CD LYS A 63 -9.549 5.642 12.330 1.00 34.21 C ATOM 446 CE LYS A 63 -9.462 4.122 12.232 1.00 22.32 C ATOM 447 NZ LYS A 63 -10.577 3.448 12.950 1.00 11.41 N ATOM 0 H LYS A 63 -6.287 8.161 12.871 1.00 20.14 H new ATOM 0 HA LYS A 63 -7.007 8.052 10.108 1.00 55.34 H new ATOM 0 HB2 LYS A 63 -8.579 8.195 12.709 1.00 40.24 H new ATOM 0 HB3 LYS A 63 -9.369 8.118 11.147 1.00 40.24 H new ATOM 0 HG2 LYS A 63 -8.212 5.958 10.675 1.00 12.31 H new ATOM 0 HG3 LYS A 63 -7.435 6.034 12.244 1.00 12.31 H new ATOM 0 HD2 LYS A 63 -9.624 5.936 13.377 1.00 34.21 H new ATOM 0 HD3 LYS A 63 -10.457 5.987 11.836 1.00 34.21 H new ATOM 0 HE2 LYS A 63 -9.476 3.826 11.183 1.00 22.32 H new ATOM 0 HE3 LYS A 63 -8.511 3.787 12.645 1.00 22.32 H new ATOM 0 HZ1 LYS A 63 -10.206 2.637 13.485 1.00 11.41 H new ATOM 0 HZ2 LYS A 63 -11.024 4.120 13.606 1.00 11.41 H new ATOM 0 HZ3 LYS A 63 -11.282 3.115 12.262 1.00 11.41 H new ATOM 461 N LYS A 64 -6.941 10.963 11.330 1.00 42.23 N ATOM 462 CA LYS A 64 -7.129 12.387 11.013 1.00 24.30 C ATOM 463 C LYS A 64 -5.958 12.924 10.170 1.00 51.10 C ATOM 464 O LYS A 64 -5.813 14.132 9.976 1.00 24.03 O ATOM 465 CB LYS A 64 -7.286 13.199 12.309 1.00 50.03 C ATOM 466 CG LYS A 64 -8.463 12.747 13.176 1.00 52.13 C ATOM 467 CD LYS A 64 -9.787 12.783 12.410 1.00 52.01 C ATOM 468 CE LYS A 64 -10.949 12.264 13.252 1.00 23.55 C ATOM 469 NZ LYS A 64 -11.226 13.135 14.425 1.00 30.33 N ATOM 0 H LYS A 64 -6.251 10.782 12.059 1.00 42.23 H new ATOM 0 HA LYS A 64 -8.039 12.492 10.422 1.00 24.30 H new ATOM 0 HB2 LYS A 64 -6.367 13.122 12.890 1.00 50.03 H new ATOM 0 HB3 LYS A 64 -7.415 14.251 12.055 1.00 50.03 H new ATOM 0 HG2 LYS A 64 -8.280 11.735 13.536 1.00 52.13 H new ATOM 0 HG3 LYS A 64 -8.534 13.389 14.054 1.00 52.13 H new ATOM 0 HD2 LYS A 64 -9.996 13.805 12.095 1.00 52.01 H new ATOM 0 HD3 LYS A 64 -9.699 12.182 11.505 1.00 52.01 H new ATOM 0 HE2 LYS A 64 -11.843 12.197 12.632 1.00 23.55 H new ATOM 0 HE3 LYS A 64 -10.724 11.255 13.596 1.00 23.55 H new ATOM 0 HZ1 LYS A 64 -12.084 12.802 14.910 1.00 30.33 H new ATOM 0 HZ2 LYS A 64 -10.421 13.099 15.082 1.00 30.33 H new ATOM 0 HZ3 LYS A 64 -11.367 14.114 14.105 1.00 30.33 H new ATOM 483 N GLY A 65 -5.139 12.005 9.657 1.00 20.15 N ATOM 484 CA GLY A 65 -3.987 12.371 8.836 1.00 4.42 C ATOM 485 C GLY A 65 -2.918 11.281 8.821 1.00 64.13 C ATOM 486 O GLY A 65 -2.478 10.832 9.876 1.00 2.54 O ATOM 0 H GLY A 65 -5.253 11.001 9.796 1.00 20.15 H new ATOM 0 HA2 GLY A 65 -4.318 12.567 7.816 1.00 4.42 H new ATOM 0 HA3 GLY A 65 -3.554 13.297 9.214 1.00 4.42 H new ATOM 490 N ILE A 66 -2.497 10.846 7.632 1.00 4.21 N ATOM 491 CA ILE A 66 -1.508 9.763 7.517 1.00 64.42 C ATOM 492 C ILE A 66 -0.791 9.783 6.152 1.00 31.11 C ATOM 493 O ILE A 66 -1.326 10.302 5.172 1.00 13.24 O ATOM 494 CB ILE A 66 -2.193 8.388 7.728 1.00 3.02 C ATOM 495 CG1 ILE A 66 -1.154 7.267 7.848 1.00 70.40 C ATOM 496 CG2 ILE A 66 -3.176 8.095 6.595 1.00 63.24 C ATOM 497 CD1 ILE A 66 -1.756 5.926 8.217 1.00 44.42 C ATOM 0 H ILE A 66 -2.820 11.221 6.740 1.00 4.21 H new ATOM 0 HA ILE A 66 -0.758 9.922 8.292 1.00 64.42 H new ATOM 0 HB ILE A 66 -2.751 8.430 8.664 1.00 3.02 H new ATOM 0 HG12 ILE A 66 -0.623 7.171 6.901 1.00 70.40 H new ATOM 0 HG13 ILE A 66 -0.416 7.545 8.600 1.00 70.40 H new ATOM 0 HG21 ILE A 66 -3.646 7.126 6.762 1.00 63.24 H new ATOM 0 HG22 ILE A 66 -3.942 8.870 6.569 1.00 63.24 H new ATOM 0 HG23 ILE A 66 -2.642 8.080 5.645 1.00 63.24 H new ATOM 0 HD11 ILE A 66 -0.965 5.179 8.285 1.00 44.42 H new ATOM 0 HD12 ILE A 66 -2.263 6.007 9.179 1.00 44.42 H new ATOM 0 HD13 ILE A 66 -2.473 5.627 7.453 1.00 44.42 H new ATOM 509 N ASP A 67 0.431 9.241 6.095 1.00 14.40 N ATOM 510 CA ASP A 67 1.199 9.200 4.843 1.00 64.53 C ATOM 511 C ASP A 67 1.184 7.802 4.193 1.00 75.14 C ATOM 512 O ASP A 67 0.607 6.854 4.729 1.00 13.22 O ATOM 513 CB ASP A 67 2.645 9.652 5.092 1.00 24.53 C ATOM 514 CG ASP A 67 3.412 8.688 5.977 1.00 61.55 C ATOM 515 OD1 ASP A 67 3.323 8.816 7.216 1.00 2.40 O ATOM 516 OD2 ASP A 67 4.099 7.798 5.430 1.00 43.20 O ATOM 0 H ASP A 67 0.908 8.827 6.896 1.00 14.40 H new ATOM 0 HA ASP A 67 0.718 9.887 4.147 1.00 64.53 H new ATOM 0 HB2 ASP A 67 3.160 9.751 4.137 1.00 24.53 H new ATOM 0 HB3 ASP A 67 2.639 10.639 5.555 1.00 24.53 H new ATOM 521 N CYS A 68 1.831 7.695 3.029 1.00 34.03 N ATOM 522 CA CYS A 68 1.881 6.441 2.257 1.00 64.23 C ATOM 523 C CYS A 68 2.489 5.277 3.056 1.00 21.30 C ATOM 524 O CYS A 68 1.879 4.209 3.178 1.00 51.31 O ATOM 525 CB CYS A 68 2.682 6.654 0.967 1.00 53.12 C ATOM 526 SG CYS A 68 3.093 5.133 0.079 1.00 64.11 S ATOM 0 H CYS A 68 2.334 8.468 2.593 1.00 34.03 H new ATOM 0 HA CYS A 68 0.852 6.170 2.021 1.00 64.23 H new ATOM 0 HB2 CYS A 68 2.112 7.304 0.304 1.00 53.12 H new ATOM 0 HB3 CYS A 68 3.606 7.178 1.211 1.00 53.12 H new ATOM 0 HG CYS A 68 1.999 4.549 -0.310 1.00 64.11 H new ATOM 532 N SER A 69 3.678 5.488 3.613 1.00 25.13 N ATOM 533 CA SER A 69 4.387 4.431 4.351 1.00 54.34 C ATOM 534 C SER A 69 3.665 4.111 5.666 1.00 22.24 C ATOM 535 O SER A 69 3.484 2.943 6.030 1.00 52.51 O ATOM 536 CB SER A 69 5.835 4.855 4.636 1.00 4.11 C ATOM 537 OG SER A 69 6.592 3.786 5.181 1.00 10.32 O ATOM 0 H SER A 69 4.175 6.377 3.571 1.00 25.13 H new ATOM 0 HA SER A 69 4.398 3.533 3.733 1.00 54.34 H new ATOM 0 HB2 SER A 69 6.302 5.200 3.714 1.00 4.11 H new ATOM 0 HB3 SER A 69 5.839 5.696 5.330 1.00 4.11 H new ATOM 0 HG SER A 69 6.708 3.925 6.144 1.00 10.32 H new ATOM 543 N GLY A 70 3.237 5.162 6.364 1.00 22.03 N ATOM 544 CA GLY A 70 2.480 4.994 7.596 1.00 0.32 C ATOM 545 C GLY A 70 1.183 4.211 7.402 1.00 11.41 C ATOM 546 O GLY A 70 0.754 3.475 8.293 1.00 33.41 O ATOM 0 H GLY A 70 3.402 6.132 6.096 1.00 22.03 H new ATOM 0 HA2 GLY A 70 3.101 4.480 8.329 1.00 0.32 H new ATOM 0 HA3 GLY A 70 2.246 5.976 8.008 1.00 0.32 H new ATOM 550 N PHE A 71 0.551 4.367 6.238 1.00 11.10 N ATOM 551 CA PHE A 71 -0.706 3.672 5.949 1.00 32.04 C ATOM 552 C PHE A 71 -0.509 2.159 5.801 1.00 41.12 C ATOM 553 O PHE A 71 -1.244 1.365 6.401 1.00 14.42 O ATOM 554 CB PHE A 71 -1.368 4.236 4.684 1.00 74.31 C ATOM 555 CG PHE A 71 -2.647 3.520 4.322 1.00 12.11 C ATOM 556 CD1 PHE A 71 -3.781 3.656 5.112 1.00 74.51 C ATOM 557 CD2 PHE A 71 -2.710 2.695 3.207 1.00 22.43 C ATOM 558 CE1 PHE A 71 -4.949 2.990 4.796 1.00 12.41 C ATOM 559 CE2 PHE A 71 -3.876 2.024 2.889 1.00 34.41 C ATOM 560 CZ PHE A 71 -4.996 2.173 3.683 1.00 22.10 C ATOM 0 H PHE A 71 0.886 4.965 5.483 1.00 11.10 H new ATOM 0 HA PHE A 71 -1.361 3.843 6.803 1.00 32.04 H new ATOM 0 HB2 PHE A 71 -1.580 5.295 4.832 1.00 74.31 H new ATOM 0 HB3 PHE A 71 -0.669 4.164 3.851 1.00 74.31 H new ATOM 0 HD1 PHE A 71 -3.749 4.291 5.985 1.00 74.51 H new ATOM 0 HD2 PHE A 71 -1.838 2.576 2.581 1.00 22.43 H new ATOM 0 HE1 PHE A 71 -5.824 3.108 5.418 1.00 12.41 H new ATOM 0 HE2 PHE A 71 -3.911 1.384 2.020 1.00 34.41 H new ATOM 0 HZ PHE A 71 -5.908 1.651 3.434 1.00 22.10 H new ATOM 570 N VAL A 72 0.475 1.755 5.003 1.00 11.12 N ATOM 571 CA VAL A 72 0.708 0.332 4.749 1.00 40.21 C ATOM 572 C VAL A 72 1.063 -0.429 6.040 1.00 54.34 C ATOM 573 O VAL A 72 0.531 -1.512 6.296 1.00 62.15 O ATOM 574 CB VAL A 72 1.800 0.110 3.666 1.00 70.12 C ATOM 575 CG1 VAL A 72 3.149 0.670 4.103 1.00 51.21 C ATOM 576 CG2 VAL A 72 1.914 -1.369 3.309 1.00 11.33 C ATOM 0 H VAL A 72 1.120 2.384 4.524 1.00 11.12 H new ATOM 0 HA VAL A 72 -0.229 -0.073 4.368 1.00 40.21 H new ATOM 0 HB VAL A 72 1.494 0.657 2.774 1.00 70.12 H new ATOM 0 HG11 VAL A 72 3.886 0.496 3.320 1.00 51.21 H new ATOM 0 HG12 VAL A 72 3.057 1.741 4.283 1.00 51.21 H new ATOM 0 HG13 VAL A 72 3.469 0.174 5.019 1.00 51.21 H new ATOM 0 HG21 VAL A 72 2.684 -1.502 2.549 1.00 11.33 H new ATOM 0 HG22 VAL A 72 2.181 -1.939 4.199 1.00 11.33 H new ATOM 0 HG23 VAL A 72 0.959 -1.725 2.923 1.00 11.33 H new ATOM 586 N GLN A 73 1.934 0.151 6.873 1.00 4.32 N ATOM 587 CA GLN A 73 2.317 -0.489 8.139 1.00 11.21 C ATOM 588 C GLN A 73 1.112 -0.620 9.093 1.00 72.21 C ATOM 589 O GLN A 73 0.970 -1.625 9.796 1.00 42.13 O ATOM 590 CB GLN A 73 3.475 0.274 8.810 1.00 75.53 C ATOM 591 CG GLN A 73 3.139 1.704 9.214 1.00 33.42 C ATOM 592 CD GLN A 73 4.355 2.477 9.703 1.00 33.21 C ATOM 593 OE1 GLN A 73 5.042 3.126 8.930 1.00 41.22 O ATOM 594 NE2 GLN A 73 4.630 2.416 10.990 1.00 70.03 N ATOM 0 H GLN A 73 2.383 1.050 6.698 1.00 4.32 H new ATOM 0 HA GLN A 73 2.663 -1.497 7.910 1.00 11.21 H new ATOM 0 HB2 GLN A 73 3.790 -0.276 9.697 1.00 75.53 H new ATOM 0 HB3 GLN A 73 4.325 0.293 8.128 1.00 75.53 H new ATOM 0 HG2 GLN A 73 2.701 2.224 8.362 1.00 33.42 H new ATOM 0 HG3 GLN A 73 2.384 1.687 10.000 1.00 33.42 H new ATOM 0 HE21 GLN A 73 4.038 1.866 11.612 1.00 70.03 H new ATOM 0 HE22 GLN A 73 5.435 2.919 11.364 1.00 70.03 H new ATOM 603 N ARG A 74 0.238 0.398 9.105 1.00 43.14 N ATOM 604 CA ARG A 74 -1.016 0.333 9.871 1.00 22.11 C ATOM 605 C ARG A 74 -1.895 -0.835 9.404 1.00 53.52 C ATOM 606 O ARG A 74 -2.114 -1.790 10.143 1.00 1.10 O ATOM 607 CB ARG A 74 -1.810 1.645 9.734 1.00 62.12 C ATOM 608 CG ARG A 74 -1.239 2.823 10.516 1.00 40.41 C ATOM 609 CD ARG A 74 -1.459 2.688 12.023 1.00 22.33 C ATOM 610 NE ARG A 74 -0.997 3.875 12.743 1.00 72.22 N ATOM 611 CZ ARG A 74 -0.774 3.925 14.028 1.00 23.52 C ATOM 612 NH1 ARG A 74 -0.940 2.882 14.775 1.00 73.35 N ATOM 613 NH2 ARG A 74 -0.384 5.030 14.570 1.00 44.12 N ATOM 0 H ARG A 74 0.375 1.271 8.596 1.00 43.14 H new ATOM 0 HA ARG A 74 -0.746 0.178 10.916 1.00 22.11 H new ATOM 0 HB2 ARG A 74 -1.857 1.916 8.679 1.00 62.12 H new ATOM 0 HB3 ARG A 74 -2.834 1.470 10.064 1.00 62.12 H new ATOM 0 HG2 ARG A 74 -0.171 2.905 10.314 1.00 40.41 H new ATOM 0 HG3 ARG A 74 -1.702 3.746 10.166 1.00 40.41 H new ATOM 0 HD2 ARG A 74 -2.519 2.529 12.224 1.00 22.33 H new ATOM 0 HD3 ARG A 74 -0.930 1.809 12.391 1.00 22.33 H new ATOM 0 HE ARG A 74 -0.838 4.725 12.202 1.00 72.22 H new ATOM 0 HH11 ARG A 74 -1.250 2.003 14.361 1.00 73.35 H new ATOM 0 HH12 ARG A 74 -0.761 2.939 15.778 1.00 73.35 H new ATOM 0 HH21 ARG A 74 -0.251 5.861 13.994 1.00 44.12 H new ATOM 0 HH22 ARG A 74 -0.209 5.072 15.574 1.00 44.12 H new ATOM 627 N THR A 75 -2.375 -0.751 8.163 1.00 55.05 N ATOM 628 CA THR A 75 -3.317 -1.738 7.606 1.00 44.12 C ATOM 629 C THR A 75 -2.919 -3.187 7.919 1.00 11.01 C ATOM 630 O THR A 75 -3.754 -3.993 8.343 1.00 31.32 O ATOM 631 CB THR A 75 -3.453 -1.570 6.075 1.00 11.15 C ATOM 632 OG1 THR A 75 -3.965 -0.260 5.778 1.00 75.12 O ATOM 633 CG2 THR A 75 -4.378 -2.627 5.471 1.00 64.20 C ATOM 0 H THR A 75 -2.127 -0.004 7.514 1.00 55.05 H new ATOM 0 HA THR A 75 -4.275 -1.542 8.088 1.00 44.12 H new ATOM 0 HB THR A 75 -2.464 -1.696 5.635 1.00 11.15 H new ATOM 0 HG1 THR A 75 -3.254 0.404 5.899 1.00 75.12 H new ATOM 0 HG21 THR A 75 -4.448 -2.476 4.394 1.00 64.20 H new ATOM 0 HG22 THR A 75 -3.976 -3.620 5.673 1.00 64.20 H new ATOM 0 HG23 THR A 75 -5.370 -2.539 5.915 1.00 64.20 H new ATOM 641 N PHE A 76 -1.644 -3.515 7.728 1.00 34.01 N ATOM 642 CA PHE A 76 -1.163 -4.877 7.971 1.00 42.12 C ATOM 643 C PHE A 76 -1.188 -5.260 9.464 1.00 0.40 C ATOM 644 O PHE A 76 -1.612 -6.367 9.807 1.00 11.31 O ATOM 645 CB PHE A 76 0.235 -5.069 7.370 1.00 51.33 C ATOM 646 CG PHE A 76 0.200 -5.349 5.888 1.00 65.03 C ATOM 647 CD1 PHE A 76 0.117 -6.653 5.420 1.00 61.35 C ATOM 648 CD2 PHE A 76 0.235 -4.315 4.964 1.00 11.32 C ATOM 649 CE1 PHE A 76 0.069 -6.919 4.067 1.00 31.15 C ATOM 650 CE2 PHE A 76 0.189 -4.577 3.609 1.00 24.45 C ATOM 651 CZ PHE A 76 0.106 -5.880 3.160 1.00 5.41 C ATOM 0 H PHE A 76 -0.928 -2.863 7.408 1.00 34.01 H new ATOM 0 HA PHE A 76 -1.854 -5.555 7.470 1.00 42.12 H new ATOM 0 HB2 PHE A 76 0.830 -4.174 7.552 1.00 51.33 H new ATOM 0 HB3 PHE A 76 0.735 -5.893 7.879 1.00 51.33 H new ATOM 0 HD1 PHE A 76 0.090 -7.471 6.125 1.00 61.35 H new ATOM 0 HD2 PHE A 76 0.299 -3.293 5.308 1.00 11.32 H new ATOM 0 HE1 PHE A 76 0.003 -7.939 3.718 1.00 31.15 H new ATOM 0 HE2 PHE A 76 0.218 -3.763 2.900 1.00 24.45 H new ATOM 0 HZ PHE A 76 0.070 -6.086 2.100 1.00 5.41 H new ATOM 661 N ARG A 77 -0.759 -4.364 10.362 1.00 63.13 N ATOM 662 CA ARG A 77 -0.794 -4.678 11.803 1.00 73.23 C ATOM 663 C ARG A 77 -2.235 -4.680 12.347 1.00 40.33 C ATOM 664 O ARG A 77 -2.552 -5.413 13.285 1.00 43.31 O ATOM 665 CB ARG A 77 0.078 -3.716 12.629 1.00 31.03 C ATOM 666 CG ARG A 77 -0.373 -2.259 12.598 1.00 22.33 C ATOM 667 CD ARG A 77 0.260 -1.444 13.725 1.00 11.50 C ATOM 668 NE ARG A 77 1.719 -1.565 13.751 1.00 53.01 N ATOM 669 CZ ARG A 77 2.436 -1.531 14.845 1.00 52.23 C ATOM 670 NH1 ARG A 77 1.872 -1.409 16.000 1.00 32.32 N ATOM 671 NH2 ARG A 77 3.722 -1.630 14.782 1.00 2.24 N ATOM 0 H ARG A 77 -0.393 -3.441 10.130 1.00 63.13 H new ATOM 0 HA ARG A 77 -0.380 -5.681 11.907 1.00 73.23 H new ATOM 0 HB2 ARG A 77 0.090 -4.056 13.664 1.00 31.03 H new ATOM 0 HB3 ARG A 77 1.103 -3.772 12.263 1.00 31.03 H new ATOM 0 HG2 ARG A 77 -0.108 -1.817 11.637 1.00 22.33 H new ATOM 0 HG3 ARG A 77 -1.459 -2.213 12.682 1.00 22.33 H new ATOM 0 HD2 ARG A 77 -0.013 -0.395 13.608 1.00 11.50 H new ATOM 0 HD3 ARG A 77 -0.146 -1.775 14.681 1.00 11.50 H new ATOM 0 HE ARG A 77 2.206 -1.683 12.863 1.00 53.01 H new ATOM 0 HH11 ARG A 77 0.857 -1.338 16.067 1.00 32.32 H new ATOM 0 HH12 ARG A 77 2.442 -1.384 16.846 1.00 32.32 H new ATOM 0 HH21 ARG A 77 4.182 -1.735 13.878 1.00 2.24 H new ATOM 0 HH22 ARG A 77 4.278 -1.603 15.637 1.00 2.24 H new ATOM 685 N GLU A 78 -3.103 -3.863 11.752 1.00 73.14 N ATOM 686 CA GLU A 78 -4.511 -3.785 12.164 1.00 41.43 C ATOM 687 C GLU A 78 -5.267 -5.080 11.824 1.00 24.32 C ATOM 688 O GLU A 78 -5.938 -5.665 12.677 1.00 21.02 O ATOM 689 CB GLU A 78 -5.202 -2.586 11.491 1.00 52.13 C ATOM 690 CG GLU A 78 -4.572 -1.232 11.816 1.00 41.24 C ATOM 691 CD GLU A 78 -4.626 -0.886 13.297 1.00 64.30 C ATOM 692 OE1 GLU A 78 -3.745 -1.341 14.054 1.00 73.43 O ATOM 693 OE2 GLU A 78 -5.547 -0.154 13.710 1.00 1.43 O ATOM 0 H GLU A 78 -2.859 -3.242 10.980 1.00 73.14 H new ATOM 0 HA GLU A 78 -4.531 -3.651 13.246 1.00 41.43 H new ATOM 0 HB2 GLU A 78 -5.185 -2.731 10.411 1.00 52.13 H new ATOM 0 HB3 GLU A 78 -6.249 -2.568 11.794 1.00 52.13 H new ATOM 0 HG2 GLU A 78 -3.533 -1.234 11.488 1.00 41.24 H new ATOM 0 HG3 GLU A 78 -5.084 -0.455 11.249 1.00 41.24 H new ATOM 700 N GLN A 79 -5.148 -5.525 10.573 1.00 64.43 N ATOM 701 CA GLN A 79 -5.863 -6.723 10.104 1.00 51.42 C ATOM 702 C GLN A 79 -5.069 -8.018 10.356 1.00 53.11 C ATOM 703 O GLN A 79 -5.518 -8.899 11.088 1.00 72.23 O ATOM 704 CB GLN A 79 -6.182 -6.596 8.605 1.00 44.30 C ATOM 705 CG GLN A 79 -7.161 -5.476 8.269 1.00 34.11 C ATOM 706 CD GLN A 79 -8.555 -5.719 8.827 1.00 63.34 C ATOM 707 OE1 GLN A 79 -9.397 -6.326 8.176 1.00 3.13 O ATOM 708 NE2 GLN A 79 -8.813 -5.249 10.030 1.00 52.13 N ATOM 0 H GLN A 79 -4.566 -5.079 9.864 1.00 64.43 H new ATOM 0 HA GLN A 79 -6.788 -6.788 10.678 1.00 51.42 H new ATOM 0 HB2 GLN A 79 -5.253 -6.428 8.060 1.00 44.30 H new ATOM 0 HB3 GLN A 79 -6.593 -7.541 8.251 1.00 44.30 H new ATOM 0 HG2 GLN A 79 -6.777 -4.535 8.662 1.00 34.11 H new ATOM 0 HG3 GLN A 79 -7.223 -5.367 7.186 1.00 34.11 H new ATOM 0 HE21 GLN A 79 -8.091 -4.748 10.547 1.00 52.13 H new ATOM 0 HE22 GLN A 79 -9.735 -5.386 10.444 1.00 52.13 H new ATOM 717 N PHE A 80 -3.888 -8.124 9.751 1.00 13.51 N ATOM 718 CA PHE A 80 -3.115 -9.376 9.770 1.00 41.50 C ATOM 719 C PHE A 80 -2.110 -9.431 10.933 1.00 44.21 C ATOM 720 O PHE A 80 -1.420 -10.436 11.119 1.00 53.53 O ATOM 721 CB PHE A 80 -2.377 -9.544 8.433 1.00 12.33 C ATOM 722 CG PHE A 80 -3.290 -9.454 7.236 1.00 13.35 C ATOM 723 CD1 PHE A 80 -4.073 -10.538 6.860 1.00 52.41 C ATOM 724 CD2 PHE A 80 -3.381 -8.281 6.497 1.00 30.40 C ATOM 725 CE1 PHE A 80 -4.920 -10.454 5.773 1.00 34.03 C ATOM 726 CE2 PHE A 80 -4.228 -8.195 5.410 1.00 53.35 C ATOM 727 CZ PHE A 80 -4.997 -9.281 5.048 1.00 31.11 C ATOM 0 H PHE A 80 -3.441 -7.362 9.241 1.00 13.51 H new ATOM 0 HA PHE A 80 -3.820 -10.194 9.917 1.00 41.50 H new ATOM 0 HB2 PHE A 80 -1.606 -8.778 8.352 1.00 12.33 H new ATOM 0 HB3 PHE A 80 -1.870 -10.509 8.424 1.00 12.33 H new ATOM 0 HD1 PHE A 80 -4.019 -11.457 7.425 1.00 52.41 H new ATOM 0 HD2 PHE A 80 -2.782 -7.427 6.776 1.00 30.40 H new ATOM 0 HE1 PHE A 80 -5.522 -11.305 5.490 1.00 34.03 H new ATOM 0 HE2 PHE A 80 -4.288 -7.278 4.843 1.00 53.35 H new ATOM 0 HZ PHE A 80 -5.659 -9.214 4.198 1.00 31.11 H new ATOM 737 N GLY A 81 -2.022 -8.350 11.707 1.00 32.12 N ATOM 738 CA GLY A 81 -1.067 -8.291 12.810 1.00 33.34 C ATOM 739 C GLY A 81 0.384 -8.288 12.337 1.00 14.10 C ATOM 740 O GLY A 81 1.292 -8.666 13.080 1.00 33.42 O ATOM 0 H GLY A 81 -2.594 -7.513 11.592 1.00 32.12 H new ATOM 0 HA2 GLY A 81 -1.254 -7.393 13.399 1.00 33.34 H new ATOM 0 HA3 GLY A 81 -1.228 -9.144 13.469 1.00 33.34 H new ATOM 744 N LEU A 82 0.601 -7.858 11.097 1.00 21.13 N ATOM 745 CA LEU A 82 1.946 -7.808 10.514 1.00 42.53 C ATOM 746 C LEU A 82 2.563 -6.410 10.678 1.00 31.44 C ATOM 747 O LEU A 82 2.065 -5.430 10.123 1.00 21.24 O ATOM 748 CB LEU A 82 1.892 -8.189 9.026 1.00 35.45 C ATOM 749 CG LEU A 82 3.259 -8.313 8.334 1.00 20.10 C ATOM 750 CD1 LEU A 82 4.046 -9.496 8.894 1.00 74.12 C ATOM 751 CD2 LEU A 82 3.086 -8.446 6.825 1.00 15.34 C ATOM 0 H LEU A 82 -0.138 -7.537 10.471 1.00 21.13 H new ATOM 0 HA LEU A 82 2.574 -8.524 11.043 1.00 42.53 H new ATOM 0 HB2 LEU A 82 1.366 -9.139 8.929 1.00 35.45 H new ATOM 0 HB3 LEU A 82 1.301 -7.442 8.497 1.00 35.45 H new ATOM 0 HG LEU A 82 3.826 -7.404 8.535 1.00 20.10 H new ATOM 0 HD11 LEU A 82 5.010 -9.564 8.389 1.00 74.12 H new ATOM 0 HD12 LEU A 82 4.206 -9.354 9.963 1.00 74.12 H new ATOM 0 HD13 LEU A 82 3.485 -10.416 8.730 1.00 74.12 H new ATOM 0 HD21 LEU A 82 4.065 -8.533 6.353 1.00 15.34 H new ATOM 0 HD22 LEU A 82 2.496 -9.335 6.603 1.00 15.34 H new ATOM 0 HD23 LEU A 82 2.573 -7.565 6.439 1.00 15.34 H new ATOM 763 N GLU A 83 3.650 -6.322 11.440 1.00 54.05 N ATOM 764 CA GLU A 83 4.294 -5.034 11.718 1.00 12.23 C ATOM 765 C GLU A 83 5.382 -4.696 10.689 1.00 73.30 C ATOM 766 O GLU A 83 6.482 -5.254 10.715 1.00 11.15 O ATOM 767 CB GLU A 83 4.893 -5.022 13.132 1.00 71.14 C ATOM 768 CG GLU A 83 3.849 -4.972 14.246 1.00 52.44 C ATOM 769 CD GLU A 83 4.470 -4.773 15.622 1.00 52.40 C ATOM 770 OE1 GLU A 83 5.252 -3.811 15.795 1.00 60.41 O ATOM 771 OE2 GLU A 83 4.168 -5.563 16.541 1.00 2.42 O ATOM 0 H GLU A 83 4.105 -7.123 11.877 1.00 54.05 H new ATOM 0 HA GLU A 83 3.519 -4.270 11.646 1.00 12.23 H new ATOM 0 HB2 GLU A 83 5.508 -5.913 13.263 1.00 71.14 H new ATOM 0 HB3 GLU A 83 5.555 -4.161 13.228 1.00 71.14 H new ATOM 0 HG2 GLU A 83 3.149 -4.161 14.047 1.00 52.44 H new ATOM 0 HG3 GLU A 83 3.274 -5.898 14.242 1.00 52.44 H new ATOM 778 N LEU A 84 5.056 -3.784 9.777 1.00 64.31 N ATOM 779 CA LEU A 84 6.028 -3.265 8.812 1.00 72.42 C ATOM 780 C LEU A 84 6.760 -2.041 9.389 1.00 25.23 C ATOM 781 O LEU A 84 6.183 -1.281 10.168 1.00 25.43 O ATOM 782 CB LEU A 84 5.323 -2.893 7.498 1.00 61.21 C ATOM 783 CG LEU A 84 4.601 -4.052 6.792 1.00 34.01 C ATOM 784 CD1 LEU A 84 3.909 -3.558 5.523 1.00 71.52 C ATOM 785 CD2 LEU A 84 5.575 -5.186 6.475 1.00 45.40 C ATOM 0 H LEU A 84 4.122 -3.386 9.684 1.00 64.31 H new ATOM 0 HA LEU A 84 6.764 -4.043 8.608 1.00 72.42 H new ATOM 0 HB2 LEU A 84 4.598 -2.106 7.704 1.00 61.21 H new ATOM 0 HB3 LEU A 84 6.061 -2.475 6.814 1.00 61.21 H new ATOM 0 HG LEU A 84 3.839 -4.443 7.466 1.00 34.01 H new ATOM 0 HD11 LEU A 84 3.403 -4.392 5.036 1.00 71.52 H new ATOM 0 HD12 LEU A 84 3.179 -2.791 5.782 1.00 71.52 H new ATOM 0 HD13 LEU A 84 4.651 -3.138 4.844 1.00 71.52 H new ATOM 0 HD21 LEU A 84 5.042 -5.995 5.976 1.00 45.40 H new ATOM 0 HD22 LEU A 84 6.365 -4.815 5.822 1.00 45.40 H new ATOM 0 HD23 LEU A 84 6.014 -5.558 7.401 1.00 45.40 H new ATOM 797 N PRO A 85 8.046 -1.844 9.036 1.00 24.21 N ATOM 798 CA PRO A 85 8.849 -0.718 9.555 1.00 52.32 C ATOM 799 C PRO A 85 8.310 0.667 9.144 1.00 1.53 C ATOM 800 O PRO A 85 7.407 0.781 8.314 1.00 1.03 O ATOM 801 CB PRO A 85 10.242 -0.965 8.959 1.00 61.02 C ATOM 802 CG PRO A 85 10.006 -1.839 7.775 1.00 72.41 C ATOM 803 CD PRO A 85 8.824 -2.699 8.125 1.00 32.23 C ATOM 0 HA PRO A 85 8.834 -0.691 10.645 1.00 52.32 H new ATOM 0 HB2 PRO A 85 10.719 -0.029 8.669 1.00 61.02 H new ATOM 0 HB3 PRO A 85 10.900 -1.448 9.681 1.00 61.02 H new ATOM 0 HG2 PRO A 85 9.805 -1.244 6.884 1.00 72.41 H new ATOM 0 HG3 PRO A 85 10.883 -2.450 7.560 1.00 72.41 H new ATOM 0 HD2 PRO A 85 8.249 -2.973 7.240 1.00 32.23 H new ATOM 0 HD3 PRO A 85 9.130 -3.628 8.607 1.00 32.23 H new ATOM 811 N ARG A 86 8.906 1.713 9.716 1.00 14.50 N ATOM 812 CA ARG A 86 8.380 3.084 9.613 1.00 52.40 C ATOM 813 C ARG A 86 8.465 3.661 8.184 1.00 11.32 C ATOM 814 O ARG A 86 7.498 4.230 7.683 1.00 23.25 O ATOM 815 CB ARG A 86 9.141 3.978 10.613 1.00 15.22 C ATOM 816 CG ARG A 86 8.513 5.349 10.885 1.00 32.43 C ATOM 817 CD ARG A 86 8.812 6.368 9.788 1.00 4.52 C ATOM 818 NE ARG A 86 8.326 7.700 10.136 1.00 24.13 N ATOM 819 CZ ARG A 86 8.724 8.799 9.558 1.00 41.40 C ATOM 820 NH1 ARG A 86 9.579 8.764 8.585 1.00 73.42 N ATOM 821 NH2 ARG A 86 8.256 9.935 9.954 1.00 44.13 N ATOM 0 H ARG A 86 9.764 1.640 10.263 1.00 14.50 H new ATOM 0 HA ARG A 86 7.318 3.058 9.856 1.00 52.40 H new ATOM 0 HB2 ARG A 86 9.227 3.443 11.559 1.00 15.22 H new ATOM 0 HB3 ARG A 86 10.154 4.130 10.240 1.00 15.22 H new ATOM 0 HG2 ARG A 86 7.433 5.235 10.984 1.00 32.43 H new ATOM 0 HG3 ARG A 86 8.882 5.729 11.838 1.00 32.43 H new ATOM 0 HD2 ARG A 86 9.887 6.408 9.613 1.00 4.52 H new ATOM 0 HD3 ARG A 86 8.349 6.045 8.856 1.00 4.52 H new ATOM 0 HE ARG A 86 7.631 7.776 10.879 1.00 24.13 H new ATOM 0 HH11 ARG A 86 9.949 7.870 8.263 1.00 73.42 H new ATOM 0 HH12 ARG A 86 9.882 9.631 8.141 1.00 73.42 H new ATOM 0 HH21 ARG A 86 7.578 9.970 10.716 1.00 44.13 H new ATOM 0 HH22 ARG A 86 8.564 10.798 9.505 1.00 44.13 H new ATOM 835 N SER A 87 9.626 3.548 7.540 1.00 74.40 N ATOM 836 CA SER A 87 9.827 4.138 6.203 1.00 0.22 C ATOM 837 C SER A 87 9.901 3.065 5.105 1.00 72.44 C ATOM 838 O SER A 87 10.454 1.983 5.317 1.00 51.55 O ATOM 839 CB SER A 87 11.108 4.987 6.178 1.00 31.11 C ATOM 840 OG SER A 87 11.072 6.011 7.164 1.00 50.31 O ATOM 0 H SER A 87 10.440 3.059 7.913 1.00 74.40 H new ATOM 0 HA SER A 87 8.963 4.771 5.999 1.00 0.22 H new ATOM 0 HB2 SER A 87 11.974 4.347 6.348 1.00 31.11 H new ATOM 0 HB3 SER A 87 11.231 5.434 5.191 1.00 31.11 H new ATOM 0 HG SER A 87 11.901 6.533 7.124 1.00 50.31 H new ATOM 846 N THR A 88 9.358 3.385 3.925 1.00 54.43 N ATOM 847 CA THR A 88 9.368 2.467 2.764 1.00 30.53 C ATOM 848 C THR A 88 10.732 1.823 2.530 1.00 21.31 C ATOM 849 O THR A 88 10.826 0.625 2.263 1.00 14.23 O ATOM 850 CB THR A 88 8.976 3.186 1.453 1.00 65.11 C ATOM 851 OG1 THR A 88 9.774 4.367 1.271 1.00 10.13 O ATOM 852 CG2 THR A 88 7.508 3.558 1.446 1.00 54.22 C ATOM 0 H THR A 88 8.901 4.278 3.741 1.00 54.43 H new ATOM 0 HA THR A 88 8.636 1.700 3.015 1.00 30.53 H new ATOM 0 HB THR A 88 9.160 2.495 0.631 1.00 65.11 H new ATOM 0 HG1 THR A 88 9.348 4.951 0.609 1.00 10.13 H new ATOM 0 HG21 THR A 88 7.265 4.062 0.511 1.00 54.22 H new ATOM 0 HG22 THR A 88 6.904 2.656 1.540 1.00 54.22 H new ATOM 0 HG23 THR A 88 7.298 4.224 2.282 1.00 54.22 H new ATOM 860 N TYR A 89 11.784 2.627 2.627 1.00 71.24 N ATOM 861 CA TYR A 89 13.140 2.144 2.377 1.00 14.12 C ATOM 862 C TYR A 89 13.465 0.914 3.243 1.00 0.23 C ATOM 863 O TYR A 89 14.162 -0.005 2.808 1.00 45.14 O ATOM 864 CB TYR A 89 14.161 3.258 2.643 1.00 63.21 C ATOM 865 CG TYR A 89 13.860 4.550 1.906 1.00 54.01 C ATOM 866 CD1 TYR A 89 14.182 4.698 0.562 1.00 52.24 C ATOM 867 CD2 TYR A 89 13.248 5.618 2.558 1.00 21.31 C ATOM 868 CE1 TYR A 89 13.904 5.872 -0.111 1.00 61.43 C ATOM 869 CE2 TYR A 89 12.969 6.795 1.889 1.00 44.30 C ATOM 870 CZ TYR A 89 13.298 6.916 0.557 1.00 20.03 C ATOM 871 OH TYR A 89 13.022 8.083 -0.112 1.00 63.43 O ATOM 0 H TYR A 89 11.726 3.614 2.876 1.00 71.24 H new ATOM 0 HA TYR A 89 13.199 1.847 1.330 1.00 14.12 H new ATOM 0 HB2 TYR A 89 14.194 3.460 3.714 1.00 63.21 H new ATOM 0 HB3 TYR A 89 15.152 2.907 2.354 1.00 63.21 H new ATOM 0 HD1 TYR A 89 14.657 3.883 0.036 1.00 52.24 H new ATOM 0 HD2 TYR A 89 12.988 5.525 3.602 1.00 21.31 H new ATOM 0 HE1 TYR A 89 14.160 5.972 -1.155 1.00 61.43 H new ATOM 0 HE2 TYR A 89 12.496 7.615 2.408 1.00 44.30 H new ATOM 0 HH TYR A 89 12.594 8.718 0.500 1.00 63.43 H new ATOM 881 N GLU A 90 12.938 0.914 4.466 1.00 1.21 N ATOM 882 CA GLU A 90 13.080 -0.212 5.391 1.00 42.33 C ATOM 883 C GLU A 90 12.170 -1.376 4.974 1.00 74.12 C ATOM 884 O GLU A 90 12.546 -2.548 5.061 1.00 63.35 O ATOM 885 CB GLU A 90 12.712 0.240 6.813 1.00 22.21 C ATOM 886 CG GLU A 90 13.503 1.442 7.314 1.00 3.30 C ATOM 887 CD GLU A 90 12.944 2.017 8.606 1.00 22.42 C ATOM 888 OE1 GLU A 90 13.149 1.409 9.676 1.00 42.11 O ATOM 889 OE2 GLU A 90 12.305 3.089 8.559 1.00 74.21 O ATOM 0 H GLU A 90 12.400 1.694 4.845 1.00 1.21 H new ATOM 0 HA GLU A 90 14.115 -0.552 5.367 1.00 42.33 H new ATOM 0 HB2 GLU A 90 11.650 0.482 6.841 1.00 22.21 H new ATOM 0 HB3 GLU A 90 12.867 -0.593 7.498 1.00 22.21 H new ATOM 0 HG2 GLU A 90 14.541 1.148 7.471 1.00 3.30 H new ATOM 0 HG3 GLU A 90 13.503 2.216 6.547 1.00 3.30 H new ATOM 896 N GLN A 91 10.964 -1.032 4.517 1.00 64.32 N ATOM 897 CA GLN A 91 9.961 -2.023 4.104 1.00 41.21 C ATOM 898 C GLN A 91 10.447 -2.852 2.900 1.00 45.32 C ATOM 899 O GLN A 91 10.100 -4.029 2.763 1.00 2.23 O ATOM 900 CB GLN A 91 8.635 -1.317 3.772 1.00 14.51 C ATOM 901 CG GLN A 91 8.171 -0.358 4.869 1.00 43.11 C ATOM 902 CD GLN A 91 6.893 0.387 4.520 1.00 2.21 C ATOM 903 OE1 GLN A 91 6.582 0.604 3.354 1.00 42.20 O ATOM 904 NE2 GLN A 91 6.163 0.820 5.531 1.00 13.02 N ATOM 0 H GLN A 91 10.654 -0.065 4.422 1.00 64.32 H new ATOM 0 HA GLN A 91 9.803 -2.712 4.933 1.00 41.21 H new ATOM 0 HB2 GLN A 91 8.749 -0.764 2.840 1.00 14.51 H new ATOM 0 HB3 GLN A 91 7.863 -2.068 3.605 1.00 14.51 H new ATOM 0 HG2 GLN A 91 8.015 -0.920 5.790 1.00 43.11 H new ATOM 0 HG3 GLN A 91 8.962 0.366 5.067 1.00 43.11 H new ATOM 0 HE21 GLN A 91 6.451 0.622 6.489 1.00 13.02 H new ATOM 0 HE22 GLN A 91 5.311 1.353 5.354 1.00 13.02 H new ATOM 913 N GLN A 92 11.263 -2.236 2.039 1.00 32.14 N ATOM 914 CA GLN A 92 11.860 -2.943 0.893 1.00 44.01 C ATOM 915 C GLN A 92 12.721 -4.125 1.368 1.00 4.12 C ATOM 916 O GLN A 92 12.771 -5.172 0.728 1.00 22.02 O ATOM 917 CB GLN A 92 12.726 -1.993 0.046 1.00 44.04 C ATOM 918 CG GLN A 92 12.030 -0.693 -0.344 1.00 15.02 C ATOM 919 CD GLN A 92 12.808 0.103 -1.380 1.00 71.13 C ATOM 920 OE1 GLN A 92 12.584 -0.025 -2.579 1.00 74.10 O ATOM 921 NE2 GLN A 92 13.750 0.908 -0.934 1.00 71.34 N ATOM 0 H GLN A 92 11.527 -1.253 2.110 1.00 32.14 H new ATOM 0 HA GLN A 92 11.041 -3.318 0.280 1.00 44.01 H new ATOM 0 HB2 GLN A 92 13.633 -1.754 0.601 1.00 44.04 H new ATOM 0 HB3 GLN A 92 13.035 -2.513 -0.861 1.00 44.04 H new ATOM 0 HG2 GLN A 92 11.039 -0.920 -0.736 1.00 15.02 H new ATOM 0 HG3 GLN A 92 11.888 -0.081 0.547 1.00 15.02 H new ATOM 0 HE21 GLN A 92 13.914 0.995 0.069 1.00 71.34 H new ATOM 0 HE22 GLN A 92 14.315 1.445 -1.592 1.00 71.34 H new ATOM 930 N GLU A 93 13.378 -3.949 2.511 1.00 24.03 N ATOM 931 CA GLU A 93 14.270 -4.973 3.071 1.00 21.22 C ATOM 932 C GLU A 93 13.492 -6.063 3.835 1.00 74.52 C ATOM 933 O GLU A 93 14.088 -6.912 4.501 1.00 13.40 O ATOM 934 CB GLU A 93 15.301 -4.308 3.999 1.00 23.12 C ATOM 935 CG GLU A 93 16.156 -3.246 3.307 1.00 24.13 C ATOM 936 CD GLU A 93 17.127 -2.552 4.255 1.00 34.31 C ATOM 937 OE1 GLU A 93 18.257 -3.056 4.432 1.00 73.34 O ATOM 938 OE2 GLU A 93 16.768 -1.499 4.820 1.00 64.31 O ATOM 0 H GLU A 93 13.312 -3.102 3.075 1.00 24.03 H new ATOM 0 HA GLU A 93 14.781 -5.461 2.241 1.00 21.22 H new ATOM 0 HB2 GLU A 93 14.779 -3.850 4.839 1.00 23.12 H new ATOM 0 HB3 GLU A 93 15.955 -5.077 4.411 1.00 23.12 H new ATOM 0 HG2 GLU A 93 16.718 -3.711 2.497 1.00 24.13 H new ATOM 0 HG3 GLU A 93 15.503 -2.500 2.855 1.00 24.13 H new ATOM 945 N MET A 94 12.162 -6.036 3.737 1.00 14.14 N ATOM 946 CA MET A 94 11.308 -7.027 4.409 1.00 22.31 C ATOM 947 C MET A 94 10.886 -8.155 3.451 1.00 33.11 C ATOM 948 O MET A 94 11.307 -9.305 3.601 1.00 42.14 O ATOM 949 CB MET A 94 10.062 -6.339 4.988 1.00 14.20 C ATOM 950 CG MET A 94 10.377 -5.282 6.038 1.00 11.54 C ATOM 951 SD MET A 94 11.134 -5.975 7.524 1.00 73.21 S ATOM 952 CE MET A 94 9.820 -7.047 8.115 1.00 74.11 C ATOM 0 H MET A 94 11.648 -5.339 3.198 1.00 14.14 H new ATOM 0 HA MET A 94 11.888 -7.474 5.217 1.00 22.31 H new ATOM 0 HB2 MET A 94 9.503 -5.875 4.175 1.00 14.20 H new ATOM 0 HB3 MET A 94 9.413 -7.095 5.430 1.00 14.20 H new ATOM 0 HG2 MET A 94 11.047 -4.538 5.608 1.00 11.54 H new ATOM 0 HG3 MET A 94 9.458 -4.763 6.312 1.00 11.54 H new ATOM 0 HE1 MET A 94 9.984 -7.278 9.168 1.00 74.11 H new ATOM 0 HE2 MET A 94 8.860 -6.544 7.999 1.00 74.11 H new ATOM 0 HE3 MET A 94 9.817 -7.971 7.537 1.00 74.11 H new ATOM 962 N GLY A 95 10.054 -7.820 2.467 1.00 0.43 N ATOM 963 CA GLY A 95 9.552 -8.822 1.530 1.00 35.10 C ATOM 964 C GLY A 95 10.466 -9.043 0.329 1.00 13.14 C ATOM 965 O GLY A 95 11.356 -8.237 0.059 1.00 25.11 O ATOM 0 H GLY A 95 9.716 -6.872 2.299 1.00 0.43 H new ATOM 0 HA2 GLY A 95 9.422 -9.767 2.057 1.00 35.10 H new ATOM 0 HA3 GLY A 95 8.567 -8.516 1.176 1.00 35.10 H new ATOM 969 N LYS A 96 10.249 -10.143 -0.391 1.00 74.24 N ATOM 970 CA LYS A 96 11.042 -10.463 -1.587 1.00 54.41 C ATOM 971 C LYS A 96 10.398 -9.895 -2.859 1.00 2.32 C ATOM 972 O LYS A 96 9.173 -9.763 -2.949 1.00 0.13 O ATOM 973 CB LYS A 96 11.214 -11.979 -1.720 1.00 14.23 C ATOM 974 CG LYS A 96 11.946 -12.614 -0.544 1.00 55.45 C ATOM 975 CD LYS A 96 13.396 -12.140 -0.436 1.00 44.44 C ATOM 976 CE LYS A 96 14.239 -12.598 -1.623 1.00 42.31 C ATOM 977 NZ LYS A 96 14.247 -14.079 -1.762 1.00 20.54 N ATOM 0 H LYS A 96 9.530 -10.832 -0.170 1.00 74.24 H new ATOM 0 HA LYS A 96 12.021 -9.998 -1.469 1.00 54.41 H new ATOM 0 HB2 LYS A 96 10.232 -12.441 -1.818 1.00 14.23 H new ATOM 0 HB3 LYS A 96 11.761 -12.195 -2.638 1.00 14.23 H new ATOM 0 HG2 LYS A 96 11.419 -12.376 0.380 1.00 55.45 H new ATOM 0 HG3 LYS A 96 11.928 -13.699 -0.651 1.00 55.45 H new ATOM 0 HD2 LYS A 96 13.418 -11.052 -0.375 1.00 44.44 H new ATOM 0 HD3 LYS A 96 13.834 -12.520 0.487 1.00 44.44 H new ATOM 0 HE2 LYS A 96 13.851 -12.150 -2.538 1.00 42.31 H new ATOM 0 HE3 LYS A 96 15.261 -12.240 -1.502 1.00 42.31 H new ATOM 0 HZ1 LYS A 96 15.015 -14.363 -2.403 1.00 20.54 H new ATOM 0 HZ2 LYS A 96 14.395 -14.514 -0.829 1.00 20.54 H new ATOM 0 HZ3 LYS A 96 13.336 -14.396 -2.151 1.00 20.54 H new ATOM 991 N SER A 97 11.234 -9.586 -3.845 1.00 52.05 N ATOM 992 CA SER A 97 10.785 -8.915 -5.076 1.00 3.40 C ATOM 993 C SER A 97 10.058 -9.864 -6.043 1.00 4.25 C ATOM 994 O SER A 97 10.645 -10.811 -6.571 1.00 2.41 O ATOM 995 CB SER A 97 11.978 -8.274 -5.797 1.00 22.05 C ATOM 996 OG SER A 97 12.957 -9.249 -6.132 1.00 13.30 O ATOM 0 H SER A 97 12.234 -9.788 -3.822 1.00 52.05 H new ATOM 0 HA SER A 97 10.072 -8.149 -4.769 1.00 3.40 H new ATOM 0 HB2 SER A 97 11.634 -7.774 -6.702 1.00 22.05 H new ATOM 0 HB3 SER A 97 12.424 -7.510 -5.160 1.00 22.05 H new ATOM 0 HG SER A 97 12.515 -10.047 -6.491 1.00 13.30 H new ATOM 1002 N VAL A 98 8.778 -9.593 -6.268 1.00 71.15 N ATOM 1003 CA VAL A 98 7.977 -10.310 -7.269 1.00 12.15 C ATOM 1004 C VAL A 98 7.763 -9.451 -8.528 1.00 21.34 C ATOM 1005 O VAL A 98 7.776 -8.218 -8.465 1.00 5.34 O ATOM 1006 CB VAL A 98 6.587 -10.717 -6.704 1.00 43.01 C ATOM 1007 CG1 VAL A 98 6.718 -11.859 -5.703 1.00 2.53 C ATOM 1008 CG2 VAL A 98 5.881 -9.523 -6.066 1.00 30.02 C ATOM 0 H VAL A 98 8.261 -8.872 -5.765 1.00 71.15 H new ATOM 0 HA VAL A 98 8.536 -11.209 -7.529 1.00 12.15 H new ATOM 0 HB VAL A 98 5.979 -11.063 -7.540 1.00 43.01 H new ATOM 0 HG11 VAL A 98 5.732 -12.125 -5.323 1.00 2.53 H new ATOM 0 HG12 VAL A 98 7.163 -12.724 -6.194 1.00 2.53 H new ATOM 0 HG13 VAL A 98 7.354 -11.546 -4.875 1.00 2.53 H new ATOM 0 HG21 VAL A 98 4.912 -9.837 -5.680 1.00 30.02 H new ATOM 0 HG22 VAL A 98 6.489 -9.135 -5.249 1.00 30.02 H new ATOM 0 HG23 VAL A 98 5.738 -8.743 -6.814 1.00 30.02 H new ATOM 1018 N SER A 99 7.577 -10.101 -9.676 1.00 14.12 N ATOM 1019 CA SER A 99 7.266 -9.390 -10.926 1.00 42.22 C ATOM 1020 C SER A 99 5.753 -9.399 -11.198 1.00 54.50 C ATOM 1021 O SER A 99 4.975 -9.919 -10.398 1.00 12.20 O ATOM 1022 CB SER A 99 8.015 -10.014 -12.112 1.00 34.41 C ATOM 1023 OG SER A 99 7.767 -9.287 -13.307 1.00 11.34 O ATOM 0 H SER A 99 7.635 -11.115 -9.772 1.00 14.12 H new ATOM 0 HA SER A 99 7.595 -8.357 -10.811 1.00 42.22 H new ATOM 0 HB2 SER A 99 9.085 -10.027 -11.905 1.00 34.41 H new ATOM 0 HB3 SER A 99 7.702 -11.050 -12.240 1.00 34.41 H new ATOM 0 HG SER A 99 8.255 -9.701 -14.049 1.00 11.34 H new ATOM 1029 N ARG A 100 5.338 -8.840 -12.336 1.00 23.21 N ATOM 1030 CA ARG A 100 3.907 -8.710 -12.659 1.00 42.00 C ATOM 1031 C ARG A 100 3.194 -10.073 -12.716 1.00 35.11 C ATOM 1032 O ARG A 100 2.031 -10.189 -12.326 1.00 33.21 O ATOM 1033 CB ARG A 100 3.701 -7.949 -13.980 1.00 70.23 C ATOM 1034 CG ARG A 100 3.889 -6.436 -13.861 1.00 2.44 C ATOM 1035 CD ARG A 100 5.349 -6.045 -13.662 1.00 43.13 C ATOM 1036 NE ARG A 100 6.135 -6.212 -14.883 1.00 43.25 N ATOM 1037 CZ ARG A 100 7.439 -6.251 -14.925 1.00 72.24 C ATOM 1038 NH1 ARG A 100 8.143 -6.234 -13.839 1.00 53.22 N ATOM 1039 NH2 ARG A 100 8.038 -6.315 -16.067 1.00 73.14 N ATOM 0 H ARG A 100 5.966 -8.470 -13.050 1.00 23.21 H new ATOM 0 HA ARG A 100 3.458 -8.136 -11.848 1.00 42.00 H new ATOM 0 HB2 ARG A 100 4.400 -8.334 -14.722 1.00 70.23 H new ATOM 0 HB3 ARG A 100 2.697 -8.152 -14.352 1.00 70.23 H new ATOM 0 HG2 ARG A 100 3.506 -5.953 -14.760 1.00 2.44 H new ATOM 0 HG3 ARG A 100 3.299 -6.064 -13.023 1.00 2.44 H new ATOM 0 HD2 ARG A 100 5.404 -5.007 -13.335 1.00 43.13 H new ATOM 0 HD3 ARG A 100 5.781 -6.653 -12.867 1.00 43.13 H new ATOM 0 HE ARG A 100 5.629 -6.305 -15.764 1.00 43.25 H new ATOM 0 HH11 ARG A 100 7.680 -6.190 -12.931 1.00 53.22 H new ATOM 0 HH12 ARG A 100 9.161 -6.265 -13.891 1.00 53.22 H new ATOM 0 HH21 ARG A 100 7.492 -6.335 -16.929 1.00 73.14 H new ATOM 0 HH22 ARG A 100 9.057 -6.346 -16.108 1.00 73.14 H new ATOM 1053 N SER A 101 3.891 -11.099 -13.194 1.00 4.12 N ATOM 1054 CA SER A 101 3.316 -12.453 -13.272 1.00 52.21 C ATOM 1055 C SER A 101 3.260 -13.134 -11.894 1.00 51.20 C ATOM 1056 O SER A 101 2.609 -14.165 -11.728 1.00 62.10 O ATOM 1057 CB SER A 101 4.131 -13.322 -14.238 1.00 31.01 C ATOM 1058 OG SER A 101 4.198 -12.739 -15.530 1.00 54.41 O ATOM 0 H SER A 101 4.850 -11.028 -13.533 1.00 4.12 H new ATOM 0 HA SER A 101 2.295 -12.349 -13.640 1.00 52.21 H new ATOM 0 HB2 SER A 101 5.139 -13.457 -13.846 1.00 31.01 H new ATOM 0 HB3 SER A 101 3.680 -14.312 -14.307 1.00 31.01 H new ATOM 0 HG SER A 101 4.725 -13.315 -16.122 1.00 54.41 H new ATOM 1064 N ASN A 102 3.945 -12.552 -10.913 1.00 61.11 N ATOM 1065 CA ASN A 102 4.020 -13.128 -9.561 1.00 71.54 C ATOM 1066 C ASN A 102 3.117 -12.383 -8.560 1.00 15.44 C ATOM 1067 O ASN A 102 3.002 -12.792 -7.405 1.00 21.30 O ATOM 1068 CB ASN A 102 5.469 -13.095 -9.063 1.00 43.12 C ATOM 1069 CG ASN A 102 6.429 -13.782 -10.012 1.00 61.14 C ATOM 1070 OD1 ASN A 102 6.993 -13.155 -10.902 1.00 34.35 O ATOM 1071 ND2 ASN A 102 6.624 -15.072 -9.829 1.00 51.44 N ATOM 0 H ASN A 102 4.460 -11.679 -11.024 1.00 61.11 H new ATOM 0 HA ASN A 102 3.666 -14.157 -9.625 1.00 71.54 H new ATOM 0 HB2 ASN A 102 5.779 -12.059 -8.927 1.00 43.12 H new ATOM 0 HB3 ASN A 102 5.524 -13.575 -8.086 1.00 43.12 H new ATOM 0 HD21 ASN A 102 7.262 -15.583 -10.439 1.00 51.44 H new ATOM 0 HD22 ASN A 102 6.137 -15.560 -9.077 1.00 51.44 H new ATOM 1078 N LEU A 103 2.495 -11.293 -9.007 1.00 54.31 N ATOM 1079 CA LEU A 103 1.625 -10.471 -8.144 1.00 23.44 C ATOM 1080 C LEU A 103 0.478 -11.287 -7.523 1.00 63.32 C ATOM 1081 O LEU A 103 -0.304 -11.933 -8.233 1.00 41.21 O ATOM 1082 CB LEU A 103 1.036 -9.294 -8.937 1.00 3.43 C ATOM 1083 CG LEU A 103 2.059 -8.304 -9.510 1.00 75.34 C ATOM 1084 CD1 LEU A 103 1.359 -7.179 -10.269 1.00 71.32 C ATOM 1085 CD2 LEU A 103 2.943 -7.739 -8.403 1.00 53.32 C ATOM 0 H LEU A 103 2.573 -10.951 -9.965 1.00 54.31 H new ATOM 0 HA LEU A 103 2.251 -10.098 -7.334 1.00 23.44 H new ATOM 0 HB2 LEU A 103 0.443 -9.694 -9.760 1.00 3.43 H new ATOM 0 HB3 LEU A 103 0.352 -8.747 -8.288 1.00 3.43 H new ATOM 0 HG LEU A 103 2.695 -8.843 -10.212 1.00 75.34 H new ATOM 0 HD11 LEU A 103 2.104 -6.490 -10.666 1.00 71.32 H new ATOM 0 HD12 LEU A 103 0.780 -7.600 -11.091 1.00 71.32 H new ATOM 0 HD13 LEU A 103 0.693 -6.643 -9.593 1.00 71.32 H new ATOM 0 HD21 LEU A 103 3.661 -7.040 -8.832 1.00 53.32 H new ATOM 0 HD22 LEU A 103 2.323 -7.220 -7.672 1.00 53.32 H new ATOM 0 HD23 LEU A 103 3.478 -8.553 -7.913 1.00 53.32 H new ATOM 1097 N ARG A 104 0.368 -11.230 -6.195 1.00 10.20 N ATOM 1098 CA ARG A 104 -0.678 -11.952 -5.463 1.00 3.13 C ATOM 1099 C ARG A 104 -1.202 -11.107 -4.295 1.00 21.52 C ATOM 1100 O ARG A 104 -0.418 -10.529 -3.545 1.00 3.04 O ATOM 1101 CB ARG A 104 -0.159 -13.302 -4.937 1.00 31.11 C ATOM 1102 CG ARG A 104 0.475 -14.189 -6.009 1.00 62.52 C ATOM 1103 CD ARG A 104 0.533 -15.651 -5.588 1.00 3.14 C ATOM 1104 NE ARG A 104 -0.800 -16.256 -5.556 1.00 75.41 N ATOM 1105 CZ ARG A 104 -1.026 -17.541 -5.510 1.00 21.24 C ATOM 1106 NH1 ARG A 104 -0.048 -18.382 -5.453 1.00 33.32 N ATOM 1107 NH2 ARG A 104 -2.243 -17.978 -5.528 1.00 34.54 N ATOM 0 H ARG A 104 0.994 -10.688 -5.600 1.00 10.20 H new ATOM 0 HA ARG A 104 -1.495 -12.143 -6.159 1.00 3.13 H new ATOM 0 HB2 ARG A 104 0.576 -13.116 -4.154 1.00 31.11 H new ATOM 0 HB3 ARG A 104 -0.986 -13.842 -4.476 1.00 31.11 H new ATOM 0 HG2 ARG A 104 -0.095 -14.102 -6.934 1.00 62.52 H new ATOM 0 HG3 ARG A 104 1.483 -13.834 -6.222 1.00 62.52 H new ATOM 0 HD2 ARG A 104 1.168 -16.205 -6.280 1.00 3.14 H new ATOM 0 HD3 ARG A 104 0.992 -15.728 -4.602 1.00 3.14 H new ATOM 0 HE ARG A 104 -1.606 -15.631 -5.571 1.00 75.41 H new ATOM 0 HH11 ARG A 104 0.915 -18.045 -5.443 1.00 33.32 H new ATOM 0 HH12 ARG A 104 -0.238 -19.384 -5.417 1.00 33.32 H new ATOM 0 HH21 ARG A 104 -3.021 -17.320 -5.578 1.00 34.54 H new ATOM 0 HH22 ARG A 104 -2.425 -18.981 -5.492 1.00 34.54 H new ATOM 1121 N THR A 105 -2.530 -11.062 -4.150 1.00 15.54 N ATOM 1122 CA THR A 105 -3.201 -10.234 -3.132 1.00 42.51 C ATOM 1123 C THR A 105 -2.451 -10.209 -1.789 1.00 21.31 C ATOM 1124 O THR A 105 -2.569 -11.131 -0.981 1.00 10.33 O ATOM 1125 CB THR A 105 -4.647 -10.731 -2.879 1.00 43.45 C ATOM 1126 OG1 THR A 105 -5.375 -10.796 -4.116 1.00 1.54 O ATOM 1127 CG2 THR A 105 -5.381 -9.817 -1.903 1.00 1.44 C ATOM 0 H THR A 105 -3.174 -11.597 -4.733 1.00 15.54 H new ATOM 0 HA THR A 105 -3.212 -9.222 -3.536 1.00 42.51 H new ATOM 0 HB THR A 105 -4.585 -11.727 -2.441 1.00 43.45 H new ATOM 0 HG1 THR A 105 -5.789 -9.927 -4.298 1.00 1.54 H new ATOM 0 HG21 THR A 105 -6.393 -10.191 -1.745 1.00 1.44 H new ATOM 0 HG22 THR A 105 -4.849 -9.798 -0.952 1.00 1.44 H new ATOM 0 HG23 THR A 105 -5.427 -8.808 -2.314 1.00 1.44 H new ATOM 1135 N GLY A 106 -1.675 -9.149 -1.567 1.00 72.42 N ATOM 1136 CA GLY A 106 -0.911 -9.022 -0.331 1.00 45.14 C ATOM 1137 C GLY A 106 0.532 -8.559 -0.535 1.00 4.14 C ATOM 1138 O GLY A 106 1.287 -8.432 0.436 1.00 11.31 O ATOM 0 H GLY A 106 -1.560 -8.374 -2.220 1.00 72.42 H new ATOM 0 HA2 GLY A 106 -1.418 -8.316 0.327 1.00 45.14 H new ATOM 0 HA3 GLY A 106 -0.904 -9.985 0.180 1.00 45.14 H new ATOM 1142 N ASP A 107 0.938 -8.324 -1.786 1.00 33.24 N ATOM 1143 CA ASP A 107 2.278 -7.798 -2.061 1.00 65.21 C ATOM 1144 C ASP A 107 2.285 -6.257 -2.081 1.00 2.10 C ATOM 1145 O ASP A 107 1.243 -5.615 -2.240 1.00 21.13 O ATOM 1146 CB ASP A 107 2.846 -8.367 -3.373 1.00 72.12 C ATOM 1147 CG ASP A 107 2.059 -7.960 -4.610 1.00 22.51 C ATOM 1148 OD1 ASP A 107 2.340 -6.880 -5.166 1.00 33.12 O ATOM 1149 OD2 ASP A 107 1.174 -8.734 -5.035 1.00 2.20 O ATOM 0 H ASP A 107 0.366 -8.487 -2.615 1.00 33.24 H new ATOM 0 HA ASP A 107 2.927 -8.123 -1.248 1.00 65.21 H new ATOM 0 HB2 ASP A 107 3.878 -8.036 -3.485 1.00 72.12 H new ATOM 0 HB3 ASP A 107 2.866 -9.455 -3.308 1.00 72.12 H new ATOM 1154 N LEU A 108 3.463 -5.671 -1.888 1.00 61.31 N ATOM 1155 CA LEU A 108 3.614 -4.214 -1.873 1.00 71.31 C ATOM 1156 C LEU A 108 4.256 -3.711 -3.170 1.00 73.32 C ATOM 1157 O LEU A 108 5.383 -4.081 -3.500 1.00 64.31 O ATOM 1158 CB LEU A 108 4.464 -3.784 -0.669 1.00 11.43 C ATOM 1159 CG LEU A 108 3.920 -4.210 0.706 1.00 3.05 C ATOM 1160 CD1 LEU A 108 4.773 -3.629 1.833 1.00 64.41 C ATOM 1161 CD2 LEU A 108 2.456 -3.799 0.858 1.00 1.45 C ATOM 0 H LEU A 108 4.332 -6.183 -1.739 1.00 61.31 H new ATOM 0 HA LEU A 108 2.621 -3.773 -1.790 1.00 71.31 H new ATOM 0 HB2 LEU A 108 5.467 -4.195 -0.788 1.00 11.43 H new ATOM 0 HB3 LEU A 108 4.561 -2.698 -0.683 1.00 11.43 H new ATOM 0 HG LEU A 108 3.974 -5.297 0.772 1.00 3.05 H new ATOM 0 HD11 LEU A 108 4.369 -3.944 2.795 1.00 64.41 H new ATOM 0 HD12 LEU A 108 5.798 -3.987 1.735 1.00 64.41 H new ATOM 0 HD13 LEU A 108 4.762 -2.541 1.774 1.00 64.41 H new ATOM 0 HD21 LEU A 108 2.091 -4.109 1.837 1.00 1.45 H new ATOM 0 HD22 LEU A 108 2.371 -2.716 0.765 1.00 1.45 H new ATOM 0 HD23 LEU A 108 1.861 -4.278 0.080 1.00 1.45 H new ATOM 1173 N VAL A 109 3.551 -2.846 -3.886 1.00 12.32 N ATOM 1174 CA VAL A 109 4.043 -2.321 -5.160 1.00 44.42 C ATOM 1175 C VAL A 109 4.762 -0.972 -4.973 1.00 43.25 C ATOM 1176 O VAL A 109 4.158 0.035 -4.597 1.00 50.43 O ATOM 1177 CB VAL A 109 2.894 -2.183 -6.199 1.00 12.52 C ATOM 1178 CG1 VAL A 109 2.440 -3.558 -6.686 1.00 44.02 C ATOM 1179 CG2 VAL A 109 1.710 -1.416 -5.611 1.00 34.03 C ATOM 0 H VAL A 109 2.636 -2.491 -3.609 1.00 12.32 H new ATOM 0 HA VAL A 109 4.765 -3.041 -5.545 1.00 44.42 H new ATOM 0 HB VAL A 109 3.280 -1.619 -7.049 1.00 12.52 H new ATOM 0 HG11 VAL A 109 1.636 -3.440 -7.412 1.00 44.02 H new ATOM 0 HG12 VAL A 109 3.279 -4.073 -7.154 1.00 44.02 H new ATOM 0 HG13 VAL A 109 2.081 -4.144 -5.840 1.00 44.02 H new ATOM 0 HG21 VAL A 109 0.922 -1.335 -6.359 1.00 34.03 H new ATOM 0 HG22 VAL A 109 1.329 -1.947 -4.739 1.00 34.03 H new ATOM 0 HG23 VAL A 109 2.034 -0.418 -5.315 1.00 34.03 H new ATOM 1189 N LEU A 110 6.072 -0.979 -5.213 1.00 13.23 N ATOM 1190 CA LEU A 110 6.916 0.208 -5.048 1.00 61.53 C ATOM 1191 C LEU A 110 7.040 1.002 -6.356 1.00 41.41 C ATOM 1192 O LEU A 110 7.528 0.490 -7.370 1.00 41.52 O ATOM 1193 CB LEU A 110 8.311 -0.215 -4.561 1.00 65.22 C ATOM 1194 CG LEU A 110 8.339 -0.914 -3.189 1.00 32.52 C ATOM 1195 CD1 LEU A 110 9.699 -1.557 -2.940 1.00 13.42 C ATOM 1196 CD2 LEU A 110 7.993 0.076 -2.072 1.00 21.10 C ATOM 0 H LEU A 110 6.580 -1.806 -5.527 1.00 13.23 H new ATOM 0 HA LEU A 110 6.445 0.856 -4.309 1.00 61.53 H new ATOM 0 HB2 LEU A 110 8.750 -0.884 -5.301 1.00 65.22 H new ATOM 0 HB3 LEU A 110 8.946 0.670 -4.514 1.00 65.22 H new ATOM 0 HG LEU A 110 7.586 -1.702 -3.191 1.00 32.52 H new ATOM 0 HD11 LEU A 110 9.698 -2.045 -1.966 1.00 13.42 H new ATOM 0 HD12 LEU A 110 9.900 -2.296 -3.716 1.00 13.42 H new ATOM 0 HD13 LEU A 110 10.473 -0.790 -2.960 1.00 13.42 H new ATOM 0 HD21 LEU A 110 8.018 -0.437 -1.111 1.00 21.10 H new ATOM 0 HD22 LEU A 110 8.719 0.889 -2.069 1.00 21.10 H new ATOM 0 HD23 LEU A 110 6.995 0.481 -2.241 1.00 21.10 H new ATOM 1208 N PHE A 111 6.597 2.255 -6.327 1.00 70.45 N ATOM 1209 CA PHE A 111 6.669 3.136 -7.496 1.00 72.30 C ATOM 1210 C PHE A 111 7.710 4.248 -7.312 1.00 41.24 C ATOM 1211 O PHE A 111 8.030 4.651 -6.189 1.00 75.33 O ATOM 1212 CB PHE A 111 5.300 3.769 -7.771 1.00 34.34 C ATOM 1213 CG PHE A 111 4.209 2.765 -8.030 1.00 45.02 C ATOM 1214 CD1 PHE A 111 4.069 2.177 -9.278 1.00 23.50 C ATOM 1215 CD2 PHE A 111 3.321 2.410 -7.024 1.00 24.13 C ATOM 1216 CE1 PHE A 111 3.067 1.258 -9.517 1.00 24.24 C ATOM 1217 CE2 PHE A 111 2.317 1.492 -7.260 1.00 21.34 C ATOM 1218 CZ PHE A 111 2.191 0.915 -8.507 1.00 1.40 C ATOM 0 H PHE A 111 6.181 2.689 -5.503 1.00 70.45 H new ATOM 0 HA PHE A 111 6.971 2.520 -8.343 1.00 72.30 H new ATOM 0 HB2 PHE A 111 5.018 4.387 -6.919 1.00 34.34 H new ATOM 0 HB3 PHE A 111 5.383 4.432 -8.632 1.00 34.34 H new ATOM 0 HD1 PHE A 111 4.752 2.441 -10.072 1.00 23.50 H new ATOM 0 HD2 PHE A 111 3.416 2.857 -6.045 1.00 24.13 H new ATOM 0 HE1 PHE A 111 2.969 0.808 -10.494 1.00 24.24 H new ATOM 0 HE2 PHE A 111 1.631 1.226 -6.469 1.00 21.34 H new ATOM 0 HZ PHE A 111 1.407 0.195 -8.693 1.00 1.40 H new ATOM 1228 N ARG A 112 8.239 4.732 -8.429 1.00 42.52 N ATOM 1229 CA ARG A 112 9.141 5.881 -8.430 1.00 15.33 C ATOM 1230 C ARG A 112 8.319 7.173 -8.541 1.00 35.25 C ATOM 1231 O ARG A 112 7.696 7.433 -9.569 1.00 2.04 O ATOM 1232 CB ARG A 112 10.129 5.774 -9.604 1.00 30.34 C ATOM 1233 CG ARG A 112 10.802 4.406 -9.713 1.00 53.32 C ATOM 1234 CD ARG A 112 11.810 4.348 -10.862 1.00 14.12 C ATOM 1235 NE ARG A 112 11.231 4.771 -12.139 1.00 41.14 N ATOM 1236 CZ ARG A 112 10.667 3.968 -13.003 1.00 51.10 C ATOM 1237 NH1 ARG A 112 10.527 2.707 -12.744 1.00 51.02 N ATOM 1238 NH2 ARG A 112 10.230 4.433 -14.128 1.00 42.12 N ATOM 0 H ARG A 112 8.058 4.344 -9.355 1.00 42.52 H new ATOM 0 HA ARG A 112 9.710 5.897 -7.500 1.00 15.33 H new ATOM 0 HB2 ARG A 112 9.600 5.985 -10.534 1.00 30.34 H new ATOM 0 HB3 ARG A 112 10.897 6.540 -9.493 1.00 30.34 H new ATOM 0 HG2 ARG A 112 11.309 4.176 -8.776 1.00 53.32 H new ATOM 0 HG3 ARG A 112 10.041 3.639 -9.860 1.00 53.32 H new ATOM 0 HD2 ARG A 112 12.663 4.984 -10.625 1.00 14.12 H new ATOM 0 HD3 ARG A 112 12.188 3.330 -10.958 1.00 14.12 H new ATOM 0 HE ARG A 112 11.271 5.763 -12.371 1.00 41.14 H new ATOM 0 HH11 ARG A 112 10.859 2.329 -11.857 1.00 51.02 H new ATOM 0 HH12 ARG A 112 10.085 2.092 -13.427 1.00 51.02 H new ATOM 0 HH21 ARG A 112 10.325 5.426 -14.341 1.00 42.12 H new ATOM 0 HH22 ARG A 112 9.790 3.807 -14.802 1.00 42.12 H new ATOM 1252 N ALA A 113 8.331 7.993 -7.497 1.00 23.43 N ATOM 1253 CA ALA A 113 7.440 9.156 -7.434 1.00 3.51 C ATOM 1254 C ALA A 113 8.090 10.407 -8.038 1.00 42.31 C ATOM 1255 O ALA A 113 9.283 10.410 -8.350 1.00 24.30 O ATOM 1256 CB ALA A 113 7.021 9.410 -5.988 1.00 33.15 C ATOM 0 H ALA A 113 8.940 7.880 -6.687 1.00 23.43 H new ATOM 0 HA ALA A 113 6.555 8.935 -8.031 1.00 3.51 H new ATOM 0 HB1 ALA A 113 6.359 10.275 -5.948 1.00 33.15 H new ATOM 0 HB2 ALA A 113 6.498 8.535 -5.602 1.00 33.15 H new ATOM 0 HB3 ALA A 113 7.906 9.601 -5.381 1.00 33.15 H new ATOM 1301 N ARG A 118 10.459 6.509 -2.369 1.00 61.34 N ATOM 1302 CA ARG A 118 9.659 5.331 -2.739 1.00 71.30 C ATOM 1303 C ARG A 118 8.204 5.460 -2.258 1.00 53.11 C ATOM 1304 O ARG A 118 7.947 5.575 -1.058 1.00 11.20 O ATOM 1305 CB ARG A 118 10.269 4.048 -2.149 1.00 25.01 C ATOM 1306 CG ARG A 118 11.572 3.599 -2.806 1.00 41.45 C ATOM 1307 CD ARG A 118 11.403 3.340 -4.302 1.00 43.44 C ATOM 1308 NE ARG A 118 12.511 2.564 -4.860 1.00 73.54 N ATOM 1309 CZ ARG A 118 13.138 2.860 -5.967 1.00 13.33 C ATOM 1310 NH1 ARG A 118 12.883 3.957 -6.604 1.00 22.41 N ATOM 1311 NH2 ARG A 118 14.040 2.059 -6.431 1.00 70.15 N ATOM 0 HA ARG A 118 9.666 5.273 -3.827 1.00 71.30 H new ATOM 0 HB2 ARG A 118 10.449 4.204 -1.085 1.00 25.01 H new ATOM 0 HB3 ARG A 118 9.539 3.243 -2.234 1.00 25.01 H new ATOM 0 HG2 ARG A 118 12.335 4.362 -2.655 1.00 41.45 H new ATOM 0 HG3 ARG A 118 11.928 2.691 -2.320 1.00 41.45 H new ATOM 0 HD2 ARG A 118 10.467 2.808 -4.473 1.00 43.44 H new ATOM 0 HD3 ARG A 118 11.329 4.292 -4.827 1.00 43.44 H new ATOM 0 HE ARG A 118 12.815 1.735 -4.349 1.00 73.54 H new ATOM 0 HH11 ARG A 118 12.183 4.606 -6.243 1.00 22.41 H new ATOM 0 HH12 ARG A 118 13.382 4.173 -7.467 1.00 22.41 H new ATOM 0 HH21 ARG A 118 14.261 1.197 -5.933 1.00 70.15 H new ATOM 0 HH22 ARG A 118 14.530 2.289 -7.295 1.00 70.15 H new ATOM 1325 N HIS A 119 7.262 5.433 -3.199 1.00 41.00 N ATOM 1326 CA HIS A 119 5.829 5.434 -2.873 1.00 30.32 C ATOM 1327 C HIS A 119 5.272 4.002 -2.958 1.00 0.44 C ATOM 1328 O HIS A 119 5.398 3.346 -3.993 1.00 33.33 O ATOM 1329 CB HIS A 119 5.071 6.362 -3.835 1.00 3.05 C ATOM 1330 CG HIS A 119 3.618 6.538 -3.495 1.00 20.22 C ATOM 1331 ND1 HIS A 119 3.170 7.643 -2.809 1.00 4.41 N ATOM 1332 CD2 HIS A 119 2.561 5.734 -3.767 1.00 72.41 C ATOM 1333 CE1 HIS A 119 1.867 7.485 -2.679 1.00 73.42 C ATOM 1334 NE2 HIS A 119 1.453 6.346 -3.244 1.00 53.41 N ATOM 0 H HIS A 119 7.462 5.410 -4.199 1.00 41.00 H new ATOM 0 HA HIS A 119 5.694 5.803 -1.856 1.00 30.32 H new ATOM 0 HB2 HIS A 119 5.554 7.339 -3.837 1.00 3.05 H new ATOM 0 HB3 HIS A 119 5.151 5.964 -4.847 1.00 3.05 H new ATOM 0 HD2 HIS A 119 2.588 4.792 -4.295 1.00 72.41 H new ATOM 0 HE1 HIS A 119 1.216 8.187 -2.179 1.00 73.42 H new ATOM 0 HE2 HIS A 119 0.494 5.999 -3.279 1.00 53.41 H new ATOM 1342 N VAL A 120 4.661 3.518 -1.876 1.00 63.50 N ATOM 1343 CA VAL A 120 4.210 2.119 -1.805 1.00 13.24 C ATOM 1344 C VAL A 120 2.674 1.988 -1.832 1.00 11.23 C ATOM 1345 O VAL A 120 1.949 2.831 -1.301 1.00 74.41 O ATOM 1346 CB VAL A 120 4.762 1.422 -0.531 1.00 62.54 C ATOM 1347 CG1 VAL A 120 4.215 2.076 0.735 1.00 64.50 C ATOM 1348 CG2 VAL A 120 4.457 -0.078 -0.548 1.00 50.20 C ATOM 0 H VAL A 120 4.466 4.067 -1.039 1.00 63.50 H new ATOM 0 HA VAL A 120 4.604 1.627 -2.694 1.00 13.24 H new ATOM 0 HB VAL A 120 5.845 1.544 -0.529 1.00 62.54 H new ATOM 0 HG11 VAL A 120 4.618 1.567 1.611 1.00 64.50 H new ATOM 0 HG12 VAL A 120 4.508 3.126 0.758 1.00 64.50 H new ATOM 0 HG13 VAL A 120 3.127 2.003 0.742 1.00 64.50 H new ATOM 0 HG21 VAL A 120 4.855 -0.540 0.355 1.00 50.20 H new ATOM 0 HG22 VAL A 120 3.378 -0.230 -0.589 1.00 50.20 H new ATOM 0 HG23 VAL A 120 4.920 -0.534 -1.423 1.00 50.20 H new ATOM 1358 N GLY A 121 2.190 0.920 -2.470 1.00 72.10 N ATOM 1359 CA GLY A 121 0.764 0.604 -2.463 1.00 2.20 C ATOM 1360 C GLY A 121 0.501 -0.860 -2.124 1.00 24.24 C ATOM 1361 O GLY A 121 1.319 -1.726 -2.434 1.00 5.42 O ATOM 0 H GLY A 121 2.765 0.262 -2.996 1.00 72.10 H new ATOM 0 HA2 GLY A 121 0.256 1.240 -1.738 1.00 2.20 H new ATOM 0 HA3 GLY A 121 0.338 0.831 -3.440 1.00 2.20 H new ATOM 1365 N ILE A 122 -0.629 -1.141 -1.478 1.00 74.21 N ATOM 1366 CA ILE A 122 -0.986 -2.515 -1.101 1.00 42.15 C ATOM 1367 C ILE A 122 -1.791 -3.203 -2.211 1.00 74.21 C ATOM 1368 O ILE A 122 -2.968 -2.895 -2.416 1.00 61.51 O ATOM 1369 CB ILE A 122 -1.816 -2.542 0.207 1.00 30.44 C ATOM 1370 CG1 ILE A 122 -1.118 -1.724 1.304 1.00 74.51 C ATOM 1371 CG2 ILE A 122 -2.045 -3.982 0.666 1.00 72.44 C ATOM 1372 CD1 ILE A 122 -1.917 -1.612 2.588 1.00 51.13 C ATOM 0 H ILE A 122 -1.316 -0.439 -1.203 1.00 74.21 H new ATOM 0 HA ILE A 122 -0.051 -3.052 -0.945 1.00 42.15 H new ATOM 0 HB ILE A 122 -2.788 -2.089 0.010 1.00 30.44 H new ATOM 0 HG12 ILE A 122 -0.154 -2.181 1.526 1.00 74.51 H new ATOM 0 HG13 ILE A 122 -0.916 -0.722 0.924 1.00 74.51 H new ATOM 0 HG21 ILE A 122 -2.630 -3.982 1.586 1.00 72.44 H new ATOM 0 HG22 ILE A 122 -2.585 -4.529 -0.107 1.00 72.44 H new ATOM 0 HG23 ILE A 122 -1.084 -4.463 0.847 1.00 72.44 H new ATOM 0 HD11 ILE A 122 -1.359 -1.020 3.314 1.00 51.13 H new ATOM 0 HD12 ILE A 122 -2.871 -1.127 2.382 1.00 51.13 H new ATOM 0 HD13 ILE A 122 -2.096 -2.608 2.993 1.00 51.13 H new ATOM 1384 N TYR A 123 -1.158 -4.133 -2.923 1.00 23.31 N ATOM 1385 CA TYR A 123 -1.796 -4.805 -4.059 1.00 32.23 C ATOM 1386 C TYR A 123 -2.898 -5.779 -3.597 1.00 61.32 C ATOM 1387 O TYR A 123 -2.622 -6.812 -2.984 1.00 50.20 O ATOM 1388 CB TYR A 123 -0.744 -5.546 -4.898 1.00 75.11 C ATOM 1389 CG TYR A 123 -1.288 -6.100 -6.204 1.00 41.45 C ATOM 1390 CD1 TYR A 123 -1.425 -5.281 -7.323 1.00 63.31 C ATOM 1391 CD2 TYR A 123 -1.675 -7.432 -6.317 1.00 71.14 C ATOM 1392 CE1 TYR A 123 -1.929 -5.775 -8.511 1.00 42.41 C ATOM 1393 CE2 TYR A 123 -2.183 -7.931 -7.502 1.00 53.24 C ATOM 1394 CZ TYR A 123 -2.308 -7.097 -8.596 1.00 62.42 C ATOM 1395 OH TYR A 123 -2.826 -7.589 -9.778 1.00 63.24 O ATOM 0 H TYR A 123 -0.204 -4.440 -2.735 1.00 23.31 H new ATOM 0 HA TYR A 123 -2.269 -4.040 -4.675 1.00 32.23 H new ATOM 0 HB2 TYR A 123 0.079 -4.866 -5.116 1.00 75.11 H new ATOM 0 HB3 TYR A 123 -0.333 -6.365 -4.309 1.00 75.11 H new ATOM 0 HD1 TYR A 123 -1.133 -4.243 -7.261 1.00 63.31 H new ATOM 0 HD2 TYR A 123 -1.577 -8.087 -5.464 1.00 71.14 H new ATOM 0 HE1 TYR A 123 -2.026 -5.127 -9.370 1.00 42.41 H new ATOM 0 HE2 TYR A 123 -2.480 -8.967 -7.572 1.00 53.24 H new ATOM 0 HH TYR A 123 -3.042 -8.539 -9.670 1.00 63.24 H new ATOM 1405 N ILE A 124 -4.152 -5.437 -3.898 1.00 50.25 N ATOM 1406 CA ILE A 124 -5.298 -6.268 -3.507 1.00 54.32 C ATOM 1407 C ILE A 124 -5.732 -7.215 -4.639 1.00 4.42 C ATOM 1408 O ILE A 124 -6.461 -8.181 -4.409 1.00 2.33 O ATOM 1409 CB ILE A 124 -6.507 -5.395 -3.081 1.00 52.30 C ATOM 1410 CG1 ILE A 124 -6.986 -4.525 -4.255 1.00 22.42 C ATOM 1411 CG2 ILE A 124 -6.139 -4.527 -1.876 1.00 51.12 C ATOM 1412 CD1 ILE A 124 -8.177 -3.649 -3.929 1.00 4.44 C ATOM 0 H ILE A 124 -4.402 -4.592 -4.411 1.00 50.25 H new ATOM 0 HA ILE A 124 -4.970 -6.867 -2.658 1.00 54.32 H new ATOM 0 HB ILE A 124 -7.326 -6.054 -2.792 1.00 52.30 H new ATOM 0 HG12 ILE A 124 -6.162 -3.892 -4.584 1.00 22.42 H new ATOM 0 HG13 ILE A 124 -7.244 -5.173 -5.092 1.00 22.42 H new ATOM 0 HG21 ILE A 124 -6.998 -3.920 -1.589 1.00 51.12 H new ATOM 0 HG22 ILE A 124 -5.851 -5.166 -1.041 1.00 51.12 H new ATOM 0 HG23 ILE A 124 -5.305 -3.875 -2.138 1.00 51.12 H new ATOM 0 HD11 ILE A 124 -8.453 -3.067 -4.809 1.00 4.44 H new ATOM 0 HD12 ILE A 124 -9.018 -4.275 -3.630 1.00 4.44 H new ATOM 0 HD13 ILE A 124 -7.919 -2.973 -3.113 1.00 4.44 H new ATOM 1424 N GLY A 125 -5.288 -6.931 -5.862 1.00 13.50 N ATOM 1425 CA GLY A 125 -5.621 -7.782 -7.003 1.00 13.14 C ATOM 1426 C GLY A 125 -6.225 -7.006 -8.169 1.00 64.34 C ATOM 1427 O GLY A 125 -6.635 -5.856 -8.008 1.00 42.52 O ATOM 0 H GLY A 125 -4.703 -6.127 -6.087 1.00 13.50 H new ATOM 0 HA2 GLY A 125 -4.721 -8.294 -7.342 1.00 13.14 H new ATOM 0 HA3 GLY A 125 -6.324 -8.551 -6.683 1.00 13.14 H new ATOM 1431 N ASN A 126 -6.265 -7.630 -9.351 1.00 15.12 N ATOM 1432 CA ASN A 126 -6.874 -7.022 -10.548 1.00 21.11 C ATOM 1433 C ASN A 126 -6.213 -5.677 -10.908 1.00 4.51 C ATOM 1434 O ASN A 126 -6.864 -4.776 -11.441 1.00 23.13 O ATOM 1435 CB ASN A 126 -8.384 -6.830 -10.324 1.00 22.43 C ATOM 1436 CG ASN A 126 -9.119 -8.137 -10.055 1.00 53.11 C ATOM 1437 OD1 ASN A 126 -8.725 -9.204 -10.726 1.00 73.33 O flip ATOM 1438 ND2 ASN A 126 -10.054 -8.185 -9.265 1.00 30.10 N flip ATOM 0 H ASN A 126 -5.881 -8.562 -9.509 1.00 15.12 H new ATOM 0 HA ASN A 126 -6.712 -7.700 -11.386 1.00 21.11 H new ATOM 0 HB2 ASN A 126 -8.537 -6.154 -9.483 1.00 22.43 H new ATOM 0 HB3 ASN A 126 -8.817 -6.350 -11.202 1.00 22.43 H new ATOM 0 HD21 ASN A 126 -10.338 -7.346 -8.759 1.00 30.10 H new ATOM 0 HD22 ASN A 126 -10.548 -9.064 -9.113 1.00 30.10 H new ATOM 1445 N ASN A 127 -4.908 -5.562 -10.632 1.00 61.11 N ATOM 1446 CA ASN A 127 -4.151 -4.318 -10.872 1.00 1.34 C ATOM 1447 C ASN A 127 -4.627 -3.162 -9.978 1.00 63.14 C ATOM 1448 O ASN A 127 -4.238 -2.017 -10.181 1.00 15.30 O ATOM 1449 CB ASN A 127 -4.220 -3.911 -12.354 1.00 21.40 C ATOM 1450 CG ASN A 127 -3.499 -4.897 -13.249 1.00 42.11 C ATOM 1451 OD1 ASN A 127 -2.315 -4.753 -13.519 1.00 64.12 O ATOM 1452 ND2 ASN A 127 -4.203 -5.911 -13.712 1.00 22.41 N ATOM 0 H ASN A 127 -4.348 -6.319 -10.240 1.00 61.11 H new ATOM 0 HA ASN A 127 -3.114 -4.526 -10.610 1.00 1.34 H new ATOM 0 HB2 ASN A 127 -5.263 -3.838 -12.661 1.00 21.40 H new ATOM 0 HB3 ASN A 127 -3.781 -2.921 -12.479 1.00 21.40 H new ATOM 0 HD21 ASN A 127 -3.762 -6.605 -14.315 1.00 22.41 H new ATOM 0 HD22 ASN A 127 -5.189 -6.001 -13.467 1.00 22.41 H new ATOM 1459 N GLN A 128 -5.453 -3.465 -8.981 1.00 21.41 N ATOM 1460 CA GLN A 128 -5.910 -2.452 -8.029 1.00 72.20 C ATOM 1461 C GLN A 128 -5.120 -2.526 -6.718 1.00 43.01 C ATOM 1462 O GLN A 128 -4.749 -3.610 -6.257 1.00 41.41 O ATOM 1463 CB GLN A 128 -7.411 -2.612 -7.748 1.00 44.54 C ATOM 1464 CG GLN A 128 -8.293 -2.336 -8.960 1.00 73.23 C ATOM 1465 CD GLN A 128 -9.784 -2.432 -8.659 1.00 32.21 C ATOM 1466 OE1 GLN A 128 -10.181 -2.075 -7.452 1.00 61.20 O flip ATOM 1467 NE2 GLN A 128 -10.577 -2.816 -9.510 1.00 22.41 N flip ATOM 0 H GLN A 128 -5.820 -4.401 -8.810 1.00 21.41 H new ATOM 0 HA GLN A 128 -5.737 -1.474 -8.478 1.00 72.20 H new ATOM 0 HB2 GLN A 128 -7.600 -3.626 -7.395 1.00 44.54 H new ATOM 0 HB3 GLN A 128 -7.695 -1.936 -6.941 1.00 44.54 H new ATOM 0 HG2 GLN A 128 -8.071 -1.340 -9.342 1.00 73.23 H new ATOM 0 HG3 GLN A 128 -8.043 -3.044 -9.750 1.00 73.23 H new ATOM 0 HE21 GLN A 128 -10.242 -3.086 -10.435 1.00 22.41 H new ATOM 0 HE22 GLN A 128 -11.573 -2.866 -9.294 1.00 22.41 H new ATOM 1476 N PHE A 129 -4.862 -1.364 -6.130 1.00 31.23 N ATOM 1477 CA PHE A 129 -4.136 -1.275 -4.858 1.00 70.12 C ATOM 1478 C PHE A 129 -4.527 -0.017 -4.073 1.00 62.24 C ATOM 1479 O PHE A 129 -4.922 0.998 -4.655 1.00 53.24 O ATOM 1480 CB PHE A 129 -2.618 -1.305 -5.099 1.00 63.11 C ATOM 1481 CG PHE A 129 -2.140 -0.351 -6.168 1.00 15.43 C ATOM 1482 CD1 PHE A 129 -1.769 0.950 -5.855 1.00 71.24 C ATOM 1483 CD2 PHE A 129 -2.063 -0.765 -7.488 1.00 63.13 C ATOM 1484 CE1 PHE A 129 -1.333 1.815 -6.842 1.00 33.02 C ATOM 1485 CE2 PHE A 129 -1.627 0.092 -8.475 1.00 11.11 C ATOM 1486 CZ PHE A 129 -1.261 1.384 -8.153 1.00 33.34 C ATOM 0 H PHE A 129 -5.145 -0.462 -6.513 1.00 31.23 H new ATOM 0 HA PHE A 129 -4.414 -2.142 -4.259 1.00 70.12 H new ATOM 0 HB2 PHE A 129 -2.109 -1.070 -4.164 1.00 63.11 H new ATOM 0 HB3 PHE A 129 -2.326 -2.318 -5.375 1.00 63.11 H new ATOM 0 HD1 PHE A 129 -1.821 1.290 -4.831 1.00 71.24 H new ATOM 0 HD2 PHE A 129 -2.349 -1.774 -7.747 1.00 63.13 H new ATOM 0 HE1 PHE A 129 -1.049 2.826 -6.589 1.00 33.02 H new ATOM 0 HE2 PHE A 129 -1.572 -0.246 -9.499 1.00 11.11 H new ATOM 0 HZ PHE A 129 -0.919 2.057 -8.925 1.00 33.34 H new ATOM 1496 N VAL A 130 -4.421 -0.093 -2.750 1.00 40.31 N ATOM 1497 CA VAL A 130 -4.731 1.044 -1.878 1.00 34.33 C ATOM 1498 C VAL A 130 -3.444 1.714 -1.370 1.00 62.04 C ATOM 1499 O VAL A 130 -2.454 1.039 -1.079 1.00 71.04 O ATOM 1500 CB VAL A 130 -5.604 0.604 -0.673 1.00 72.11 C ATOM 1501 CG1 VAL A 130 -4.874 -0.423 0.189 1.00 11.11 C ATOM 1502 CG2 VAL A 130 -6.039 1.813 0.156 1.00 25.14 C ATOM 0 H VAL A 130 -4.122 -0.932 -2.253 1.00 40.31 H new ATOM 0 HA VAL A 130 -5.293 1.765 -2.471 1.00 34.33 H new ATOM 0 HB VAL A 130 -6.502 0.127 -1.065 1.00 72.11 H new ATOM 0 HG11 VAL A 130 -5.509 -0.713 1.026 1.00 11.11 H new ATOM 0 HG12 VAL A 130 -4.641 -1.302 -0.412 1.00 11.11 H new ATOM 0 HG13 VAL A 130 -3.950 0.012 0.569 1.00 11.11 H new ATOM 0 HG21 VAL A 130 -6.650 1.478 0.995 1.00 25.14 H new ATOM 0 HG22 VAL A 130 -5.158 2.332 0.533 1.00 25.14 H new ATOM 0 HG23 VAL A 130 -6.620 2.492 -0.468 1.00 25.14 H new ATOM 1512 N HIS A 131 -3.459 3.040 -1.276 1.00 70.31 N ATOM 1513 CA HIS A 131 -2.279 3.799 -0.842 1.00 60.44 C ATOM 1514 C HIS A 131 -2.680 5.174 -0.288 1.00 71.53 C ATOM 1515 O HIS A 131 -3.861 5.454 -0.090 1.00 3.12 O ATOM 1516 CB HIS A 131 -1.305 3.976 -2.016 1.00 71.32 C ATOM 1517 CG HIS A 131 -1.841 4.848 -3.113 1.00 53.31 C ATOM 1518 ND1 HIS A 131 -1.343 6.107 -3.331 1.00 25.42 N ATOM 1519 CD2 HIS A 131 -2.824 4.603 -4.012 1.00 63.31 C ATOM 1520 CE1 HIS A 131 -2.023 6.598 -4.347 1.00 44.32 C ATOM 1521 NE2 HIS A 131 -2.932 5.723 -4.795 1.00 73.02 N ATOM 0 H HIS A 131 -4.272 3.616 -1.493 1.00 70.31 H new ATOM 0 HA HIS A 131 -1.789 3.237 -0.047 1.00 60.44 H new ATOM 0 HB2 HIS A 131 -0.374 4.405 -1.644 1.00 71.32 H new ATOM 0 HB3 HIS A 131 -1.063 2.996 -2.427 1.00 71.32 H new ATOM 0 HD2 HIS A 131 -3.410 3.700 -4.096 1.00 63.31 H new ATOM 0 HE1 HIS A 131 -1.867 7.581 -4.765 1.00 44.32 H new ATOM 0 HE2 HIS A 131 -3.580 5.863 -5.570 1.00 73.02 H new ATOM 1529 N ALA A 132 -1.688 6.028 -0.040 1.00 32.13 N ATOM 1530 CA ALA A 132 -1.938 7.399 0.418 1.00 13.43 C ATOM 1531 C ALA A 132 -1.101 8.409 -0.383 1.00 72.24 C ATOM 1532 O ALA A 132 0.119 8.480 -0.226 1.00 44.21 O ATOM 1533 CB ALA A 132 -1.645 7.523 1.913 1.00 12.51 C ATOM 0 H ALA A 132 -0.701 5.796 -0.148 1.00 32.13 H new ATOM 0 HA ALA A 132 -2.991 7.627 0.250 1.00 13.43 H new ATOM 0 HB1 ALA A 132 -1.835 8.546 2.237 1.00 12.51 H new ATOM 0 HB2 ALA A 132 -2.289 6.841 2.468 1.00 12.51 H new ATOM 0 HB3 ALA A 132 -0.601 7.271 2.101 1.00 12.51 H new ATOM 1539 N SER A 133 -1.758 9.183 -1.250 1.00 54.34 N ATOM 1540 CA SER A 133 -1.060 10.165 -2.097 1.00 61.01 C ATOM 1541 C SER A 133 -0.994 11.537 -1.420 1.00 34.02 C ATOM 1542 O SER A 133 -1.843 11.881 -0.596 1.00 40.23 O ATOM 1543 CB SER A 133 -1.750 10.311 -3.465 1.00 52.24 C ATOM 1544 OG SER A 133 -2.983 11.009 -3.362 1.00 55.24 O ATOM 0 H SER A 133 -2.768 9.153 -1.387 1.00 54.34 H new ATOM 0 HA SER A 133 -0.047 9.792 -2.245 1.00 61.01 H new ATOM 0 HB2 SER A 133 -1.089 10.840 -4.151 1.00 52.24 H new ATOM 0 HB3 SER A 133 -1.926 9.323 -3.891 1.00 52.24 H new ATOM 0 HG SER A 133 -3.392 11.084 -4.250 1.00 55.24 H new ATOM 1550 N THR A 134 -0.002 12.339 -1.801 1.00 30.51 N ATOM 1551 CA THR A 134 0.202 13.674 -1.212 1.00 44.23 C ATOM 1552 C THR A 134 -0.936 14.654 -1.556 1.00 52.42 C ATOM 1553 O THR A 134 -0.933 15.799 -1.101 1.00 43.02 O ATOM 1554 CB THR A 134 1.543 14.293 -1.671 1.00 12.04 C ATOM 1555 OG1 THR A 134 1.549 14.466 -3.099 1.00 20.30 O ATOM 1556 CG2 THR A 134 2.724 13.417 -1.261 1.00 51.11 C ATOM 0 H THR A 134 0.680 12.092 -2.518 1.00 30.51 H new ATOM 0 HA THR A 134 0.214 13.521 -0.133 1.00 44.23 H new ATOM 0 HB THR A 134 1.644 15.263 -1.185 1.00 12.04 H new ATOM 0 HG1 THR A 134 2.402 14.860 -3.377 1.00 20.30 H new ATOM 0 HG21 THR A 134 3.653 13.878 -1.597 1.00 51.11 H new ATOM 0 HG22 THR A 134 2.742 13.315 -0.176 1.00 51.11 H new ATOM 0 HG23 THR A 134 2.622 12.432 -1.717 1.00 51.11 H new ATOM 1564 N SER A 135 -1.905 14.208 -2.356 1.00 0.24 N ATOM 1565 CA SER A 135 -3.037 15.062 -2.752 1.00 45.12 C ATOM 1566 C SER A 135 -4.279 14.816 -1.879 1.00 42.55 C ATOM 1567 O SER A 135 -4.694 15.687 -1.107 1.00 24.24 O ATOM 1568 CB SER A 135 -3.396 14.841 -4.228 1.00 43.22 C ATOM 1569 OG SER A 135 -4.523 15.621 -4.602 1.00 61.44 O ATOM 0 H SER A 135 -1.934 13.265 -2.744 1.00 0.24 H new ATOM 0 HA SER A 135 -2.719 16.094 -2.606 1.00 45.12 H new ATOM 0 HB2 SER A 135 -2.544 15.102 -4.856 1.00 43.22 H new ATOM 0 HB3 SER A 135 -3.607 13.786 -4.400 1.00 43.22 H new ATOM 0 HG SER A 135 -4.731 15.464 -5.547 1.00 61.44 H new ATOM 1575 N SER A 136 -4.877 13.628 -2.001 1.00 23.44 N ATOM 1576 CA SER A 136 -6.129 13.312 -1.288 1.00 52.22 C ATOM 1577 C SER A 136 -5.908 12.384 -0.088 1.00 54.11 C ATOM 1578 O SER A 136 -6.837 12.129 0.679 1.00 41.23 O ATOM 1579 CB SER A 136 -7.145 12.669 -2.245 1.00 1.10 C ATOM 1580 OG SER A 136 -7.491 13.548 -3.304 1.00 53.21 O ATOM 0 H SER A 136 -4.521 12.869 -2.582 1.00 23.44 H new ATOM 0 HA SER A 136 -6.517 14.258 -0.910 1.00 52.22 H new ATOM 0 HB2 SER A 136 -6.728 11.749 -2.656 1.00 1.10 H new ATOM 0 HB3 SER A 136 -8.043 12.393 -1.692 1.00 1.10 H new ATOM 0 HG SER A 136 -8.137 13.109 -3.896 1.00 53.21 H new ATOM 1586 N GLY A 137 -4.688 11.886 0.080 1.00 64.15 N ATOM 1587 CA GLY A 137 -4.412 10.955 1.166 1.00 42.44 C ATOM 1588 C GLY A 137 -4.758 9.513 0.805 1.00 72.10 C ATOM 1589 O GLY A 137 -4.409 9.043 -0.281 1.00 32.45 O ATOM 0 H GLY A 137 -3.887 12.107 -0.511 1.00 64.15 H new ATOM 0 HA2 GLY A 137 -3.357 11.016 1.432 1.00 42.44 H new ATOM 0 HA3 GLY A 137 -4.981 11.252 2.047 1.00 42.44 H new ATOM 1593 N VAL A 138 -5.449 8.819 1.708 1.00 64.52 N ATOM 1594 CA VAL A 138 -5.780 7.398 1.514 1.00 45.21 C ATOM 1595 C VAL A 138 -6.807 7.188 0.385 1.00 52.13 C ATOM 1596 O VAL A 138 -7.989 7.510 0.538 1.00 13.43 O ATOM 1597 CB VAL A 138 -6.318 6.763 2.820 1.00 2.01 C ATOM 1598 CG1 VAL A 138 -6.625 5.279 2.617 1.00 32.11 C ATOM 1599 CG2 VAL A 138 -5.323 6.959 3.962 1.00 71.13 C ATOM 0 H VAL A 138 -5.793 9.213 2.584 1.00 64.52 H new ATOM 0 HA VAL A 138 -4.851 6.905 1.229 1.00 45.21 H new ATOM 0 HB VAL A 138 -7.247 7.266 3.086 1.00 2.01 H new ATOM 0 HG11 VAL A 138 -7.001 4.855 3.548 1.00 32.11 H new ATOM 0 HG12 VAL A 138 -7.377 5.167 1.836 1.00 32.11 H new ATOM 0 HG13 VAL A 138 -5.715 4.756 2.322 1.00 32.11 H new ATOM 0 HG21 VAL A 138 -5.719 6.506 4.871 1.00 71.13 H new ATOM 0 HG22 VAL A 138 -4.375 6.486 3.704 1.00 71.13 H new ATOM 0 HG23 VAL A 138 -5.164 8.025 4.127 1.00 71.13 H new ATOM 1609 N ILE A 139 -6.344 6.633 -0.740 1.00 62.51 N ATOM 1610 CA ILE A 139 -7.197 6.388 -1.914 1.00 53.45 C ATOM 1611 C ILE A 139 -6.829 5.075 -2.637 1.00 42.31 C ATOM 1612 O ILE A 139 -5.899 4.367 -2.243 1.00 13.32 O ATOM 1613 CB ILE A 139 -7.099 7.549 -2.940 1.00 75.43 C ATOM 1614 CG1 ILE A 139 -5.639 7.753 -3.387 1.00 53.41 C ATOM 1615 CG2 ILE A 139 -7.672 8.843 -2.364 1.00 51.40 C ATOM 1616 CD1 ILE A 139 -5.463 8.836 -4.433 1.00 75.42 C ATOM 0 H ILE A 139 -5.375 6.342 -0.865 1.00 62.51 H new ATOM 0 HA ILE A 139 -8.215 6.315 -1.531 1.00 53.45 H new ATOM 0 HB ILE A 139 -7.694 7.279 -3.813 1.00 75.43 H new ATOM 0 HG12 ILE A 139 -5.034 8.002 -2.515 1.00 53.41 H new ATOM 0 HG13 ILE A 139 -5.256 6.813 -3.783 1.00 53.41 H new ATOM 0 HG21 ILE A 139 -7.590 9.639 -3.105 1.00 51.40 H new ATOM 0 HG22 ILE A 139 -8.721 8.694 -2.106 1.00 51.40 H new ATOM 0 HG23 ILE A 139 -7.115 9.121 -1.469 1.00 51.40 H new ATOM 0 HD11 ILE A 139 -4.409 8.920 -4.696 1.00 75.42 H new ATOM 0 HD12 ILE A 139 -6.040 8.580 -5.322 1.00 75.42 H new ATOM 0 HD13 ILE A 139 -5.814 9.788 -4.034 1.00 75.42 H new ATOM 1628 N ILE A 140 -7.566 4.765 -3.707 1.00 64.12 N ATOM 1629 CA ILE A 140 -7.290 3.584 -4.545 1.00 53.53 C ATOM 1630 C ILE A 140 -6.675 4.000 -5.898 1.00 63.11 C ATOM 1631 O ILE A 140 -6.943 5.091 -6.402 1.00 52.21 O ATOM 1632 CB ILE A 140 -8.595 2.776 -4.817 1.00 73.53 C ATOM 1633 CG1 ILE A 140 -9.281 2.383 -3.495 1.00 30.01 C ATOM 1634 CG2 ILE A 140 -8.305 1.532 -5.662 1.00 1.23 C ATOM 1635 CD1 ILE A 140 -8.466 1.444 -2.629 1.00 52.40 C ATOM 0 H ILE A 140 -8.365 5.317 -4.019 1.00 64.12 H new ATOM 0 HA ILE A 140 -6.582 2.960 -3.999 1.00 53.53 H new ATOM 0 HB ILE A 140 -9.274 3.417 -5.379 1.00 73.53 H new ATOM 0 HG12 ILE A 140 -9.497 3.288 -2.927 1.00 30.01 H new ATOM 0 HG13 ILE A 140 -10.238 1.913 -3.721 1.00 30.01 H new ATOM 0 HG21 ILE A 140 -9.232 0.987 -5.837 1.00 1.23 H new ATOM 0 HG22 ILE A 140 -7.875 1.833 -6.617 1.00 1.23 H new ATOM 0 HG23 ILE A 140 -7.600 0.890 -5.134 1.00 1.23 H new ATOM 0 HD11 ILE A 140 -9.020 1.217 -1.718 1.00 52.40 H new ATOM 0 HD12 ILE A 140 -8.272 0.521 -3.176 1.00 52.40 H new ATOM 0 HD13 ILE A 140 -7.519 1.918 -2.370 1.00 52.40 H new ATOM 1647 N SER A 141 -5.838 3.135 -6.474 1.00 23.14 N ATOM 1648 CA SER A 141 -5.268 3.373 -7.815 1.00 44.03 C ATOM 1649 C SER A 141 -5.013 2.054 -8.558 1.00 72.31 C ATOM 1650 O SER A 141 -5.141 0.968 -7.981 1.00 34.15 O ATOM 1651 CB SER A 141 -3.973 4.192 -7.721 1.00 71.32 C ATOM 1652 OG SER A 141 -4.232 5.513 -7.257 1.00 24.24 O ATOM 0 H SER A 141 -5.536 2.263 -6.039 1.00 23.14 H new ATOM 0 HA SER A 141 -6.000 3.945 -8.385 1.00 44.03 H new ATOM 0 HB2 SER A 141 -3.275 3.697 -7.046 1.00 71.32 H new ATOM 0 HB3 SER A 141 -3.495 4.235 -8.700 1.00 71.32 H new ATOM 0 HG SER A 141 -5.179 5.596 -7.019 1.00 24.24 H new ATOM 1658 N SER A 142 -4.650 2.152 -9.839 1.00 44.22 N ATOM 1659 CA SER A 142 -4.488 0.962 -10.692 1.00 50.34 C ATOM 1660 C SER A 142 -3.139 0.950 -11.430 1.00 51.33 C ATOM 1661 O SER A 142 -2.653 1.982 -11.889 1.00 54.14 O ATOM 1662 CB SER A 142 -5.626 0.879 -11.717 1.00 21.14 C ATOM 1663 OG SER A 142 -6.898 0.829 -11.087 1.00 13.02 O ATOM 0 H SER A 142 -4.462 3.037 -10.311 1.00 44.22 H new ATOM 0 HA SER A 142 -4.517 0.096 -10.031 1.00 50.34 H new ATOM 0 HB2 SER A 142 -5.582 1.743 -12.380 1.00 21.14 H new ATOM 0 HB3 SER A 142 -5.492 -0.007 -12.338 1.00 21.14 H new ATOM 0 HG SER A 142 -7.599 0.778 -11.770 1.00 13.02 H new ATOM 1669 N MET A 143 -2.563 -0.246 -11.564 1.00 32.43 N ATOM 1670 CA MET A 143 -1.260 -0.432 -12.227 1.00 33.45 C ATOM 1671 C MET A 143 -1.270 0.042 -13.690 1.00 32.42 C ATOM 1672 O MET A 143 -0.232 0.411 -14.234 1.00 1.24 O ATOM 1673 CB MET A 143 -0.857 -1.914 -12.190 1.00 54.33 C ATOM 1674 CG MET A 143 -0.596 -2.457 -10.792 1.00 11.35 C ATOM 1675 SD MET A 143 0.822 -1.680 -9.997 1.00 50.42 S ATOM 1676 CE MET A 143 2.113 -2.022 -11.188 1.00 2.54 C ATOM 0 H MET A 143 -2.979 -1.111 -11.220 1.00 32.43 H new ATOM 0 HA MET A 143 -0.540 0.176 -11.680 1.00 33.45 H new ATOM 0 HB2 MET A 143 -1.646 -2.505 -12.655 1.00 54.33 H new ATOM 0 HB3 MET A 143 0.041 -2.050 -12.793 1.00 54.33 H new ATOM 0 HG2 MET A 143 -1.482 -2.303 -10.176 1.00 11.35 H new ATOM 0 HG3 MET A 143 -0.431 -3.533 -10.850 1.00 11.35 H new ATOM 0 HE1 MET A 143 2.946 -2.517 -10.689 1.00 2.54 H new ATOM 0 HE2 MET A 143 1.722 -2.671 -11.972 1.00 2.54 H new ATOM 0 HE3 MET A 143 2.458 -1.087 -11.629 1.00 2.54 H new ATOM 1686 N ASN A 144 -2.435 0.015 -14.328 1.00 63.14 N ATOM 1687 CA ASN A 144 -2.545 0.377 -15.746 1.00 54.04 C ATOM 1688 C ASN A 144 -2.721 1.893 -15.958 1.00 61.03 C ATOM 1689 O ASN A 144 -2.903 2.350 -17.089 1.00 31.42 O ATOM 1690 CB ASN A 144 -3.706 -0.383 -16.392 1.00 22.31 C ATOM 1691 CG ASN A 144 -3.584 -1.894 -16.242 1.00 60.41 C ATOM 1692 OD1 ASN A 144 -2.366 -2.405 -16.199 1.00 13.14 O flip ATOM 1693 ND2 ASN A 144 -4.582 -2.603 -16.170 1.00 43.34 N flip ATOM 0 H ASN A 144 -3.317 -0.252 -13.892 1.00 63.14 H new ATOM 0 HA ASN A 144 -1.607 0.094 -16.224 1.00 54.04 H new ATOM 0 HB2 ASN A 144 -4.643 -0.053 -15.944 1.00 22.31 H new ATOM 0 HB3 ASN A 144 -3.753 -0.131 -17.451 1.00 22.31 H new ATOM 0 HD21 ASN A 144 -5.510 -2.182 -16.206 1.00 43.34 H new ATOM 0 HD22 ASN A 144 -4.484 -3.614 -16.074 1.00 43.34 H new ATOM 1700 N GLU A 145 -2.676 2.670 -14.876 1.00 14.31 N ATOM 1701 CA GLU A 145 -2.748 4.134 -14.977 1.00 65.42 C ATOM 1702 C GLU A 145 -1.366 4.714 -15.334 1.00 0.43 C ATOM 1703 O GLU A 145 -0.385 4.445 -14.643 1.00 45.05 O ATOM 1704 CB GLU A 145 -3.267 4.742 -13.666 1.00 33.45 C ATOM 1705 CG GLU A 145 -4.661 4.257 -13.278 1.00 32.14 C ATOM 1706 CD GLU A 145 -5.200 4.911 -12.009 1.00 70.14 C ATOM 1707 OE1 GLU A 145 -4.516 4.861 -10.968 1.00 70.55 O ATOM 1708 OE2 GLU A 145 -6.326 5.457 -12.043 1.00 30.51 O ATOM 0 H GLU A 145 -2.591 2.316 -13.923 1.00 14.31 H new ATOM 0 HA GLU A 145 -3.448 4.392 -15.772 1.00 65.42 H new ATOM 0 HB2 GLU A 145 -2.571 4.501 -12.863 1.00 33.45 H new ATOM 0 HB3 GLU A 145 -3.282 5.828 -13.760 1.00 33.45 H new ATOM 0 HG2 GLU A 145 -5.348 4.456 -14.100 1.00 32.14 H new ATOM 0 HG3 GLU A 145 -4.636 3.176 -13.138 1.00 32.14 H new ATOM 1715 N PRO A 146 -1.283 5.525 -16.414 1.00 43.31 N ATOM 1716 CA PRO A 146 -0.010 6.035 -16.968 1.00 51.21 C ATOM 1717 C PRO A 146 1.056 6.413 -15.923 1.00 13.00 C ATOM 1718 O PRO A 146 2.206 5.982 -16.024 1.00 35.42 O ATOM 1719 CB PRO A 146 -0.462 7.272 -17.747 1.00 42.23 C ATOM 1720 CG PRO A 146 -1.822 6.912 -18.247 1.00 4.15 C ATOM 1721 CD PRO A 146 -2.440 6.017 -17.196 1.00 1.12 C ATOM 0 HA PRO A 146 0.492 5.267 -17.557 1.00 51.21 H new ATOM 0 HB2 PRO A 146 -0.493 8.155 -17.109 1.00 42.23 H new ATOM 0 HB3 PRO A 146 0.218 7.496 -18.569 1.00 42.23 H new ATOM 0 HG2 PRO A 146 -2.428 7.805 -18.402 1.00 4.15 H new ATOM 0 HG3 PRO A 146 -1.760 6.399 -19.207 1.00 4.15 H new ATOM 0 HD2 PRO A 146 -3.141 6.566 -16.568 1.00 1.12 H new ATOM 0 HD3 PRO A 146 -2.994 5.194 -17.649 1.00 1.12 H new ATOM 1729 N TYR A 147 0.676 7.211 -14.920 1.00 3.11 N ATOM 1730 CA TYR A 147 1.635 7.676 -13.905 1.00 14.43 C ATOM 1731 C TYR A 147 2.271 6.508 -13.136 1.00 41.43 C ATOM 1732 O TYR A 147 3.475 6.500 -12.898 1.00 24.24 O ATOM 1733 CB TYR A 147 0.963 8.642 -12.916 1.00 5.25 C ATOM 1734 CG TYR A 147 1.879 9.069 -11.776 1.00 52.30 C ATOM 1735 CD1 TYR A 147 2.958 9.917 -12.005 1.00 42.14 C ATOM 1736 CD2 TYR A 147 1.677 8.607 -10.478 1.00 63.23 C ATOM 1737 CE1 TYR A 147 3.806 10.293 -10.979 1.00 24.01 C ATOM 1738 CE2 TYR A 147 2.519 8.982 -9.446 1.00 3.10 C ATOM 1739 CZ TYR A 147 3.583 9.823 -9.703 1.00 12.51 C ATOM 1740 OH TYR A 147 4.430 10.189 -8.677 1.00 34.11 O ATOM 0 H TYR A 147 -0.278 7.547 -14.787 1.00 3.11 H new ATOM 0 HA TYR A 147 2.427 8.202 -14.438 1.00 14.43 H new ATOM 0 HB2 TYR A 147 0.628 9.528 -13.455 1.00 5.25 H new ATOM 0 HB3 TYR A 147 0.075 8.166 -12.501 1.00 5.25 H new ATOM 0 HD1 TYR A 147 3.137 10.289 -13.003 1.00 42.14 H new ATOM 0 HD2 TYR A 147 0.849 7.945 -10.273 1.00 63.23 H new ATOM 0 HE1 TYR A 147 4.639 10.952 -11.177 1.00 24.01 H new ATOM 0 HE2 TYR A 147 2.345 8.618 -8.444 1.00 3.10 H new ATOM 0 HH TYR A 147 4.131 9.772 -7.842 1.00 34.11 H new ATOM 1750 N TRP A 148 1.460 5.527 -12.759 1.00 64.32 N ATOM 1751 CA TRP A 148 1.942 4.393 -11.962 1.00 74.34 C ATOM 1752 C TRP A 148 2.624 3.344 -12.851 1.00 61.24 C ATOM 1753 O TRP A 148 3.684 2.814 -12.514 1.00 50.22 O ATOM 1754 CB TRP A 148 0.772 3.752 -11.197 1.00 5.31 C ATOM 1755 CG TRP A 148 0.041 4.714 -10.305 1.00 14.35 C ATOM 1756 CD1 TRP A 148 -1.208 5.227 -10.499 1.00 62.42 C ATOM 1757 CD2 TRP A 148 0.520 5.288 -9.085 1.00 20.33 C ATOM 1758 NE1 TRP A 148 -1.535 6.079 -9.474 1.00 44.13 N ATOM 1759 CE2 TRP A 148 -0.490 6.132 -8.592 1.00 75.34 C ATOM 1760 CE3 TRP A 148 1.704 5.164 -8.361 1.00 73.24 C ATOM 1761 CZ2 TRP A 148 -0.348 6.850 -7.408 1.00 33.34 C ATOM 1762 CZ3 TRP A 148 1.847 5.875 -7.186 1.00 63.11 C ATOM 1763 CH2 TRP A 148 0.825 6.710 -6.719 1.00 54.35 C ATOM 0 H TRP A 148 0.467 5.489 -12.989 1.00 64.32 H new ATOM 0 HA TRP A 148 2.677 4.766 -11.249 1.00 74.34 H new ATOM 0 HB2 TRP A 148 0.069 3.327 -11.914 1.00 5.31 H new ATOM 0 HB3 TRP A 148 1.151 2.926 -10.595 1.00 5.31 H new ATOM 0 HD1 TRP A 148 -1.847 4.996 -11.338 1.00 62.42 H new ATOM 0 HE1 TRP A 148 -2.414 6.589 -9.384 1.00 44.13 H new ATOM 0 HE3 TRP A 148 2.498 4.522 -8.713 1.00 73.24 H new ATOM 0 HZ2 TRP A 148 -1.136 7.494 -7.047 1.00 33.34 H new ATOM 0 HZ3 TRP A 148 2.761 5.786 -6.618 1.00 63.11 H new ATOM 0 HH2 TRP A 148 0.966 7.254 -5.797 1.00 54.35 H new ATOM 1774 N LYS A 149 2.011 3.078 -13.998 1.00 74.01 N ATOM 1775 CA LYS A 149 2.484 2.061 -14.943 1.00 30.03 C ATOM 1776 C LYS A 149 3.957 2.263 -15.348 1.00 61.34 C ATOM 1777 O LYS A 149 4.782 1.365 -15.185 1.00 65.02 O ATOM 1778 CB LYS A 149 1.577 2.070 -16.181 1.00 34.12 C ATOM 1779 CG LYS A 149 2.000 1.107 -17.286 1.00 62.20 C ATOM 1780 CD LYS A 149 0.945 1.022 -18.389 1.00 52.55 C ATOM 1781 CE LYS A 149 0.608 2.390 -18.971 1.00 55.31 C ATOM 1782 NZ LYS A 149 -0.449 2.306 -20.014 1.00 44.53 N ATOM 0 H LYS A 149 1.167 3.562 -14.305 1.00 74.01 H new ATOM 0 HA LYS A 149 2.435 1.092 -14.447 1.00 30.03 H new ATOM 0 HB2 LYS A 149 0.561 1.824 -15.872 1.00 34.12 H new ATOM 0 HB3 LYS A 149 1.551 3.081 -16.588 1.00 34.12 H new ATOM 0 HG2 LYS A 149 2.948 1.435 -17.712 1.00 62.20 H new ATOM 0 HG3 LYS A 149 2.166 0.116 -16.863 1.00 62.20 H new ATOM 0 HD2 LYS A 149 1.305 0.370 -19.184 1.00 52.55 H new ATOM 0 HD3 LYS A 149 0.039 0.566 -17.989 1.00 52.55 H new ATOM 0 HE2 LYS A 149 0.277 3.053 -18.171 1.00 55.31 H new ATOM 0 HE3 LYS A 149 1.507 2.833 -19.400 1.00 55.31 H new ATOM 0 HZ1 LYS A 149 -0.648 3.257 -20.384 1.00 44.53 H new ATOM 0 HZ2 LYS A 149 -0.124 1.694 -20.790 1.00 44.53 H new ATOM 0 HZ3 LYS A 149 -1.315 1.907 -19.599 1.00 44.53 H new ATOM 1796 N LYS A 150 4.291 3.447 -15.861 1.00 34.32 N ATOM 1797 CA LYS A 150 5.652 3.706 -16.352 1.00 32.35 C ATOM 1798 C LYS A 150 6.628 4.033 -15.206 1.00 74.32 C ATOM 1799 O LYS A 150 7.845 4.057 -15.406 1.00 74.22 O ATOM 1800 CB LYS A 150 5.640 4.836 -17.393 1.00 60.13 C ATOM 1801 CG LYS A 150 5.322 6.220 -16.832 1.00 75.02 C ATOM 1802 CD LYS A 150 5.156 7.251 -17.948 1.00 64.33 C ATOM 1803 CE LYS A 150 5.047 8.669 -17.401 1.00 14.45 C ATOM 1804 NZ LYS A 150 6.332 9.142 -16.826 1.00 62.43 N ATOM 0 H LYS A 150 3.650 4.235 -15.949 1.00 34.32 H new ATOM 0 HA LYS A 150 6.008 2.792 -16.827 1.00 32.35 H new ATOM 0 HB2 LYS A 150 6.614 4.872 -17.881 1.00 60.13 H new ATOM 0 HB3 LYS A 150 4.907 4.594 -18.163 1.00 60.13 H new ATOM 0 HG2 LYS A 150 4.408 6.173 -16.240 1.00 75.02 H new ATOM 0 HG3 LYS A 150 6.121 6.534 -16.161 1.00 75.02 H new ATOM 0 HD2 LYS A 150 6.005 7.189 -18.629 1.00 64.33 H new ATOM 0 HD3 LYS A 150 4.264 7.017 -18.529 1.00 64.33 H new ATOM 0 HE2 LYS A 150 4.737 9.343 -18.199 1.00 14.45 H new ATOM 0 HE3 LYS A 150 4.272 8.704 -16.635 1.00 14.45 H new ATOM 0 HZ1 LYS A 150 6.284 10.169 -16.668 1.00 62.43 H new ATOM 0 HZ2 LYS A 150 6.506 8.660 -15.921 1.00 62.43 H new ATOM 0 HZ3 LYS A 150 7.107 8.929 -17.486 1.00 62.43 H new ATOM 1818 N ARG A 151 6.093 4.274 -14.008 1.00 35.25 N ATOM 1819 CA ARG A 151 6.924 4.578 -12.831 1.00 73.32 C ATOM 1820 C ARG A 151 7.119 3.350 -11.925 1.00 63.25 C ATOM 1821 O ARG A 151 7.822 3.426 -10.914 1.00 24.11 O ATOM 1822 CB ARG A 151 6.309 5.727 -12.021 1.00 31.01 C ATOM 1823 CG ARG A 151 6.493 7.105 -12.655 1.00 23.42 C ATOM 1824 CD ARG A 151 7.957 7.532 -12.662 1.00 33.34 C ATOM 1825 NE ARG A 151 8.131 8.925 -13.074 1.00 74.23 N ATOM 1826 CZ ARG A 151 8.475 9.892 -12.265 1.00 45.22 C ATOM 1827 NH1 ARG A 151 8.612 9.674 -10.996 1.00 60.31 N ATOM 1828 NH2 ARG A 151 8.667 11.081 -12.729 1.00 64.53 N ATOM 0 H ARG A 151 5.090 4.266 -13.822 1.00 35.25 H new ATOM 0 HA ARG A 151 7.904 4.877 -13.202 1.00 73.32 H new ATOM 0 HB2 ARG A 151 5.243 5.537 -11.893 1.00 31.01 H new ATOM 0 HB3 ARG A 151 6.754 5.734 -11.026 1.00 31.01 H new ATOM 0 HG2 ARG A 151 6.114 7.089 -13.677 1.00 23.42 H new ATOM 0 HG3 ARG A 151 5.902 7.839 -12.107 1.00 23.42 H new ATOM 0 HD2 ARG A 151 8.377 7.396 -11.665 1.00 33.34 H new ATOM 0 HD3 ARG A 151 8.518 6.884 -13.336 1.00 33.34 H new ATOM 0 HE ARG A 151 7.974 9.156 -14.055 1.00 74.23 H new ATOM 0 HH11 ARG A 151 8.451 8.740 -10.619 1.00 60.31 H new ATOM 0 HH12 ARG A 151 8.881 10.436 -10.374 1.00 60.31 H new ATOM 0 HH21 ARG A 151 8.550 11.265 -13.726 1.00 64.53 H new ATOM 0 HH22 ARG A 151 8.936 11.837 -12.099 1.00 64.53 H new ATOM 1842 N TYR A 152 6.498 2.230 -12.283 1.00 50.14 N ATOM 1843 CA TYR A 152 6.621 0.991 -11.506 1.00 53.01 C ATOM 1844 C TYR A 152 8.087 0.538 -11.384 1.00 31.30 C ATOM 1845 O TYR A 152 8.795 0.391 -12.384 1.00 65.34 O ATOM 1846 CB TYR A 152 5.778 -0.122 -12.142 1.00 54.33 C ATOM 1847 CG TYR A 152 5.945 -1.481 -11.481 1.00 22.11 C ATOM 1848 CD1 TYR A 152 5.470 -1.721 -10.193 1.00 23.23 C ATOM 1849 CD2 TYR A 152 6.574 -2.525 -12.149 1.00 53.10 C ATOM 1850 CE1 TYR A 152 5.615 -2.961 -9.598 1.00 1.23 C ATOM 1851 CE2 TYR A 152 6.723 -3.764 -11.558 1.00 34.34 C ATOM 1852 CZ TYR A 152 6.241 -3.979 -10.286 1.00 31.12 C ATOM 1853 OH TYR A 152 6.387 -5.217 -9.702 1.00 11.24 O ATOM 0 H TYR A 152 5.902 2.150 -13.107 1.00 50.14 H new ATOM 0 HA TYR A 152 6.250 1.195 -10.501 1.00 53.01 H new ATOM 0 HB2 TYR A 152 4.727 0.164 -12.100 1.00 54.33 H new ATOM 0 HB3 TYR A 152 6.043 -0.207 -13.196 1.00 54.33 H new ATOM 0 HD1 TYR A 152 4.981 -0.926 -9.651 1.00 23.23 H new ATOM 0 HD2 TYR A 152 6.953 -2.364 -13.148 1.00 53.10 H new ATOM 0 HE1 TYR A 152 5.240 -3.131 -8.600 1.00 1.23 H new ATOM 0 HE2 TYR A 152 7.216 -4.563 -12.092 1.00 34.34 H new ATOM 0 HH TYR A 152 6.849 -5.819 -10.322 1.00 11.24 H new ATOM 1863 N ASN A 153 8.540 0.315 -10.149 1.00 25.45 N ATOM 1864 CA ASN A 153 9.914 -0.132 -9.902 1.00 22.33 C ATOM 1865 C ASN A 153 9.958 -1.641 -9.608 1.00 65.34 C ATOM 1866 O ASN A 153 10.615 -2.403 -10.319 1.00 62.20 O ATOM 1867 CB ASN A 153 10.528 0.651 -8.734 1.00 5.02 C ATOM 1868 CG ASN A 153 12.033 0.469 -8.648 1.00 1.12 C ATOM 1869 OD1 ASN A 153 12.789 1.226 -9.245 1.00 5.51 O ATOM 1870 ND2 ASN A 153 12.482 -0.530 -7.919 1.00 40.44 N ATOM 0 H ASN A 153 7.978 0.436 -9.306 1.00 25.45 H new ATOM 0 HA ASN A 153 10.498 0.059 -10.802 1.00 22.33 H new ATOM 0 HB2 ASN A 153 10.298 1.710 -8.849 1.00 5.02 H new ATOM 0 HB3 ASN A 153 10.071 0.325 -7.800 1.00 5.02 H new ATOM 0 HD21 ASN A 153 13.486 -0.692 -7.839 1.00 40.44 H new ATOM 0 HD22 ASN A 153 11.826 -1.143 -7.434 1.00 40.44 H new ATOM 1877 N GLU A 154 9.255 -2.063 -8.555 1.00 11.41 N ATOM 1878 CA GLU A 154 9.223 -3.479 -8.164 1.00 50.05 C ATOM 1879 C GLU A 154 8.147 -3.744 -7.100 1.00 2.40 C ATOM 1880 O GLU A 154 7.871 -2.891 -6.260 1.00 14.43 O ATOM 1881 CB GLU A 154 10.595 -3.917 -7.624 1.00 61.25 C ATOM 1882 CG GLU A 154 10.980 -3.246 -6.308 1.00 45.10 C ATOM 1883 CD GLU A 154 12.414 -3.532 -5.895 1.00 11.42 C ATOM 1884 OE1 GLU A 154 12.652 -4.548 -5.211 1.00 43.42 O ATOM 1885 OE2 GLU A 154 13.310 -2.740 -6.260 1.00 33.42 O ATOM 0 H GLU A 154 8.701 -1.449 -7.958 1.00 11.41 H new ATOM 0 HA GLU A 154 8.979 -4.059 -9.054 1.00 50.05 H new ATOM 0 HB2 GLU A 154 10.592 -4.998 -7.483 1.00 61.25 H new ATOM 0 HB3 GLU A 154 11.357 -3.695 -8.371 1.00 61.25 H new ATOM 0 HG2 GLU A 154 10.842 -2.169 -6.402 1.00 45.10 H new ATOM 0 HG3 GLU A 154 10.306 -3.586 -5.522 1.00 45.10 H new ATOM 1892 N ALA A 155 7.528 -4.919 -7.157 1.00 4.43 N ATOM 1893 CA ALA A 155 6.605 -5.359 -6.107 1.00 31.04 C ATOM 1894 C ALA A 155 7.303 -6.342 -5.159 1.00 13.25 C ATOM 1895 O ALA A 155 8.174 -7.101 -5.579 1.00 11.31 O ATOM 1896 CB ALA A 155 5.372 -5.999 -6.724 1.00 71.22 C ATOM 0 H ALA A 155 7.647 -5.587 -7.919 1.00 4.43 H new ATOM 0 HA ALA A 155 6.292 -4.488 -5.531 1.00 31.04 H new ATOM 0 HB1 ALA A 155 4.695 -6.321 -5.933 1.00 71.22 H new ATOM 0 HB2 ALA A 155 4.866 -5.274 -7.362 1.00 71.22 H new ATOM 0 HB3 ALA A 155 5.670 -6.861 -7.321 1.00 71.22 H new ATOM 1902 N ARG A 156 6.939 -6.318 -3.880 1.00 32.02 N ATOM 1903 CA ARG A 156 7.577 -7.183 -2.876 1.00 42.40 C ATOM 1904 C ARG A 156 6.548 -7.686 -1.849 1.00 44.34 C ATOM 1905 O ARG A 156 5.973 -6.896 -1.100 1.00 75.12 O ATOM 1906 CB ARG A 156 8.718 -6.425 -2.166 1.00 61.34 C ATOM 1907 CG ARG A 156 9.739 -5.811 -3.126 1.00 32.42 C ATOM 1908 CD ARG A 156 10.919 -5.175 -2.399 1.00 0.24 C ATOM 1909 NE ARG A 156 11.725 -6.165 -1.690 1.00 51.14 N ATOM 1910 CZ ARG A 156 12.936 -6.517 -2.031 1.00 71.15 C ATOM 1911 NH1 ARG A 156 13.503 -6.020 -3.083 1.00 55.24 N ATOM 1912 NH2 ARG A 156 13.574 -7.379 -1.314 1.00 45.33 N ATOM 0 H ARG A 156 6.207 -5.712 -3.509 1.00 32.02 H new ATOM 0 HA ARG A 156 7.995 -8.049 -3.389 1.00 42.40 H new ATOM 0 HB2 ARG A 156 8.289 -5.634 -1.551 1.00 61.34 H new ATOM 0 HB3 ARG A 156 9.232 -7.109 -1.492 1.00 61.34 H new ATOM 0 HG2 ARG A 156 10.107 -6.583 -3.802 1.00 32.42 H new ATOM 0 HG3 ARG A 156 9.247 -5.057 -3.741 1.00 32.42 H new ATOM 0 HD2 ARG A 156 11.545 -4.646 -3.118 1.00 0.24 H new ATOM 0 HD3 ARG A 156 10.551 -4.433 -1.690 1.00 0.24 H new ATOM 0 HE ARG A 156 11.314 -6.613 -0.871 1.00 51.14 H new ATOM 0 HH11 ARG A 156 13.004 -5.343 -3.660 1.00 55.24 H new ATOM 0 HH12 ARG A 156 14.449 -6.305 -3.335 1.00 55.24 H new ATOM 0 HH21 ARG A 156 13.133 -7.781 -0.487 1.00 45.33 H new ATOM 0 HH22 ARG A 156 14.520 -7.659 -1.574 1.00 45.33 H new ATOM 1926 N ARG A 157 6.314 -9.002 -1.807 1.00 21.43 N ATOM 1927 CA ARG A 157 5.283 -9.561 -0.915 1.00 10.23 C ATOM 1928 C ARG A 157 5.795 -9.722 0.527 1.00 50.32 C ATOM 1929 O ARG A 157 6.793 -10.398 0.778 1.00 13.44 O ATOM 1930 CB ARG A 157 4.718 -10.895 -1.456 1.00 3.12 C ATOM 1931 CG ARG A 157 5.607 -12.134 -1.288 1.00 14.32 C ATOM 1932 CD ARG A 157 6.880 -12.089 -2.135 1.00 50.35 C ATOM 1933 NE ARG A 157 7.217 -13.406 -2.674 1.00 24.43 N ATOM 1934 CZ ARG A 157 8.075 -14.238 -2.149 1.00 73.04 C ATOM 1935 NH1 ARG A 157 8.710 -13.948 -1.057 1.00 24.42 N ATOM 1936 NH2 ARG A 157 8.281 -15.378 -2.716 1.00 31.22 N ATOM 0 H ARG A 157 6.813 -9.693 -2.368 1.00 21.43 H new ATOM 0 HA ARG A 157 4.465 -8.840 -0.893 1.00 10.23 H new ATOM 0 HB2 ARG A 157 3.767 -11.088 -0.961 1.00 3.12 H new ATOM 0 HB3 ARG A 157 4.505 -10.770 -2.518 1.00 3.12 H new ATOM 0 HG2 ARG A 157 5.882 -12.235 -0.238 1.00 14.32 H new ATOM 0 HG3 ARG A 157 5.034 -13.022 -1.554 1.00 14.32 H new ATOM 0 HD2 ARG A 157 6.747 -11.383 -2.955 1.00 50.35 H new ATOM 0 HD3 ARG A 157 7.708 -11.721 -1.529 1.00 50.35 H new ATOM 0 HE ARG A 157 6.744 -13.698 -3.529 1.00 24.43 H new ATOM 0 HH11 ARG A 157 8.543 -13.056 -0.592 1.00 24.42 H new ATOM 0 HH12 ARG A 157 9.376 -14.612 -0.663 1.00 24.42 H new ATOM 0 HH21 ARG A 157 7.775 -15.623 -3.567 1.00 31.22 H new ATOM 0 HH22 ARG A 157 8.950 -16.035 -2.313 1.00 31.22 H new ATOM 1950 N VAL A 158 5.106 -9.083 1.472 1.00 15.24 N ATOM 1951 CA VAL A 158 5.503 -9.121 2.889 1.00 23.52 C ATOM 1952 C VAL A 158 4.711 -10.167 3.697 1.00 44.31 C ATOM 1953 O VAL A 158 5.145 -10.585 4.770 1.00 54.14 O ATOM 1954 CB VAL A 158 5.340 -7.731 3.553 1.00 23.52 C ATOM 1955 CG1 VAL A 158 6.302 -6.719 2.929 1.00 34.52 C ATOM 1956 CG2 VAL A 158 3.896 -7.242 3.445 1.00 4.31 C ATOM 0 H VAL A 158 4.269 -8.531 1.287 1.00 15.24 H new ATOM 0 HA VAL A 158 6.554 -9.410 2.900 1.00 23.52 H new ATOM 0 HB VAL A 158 5.585 -7.829 4.610 1.00 23.52 H new ATOM 0 HG11 VAL A 158 6.172 -5.749 3.409 1.00 34.52 H new ATOM 0 HG12 VAL A 158 7.328 -7.058 3.069 1.00 34.52 H new ATOM 0 HG13 VAL A 158 6.093 -6.627 1.863 1.00 34.52 H new ATOM 0 HG21 VAL A 158 3.807 -6.264 3.918 1.00 4.31 H new ATOM 0 HG22 VAL A 158 3.616 -7.164 2.394 1.00 4.31 H new ATOM 0 HG23 VAL A 158 3.234 -7.949 3.945 1.00 4.31 H new ATOM 1966 N LEU A 159 3.553 -10.582 3.186 1.00 43.53 N ATOM 1967 CA LEU A 159 2.734 -11.592 3.869 1.00 32.22 C ATOM 1968 C LEU A 159 3.407 -12.973 3.867 1.00 71.33 C ATOM 1969 O LEU A 159 3.447 -13.662 2.847 1.00 11.04 O ATOM 1970 CB LEU A 159 1.333 -11.686 3.240 1.00 5.44 C ATOM 1971 CG LEU A 159 0.388 -10.523 3.578 1.00 55.40 C ATOM 1972 CD1 LEU A 159 -0.971 -10.715 2.906 1.00 53.43 C ATOM 1973 CD2 LEU A 159 0.228 -10.385 5.093 1.00 23.42 C ATOM 0 H LEU A 159 3.160 -10.240 2.309 1.00 43.53 H new ATOM 0 HA LEU A 159 2.633 -11.269 4.905 1.00 32.22 H new ATOM 0 HB2 LEU A 159 1.441 -11.743 2.157 1.00 5.44 H new ATOM 0 HB3 LEU A 159 0.868 -12.617 3.563 1.00 5.44 H new ATOM 0 HG LEU A 159 0.828 -9.603 3.194 1.00 55.40 H new ATOM 0 HD11 LEU A 159 -1.624 -9.880 3.160 1.00 53.43 H new ATOM 0 HD12 LEU A 159 -0.839 -10.758 1.825 1.00 53.43 H new ATOM 0 HD13 LEU A 159 -1.421 -11.645 3.254 1.00 53.43 H new ATOM 0 HD21 LEU A 159 -0.445 -9.556 5.314 1.00 23.42 H new ATOM 0 HD22 LEU A 159 -0.186 -11.307 5.501 1.00 23.42 H new ATOM 0 HD23 LEU A 159 1.201 -10.193 5.546 1.00 23.42 H new