USER MOD reduce.3.24.130724 H: found=0, std=0, add=1146, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 957 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 39 SER OG : rot 53:sc= 0.768 USER MOD Set 1.2: A 68 GLN :FLIP amide:sc= 0.68 F(o=0.28,f=1.4) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 180:sc= -0.922 USER MOD Single : A 11 TYR OH : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0.0509 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= -0.0337 USER MOD Single : A 18 LYS NZ :NH3+ 145:sc= 1.25 (180deg=0.0636) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl -178:sc= -0.253 (180deg=-0.266) USER MOD Single : A 23 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00297) USER MOD Single : A 25 ASN :FLIP amide:sc= -0.119 F(o=-1.7,f=-0.12) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 146:sc= 1.29 (180deg=1.14) USER MOD Single : A 31 SER OG : rot -49:sc= -0.618 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 175:sc= 1.12 (180deg=0.968) USER MOD Single : A 42 THR OG1 : rot 86:sc= 0.956 USER MOD Single : A 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot 93:sc= 0.36 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -158:sc= 1.3 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 57 GLN : amide:sc= 0.545 K(o=0.54,f=-0.46) USER MOD Single : A 59 GLN :FLIP amide:sc= -0.884 F(o=-5.4!,f=-0.88) USER MOD Single : A 61 ASN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= -0.0883 X(o=-0.088,f=0) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 0.463 X(o=0.46,f=0) USER MOD Single : A 76 ASN :FLIP amide:sc= 0.0757 F(o=-1.2,f=0.076) USER MOD Single : A 77 TYR OH : rot -38:sc= 0.607 USER MOD Single : A 84 SER OG : rot 116:sc= 1.39 USER MOD Single : A 88 SER OG : rot 180:sc= 0.0589 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 154:sc= 1.25 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot -163:sc= 1.15 USER MOD Single : A 101 GLN : amide:sc= -0.128 X(o=-0.13,f=-0.02) USER MOD Single : A 102 MET CE :methyl 165:sc= 0 (180deg=-0.136) USER MOD Single : A 103 LYS NZ :NH3+ -125:sc= 1.24 (180deg=0.0983) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 TYR OH : rot -144:sc= 0.0411 USER MOD Single : A 111 SER OG : rot 180:sc= -0.0626 USER MOD Single : A 114 THR OG1 : rot 48:sc= 0.406 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 ASN : amide:sc= -0.271 X(o=-0.27,f=-0.28) USER MOD Single : A 120 HIS :FLIP no HD1:sc= 0.0332 F(o=-0.75,f=0.033) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 TYR OH : rot 180:sc= -0.381 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HD1:sc= -0.612 X(o=-0.61,f=-1) USER MOD Single : A 128 ASN : amide:sc= -0.0203 K(o=-0.02,f=-0.55) USER MOD Single : A 135 ASN : amide:sc= 0.917 K(o=0.92,f=0) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -177:sc= 1.24 (180deg=1.18) USER MOD Single : A 150 SER OG : rot -52:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 33 N LYS A 4 -5.222 -18.116 -1.789 1.00 0.00 N ATOM 34 CA LYS A 4 -4.554 -16.914 -1.278 1.00 74.51 C ATOM 35 C LYS A 4 -3.532 -16.398 -2.279 1.00 75.34 C ATOM 36 O LYS A 4 -2.889 -17.185 -2.973 1.00 71.11 O ATOM 37 CB LYS A 4 -3.980 -17.083 0.150 1.00 62.42 C ATOM 38 CG LYS A 4 -3.208 -18.363 0.536 1.00 23.12 C ATOM 39 CD LYS A 4 -2.098 -18.853 -0.403 1.00 40.15 C ATOM 40 CE LYS A 4 -1.036 -17.830 -0.833 1.00 11.13 C ATOM 41 NZ LYS A 4 -0.028 -17.558 0.206 1.00 23.31 N ATOM 0 HA LYS A 4 -5.320 -16.146 -1.168 1.00 74.51 H new ATOM 0 HB2 LYS A 4 -3.315 -16.239 0.332 1.00 62.42 H new ATOM 0 HB3 LYS A 4 -4.814 -16.988 0.846 1.00 62.42 H new ATOM 0 HG2 LYS A 4 -2.765 -18.201 1.519 1.00 23.12 H new ATOM 0 HG3 LYS A 4 -3.933 -19.170 0.643 1.00 23.12 H new ATOM 0 HD2 LYS A 4 -1.588 -19.685 0.083 1.00 40.15 H new ATOM 0 HD3 LYS A 4 -2.568 -19.250 -1.303 1.00 40.15 H new ATOM 0 HE2 LYS A 4 -0.534 -18.194 -1.729 1.00 11.13 H new ATOM 0 HE3 LYS A 4 -1.530 -16.896 -1.102 1.00 11.13 H new ATOM 0 HZ1 LYS A 4 0.657 -16.861 -0.149 1.00 23.31 H new ATOM 0 HZ2 LYS A 4 -0.497 -17.182 1.055 1.00 23.31 H new ATOM 0 HZ3 LYS A 4 0.469 -18.439 0.447 1.00 23.31 H new ATOM 51 N LYS A 5 -3.311 -15.083 -2.299 1.00 64.53 N ATOM 52 CA LYS A 5 -2.339 -14.404 -3.158 1.00 55.44 C ATOM 53 C LYS A 5 -1.809 -13.182 -2.445 1.00 54.04 C ATOM 54 O LYS A 5 -2.405 -12.729 -1.468 1.00 2.42 O ATOM 55 CB LYS A 5 -2.996 -13.897 -4.453 1.00 60.43 C ATOM 56 CG LYS A 5 -3.715 -15.009 -5.187 1.00 12.23 C ATOM 57 CD LYS A 5 -4.176 -14.612 -6.600 1.00 24.30 C ATOM 58 CE LYS A 5 -3.485 -15.455 -7.673 1.00 13.21 C ATOM 59 NZ LYS A 5 -2.061 -15.093 -7.851 1.00 15.11 N ATOM 0 H LYS A 5 -3.822 -14.438 -1.696 1.00 64.53 H new ATOM 0 HA LYS A 5 -1.552 -15.122 -3.388 1.00 55.44 H new ATOM 0 HB2 LYS A 5 -3.702 -13.101 -4.216 1.00 60.43 H new ATOM 0 HB3 LYS A 5 -2.235 -13.465 -5.102 1.00 60.43 H new ATOM 0 HG2 LYS A 5 -3.055 -15.873 -5.258 1.00 12.23 H new ATOM 0 HG3 LYS A 5 -4.582 -15.318 -4.603 1.00 12.23 H new ATOM 0 HD2 LYS A 5 -5.256 -14.735 -6.679 1.00 24.30 H new ATOM 0 HD3 LYS A 5 -3.962 -13.557 -6.771 1.00 24.30 H new ATOM 0 HE2 LYS A 5 -3.557 -16.509 -7.404 1.00 13.21 H new ATOM 0 HE3 LYS A 5 -4.009 -15.331 -8.621 1.00 13.21 H new ATOM 0 HZ1 LYS A 5 -1.640 -15.693 -8.589 1.00 15.11 H new ATOM 0 HZ2 LYS A 5 -1.989 -14.095 -8.134 1.00 15.11 H new ATOM 0 HZ3 LYS A 5 -1.552 -15.236 -6.956 1.00 15.11 H new ATOM 69 N THR A 6 -0.770 -12.597 -3.022 1.00 74.52 N ATOM 70 CA THR A 6 -0.200 -11.329 -2.604 1.00 32.13 C ATOM 71 C THR A 6 0.049 -10.474 -3.853 1.00 61.44 C ATOM 72 O THR A 6 0.829 -10.848 -4.732 1.00 60.53 O ATOM 73 CB THR A 6 1.056 -11.566 -1.749 1.00 21.24 C ATOM 74 OG1 THR A 6 0.769 -12.277 -0.559 1.00 33.32 O ATOM 75 CG2 THR A 6 1.746 -10.260 -1.345 1.00 32.42 C ATOM 0 H THR A 6 -0.286 -13.007 -3.821 1.00 74.52 H new ATOM 0 HA THR A 6 -0.888 -10.777 -1.963 1.00 32.13 H new ATOM 0 HB THR A 6 1.717 -12.153 -2.387 1.00 21.24 H new ATOM 0 HG1 THR A 6 1.595 -12.406 -0.048 1.00 33.32 H new ATOM 0 HG21 THR A 6 2.626 -10.485 -0.743 1.00 32.42 H new ATOM 0 HG22 THR A 6 2.048 -9.716 -2.240 1.00 32.42 H new ATOM 0 HG23 THR A 6 1.056 -9.648 -0.764 1.00 32.42 H new ATOM 83 N LEU A 7 -0.649 -9.345 -3.964 1.00 12.43 N ATOM 84 CA LEU A 7 -0.219 -8.191 -4.769 1.00 31.40 C ATOM 85 C LEU A 7 0.660 -7.293 -3.895 1.00 12.22 C ATOM 86 O LEU A 7 0.501 -7.270 -2.672 1.00 2.24 O ATOM 87 CB LEU A 7 -1.481 -7.485 -5.291 1.00 60.34 C ATOM 88 CG LEU A 7 -1.272 -6.208 -6.122 1.00 62.11 C ATOM 89 CD1 LEU A 7 -0.374 -6.399 -7.351 1.00 73.24 C ATOM 90 CD2 LEU A 7 -2.646 -5.715 -6.595 1.00 43.03 C ATOM 0 H LEU A 7 -1.542 -9.199 -3.493 1.00 12.43 H new ATOM 0 HA LEU A 7 0.379 -8.481 -5.633 1.00 31.40 H new ATOM 0 HB2 LEU A 7 -2.041 -8.197 -5.898 1.00 60.34 H new ATOM 0 HB3 LEU A 7 -2.107 -7.234 -4.435 1.00 60.34 H new ATOM 0 HG LEU A 7 -0.766 -5.490 -5.477 1.00 62.11 H new ATOM 0 HD11 LEU A 7 -0.278 -5.452 -7.882 1.00 73.24 H new ATOM 0 HD12 LEU A 7 0.612 -6.738 -7.032 1.00 73.24 H new ATOM 0 HD13 LEU A 7 -0.817 -7.143 -8.013 1.00 73.24 H new ATOM 0 HD21 LEU A 7 -2.523 -4.808 -7.188 1.00 43.03 H new ATOM 0 HD22 LEU A 7 -3.119 -6.485 -7.204 1.00 43.03 H new ATOM 0 HD23 LEU A 7 -3.273 -5.501 -5.730 1.00 43.03 H new ATOM 101 N ILE A 8 1.578 -6.546 -4.509 1.00 14.44 N ATOM 102 CA ILE A 8 2.418 -5.571 -3.838 1.00 2.40 C ATOM 103 C ILE A 8 2.395 -4.290 -4.669 1.00 12.02 C ATOM 104 O ILE A 8 2.533 -4.336 -5.899 1.00 3.13 O ATOM 105 CB ILE A 8 3.869 -6.071 -3.675 1.00 32.10 C ATOM 106 CG1 ILE A 8 4.040 -7.536 -3.210 1.00 35.44 C ATOM 107 CG2 ILE A 8 4.560 -5.088 -2.706 1.00 11.44 C ATOM 108 CD1 ILE A 8 5.488 -8.030 -3.378 1.00 74.34 C ATOM 0 H ILE A 8 1.757 -6.609 -5.511 1.00 14.44 H new ATOM 0 HA ILE A 8 2.032 -5.396 -2.834 1.00 2.40 H new ATOM 0 HB ILE A 8 4.328 -6.087 -4.664 1.00 32.10 H new ATOM 0 HG12 ILE A 8 3.747 -7.620 -2.163 1.00 35.44 H new ATOM 0 HG13 ILE A 8 3.369 -8.178 -3.781 1.00 35.44 H new ATOM 0 HG21 ILE A 8 5.595 -5.395 -2.553 1.00 11.44 H new ATOM 0 HG22 ILE A 8 4.538 -4.084 -3.129 1.00 11.44 H new ATOM 0 HG23 ILE A 8 4.036 -5.091 -1.750 1.00 11.44 H new ATOM 0 HD11 ILE A 8 5.562 -9.063 -3.039 1.00 74.34 H new ATOM 0 HD12 ILE A 8 5.773 -7.972 -4.429 1.00 74.34 H new ATOM 0 HD13 ILE A 8 6.157 -7.405 -2.786 1.00 74.34 H new ATOM 119 N LEU A 9 2.201 -3.153 -3.999 1.00 54.11 N ATOM 120 CA LEU A 9 2.047 -1.847 -4.616 1.00 54.11 C ATOM 121 C LEU A 9 2.797 -0.792 -3.807 1.00 12.44 C ATOM 122 O LEU A 9 2.900 -0.897 -2.584 1.00 72.02 O ATOM 123 CB LEU A 9 0.555 -1.473 -4.631 1.00 64.31 C ATOM 124 CG LEU A 9 -0.386 -2.455 -5.366 1.00 33.52 C ATOM 125 CD1 LEU A 9 -1.530 -2.844 -4.433 1.00 55.42 C ATOM 126 CD2 LEU A 9 -0.937 -1.893 -6.675 1.00 72.21 C ATOM 0 H LEU A 9 2.146 -3.121 -2.981 1.00 54.11 H new ATOM 0 HA LEU A 9 2.447 -1.885 -5.629 1.00 54.11 H new ATOM 0 HB2 LEU A 9 0.215 -1.379 -3.600 1.00 64.31 H new ATOM 0 HB3 LEU A 9 0.452 -0.490 -5.091 1.00 64.31 H new ATOM 0 HG LEU A 9 0.202 -3.332 -5.635 1.00 33.52 H new ATOM 0 HD11 LEU A 9 -2.198 -3.537 -4.945 1.00 55.42 H new ATOM 0 HD12 LEU A 9 -1.125 -3.323 -3.541 1.00 55.42 H new ATOM 0 HD13 LEU A 9 -2.085 -1.951 -4.146 1.00 55.42 H new ATOM 0 HD21 LEU A 9 -1.590 -2.631 -7.141 1.00 72.21 H new ATOM 0 HD22 LEU A 9 -1.504 -0.984 -6.471 1.00 72.21 H new ATOM 0 HD23 LEU A 9 -0.111 -1.662 -7.348 1.00 72.21 H new ATOM 137 N TYR A 10 3.247 0.276 -4.463 1.00 63.45 N ATOM 138 CA TYR A 10 3.845 1.451 -3.819 1.00 64.03 C ATOM 139 C TYR A 10 4.007 2.631 -4.763 1.00 24.23 C ATOM 140 O TYR A 10 4.007 2.464 -5.984 1.00 53.13 O ATOM 141 CB TYR A 10 5.159 1.150 -3.061 1.00 32.10 C ATOM 142 CG TYR A 10 5.930 -0.079 -3.486 1.00 54.31 C ATOM 143 CD1 TYR A 10 6.064 -0.423 -4.844 1.00 11.43 C ATOM 144 CD2 TYR A 10 6.352 -0.971 -2.481 1.00 2.23 C ATOM 145 CE1 TYR A 10 6.506 -1.705 -5.184 1.00 62.51 C ATOM 146 CE2 TYR A 10 6.839 -2.236 -2.811 1.00 11.02 C ATOM 147 CZ TYR A 10 6.888 -2.606 -4.167 1.00 73.51 C ATOM 148 OH TYR A 10 7.350 -3.824 -4.507 1.00 22.21 O ATOM 0 H TYR A 10 3.207 0.353 -5.479 1.00 63.45 H new ATOM 0 HA TYR A 10 3.116 1.742 -3.062 1.00 64.03 H new ATOM 0 HB2 TYR A 10 5.815 2.014 -3.164 1.00 32.10 H new ATOM 0 HB3 TYR A 10 4.924 1.053 -2.001 1.00 32.10 H new ATOM 0 HD1 TYR A 10 5.828 0.295 -5.615 1.00 11.43 H new ATOM 0 HD2 TYR A 10 6.298 -0.673 -1.444 1.00 2.23 H new ATOM 0 HE1 TYR A 10 6.555 -2.005 -6.220 1.00 62.51 H new ATOM 0 HE2 TYR A 10 7.171 -2.917 -2.041 1.00 11.02 H new ATOM 0 HH TYR A 10 7.572 -4.328 -3.696 1.00 22.21 H new ATOM 157 N TYR A 11 4.204 3.812 -4.171 1.00 61.44 N ATOM 158 CA TYR A 11 4.687 5.004 -4.851 1.00 62.44 C ATOM 159 C TYR A 11 6.128 5.271 -4.389 1.00 71.13 C ATOM 160 O TYR A 11 6.424 5.116 -3.200 1.00 43.11 O ATOM 161 CB TYR A 11 3.755 6.200 -4.579 1.00 15.41 C ATOM 162 CG TYR A 11 4.137 7.491 -5.304 1.00 64.05 C ATOM 163 CD1 TYR A 11 4.731 7.463 -6.585 1.00 31.10 C ATOM 164 CD2 TYR A 11 3.920 8.740 -4.686 1.00 75.01 C ATOM 165 CE1 TYR A 11 5.136 8.644 -7.225 1.00 15.53 C ATOM 166 CE2 TYR A 11 4.307 9.932 -5.330 1.00 44.22 C ATOM 167 CZ TYR A 11 4.933 9.888 -6.596 1.00 35.21 C ATOM 168 OH TYR A 11 5.335 11.035 -7.210 1.00 52.43 O ATOM 0 H TYR A 11 4.025 3.963 -3.178 1.00 61.44 H new ATOM 0 HA TYR A 11 4.686 4.854 -5.931 1.00 62.44 H new ATOM 0 HB2 TYR A 11 2.741 5.925 -4.868 1.00 15.41 H new ATOM 0 HB3 TYR A 11 3.740 6.394 -3.506 1.00 15.41 H new ATOM 0 HD1 TYR A 11 4.876 6.515 -7.081 1.00 31.10 H new ATOM 0 HD2 TYR A 11 3.454 8.783 -3.713 1.00 75.01 H new ATOM 0 HE1 TYR A 11 5.603 8.599 -8.198 1.00 15.53 H new ATOM 0 HE2 TYR A 11 4.124 10.884 -4.854 1.00 44.22 H new ATOM 0 HH TYR A 11 5.119 11.803 -6.641 1.00 52.43 H new ATOM 177 N SER A 12 7.010 5.647 -5.318 1.00 44.35 N ATOM 178 CA SER A 12 8.393 6.057 -5.067 1.00 11.12 C ATOM 179 C SER A 12 8.472 7.525 -4.587 1.00 51.31 C ATOM 180 O SER A 12 7.447 8.101 -4.221 1.00 53.31 O ATOM 181 CB SER A 12 9.241 5.724 -6.299 1.00 63.24 C ATOM 182 OG SER A 12 8.580 5.983 -7.525 1.00 22.50 O ATOM 0 H SER A 12 6.769 5.675 -6.309 1.00 44.35 H new ATOM 0 HA SER A 12 8.818 5.493 -4.237 1.00 11.12 H new ATOM 0 HB2 SER A 12 10.164 6.303 -6.263 1.00 63.24 H new ATOM 0 HB3 SER A 12 9.524 4.672 -6.263 1.00 63.24 H new ATOM 0 HG SER A 12 9.172 5.752 -8.271 1.00 22.50 H new ATOM 187 N TRP A 13 9.667 8.139 -4.514 1.00 3.10 N ATOM 188 CA TRP A 13 9.813 9.543 -4.118 1.00 51.53 C ATOM 189 C TRP A 13 10.849 10.241 -4.990 1.00 24.04 C ATOM 190 O TRP A 13 10.495 10.820 -6.017 1.00 55.41 O ATOM 191 CB TRP A 13 10.102 9.726 -2.620 1.00 35.44 C ATOM 192 CG TRP A 13 9.783 11.122 -2.186 1.00 40.55 C ATOM 193 CD1 TRP A 13 8.530 11.617 -2.090 1.00 63.31 C ATOM 194 CD2 TRP A 13 10.672 12.262 -1.979 1.00 51.11 C ATOM 195 NE1 TRP A 13 8.579 12.960 -1.800 1.00 74.11 N ATOM 196 CE2 TRP A 13 9.871 13.431 -1.800 1.00 33.23 C ATOM 197 CE3 TRP A 13 12.070 12.443 -1.981 1.00 24.43 C ATOM 198 CZ2 TRP A 13 10.422 14.714 -1.678 1.00 35.11 C ATOM 199 CZ3 TRP A 13 12.637 13.724 -1.846 1.00 20.31 C ATOM 200 CH2 TRP A 13 11.818 14.858 -1.703 1.00 63.33 C ATOM 0 H TRP A 13 10.550 7.676 -4.727 1.00 3.10 H new ATOM 0 HA TRP A 13 8.848 10.021 -4.284 1.00 51.53 H new ATOM 0 HB2 TRP A 13 9.511 9.016 -2.041 1.00 35.44 H new ATOM 0 HB3 TRP A 13 11.151 9.508 -2.418 1.00 35.44 H new ATOM 0 HD1 TRP A 13 7.624 11.043 -2.221 1.00 63.31 H new ATOM 0 HE1 TRP A 13 7.759 13.536 -1.609 1.00 74.11 H new ATOM 0 HE3 TRP A 13 12.717 11.585 -2.088 1.00 24.43 H new ATOM 0 HZ2 TRP A 13 9.783 15.578 -1.567 1.00 35.11 H new ATOM 0 HZ3 TRP A 13 13.711 13.837 -1.852 1.00 20.31 H new ATOM 0 HH2 TRP A 13 12.262 15.838 -1.613 1.00 63.33 H new ATOM 210 N SER A 14 12.126 10.130 -4.623 1.00 33.01 N ATOM 211 CA SER A 14 13.254 10.359 -5.502 1.00 12.50 C ATOM 212 C SER A 14 14.299 9.282 -5.181 1.00 2.21 C ATOM 213 O SER A 14 15.439 9.566 -4.811 1.00 42.44 O ATOM 214 CB SER A 14 13.731 11.816 -5.403 1.00 20.20 C ATOM 215 OG SER A 14 14.337 12.203 -6.624 1.00 2.31 O ATOM 0 H SER A 14 12.403 9.870 -3.676 1.00 33.01 H new ATOM 0 HA SER A 14 12.999 10.253 -6.557 1.00 12.50 H new ATOM 0 HB2 SER A 14 12.888 12.471 -5.180 1.00 20.20 H new ATOM 0 HB3 SER A 14 14.442 11.921 -4.583 1.00 20.20 H new ATOM 0 HG SER A 14 14.639 13.133 -6.559 1.00 2.31 H new ATOM 220 N GLY A 15 13.903 8.010 -5.299 1.00 14.03 N ATOM 221 CA GLY A 15 14.821 6.873 -5.255 1.00 43.44 C ATOM 222 C GLY A 15 14.893 6.199 -3.886 1.00 53.13 C ATOM 223 O GLY A 15 15.786 5.379 -3.655 1.00 12.40 O ATOM 0 H GLY A 15 12.928 7.741 -5.429 1.00 14.03 H new ATOM 0 HA2 GLY A 15 14.511 6.137 -5.997 1.00 43.44 H new ATOM 0 HA3 GLY A 15 15.818 7.210 -5.538 1.00 43.44 H new ATOM 227 N GLU A 16 13.985 6.544 -2.973 1.00 31.40 N ATOM 228 CA GLU A 16 13.935 5.989 -1.623 1.00 43.24 C ATOM 229 C GLU A 16 13.071 4.734 -1.682 1.00 62.21 C ATOM 230 O GLU A 16 13.566 3.620 -1.842 1.00 34.14 O ATOM 231 CB GLU A 16 13.368 7.036 -0.643 1.00 75.35 C ATOM 232 CG GLU A 16 14.203 8.324 -0.648 1.00 72.32 C ATOM 233 CD GLU A 16 13.923 9.219 0.560 1.00 51.51 C ATOM 234 OE1 GLU A 16 12.742 9.587 0.767 1.00 1.44 O ATOM 235 OE2 GLU A 16 14.885 9.591 1.270 1.00 23.04 O ATOM 0 H GLU A 16 13.252 7.229 -3.155 1.00 31.40 H new ATOM 0 HA GLU A 16 14.930 5.728 -1.261 1.00 43.24 H new ATOM 0 HB2 GLU A 16 12.338 7.268 -0.913 1.00 75.35 H new ATOM 0 HB3 GLU A 16 13.347 6.619 0.364 1.00 75.35 H new ATOM 0 HG2 GLU A 16 15.262 8.065 -0.664 1.00 72.32 H new ATOM 0 HG3 GLU A 16 13.997 8.881 -1.562 1.00 72.32 H new ATOM 240 N THR A 17 11.757 4.939 -1.717 1.00 23.42 N ATOM 241 CA THR A 17 10.733 3.910 -1.706 1.00 43.42 C ATOM 242 C THR A 17 10.912 2.936 -2.883 1.00 64.11 C ATOM 243 O THR A 17 10.634 1.742 -2.763 1.00 75.33 O ATOM 244 CB THR A 17 9.357 4.616 -1.734 1.00 11.32 C ATOM 245 OG1 THR A 17 9.428 6.021 -1.970 1.00 34.20 O ATOM 246 CG2 THR A 17 8.563 4.408 -0.451 1.00 34.24 C ATOM 0 H THR A 17 11.362 5.879 -1.756 1.00 23.42 H new ATOM 0 HA THR A 17 10.810 3.303 -0.804 1.00 43.42 H new ATOM 0 HB THR A 17 8.851 4.142 -2.575 1.00 11.32 H new ATOM 0 HG1 THR A 17 8.523 6.398 -1.976 1.00 34.20 H new ATOM 0 HG21 THR A 17 7.607 4.925 -0.527 1.00 34.24 H new ATOM 0 HG22 THR A 17 8.388 3.343 -0.300 1.00 34.24 H new ATOM 0 HG23 THR A 17 9.125 4.807 0.393 1.00 34.24 H new ATOM 254 N LYS A 18 11.474 3.440 -3.989 1.00 15.30 N ATOM 255 CA LYS A 18 11.879 2.686 -5.168 1.00 14.13 C ATOM 256 C LYS A 18 12.778 1.510 -4.796 1.00 35.11 C ATOM 257 O LYS A 18 12.590 0.409 -5.304 1.00 64.32 O ATOM 258 CB LYS A 18 12.596 3.642 -6.136 1.00 71.53 C ATOM 259 CG LYS A 18 12.849 3.021 -7.522 1.00 33.13 C ATOM 260 CD LYS A 18 14.319 3.066 -7.962 1.00 53.21 C ATOM 261 CE LYS A 18 15.215 2.069 -7.205 1.00 4.41 C ATOM 262 NZ LYS A 18 16.234 1.452 -8.081 1.00 74.13 N ATOM 0 H LYS A 18 11.666 4.437 -4.084 1.00 15.30 H new ATOM 0 HA LYS A 18 10.995 2.267 -5.649 1.00 14.13 H new ATOM 0 HB2 LYS A 18 11.999 4.546 -6.253 1.00 71.53 H new ATOM 0 HB3 LYS A 18 13.549 3.944 -5.700 1.00 71.53 H new ATOM 0 HG2 LYS A 18 12.514 1.984 -7.512 1.00 33.13 H new ATOM 0 HG3 LYS A 18 12.242 3.545 -8.261 1.00 33.13 H new ATOM 0 HD2 LYS A 18 14.377 2.857 -9.030 1.00 53.21 H new ATOM 0 HD3 LYS A 18 14.704 4.075 -7.813 1.00 53.21 H new ATOM 0 HE2 LYS A 18 15.710 2.583 -6.381 1.00 4.41 H new ATOM 0 HE3 LYS A 18 14.595 1.287 -6.766 1.00 4.41 H new ATOM 0 HZ1 LYS A 18 17.109 1.298 -7.541 1.00 74.13 H new ATOM 0 HZ2 LYS A 18 15.881 0.540 -8.435 1.00 74.13 H new ATOM 0 HZ3 LYS A 18 16.430 2.083 -8.884 1.00 74.13 H new ATOM 272 N LYS A 19 13.804 1.732 -3.974 1.00 13.34 N ATOM 273 CA LYS A 19 14.760 0.689 -3.611 1.00 64.41 C ATOM 274 C LYS A 19 14.063 -0.404 -2.815 1.00 12.30 C ATOM 275 O LYS A 19 14.326 -1.583 -3.036 1.00 13.10 O ATOM 276 CB LYS A 19 15.913 1.312 -2.793 1.00 72.23 C ATOM 277 CG LYS A 19 17.223 1.386 -3.588 1.00 15.13 C ATOM 278 CD LYS A 19 17.907 0.025 -3.790 1.00 64.55 C ATOM 279 CE LYS A 19 18.344 -0.652 -2.485 1.00 0.30 C ATOM 280 NZ LYS A 19 19.542 -0.053 -1.857 1.00 61.34 N ATOM 0 H LYS A 19 13.994 2.637 -3.543 1.00 13.34 H new ATOM 0 HA LYS A 19 15.172 0.241 -4.515 1.00 64.41 H new ATOM 0 HB2 LYS A 19 15.628 2.315 -2.474 1.00 72.23 H new ATOM 0 HB3 LYS A 19 16.073 0.724 -1.889 1.00 72.23 H new ATOM 0 HG2 LYS A 19 17.020 1.828 -4.564 1.00 15.13 H new ATOM 0 HG3 LYS A 19 17.912 2.055 -3.072 1.00 15.13 H new ATOM 0 HD2 LYS A 19 17.224 -0.638 -4.321 1.00 64.55 H new ATOM 0 HD3 LYS A 19 18.781 0.160 -4.428 1.00 64.55 H new ATOM 0 HE2 LYS A 19 17.518 -0.612 -1.775 1.00 0.30 H new ATOM 0 HE3 LYS A 19 18.542 -1.705 -2.685 1.00 0.30 H new ATOM 0 HZ1 LYS A 19 19.770 -0.568 -0.982 1.00 61.34 H new ATOM 0 HZ2 LYS A 19 20.346 -0.114 -2.514 1.00 61.34 H new ATOM 0 HZ3 LYS A 19 19.354 0.945 -1.632 1.00 61.34 H new ATOM 290 N MET A 20 13.168 -0.009 -1.912 1.00 21.12 N ATOM 291 CA MET A 20 12.460 -0.929 -1.034 1.00 42.15 C ATOM 292 C MET A 20 11.569 -1.903 -1.811 1.00 54.33 C ATOM 293 O MET A 20 11.284 -2.990 -1.315 1.00 51.33 O ATOM 294 CB MET A 20 11.623 -0.102 -0.039 1.00 52.21 C ATOM 295 CG MET A 20 11.585 -0.710 1.363 1.00 52.12 C ATOM 296 SD MET A 20 13.193 -0.927 2.186 1.00 2.40 S ATOM 297 CE MET A 20 13.866 0.746 2.169 1.00 22.40 C ATOM 0 H MET A 20 12.914 0.969 -1.770 1.00 21.12 H new ATOM 0 HA MET A 20 13.190 -1.539 -0.502 1.00 42.15 H new ATOM 0 HB2 MET A 20 12.032 0.907 0.020 1.00 52.21 H new ATOM 0 HB3 MET A 20 10.605 -0.012 -0.417 1.00 52.21 H new ATOM 0 HG2 MET A 20 10.959 -0.079 1.994 1.00 52.12 H new ATOM 0 HG3 MET A 20 11.097 -1.683 1.302 1.00 52.12 H new ATOM 0 HE1 MET A 20 14.862 0.742 2.611 1.00 22.40 H new ATOM 0 HE2 MET A 20 13.927 1.103 1.141 1.00 22.40 H new ATOM 0 HE3 MET A 20 13.216 1.405 2.744 1.00 22.40 H new ATOM 305 N ALA A 21 11.122 -1.534 -3.016 1.00 44.23 N ATOM 306 CA ALA A 21 10.186 -2.304 -3.803 1.00 33.51 C ATOM 307 C ALA A 21 10.899 -3.566 -4.257 1.00 35.13 C ATOM 308 O ALA A 21 10.473 -4.693 -3.998 1.00 3.03 O ATOM 309 CB ALA A 21 9.752 -1.456 -5.010 1.00 21.51 C ATOM 0 H ALA A 21 11.415 -0.670 -3.471 1.00 44.23 H new ATOM 0 HA ALA A 21 9.299 -2.573 -3.230 1.00 33.51 H new ATOM 0 HB1 ALA A 21 9.045 -2.022 -5.616 1.00 21.51 H new ATOM 0 HB2 ALA A 21 9.278 -0.540 -4.659 1.00 21.51 H new ATOM 0 HB3 ALA A 21 10.626 -1.205 -5.611 1.00 21.51 H new ATOM 315 N GLU A 22 12.025 -3.337 -4.932 1.00 0.23 N ATOM 316 CA GLU A 22 12.810 -4.371 -5.563 1.00 21.31 C ATOM 317 C GLU A 22 13.350 -5.360 -4.522 1.00 1.33 C ATOM 318 O GLU A 22 13.468 -6.555 -4.799 1.00 34.40 O ATOM 319 CB GLU A 22 13.999 -3.732 -6.327 1.00 14.14 C ATOM 320 CG GLU A 22 13.659 -2.554 -7.258 1.00 74.33 C ATOM 321 CD GLU A 22 14.887 -1.812 -7.815 1.00 35.20 C ATOM 322 OE1 GLU A 22 16.048 -2.166 -7.503 1.00 73.41 O ATOM 323 OE2 GLU A 22 14.693 -0.757 -8.464 1.00 44.01 O ATOM 0 H GLU A 22 12.417 -2.403 -5.052 1.00 0.23 H new ATOM 0 HA GLU A 22 12.168 -4.911 -6.259 1.00 21.31 H new ATOM 0 HB2 GLU A 22 14.731 -3.389 -5.596 1.00 14.14 H new ATOM 0 HB3 GLU A 22 14.481 -4.509 -6.921 1.00 14.14 H new ATOM 0 HG2 GLU A 22 13.064 -2.926 -8.092 1.00 74.33 H new ATOM 0 HG3 GLU A 22 13.036 -1.844 -6.714 1.00 74.33 H new ATOM 328 N LYS A 23 13.665 -4.860 -3.321 1.00 1.23 N ATOM 329 CA LYS A 23 14.126 -5.670 -2.206 1.00 60.12 C ATOM 330 C LYS A 23 13.000 -6.597 -1.757 1.00 75.35 C ATOM 331 O LYS A 23 13.104 -7.815 -1.920 1.00 71.52 O ATOM 332 CB LYS A 23 14.654 -4.768 -1.067 1.00 60.52 C ATOM 333 CG LYS A 23 16.112 -5.104 -0.720 1.00 61.41 C ATOM 334 CD LYS A 23 17.121 -4.135 -1.347 1.00 74.23 C ATOM 335 CE LYS A 23 18.543 -4.709 -1.436 1.00 43.03 C ATOM 336 NZ LYS A 23 19.082 -5.207 -0.154 1.00 54.12 N ATOM 0 H LYS A 23 13.603 -3.866 -3.102 1.00 1.23 H new ATOM 0 HA LYS A 23 14.963 -6.296 -2.515 1.00 60.12 H new ATOM 0 HB2 LYS A 23 14.580 -3.722 -1.365 1.00 60.52 H new ATOM 0 HB3 LYS A 23 14.029 -4.892 -0.182 1.00 60.52 H new ATOM 0 HG2 LYS A 23 16.233 -5.093 0.363 1.00 61.41 H new ATOM 0 HG3 LYS A 23 16.334 -6.117 -1.055 1.00 61.41 H new ATOM 0 HD2 LYS A 23 16.782 -3.866 -2.348 1.00 74.23 H new ATOM 0 HD3 LYS A 23 17.144 -3.216 -0.761 1.00 74.23 H new ATOM 0 HE2 LYS A 23 18.548 -5.524 -2.159 1.00 43.03 H new ATOM 0 HE3 LYS A 23 19.210 -3.937 -1.821 1.00 43.03 H new ATOM 0 HZ1 LYS A 23 20.055 -5.545 -0.295 1.00 54.12 H new ATOM 0 HZ2 LYS A 23 19.080 -4.437 0.546 1.00 54.12 H new ATOM 0 HZ3 LYS A 23 18.490 -5.990 0.191 1.00 54.12 H new ATOM 346 N ILE A 24 11.905 -6.017 -1.257 1.00 31.52 N ATOM 347 CA ILE A 24 10.818 -6.754 -0.621 1.00 43.24 C ATOM 348 C ILE A 24 10.249 -7.795 -1.586 1.00 61.54 C ATOM 349 O ILE A 24 9.920 -8.889 -1.141 1.00 52.31 O ATOM 350 CB ILE A 24 9.744 -5.753 -0.123 1.00 40.14 C ATOM 351 CG1 ILE A 24 10.263 -4.906 1.049 1.00 34.52 C ATOM 352 CG2 ILE A 24 8.436 -6.445 0.307 1.00 3.40 C ATOM 353 CD1 ILE A 24 9.371 -3.701 1.376 1.00 74.35 C ATOM 0 H ILE A 24 11.750 -5.009 -1.285 1.00 31.52 H new ATOM 0 HA ILE A 24 11.190 -7.300 0.246 1.00 43.24 H new ATOM 0 HB ILE A 24 9.529 -5.110 -0.976 1.00 40.14 H new ATOM 0 HG12 ILE A 24 10.346 -5.537 1.934 1.00 34.52 H new ATOM 0 HG13 ILE A 24 11.267 -4.552 0.814 1.00 34.52 H new ATOM 0 HG21 ILE A 24 7.722 -5.695 0.646 1.00 3.40 H new ATOM 0 HG22 ILE A 24 8.017 -6.989 -0.540 1.00 3.40 H new ATOM 0 HG23 ILE A 24 8.643 -7.142 1.119 1.00 3.40 H new ATOM 0 HD11 ILE A 24 9.798 -3.149 2.213 1.00 74.35 H new ATOM 0 HD12 ILE A 24 9.308 -3.048 0.505 1.00 74.35 H new ATOM 0 HD13 ILE A 24 8.373 -4.049 1.642 1.00 74.35 H new ATOM 364 N ASN A 25 10.093 -7.482 -2.883 1.00 71.54 N ATOM 365 CA ASN A 25 9.473 -8.437 -3.804 1.00 35.14 C ATOM 366 C ASN A 25 10.252 -9.750 -3.852 1.00 35.32 C ATOM 367 O ASN A 25 9.654 -10.810 -3.997 1.00 15.21 O ATOM 368 CB ASN A 25 9.360 -7.886 -5.236 1.00 35.34 C ATOM 369 CG ASN A 25 8.579 -8.838 -6.155 1.00 13.23 C ATOM 370 OD1 ASN A 25 7.426 -9.348 -5.744 1.00 0.04 O flip ATOM 371 ND2 ASN A 25 8.998 -9.118 -7.272 1.00 60.54 N flip ATOM 0 H ASN A 25 10.380 -6.599 -3.305 1.00 71.54 H new ATOM 0 HA ASN A 25 8.470 -8.613 -3.415 1.00 35.14 H new ATOM 0 HB2 ASN A 25 8.865 -6.915 -5.214 1.00 35.34 H new ATOM 0 HB3 ASN A 25 10.358 -7.725 -5.643 1.00 35.34 H new ATOM 0 HD21 ASN A 25 9.884 -8.730 -7.596 1.00 60.54 H new ATOM 0 HD22 ASN A 25 8.461 -9.739 -7.877 1.00 60.54 H new ATOM 377 N SER A 26 11.576 -9.677 -3.737 1.00 74.43 N ATOM 378 CA SER A 26 12.444 -10.836 -3.822 1.00 51.41 C ATOM 379 C SER A 26 12.394 -11.671 -2.533 1.00 23.53 C ATOM 380 O SER A 26 12.669 -12.867 -2.591 1.00 75.43 O ATOM 381 CB SER A 26 13.858 -10.330 -4.129 1.00 60.52 C ATOM 382 OG SER A 26 14.635 -11.300 -4.808 1.00 75.11 O ATOM 0 H SER A 26 12.075 -8.801 -3.581 1.00 74.43 H new ATOM 0 HA SER A 26 12.112 -11.504 -4.617 1.00 51.41 H new ATOM 0 HB2 SER A 26 13.796 -9.427 -4.736 1.00 60.52 H new ATOM 0 HB3 SER A 26 14.354 -10.055 -3.198 1.00 60.52 H new ATOM 0 HG SER A 26 15.528 -10.938 -4.986 1.00 75.11 H new ATOM 387 N GLU A 27 12.036 -11.082 -1.386 1.00 54.02 N ATOM 388 CA GLU A 27 11.915 -11.750 -0.086 1.00 71.41 C ATOM 389 C GLU A 27 10.517 -12.376 0.103 1.00 74.12 C ATOM 390 O GLU A 27 10.154 -12.746 1.225 1.00 12.04 O ATOM 391 CB GLU A 27 12.242 -10.738 1.035 1.00 21.44 C ATOM 392 CG GLU A 27 13.736 -10.394 1.177 1.00 4.11 C ATOM 393 CD GLU A 27 14.640 -11.574 1.566 1.00 32.33 C ATOM 394 OE1 GLU A 27 14.399 -12.278 2.574 1.00 43.34 O ATOM 395 OE2 GLU A 27 15.692 -11.766 0.916 1.00 44.40 O ATOM 0 H GLU A 27 11.814 -10.088 -1.337 1.00 54.02 H new ATOM 0 HA GLU A 27 12.629 -12.573 -0.041 1.00 71.41 H new ATOM 0 HB2 GLU A 27 11.688 -9.818 0.848 1.00 21.44 H new ATOM 0 HB3 GLU A 27 11.884 -11.139 1.983 1.00 21.44 H new ATOM 0 HG2 GLU A 27 14.090 -9.981 0.232 1.00 4.11 H new ATOM 0 HG3 GLU A 27 13.843 -9.611 1.927 1.00 4.11 H new ATOM 400 N ILE A 28 9.729 -12.502 -0.969 1.00 51.03 N ATOM 401 CA ILE A 28 8.348 -12.982 -1.008 1.00 22.33 C ATOM 402 C ILE A 28 8.275 -14.106 -2.063 1.00 61.12 C ATOM 403 O ILE A 28 9.230 -14.343 -2.810 1.00 21.31 O ATOM 404 CB ILE A 28 7.397 -11.768 -1.231 1.00 14.34 C ATOM 405 CG1 ILE A 28 7.415 -10.850 0.016 1.00 2.32 C ATOM 406 CG2 ILE A 28 5.935 -12.149 -1.530 1.00 35.22 C ATOM 407 CD1 ILE A 28 6.607 -9.558 -0.148 1.00 2.11 C ATOM 0 H ILE A 28 10.066 -12.253 -1.899 1.00 51.03 H new ATOM 0 HA ILE A 28 8.012 -13.426 -0.071 1.00 22.33 H new ATOM 0 HB ILE A 28 7.781 -11.259 -2.115 1.00 14.34 H new ATOM 0 HG12 ILE A 28 7.024 -11.405 0.869 1.00 2.32 H new ATOM 0 HG13 ILE A 28 8.448 -10.593 0.250 1.00 2.32 H new ATOM 0 HG21 ILE A 28 5.345 -11.244 -1.671 1.00 35.22 H new ATOM 0 HG22 ILE A 28 5.895 -12.754 -2.436 1.00 35.22 H new ATOM 0 HG23 ILE A 28 5.530 -12.720 -0.695 1.00 35.22 H new ATOM 0 HD11 ILE A 28 6.670 -8.971 0.768 1.00 2.11 H new ATOM 0 HD12 ILE A 28 7.011 -8.979 -0.979 1.00 2.11 H new ATOM 0 HD13 ILE A 28 5.565 -9.804 -0.350 1.00 2.11 H new ATOM 418 N LYS A 29 7.174 -14.870 -2.066 1.00 35.24 N ATOM 419 CA LYS A 29 6.795 -15.793 -3.142 1.00 33.13 C ATOM 420 C LYS A 29 6.642 -15.053 -4.485 1.00 32.53 C ATOM 421 O LYS A 29 6.855 -13.849 -4.576 1.00 41.04 O ATOM 422 CB LYS A 29 5.483 -16.513 -2.745 1.00 64.15 C ATOM 423 CG LYS A 29 5.523 -18.030 -2.994 1.00 20.41 C ATOM 424 CD LYS A 29 4.245 -18.715 -2.484 1.00 12.23 C ATOM 425 CE LYS A 29 2.980 -18.384 -3.289 1.00 42.23 C ATOM 426 NZ LYS A 29 2.825 -19.237 -4.486 1.00 2.43 N ATOM 0 H LYS A 29 6.504 -14.862 -1.297 1.00 35.24 H new ATOM 0 HA LYS A 29 7.585 -16.532 -3.278 1.00 33.13 H new ATOM 0 HB2 LYS A 29 5.281 -16.330 -1.690 1.00 64.15 H new ATOM 0 HB3 LYS A 29 4.655 -16.081 -3.307 1.00 64.15 H new ATOM 0 HG2 LYS A 29 5.640 -18.222 -4.060 1.00 20.41 H new ATOM 0 HG3 LYS A 29 6.392 -18.460 -2.495 1.00 20.41 H new ATOM 0 HD2 LYS A 29 4.397 -19.794 -2.497 1.00 12.23 H new ATOM 0 HD3 LYS A 29 4.084 -18.428 -1.445 1.00 12.23 H new ATOM 0 HE2 LYS A 29 2.106 -18.502 -2.649 1.00 42.23 H new ATOM 0 HE3 LYS A 29 3.012 -17.338 -3.595 1.00 42.23 H new ATOM 0 HZ1 LYS A 29 1.815 -19.415 -4.657 1.00 2.43 H new ATOM 0 HZ2 LYS A 29 3.237 -18.756 -5.311 1.00 2.43 H new ATOM 0 HZ3 LYS A 29 3.315 -20.142 -4.333 1.00 2.43 H new ATOM 436 N ASP A 30 6.154 -15.760 -5.509 1.00 53.03 N ATOM 437 CA ASP A 30 5.823 -15.315 -6.875 1.00 3.12 C ATOM 438 C ASP A 30 4.716 -14.240 -6.981 1.00 3.32 C ATOM 439 O ASP A 30 4.010 -14.115 -7.987 1.00 35.54 O ATOM 440 CB ASP A 30 5.456 -16.544 -7.719 1.00 74.32 C ATOM 441 CG ASP A 30 4.229 -17.283 -7.183 1.00 71.51 C ATOM 442 OD1 ASP A 30 4.424 -18.087 -6.249 1.00 60.45 O ATOM 443 OD2 ASP A 30 3.064 -17.004 -7.554 1.00 34.50 O ATOM 0 H ASP A 30 5.961 -16.755 -5.396 1.00 53.03 H new ATOM 0 HA ASP A 30 6.716 -14.817 -7.252 1.00 3.12 H new ATOM 0 HB2 ASP A 30 5.267 -16.231 -8.746 1.00 74.32 H new ATOM 0 HB3 ASP A 30 6.304 -17.228 -7.745 1.00 74.32 H new ATOM 447 N SER A 31 4.544 -13.437 -5.944 1.00 43.03 N ATOM 448 CA SER A 31 3.656 -12.296 -5.832 1.00 22.44 C ATOM 449 C SER A 31 3.992 -11.202 -6.858 1.00 61.21 C ATOM 450 O SER A 31 5.138 -11.071 -7.312 1.00 1.21 O ATOM 451 CB SER A 31 3.823 -11.820 -4.390 1.00 22.52 C ATOM 452 OG SER A 31 3.540 -12.940 -3.557 1.00 64.21 O ATOM 0 H SER A 31 5.071 -13.582 -5.083 1.00 43.03 H new ATOM 0 HA SER A 31 2.621 -12.556 -6.051 1.00 22.44 H new ATOM 0 HB2 SER A 31 4.835 -11.455 -4.217 1.00 22.52 H new ATOM 0 HB3 SER A 31 3.145 -10.995 -4.173 1.00 22.52 H new ATOM 0 HG SER A 31 2.697 -13.352 -3.838 1.00 64.21 H new ATOM 457 N GLU A 32 2.976 -10.430 -7.237 1.00 1.32 N ATOM 458 CA GLU A 32 3.081 -9.361 -8.227 1.00 35.12 C ATOM 459 C GLU A 32 3.784 -8.125 -7.651 1.00 43.04 C ATOM 460 O GLU A 32 3.960 -8.006 -6.437 1.00 53.25 O ATOM 461 CB GLU A 32 1.676 -9.013 -8.758 1.00 14.20 C ATOM 462 CG GLU A 32 1.395 -9.624 -10.144 1.00 51.03 C ATOM 463 CD GLU A 32 0.321 -10.707 -10.135 1.00 51.05 C ATOM 464 OE1 GLU A 32 -0.863 -10.388 -10.358 1.00 32.24 O ATOM 465 OE2 GLU A 32 0.635 -11.917 -10.021 1.00 63.15 O ATOM 0 H GLU A 32 2.036 -10.533 -6.856 1.00 1.32 H new ATOM 0 HA GLU A 32 3.695 -9.712 -9.056 1.00 35.12 H new ATOM 0 HB2 GLU A 32 0.927 -9.368 -8.050 1.00 14.20 H new ATOM 0 HB3 GLU A 32 1.572 -7.929 -8.815 1.00 14.20 H new ATOM 0 HG2 GLU A 32 1.091 -8.830 -10.826 1.00 51.03 H new ATOM 0 HG3 GLU A 32 2.319 -10.046 -10.539 1.00 51.03 H new ATOM 470 N LEU A 33 4.179 -7.213 -8.543 1.00 62.53 N ATOM 471 CA LEU A 33 5.057 -6.078 -8.297 1.00 35.12 C ATOM 472 C LEU A 33 4.634 -4.913 -9.197 1.00 60.12 C ATOM 473 O LEU A 33 5.068 -4.824 -10.346 1.00 52.24 O ATOM 474 CB LEU A 33 6.513 -6.517 -8.576 1.00 24.20 C ATOM 475 CG LEU A 33 7.543 -5.372 -8.534 1.00 71.53 C ATOM 476 CD1 LEU A 33 7.462 -4.649 -7.202 1.00 22.54 C ATOM 477 CD2 LEU A 33 8.969 -5.888 -8.694 1.00 74.22 C ATOM 0 H LEU A 33 3.872 -7.255 -9.515 1.00 62.53 H new ATOM 0 HA LEU A 33 4.988 -5.743 -7.262 1.00 35.12 H new ATOM 0 HB2 LEU A 33 6.798 -7.273 -7.844 1.00 24.20 H new ATOM 0 HB3 LEU A 33 6.555 -6.991 -9.557 1.00 24.20 H new ATOM 0 HG LEU A 33 7.307 -4.701 -9.360 1.00 71.53 H new ATOM 0 HD11 LEU A 33 8.194 -3.841 -7.181 1.00 22.54 H new ATOM 0 HD12 LEU A 33 6.462 -4.236 -7.072 1.00 22.54 H new ATOM 0 HD13 LEU A 33 7.672 -5.350 -6.394 1.00 22.54 H new ATOM 0 HD21 LEU A 33 9.665 -5.050 -8.659 1.00 74.22 H new ATOM 0 HD22 LEU A 33 9.197 -6.583 -7.886 1.00 74.22 H new ATOM 0 HD23 LEU A 33 9.065 -6.400 -9.651 1.00 74.22 H new ATOM 488 N LYS A 34 3.818 -3.979 -8.703 1.00 51.01 N ATOM 489 CA LYS A 34 3.362 -2.830 -9.507 1.00 40.05 C ATOM 490 C LYS A 34 3.923 -1.549 -8.890 1.00 42.33 C ATOM 491 O LYS A 34 4.280 -1.567 -7.710 1.00 0.43 O ATOM 492 CB LYS A 34 1.822 -2.809 -9.557 1.00 64.12 C ATOM 493 CG LYS A 34 1.149 -3.893 -10.424 1.00 71.51 C ATOM 494 CD LYS A 34 1.399 -3.737 -11.935 1.00 73.22 C ATOM 495 CE LYS A 34 0.348 -4.528 -12.734 1.00 72.41 C ATOM 496 NZ LYS A 34 0.549 -4.441 -14.196 1.00 3.14 N ATOM 0 H LYS A 34 3.456 -3.991 -7.749 1.00 51.01 H new ATOM 0 HA LYS A 34 3.723 -2.911 -10.532 1.00 40.05 H new ATOM 0 HB2 LYS A 34 1.446 -2.904 -8.538 1.00 64.12 H new ATOM 0 HB3 LYS A 34 1.505 -1.833 -9.924 1.00 64.12 H new ATOM 0 HG2 LYS A 34 1.509 -4.872 -10.107 1.00 71.51 H new ATOM 0 HG3 LYS A 34 0.075 -3.874 -10.241 1.00 71.51 H new ATOM 0 HD2 LYS A 34 1.358 -2.683 -12.211 1.00 73.22 H new ATOM 0 HD3 LYS A 34 2.399 -4.093 -12.184 1.00 73.22 H new ATOM 0 HE2 LYS A 34 0.380 -5.574 -12.430 1.00 72.41 H new ATOM 0 HE3 LYS A 34 -0.646 -4.154 -12.486 1.00 72.41 H new ATOM 0 HZ1 LYS A 34 -0.187 -4.992 -14.681 1.00 3.14 H new ATOM 0 HZ2 LYS A 34 0.491 -3.447 -14.496 1.00 3.14 H new ATOM 0 HZ3 LYS A 34 1.485 -4.823 -14.441 1.00 3.14 H new ATOM 506 N GLU A 35 3.884 -0.423 -9.610 1.00 51.23 N ATOM 507 CA GLU A 35 4.022 0.905 -9.008 1.00 63.52 C ATOM 508 C GLU A 35 2.801 1.778 -9.324 1.00 64.54 C ATOM 509 O GLU A 35 2.143 1.604 -10.355 1.00 11.42 O ATOM 510 CB GLU A 35 5.337 1.598 -9.406 1.00 54.22 C ATOM 511 CG GLU A 35 5.527 1.834 -10.916 1.00 74.51 C ATOM 512 CD GLU A 35 6.471 2.994 -11.271 1.00 64.15 C ATOM 513 OE1 GLU A 35 7.078 3.636 -10.383 1.00 62.32 O ATOM 514 OE2 GLU A 35 6.529 3.360 -12.468 1.00 24.22 O ATOM 0 H GLU A 35 3.756 -0.407 -10.622 1.00 51.23 H new ATOM 0 HA GLU A 35 4.066 0.766 -7.928 1.00 63.52 H new ATOM 0 HB2 GLU A 35 5.391 2.560 -8.895 1.00 54.22 H new ATOM 0 HB3 GLU A 35 6.170 0.997 -9.042 1.00 54.22 H new ATOM 0 HG2 GLU A 35 5.912 0.919 -11.367 1.00 74.51 H new ATOM 0 HG3 GLU A 35 4.553 2.026 -11.365 1.00 74.51 H new ATOM 519 N VAL A 36 2.562 2.760 -8.456 1.00 54.23 N ATOM 520 CA VAL A 36 1.546 3.802 -8.530 1.00 41.12 C ATOM 521 C VAL A 36 2.287 5.129 -8.762 1.00 55.31 C ATOM 522 O VAL A 36 3.484 5.248 -8.498 1.00 12.33 O ATOM 523 CB VAL A 36 0.717 3.804 -7.223 1.00 55.35 C ATOM 524 CG1 VAL A 36 -0.608 4.562 -7.402 1.00 34.20 C ATOM 525 CG2 VAL A 36 0.336 2.401 -6.728 1.00 63.15 C ATOM 0 H VAL A 36 3.125 2.852 -7.610 1.00 54.23 H new ATOM 0 HA VAL A 36 0.841 3.638 -9.345 1.00 41.12 H new ATOM 0 HB VAL A 36 1.371 4.284 -6.496 1.00 55.35 H new ATOM 0 HG11 VAL A 36 -1.166 4.545 -6.466 1.00 34.20 H new ATOM 0 HG12 VAL A 36 -0.401 5.595 -7.682 1.00 34.20 H new ATOM 0 HG13 VAL A 36 -1.197 4.085 -8.185 1.00 34.20 H new ATOM 0 HG21 VAL A 36 -0.243 2.484 -5.808 1.00 63.15 H new ATOM 0 HG22 VAL A 36 -0.260 1.897 -7.488 1.00 63.15 H new ATOM 0 HG23 VAL A 36 1.241 1.825 -6.536 1.00 63.15 H new ATOM 535 N LYS A 37 1.585 6.125 -9.295 1.00 15.20 N ATOM 536 CA LYS A 37 2.066 7.445 -9.696 1.00 33.24 C ATOM 537 C LYS A 37 1.053 8.511 -9.254 1.00 22.11 C ATOM 538 O LYS A 37 0.021 8.163 -8.664 1.00 64.44 O ATOM 539 CB LYS A 37 2.254 7.453 -11.227 1.00 51.04 C ATOM 540 CG LYS A 37 3.476 6.662 -11.727 1.00 71.24 C ATOM 541 CD LYS A 37 3.302 5.132 -11.827 1.00 71.33 C ATOM 542 CE LYS A 37 3.441 4.590 -13.253 1.00 61.51 C ATOM 543 NZ LYS A 37 4.750 4.894 -13.870 1.00 1.44 N ATOM 0 H LYS A 37 0.586 6.022 -9.472 1.00 15.20 H new ATOM 0 HA LYS A 37 3.021 7.670 -9.222 1.00 33.24 H new ATOM 0 HB2 LYS A 37 1.357 7.043 -11.692 1.00 51.04 H new ATOM 0 HB3 LYS A 37 2.344 8.486 -11.563 1.00 51.04 H new ATOM 0 HG2 LYS A 37 3.750 7.041 -12.712 1.00 71.24 H new ATOM 0 HG3 LYS A 37 4.314 6.869 -11.061 1.00 71.24 H new ATOM 0 HD2 LYS A 37 4.042 4.648 -11.190 1.00 71.33 H new ATOM 0 HD3 LYS A 37 2.321 4.860 -11.438 1.00 71.33 H new ATOM 0 HE2 LYS A 37 3.296 3.510 -13.239 1.00 61.51 H new ATOM 0 HE3 LYS A 37 2.649 5.010 -13.873 1.00 61.51 H new ATOM 0 HZ1 LYS A 37 4.813 4.429 -14.798 1.00 1.44 H new ATOM 0 HZ2 LYS A 37 4.847 5.922 -13.990 1.00 1.44 H new ATOM 0 HZ3 LYS A 37 5.513 4.544 -13.256 1.00 1.44 H new ATOM 553 N VAL A 38 1.290 9.782 -9.565 1.00 60.15 N ATOM 554 CA VAL A 38 0.292 10.854 -9.536 1.00 71.24 C ATOM 555 C VAL A 38 0.416 11.687 -10.818 1.00 72.41 C ATOM 556 O VAL A 38 1.291 11.405 -11.642 1.00 13.40 O ATOM 557 CB VAL A 38 0.392 11.694 -8.244 1.00 62.43 C ATOM 558 CG1 VAL A 38 -0.040 10.863 -7.030 1.00 23.43 C ATOM 559 CG2 VAL A 38 1.796 12.271 -7.997 1.00 44.11 C ATOM 0 H VAL A 38 2.212 10.108 -9.854 1.00 60.15 H new ATOM 0 HA VAL A 38 -0.709 10.424 -9.513 1.00 71.24 H new ATOM 0 HB VAL A 38 -0.282 12.540 -8.382 1.00 62.43 H new ATOM 0 HG11 VAL A 38 0.036 11.470 -6.128 1.00 23.43 H new ATOM 0 HG12 VAL A 38 -1.072 10.536 -7.161 1.00 23.43 H new ATOM 0 HG13 VAL A 38 0.608 9.991 -6.937 1.00 23.43 H new ATOM 0 HG21 VAL A 38 1.794 12.850 -7.073 1.00 44.11 H new ATOM 0 HG22 VAL A 38 2.515 11.456 -7.913 1.00 44.11 H new ATOM 0 HG23 VAL A 38 2.075 12.917 -8.829 1.00 44.11 H new ATOM 569 N SER A 39 -0.460 12.672 -11.019 1.00 13.10 N ATOM 570 CA SER A 39 -0.429 13.548 -12.163 1.00 22.33 C ATOM 571 C SER A 39 0.780 14.482 -12.084 1.00 43.45 C ATOM 572 O SER A 39 1.513 14.550 -11.089 1.00 60.32 O ATOM 573 CB SER A 39 -1.731 14.349 -12.153 1.00 55.44 C ATOM 574 OG SER A 39 -2.635 13.867 -13.129 1.00 11.31 O ATOM 0 H SER A 39 -1.221 12.877 -10.372 1.00 13.10 H new ATOM 0 HA SER A 39 -0.339 12.977 -13.087 1.00 22.33 H new ATOM 0 HB2 SER A 39 -2.191 14.289 -11.166 1.00 55.44 H new ATOM 0 HB3 SER A 39 -1.516 15.401 -12.341 1.00 55.44 H new ATOM 0 HG SER A 39 -2.754 12.901 -13.016 1.00 11.31 H new ATOM 579 N GLU A 40 0.986 15.202 -13.174 1.00 1.40 N ATOM 580 CA GLU A 40 2.080 16.144 -13.312 1.00 22.22 C ATOM 581 C GLU A 40 1.868 17.354 -12.429 1.00 61.32 C ATOM 582 O GLU A 40 0.758 17.882 -12.360 1.00 22.33 O ATOM 583 CB GLU A 40 2.192 16.638 -14.749 1.00 14.43 C ATOM 584 CG GLU A 40 2.804 15.552 -15.625 1.00 23.54 C ATOM 585 CD GLU A 40 3.086 16.026 -17.042 1.00 51.04 C ATOM 586 OE1 GLU A 40 3.449 17.212 -17.222 1.00 53.13 O ATOM 587 OE2 GLU A 40 3.037 15.189 -17.972 1.00 73.54 O ATOM 0 H GLU A 40 0.388 15.147 -13.999 1.00 1.40 H new ATOM 0 HA GLU A 40 2.989 15.619 -13.019 1.00 22.22 H new ATOM 0 HB2 GLU A 40 1.206 16.910 -15.127 1.00 14.43 H new ATOM 0 HB3 GLU A 40 2.807 17.537 -14.787 1.00 14.43 H new ATOM 0 HG2 GLU A 40 3.733 15.206 -15.171 1.00 23.54 H new ATOM 0 HG3 GLU A 40 2.129 14.697 -15.661 1.00 23.54 H new ATOM 592 N GLY A 41 2.959 17.845 -11.842 1.00 42.35 N ATOM 593 CA GLY A 41 2.963 19.131 -11.175 1.00 44.51 C ATOM 594 C GLY A 41 2.314 19.084 -9.792 1.00 15.41 C ATOM 595 O GLY A 41 2.054 20.141 -9.218 1.00 61.14 O ATOM 0 H GLY A 41 3.856 17.360 -11.819 1.00 42.35 H new ATOM 0 HA2 GLY A 41 3.991 19.481 -11.077 1.00 44.51 H new ATOM 0 HA3 GLY A 41 2.436 19.858 -11.794 1.00 44.51 H new ATOM 599 N THR A 42 2.063 17.886 -9.250 1.00 44.12 N ATOM 600 CA THR A 42 1.433 17.729 -7.947 1.00 64.43 C ATOM 601 C THR A 42 2.382 18.184 -6.818 1.00 31.33 C ATOM 602 O THR A 42 1.925 18.745 -5.831 1.00 2.30 O ATOM 603 CB THR A 42 0.963 16.271 -7.762 1.00 72.34 C ATOM 604 OG1 THR A 42 0.283 15.752 -8.902 1.00 3.34 O ATOM 605 CG2 THR A 42 -0.032 16.131 -6.613 1.00 0.53 C ATOM 0 H THR A 42 2.293 17.004 -9.707 1.00 44.12 H new ATOM 0 HA THR A 42 0.554 18.371 -7.895 1.00 64.43 H new ATOM 0 HB THR A 42 1.887 15.723 -7.575 1.00 72.34 H new ATOM 0 HG1 THR A 42 0.936 15.383 -9.533 1.00 3.34 H new ATOM 0 HG21 THR A 42 -0.336 15.088 -6.520 1.00 0.53 H new ATOM 0 HG22 THR A 42 0.436 16.457 -5.684 1.00 0.53 H new ATOM 0 HG23 THR A 42 -0.908 16.747 -6.813 1.00 0.53 H new ATOM 613 N PHE A 43 3.702 17.973 -6.931 1.00 40.51 N ATOM 614 CA PHE A 43 4.678 18.394 -5.921 1.00 33.40 C ATOM 615 C PHE A 43 6.000 18.736 -6.597 1.00 23.40 C ATOM 616 O PHE A 43 6.209 18.325 -7.745 1.00 15.51 O ATOM 617 CB PHE A 43 4.928 17.279 -4.892 1.00 71.42 C ATOM 618 CG PHE A 43 3.697 16.578 -4.364 1.00 20.01 C ATOM 619 CD1 PHE A 43 2.893 17.205 -3.395 1.00 43.35 C ATOM 620 CD2 PHE A 43 3.320 15.330 -4.899 1.00 2.42 C ATOM 621 CE1 PHE A 43 1.688 16.608 -2.996 1.00 75.24 C ATOM 622 CE2 PHE A 43 2.121 14.727 -4.487 1.00 1.20 C ATOM 623 CZ PHE A 43 1.296 15.378 -3.553 1.00 62.12 C ATOM 0 H PHE A 43 4.123 17.502 -7.732 1.00 40.51 H new ATOM 0 HA PHE A 43 4.274 19.267 -5.408 1.00 33.40 H new ATOM 0 HB2 PHE A 43 5.581 16.533 -5.345 1.00 71.42 H new ATOM 0 HB3 PHE A 43 5.470 17.705 -4.048 1.00 71.42 H new ATOM 0 HD1 PHE A 43 3.203 18.144 -2.959 1.00 43.35 H new ATOM 0 HD2 PHE A 43 3.952 14.839 -5.624 1.00 2.42 H new ATOM 0 HE1 PHE A 43 1.062 17.093 -2.262 1.00 75.24 H new ATOM 0 HE2 PHE A 43 1.833 13.766 -4.886 1.00 1.20 H new ATOM 0 HZ PHE A 43 0.357 14.931 -3.262 1.00 62.12 H new ATOM 632 N ASP A 44 6.940 19.363 -5.894 1.00 51.51 N ATOM 633 CA ASP A 44 8.186 19.859 -6.522 1.00 13.40 C ATOM 634 C ASP A 44 9.430 19.220 -5.917 1.00 11.50 C ATOM 635 O ASP A 44 10.545 19.718 -6.045 1.00 11.43 O ATOM 636 CB ASP A 44 8.256 21.385 -6.422 1.00 1.53 C ATOM 637 CG ASP A 44 8.763 22.040 -7.704 1.00 52.45 C ATOM 638 OD1 ASP A 44 9.987 22.028 -7.965 1.00 73.03 O ATOM 639 OD2 ASP A 44 7.905 22.576 -8.443 1.00 74.02 O ATOM 0 H ASP A 44 6.874 19.545 -4.892 1.00 51.51 H new ATOM 0 HA ASP A 44 8.161 19.571 -7.573 1.00 13.40 H new ATOM 0 HB2 ASP A 44 7.265 21.775 -6.188 1.00 1.53 H new ATOM 0 HB3 ASP A 44 8.911 21.661 -5.595 1.00 1.53 H new ATOM 643 N ALA A 45 9.240 18.154 -5.142 1.00 75.25 N ATOM 644 CA ALA A 45 10.162 17.652 -4.121 1.00 44.21 C ATOM 645 C ALA A 45 10.649 18.717 -3.125 1.00 40.15 C ATOM 646 O ALA A 45 11.420 18.393 -2.223 1.00 52.12 O ATOM 647 CB ALA A 45 11.314 16.899 -4.787 1.00 42.55 C ATOM 0 H ALA A 45 8.395 17.587 -5.212 1.00 75.25 H new ATOM 0 HA ALA A 45 9.598 16.956 -3.500 1.00 44.21 H new ATOM 0 HB1 ALA A 45 11.996 16.528 -4.022 1.00 42.55 H new ATOM 0 HB2 ALA A 45 10.918 16.059 -5.358 1.00 42.55 H new ATOM 0 HB3 ALA A 45 11.850 17.572 -5.456 1.00 42.55 H new ATOM 653 N ASP A 46 10.177 19.960 -3.231 1.00 75.34 N ATOM 654 CA ASP A 46 10.425 21.036 -2.290 1.00 60.34 C ATOM 655 C ASP A 46 9.842 20.687 -0.923 1.00 63.24 C ATOM 656 O ASP A 46 9.023 19.767 -0.811 1.00 62.14 O ATOM 657 CB ASP A 46 9.803 22.355 -2.807 1.00 51.35 C ATOM 658 CG ASP A 46 10.781 23.291 -3.525 1.00 73.41 C ATOM 659 OD1 ASP A 46 11.965 23.342 -3.129 1.00 32.11 O ATOM 660 OD2 ASP A 46 10.329 24.055 -4.403 1.00 0.51 O ATOM 0 H ASP A 46 9.587 20.249 -4.011 1.00 75.34 H new ATOM 0 HA ASP A 46 11.502 21.169 -2.192 1.00 60.34 H new ATOM 0 HB2 ASP A 46 8.988 22.113 -3.489 1.00 51.35 H new ATOM 0 HB3 ASP A 46 9.365 22.888 -1.963 1.00 51.35 H new ATOM 664 N MET A 47 10.210 21.482 0.084 1.00 75.35 N ATOM 665 CA MET A 47 9.555 21.569 1.388 1.00 71.05 C ATOM 666 C MET A 47 8.623 22.785 1.426 1.00 40.41 C ATOM 667 O MET A 47 7.435 22.649 1.699 1.00 21.34 O ATOM 668 CB MET A 47 10.576 21.571 2.542 1.00 20.04 C ATOM 669 CG MET A 47 11.871 22.323 2.226 1.00 4.20 C ATOM 670 SD MET A 47 12.844 22.843 3.656 1.00 32.41 S ATOM 671 CE MET A 47 12.922 24.597 3.226 1.00 4.22 C ATOM 0 H MET A 47 11.009 22.111 0.008 1.00 75.35 H new ATOM 0 HA MET A 47 8.945 20.677 1.532 1.00 71.05 H new ATOM 0 HB2 MET A 47 10.114 22.018 3.422 1.00 20.04 H new ATOM 0 HB3 MET A 47 10.820 20.540 2.799 1.00 20.04 H new ATOM 0 HG2 MET A 47 12.494 21.687 1.597 1.00 4.20 H new ATOM 0 HG3 MET A 47 11.622 23.207 1.638 1.00 4.20 H new ATOM 0 HE1 MET A 47 13.490 25.133 3.986 1.00 4.22 H new ATOM 0 HE2 MET A 47 13.411 24.713 2.259 1.00 4.22 H new ATOM 0 HE3 MET A 47 11.912 25.004 3.173 1.00 4.22 H new ATOM 679 N TYR A 48 9.123 23.992 1.147 1.00 12.31 N ATOM 680 CA TYR A 48 8.348 25.224 1.305 1.00 34.30 C ATOM 681 C TYR A 48 7.211 25.333 0.281 1.00 74.33 C ATOM 682 O TYR A 48 6.151 25.861 0.601 1.00 63.01 O ATOM 683 CB TYR A 48 9.275 26.447 1.230 1.00 33.22 C ATOM 684 CG TYR A 48 10.051 26.541 -0.067 1.00 64.05 C ATOM 685 CD1 TYR A 48 11.258 25.829 -0.204 1.00 44.35 C ATOM 686 CD2 TYR A 48 9.552 27.292 -1.152 1.00 15.23 C ATOM 687 CE1 TYR A 48 11.932 25.821 -1.432 1.00 21.31 C ATOM 688 CE2 TYR A 48 10.224 27.278 -2.387 1.00 54.12 C ATOM 689 CZ TYR A 48 11.399 26.510 -2.539 1.00 75.11 C ATOM 690 OH TYR A 48 12.017 26.403 -3.740 1.00 63.13 O ATOM 0 H TYR A 48 10.073 24.142 0.807 1.00 12.31 H new ATOM 0 HA TYR A 48 7.881 25.194 2.289 1.00 34.30 H new ATOM 0 HB2 TYR A 48 8.680 27.352 1.354 1.00 33.22 H new ATOM 0 HB3 TYR A 48 9.978 26.411 2.062 1.00 33.22 H new ATOM 0 HD1 TYR A 48 11.664 25.289 0.638 1.00 44.35 H new ATOM 0 HD2 TYR A 48 8.653 27.878 -1.034 1.00 15.23 H new ATOM 0 HE1 TYR A 48 12.864 25.284 -1.530 1.00 21.31 H new ATOM 0 HE2 TYR A 48 9.842 27.853 -3.217 1.00 54.12 H new ATOM 0 HH TYR A 48 11.609 25.676 -4.254 1.00 63.13 H new ATOM 699 N LYS A 49 7.396 24.864 -0.958 1.00 34.33 N ATOM 700 CA LYS A 49 6.337 24.909 -1.971 1.00 55.13 C ATOM 701 C LYS A 49 5.258 23.884 -1.654 1.00 73.22 C ATOM 702 O LYS A 49 4.073 24.189 -1.678 1.00 72.02 O ATOM 703 CB LYS A 49 6.933 24.669 -3.361 1.00 72.32 C ATOM 704 CG LYS A 49 6.074 25.347 -4.435 1.00 32.33 C ATOM 705 CD LYS A 49 6.438 26.827 -4.620 1.00 74.21 C ATOM 706 CE LYS A 49 5.758 27.381 -5.876 1.00 62.24 C ATOM 707 NZ LYS A 49 6.391 28.633 -6.336 1.00 0.44 N ATOM 0 H LYS A 49 8.269 24.449 -1.283 1.00 34.33 H new ATOM 0 HA LYS A 49 5.876 25.896 -1.961 1.00 55.13 H new ATOM 0 HB2 LYS A 49 7.950 25.059 -3.400 1.00 72.32 H new ATOM 0 HB3 LYS A 49 6.994 23.599 -3.558 1.00 72.32 H new ATOM 0 HG2 LYS A 49 6.199 24.823 -5.382 1.00 32.33 H new ATOM 0 HG3 LYS A 49 5.022 25.265 -4.162 1.00 32.33 H new ATOM 0 HD2 LYS A 49 6.126 27.399 -3.746 1.00 74.21 H new ATOM 0 HD3 LYS A 49 7.519 26.936 -4.704 1.00 74.21 H new ATOM 0 HE2 LYS A 49 5.803 26.637 -6.672 1.00 62.24 H new ATOM 0 HE3 LYS A 49 4.703 27.562 -5.668 1.00 62.24 H new ATOM 0 HZ1 LYS A 49 5.903 28.976 -7.188 1.00 0.44 H new ATOM 0 HZ2 LYS A 49 6.326 29.351 -5.586 1.00 0.44 H new ATOM 0 HZ3 LYS A 49 7.391 28.455 -6.559 1.00 0.44 H new ATOM 717 N THR A 50 5.662 22.659 -1.344 1.00 24.42 N ATOM 718 CA THR A 50 4.758 21.547 -1.098 1.00 1.22 C ATOM 719 C THR A 50 3.989 21.766 0.220 1.00 2.21 C ATOM 720 O THR A 50 2.858 21.286 0.352 1.00 52.54 O ATOM 721 CB THR A 50 5.606 20.267 -1.137 1.00 12.44 C ATOM 722 OG1 THR A 50 6.602 20.409 -0.149 1.00 15.34 O ATOM 723 CG2 THR A 50 6.269 20.077 -2.512 1.00 52.51 C ATOM 0 H THR A 50 6.646 22.407 -1.255 1.00 24.42 H new ATOM 0 HA THR A 50 3.981 21.462 -1.858 1.00 1.22 H new ATOM 0 HB THR A 50 4.977 19.395 -0.957 1.00 12.44 H new ATOM 0 HG1 THR A 50 7.358 19.822 -0.360 1.00 15.34 H new ATOM 0 HG21 THR A 50 6.862 19.162 -2.507 1.00 52.51 H new ATOM 0 HG22 THR A 50 5.499 20.006 -3.280 1.00 52.51 H new ATOM 0 HG23 THR A 50 6.916 20.928 -2.724 1.00 52.51 H new ATOM 731 N SER A 51 4.538 22.586 1.134 1.00 42.45 N ATOM 732 CA SER A 51 3.859 23.136 2.300 1.00 1.30 C ATOM 733 C SER A 51 2.525 23.779 1.906 1.00 71.44 C ATOM 734 O SER A 51 1.571 23.645 2.662 1.00 3.30 O ATOM 735 CB SER A 51 4.762 24.150 3.022 1.00 51.31 C ATOM 736 OG SER A 51 4.375 24.362 4.370 1.00 55.22 O ATOM 0 H SER A 51 5.509 22.891 1.069 1.00 42.45 H new ATOM 0 HA SER A 51 3.646 22.317 2.987 1.00 1.30 H new ATOM 0 HB2 SER A 51 5.793 23.797 2.995 1.00 51.31 H new ATOM 0 HB3 SER A 51 4.736 25.099 2.487 1.00 51.31 H new ATOM 0 HG SER A 51 4.979 25.012 4.785 1.00 55.22 H new ATOM 741 N ASP A 52 2.427 24.394 0.726 1.00 60.03 N ATOM 742 CA ASP A 52 1.213 25.055 0.258 1.00 3.33 C ATOM 743 C ASP A 52 0.261 24.069 -0.429 1.00 55.24 C ATOM 744 O ASP A 52 -0.944 24.079 -0.177 1.00 75.32 O ATOM 745 CB ASP A 52 1.596 26.183 -0.717 1.00 13.51 C ATOM 746 CG ASP A 52 0.405 27.110 -0.989 1.00 1.14 C ATOM 747 OD1 ASP A 52 -0.352 27.443 -0.045 1.00 71.44 O ATOM 748 OD2 ASP A 52 0.181 27.458 -2.168 1.00 52.13 O ATOM 0 H ASP A 52 3.200 24.446 0.062 1.00 60.03 H new ATOM 0 HA ASP A 52 0.691 25.467 1.122 1.00 3.33 H new ATOM 0 HB2 ASP A 52 2.422 26.760 -0.302 1.00 13.51 H new ATOM 0 HB3 ASP A 52 1.947 25.753 -1.655 1.00 13.51 H new ATOM 752 N ILE A 53 0.795 23.209 -1.303 1.00 20.01 N ATOM 753 CA ILE A 53 0.019 22.368 -2.213 1.00 64.31 C ATOM 754 C ILE A 53 -0.767 21.322 -1.428 1.00 11.52 C ATOM 755 O ILE A 53 -1.986 21.273 -1.546 1.00 72.04 O ATOM 756 CB ILE A 53 0.905 21.726 -3.310 1.00 54.35 C ATOM 757 CG1 ILE A 53 1.733 22.788 -4.076 1.00 20.42 C ATOM 758 CG2 ILE A 53 -0.015 20.957 -4.282 1.00 52.24 C ATOM 759 CD1 ILE A 53 2.836 22.206 -4.973 1.00 74.44 C ATOM 0 H ILE A 53 1.802 23.077 -1.397 1.00 20.01 H new ATOM 0 HA ILE A 53 -0.695 23.006 -2.734 1.00 64.31 H new ATOM 0 HB ILE A 53 1.619 21.048 -2.841 1.00 54.35 H new ATOM 0 HG12 ILE A 53 1.058 23.383 -4.691 1.00 20.42 H new ATOM 0 HG13 ILE A 53 2.188 23.466 -3.354 1.00 20.42 H new ATOM 0 HG21 ILE A 53 0.587 20.496 -5.065 1.00 52.24 H new ATOM 0 HG22 ILE A 53 -0.555 20.184 -3.736 1.00 52.24 H new ATOM 0 HG23 ILE A 53 -0.727 21.648 -4.732 1.00 52.24 H new ATOM 0 HD11 ILE A 53 3.366 23.018 -5.471 1.00 74.44 H new ATOM 0 HD12 ILE A 53 3.537 21.635 -4.364 1.00 74.44 H new ATOM 0 HD13 ILE A 53 2.389 21.551 -5.721 1.00 74.44 H new ATOM 770 N ALA A 54 -0.103 20.490 -0.619 1.00 72.04 N ATOM 771 CA ALA A 54 -0.822 19.447 0.104 1.00 15.34 C ATOM 772 C ALA A 54 -1.829 20.080 1.083 1.00 14.32 C ATOM 773 O ALA A 54 -2.943 19.588 1.229 1.00 61.15 O ATOM 774 CB ALA A 54 0.175 18.494 0.776 1.00 75.35 C ATOM 0 H ALA A 54 0.903 20.518 -0.454 1.00 72.04 H new ATOM 0 HA ALA A 54 -1.408 18.842 -0.588 1.00 15.34 H new ATOM 0 HB1 ALA A 54 -0.369 17.718 1.314 1.00 75.35 H new ATOM 0 HB2 ALA A 54 0.807 18.034 0.016 1.00 75.35 H new ATOM 0 HB3 ALA A 54 0.797 19.052 1.476 1.00 75.35 H new ATOM 780 N LEU A 55 -1.481 21.208 1.714 1.00 15.30 N ATOM 781 CA LEU A 55 -2.306 21.907 2.707 1.00 52.31 C ATOM 782 C LEU A 55 -3.712 22.209 2.182 1.00 55.43 C ATOM 783 O LEU A 55 -4.695 22.056 2.910 1.00 32.01 O ATOM 784 CB LEU A 55 -1.568 23.192 3.109 1.00 64.04 C ATOM 785 CG LEU A 55 -2.140 24.060 4.232 1.00 31.44 C ATOM 786 CD1 LEU A 55 -3.220 25.005 3.696 1.00 63.42 C ATOM 787 CD2 LEU A 55 -2.559 23.234 5.452 1.00 43.53 C ATOM 0 H LEU A 55 -0.590 21.674 1.542 1.00 15.30 H new ATOM 0 HA LEU A 55 -2.449 21.266 3.577 1.00 52.31 H new ATOM 0 HB2 LEU A 55 -0.554 22.913 3.394 1.00 64.04 H new ATOM 0 HB3 LEU A 55 -1.488 23.817 2.219 1.00 64.04 H new ATOM 0 HG LEU A 55 -1.345 24.703 4.610 1.00 31.44 H new ATOM 0 HD11 LEU A 55 -3.611 25.611 4.513 1.00 63.42 H new ATOM 0 HD12 LEU A 55 -2.789 25.656 2.935 1.00 63.42 H new ATOM 0 HD13 LEU A 55 -4.029 24.421 3.258 1.00 63.42 H new ATOM 0 HD21 LEU A 55 -2.958 23.896 6.220 1.00 43.53 H new ATOM 0 HD22 LEU A 55 -3.324 22.515 5.159 1.00 43.53 H new ATOM 0 HD23 LEU A 55 -1.693 22.702 5.846 1.00 43.53 H new ATOM 798 N ASP A 56 -3.789 22.634 0.922 1.00 41.54 N ATOM 799 CA ASP A 56 -5.021 22.905 0.187 1.00 24.02 C ATOM 800 C ASP A 56 -5.935 21.668 0.164 1.00 35.23 C ATOM 801 O ASP A 56 -7.122 21.743 0.498 1.00 35.23 O ATOM 802 CB ASP A 56 -4.618 23.347 -1.231 1.00 1.32 C ATOM 803 CG ASP A 56 -5.676 23.289 -2.230 1.00 21.12 C ATOM 804 OD1 ASP A 56 -6.734 23.873 -1.885 1.00 62.42 O ATOM 805 OD2 ASP A 56 -5.323 22.859 -3.347 1.00 3.41 O ATOM 0 H ASP A 56 -2.955 22.806 0.361 1.00 41.54 H new ATOM 0 HA ASP A 56 -5.595 23.694 0.673 1.00 24.02 H new ATOM 0 HB2 ASP A 56 -4.245 24.370 -1.182 1.00 1.32 H new ATOM 0 HB3 ASP A 56 -3.791 22.721 -1.566 1.00 1.32 H new ATOM 809 N GLN A 57 -5.372 20.509 -0.184 1.00 24.34 N ATOM 810 CA GLN A 57 -6.084 19.238 -0.240 1.00 31.44 C ATOM 811 C GLN A 57 -6.460 18.769 1.174 1.00 22.14 C ATOM 812 O GLN A 57 -7.565 18.273 1.385 1.00 2.33 O ATOM 813 CB GLN A 57 -5.226 18.186 -0.970 1.00 51.23 C ATOM 814 CG GLN A 57 -4.752 18.660 -2.354 1.00 3.44 C ATOM 815 CD GLN A 57 -3.879 17.631 -3.071 1.00 72.41 C ATOM 816 OE1 GLN A 57 -2.771 17.308 -2.646 1.00 72.35 O ATOM 817 NE2 GLN A 57 -4.341 17.102 -4.190 1.00 24.33 N ATOM 0 H GLN A 57 -4.388 20.430 -0.439 1.00 24.34 H new ATOM 0 HA GLN A 57 -7.009 19.372 -0.801 1.00 31.44 H new ATOM 0 HB2 GLN A 57 -4.358 17.943 -0.357 1.00 51.23 H new ATOM 0 HB3 GLN A 57 -5.803 17.268 -1.083 1.00 51.23 H new ATOM 0 HG2 GLN A 57 -5.621 18.885 -2.972 1.00 3.44 H new ATOM 0 HG3 GLN A 57 -4.192 19.588 -2.242 1.00 3.44 H new ATOM 0 HE21 GLN A 57 -5.260 17.372 -4.540 1.00 24.33 H new ATOM 0 HE22 GLN A 57 -3.778 16.424 -4.704 1.00 24.33 H new ATOM 824 N ILE A 58 -5.567 18.934 2.154 1.00 60.25 N ATOM 825 CA ILE A 58 -5.731 18.471 3.533 1.00 21.40 C ATOM 826 C ILE A 58 -6.920 19.143 4.186 1.00 52.42 C ATOM 827 O ILE A 58 -7.749 18.463 4.792 1.00 54.42 O ATOM 828 CB ILE A 58 -4.429 18.706 4.333 1.00 23.20 C ATOM 829 CG1 ILE A 58 -3.379 17.691 3.862 1.00 11.51 C ATOM 830 CG2 ILE A 58 -4.590 18.560 5.855 1.00 31.10 C ATOM 831 CD1 ILE A 58 -1.938 18.177 3.983 1.00 34.24 C ATOM 0 H ILE A 58 -4.678 19.411 2.002 1.00 60.25 H new ATOM 0 HA ILE A 58 -5.929 17.399 3.525 1.00 21.40 H new ATOM 0 HB ILE A 58 -4.131 19.737 4.145 1.00 23.20 H new ATOM 0 HG12 ILE A 58 -3.491 16.775 4.441 1.00 11.51 H new ATOM 0 HG13 ILE A 58 -3.578 17.436 2.821 1.00 11.51 H new ATOM 0 HG21 ILE A 58 -3.631 18.740 6.341 1.00 31.10 H new ATOM 0 HG22 ILE A 58 -5.321 19.284 6.215 1.00 31.10 H new ATOM 0 HG23 ILE A 58 -4.932 17.552 6.090 1.00 31.10 H new ATOM 0 HD11 ILE A 58 -1.261 17.400 3.629 1.00 34.24 H new ATOM 0 HD12 ILE A 58 -1.805 19.076 3.381 1.00 34.24 H new ATOM 0 HD13 ILE A 58 -1.717 18.404 5.026 1.00 34.24 H new ATOM 842 N GLN A 59 -6.994 20.470 4.110 1.00 4.44 N ATOM 843 CA GLN A 59 -8.061 21.189 4.785 1.00 75.13 C ATOM 844 C GLN A 59 -9.427 20.898 4.148 1.00 62.34 C ATOM 845 O GLN A 59 -10.448 21.098 4.812 1.00 54.11 O ATOM 846 CB GLN A 59 -7.702 22.677 4.876 1.00 52.43 C ATOM 847 CG GLN A 59 -6.550 22.834 5.894 1.00 63.44 C ATOM 848 CD GLN A 59 -6.359 24.284 6.296 1.00 73.34 C ATOM 849 OE1 GLN A 59 -5.253 24.880 5.892 1.00 0.52 O flip ATOM 850 NE2 GLN A 59 -7.231 24.897 6.905 1.00 12.10 N flip ATOM 0 H GLN A 59 -6.338 21.057 3.596 1.00 4.44 H new ATOM 0 HA GLN A 59 -8.159 20.832 5.810 1.00 75.13 H new ATOM 0 HB2 GLN A 59 -7.401 23.056 3.899 1.00 52.43 H new ATOM 0 HB3 GLN A 59 -8.569 23.259 5.190 1.00 52.43 H new ATOM 0 HG2 GLN A 59 -6.761 22.234 6.779 1.00 63.44 H new ATOM 0 HG3 GLN A 59 -5.626 22.450 5.462 1.00 63.44 H new ATOM 0 HE21 GLN A 59 -8.077 24.414 7.207 1.00 12.10 H new ATOM 0 HE22 GLN A 59 -7.109 25.889 7.109 1.00 12.10 H new ATOM 857 N GLY A 60 -9.449 20.337 2.933 1.00 35.22 N ATOM 858 CA GLY A 60 -10.657 19.996 2.201 1.00 34.31 C ATOM 859 C GLY A 60 -11.139 21.174 1.372 1.00 51.45 C ATOM 860 O GLY A 60 -12.344 21.336 1.161 1.00 71.43 O ATOM 0 H GLY A 60 -8.596 20.104 2.424 1.00 35.22 H new ATOM 0 HA2 GLY A 60 -10.464 19.143 1.550 1.00 34.31 H new ATOM 0 HA3 GLY A 60 -11.437 19.694 2.900 1.00 34.31 H new ATOM 864 N ASN A 61 -10.216 22.040 0.958 1.00 51.14 N ATOM 865 CA ASN A 61 -10.490 23.121 0.022 1.00 11.13 C ATOM 866 C ASN A 61 -10.492 22.491 -1.362 1.00 20.20 C ATOM 867 O ASN A 61 -11.505 22.493 -2.063 1.00 54.15 O ATOM 868 CB ASN A 61 -9.414 24.211 0.129 1.00 64.44 C ATOM 869 CG ASN A 61 -9.394 24.900 1.481 1.00 20.31 C ATOM 870 OD1 ASN A 61 -10.373 24.917 2.222 1.00 40.15 O ATOM 871 ND2 ASN A 61 -8.286 25.519 1.830 1.00 13.24 N ATOM 0 H ASN A 61 -9.245 22.008 1.269 1.00 51.14 H new ATOM 0 HA ASN A 61 -11.445 23.602 0.235 1.00 11.13 H new ATOM 0 HB2 ASN A 61 -8.436 23.767 -0.060 1.00 64.44 H new ATOM 0 HB3 ASN A 61 -9.582 24.956 -0.649 1.00 64.44 H new ATOM 0 HD21 ASN A 61 -8.238 26.016 2.720 1.00 13.24 H new ATOM 0 HD22 ASN A 61 -7.476 25.502 1.211 1.00 13.24 H new ATOM 877 N LYS A 62 -9.354 21.911 -1.745 1.00 53.43 N ATOM 878 CA LYS A 62 -9.246 21.024 -2.891 1.00 0.22 C ATOM 879 C LYS A 62 -9.360 19.593 -2.416 1.00 31.11 C ATOM 880 O LYS A 62 -9.635 19.299 -1.254 1.00 4.23 O ATOM 881 CB LYS A 62 -7.934 21.316 -3.638 1.00 44.31 C ATOM 882 CG LYS A 62 -7.999 22.677 -4.340 1.00 12.40 C ATOM 883 CD LYS A 62 -9.124 22.959 -5.351 1.00 62.14 C ATOM 884 CE LYS A 62 -9.844 24.246 -4.935 1.00 21.41 C ATOM 885 NZ LYS A 62 -10.835 24.692 -5.932 1.00 14.34 N ATOM 0 H LYS A 62 -8.470 22.050 -1.256 1.00 53.43 H new ATOM 0 HA LYS A 62 -10.056 21.192 -3.601 1.00 0.22 H new ATOM 0 HB2 LYS A 62 -7.100 21.303 -2.936 1.00 44.31 H new ATOM 0 HB3 LYS A 62 -7.746 20.532 -4.371 1.00 44.31 H new ATOM 0 HG2 LYS A 62 -8.058 23.441 -3.565 1.00 12.40 H new ATOM 0 HG3 LYS A 62 -7.051 22.822 -4.858 1.00 12.40 H new ATOM 0 HD2 LYS A 62 -8.713 23.063 -6.355 1.00 62.14 H new ATOM 0 HD3 LYS A 62 -9.825 22.125 -5.379 1.00 62.14 H new ATOM 0 HE2 LYS A 62 -10.343 24.085 -3.979 1.00 21.41 H new ATOM 0 HE3 LYS A 62 -9.108 25.036 -4.782 1.00 21.41 H new ATOM 0 HZ1 LYS A 62 -11.292 25.566 -5.601 1.00 14.34 H new ATOM 0 HZ2 LYS A 62 -10.358 24.873 -6.838 1.00 14.34 H new ATOM 0 HZ3 LYS A 62 -11.555 23.952 -6.061 1.00 14.34 H new ATOM 895 N ASP A 63 -9.188 18.716 -3.383 1.00 55.42 N ATOM 896 CA ASP A 63 -9.453 17.291 -3.308 1.00 51.24 C ATOM 897 C ASP A 63 -8.174 16.524 -3.656 1.00 74.04 C ATOM 898 O ASP A 63 -7.194 17.119 -4.123 1.00 13.34 O ATOM 899 CB ASP A 63 -10.624 16.962 -4.244 1.00 31.30 C ATOM 900 CG ASP A 63 -11.991 17.162 -3.581 1.00 75.43 C ATOM 901 OD1 ASP A 63 -12.502 16.216 -2.938 1.00 44.13 O ATOM 902 OD2 ASP A 63 -12.578 18.264 -3.738 1.00 0.30 O ATOM 0 H ASP A 63 -8.838 18.995 -4.300 1.00 55.42 H new ATOM 0 HA ASP A 63 -9.742 16.989 -2.301 1.00 51.24 H new ATOM 0 HB2 ASP A 63 -10.561 17.591 -5.132 1.00 31.30 H new ATOM 0 HB3 ASP A 63 -10.536 15.928 -4.579 1.00 31.30 H new ATOM 906 N PHE A 64 -8.166 15.211 -3.395 1.00 1.21 N ATOM 907 CA PHE A 64 -6.986 14.351 -3.466 1.00 1.20 C ATOM 908 C PHE A 64 -6.410 14.238 -4.892 1.00 74.15 C ATOM 909 O PHE A 64 -7.141 14.397 -5.875 1.00 54.32 O ATOM 910 CB PHE A 64 -7.328 12.976 -2.852 1.00 74.02 C ATOM 911 CG PHE A 64 -8.622 12.316 -3.307 1.00 33.12 C ATOM 912 CD1 PHE A 64 -8.799 11.930 -4.649 1.00 42.32 C ATOM 913 CD2 PHE A 64 -9.647 12.060 -2.373 1.00 43.41 C ATOM 914 CE1 PHE A 64 -10.018 11.356 -5.060 1.00 1.50 C ATOM 915 CE2 PHE A 64 -10.845 11.445 -2.777 1.00 63.05 C ATOM 916 CZ PHE A 64 -11.039 11.109 -4.127 1.00 51.21 C ATOM 0 H PHE A 64 -9.008 14.706 -3.120 1.00 1.21 H new ATOM 0 HA PHE A 64 -6.187 14.809 -2.883 1.00 1.20 H new ATOM 0 HB2 PHE A 64 -6.506 12.294 -3.070 1.00 74.02 H new ATOM 0 HB3 PHE A 64 -7.369 13.090 -1.769 1.00 74.02 H new ATOM 0 HD1 PHE A 64 -8.001 12.074 -5.363 1.00 42.32 H new ATOM 0 HD2 PHE A 64 -9.511 12.339 -1.339 1.00 43.41 H new ATOM 0 HE1 PHE A 64 -10.169 11.104 -6.099 1.00 1.50 H new ATOM 0 HE2 PHE A 64 -11.615 11.231 -2.050 1.00 63.05 H new ATOM 0 HZ PHE A 64 -11.969 10.663 -4.446 1.00 51.21 H new ATOM 925 N PRO A 65 -5.110 13.913 -5.043 1.00 75.12 N ATOM 926 CA PRO A 65 -4.448 13.889 -6.347 1.00 23.11 C ATOM 927 C PRO A 65 -4.916 12.717 -7.218 1.00 2.33 C ATOM 928 O PRO A 65 -5.343 11.669 -6.712 1.00 61.44 O ATOM 929 CB PRO A 65 -2.951 13.798 -6.038 1.00 35.21 C ATOM 930 CG PRO A 65 -2.919 13.078 -4.692 1.00 74.33 C ATOM 931 CD PRO A 65 -4.141 13.650 -3.984 1.00 73.25 C ATOM 0 HA PRO A 65 -4.691 14.780 -6.927 1.00 23.11 H new ATOM 0 HB2 PRO A 65 -2.414 13.241 -6.806 1.00 35.21 H new ATOM 0 HB3 PRO A 65 -2.491 14.784 -5.979 1.00 35.21 H new ATOM 0 HG2 PRO A 65 -2.987 11.996 -4.808 1.00 74.33 H new ATOM 0 HG3 PRO A 65 -1.999 13.283 -4.144 1.00 74.33 H new ATOM 0 HD2 PRO A 65 -4.538 12.945 -3.253 1.00 73.25 H new ATOM 0 HD3 PRO A 65 -3.891 14.563 -3.443 1.00 73.25 H new ATOM 936 N GLU A 66 -4.793 12.885 -8.536 1.00 12.40 N ATOM 937 CA GLU A 66 -5.216 11.893 -9.518 1.00 13.40 C ATOM 938 C GLU A 66 -4.193 10.761 -9.593 1.00 72.03 C ATOM 939 O GLU A 66 -2.980 11.008 -9.626 1.00 12.52 O ATOM 940 CB GLU A 66 -5.393 12.529 -10.908 1.00 34.31 C ATOM 941 CG GLU A 66 -6.472 13.619 -10.911 1.00 55.15 C ATOM 942 CD GLU A 66 -7.138 13.766 -12.285 1.00 24.21 C ATOM 943 OE1 GLU A 66 -6.565 14.407 -13.194 1.00 73.31 O ATOM 944 OE2 GLU A 66 -8.252 13.202 -12.443 1.00 13.52 O ATOM 0 H GLU A 66 -4.392 13.725 -8.953 1.00 12.40 H new ATOM 0 HA GLU A 66 -6.178 11.492 -9.200 1.00 13.40 H new ATOM 0 HB2 GLU A 66 -4.445 12.957 -11.234 1.00 34.31 H new ATOM 0 HB3 GLU A 66 -5.658 11.756 -11.629 1.00 34.31 H new ATOM 0 HG2 GLU A 66 -7.230 13.381 -10.165 1.00 55.15 H new ATOM 0 HG3 GLU A 66 -6.027 14.571 -10.621 1.00 55.15 H new ATOM 949 N ILE A 67 -4.675 9.523 -9.698 1.00 15.33 N ATOM 950 CA ILE A 67 -3.851 8.356 -9.986 1.00 32.22 C ATOM 951 C ILE A 67 -3.880 8.077 -11.489 1.00 60.51 C ATOM 952 O ILE A 67 -4.829 8.401 -12.204 1.00 33.33 O ATOM 953 CB ILE A 67 -4.250 7.124 -9.135 1.00 1.51 C ATOM 954 CG1 ILE A 67 -5.704 6.650 -9.348 1.00 72.21 C ATOM 955 CG2 ILE A 67 -3.952 7.433 -7.660 1.00 14.20 C ATOM 956 CD1 ILE A 67 -6.015 5.355 -8.582 1.00 43.41 C ATOM 0 H ILE A 67 -5.664 9.302 -9.583 1.00 15.33 H new ATOM 0 HA ILE A 67 -2.822 8.572 -9.697 1.00 32.22 H new ATOM 0 HB ILE A 67 -3.649 6.279 -9.470 1.00 1.51 H new ATOM 0 HG12 ILE A 67 -6.390 7.433 -9.026 1.00 72.21 H new ATOM 0 HG13 ILE A 67 -5.879 6.491 -10.412 1.00 72.21 H new ATOM 0 HG21 ILE A 67 -4.227 6.576 -7.046 1.00 14.20 H new ATOM 0 HG22 ILE A 67 -2.889 7.640 -7.539 1.00 14.20 H new ATOM 0 HG23 ILE A 67 -4.529 8.303 -7.347 1.00 14.20 H new ATOM 0 HD11 ILE A 67 -7.049 5.064 -8.765 1.00 43.41 H new ATOM 0 HD12 ILE A 67 -5.349 4.562 -8.922 1.00 43.41 H new ATOM 0 HD13 ILE A 67 -5.867 5.519 -7.515 1.00 43.41 H new ATOM 967 N GLN A 68 -2.815 7.447 -11.962 1.00 15.14 N ATOM 968 CA GLN A 68 -2.505 7.130 -13.349 1.00 0.12 C ATOM 969 C GLN A 68 -2.316 5.607 -13.425 1.00 74.43 C ATOM 970 O GLN A 68 -1.406 5.084 -14.069 1.00 12.22 O ATOM 971 CB GLN A 68 -1.257 7.924 -13.778 1.00 20.30 C ATOM 972 CG GLN A 68 -1.147 9.341 -13.186 1.00 71.52 C ATOM 973 CD GLN A 68 -2.301 10.284 -13.528 1.00 23.10 C ATOM 974 OE1 GLN A 68 -2.799 11.037 -12.566 1.00 41.41 O flip ATOM 975 NE2 GLN A 68 -2.778 10.360 -14.658 1.00 72.52 N flip ATOM 0 H GLN A 68 -2.084 7.116 -11.332 1.00 15.14 H new ATOM 0 HA GLN A 68 -3.300 7.415 -14.038 1.00 0.12 H new ATOM 0 HB2 GLN A 68 -0.370 7.358 -13.493 1.00 20.30 H new ATOM 0 HB3 GLN A 68 -1.250 8.000 -14.865 1.00 20.30 H new ATOM 0 HG2 GLN A 68 -1.076 9.259 -12.101 1.00 71.52 H new ATOM 0 HG3 GLN A 68 -0.217 9.791 -13.533 1.00 71.52 H new ATOM 0 HE21 GLN A 68 -2.402 9.783 -15.410 1.00 72.52 H new ATOM 0 HE22 GLN A 68 -3.550 11.000 -14.844 1.00 72.52 H new ATOM 982 N LEU A 69 -3.108 4.895 -12.626 1.00 54.41 N ATOM 983 CA LEU A 69 -3.026 3.464 -12.384 1.00 24.21 C ATOM 984 C LEU A 69 -4.186 2.810 -13.104 1.00 4.00 C ATOM 985 O LEU A 69 -5.339 3.228 -12.976 1.00 72.45 O ATOM 986 CB LEU A 69 -3.047 3.201 -10.878 1.00 33.20 C ATOM 987 CG LEU A 69 -2.631 1.822 -10.333 1.00 42.44 C ATOM 988 CD1 LEU A 69 -3.575 0.687 -10.716 1.00 43.43 C ATOM 989 CD2 LEU A 69 -1.199 1.468 -10.737 1.00 24.22 C ATOM 0 H LEU A 69 -3.867 5.331 -12.102 1.00 54.41 H new ATOM 0 HA LEU A 69 -2.096 3.041 -12.765 1.00 24.21 H new ATOM 0 HB2 LEU A 69 -2.401 3.943 -10.410 1.00 33.20 H new ATOM 0 HB3 LEU A 69 -4.061 3.396 -10.529 1.00 33.20 H new ATOM 0 HG LEU A 69 -2.690 1.922 -9.249 1.00 42.44 H new ATOM 0 HD11 LEU A 69 -3.210 -0.249 -10.293 1.00 43.43 H new ATOM 0 HD12 LEU A 69 -4.572 0.896 -10.328 1.00 43.43 H new ATOM 0 HD13 LEU A 69 -3.619 0.601 -11.802 1.00 43.43 H new ATOM 0 HD21 LEU A 69 -0.939 0.489 -10.335 1.00 24.22 H new ATOM 0 HD22 LEU A 69 -1.122 1.446 -11.824 1.00 24.22 H new ATOM 0 HD23 LEU A 69 -0.513 2.217 -10.340 1.00 24.22 H new ATOM 1000 N ASP A 70 -3.818 1.801 -13.874 1.00 24.42 N ATOM 1001 CA ASP A 70 -4.690 1.084 -14.801 1.00 14.40 C ATOM 1002 C ASP A 70 -5.834 0.381 -14.072 1.00 3.40 C ATOM 1003 O ASP A 70 -5.832 0.245 -12.845 1.00 31.11 O ATOM 1004 CB ASP A 70 -3.885 0.107 -15.683 1.00 72.13 C ATOM 1005 CG ASP A 70 -3.743 0.638 -17.114 1.00 62.23 C ATOM 1006 OD1 ASP A 70 -3.573 1.862 -17.310 1.00 42.23 O ATOM 1007 OD2 ASP A 70 -3.804 -0.163 -18.069 1.00 75.11 O ATOM 0 H ASP A 70 -2.864 1.440 -13.874 1.00 24.42 H new ATOM 0 HA ASP A 70 -5.143 1.822 -15.463 1.00 14.40 H new ATOM 0 HB2 ASP A 70 -2.897 -0.047 -15.250 1.00 72.13 H new ATOM 0 HB3 ASP A 70 -4.381 -0.864 -15.700 1.00 72.13 H new ATOM 1011 N ASN A 71 -6.857 -0.049 -14.813 1.00 35.21 N ATOM 1012 CA ASN A 71 -8.050 -0.586 -14.180 1.00 53.23 C ATOM 1013 C ASN A 71 -7.855 -2.059 -13.861 1.00 2.02 C ATOM 1014 O ASN A 71 -7.729 -2.878 -14.774 1.00 72.15 O ATOM 1015 CB ASN A 71 -9.295 -0.369 -15.032 1.00 13.31 C ATOM 1016 CG ASN A 71 -10.479 -0.360 -14.096 1.00 61.31 C ATOM 1017 OD1 ASN A 71 -11.176 -1.356 -13.952 1.00 63.43 O ATOM 1018 ND2 ASN A 71 -10.642 0.734 -13.379 1.00 0.03 N ATOM 0 H ASN A 71 -6.880 -0.035 -15.833 1.00 35.21 H new ATOM 0 HA ASN A 71 -8.207 -0.043 -13.248 1.00 53.23 H new ATOM 0 HB2 ASN A 71 -9.229 0.572 -15.578 1.00 13.31 H new ATOM 0 HB3 ASN A 71 -9.397 -1.161 -15.774 1.00 13.31 H new ATOM 0 HD21 ASN A 71 -11.373 0.774 -12.669 1.00 0.03 H new ATOM 0 HD22 ASN A 71 -10.037 1.540 -13.534 1.00 0.03 H new ATOM 1024 N ILE A 72 -7.797 -2.388 -12.576 1.00 42.13 N ATOM 1025 CA ILE A 72 -7.361 -3.688 -12.066 1.00 21.14 C ATOM 1026 C ILE A 72 -8.346 -4.118 -10.984 1.00 32.51 C ATOM 1027 O ILE A 72 -8.679 -3.339 -10.092 1.00 21.54 O ATOM 1028 CB ILE A 72 -5.900 -3.605 -11.543 1.00 20.23 C ATOM 1029 CG1 ILE A 72 -4.905 -3.266 -12.679 1.00 71.23 C ATOM 1030 CG2 ILE A 72 -5.471 -4.920 -10.857 1.00 53.21 C ATOM 1031 CD1 ILE A 72 -3.481 -2.964 -12.192 1.00 60.12 C ATOM 0 H ILE A 72 -8.060 -1.739 -11.835 1.00 42.13 H new ATOM 0 HA ILE A 72 -7.357 -4.437 -12.858 1.00 21.14 H new ATOM 0 HB ILE A 72 -5.877 -2.800 -10.808 1.00 20.23 H new ATOM 0 HG12 ILE A 72 -4.869 -4.101 -13.378 1.00 71.23 H new ATOM 0 HG13 ILE A 72 -5.280 -2.404 -13.231 1.00 71.23 H new ATOM 0 HG21 ILE A 72 -4.444 -4.828 -10.503 1.00 53.21 H new ATOM 0 HG22 ILE A 72 -6.129 -5.121 -10.012 1.00 53.21 H new ATOM 0 HG23 ILE A 72 -5.536 -5.741 -11.571 1.00 53.21 H new ATOM 0 HD11 ILE A 72 -2.845 -2.736 -13.047 1.00 60.12 H new ATOM 0 HD12 ILE A 72 -3.501 -2.109 -11.517 1.00 60.12 H new ATOM 0 HD13 ILE A 72 -3.085 -3.832 -11.666 1.00 60.12 H new ATOM 1042 N ASP A 73 -8.793 -5.370 -11.061 1.00 62.24 N ATOM 1043 CA ASP A 73 -9.558 -6.038 -10.024 1.00 21.42 C ATOM 1044 C ASP A 73 -8.593 -6.427 -8.913 1.00 20.20 C ATOM 1045 O ASP A 73 -7.646 -7.181 -9.169 1.00 72.41 O ATOM 1046 CB ASP A 73 -10.182 -7.317 -10.595 1.00 63.44 C ATOM 1047 CG ASP A 73 -11.348 -7.019 -11.523 1.00 24.11 C ATOM 1048 OD1 ASP A 73 -12.293 -6.328 -11.082 1.00 23.42 O ATOM 1049 OD2 ASP A 73 -11.251 -7.391 -12.714 1.00 2.23 O ATOM 0 H ASP A 73 -8.624 -5.961 -11.875 1.00 62.24 H new ATOM 0 HA ASP A 73 -10.344 -5.382 -9.652 1.00 21.42 H new ATOM 0 HB2 ASP A 73 -9.422 -7.880 -11.137 1.00 63.44 H new ATOM 0 HB3 ASP A 73 -10.524 -7.950 -9.776 1.00 63.44 H new ATOM 1053 N TYR A 74 -8.836 -5.956 -7.691 1.00 22.44 N ATOM 1054 CA TYR A 74 -8.055 -6.329 -6.517 1.00 13.11 C ATOM 1055 C TYR A 74 -8.741 -7.428 -5.705 1.00 32.10 C ATOM 1056 O TYR A 74 -8.143 -7.931 -4.762 1.00 32.14 O ATOM 1057 CB TYR A 74 -7.795 -5.102 -5.631 1.00 11.31 C ATOM 1058 CG TYR A 74 -7.263 -3.894 -6.372 1.00 20.50 C ATOM 1059 CD1 TYR A 74 -6.048 -3.973 -7.077 1.00 55.24 C ATOM 1060 CD2 TYR A 74 -8.008 -2.703 -6.393 1.00 52.05 C ATOM 1061 CE1 TYR A 74 -5.612 -2.883 -7.849 1.00 60.35 C ATOM 1062 CE2 TYR A 74 -7.559 -1.598 -7.131 1.00 41.23 C ATOM 1063 CZ TYR A 74 -6.380 -1.698 -7.901 1.00 15.30 C ATOM 1064 OH TYR A 74 -5.950 -0.650 -8.649 1.00 60.24 O ATOM 0 H TYR A 74 -9.589 -5.298 -7.488 1.00 22.44 H new ATOM 0 HA TYR A 74 -7.102 -6.722 -6.872 1.00 13.11 H new ATOM 0 HB2 TYR A 74 -8.724 -4.826 -5.132 1.00 11.31 H new ATOM 0 HB3 TYR A 74 -7.084 -5.376 -4.852 1.00 11.31 H new ATOM 0 HD1 TYR A 74 -5.451 -4.871 -7.025 1.00 55.24 H new ATOM 0 HD2 TYR A 74 -8.932 -2.638 -5.838 1.00 52.05 H new ATOM 0 HE1 TYR A 74 -4.688 -2.951 -8.404 1.00 60.35 H new ATOM 0 HE2 TYR A 74 -8.114 -0.672 -7.110 1.00 41.23 H new ATOM 0 HH TYR A 74 -6.592 0.087 -8.579 1.00 60.24 H new ATOM 1073 N ASN A 75 -9.978 -7.824 -6.028 1.00 51.13 N ATOM 1074 CA ASN A 75 -10.723 -8.738 -5.155 1.00 31.50 C ATOM 1075 C ASN A 75 -10.166 -10.167 -5.173 1.00 31.22 C ATOM 1076 O ASN A 75 -10.409 -10.950 -4.256 1.00 43.33 O ATOM 1077 CB ASN A 75 -12.225 -8.725 -5.482 1.00 24.23 C ATOM 1078 CG ASN A 75 -13.045 -8.649 -4.201 1.00 12.24 C ATOM 1079 OD1 ASN A 75 -13.909 -7.790 -4.060 1.00 0.51 O ATOM 1080 ND2 ASN A 75 -12.752 -9.492 -3.229 1.00 52.12 N ATOM 0 H ASN A 75 -10.476 -7.533 -6.869 1.00 51.13 H new ATOM 0 HA ASN A 75 -10.591 -8.366 -4.139 1.00 31.50 H new ATOM 0 HB2 ASN A 75 -12.457 -7.873 -6.121 1.00 24.23 H new ATOM 0 HB3 ASN A 75 -12.491 -9.624 -6.039 1.00 24.23 H new ATOM 0 HD21 ASN A 75 -13.248 -9.437 -2.339 1.00 52.12 H new ATOM 0 HD22 ASN A 75 -12.030 -10.199 -3.367 1.00 52.12 H new ATOM 1086 N ASN A 76 -9.384 -10.492 -6.203 1.00 24.10 N ATOM 1087 CA ASN A 76 -8.688 -11.752 -6.428 1.00 13.30 C ATOM 1088 C ASN A 76 -7.307 -11.766 -5.751 1.00 12.34 C ATOM 1089 O ASN A 76 -6.353 -12.314 -6.298 1.00 64.51 O ATOM 1090 CB ASN A 76 -8.628 -12.053 -7.940 1.00 61.42 C ATOM 1091 CG ASN A 76 -7.946 -10.967 -8.765 1.00 32.42 C ATOM 1092 OD1 ASN A 76 -8.647 -9.874 -9.019 1.00 53.25 O flip ATOM 1093 ND2 ASN A 76 -6.821 -11.089 -9.241 1.00 14.03 N flip ATOM 0 H ASN A 76 -9.210 -9.828 -6.957 1.00 24.10 H new ATOM 0 HA ASN A 76 -9.249 -12.559 -5.957 1.00 13.30 H new ATOM 0 HB2 ASN A 76 -8.100 -12.994 -8.091 1.00 61.42 H new ATOM 0 HB3 ASN A 76 -9.643 -12.193 -8.312 1.00 61.42 H new ATOM 0 HD21 ASN A 76 -6.275 -11.929 -9.050 1.00 14.03 H new ATOM 0 HD22 ASN A 76 -6.433 -10.351 -9.828 1.00 14.03 H new ATOM 1099 N TYR A 77 -7.193 -11.159 -4.566 1.00 13.23 N ATOM 1100 CA TYR A 77 -6.019 -11.218 -3.700 1.00 13.30 C ATOM 1101 C TYR A 77 -6.471 -11.512 -2.279 1.00 53.42 C ATOM 1102 O TYR A 77 -7.623 -11.260 -1.926 1.00 42.32 O ATOM 1103 CB TYR A 77 -5.183 -9.936 -3.791 1.00 55.41 C ATOM 1104 CG TYR A 77 -4.566 -9.799 -5.164 1.00 52.25 C ATOM 1105 CD1 TYR A 77 -3.406 -10.523 -5.493 1.00 60.34 C ATOM 1106 CD2 TYR A 77 -5.265 -9.107 -6.164 1.00 2.20 C ATOM 1107 CE1 TYR A 77 -2.999 -10.630 -6.833 1.00 44.15 C ATOM 1108 CE2 TYR A 77 -4.879 -9.210 -7.504 1.00 74.54 C ATOM 1109 CZ TYR A 77 -3.769 -10.012 -7.844 1.00 11.31 C ATOM 1110 OH TYR A 77 -3.469 -10.217 -9.150 1.00 32.13 O ATOM 0 H TYR A 77 -7.945 -10.593 -4.172 1.00 13.23 H new ATOM 0 HA TYR A 77 -5.364 -12.023 -4.033 1.00 13.30 H new ATOM 0 HB2 TYR A 77 -5.811 -9.070 -3.581 1.00 55.41 H new ATOM 0 HB3 TYR A 77 -4.399 -9.952 -3.034 1.00 55.41 H new ATOM 0 HD1 TYR A 77 -2.827 -10.997 -4.714 1.00 60.34 H new ATOM 0 HD2 TYR A 77 -6.109 -8.489 -5.896 1.00 2.20 H new ATOM 0 HE1 TYR A 77 -2.105 -11.180 -7.089 1.00 44.15 H new ATOM 0 HE2 TYR A 77 -5.425 -8.681 -8.271 1.00 74.54 H new ATOM 0 HH TYR A 77 -2.496 -10.242 -9.262 1.00 32.13 H new ATOM 1119 N ASP A 78 -5.560 -12.045 -1.468 1.00 71.44 N ATOM 1120 CA ASP A 78 -5.792 -12.285 -0.042 1.00 54.21 C ATOM 1121 C ASP A 78 -5.007 -11.284 0.812 1.00 2.44 C ATOM 1122 O ASP A 78 -5.538 -10.724 1.779 1.00 4.10 O ATOM 1123 CB ASP A 78 -5.398 -13.728 0.268 1.00 4.34 C ATOM 1124 CG ASP A 78 -5.575 -14.102 1.733 1.00 73.23 C ATOM 1125 OD1 ASP A 78 -6.668 -13.902 2.306 1.00 60.44 O ATOM 1126 OD2 ASP A 78 -4.623 -14.655 2.316 1.00 62.44 O ATOM 0 H ASP A 78 -4.631 -12.326 -1.783 1.00 71.44 H new ATOM 0 HA ASP A 78 -6.845 -12.141 0.200 1.00 54.21 H new ATOM 0 HB2 ASP A 78 -5.997 -14.400 -0.346 1.00 4.34 H new ATOM 0 HB3 ASP A 78 -4.357 -13.881 -0.015 1.00 4.34 H new ATOM 1130 N LEU A 79 -3.775 -11.003 0.383 1.00 11.12 N ATOM 1131 CA LEU A 79 -2.834 -10.026 0.909 1.00 54.31 C ATOM 1132 C LEU A 79 -2.600 -8.967 -0.171 1.00 60.23 C ATOM 1133 O LEU A 79 -2.541 -9.298 -1.360 1.00 34.33 O ATOM 1134 CB LEU A 79 -1.503 -10.737 1.224 1.00 21.41 C ATOM 1135 CG LEU A 79 -1.133 -10.877 2.707 1.00 74.43 C ATOM 1136 CD1 LEU A 79 0.186 -11.637 2.801 1.00 13.40 C ATOM 1137 CD2 LEU A 79 -0.877 -9.538 3.384 1.00 63.31 C ATOM 0 H LEU A 79 -3.380 -11.502 -0.414 1.00 11.12 H new ATOM 0 HA LEU A 79 -3.222 -9.563 1.816 1.00 54.31 H new ATOM 0 HB2 LEU A 79 -1.538 -11.734 0.786 1.00 21.41 H new ATOM 0 HB3 LEU A 79 -0.701 -10.196 0.722 1.00 21.41 H new ATOM 0 HG LEU A 79 -1.971 -11.377 3.193 1.00 74.43 H new ATOM 0 HD11 LEU A 79 0.468 -11.748 3.848 1.00 13.40 H new ATOM 0 HD12 LEU A 79 0.071 -12.623 2.350 1.00 13.40 H new ATOM 0 HD13 LEU A 79 0.963 -11.084 2.273 1.00 13.40 H new ATOM 0 HD21 LEU A 79 -0.620 -9.703 4.430 1.00 63.31 H new ATOM 0 HD22 LEU A 79 -0.053 -9.029 2.884 1.00 63.31 H new ATOM 0 HD23 LEU A 79 -1.774 -8.922 3.323 1.00 63.31 H new ATOM 1148 N ILE A 80 -2.430 -7.713 0.241 1.00 31.30 N ATOM 1149 CA ILE A 80 -2.119 -6.572 -0.622 1.00 72.35 C ATOM 1150 C ILE A 80 -1.209 -5.631 0.179 1.00 43.44 C ATOM 1151 O ILE A 80 -1.683 -4.858 1.009 1.00 54.32 O ATOM 1152 CB ILE A 80 -3.392 -5.861 -1.159 1.00 61.31 C ATOM 1153 CG1 ILE A 80 -4.284 -6.803 -1.998 1.00 40.22 C ATOM 1154 CG2 ILE A 80 -2.987 -4.666 -2.040 1.00 72.33 C ATOM 1155 CD1 ILE A 80 -5.475 -6.119 -2.683 1.00 14.31 C ATOM 0 H ILE A 80 -2.508 -7.452 1.224 1.00 31.30 H new ATOM 0 HA ILE A 80 -1.604 -6.914 -1.520 1.00 72.35 H new ATOM 0 HB ILE A 80 -3.962 -5.533 -0.290 1.00 61.31 H new ATOM 0 HG12 ILE A 80 -3.668 -7.280 -2.761 1.00 40.22 H new ATOM 0 HG13 ILE A 80 -4.661 -7.596 -1.351 1.00 40.22 H new ATOM 0 HG21 ILE A 80 -3.882 -4.170 -2.415 1.00 72.33 H new ATOM 0 HG22 ILE A 80 -2.402 -3.961 -1.450 1.00 72.33 H new ATOM 0 HG23 ILE A 80 -2.390 -5.019 -2.880 1.00 72.33 H new ATOM 0 HD11 ILE A 80 -6.043 -6.858 -3.248 1.00 14.31 H new ATOM 0 HD12 ILE A 80 -6.118 -5.667 -1.928 1.00 14.31 H new ATOM 0 HD13 ILE A 80 -5.111 -5.346 -3.360 1.00 14.31 H new ATOM 1166 N LEU A 81 0.104 -5.704 -0.040 1.00 23.13 N ATOM 1167 CA LEU A 81 1.081 -4.796 0.574 1.00 60.34 C ATOM 1168 C LEU A 81 0.966 -3.427 -0.104 1.00 43.33 C ATOM 1169 O LEU A 81 0.984 -3.377 -1.339 1.00 75.43 O ATOM 1170 CB LEU A 81 2.498 -5.367 0.337 1.00 62.12 C ATOM 1171 CG LEU A 81 3.029 -6.321 1.424 1.00 21.03 C ATOM 1172 CD1 LEU A 81 2.130 -7.544 1.636 1.00 4.12 C ATOM 1173 CD2 LEU A 81 4.421 -6.814 1.005 1.00 24.20 C ATOM 0 H LEU A 81 0.526 -6.401 -0.654 1.00 23.13 H new ATOM 0 HA LEU A 81 0.895 -4.697 1.643 1.00 60.34 H new ATOM 0 HB2 LEU A 81 2.501 -5.896 -0.616 1.00 62.12 H new ATOM 0 HB3 LEU A 81 3.193 -4.533 0.241 1.00 62.12 H new ATOM 0 HG LEU A 81 3.056 -5.764 2.360 1.00 21.03 H new ATOM 0 HD11 LEU A 81 2.556 -8.178 2.413 1.00 4.12 H new ATOM 0 HD12 LEU A 81 1.136 -7.216 1.939 1.00 4.12 H new ATOM 0 HD13 LEU A 81 2.058 -8.108 0.706 1.00 4.12 H new ATOM 0 HD21 LEU A 81 4.811 -7.491 1.765 1.00 24.20 H new ATOM 0 HD22 LEU A 81 4.349 -7.340 0.053 1.00 24.20 H new ATOM 0 HD23 LEU A 81 5.092 -5.962 0.899 1.00 24.20 H new ATOM 1184 N ILE A 82 0.889 -2.316 0.651 1.00 60.25 N ATOM 1185 CA ILE A 82 0.856 -0.969 0.077 1.00 41.15 C ATOM 1186 C ILE A 82 1.887 -0.069 0.752 1.00 15.11 C ATOM 1187 O ILE A 82 1.782 0.254 1.935 1.00 3.51 O ATOM 1188 CB ILE A 82 -0.567 -0.373 0.112 1.00 51.53 C ATOM 1189 CG1 ILE A 82 -1.454 -1.128 -0.901 1.00 74.22 C ATOM 1190 CG2 ILE A 82 -0.524 1.129 -0.246 1.00 14.53 C ATOM 1191 CD1 ILE A 82 -2.933 -0.752 -0.892 1.00 64.34 C ATOM 0 H ILE A 82 0.848 -2.332 1.670 1.00 60.25 H new ATOM 0 HA ILE A 82 1.131 -1.038 -0.975 1.00 41.15 H new ATOM 0 HB ILE A 82 -0.980 -0.480 1.115 1.00 51.53 H new ATOM 0 HG12 ILE A 82 -1.060 -0.954 -1.902 1.00 74.22 H new ATOM 0 HG13 ILE A 82 -1.368 -2.197 -0.706 1.00 74.22 H new ATOM 0 HG21 ILE A 82 -1.534 1.539 -0.218 1.00 14.53 H new ATOM 0 HG22 ILE A 82 0.102 1.657 0.474 1.00 14.53 H new ATOM 0 HG23 ILE A 82 -0.110 1.253 -1.247 1.00 14.53 H new ATOM 0 HD11 ILE A 82 -3.463 -1.341 -1.641 1.00 64.34 H new ATOM 0 HD12 ILE A 82 -3.354 -0.954 0.093 1.00 64.34 H new ATOM 0 HD13 ILE A 82 -3.040 0.308 -1.122 1.00 64.34 H new ATOM 1202 N GLY A 83 2.840 0.427 -0.034 1.00 35.44 N ATOM 1203 CA GLY A 83 3.827 1.394 0.428 1.00 42.51 C ATOM 1204 C GLY A 83 3.581 2.795 -0.136 1.00 71.12 C ATOM 1205 O GLY A 83 2.805 2.970 -1.084 1.00 61.25 O ATOM 0 H GLY A 83 2.948 0.166 -1.014 1.00 35.44 H new ATOM 0 HA2 GLY A 83 3.809 1.436 1.517 1.00 42.51 H new ATOM 0 HA3 GLY A 83 4.823 1.059 0.139 1.00 42.51 H new ATOM 1209 N SER A 84 4.249 3.804 0.425 1.00 35.11 N ATOM 1210 CA SER A 84 4.095 5.213 0.061 1.00 4.24 C ATOM 1211 C SER A 84 5.267 6.041 0.619 1.00 55.33 C ATOM 1212 O SER A 84 5.843 5.646 1.626 1.00 24.12 O ATOM 1213 CB SER A 84 2.760 5.750 0.615 1.00 35.11 C ATOM 1214 OG SER A 84 2.241 5.003 1.710 1.00 61.03 O ATOM 0 H SER A 84 4.933 3.659 1.168 1.00 35.11 H new ATOM 0 HA SER A 84 4.094 5.299 -1.026 1.00 4.24 H new ATOM 0 HB2 SER A 84 2.899 6.785 0.929 1.00 35.11 H new ATOM 0 HB3 SER A 84 2.023 5.757 -0.188 1.00 35.11 H new ATOM 0 HG SER A 84 2.228 5.565 2.513 1.00 61.03 H new ATOM 1219 N PRO A 85 5.606 7.204 0.032 1.00 35.22 N ATOM 1220 CA PRO A 85 6.607 8.106 0.595 1.00 42.22 C ATOM 1221 C PRO A 85 6.047 8.958 1.743 1.00 32.43 C ATOM 1222 O PRO A 85 4.838 8.955 1.985 1.00 43.42 O ATOM 1223 CB PRO A 85 7.019 8.979 -0.584 1.00 4.21 C ATOM 1224 CG PRO A 85 5.765 9.077 -1.443 1.00 1.54 C ATOM 1225 CD PRO A 85 5.118 7.706 -1.244 1.00 23.30 C ATOM 0 HA PRO A 85 7.441 7.560 1.035 1.00 42.22 H new ATOM 0 HB2 PRO A 85 7.351 9.963 -0.252 1.00 4.21 H new ATOM 0 HB3 PRO A 85 7.846 8.534 -1.138 1.00 4.21 H new ATOM 0 HG2 PRO A 85 5.111 9.885 -1.116 1.00 1.54 H new ATOM 0 HG3 PRO A 85 6.004 9.265 -2.490 1.00 1.54 H new ATOM 0 HD2 PRO A 85 4.031 7.786 -1.240 1.00 23.30 H new ATOM 0 HD3 PRO A 85 5.385 7.029 -2.056 1.00 23.30 H new ATOM 1230 N VAL A 86 6.891 9.775 2.374 1.00 64.31 N ATOM 1231 CA VAL A 86 6.543 10.758 3.397 1.00 61.45 C ATOM 1232 C VAL A 86 7.184 12.089 3.002 1.00 60.22 C ATOM 1233 O VAL A 86 8.336 12.102 2.567 1.00 75.11 O ATOM 1234 CB VAL A 86 7.015 10.249 4.776 1.00 42.43 C ATOM 1235 CG1 VAL A 86 7.040 11.339 5.845 1.00 22.43 C ATOM 1236 CG2 VAL A 86 6.090 9.128 5.263 1.00 63.34 C ATOM 0 H VAL A 86 7.891 9.767 2.173 1.00 64.31 H new ATOM 0 HA VAL A 86 5.466 10.906 3.470 1.00 61.45 H new ATOM 0 HB VAL A 86 8.035 9.892 4.634 1.00 42.43 H new ATOM 0 HG11 VAL A 86 7.381 10.915 6.789 1.00 22.43 H new ATOM 0 HG12 VAL A 86 7.720 12.134 5.538 1.00 22.43 H new ATOM 0 HG13 VAL A 86 6.037 11.748 5.971 1.00 22.43 H new ATOM 0 HG21 VAL A 86 6.429 8.774 6.236 1.00 63.34 H new ATOM 0 HG22 VAL A 86 5.072 9.508 5.350 1.00 63.34 H new ATOM 0 HG23 VAL A 86 6.110 8.304 4.550 1.00 63.34 H new ATOM 1246 N TRP A 87 6.437 13.185 3.141 1.00 24.23 N ATOM 1247 CA TRP A 87 6.892 14.556 2.941 1.00 72.05 C ATOM 1248 C TRP A 87 7.249 15.188 4.291 1.00 11.10 C ATOM 1249 O TRP A 87 7.349 14.495 5.304 1.00 11.32 O ATOM 1250 CB TRP A 87 5.799 15.355 2.200 1.00 52.43 C ATOM 1251 CG TRP A 87 6.271 15.903 0.882 1.00 55.43 C ATOM 1252 CD1 TRP A 87 6.918 17.072 0.649 1.00 53.33 C ATOM 1253 CD2 TRP A 87 6.177 15.244 -0.414 1.00 72.01 C ATOM 1254 NE1 TRP A 87 7.246 17.164 -0.696 1.00 1.22 N ATOM 1255 CE2 TRP A 87 6.807 16.061 -1.396 1.00 62.22 C ATOM 1256 CE3 TRP A 87 5.607 14.030 -0.853 1.00 52.35 C ATOM 1257 CZ2 TRP A 87 6.876 15.680 -2.743 1.00 53.24 C ATOM 1258 CZ3 TRP A 87 5.610 13.672 -2.214 1.00 74.05 C ATOM 1259 CH2 TRP A 87 6.246 14.493 -3.158 1.00 64.05 C ATOM 0 H TRP A 87 5.454 13.136 3.408 1.00 24.23 H new ATOM 0 HA TRP A 87 7.792 14.568 2.326 1.00 72.05 H new ATOM 0 HB2 TRP A 87 4.935 14.711 2.032 1.00 52.43 H new ATOM 0 HB3 TRP A 87 5.465 16.178 2.832 1.00 52.43 H new ATOM 0 HD1 TRP A 87 7.144 17.818 1.397 1.00 53.33 H new ATOM 0 HE1 TRP A 87 7.748 17.948 -1.113 1.00 1.22 H new ATOM 0 HE3 TRP A 87 5.160 13.363 -0.131 1.00 52.35 H new ATOM 0 HZ2 TRP A 87 7.408 16.292 -3.456 1.00 53.24 H new ATOM 0 HZ3 TRP A 87 5.122 12.763 -2.533 1.00 74.05 H new ATOM 0 HH2 TRP A 87 6.252 14.214 -4.201 1.00 64.05 H new ATOM 1269 N SER A 88 7.436 16.504 4.312 1.00 54.23 N ATOM 1270 CA SER A 88 7.516 17.388 5.456 1.00 12.13 C ATOM 1271 C SER A 88 6.360 17.099 6.413 1.00 14.50 C ATOM 1272 O SER A 88 5.247 17.610 6.286 1.00 64.32 O ATOM 1273 CB SER A 88 7.508 18.844 4.962 1.00 40.21 C ATOM 1274 OG SER A 88 8.328 19.017 3.818 1.00 75.23 O ATOM 0 H SER A 88 7.545 17.022 3.440 1.00 54.23 H new ATOM 0 HA SER A 88 8.442 17.221 6.006 1.00 12.13 H new ATOM 0 HB2 SER A 88 6.487 19.142 4.725 1.00 40.21 H new ATOM 0 HB3 SER A 88 7.855 19.500 5.760 1.00 40.21 H new ATOM 0 HG SER A 88 8.297 19.954 3.532 1.00 75.23 H new ATOM 1279 N GLY A 89 6.633 16.211 7.353 1.00 64.44 N ATOM 1280 CA GLY A 89 5.765 15.800 8.438 1.00 75.05 C ATOM 1281 C GLY A 89 4.669 14.823 8.032 1.00 15.21 C ATOM 1282 O GLY A 89 4.395 13.939 8.843 1.00 44.55 O ATOM 0 H GLY A 89 7.530 15.726 7.378 1.00 64.44 H new ATOM 0 HA2 GLY A 89 6.372 15.342 9.219 1.00 75.05 H new ATOM 0 HA3 GLY A 89 5.302 16.686 8.872 1.00 75.05 H new ATOM 1286 N TYR A 90 4.063 14.888 6.836 1.00 53.42 N ATOM 1287 CA TYR A 90 2.984 13.964 6.475 1.00 51.11 C ATOM 1288 C TYR A 90 3.166 13.469 5.040 1.00 43.42 C ATOM 1289 O TYR A 90 3.901 14.104 4.278 1.00 75.15 O ATOM 1290 CB TYR A 90 1.645 14.685 6.623 1.00 2.24 C ATOM 1291 CG TYR A 90 1.136 14.993 8.026 1.00 51.12 C ATOM 1292 CD1 TYR A 90 1.132 14.006 9.031 1.00 33.44 C ATOM 1293 CD2 TYR A 90 0.504 16.226 8.273 1.00 11.42 C ATOM 1294 CE1 TYR A 90 0.444 14.222 10.240 1.00 20.11 C ATOM 1295 CE2 TYR A 90 -0.193 16.445 9.474 1.00 42.15 C ATOM 1296 CZ TYR A 90 -0.252 15.432 10.452 1.00 75.02 C ATOM 1297 OH TYR A 90 -1.015 15.598 11.569 1.00 64.14 O ATOM 0 H TYR A 90 4.301 15.565 6.111 1.00 53.42 H new ATOM 0 HA TYR A 90 3.007 13.098 7.137 1.00 51.11 H new ATOM 0 HB2 TYR A 90 1.715 15.628 6.081 1.00 2.24 H new ATOM 0 HB3 TYR A 90 0.887 14.084 6.120 1.00 2.24 H new ATOM 0 HD1 TYR A 90 1.660 13.077 8.873 1.00 33.44 H new ATOM 0 HD2 TYR A 90 0.555 17.011 7.533 1.00 11.42 H new ATOM 0 HE1 TYR A 90 0.449 13.461 11.006 1.00 20.11 H new ATOM 0 HE2 TYR A 90 -0.684 17.391 9.647 1.00 42.15 H new ATOM 0 HH TYR A 90 -1.423 16.489 11.557 1.00 64.14 H new ATOM 1306 N PRO A 91 2.520 12.364 4.627 1.00 52.24 N ATOM 1307 CA PRO A 91 2.559 11.914 3.240 1.00 61.21 C ATOM 1308 C PRO A 91 1.817 12.893 2.321 1.00 15.54 C ATOM 1309 O PRO A 91 1.086 13.776 2.768 1.00 60.13 O ATOM 1310 CB PRO A 91 1.953 10.502 3.255 1.00 43.52 C ATOM 1311 CG PRO A 91 0.991 10.549 4.438 1.00 15.30 C ATOM 1312 CD PRO A 91 1.719 11.453 5.435 1.00 63.11 C ATOM 0 HA PRO A 91 3.571 11.883 2.836 1.00 61.21 H new ATOM 0 HB2 PRO A 91 1.435 10.276 2.323 1.00 43.52 H new ATOM 0 HB3 PRO A 91 2.718 9.737 3.388 1.00 43.52 H new ATOM 0 HG2 PRO A 91 0.022 10.959 4.154 1.00 15.30 H new ATOM 0 HG3 PRO A 91 0.809 9.557 4.851 1.00 15.30 H new ATOM 0 HD2 PRO A 91 1.011 12.000 6.057 1.00 63.11 H new ATOM 0 HD3 PRO A 91 2.348 10.869 6.107 1.00 63.11 H new ATOM 1317 N ALA A 92 1.995 12.721 1.015 1.00 71.03 N ATOM 1318 CA ALA A 92 1.352 13.440 -0.087 1.00 52.55 C ATOM 1319 C ALA A 92 -0.098 12.978 -0.337 1.00 3.44 C ATOM 1320 O ALA A 92 -0.633 13.146 -1.431 1.00 4.21 O ATOM 1321 CB ALA A 92 2.241 13.223 -1.326 1.00 40.13 C ATOM 0 H ALA A 92 2.647 12.017 0.668 1.00 71.03 H new ATOM 0 HA ALA A 92 1.266 14.499 0.156 1.00 52.55 H new ATOM 0 HB1 ALA A 92 1.806 13.740 -2.181 1.00 40.13 H new ATOM 0 HB2 ALA A 92 3.238 13.618 -1.132 1.00 40.13 H new ATOM 0 HB3 ALA A 92 2.309 12.157 -1.543 1.00 40.13 H new ATOM 1327 N THR A 93 -0.681 12.244 0.615 1.00 24.32 N ATOM 1328 CA THR A 93 -1.933 11.501 0.474 1.00 11.11 C ATOM 1329 C THR A 93 -2.025 10.747 -0.874 1.00 61.41 C ATOM 1330 O THR A 93 -3.025 10.854 -1.584 1.00 73.02 O ATOM 1331 CB THR A 93 -3.156 12.354 0.860 1.00 42.34 C ATOM 1332 OG1 THR A 93 -4.335 11.658 0.529 1.00 51.55 O ATOM 1333 CG2 THR A 93 -3.196 13.750 0.231 1.00 11.24 C ATOM 0 H THR A 93 -0.274 12.148 1.545 1.00 24.32 H new ATOM 0 HA THR A 93 -1.936 10.696 1.209 1.00 11.11 H new ATOM 0 HB THR A 93 -3.073 12.518 1.934 1.00 42.34 H new ATOM 0 HG1 THR A 93 -5.066 11.957 1.110 1.00 51.55 H new ATOM 0 HG21 THR A 93 -4.093 14.273 0.562 1.00 11.24 H new ATOM 0 HG22 THR A 93 -2.314 14.313 0.537 1.00 11.24 H new ATOM 0 HG23 THR A 93 -3.209 13.659 -0.855 1.00 11.24 H new ATOM 1341 N PRO A 94 -1.041 9.905 -1.220 1.00 24.10 N ATOM 1342 CA PRO A 94 -1.124 9.119 -2.439 1.00 60.33 C ATOM 1343 C PRO A 94 -2.206 8.039 -2.315 1.00 34.02 C ATOM 1344 O PRO A 94 -2.930 7.782 -3.271 1.00 41.35 O ATOM 1345 CB PRO A 94 0.292 8.559 -2.625 1.00 12.13 C ATOM 1346 CG PRO A 94 0.846 8.479 -1.203 1.00 44.44 C ATOM 1347 CD PRO A 94 0.229 9.695 -0.551 1.00 22.00 C ATOM 0 HA PRO A 94 -1.425 9.697 -3.313 1.00 60.33 H new ATOM 0 HB2 PRO A 94 0.275 7.579 -3.103 1.00 12.13 H new ATOM 0 HB3 PRO A 94 0.899 9.210 -3.254 1.00 12.13 H new ATOM 0 HG2 PRO A 94 0.552 7.556 -0.703 1.00 44.44 H new ATOM 0 HG3 PRO A 94 1.935 8.517 -1.188 1.00 44.44 H new ATOM 0 HD2 PRO A 94 0.085 9.534 0.518 1.00 22.00 H new ATOM 0 HD3 PRO A 94 0.876 10.566 -0.658 1.00 22.00 H new ATOM 1352 N ILE A 95 -2.350 7.394 -1.155 1.00 64.22 N ATOM 1353 CA ILE A 95 -3.123 6.157 -1.069 1.00 35.43 C ATOM 1354 C ILE A 95 -4.626 6.462 -0.913 1.00 23.21 C ATOM 1355 O ILE A 95 -5.438 5.615 -1.278 1.00 2.31 O ATOM 1356 CB ILE A 95 -2.530 5.232 0.027 1.00 53.22 C ATOM 1357 CG1 ILE A 95 -0.987 5.036 -0.055 1.00 40.32 C ATOM 1358 CG2 ILE A 95 -3.191 3.844 0.010 1.00 21.30 C ATOM 1359 CD1 ILE A 95 -0.401 4.761 -1.452 1.00 41.55 C ATOM 0 H ILE A 95 -1.945 7.705 -0.272 1.00 64.22 H new ATOM 0 HA ILE A 95 -3.043 5.598 -2.002 1.00 35.43 H new ATOM 0 HB ILE A 95 -2.746 5.755 0.958 1.00 53.22 H new ATOM 0 HG12 ILE A 95 -0.508 5.930 0.346 1.00 40.32 H new ATOM 0 HG13 ILE A 95 -0.713 4.208 0.598 1.00 40.32 H new ATOM 0 HG21 ILE A 95 -2.752 3.222 0.790 1.00 21.30 H new ATOM 0 HG22 ILE A 95 -4.261 3.948 0.189 1.00 21.30 H new ATOM 0 HG23 ILE A 95 -3.029 3.376 -0.961 1.00 21.30 H new ATOM 0 HD11 ILE A 95 0.680 4.643 -1.376 1.00 41.55 H new ATOM 0 HD12 ILE A 95 -0.838 3.848 -1.857 1.00 41.55 H new ATOM 0 HD13 ILE A 95 -0.630 5.597 -2.113 1.00 41.55 H new ATOM 1370 N LYS A 96 -5.022 7.670 -0.471 1.00 35.33 N ATOM 1371 CA LYS A 96 -6.427 8.088 -0.344 1.00 20.24 C ATOM 1372 C LYS A 96 -7.232 7.729 -1.587 1.00 2.43 C ATOM 1373 O LYS A 96 -8.233 7.031 -1.468 1.00 1.21 O ATOM 1374 CB LYS A 96 -6.463 9.589 -0.038 1.00 41.43 C ATOM 1375 CG LYS A 96 -7.825 10.295 -0.108 1.00 0.20 C ATOM 1376 CD LYS A 96 -8.741 10.287 1.124 1.00 42.14 C ATOM 1377 CE LYS A 96 -9.048 8.918 1.740 1.00 2.20 C ATOM 1378 NZ LYS A 96 -10.240 9.005 2.603 1.00 40.41 N ATOM 0 H LYS A 96 -4.362 8.394 -0.188 1.00 35.33 H new ATOM 0 HA LYS A 96 -6.899 7.550 0.478 1.00 20.24 H new ATOM 0 HB2 LYS A 96 -6.058 9.738 0.963 1.00 41.43 H new ATOM 0 HB3 LYS A 96 -5.788 10.090 -0.732 1.00 41.43 H new ATOM 0 HG2 LYS A 96 -7.641 11.336 -0.372 1.00 0.20 H new ATOM 0 HG3 LYS A 96 -8.382 9.851 -0.933 1.00 0.20 H new ATOM 0 HD2 LYS A 96 -8.285 10.912 1.892 1.00 42.14 H new ATOM 0 HD3 LYS A 96 -9.685 10.757 0.850 1.00 42.14 H new ATOM 0 HE2 LYS A 96 -9.214 8.185 0.951 1.00 2.20 H new ATOM 0 HE3 LYS A 96 -8.193 8.573 2.321 1.00 2.20 H new ATOM 0 HZ1 LYS A 96 -10.439 8.071 3.015 1.00 40.41 H new ATOM 0 HZ2 LYS A 96 -10.067 9.691 3.366 1.00 40.41 H new ATOM 0 HZ3 LYS A 96 -11.056 9.315 2.038 1.00 40.41 H new ATOM 1388 N THR A 97 -6.799 8.200 -2.754 1.00 44.31 N ATOM 1389 CA THR A 97 -7.529 8.017 -3.997 1.00 75.12 C ATOM 1390 C THR A 97 -7.770 6.523 -4.258 1.00 11.43 C ATOM 1391 O THR A 97 -8.895 6.071 -4.455 1.00 14.30 O ATOM 1392 CB THR A 97 -6.720 8.676 -5.133 1.00 23.41 C ATOM 1393 OG1 THR A 97 -6.174 9.921 -4.716 1.00 61.01 O ATOM 1394 CG2 THR A 97 -7.609 8.864 -6.364 1.00 23.22 C ATOM 0 H THR A 97 -5.928 8.721 -2.860 1.00 44.31 H new ATOM 0 HA THR A 97 -8.509 8.490 -3.940 1.00 75.12 H new ATOM 0 HB THR A 97 -5.890 8.019 -5.392 1.00 23.41 H new ATOM 0 HG1 THR A 97 -5.904 10.440 -5.502 1.00 61.01 H new ATOM 0 HG21 THR A 97 -7.031 9.330 -7.162 1.00 23.22 H new ATOM 0 HG22 THR A 97 -7.975 7.894 -6.700 1.00 23.22 H new ATOM 0 HG23 THR A 97 -8.455 9.502 -6.108 1.00 23.22 H new ATOM 1402 N LEU A 98 -6.701 5.728 -4.236 1.00 22.32 N ATOM 1403 CA LEU A 98 -6.751 4.310 -4.563 1.00 60.21 C ATOM 1404 C LEU A 98 -7.632 3.537 -3.582 1.00 51.35 C ATOM 1405 O LEU A 98 -8.417 2.692 -4.012 1.00 2.32 O ATOM 1406 CB LEU A 98 -5.305 3.781 -4.564 1.00 32.20 C ATOM 1407 CG LEU A 98 -5.178 2.270 -4.827 1.00 52.33 C ATOM 1408 CD1 LEU A 98 -5.697 1.899 -6.219 1.00 55.55 C ATOM 1409 CD2 LEU A 98 -3.702 1.871 -4.684 1.00 0.33 C ATOM 0 H LEU A 98 -5.768 6.057 -3.988 1.00 22.32 H new ATOM 0 HA LEU A 98 -7.202 4.169 -5.545 1.00 60.21 H new ATOM 0 HB2 LEU A 98 -4.736 4.318 -5.323 1.00 32.20 H new ATOM 0 HB3 LEU A 98 -4.848 4.009 -3.601 1.00 32.20 H new ATOM 0 HG LEU A 98 -5.786 1.730 -4.101 1.00 52.33 H new ATOM 0 HD11 LEU A 98 -5.593 0.825 -6.372 1.00 55.55 H new ATOM 0 HD12 LEU A 98 -6.748 2.177 -6.302 1.00 55.55 H new ATOM 0 HD13 LEU A 98 -5.121 2.431 -6.976 1.00 55.55 H new ATOM 0 HD21 LEU A 98 -3.595 0.802 -4.867 1.00 0.33 H new ATOM 0 HD22 LEU A 98 -3.104 2.425 -5.407 1.00 0.33 H new ATOM 0 HD23 LEU A 98 -3.359 2.102 -3.676 1.00 0.33 H new ATOM 1420 N LEU A 99 -7.510 3.802 -2.277 1.00 73.43 N ATOM 1421 CA LEU A 99 -8.309 3.128 -1.269 1.00 41.35 C ATOM 1422 C LEU A 99 -9.788 3.453 -1.495 1.00 42.13 C ATOM 1423 O LEU A 99 -10.628 2.569 -1.347 1.00 24.31 O ATOM 1424 CB LEU A 99 -7.764 3.438 0.137 1.00 31.24 C ATOM 1425 CG LEU A 99 -8.511 4.541 0.897 1.00 75.22 C ATOM 1426 CD1 LEU A 99 -9.681 3.952 1.677 1.00 11.53 C ATOM 1427 CD2 LEU A 99 -7.587 5.273 1.846 1.00 1.52 C ATOM 0 H LEU A 99 -6.856 4.487 -1.899 1.00 73.43 H new ATOM 0 HA LEU A 99 -8.233 2.044 -1.357 1.00 41.35 H new ATOM 0 HB2 LEU A 99 -7.795 2.525 0.731 1.00 31.24 H new ATOM 0 HB3 LEU A 99 -6.716 3.725 0.048 1.00 31.24 H new ATOM 0 HG LEU A 99 -8.888 5.252 0.162 1.00 75.22 H new ATOM 0 HD11 LEU A 99 -10.200 4.748 2.211 1.00 11.53 H new ATOM 0 HD12 LEU A 99 -10.371 3.468 0.987 1.00 11.53 H new ATOM 0 HD13 LEU A 99 -9.309 3.219 2.392 1.00 11.53 H new ATOM 0 HD21 LEU A 99 -8.145 6.049 2.371 1.00 1.52 H new ATOM 0 HD22 LEU A 99 -7.177 4.569 2.570 1.00 1.52 H new ATOM 0 HD23 LEU A 99 -6.773 5.729 1.282 1.00 1.52 H new ATOM 1438 N ASP A 100 -10.114 4.694 -1.885 1.00 55.44 N ATOM 1439 CA ASP A 100 -11.503 5.120 -2.020 1.00 0.14 C ATOM 1440 C ASP A 100 -12.213 4.284 -3.075 1.00 55.33 C ATOM 1441 O ASP A 100 -13.357 3.868 -2.899 1.00 41.15 O ATOM 1442 CB ASP A 100 -11.632 6.599 -2.399 1.00 2.22 C ATOM 1443 CG ASP A 100 -13.058 7.039 -2.074 1.00 13.31 C ATOM 1444 OD1 ASP A 100 -13.392 7.097 -0.866 1.00 53.33 O ATOM 1445 OD2 ASP A 100 -13.867 7.269 -3.000 1.00 3.44 O ATOM 0 H ASP A 100 -9.430 5.416 -2.111 1.00 55.44 H new ATOM 0 HA ASP A 100 -11.965 4.977 -1.043 1.00 0.14 H new ATOM 0 HB2 ASP A 100 -10.911 7.200 -1.845 1.00 2.22 H new ATOM 0 HB3 ASP A 100 -11.420 6.742 -3.458 1.00 2.22 H new ATOM 1449 N GLN A 101 -11.498 3.983 -4.154 1.00 20.22 N ATOM 1450 CA GLN A 101 -11.971 3.108 -5.205 1.00 22.32 C ATOM 1451 C GLN A 101 -12.128 1.680 -4.674 1.00 61.05 C ATOM 1452 O GLN A 101 -13.233 1.135 -4.704 1.00 14.44 O ATOM 1453 CB GLN A 101 -11.010 3.219 -6.397 1.00 62.01 C ATOM 1454 CG GLN A 101 -11.025 4.660 -6.939 1.00 33.33 C ATOM 1455 CD GLN A 101 -10.702 4.720 -8.420 1.00 55.21 C ATOM 1456 OE1 GLN A 101 -11.418 4.164 -9.247 1.00 64.13 O ATOM 1457 NE2 GLN A 101 -9.631 5.394 -8.801 1.00 22.04 N ATOM 0 H GLN A 101 -10.560 4.349 -4.319 1.00 20.22 H new ATOM 0 HA GLN A 101 -12.961 3.405 -5.550 1.00 22.32 H new ATOM 0 HB2 GLN A 101 -10.000 2.946 -6.090 1.00 62.01 H new ATOM 0 HB3 GLN A 101 -11.305 2.522 -7.181 1.00 62.01 H new ATOM 0 HG2 GLN A 101 -12.006 5.101 -6.765 1.00 33.33 H new ATOM 0 HG3 GLN A 101 -10.303 5.261 -6.387 1.00 33.33 H new ATOM 0 HE21 GLN A 101 -9.043 5.852 -8.105 1.00 22.04 H new ATOM 0 HE22 GLN A 101 -9.393 5.456 -9.791 1.00 22.04 H new ATOM 1464 N MET A 102 -11.043 1.087 -4.167 1.00 52.42 N ATOM 1465 CA MET A 102 -10.952 -0.339 -3.843 1.00 1.41 C ATOM 1466 C MET A 102 -11.673 -0.778 -2.554 1.00 13.51 C ATOM 1467 O MET A 102 -11.572 -1.951 -2.204 1.00 14.21 O ATOM 1468 CB MET A 102 -9.478 -0.778 -3.847 1.00 4.44 C ATOM 1469 CG MET A 102 -8.635 -0.218 -2.706 1.00 24.00 C ATOM 1470 SD MET A 102 -8.264 -1.345 -1.329 1.00 31.03 S ATOM 1471 CE MET A 102 -7.213 -2.574 -2.156 1.00 53.15 C ATOM 0 H MET A 102 -10.183 1.598 -3.966 1.00 52.42 H new ATOM 0 HA MET A 102 -11.502 -0.856 -4.629 1.00 1.41 H new ATOM 0 HB2 MET A 102 -9.439 -1.867 -3.807 1.00 4.44 H new ATOM 0 HB3 MET A 102 -9.028 -0.477 -4.793 1.00 4.44 H new ATOM 0 HG2 MET A 102 -7.690 0.132 -3.122 1.00 24.00 H new ATOM 0 HG3 MET A 102 -9.148 0.655 -2.302 1.00 24.00 H new ATOM 0 HE1 MET A 102 -6.693 -3.171 -1.407 1.00 53.15 H new ATOM 0 HE2 MET A 102 -7.832 -3.225 -2.774 1.00 53.15 H new ATOM 0 HE3 MET A 102 -6.482 -2.064 -2.784 1.00 53.15 H new ATOM 1479 N LYS A 103 -12.415 0.095 -1.850 1.00 22.33 N ATOM 1480 CA LYS A 103 -13.018 -0.159 -0.521 1.00 55.51 C ATOM 1481 C LYS A 103 -13.736 -1.496 -0.333 1.00 23.30 C ATOM 1482 O LYS A 103 -13.882 -1.945 0.805 1.00 15.10 O ATOM 1483 CB LYS A 103 -14.035 0.937 -0.161 1.00 23.02 C ATOM 1484 CG LYS A 103 -13.386 2.258 0.262 1.00 62.12 C ATOM 1485 CD LYS A 103 -14.208 2.946 1.357 1.00 1.24 C ATOM 1486 CE LYS A 103 -13.896 4.443 1.399 1.00 34.13 C ATOM 1487 NZ LYS A 103 -14.782 5.214 0.504 1.00 75.32 N ATOM 0 H LYS A 103 -12.621 1.031 -2.199 1.00 22.33 H new ATOM 0 HA LYS A 103 -12.144 -0.171 0.131 1.00 55.51 H new ATOM 0 HB2 LYS A 103 -14.682 1.118 -1.020 1.00 23.02 H new ATOM 0 HB3 LYS A 103 -14.672 0.579 0.648 1.00 23.02 H new ATOM 0 HG2 LYS A 103 -12.375 2.071 0.624 1.00 62.12 H new ATOM 0 HG3 LYS A 103 -13.299 2.918 -0.601 1.00 62.12 H new ATOM 0 HD2 LYS A 103 -15.271 2.795 1.171 1.00 1.24 H new ATOM 0 HD3 LYS A 103 -13.986 2.495 2.324 1.00 1.24 H new ATOM 0 HE2 LYS A 103 -14.004 4.808 2.420 1.00 34.13 H new ATOM 0 HE3 LYS A 103 -12.858 4.606 1.111 1.00 34.13 H new ATOM 0 HZ1 LYS A 103 -14.206 5.778 -0.153 1.00 75.32 H new ATOM 0 HZ2 LYS A 103 -15.384 4.560 -0.036 1.00 75.32 H new ATOM 0 HZ3 LYS A 103 -15.381 5.848 1.070 1.00 75.32 H new ATOM 1497 N ASN A 104 -14.240 -2.100 -1.405 1.00 42.24 N ATOM 1498 CA ASN A 104 -15.001 -3.350 -1.349 1.00 54.33 C ATOM 1499 C ASN A 104 -14.110 -4.577 -1.153 1.00 55.31 C ATOM 1500 O ASN A 104 -14.621 -5.670 -0.915 1.00 72.24 O ATOM 1501 CB ASN A 104 -15.903 -3.493 -2.583 1.00 54.45 C ATOM 1502 CG ASN A 104 -17.183 -2.717 -2.339 1.00 43.25 C ATOM 1503 OD1 ASN A 104 -18.221 -3.285 -2.021 1.00 60.12 O ATOM 1504 ND2 ASN A 104 -17.117 -1.397 -2.390 1.00 53.32 N ATOM 0 H ASN A 104 -14.132 -1.733 -2.350 1.00 42.24 H new ATOM 0 HA ASN A 104 -15.638 -3.298 -0.466 1.00 54.33 H new ATOM 0 HB2 ASN A 104 -15.394 -3.114 -3.469 1.00 54.45 H new ATOM 0 HB3 ASN A 104 -16.127 -4.544 -2.768 1.00 54.45 H new ATOM 0 HD21 ASN A 104 -17.938 -0.836 -2.163 1.00 53.32 H new ATOM 0 HD22 ASN A 104 -16.245 -0.940 -2.657 1.00 53.32 H new ATOM 1510 N TYR A 105 -12.791 -4.422 -1.239 1.00 71.45 N ATOM 1511 CA TYR A 105 -11.835 -5.471 -0.924 1.00 14.23 C ATOM 1512 C TYR A 105 -11.926 -5.866 0.548 1.00 4.44 C ATOM 1513 O TYR A 105 -11.920 -4.999 1.428 1.00 1.53 O ATOM 1514 CB TYR A 105 -10.428 -4.945 -1.239 1.00 64.13 C ATOM 1515 CG TYR A 105 -9.337 -5.950 -0.950 1.00 31.11 C ATOM 1516 CD1 TYR A 105 -9.156 -7.011 -1.845 1.00 21.03 C ATOM 1517 CD2 TYR A 105 -8.541 -5.862 0.210 1.00 75.33 C ATOM 1518 CE1 TYR A 105 -8.200 -7.999 -1.587 1.00 73.12 C ATOM 1519 CE2 TYR A 105 -7.576 -6.852 0.477 1.00 44.45 C ATOM 1520 CZ TYR A 105 -7.413 -7.931 -0.421 1.00 54.54 C ATOM 1521 OH TYR A 105 -6.491 -8.903 -0.198 1.00 42.21 O ATOM 0 H TYR A 105 -12.354 -3.549 -1.534 1.00 71.45 H new ATOM 0 HA TYR A 105 -12.054 -6.357 -1.520 1.00 14.23 H new ATOM 0 HB2 TYR A 105 -10.381 -4.660 -2.290 1.00 64.13 H new ATOM 0 HB3 TYR A 105 -10.246 -4.043 -0.655 1.00 64.13 H new ATOM 0 HD1 TYR A 105 -9.758 -7.067 -2.740 1.00 21.03 H new ATOM 0 HD2 TYR A 105 -8.671 -5.036 0.893 1.00 75.33 H new ATOM 0 HE1 TYR A 105 -8.065 -8.814 -2.282 1.00 73.12 H new ATOM 0 HE2 TYR A 105 -6.963 -6.787 1.364 1.00 44.45 H new ATOM 0 HH TYR A 105 -6.442 -9.093 0.762 1.00 42.21 H new ATOM 1530 N ARG A 106 -11.920 -7.167 0.841 1.00 31.21 N ATOM 1531 CA ARG A 106 -11.659 -7.677 2.183 1.00 2.41 C ATOM 1532 C ARG A 106 -10.313 -8.387 2.147 1.00 3.31 C ATOM 1533 O ARG A 106 -9.985 -9.026 1.148 1.00 51.15 O ATOM 1534 CB ARG A 106 -12.754 -8.661 2.619 1.00 4.40 C ATOM 1535 CG ARG A 106 -14.203 -8.163 2.448 1.00 72.43 C ATOM 1536 CD ARG A 106 -14.974 -8.351 3.765 1.00 64.33 C ATOM 1537 NE ARG A 106 -16.404 -8.049 3.627 1.00 0.21 N ATOM 1538 CZ ARG A 106 -17.272 -7.780 4.612 1.00 71.35 C ATOM 1539 NH1 ARG A 106 -16.867 -7.718 5.877 1.00 0.53 N ATOM 1540 NH2 ARG A 106 -18.555 -7.590 4.318 1.00 31.42 N ATOM 0 H ARG A 106 -12.097 -7.897 0.151 1.00 31.21 H new ATOM 0 HA ARG A 106 -11.651 -6.855 2.898 1.00 2.41 H new ATOM 0 HB2 ARG A 106 -12.636 -9.583 2.050 1.00 4.40 H new ATOM 0 HB3 ARG A 106 -12.596 -8.911 3.668 1.00 4.40 H new ATOM 0 HG2 ARG A 106 -14.205 -7.111 2.161 1.00 72.43 H new ATOM 0 HG3 ARG A 106 -14.695 -8.713 1.646 1.00 72.43 H new ATOM 0 HD2 ARG A 106 -14.854 -9.378 4.109 1.00 64.33 H new ATOM 0 HD3 ARG A 106 -14.542 -7.706 4.530 1.00 64.33 H new ATOM 0 HE ARG A 106 -16.778 -8.043 2.678 1.00 0.21 H new ATOM 0 HH11 ARG A 106 -15.886 -7.876 6.107 1.00 0.53 H new ATOM 0 HH12 ARG A 106 -17.537 -7.512 6.618 1.00 0.53 H new ATOM 0 HH21 ARG A 106 -18.871 -7.650 3.350 1.00 31.42 H new ATOM 0 HH22 ARG A 106 -19.223 -7.385 5.061 1.00 31.42 H new ATOM 1551 N GLY A 107 -9.547 -8.317 3.233 1.00 24.11 N ATOM 1552 CA GLY A 107 -8.283 -9.016 3.335 1.00 33.31 C ATOM 1553 C GLY A 107 -7.270 -8.198 4.106 1.00 33.03 C ATOM 1554 O GLY A 107 -7.634 -7.395 4.968 1.00 64.15 O ATOM 0 H GLY A 107 -9.790 -7.774 4.061 1.00 24.11 H new ATOM 0 HA2 GLY A 107 -8.433 -9.975 3.830 1.00 33.31 H new ATOM 0 HA3 GLY A 107 -7.900 -9.229 2.337 1.00 33.31 H new ATOM 1558 N GLU A 108 -5.999 -8.458 3.829 1.00 75.35 N ATOM 1559 CA GLU A 108 -4.877 -8.101 4.676 1.00 11.51 C ATOM 1560 C GLU A 108 -4.059 -6.999 3.998 1.00 64.41 C ATOM 1561 O GLU A 108 -3.467 -7.240 2.942 1.00 2.20 O ATOM 1562 CB GLU A 108 -4.068 -9.385 4.920 1.00 60.01 C ATOM 1563 CG GLU A 108 -4.845 -10.419 5.740 1.00 62.11 C ATOM 1564 CD GLU A 108 -4.002 -11.662 6.045 1.00 44.15 C ATOM 1565 OE1 GLU A 108 -3.841 -12.553 5.176 1.00 73.22 O ATOM 1566 OE2 GLU A 108 -3.542 -11.797 7.201 1.00 73.14 O ATOM 0 H GLU A 108 -5.715 -8.941 2.977 1.00 75.35 H new ATOM 0 HA GLU A 108 -5.195 -7.700 5.638 1.00 11.51 H new ATOM 0 HB2 GLU A 108 -3.788 -9.822 3.962 1.00 60.01 H new ATOM 0 HB3 GLU A 108 -3.143 -9.135 5.439 1.00 60.01 H new ATOM 0 HG2 GLU A 108 -5.175 -9.966 6.675 1.00 62.11 H new ATOM 0 HG3 GLU A 108 -5.742 -10.714 5.195 1.00 62.11 H new ATOM 1571 N VAL A 109 -4.039 -5.788 4.566 1.00 54.53 N ATOM 1572 CA VAL A 109 -3.491 -4.600 3.898 1.00 3.12 C ATOM 1573 C VAL A 109 -2.545 -3.818 4.824 1.00 15.11 C ATOM 1574 O VAL A 109 -2.976 -2.981 5.615 1.00 20.42 O ATOM 1575 CB VAL A 109 -4.625 -3.715 3.340 1.00 62.14 C ATOM 1576 CG1 VAL A 109 -4.047 -2.719 2.322 1.00 22.00 C ATOM 1577 CG2 VAL A 109 -5.740 -4.505 2.629 1.00 62.15 C ATOM 0 H VAL A 109 -4.402 -5.603 5.501 1.00 54.53 H new ATOM 0 HA VAL A 109 -2.891 -4.933 3.051 1.00 3.12 H new ATOM 0 HB VAL A 109 -5.064 -3.218 4.205 1.00 62.14 H new ATOM 0 HG11 VAL A 109 -4.849 -2.094 1.928 1.00 22.00 H new ATOM 0 HG12 VAL A 109 -3.303 -2.090 2.811 1.00 22.00 H new ATOM 0 HG13 VAL A 109 -3.578 -3.266 1.504 1.00 22.00 H new ATOM 0 HG21 VAL A 109 -6.500 -3.814 2.265 1.00 62.15 H new ATOM 0 HG22 VAL A 109 -5.317 -5.055 1.788 1.00 62.15 H new ATOM 0 HG23 VAL A 109 -6.193 -5.206 3.330 1.00 62.15 H new ATOM 1587 N ALA A 110 -1.252 -4.124 4.765 1.00 2.13 N ATOM 1588 CA ALA A 110 -0.217 -3.462 5.541 1.00 31.21 C ATOM 1589 C ALA A 110 0.245 -2.171 4.870 1.00 24.21 C ATOM 1590 O ALA A 110 0.200 -2.054 3.640 1.00 13.34 O ATOM 1591 CB ALA A 110 0.972 -4.401 5.681 1.00 1.50 C ATOM 0 H ALA A 110 -0.889 -4.860 4.159 1.00 2.13 H new ATOM 0 HA ALA A 110 -0.629 -3.210 6.518 1.00 31.21 H new ATOM 0 HB1 ALA A 110 1.755 -3.913 6.262 1.00 1.50 H new ATOM 0 HB2 ALA A 110 0.658 -5.313 6.189 1.00 1.50 H new ATOM 0 HB3 ALA A 110 1.357 -4.651 4.692 1.00 1.50 H new ATOM 1597 N SER A 111 0.754 -1.237 5.680 1.00 34.32 N ATOM 1598 CA SER A 111 1.111 0.113 5.268 1.00 55.31 C ATOM 1599 C SER A 111 2.549 0.443 5.704 1.00 44.23 C ATOM 1600 O SER A 111 2.918 0.314 6.878 1.00 14.44 O ATOM 1601 CB SER A 111 0.029 1.075 5.783 1.00 23.31 C ATOM 1602 OG SER A 111 -0.318 0.794 7.128 1.00 41.43 O ATOM 0 H SER A 111 0.932 -1.411 6.669 1.00 34.32 H new ATOM 0 HA SER A 111 1.129 0.217 4.183 1.00 55.31 H new ATOM 0 HB2 SER A 111 0.387 2.102 5.705 1.00 23.31 H new ATOM 0 HB3 SER A 111 -0.858 0.998 5.154 1.00 23.31 H new ATOM 0 HG SER A 111 -1.007 1.424 7.427 1.00 41.43 H new ATOM 1607 N PHE A 112 3.413 0.820 4.752 1.00 22.21 N ATOM 1608 CA PHE A 112 4.820 1.116 5.030 1.00 15.44 C ATOM 1609 C PHE A 112 5.340 2.296 4.221 1.00 3.10 C ATOM 1610 O PHE A 112 4.733 2.708 3.234 1.00 24.02 O ATOM 1611 CB PHE A 112 5.704 -0.129 4.856 1.00 3.41 C ATOM 1612 CG PHE A 112 5.724 -0.742 3.470 1.00 31.14 C ATOM 1613 CD1 PHE A 112 4.619 -1.488 3.016 1.00 0.34 C ATOM 1614 CD2 PHE A 112 6.864 -0.614 2.654 1.00 40.31 C ATOM 1615 CE1 PHE A 112 4.651 -2.098 1.755 1.00 63.01 C ATOM 1616 CE2 PHE A 112 6.892 -1.228 1.389 1.00 44.21 C ATOM 1617 CZ PHE A 112 5.790 -1.979 0.944 1.00 53.42 C ATOM 0 H PHE A 112 3.155 0.927 3.771 1.00 22.21 H new ATOM 0 HA PHE A 112 4.875 1.414 6.077 1.00 15.44 H new ATOM 0 HB2 PHE A 112 6.726 0.134 5.130 1.00 3.41 H new ATOM 0 HB3 PHE A 112 5.370 -0.889 5.563 1.00 3.41 H new ATOM 0 HD1 PHE A 112 3.745 -1.590 3.642 1.00 0.34 H new ATOM 0 HD2 PHE A 112 7.715 -0.046 2.999 1.00 40.31 H new ATOM 0 HE1 PHE A 112 3.798 -2.661 1.407 1.00 63.01 H new ATOM 0 HE2 PHE A 112 7.762 -1.122 0.758 1.00 44.21 H new ATOM 0 HZ PHE A 112 5.820 -2.464 -0.021 1.00 53.42 H new ATOM 1626 N PHE A 113 6.463 2.855 4.678 1.00 21.04 N ATOM 1627 CA PHE A 113 7.048 4.104 4.202 1.00 71.02 C ATOM 1628 C PHE A 113 8.565 4.060 4.453 1.00 3.13 C ATOM 1629 O PHE A 113 9.004 3.284 5.305 1.00 23.23 O ATOM 1630 CB PHE A 113 6.425 5.283 4.984 1.00 63.11 C ATOM 1631 CG PHE A 113 4.906 5.421 4.981 1.00 73.12 C ATOM 1632 CD1 PHE A 113 4.116 4.606 5.818 1.00 52.24 C ATOM 1633 CD2 PHE A 113 4.275 6.391 4.179 1.00 53.22 C ATOM 1634 CE1 PHE A 113 2.717 4.731 5.824 1.00 51.42 C ATOM 1635 CE2 PHE A 113 2.880 6.551 4.217 1.00 73.41 C ATOM 1636 CZ PHE A 113 2.103 5.711 5.030 1.00 24.24 C ATOM 0 H PHE A 113 7.012 2.427 5.424 1.00 21.04 H new ATOM 0 HA PHE A 113 6.853 4.234 3.138 1.00 71.02 H new ATOM 0 HB2 PHE A 113 6.751 5.205 6.021 1.00 63.11 H new ATOM 0 HB3 PHE A 113 6.845 6.207 4.586 1.00 63.11 H new ATOM 0 HD1 PHE A 113 4.591 3.879 6.460 1.00 52.24 H new ATOM 0 HD2 PHE A 113 4.868 7.017 3.529 1.00 53.22 H new ATOM 0 HE1 PHE A 113 2.117 4.075 6.437 1.00 51.42 H new ATOM 0 HE2 PHE A 113 2.407 7.318 3.622 1.00 73.41 H new ATOM 0 HZ PHE A 113 1.029 5.820 5.044 1.00 24.24 H new ATOM 1645 N THR A 114 9.374 4.945 3.864 1.00 51.13 N ATOM 1646 CA THR A 114 10.840 4.942 3.987 1.00 41.41 C ATOM 1647 C THR A 114 11.370 6.367 4.244 1.00 3.41 C ATOM 1648 O THR A 114 11.986 6.980 3.369 1.00 34.40 O ATOM 1649 CB THR A 114 11.462 4.282 2.737 1.00 72.02 C ATOM 1650 OG1 THR A 114 11.241 5.054 1.573 1.00 73.05 O ATOM 1651 CG2 THR A 114 10.902 2.885 2.466 1.00 12.40 C ATOM 0 H THR A 114 9.024 5.701 3.275 1.00 51.13 H new ATOM 0 HA THR A 114 11.138 4.348 4.851 1.00 41.41 H new ATOM 0 HB THR A 114 12.527 4.213 2.957 1.00 72.02 H new ATOM 0 HG1 THR A 114 11.462 5.991 1.755 1.00 73.05 H new ATOM 0 HG21 THR A 114 11.375 2.470 1.576 1.00 12.40 H new ATOM 0 HG22 THR A 114 11.106 2.239 3.320 1.00 12.40 H new ATOM 0 HG23 THR A 114 9.825 2.949 2.308 1.00 12.40 H new ATOM 1659 N SER A 115 11.050 6.937 5.407 1.00 31.04 N ATOM 1660 CA SER A 115 11.282 8.351 5.718 1.00 12.54 C ATOM 1661 C SER A 115 12.706 8.628 6.229 1.00 72.14 C ATOM 1662 O SER A 115 13.543 7.733 6.342 1.00 33.02 O ATOM 1663 CB SER A 115 10.251 8.842 6.744 1.00 0.54 C ATOM 1664 OG SER A 115 8.997 8.197 6.605 1.00 52.53 O ATOM 0 H SER A 115 10.615 6.422 6.173 1.00 31.04 H new ATOM 0 HA SER A 115 11.168 8.901 4.784 1.00 12.54 H new ATOM 0 HB2 SER A 115 10.634 8.671 7.750 1.00 0.54 H new ATOM 0 HB3 SER A 115 10.117 9.918 6.633 1.00 0.54 H new ATOM 0 HG SER A 115 8.376 8.541 7.280 1.00 52.53 H new ATOM 1669 N ALA A 116 12.958 9.889 6.590 1.00 22.11 N ATOM 1670 CA ALA A 116 14.239 10.468 6.957 1.00 51.23 C ATOM 1671 C ALA A 116 14.545 10.306 8.449 1.00 43.44 C ATOM 1672 O ALA A 116 15.373 11.043 8.986 1.00 61.34 O ATOM 1673 CB ALA A 116 14.180 11.956 6.594 1.00 34.31 C ATOM 0 H ALA A 116 12.209 10.580 6.634 1.00 22.11 H new ATOM 0 HA ALA A 116 15.036 9.952 6.421 1.00 51.23 H new ATOM 0 HB1 ALA A 116 15.126 12.432 6.854 1.00 34.31 H new ATOM 0 HB2 ALA A 116 14.002 12.063 5.524 1.00 34.31 H new ATOM 0 HB3 ALA A 116 13.370 12.433 7.146 1.00 34.31 H new ATOM 1679 N GLY A 117 13.840 9.426 9.162 1.00 44.51 N ATOM 1680 CA GLY A 117 14.137 9.162 10.560 1.00 24.14 C ATOM 1681 C GLY A 117 13.616 10.226 11.532 1.00 72.25 C ATOM 1682 O GLY A 117 13.930 10.170 12.726 1.00 5.50 O ATOM 0 H GLY A 117 13.059 8.886 8.788 1.00 44.51 H new ATOM 0 HA2 GLY A 117 13.709 8.198 10.833 1.00 24.14 H new ATOM 0 HA3 GLY A 117 15.217 9.077 10.679 1.00 24.14 H new ATOM 1686 N THR A 118 12.822 11.176 11.042 1.00 43.13 N ATOM 1687 CA THR A 118 12.103 12.172 11.820 1.00 22.20 C ATOM 1688 C THR A 118 10.611 12.107 11.453 1.00 55.14 C ATOM 1689 O THR A 118 10.241 11.440 10.481 1.00 2.11 O ATOM 1690 CB THR A 118 12.751 13.554 11.593 1.00 3.14 C ATOM 1691 OG1 THR A 118 13.034 13.820 10.230 1.00 51.33 O ATOM 1692 CG2 THR A 118 14.078 13.652 12.353 1.00 13.43 C ATOM 0 H THR A 118 12.657 11.273 10.040 1.00 43.13 H new ATOM 0 HA THR A 118 12.168 11.976 12.890 1.00 22.20 H new ATOM 0 HB THR A 118 12.022 14.281 11.953 1.00 3.14 H new ATOM 0 HG1 THR A 118 13.441 14.708 10.148 1.00 51.33 H new ATOM 0 HG21 THR A 118 14.523 14.632 12.183 1.00 13.43 H new ATOM 0 HG22 THR A 118 13.898 13.515 13.419 1.00 13.43 H new ATOM 0 HG23 THR A 118 14.759 12.878 11.998 1.00 13.43 H new ATOM 1700 N ASN A 119 9.743 12.765 12.231 1.00 13.34 N ATOM 1701 CA ASN A 119 8.287 12.837 12.036 1.00 41.21 C ATOM 1702 C ASN A 119 7.628 11.453 11.932 1.00 43.43 C ATOM 1703 O ASN A 119 6.663 11.248 11.192 1.00 63.22 O ATOM 1704 CB ASN A 119 7.937 13.755 10.851 1.00 43.53 C ATOM 1705 CG ASN A 119 8.243 15.209 11.164 1.00 72.34 C ATOM 1706 OD1 ASN A 119 7.598 15.813 12.018 1.00 43.31 O ATOM 1707 ND2 ASN A 119 9.196 15.823 10.488 1.00 52.33 N ATOM 0 H ASN A 119 10.049 13.287 13.052 1.00 13.34 H new ATOM 0 HA ASN A 119 7.862 13.287 12.933 1.00 41.21 H new ATOM 0 HB2 ASN A 119 8.500 13.445 9.971 1.00 43.53 H new ATOM 0 HB3 ASN A 119 6.880 13.649 10.607 1.00 43.53 H new ATOM 0 HD21 ASN A 119 9.401 16.805 10.673 1.00 52.33 H new ATOM 0 HD22 ASN A 119 9.727 15.316 9.781 1.00 52.33 H new ATOM 1713 N HIS A 120 8.167 10.464 12.648 1.00 3.24 N ATOM 1714 CA HIS A 120 7.715 9.091 12.541 1.00 13.51 C ATOM 1715 C HIS A 120 6.288 8.913 13.071 1.00 12.24 C ATOM 1716 O HIS A 120 5.467 8.262 12.432 1.00 34.33 O ATOM 1717 CB HIS A 120 8.717 8.155 13.238 1.00 42.44 C ATOM 1718 CG HIS A 120 8.994 8.455 14.694 1.00 3.11 C ATOM 1719 ND1 HIS A 120 9.851 9.413 15.167 1.00 72.21 N flip ATOM 1720 CD2 HIS A 120 8.490 7.776 15.784 1.00 30.11 C flip ATOM 1721 CE1 HIS A 120 9.841 9.339 16.564 1.00 11.10 C flip ATOM 1722 NE2 HIS A 120 8.999 8.343 16.889 1.00 71.11 N flip ATOM 0 H HIS A 120 8.927 10.600 13.315 1.00 3.24 H new ATOM 0 HA HIS A 120 7.676 8.822 11.485 1.00 13.51 H new ATOM 0 HB2 HIS A 120 8.345 7.133 13.161 1.00 42.44 H new ATOM 0 HB3 HIS A 120 9.660 8.192 12.693 1.00 42.44 H new ATOM 0 HD2 HIS A 120 7.808 6.939 15.754 1.00 30.11 H new ATOM 0 HE1 HIS A 120 10.400 9.961 17.248 1.00 11.10 H new ATOM 0 HE2 HIS A 120 8.778 8.058 17.843 1.00 71.11 H new ATOM 1729 N LYS A 121 5.949 9.475 14.232 1.00 75.22 N ATOM 1730 CA LYS A 121 4.628 9.241 14.817 1.00 22.14 C ATOM 1731 C LYS A 121 3.522 9.863 13.955 1.00 1.14 C ATOM 1732 O LYS A 121 2.433 9.292 13.856 1.00 11.12 O ATOM 1733 CB LYS A 121 4.630 9.736 16.275 1.00 13.52 C ATOM 1734 CG LYS A 121 4.032 8.709 17.241 1.00 3.34 C ATOM 1735 CD LYS A 121 2.503 8.692 17.267 1.00 33.10 C ATOM 1736 CE LYS A 121 2.042 7.657 18.297 1.00 34.20 C ATOM 1737 NZ LYS A 121 0.577 7.655 18.445 1.00 24.10 N ATOM 0 H LYS A 121 6.558 10.085 14.778 1.00 75.22 H new ATOM 0 HA LYS A 121 4.408 8.174 14.835 1.00 22.14 H new ATOM 0 HB2 LYS A 121 5.652 9.963 16.577 1.00 13.52 H new ATOM 0 HB3 LYS A 121 4.064 10.665 16.341 1.00 13.52 H new ATOM 0 HG2 LYS A 121 4.391 7.717 16.967 1.00 3.34 H new ATOM 0 HG3 LYS A 121 4.399 8.915 18.246 1.00 3.34 H new ATOM 0 HD2 LYS A 121 2.118 9.679 17.524 1.00 33.10 H new ATOM 0 HD3 LYS A 121 2.111 8.444 16.281 1.00 33.10 H new ATOM 0 HE2 LYS A 121 2.379 6.666 17.994 1.00 34.20 H new ATOM 0 HE3 LYS A 121 2.505 7.870 19.260 1.00 34.20 H new ATOM 0 HZ1 LYS A 121 0.300 6.942 19.150 1.00 24.10 H new ATOM 0 HZ2 LYS A 121 0.258 8.594 18.758 1.00 24.10 H new ATOM 0 HZ3 LYS A 121 0.136 7.427 17.531 1.00 24.10 H new ATOM 1747 N ALA A 122 3.822 10.978 13.281 1.00 63.14 N ATOM 1748 CA ALA A 122 2.924 11.659 12.363 1.00 43.41 C ATOM 1749 C ALA A 122 2.469 10.706 11.257 1.00 22.31 C ATOM 1750 O ALA A 122 1.273 10.633 10.985 1.00 35.33 O ATOM 1751 CB ALA A 122 3.604 12.915 11.789 1.00 21.10 C ATOM 0 H ALA A 122 4.727 11.440 13.367 1.00 63.14 H new ATOM 0 HA ALA A 122 2.035 11.981 12.905 1.00 43.41 H new ATOM 0 HB1 ALA A 122 2.922 13.417 11.103 1.00 21.10 H new ATOM 0 HB2 ALA A 122 3.863 13.592 12.603 1.00 21.10 H new ATOM 0 HB3 ALA A 122 4.509 12.627 11.255 1.00 21.10 H new ATOM 1757 N TYR A 123 3.392 9.957 10.640 1.00 20.13 N ATOM 1758 CA TYR A 123 3.069 9.114 9.486 1.00 74.31 C ATOM 1759 C TYR A 123 2.047 8.050 9.883 1.00 11.12 C ATOM 1760 O TYR A 123 1.063 7.831 9.174 1.00 20.22 O ATOM 1761 CB TYR A 123 4.348 8.517 8.852 1.00 32.13 C ATOM 1762 CG TYR A 123 4.812 7.123 9.228 1.00 1.32 C ATOM 1763 CD1 TYR A 123 4.119 5.977 8.796 1.00 21.00 C ATOM 1764 CD2 TYR A 123 6.019 6.973 9.921 1.00 41.22 C ATOM 1765 CE1 TYR A 123 4.619 4.698 9.098 1.00 24.43 C ATOM 1766 CE2 TYR A 123 6.509 5.710 10.273 1.00 53.23 C ATOM 1767 CZ TYR A 123 5.808 4.567 9.850 1.00 60.14 C ATOM 1768 OH TYR A 123 6.309 3.346 10.147 1.00 62.42 O ATOM 0 H TYR A 123 4.371 9.919 10.923 1.00 20.13 H new ATOM 0 HA TYR A 123 2.610 9.729 8.712 1.00 74.31 H new ATOM 0 HB2 TYR A 123 4.208 8.529 7.771 1.00 32.13 H new ATOM 0 HB3 TYR A 123 5.167 9.200 9.075 1.00 32.13 H new ATOM 0 HD1 TYR A 123 3.203 6.080 8.233 1.00 21.00 H new ATOM 0 HD2 TYR A 123 6.585 7.852 10.190 1.00 41.22 H new ATOM 0 HE1 TYR A 123 4.095 3.818 8.756 1.00 24.43 H new ATOM 0 HE2 TYR A 123 7.411 5.615 10.860 1.00 53.23 H new ATOM 0 HH TYR A 123 7.132 3.448 10.669 1.00 62.42 H new ATOM 1777 N VAL A 124 2.262 7.420 11.043 1.00 64.35 N ATOM 1778 CA VAL A 124 1.432 6.330 11.529 1.00 0.33 C ATOM 1779 C VAL A 124 0.011 6.857 11.788 1.00 63.05 C ATOM 1780 O VAL A 124 -0.954 6.190 11.429 1.00 35.30 O ATOM 1781 CB VAL A 124 2.081 5.675 12.770 1.00 31.33 C ATOM 1782 CG1 VAL A 124 1.330 4.415 13.234 1.00 55.31 C ATOM 1783 CG2 VAL A 124 3.537 5.251 12.504 1.00 32.14 C ATOM 0 H VAL A 124 3.028 7.661 11.672 1.00 64.35 H new ATOM 0 HA VAL A 124 1.354 5.543 10.779 1.00 0.33 H new ATOM 0 HB VAL A 124 2.038 6.443 13.542 1.00 31.33 H new ATOM 0 HG11 VAL A 124 1.828 3.996 14.108 1.00 55.31 H new ATOM 0 HG12 VAL A 124 0.304 4.677 13.492 1.00 55.31 H new ATOM 0 HG13 VAL A 124 1.325 3.678 12.431 1.00 55.31 H new ATOM 0 HG21 VAL A 124 3.953 4.796 13.403 1.00 32.14 H new ATOM 0 HG22 VAL A 124 3.563 4.530 11.687 1.00 32.14 H new ATOM 0 HG23 VAL A 124 4.127 6.127 12.234 1.00 32.14 H new ATOM 1793 N SER A 125 -0.144 8.060 12.355 1.00 43.53 N ATOM 1794 CA SER A 125 -1.464 8.670 12.514 1.00 0.32 C ATOM 1795 C SER A 125 -2.086 8.967 11.150 1.00 12.20 C ATOM 1796 O SER A 125 -3.251 8.629 10.909 1.00 71.15 O ATOM 1797 CB SER A 125 -1.321 9.964 13.331 1.00 63.04 C ATOM 1798 OG SER A 125 -2.539 10.678 13.417 1.00 11.23 O ATOM 0 H SER A 125 0.627 8.626 12.709 1.00 43.53 H new ATOM 0 HA SER A 125 -2.122 7.978 13.039 1.00 0.32 H new ATOM 0 HB2 SER A 125 -0.972 9.721 14.335 1.00 63.04 H new ATOM 0 HB3 SER A 125 -0.561 10.598 12.874 1.00 63.04 H new ATOM 0 HG SER A 125 -2.404 11.492 13.946 1.00 11.23 H new ATOM 1803 N HIS A 126 -1.340 9.659 10.288 1.00 51.24 N ATOM 1804 CA HIS A 126 -1.917 10.289 9.115 1.00 15.30 C ATOM 1805 C HIS A 126 -2.553 9.270 8.181 1.00 53.42 C ATOM 1806 O HIS A 126 -3.619 9.544 7.639 1.00 0.50 O ATOM 1807 CB HIS A 126 -0.856 11.093 8.366 1.00 23.11 C ATOM 1808 CG HIS A 126 -1.457 11.934 7.272 1.00 14.52 C ATOM 1809 ND1 HIS A 126 -1.971 11.487 6.073 1.00 62.41 N ATOM 1810 CD2 HIS A 126 -1.681 13.279 7.329 1.00 55.32 C ATOM 1811 CE1 HIS A 126 -2.495 12.537 5.425 1.00 63.32 C ATOM 1812 NE2 HIS A 126 -2.307 13.655 6.140 1.00 61.42 N ATOM 0 H HIS A 126 -0.334 9.794 10.386 1.00 51.24 H new ATOM 0 HA HIS A 126 -2.702 10.962 9.460 1.00 15.30 H new ATOM 0 HB2 HIS A 126 -0.325 11.736 9.068 1.00 23.11 H new ATOM 0 HB3 HIS A 126 -0.120 10.412 7.938 1.00 23.11 H new ATOM 0 HD2 HIS A 126 -1.421 13.934 8.147 1.00 55.32 H new ATOM 0 HE1 HIS A 126 -2.995 12.489 4.469 1.00 63.32 H new ATOM 0 HE2 HIS A 126 -2.571 14.601 5.867 1.00 61.42 H new ATOM 1819 N PHE A 127 -1.898 8.127 7.954 1.00 12.51 N ATOM 1820 CA PHE A 127 -2.499 7.077 7.147 1.00 24.30 C ATOM 1821 C PHE A 127 -3.857 6.701 7.737 1.00 54.45 C ATOM 1822 O PHE A 127 -4.844 6.916 7.052 1.00 72.02 O ATOM 1823 CB PHE A 127 -1.554 5.892 6.960 1.00 61.01 C ATOM 1824 CG PHE A 127 -2.046 4.848 5.970 1.00 41.21 C ATOM 1825 CD1 PHE A 127 -2.926 3.836 6.390 1.00 1.32 C ATOM 1826 CD2 PHE A 127 -1.598 4.850 4.636 1.00 0.40 C ATOM 1827 CE1 PHE A 127 -3.274 2.783 5.526 1.00 31.10 C ATOM 1828 CE2 PHE A 127 -1.950 3.801 3.769 1.00 0.31 C ATOM 1829 CZ PHE A 127 -2.764 2.750 4.219 1.00 74.43 C ATOM 0 H PHE A 127 -0.968 7.913 8.314 1.00 12.51 H new ATOM 0 HA PHE A 127 -2.676 7.447 6.137 1.00 24.30 H new ATOM 0 HB2 PHE A 127 -0.585 6.264 6.626 1.00 61.01 H new ATOM 0 HB3 PHE A 127 -1.395 5.413 7.926 1.00 61.01 H new ATOM 0 HD1 PHE A 127 -3.339 3.868 7.387 1.00 1.32 H new ATOM 0 HD2 PHE A 127 -0.981 5.661 4.277 1.00 0.40 H new ATOM 0 HE1 PHE A 127 -3.934 1.999 5.868 1.00 31.10 H new ATOM 0 HE2 PHE A 127 -1.592 3.804 2.750 1.00 0.31 H new ATOM 0 HZ PHE A 127 -2.996 1.923 3.565 1.00 74.43 H new ATOM 1838 N ASN A 128 -3.909 6.234 8.992 1.00 64.43 N ATOM 1839 CA ASN A 128 -5.111 5.737 9.673 1.00 42.33 C ATOM 1840 C ASN A 128 -6.324 6.652 9.468 1.00 35.13 C ATOM 1841 O ASN A 128 -7.347 6.201 8.964 1.00 51.34 O ATOM 1842 CB ASN A 128 -4.846 5.517 11.178 1.00 64.32 C ATOM 1843 CG ASN A 128 -4.138 4.203 11.508 1.00 12.22 C ATOM 1844 OD1 ASN A 128 -4.320 3.176 10.852 1.00 12.43 O ATOM 1845 ND2 ASN A 128 -3.232 4.221 12.478 1.00 4.50 N ATOM 0 H ASN A 128 -3.080 6.191 9.584 1.00 64.43 H new ATOM 0 HA ASN A 128 -5.352 4.777 9.216 1.00 42.33 H new ATOM 0 HB2 ASN A 128 -4.244 6.344 11.553 1.00 64.32 H new ATOM 0 HB3 ASN A 128 -5.797 5.547 11.710 1.00 64.32 H new ATOM 0 HD21 ASN A 128 -2.686 3.384 12.681 1.00 4.50 H new ATOM 0 HD22 ASN A 128 -3.082 5.072 13.020 1.00 4.50 H new ATOM 1851 N GLU A 129 -6.224 7.942 9.800 1.00 20.23 N ATOM 1852 CA GLU A 129 -7.349 8.881 9.672 1.00 23.02 C ATOM 1853 C GLU A 129 -7.861 8.991 8.231 1.00 1.12 C ATOM 1854 O GLU A 129 -9.065 9.123 7.998 1.00 55.13 O ATOM 1855 CB GLU A 129 -6.903 10.275 10.159 1.00 14.12 C ATOM 1856 CG GLU A 129 -7.238 10.547 11.629 1.00 75.45 C ATOM 1857 CD GLU A 129 -8.600 11.221 11.794 1.00 75.23 C ATOM 1858 OE1 GLU A 129 -9.635 10.554 11.570 1.00 24.13 O ATOM 1859 OE2 GLU A 129 -8.630 12.429 12.132 1.00 71.24 O ATOM 0 H GLU A 129 -5.370 8.365 10.162 1.00 20.23 H new ATOM 0 HA GLU A 129 -8.167 8.498 10.282 1.00 23.02 H new ATOM 0 HB2 GLU A 129 -5.827 10.374 10.016 1.00 14.12 H new ATOM 0 HB3 GLU A 129 -7.378 11.036 9.540 1.00 14.12 H new ATOM 0 HG2 GLU A 129 -7.230 9.608 12.182 1.00 75.45 H new ATOM 0 HG3 GLU A 129 -6.466 11.180 12.065 1.00 75.45 H new ATOM 1864 N TRP A 130 -6.945 8.926 7.268 1.00 32.10 N ATOM 1865 CA TRP A 130 -7.175 8.979 5.833 1.00 22.24 C ATOM 1866 C TRP A 130 -7.350 7.571 5.252 1.00 1.33 C ATOM 1867 O TRP A 130 -7.209 7.414 4.037 1.00 44.12 O ATOM 1868 CB TRP A 130 -5.975 9.700 5.196 1.00 42.23 C ATOM 1869 CG TRP A 130 -5.850 11.173 5.455 1.00 62.11 C ATOM 1870 CD1 TRP A 130 -5.671 11.779 6.651 1.00 42.55 C ATOM 1871 CD2 TRP A 130 -5.886 12.252 4.477 1.00 75.11 C ATOM 1872 NE1 TRP A 130 -5.601 13.147 6.476 1.00 44.33 N ATOM 1873 CE2 TRP A 130 -5.691 13.495 5.144 1.00 31.21 C ATOM 1874 CE3 TRP A 130 -6.045 12.294 3.080 1.00 63.24 C ATOM 1875 CZ2 TRP A 130 -5.621 14.712 4.447 1.00 12.53 C ATOM 1876 CZ3 TRP A 130 -6.031 13.511 2.379 1.00 31.31 C ATOM 1877 CH2 TRP A 130 -5.803 14.718 3.053 1.00 60.43 C ATOM 0 H TRP A 130 -5.954 8.828 7.489 1.00 32.10 H new ATOM 0 HA TRP A 130 -8.095 9.522 5.617 1.00 22.24 H new ATOM 0 HB2 TRP A 130 -5.064 9.216 5.547 1.00 42.23 H new ATOM 0 HB3 TRP A 130 -6.022 9.548 4.118 1.00 42.23 H new ATOM 0 HD1 TRP A 130 -5.594 11.270 7.600 1.00 42.55 H new ATOM 0 HE1 TRP A 130 -5.496 13.817 7.237 1.00 44.33 H new ATOM 0 HE3 TRP A 130 -6.181 11.371 2.535 1.00 63.24 H new ATOM 0 HZ2 TRP A 130 -5.429 15.634 4.976 1.00 12.53 H new ATOM 0 HZ3 TRP A 130 -6.197 13.516 1.312 1.00 31.31 H new ATOM 0 HH2 TRP A 130 -5.767 15.648 2.505 1.00 60.43 H new ATOM 1887 N ALA A 131 -7.593 6.538 6.067 1.00 23.20 N ATOM 1888 CA ALA A 131 -7.581 5.139 5.654 1.00 4.54 C ATOM 1889 C ALA A 131 -8.644 4.288 6.338 1.00 20.14 C ATOM 1890 O ALA A 131 -8.794 3.130 5.949 1.00 53.53 O ATOM 1891 CB ALA A 131 -6.202 4.544 5.943 1.00 74.43 C ATOM 0 H ALA A 131 -7.808 6.660 7.056 1.00 23.20 H new ATOM 0 HA ALA A 131 -7.808 5.126 4.588 1.00 4.54 H new ATOM 0 HB1 ALA A 131 -6.186 3.498 5.637 1.00 74.43 H new ATOM 0 HB2 ALA A 131 -5.444 5.097 5.388 1.00 74.43 H new ATOM 0 HB3 ALA A 131 -5.992 4.613 7.010 1.00 74.43 H new ATOM 1897 N ASP A 132 -9.355 4.818 7.334 1.00 73.43 N ATOM 1898 CA ASP A 132 -10.296 4.053 8.139 1.00 61.45 C ATOM 1899 C ASP A 132 -11.413 3.509 7.242 1.00 75.44 C ATOM 1900 O ASP A 132 -12.249 4.274 6.753 1.00 54.41 O ATOM 1901 CB ASP A 132 -10.845 4.910 9.280 1.00 23.12 C ATOM 1902 CG ASP A 132 -11.466 3.999 10.338 1.00 43.21 C ATOM 1903 OD1 ASP A 132 -12.450 3.284 10.029 1.00 24.43 O ATOM 1904 OD2 ASP A 132 -10.897 3.911 11.450 1.00 31.43 O ATOM 0 H ASP A 132 -9.290 5.800 7.604 1.00 73.43 H new ATOM 0 HA ASP A 132 -9.784 3.205 8.594 1.00 61.45 H new ATOM 0 HB2 ASP A 132 -10.046 5.506 9.720 1.00 23.12 H new ATOM 0 HB3 ASP A 132 -11.591 5.608 8.900 1.00 23.12 H new ATOM 1908 N GLY A 133 -11.364 2.218 6.923 1.00 44.53 N ATOM 1909 CA GLY A 133 -12.114 1.647 5.812 1.00 54.34 C ATOM 1910 C GLY A 133 -11.744 0.187 5.603 1.00 52.11 C ATOM 1911 O GLY A 133 -12.532 -0.697 5.944 1.00 51.35 O ATOM 0 H GLY A 133 -10.800 1.537 7.431 1.00 44.53 H new ATOM 0 HA2 GLY A 133 -13.183 1.731 6.008 1.00 54.34 H new ATOM 0 HA3 GLY A 133 -11.911 2.212 4.902 1.00 54.34 H new ATOM 1915 N LEU A 134 -10.540 -0.085 5.091 1.00 32.34 N ATOM 1916 CA LEU A 134 -10.023 -1.450 4.956 1.00 64.33 C ATOM 1917 C LEU A 134 -9.537 -1.958 6.326 1.00 55.42 C ATOM 1918 O LEU A 134 -9.632 -1.250 7.332 1.00 54.25 O ATOM 1919 CB LEU A 134 -8.905 -1.531 3.888 1.00 54.21 C ATOM 1920 CG LEU A 134 -9.284 -1.312 2.408 1.00 75.23 C ATOM 1921 CD1 LEU A 134 -10.377 -2.282 1.956 1.00 40.53 C ATOM 1922 CD2 LEU A 134 -9.672 0.127 2.045 1.00 0.12 C ATOM 0 H LEU A 134 -9.897 0.634 4.759 1.00 32.34 H new ATOM 0 HA LEU A 134 -10.830 -2.097 4.612 1.00 64.33 H new ATOM 0 HB2 LEU A 134 -8.144 -0.795 4.148 1.00 54.21 H new ATOM 0 HB3 LEU A 134 -8.439 -2.513 3.969 1.00 54.21 H new ATOM 0 HG LEU A 134 -8.363 -1.519 1.863 1.00 75.23 H new ATOM 0 HD11 LEU A 134 -10.617 -2.097 0.909 1.00 40.53 H new ATOM 0 HD12 LEU A 134 -10.025 -3.307 2.072 1.00 40.53 H new ATOM 0 HD13 LEU A 134 -11.269 -2.134 2.564 1.00 40.53 H new ATOM 0 HD21 LEU A 134 -9.921 0.180 0.985 1.00 0.12 H new ATOM 0 HD22 LEU A 134 -10.535 0.431 2.637 1.00 0.12 H new ATOM 0 HD23 LEU A 134 -8.835 0.793 2.255 1.00 0.12 H new ATOM 1933 N ASN A 135 -9.043 -3.197 6.372 1.00 75.21 N ATOM 1934 CA ASN A 135 -8.373 -3.812 7.518 1.00 63.01 C ATOM 1935 C ASN A 135 -6.860 -3.667 7.340 1.00 74.01 C ATOM 1936 O ASN A 135 -6.347 -3.892 6.242 1.00 73.34 O ATOM 1937 CB ASN A 135 -8.740 -5.305 7.591 1.00 44.21 C ATOM 1938 CG ASN A 135 -7.735 -6.118 8.415 1.00 2.11 C ATOM 1939 OD1 ASN A 135 -7.516 -5.892 9.607 1.00 35.44 O ATOM 1940 ND2 ASN A 135 -7.064 -7.063 7.778 1.00 43.53 N ATOM 0 H ASN A 135 -9.102 -3.828 5.573 1.00 75.21 H new ATOM 0 HA ASN A 135 -8.689 -3.321 8.438 1.00 63.01 H new ATOM 0 HB2 ASN A 135 -9.733 -5.411 8.028 1.00 44.21 H new ATOM 0 HB3 ASN A 135 -8.791 -5.713 6.581 1.00 44.21 H new ATOM 0 HD21 ASN A 135 -6.360 -7.610 8.273 1.00 43.53 H new ATOM 0 HD22 ASN A 135 -7.251 -7.244 6.792 1.00 43.53 H new ATOM 1946 N VAL A 136 -6.140 -3.365 8.418 1.00 60.01 N ATOM 1947 CA VAL A 136 -4.703 -3.140 8.430 1.00 21.10 C ATOM 1948 C VAL A 136 -4.035 -4.171 9.342 1.00 51.34 C ATOM 1949 O VAL A 136 -4.276 -4.162 10.550 1.00 41.32 O ATOM 1950 CB VAL A 136 -4.410 -1.689 8.872 1.00 1.51 C ATOM 1951 CG1 VAL A 136 -2.908 -1.433 9.073 1.00 2.21 C ATOM 1952 CG2 VAL A 136 -4.963 -0.670 7.864 1.00 73.45 C ATOM 0 H VAL A 136 -6.562 -3.267 9.342 1.00 60.01 H new ATOM 0 HA VAL A 136 -4.289 -3.267 7.430 1.00 21.10 H new ATOM 0 HB VAL A 136 -4.915 -1.560 9.829 1.00 1.51 H new ATOM 0 HG11 VAL A 136 -2.753 -0.400 9.383 1.00 2.21 H new ATOM 0 HG12 VAL A 136 -2.524 -2.104 9.842 1.00 2.21 H new ATOM 0 HG13 VAL A 136 -2.380 -1.614 8.137 1.00 2.21 H new ATOM 0 HG21 VAL A 136 -4.739 0.340 8.207 1.00 73.45 H new ATOM 0 HG22 VAL A 136 -4.501 -0.834 6.891 1.00 73.45 H new ATOM 0 HG23 VAL A 136 -6.043 -0.792 7.778 1.00 73.45 H new ATOM 1962 N ILE A 137 -3.166 -5.025 8.787 1.00 60.23 N ATOM 1963 CA ILE A 137 -2.441 -6.036 9.569 1.00 55.15 C ATOM 1964 C ILE A 137 -1.192 -5.496 10.293 1.00 2.10 C ATOM 1965 O ILE A 137 -0.606 -6.187 11.131 1.00 35.33 O ATOM 1966 CB ILE A 137 -2.103 -7.260 8.698 1.00 23.01 C ATOM 1967 CG1 ILE A 137 -1.220 -6.853 7.503 1.00 3.23 C ATOM 1968 CG2 ILE A 137 -3.394 -7.967 8.252 1.00 20.32 C ATOM 1969 CD1 ILE A 137 -0.584 -8.044 6.795 1.00 12.34 C ATOM 0 H ILE A 137 -2.946 -5.036 7.791 1.00 60.23 H new ATOM 0 HA ILE A 137 -3.120 -6.344 10.364 1.00 55.15 H new ATOM 0 HB ILE A 137 -1.527 -7.971 9.291 1.00 23.01 H new ATOM 0 HG12 ILE A 137 -1.823 -6.293 6.788 1.00 3.23 H new ATOM 0 HG13 ILE A 137 -0.434 -6.183 7.852 1.00 3.23 H new ATOM 0 HG21 ILE A 137 -3.142 -8.831 7.637 1.00 20.32 H new ATOM 0 HG22 ILE A 137 -3.950 -8.296 9.130 1.00 20.32 H new ATOM 0 HG23 ILE A 137 -4.006 -7.275 7.673 1.00 20.32 H new ATOM 0 HD11 ILE A 137 0.025 -7.690 5.963 1.00 12.34 H new ATOM 0 HD12 ILE A 137 0.044 -8.592 7.497 1.00 12.34 H new ATOM 0 HD13 ILE A 137 -1.366 -8.703 6.417 1.00 12.34 H new ATOM 1980 N GLY A 138 -0.762 -4.269 9.993 1.00 55.21 N ATOM 1981 CA GLY A 138 0.376 -3.646 10.645 1.00 42.22 C ATOM 1982 C GLY A 138 0.784 -2.391 9.896 1.00 62.21 C ATOM 1983 O GLY A 138 0.447 -2.238 8.722 1.00 64.22 O ATOM 0 H GLY A 138 -1.201 -3.681 9.285 1.00 55.21 H new ATOM 0 HA2 GLY A 138 0.123 -3.398 11.676 1.00 42.22 H new ATOM 0 HA3 GLY A 138 1.212 -4.345 10.681 1.00 42.22 H new ATOM 1987 N VAL A 139 1.538 -1.525 10.573 1.00 35.11 N ATOM 1988 CA VAL A 139 2.089 -0.294 10.025 1.00 1.52 C ATOM 1989 C VAL A 139 3.564 -0.315 10.394 1.00 20.11 C ATOM 1990 O VAL A 139 3.882 -0.496 11.575 1.00 4.52 O ATOM 1991 CB VAL A 139 1.366 0.950 10.594 1.00 23.14 C ATOM 1992 CG1 VAL A 139 1.733 2.198 9.780 1.00 55.14 C ATOM 1993 CG2 VAL A 139 -0.153 0.768 10.619 1.00 55.33 C ATOM 0 H VAL A 139 1.788 -1.670 11.551 1.00 35.11 H new ATOM 0 HA VAL A 139 1.953 -0.233 8.945 1.00 1.52 H new ATOM 0 HB VAL A 139 1.700 1.078 11.624 1.00 23.14 H new ATOM 0 HG11 VAL A 139 1.217 3.066 10.192 1.00 55.14 H new ATOM 0 HG12 VAL A 139 2.810 2.360 9.828 1.00 55.14 H new ATOM 0 HG13 VAL A 139 1.433 2.056 8.742 1.00 55.14 H new ATOM 0 HG21 VAL A 139 -0.620 1.665 11.026 1.00 55.33 H new ATOM 0 HG22 VAL A 139 -0.516 0.598 9.605 1.00 55.33 H new ATOM 0 HG23 VAL A 139 -0.407 -0.088 11.244 1.00 55.33 H new ATOM 2003 N ALA A 140 4.471 -0.196 9.430 1.00 75.05 N ATOM 2004 CA ALA A 140 5.914 -0.244 9.685 1.00 73.24 C ATOM 2005 C ALA A 140 6.651 0.745 8.796 1.00 75.31 C ATOM 2006 O ALA A 140 6.030 1.592 8.149 1.00 55.35 O ATOM 2007 CB ALA A 140 6.469 -1.661 9.507 1.00 21.14 C ATOM 0 H ALA A 140 4.230 -0.063 8.448 1.00 75.05 H new ATOM 0 HA ALA A 140 6.077 0.043 10.724 1.00 73.24 H new ATOM 0 HB1 ALA A 140 7.541 -1.659 9.704 1.00 21.14 H new ATOM 0 HB2 ALA A 140 5.973 -2.336 10.204 1.00 21.14 H new ATOM 0 HB3 ALA A 140 6.288 -1.997 8.486 1.00 21.14 H new ATOM 2013 N ARG A 141 7.979 0.704 8.809 1.00 40.42 N ATOM 2014 CA ARG A 141 8.807 1.364 7.819 1.00 32.33 C ATOM 2015 C ARG A 141 9.682 0.316 7.159 1.00 51.44 C ATOM 2016 O ARG A 141 9.855 -0.769 7.724 1.00 24.33 O ATOM 2017 CB ARG A 141 9.651 2.468 8.470 1.00 73.42 C ATOM 2018 CG ARG A 141 10.638 1.950 9.535 1.00 13.44 C ATOM 2019 CD ARG A 141 10.402 2.631 10.882 1.00 22.31 C ATOM 2020 NE ARG A 141 10.816 4.042 10.834 1.00 74.42 N ATOM 2021 CZ ARG A 141 10.858 4.907 11.848 1.00 13.12 C ATOM 2022 NH1 ARG A 141 10.416 4.578 13.055 1.00 43.15 N ATOM 2023 NH2 ARG A 141 11.340 6.122 11.643 1.00 34.23 N ATOM 0 H ARG A 141 8.513 0.203 9.519 1.00 40.42 H new ATOM 0 HA ARG A 141 8.183 1.843 7.065 1.00 32.33 H new ATOM 0 HB2 ARG A 141 10.210 2.991 7.694 1.00 73.42 H new ATOM 0 HB3 ARG A 141 8.985 3.198 8.930 1.00 73.42 H new ATOM 0 HG2 ARG A 141 10.526 0.871 9.645 1.00 13.44 H new ATOM 0 HG3 ARG A 141 11.661 2.132 9.206 1.00 13.44 H new ATOM 0 HD2 ARG A 141 9.347 2.566 11.148 1.00 22.31 H new ATOM 0 HD3 ARG A 141 10.959 2.110 11.661 1.00 22.31 H new ATOM 0 HE ARG A 141 11.103 4.399 9.923 1.00 74.42 H new ATOM 0 HH11 ARG A 141 10.034 3.647 13.222 1.00 43.15 H new ATOM 0 HH12 ARG A 141 10.458 5.256 13.816 1.00 43.15 H new ATOM 0 HH21 ARG A 141 11.674 6.388 10.717 1.00 34.23 H new ATOM 0 HH22 ARG A 141 11.377 6.792 12.411 1.00 34.23 H new ATOM 2034 N ASP A 142 10.290 0.716 6.045 1.00 61.02 N ATOM 2035 CA ASP A 142 11.324 -0.047 5.366 1.00 22.20 C ATOM 2036 C ASP A 142 10.804 -1.451 5.068 1.00 2.11 C ATOM 2037 O ASP A 142 9.604 -1.643 4.864 1.00 43.43 O ATOM 2038 CB ASP A 142 12.645 -0.016 6.156 1.00 75.33 C ATOM 2039 CG ASP A 142 13.142 1.383 6.511 1.00 3.43 C ATOM 2040 OD1 ASP A 142 12.922 2.367 5.771 1.00 54.33 O ATOM 2041 OD2 ASP A 142 13.837 1.495 7.545 1.00 24.33 O ATOM 0 H ASP A 142 10.070 1.598 5.583 1.00 61.02 H new ATOM 0 HA ASP A 142 11.561 0.411 4.406 1.00 22.20 H new ATOM 0 HB2 ASP A 142 12.516 -0.586 7.076 1.00 75.33 H new ATOM 0 HB3 ASP A 142 13.414 -0.523 5.573 1.00 75.33 H new ATOM 2045 N ASP A 143 11.711 -2.411 4.955 1.00 11.53 N ATOM 2046 CA ASP A 143 11.490 -3.830 4.715 1.00 31.04 C ATOM 2047 C ASP A 143 11.693 -4.648 5.998 1.00 34.01 C ATOM 2048 O ASP A 143 12.174 -5.780 5.948 1.00 72.25 O ATOM 2049 CB ASP A 143 12.403 -4.291 3.571 1.00 40.51 C ATOM 2050 CG ASP A 143 13.902 -4.183 3.829 1.00 51.52 C ATOM 2051 OD1 ASP A 143 14.330 -3.348 4.655 1.00 1.10 O ATOM 2052 OD2 ASP A 143 14.665 -4.820 3.066 1.00 43.01 O ATOM 0 H ASP A 143 12.705 -2.199 5.036 1.00 11.53 H new ATOM 0 HA ASP A 143 10.455 -3.996 4.415 1.00 31.04 H new ATOM 0 HB2 ASP A 143 12.168 -5.330 3.341 1.00 40.51 H new ATOM 0 HB3 ASP A 143 12.164 -3.706 2.683 1.00 40.51 H new ATOM 2056 N SER A 144 11.337 -4.092 7.158 1.00 74.13 N ATOM 2057 CA SER A 144 11.471 -4.695 8.467 1.00 64.03 C ATOM 2058 C SER A 144 10.314 -5.591 8.925 1.00 42.44 C ATOM 2059 O SER A 144 10.514 -6.351 9.871 1.00 71.42 O ATOM 2060 CB SER A 144 11.701 -3.555 9.458 1.00 35.04 C ATOM 2061 OG SER A 144 12.684 -2.654 8.983 1.00 43.33 O ATOM 0 H SER A 144 10.927 -3.159 7.201 1.00 74.13 H new ATOM 0 HA SER A 144 12.309 -5.391 8.415 1.00 64.03 H new ATOM 0 HB2 SER A 144 10.766 -3.021 9.626 1.00 35.04 H new ATOM 0 HB3 SER A 144 12.012 -3.963 10.420 1.00 35.04 H new ATOM 0 HG SER A 144 12.810 -1.934 9.635 1.00 43.33 H new ATOM 2066 N GLU A 145 9.124 -5.541 8.310 1.00 33.00 N ATOM 2067 CA GLU A 145 7.964 -6.333 8.763 1.00 74.01 C ATOM 2068 C GLU A 145 7.394 -7.221 7.646 1.00 31.43 C ATOM 2069 O GLU A 145 6.288 -7.733 7.775 1.00 72.43 O ATOM 2070 CB GLU A 145 6.905 -5.472 9.506 1.00 23.23 C ATOM 2071 CG GLU A 145 7.490 -4.803 10.769 1.00 43.42 C ATOM 2072 CD GLU A 145 6.489 -4.101 11.705 1.00 64.21 C ATOM 2073 OE1 GLU A 145 5.263 -4.357 11.656 1.00 23.44 O ATOM 2074 OE2 GLU A 145 6.939 -3.258 12.525 1.00 72.42 O ATOM 0 H GLU A 145 8.936 -4.959 7.494 1.00 33.00 H new ATOM 0 HA GLU A 145 8.326 -7.030 9.519 1.00 74.01 H new ATOM 0 HB2 GLU A 145 6.524 -4.705 8.832 1.00 23.23 H new ATOM 0 HB3 GLU A 145 6.059 -6.099 9.786 1.00 23.23 H new ATOM 0 HG2 GLU A 145 8.018 -5.564 11.344 1.00 43.42 H new ATOM 0 HG3 GLU A 145 8.232 -4.070 10.453 1.00 43.42 H new ATOM 2079 N VAL A 146 8.147 -7.473 6.571 1.00 72.15 N ATOM 2080 CA VAL A 146 7.715 -8.382 5.505 1.00 22.02 C ATOM 2081 C VAL A 146 7.405 -9.767 6.074 1.00 12.32 C ATOM 2082 O VAL A 146 6.426 -10.398 5.684 1.00 35.03 O ATOM 2083 CB VAL A 146 8.789 -8.509 4.403 1.00 62.31 C ATOM 2084 CG1 VAL A 146 8.155 -9.033 3.114 1.00 52.31 C ATOM 2085 CG2 VAL A 146 9.547 -7.205 4.104 1.00 52.55 C ATOM 0 H VAL A 146 9.065 -7.057 6.416 1.00 72.15 H new ATOM 0 HA VAL A 146 6.812 -7.960 5.063 1.00 22.02 H new ATOM 0 HB VAL A 146 9.527 -9.212 4.790 1.00 62.31 H new ATOM 0 HG11 VAL A 146 8.919 -9.120 2.342 1.00 52.31 H new ATOM 0 HG12 VAL A 146 7.712 -10.012 3.298 1.00 52.31 H new ATOM 0 HG13 VAL A 146 7.381 -8.341 2.782 1.00 52.31 H new ATOM 0 HG21 VAL A 146 10.282 -7.383 3.319 1.00 52.55 H new ATOM 0 HG22 VAL A 146 8.842 -6.442 3.775 1.00 52.55 H new ATOM 0 HG23 VAL A 146 10.055 -6.865 5.006 1.00 52.55 H new ATOM 2095 N ASP A 147 8.197 -10.202 7.053 1.00 75.03 N ATOM 2096 CA ASP A 147 8.117 -11.527 7.647 1.00 75.01 C ATOM 2097 C ASP A 147 6.772 -11.761 8.310 1.00 62.44 C ATOM 2098 O ASP A 147 6.342 -12.903 8.406 1.00 62.32 O ATOM 2099 CB ASP A 147 9.221 -11.721 8.694 1.00 15.31 C ATOM 2100 CG ASP A 147 10.365 -12.546 8.135 1.00 34.04 C ATOM 2101 OD1 ASP A 147 11.193 -11.988 7.381 1.00 15.20 O ATOM 2102 OD2 ASP A 147 10.470 -13.735 8.505 1.00 43.33 O ATOM 0 H ASP A 147 8.930 -9.624 7.463 1.00 75.03 H new ATOM 0 HA ASP A 147 8.244 -12.245 6.837 1.00 75.01 H new ATOM 0 HB2 ASP A 147 9.594 -10.749 9.018 1.00 15.31 H new ATOM 0 HB3 ASP A 147 8.809 -12.214 9.574 1.00 15.31 H new ATOM 2106 N LYS A 148 6.086 -10.712 8.771 1.00 44.12 N ATOM 2107 CA LYS A 148 4.743 -10.893 9.317 1.00 64.02 C ATOM 2108 C LYS A 148 3.697 -10.694 8.232 1.00 1.33 C ATOM 2109 O LYS A 148 2.629 -11.295 8.331 1.00 41.23 O ATOM 2110 CB LYS A 148 4.496 -9.998 10.538 1.00 54.31 C ATOM 2111 CG LYS A 148 4.763 -8.519 10.265 1.00 24.00 C ATOM 2112 CD LYS A 148 3.994 -7.547 11.153 1.00 61.43 C ATOM 2113 CE LYS A 148 4.528 -7.509 12.575 1.00 1.44 C ATOM 2114 NZ LYS A 148 4.077 -6.296 13.273 1.00 20.00 N ATOM 0 H LYS A 148 6.429 -9.752 8.777 1.00 44.12 H new ATOM 0 HA LYS A 148 4.657 -11.919 9.674 1.00 64.02 H new ATOM 0 HB2 LYS A 148 3.464 -10.119 10.866 1.00 54.31 H new ATOM 0 HB3 LYS A 148 5.133 -10.330 11.358 1.00 54.31 H new ATOM 0 HG2 LYS A 148 5.830 -8.330 10.385 1.00 24.00 H new ATOM 0 HG3 LYS A 148 4.517 -8.308 9.224 1.00 24.00 H new ATOM 0 HD2 LYS A 148 4.047 -6.547 10.722 1.00 61.43 H new ATOM 0 HD3 LYS A 148 2.942 -7.831 11.171 1.00 61.43 H new ATOM 0 HE2 LYS A 148 4.191 -8.392 13.118 1.00 1.44 H new ATOM 0 HE3 LYS A 148 5.617 -7.541 12.560 1.00 1.44 H new ATOM 0 HZ1 LYS A 148 4.496 -6.267 14.225 1.00 20.00 H new ATOM 0 HZ2 LYS A 148 4.376 -5.456 12.738 1.00 20.00 H new ATOM 0 HZ3 LYS A 148 3.040 -6.306 13.351 1.00 20.00 H new ATOM 2124 N TRP A 149 3.957 -9.887 7.200 1.00 34.44 N ATOM 2125 CA TRP A 149 2.971 -9.621 6.159 1.00 11.52 C ATOM 2126 C TRP A 149 3.064 -10.653 5.035 1.00 41.44 C ATOM 2127 O TRP A 149 2.676 -10.369 3.905 1.00 52.32 O ATOM 2128 CB TRP A 149 3.109 -8.203 5.616 1.00 0.24 C ATOM 2129 CG TRP A 149 3.098 -7.130 6.661 1.00 74.35 C ATOM 2130 CD1 TRP A 149 2.508 -7.219 7.874 1.00 33.13 C ATOM 2131 CD2 TRP A 149 3.691 -5.802 6.609 1.00 44.53 C ATOM 2132 NE1 TRP A 149 2.749 -6.072 8.586 1.00 60.15 N ATOM 2133 CE2 TRP A 149 3.471 -5.160 7.862 1.00 64.44 C ATOM 2134 CE3 TRP A 149 4.364 -5.059 5.623 1.00 43.45 C ATOM 2135 CZ2 TRP A 149 3.921 -3.864 8.142 1.00 73.02 C ATOM 2136 CZ3 TRP A 149 4.776 -3.739 5.871 1.00 60.43 C ATOM 2137 CH2 TRP A 149 4.545 -3.137 7.119 1.00 20.13 C ATOM 0 H TRP A 149 4.847 -9.407 7.066 1.00 34.44 H new ATOM 0 HA TRP A 149 1.982 -9.708 6.610 1.00 11.52 H new ATOM 0 HB2 TRP A 149 4.039 -8.133 5.052 1.00 0.24 H new ATOM 0 HB3 TRP A 149 2.296 -8.016 4.914 1.00 0.24 H new ATOM 0 HD1 TRP A 149 1.935 -8.063 8.228 1.00 33.13 H new ATOM 0 HE1 TRP A 149 2.429 -5.916 9.542 1.00 60.15 H new ATOM 0 HE3 TRP A 149 4.567 -5.509 4.662 1.00 43.45 H new ATOM 0 HZ2 TRP A 149 3.790 -3.434 9.124 1.00 73.02 H new ATOM 0 HZ3 TRP A 149 5.276 -3.181 5.093 1.00 60.43 H new ATOM 0 HH2 TRP A 149 4.848 -2.115 7.290 1.00 20.13 H new ATOM 2147 N SER A 150 3.635 -11.829 5.293 1.00 51.14 N ATOM 2148 CA SER A 150 3.825 -12.852 4.280 1.00 0.23 C ATOM 2149 C SER A 150 3.831 -14.260 4.901 1.00 61.15 C ATOM 2150 O SER A 150 4.326 -15.197 4.270 1.00 3.11 O ATOM 2151 CB SER A 150 5.106 -12.501 3.506 1.00 24.43 C ATOM 2152 OG SER A 150 4.983 -12.880 2.146 1.00 24.13 O ATOM 0 H SER A 150 3.978 -12.095 6.216 1.00 51.14 H new ATOM 0 HA SER A 150 2.993 -12.873 3.576 1.00 0.23 H new ATOM 0 HB2 SER A 150 5.298 -11.430 3.575 1.00 24.43 H new ATOM 0 HB3 SER A 150 5.960 -13.008 3.955 1.00 24.43 H new ATOM 0 HG SER A 150 4.710 -13.820 2.092 1.00 24.13 H new ATOM 2157 N LYS A 151 3.298 -14.412 6.120 1.00 62.21 N ATOM 2158 CA LYS A 151 3.104 -15.687 6.801 1.00 61.15 C ATOM 2159 C LYS A 151 1.660 -16.079 6.621 1.00 35.44 C ATOM 2160 O LYS A 151 1.401 -17.069 5.910 1.00 33.14 O ATOM 2161 CB LYS A 151 3.488 -15.583 8.281 1.00 71.05 C ATOM 2162 CG LYS A 151 5.000 -15.777 8.440 1.00 33.02 C ATOM 2163 CD LYS A 151 5.499 -15.546 9.875 1.00 63.05 C ATOM 2164 CE LYS A 151 7.032 -15.500 9.840 1.00 3.20 C ATOM 2165 NZ LYS A 151 7.664 -15.738 11.150 1.00 21.44 N ATOM 0 H LYS A 151 2.980 -13.617 6.675 1.00 62.21 H new ATOM 0 HA LYS A 151 3.750 -16.454 6.374 1.00 61.15 H new ATOM 0 HB2 LYS A 151 3.194 -14.610 8.675 1.00 71.05 H new ATOM 0 HB3 LYS A 151 2.953 -16.336 8.859 1.00 71.05 H new ATOM 0 HG2 LYS A 151 5.263 -16.788 8.130 1.00 33.02 H new ATOM 0 HG3 LYS A 151 5.519 -15.093 7.769 1.00 33.02 H new ATOM 0 HD2 LYS A 151 5.098 -14.614 10.273 1.00 63.05 H new ATOM 0 HD3 LYS A 151 5.156 -16.346 10.531 1.00 63.05 H new ATOM 0 HE2 LYS A 151 7.393 -16.246 9.132 1.00 3.20 H new ATOM 0 HE3 LYS A 151 7.349 -14.526 9.466 1.00 3.20 H new ATOM 0 HZ1 LYS A 151 8.698 -15.692 11.050 1.00 21.44 H new ATOM 0 HZ2 LYS A 151 7.349 -15.012 11.825 1.00 21.44 H new ATOM 0 HZ3 LYS A 151 7.392 -16.678 11.501 1.00 21.44 H new