USER MOD reduce.3.24.130724 H: found=0, std=0, add=1126, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1122 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 65 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 108 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 27 THR OG1 : rot 130:sc= 0.196 USER MOD Set 2.2: A 59 ASN : amide:sc= -1.62 K(o=-1.4,f=-3.2!) USER MOD Set 3.1: A 7 SER OG : rot -87:sc= 0.666 USER MOD Set 3.2: A 18 SER OG : rot -160:sc= 0.382 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 149:sc= -0.0989 (180deg=-0.602) USER MOD Single : A 4 HIS : no HD1:sc= -0.0119 X(o=-0.012,f=-0.14) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.0884 USER MOD Single : A 8 THR OG1 : rot 70:sc= 0.517 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot -50:sc= 0.886 USER MOD Single : A 14 ASN : amide:sc= -0.206 X(o=-0.21,f=-0.56) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ -179:sc= 0.0121 (180deg=0.012) USER MOD Single : A 34 SER OG : rot -74:sc= 1.34 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0244) USER MOD Single : A 51 GLN : amide:sc= -0.727 K(o=-0.73,f=-2!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -67:sc= -2.38! USER MOD Single : A 70 HIS : no HD1:sc=-0.00105 X(o=-0.0011,f=-0.12) USER MOD Single : A 72 LYS NZ :NH3+ 152:sc= -2.67 (180deg=-3.49!) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= 1.04 K(o=1,f=-3.4!) USER MOD Single : A 79 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0365) USER MOD Single : A 81 TYR OH : rot 143:sc= -0.441 USER MOD Single : A 85 ASN : amide:sc=-0.000607 X(o=-0.00061,f=0) USER MOD Single : A 86 TYR OH : rot 180:sc= -0.0142 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.0769 USER MOD Single : A 95 ASN : amide:sc= -1.09 K(o=-1.1,f=-0.54) USER MOD Single : A 98 THR OG1 : rot 101:sc= 1.35 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 SER OG : rot 89:sc= 0.822 USER MOD Single : A 104 ASN : amide:sc= -0.562 X(o=-0.56,f=-0.73) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 95:sc= -0.604! USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 GLN : amide:sc=-0.000921 K(o=-0.00092,f=-1.9) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot -109:sc= 0.359 USER MOD Single : A 129 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 GLN : amide:sc= -0.397 K(o=-0.4,f=-1.9) USER MOD Single : A 141 ASN : amide:sc= -0.0825 X(o=-0.083,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.880 0.372 8.141 1.00 62.11 N ATOM 2 CA MET A 1 -1.570 0.632 6.883 1.00 42.32 C ATOM 3 C MET A 1 -1.378 2.082 6.448 1.00 73.44 C ATOM 4 O MET A 1 -2.260 2.675 5.826 1.00 45.14 O ATOM 5 CB MET A 1 -3.062 0.322 7.021 1.00 65.11 C ATOM 6 CG MET A 1 -3.703 -0.162 5.731 1.00 74.50 C ATOM 7 SD MET A 1 -5.370 0.486 5.498 1.00 22.33 S ATOM 8 CE MET A 1 -6.334 -1.021 5.585 1.00 73.02 C ATOM 0 H1 MET A 1 -1.396 -0.356 8.676 1.00 62.11 H new ATOM 0 H2 MET A 1 0.085 0.039 7.945 1.00 62.11 H new ATOM 0 H3 MET A 1 -0.837 1.247 8.701 1.00 62.11 H new ATOM 0 HA MET A 1 -1.141 -0.018 6.121 1.00 42.32 H new ATOM 0 HB2 MET A 1 -3.197 -0.437 7.792 1.00 65.11 H new ATOM 0 HB3 MET A 1 -3.581 1.218 7.361 1.00 65.11 H new ATOM 0 HG2 MET A 1 -3.081 0.135 4.887 1.00 74.50 H new ATOM 0 HG3 MET A 1 -3.738 -1.251 5.734 1.00 74.50 H new ATOM 0 HE1 MET A 1 -7.391 -0.785 5.458 1.00 73.02 H new ATOM 0 HE2 MET A 1 -6.017 -1.702 4.795 1.00 73.02 H new ATOM 0 HE3 MET A 1 -6.182 -1.495 6.555 1.00 73.02 H new ATOM 18 N VAL A 2 -0.221 2.647 6.779 1.00 75.52 N ATOM 19 CA VAL A 2 0.086 4.026 6.421 1.00 14.33 C ATOM 20 C VAL A 2 1.580 4.214 6.187 1.00 24.43 C ATOM 21 O VAL A 2 2.281 4.855 6.971 1.00 40.15 O ATOM 22 CB VAL A 2 -0.378 5.006 7.515 1.00 14.13 C ATOM 23 CG1 VAL A 2 -1.892 5.153 7.494 1.00 52.13 C ATOM 24 CG2 VAL A 2 0.101 4.543 8.883 1.00 41.22 C ATOM 0 H VAL A 2 0.519 2.170 7.295 1.00 75.52 H new ATOM 0 HA VAL A 2 -0.453 4.241 5.498 1.00 14.33 H new ATOM 0 HB VAL A 2 0.061 5.983 7.312 1.00 14.13 H new ATOM 0 HG11 VAL A 2 -2.201 5.849 8.274 1.00 52.13 H new ATOM 0 HG12 VAL A 2 -2.207 5.533 6.522 1.00 52.13 H new ATOM 0 HG13 VAL A 2 -2.354 4.182 7.671 1.00 52.13 H new ATOM 0 HG21 VAL A 2 -0.236 5.247 9.644 1.00 41.22 H new ATOM 0 HG22 VAL A 2 -0.307 3.555 9.096 1.00 41.22 H new ATOM 0 HG23 VAL A 2 1.190 4.495 8.890 1.00 41.22 H new ATOM 34 N PRO A 3 2.083 3.641 5.083 1.00 13.31 N ATOM 35 CA PRO A 3 3.500 3.732 4.719 1.00 12.02 C ATOM 36 C PRO A 3 3.899 5.140 4.290 1.00 60.33 C ATOM 37 O PRO A 3 5.068 5.518 4.376 1.00 13.14 O ATOM 38 CB PRO A 3 3.628 2.758 3.545 1.00 15.30 C ATOM 39 CG PRO A 3 2.261 2.695 2.955 1.00 31.43 C ATOM 40 CD PRO A 3 1.306 2.862 4.105 1.00 72.14 C ATOM 0 HA PRO A 3 4.153 3.496 5.559 1.00 12.02 H new ATOM 0 HB2 PRO A 3 4.358 3.110 2.816 1.00 15.30 H new ATOM 0 HB3 PRO A 3 3.960 1.775 3.880 1.00 15.30 H new ATOM 0 HG2 PRO A 3 2.120 3.481 2.213 1.00 31.43 H new ATOM 0 HG3 PRO A 3 2.098 1.744 2.447 1.00 31.43 H new ATOM 0 HD2 PRO A 3 0.400 3.387 3.802 1.00 72.14 H new ATOM 0 HD3 PRO A 3 0.996 1.900 4.513 1.00 72.14 H new ATOM 48 N HIS A 4 2.921 5.912 3.827 1.00 61.14 N ATOM 49 CA HIS A 4 3.171 7.279 3.385 1.00 41.25 C ATOM 50 C HIS A 4 3.918 8.068 4.455 1.00 3.44 C ATOM 51 O HIS A 4 4.855 8.810 4.156 1.00 61.42 O ATOM 52 CB HIS A 4 1.853 7.977 3.046 1.00 4.25 C ATOM 53 CG HIS A 4 1.721 8.337 1.599 1.00 55.23 C ATOM 54 ND1 HIS A 4 1.973 7.447 0.576 1.00 54.52 N ATOM 55 CD2 HIS A 4 1.358 9.498 1.005 1.00 52.12 C ATOM 56 CE1 HIS A 4 1.772 8.046 -0.585 1.00 3.13 C ATOM 57 NE2 HIS A 4 1.398 9.291 -0.352 1.00 41.32 N ATOM 0 H HIS A 4 1.949 5.614 3.748 1.00 61.14 H new ATOM 0 HA HIS A 4 3.792 7.237 2.490 1.00 41.25 H new ATOM 0 HB2 HIS A 4 1.024 7.327 3.327 1.00 4.25 H new ATOM 0 HB3 HIS A 4 1.766 8.882 3.647 1.00 4.25 H new ATOM 0 HD2 HIS A 4 1.087 10.416 1.505 1.00 52.12 H new ATOM 0 HE1 HIS A 4 1.893 7.594 -1.558 1.00 3.13 H new ATOM 0 HE2 HIS A 4 1.175 9.986 -1.064 1.00 41.32 H new ATOM 65 N THR A 5 3.498 7.905 5.706 1.00 55.21 N ATOM 66 CA THR A 5 4.125 8.603 6.821 1.00 50.33 C ATOM 67 C THR A 5 5.413 7.910 7.249 1.00 61.31 C ATOM 68 O THR A 5 6.319 8.542 7.794 1.00 31.44 O ATOM 69 CB THR A 5 3.177 8.694 8.032 1.00 43.24 C ATOM 70 OG1 THR A 5 2.279 7.579 8.036 1.00 62.14 O ATOM 71 CG2 THR A 5 2.383 9.991 8.001 1.00 1.21 C ATOM 0 H THR A 5 2.725 7.295 5.972 1.00 55.21 H new ATOM 0 HA THR A 5 4.356 9.610 6.474 1.00 50.33 H new ATOM 0 HB THR A 5 3.780 8.677 8.940 1.00 43.24 H new ATOM 0 HG1 THR A 5 1.681 7.643 8.810 1.00 62.14 H new ATOM 0 HG21 THR A 5 1.721 10.033 8.866 1.00 1.21 H new ATOM 0 HG22 THR A 5 3.069 10.838 8.028 1.00 1.21 H new ATOM 0 HG23 THR A 5 1.790 10.033 7.087 1.00 1.21 H new ATOM 79 N LEU A 6 5.490 6.607 6.998 1.00 13.42 N ATOM 80 CA LEU A 6 6.669 5.827 7.357 1.00 12.14 C ATOM 81 C LEU A 6 7.933 6.451 6.775 1.00 72.04 C ATOM 82 O LEU A 6 8.959 6.545 7.449 1.00 75.52 O ATOM 83 CB LEU A 6 6.522 4.387 6.862 1.00 0.32 C ATOM 84 CG LEU A 6 7.221 3.315 7.699 1.00 0.20 C ATOM 85 CD1 LEU A 6 6.651 3.282 9.108 1.00 13.14 C ATOM 86 CD2 LEU A 6 7.090 1.952 7.036 1.00 34.44 C ATOM 0 H LEU A 6 4.750 6.069 6.547 1.00 13.42 H new ATOM 0 HA LEU A 6 6.755 5.824 8.444 1.00 12.14 H new ATOM 0 HB2 LEU A 6 5.460 4.147 6.814 1.00 0.32 H new ATOM 0 HB3 LEU A 6 6.907 4.333 5.844 1.00 0.32 H new ATOM 0 HG LEU A 6 8.280 3.565 7.764 1.00 0.20 H new ATOM 0 HD11 LEU A 6 7.161 2.513 9.689 1.00 13.14 H new ATOM 0 HD12 LEU A 6 6.798 4.252 9.583 1.00 13.14 H new ATOM 0 HD13 LEU A 6 5.585 3.057 9.064 1.00 13.14 H new ATOM 0 HD21 LEU A 6 7.593 1.201 7.645 1.00 34.44 H new ATOM 0 HD22 LEU A 6 6.035 1.694 6.940 1.00 34.44 H new ATOM 0 HD23 LEU A 6 7.548 1.983 6.047 1.00 34.44 H new ATOM 98 N SER A 7 7.851 6.878 5.519 1.00 51.33 N ATOM 99 CA SER A 7 8.989 7.492 4.844 1.00 13.23 C ATOM 100 C SER A 7 9.177 8.935 5.302 1.00 43.43 C ATOM 101 O SER A 7 10.287 9.469 5.272 1.00 13.30 O ATOM 102 CB SER A 7 8.795 7.447 3.327 1.00 14.24 C ATOM 103 OG SER A 7 8.585 6.119 2.879 1.00 4.22 O ATOM 0 H SER A 7 7.008 6.810 4.948 1.00 51.33 H new ATOM 0 HA SER A 7 9.884 6.926 5.105 1.00 13.23 H new ATOM 0 HB2 SER A 7 7.943 8.067 3.048 1.00 14.24 H new ATOM 0 HB3 SER A 7 9.671 7.867 2.833 1.00 14.24 H new ATOM 0 HG SER A 7 9.450 5.690 2.709 1.00 4.22 H new ATOM 109 N THR A 8 8.085 9.563 5.725 1.00 15.11 N ATOM 110 CA THR A 8 8.127 10.944 6.188 1.00 44.41 C ATOM 111 C THR A 8 8.807 11.048 7.548 1.00 21.45 C ATOM 112 O THR A 8 9.256 12.122 7.950 1.00 52.21 O ATOM 113 CB THR A 8 6.714 11.548 6.286 1.00 53.22 C ATOM 114 OG1 THR A 8 5.967 11.242 5.103 1.00 43.54 O ATOM 115 CG2 THR A 8 6.781 13.056 6.473 1.00 2.35 C ATOM 0 H THR A 8 7.159 9.136 5.756 1.00 15.11 H new ATOM 0 HA THR A 8 8.703 11.505 5.453 1.00 44.41 H new ATOM 0 HB THR A 8 6.217 11.112 7.153 1.00 53.22 H new ATOM 0 HG1 THR A 8 5.755 10.285 5.088 1.00 43.54 H new ATOM 0 HG21 THR A 8 5.771 13.460 6.540 1.00 2.35 H new ATOM 0 HG22 THR A 8 7.324 13.285 7.390 1.00 2.35 H new ATOM 0 HG23 THR A 8 7.296 13.505 5.624 1.00 2.35 H new ATOM 123 N LEU A 9 8.881 9.925 8.254 1.00 32.33 N ATOM 124 CA LEU A 9 9.507 9.888 9.571 1.00 5.52 C ATOM 125 C LEU A 9 10.966 10.328 9.492 1.00 11.35 C ATOM 126 O LEU A 9 11.518 10.495 8.405 1.00 72.14 O ATOM 127 CB LEU A 9 9.419 8.480 10.161 1.00 12.04 C ATOM 128 CG LEU A 9 8.400 8.286 11.285 1.00 3.13 C ATOM 129 CD1 LEU A 9 8.674 9.253 12.426 1.00 1.44 C ATOM 130 CD2 LEU A 9 6.984 8.467 10.759 1.00 61.23 C ATOM 0 H LEU A 9 8.515 9.028 7.936 1.00 32.33 H new ATOM 0 HA LEU A 9 8.971 10.581 10.220 1.00 5.52 H new ATOM 0 HB2 LEU A 9 9.179 7.785 9.356 1.00 12.04 H new ATOM 0 HB3 LEU A 9 10.404 8.204 10.538 1.00 12.04 H new ATOM 0 HG LEU A 9 8.497 7.269 11.666 1.00 3.13 H new ATOM 0 HD11 LEU A 9 7.939 9.101 13.217 1.00 1.44 H new ATOM 0 HD12 LEU A 9 9.674 9.076 12.821 1.00 1.44 H new ATOM 0 HD13 LEU A 9 8.605 10.277 12.059 1.00 1.44 H new ATOM 0 HD21 LEU A 9 6.273 8.325 11.573 1.00 61.23 H new ATOM 0 HD22 LEU A 9 6.873 9.472 10.351 1.00 61.23 H new ATOM 0 HD23 LEU A 9 6.790 7.734 9.976 1.00 61.23 H new ATOM 142 N LYS A 10 11.586 10.513 10.653 1.00 61.01 N ATOM 143 CA LYS A 10 12.982 10.930 10.717 1.00 32.11 C ATOM 144 C LYS A 10 13.748 10.110 11.750 1.00 33.15 C ATOM 145 O LYS A 10 13.151 9.412 12.571 1.00 21.12 O ATOM 146 CB LYS A 10 13.076 12.418 11.060 1.00 14.44 C ATOM 147 CG LYS A 10 12.140 13.291 10.242 1.00 43.42 C ATOM 148 CD LYS A 10 12.467 14.766 10.407 1.00 15.22 C ATOM 149 CE LYS A 10 11.354 15.648 9.860 1.00 65.20 C ATOM 150 NZ LYS A 10 11.437 17.037 10.389 1.00 1.41 N ATOM 0 H LYS A 10 11.144 10.381 11.562 1.00 61.01 H new ATOM 0 HA LYS A 10 13.431 10.760 9.738 1.00 32.11 H new ATOM 0 HB2 LYS A 10 12.853 12.553 12.118 1.00 14.44 H new ATOM 0 HB3 LYS A 10 14.101 12.754 10.905 1.00 14.44 H new ATOM 0 HG2 LYS A 10 12.212 13.017 9.190 1.00 43.42 H new ATOM 0 HG3 LYS A 10 11.110 13.109 10.549 1.00 43.42 H new ATOM 0 HD2 LYS A 10 12.624 14.989 11.462 1.00 15.22 H new ATOM 0 HD3 LYS A 10 13.400 14.993 9.891 1.00 15.22 H new ATOM 0 HE2 LYS A 10 11.410 15.670 8.772 1.00 65.20 H new ATOM 0 HE3 LYS A 10 10.387 15.217 10.121 1.00 65.20 H new ATOM 0 HZ1 LYS A 10 10.662 17.606 9.993 1.00 1.41 H new ATOM 0 HZ2 LYS A 10 11.358 17.019 11.426 1.00 1.41 H new ATOM 0 HZ3 LYS A 10 12.349 17.458 10.118 1.00 1.41 H new ATOM 164 N THR A 11 15.073 10.200 11.706 1.00 24.42 N ATOM 165 CA THR A 11 15.921 9.467 12.638 1.00 34.54 C ATOM 166 C THR A 11 16.408 10.370 13.766 1.00 74.33 C ATOM 167 O THR A 11 16.654 11.558 13.560 1.00 73.35 O ATOM 168 CB THR A 11 17.140 8.852 11.925 1.00 33.23 C ATOM 169 OG1 THR A 11 18.026 9.888 11.489 1.00 3.33 O ATOM 170 CG2 THR A 11 16.704 8.015 10.732 1.00 53.20 C ATOM 0 H THR A 11 15.583 10.774 11.034 1.00 24.42 H new ATOM 0 HA THR A 11 15.312 8.666 13.056 1.00 34.54 H new ATOM 0 HB THR A 11 17.659 8.205 12.632 1.00 33.23 H new ATOM 0 HG1 THR A 11 17.518 10.568 10.999 1.00 3.33 H new ATOM 0 HG21 THR A 11 17.582 7.591 10.245 1.00 53.20 H new ATOM 0 HG22 THR A 11 16.053 7.209 11.071 1.00 53.20 H new ATOM 0 HG23 THR A 11 16.164 8.644 10.024 1.00 53.20 H new ATOM 178 N ALA A 12 16.545 9.799 14.958 1.00 62.42 N ATOM 179 CA ALA A 12 17.006 10.552 16.117 1.00 12.23 C ATOM 180 C ALA A 12 18.212 11.417 15.766 1.00 30.45 C ATOM 181 O ALA A 12 18.441 12.458 16.381 1.00 1.35 O ATOM 182 CB ALA A 12 17.346 9.607 17.260 1.00 31.10 C ATOM 0 H ALA A 12 16.343 8.817 15.146 1.00 62.42 H new ATOM 0 HA ALA A 12 16.199 11.212 16.434 1.00 12.23 H new ATOM 0 HB1 ALA A 12 17.689 10.184 18.119 1.00 31.10 H new ATOM 0 HB2 ALA A 12 16.459 9.037 17.536 1.00 31.10 H new ATOM 0 HB3 ALA A 12 18.134 8.923 16.944 1.00 31.10 H new ATOM 188 N ASP A 13 18.980 10.978 14.776 1.00 62.24 N ATOM 189 CA ASP A 13 20.164 11.712 14.343 1.00 75.02 C ATOM 190 C ASP A 13 19.773 12.943 13.530 1.00 35.44 C ATOM 191 O ASP A 13 20.035 14.074 13.935 1.00 15.31 O ATOM 192 CB ASP A 13 21.076 10.807 13.514 1.00 44.23 C ATOM 193 CG ASP A 13 22.324 11.524 13.037 1.00 3.22 C ATOM 194 OD1 ASP A 13 23.338 11.501 13.767 1.00 14.21 O ATOM 195 OD2 ASP A 13 22.288 12.108 11.934 1.00 70.31 O ATOM 0 H ASP A 13 18.804 10.117 14.258 1.00 62.24 H new ATOM 0 HA ASP A 13 20.702 12.041 15.232 1.00 75.02 H new ATOM 0 HB2 ASP A 13 21.363 9.941 14.111 1.00 44.23 H new ATOM 0 HB3 ASP A 13 20.524 10.431 12.652 1.00 44.23 H new ATOM 200 N ASN A 14 19.145 12.712 12.382 1.00 50.23 N ATOM 201 CA ASN A 14 18.719 13.802 11.511 1.00 3.23 C ATOM 202 C ASN A 14 18.303 13.274 10.142 1.00 61.12 C ATOM 203 O ASN A 14 17.550 13.925 9.417 1.00 62.41 O ATOM 204 CB ASN A 14 19.845 14.827 11.355 1.00 71.34 C ATOM 205 CG ASN A 14 19.724 15.627 10.072 1.00 12.02 C ATOM 206 OD1 ASN A 14 18.730 16.319 9.851 1.00 71.13 O ATOM 207 ND2 ASN A 14 20.738 15.536 9.220 1.00 60.41 N ATOM 0 H ASN A 14 18.920 11.780 12.033 1.00 50.23 H new ATOM 0 HA ASN A 14 17.857 14.286 11.971 1.00 3.23 H new ATOM 0 HB2 ASN A 14 19.834 15.507 12.207 1.00 71.34 H new ATOM 0 HB3 ASN A 14 20.806 14.313 11.370 1.00 71.34 H new ATOM 0 HD21 ASN A 14 20.713 16.052 8.341 1.00 60.41 H new ATOM 0 HD22 ASN A 14 21.542 14.950 9.445 1.00 60.41 H new ATOM 214 N ARG A 15 18.798 12.090 9.795 1.00 52.31 N ATOM 215 CA ARG A 15 18.478 11.475 8.513 1.00 70.43 C ATOM 216 C ARG A 15 17.065 10.899 8.523 1.00 31.04 C ATOM 217 O ARG A 15 16.475 10.657 9.577 1.00 55.35 O ATOM 218 CB ARG A 15 19.487 10.372 8.186 1.00 31.25 C ATOM 219 CG ARG A 15 20.514 10.776 7.142 1.00 64.00 C ATOM 220 CD ARG A 15 21.888 10.209 7.463 1.00 23.24 C ATOM 221 NE ARG A 15 22.905 10.672 6.523 1.00 62.51 N ATOM 222 CZ ARG A 15 24.211 10.530 6.724 1.00 73.03 C ATOM 223 NH1 ARG A 15 24.655 9.941 7.825 1.00 4.54 N ATOM 224 NH2 ARG A 15 25.074 10.977 5.821 1.00 43.20 N ATOM 0 H ARG A 15 19.422 11.538 10.384 1.00 52.31 H new ATOM 0 HA ARG A 15 18.532 12.247 7.745 1.00 70.43 H new ATOM 0 HB2 ARG A 15 20.005 10.083 9.100 1.00 31.25 H new ATOM 0 HB3 ARG A 15 18.949 9.492 7.833 1.00 31.25 H new ATOM 0 HG2 ARG A 15 20.194 10.425 6.161 1.00 64.00 H new ATOM 0 HG3 ARG A 15 20.571 11.863 7.088 1.00 64.00 H new ATOM 0 HD2 ARG A 15 22.172 10.498 8.475 1.00 23.24 H new ATOM 0 HD3 ARG A 15 21.844 9.120 7.443 1.00 23.24 H new ATOM 0 HE ARG A 15 22.596 11.129 5.665 1.00 62.51 H new ATOM 0 HH11 ARG A 15 23.994 9.595 8.521 1.00 4.54 H new ATOM 0 HH12 ARG A 15 25.658 9.833 7.977 1.00 4.54 H new ATOM 0 HH21 ARG A 15 24.735 11.430 4.972 1.00 43.20 H new ATOM 0 HH22 ARG A 15 26.076 10.868 5.976 1.00 43.20 H new ATOM 238 N PRO A 16 16.508 10.674 7.324 1.00 0.20 N ATOM 239 CA PRO A 16 15.158 10.124 7.169 1.00 41.45 C ATOM 240 C PRO A 16 15.076 8.661 7.590 1.00 11.31 C ATOM 241 O PRO A 16 16.078 7.947 7.586 1.00 1.32 O ATOM 242 CB PRO A 16 14.889 10.265 5.668 1.00 34.43 C ATOM 243 CG PRO A 16 16.239 10.269 5.040 1.00 62.34 C ATOM 244 CD PRO A 16 17.154 10.939 6.027 1.00 33.23 C ATOM 0 HA PRO A 16 14.432 10.641 7.797 1.00 41.45 H new ATOM 0 HB2 PRO A 16 14.282 9.440 5.296 1.00 34.43 H new ATOM 0 HB3 PRO A 16 14.347 11.185 5.448 1.00 34.43 H new ATOM 0 HG2 PRO A 16 16.573 9.254 4.826 1.00 62.34 H new ATOM 0 HG3 PRO A 16 16.227 10.807 4.092 1.00 62.34 H new ATOM 0 HD2 PRO A 16 18.161 10.524 5.987 1.00 33.23 H new ATOM 0 HD3 PRO A 16 17.242 12.008 5.832 1.00 33.23 H new ATOM 252 N ALA A 17 13.875 8.221 7.953 1.00 44.32 N ATOM 253 CA ALA A 17 13.663 6.842 8.375 1.00 55.45 C ATOM 254 C ALA A 17 13.377 5.940 7.179 1.00 41.44 C ATOM 255 O ALA A 17 13.475 4.717 7.274 1.00 11.13 O ATOM 256 CB ALA A 17 12.522 6.768 9.379 1.00 72.34 C ATOM 0 H ALA A 17 13.035 8.799 7.963 1.00 44.32 H new ATOM 0 HA ALA A 17 14.577 6.489 8.853 1.00 55.45 H new ATOM 0 HB1 ALA A 17 12.374 5.733 9.686 1.00 72.34 H new ATOM 0 HB2 ALA A 17 12.765 7.374 10.252 1.00 72.34 H new ATOM 0 HB3 ALA A 17 11.608 7.144 8.919 1.00 72.34 H new ATOM 262 N SER A 18 13.023 6.552 6.053 1.00 40.21 N ATOM 263 CA SER A 18 12.719 5.804 4.839 1.00 30.40 C ATOM 264 C SER A 18 13.959 5.082 4.321 1.00 62.11 C ATOM 265 O SER A 18 13.909 3.897 3.989 1.00 42.52 O ATOM 266 CB SER A 18 12.172 6.740 3.760 1.00 2.52 C ATOM 267 OG SER A 18 11.369 6.034 2.831 1.00 41.14 O ATOM 0 H SER A 18 12.940 7.564 5.957 1.00 40.21 H new ATOM 0 HA SER A 18 11.961 5.059 5.082 1.00 30.40 H new ATOM 0 HB2 SER A 18 11.585 7.532 4.225 1.00 2.52 H new ATOM 0 HB3 SER A 18 12.999 7.221 3.238 1.00 2.52 H new ATOM 0 HG SER A 18 11.294 6.552 2.003 1.00 41.14 H new ATOM 273 N VAL A 19 15.073 5.805 4.254 1.00 14.14 N ATOM 274 CA VAL A 19 16.327 5.235 3.778 1.00 41.21 C ATOM 275 C VAL A 19 16.748 4.043 4.630 1.00 72.01 C ATOM 276 O VAL A 19 17.530 3.199 4.192 1.00 73.30 O ATOM 277 CB VAL A 19 17.457 6.282 3.785 1.00 64.51 C ATOM 278 CG1 VAL A 19 17.122 7.437 2.854 1.00 73.40 C ATOM 279 CG2 VAL A 19 17.711 6.782 5.199 1.00 72.10 C ATOM 0 H VAL A 19 15.132 6.787 4.524 1.00 14.14 H new ATOM 0 HA VAL A 19 16.155 4.903 2.754 1.00 41.21 H new ATOM 0 HB VAL A 19 18.369 5.808 3.422 1.00 64.51 H new ATOM 0 HG11 VAL A 19 17.932 8.166 2.873 1.00 73.40 H new ATOM 0 HG12 VAL A 19 16.995 7.061 1.839 1.00 73.40 H new ATOM 0 HG13 VAL A 19 16.198 7.913 3.182 1.00 73.40 H new ATOM 0 HG21 VAL A 19 18.512 7.521 5.185 1.00 72.10 H new ATOM 0 HG22 VAL A 19 16.803 7.239 5.592 1.00 72.10 H new ATOM 0 HG23 VAL A 19 18.000 5.945 5.834 1.00 72.10 H new ATOM 289 N TYR A 20 16.224 3.980 5.849 1.00 51.01 N ATOM 290 CA TYR A 20 16.546 2.892 6.764 1.00 24.22 C ATOM 291 C TYR A 20 15.659 1.679 6.503 1.00 73.12 C ATOM 292 O TYR A 20 15.738 0.673 7.209 1.00 34.12 O ATOM 293 CB TYR A 20 16.386 3.352 8.214 1.00 51.30 C ATOM 294 CG TYR A 20 17.655 3.914 8.815 1.00 72.40 C ATOM 295 CD1 TYR A 20 18.746 3.093 9.074 1.00 41.34 C ATOM 296 CD2 TYR A 20 17.762 5.264 9.125 1.00 21.42 C ATOM 297 CE1 TYR A 20 19.907 3.601 9.623 1.00 2.43 C ATOM 298 CE2 TYR A 20 18.920 5.781 9.674 1.00 73.44 C ATOM 299 CZ TYR A 20 19.989 4.946 9.921 1.00 23.40 C ATOM 300 OH TYR A 20 21.144 5.457 10.469 1.00 73.44 O ATOM 0 H TYR A 20 15.574 4.670 6.226 1.00 51.01 H new ATOM 0 HA TYR A 20 17.583 2.604 6.593 1.00 24.22 H new ATOM 0 HB2 TYR A 20 15.605 4.110 8.262 1.00 51.30 H new ATOM 0 HB3 TYR A 20 16.050 2.510 8.819 1.00 51.30 H new ATOM 0 HD1 TYR A 20 18.685 2.040 8.842 1.00 41.34 H new ATOM 0 HD2 TYR A 20 16.926 5.921 8.934 1.00 21.42 H new ATOM 0 HE1 TYR A 20 20.746 2.949 9.818 1.00 2.43 H new ATOM 0 HE2 TYR A 20 18.987 6.833 9.908 1.00 73.44 H new ATOM 0 HH TYR A 20 21.038 6.420 10.617 1.00 73.44 H new ATOM 310 N LEU A 21 14.814 1.781 5.483 1.00 41.34 N ATOM 311 CA LEU A 21 13.911 0.693 5.125 1.00 15.12 C ATOM 312 C LEU A 21 14.206 0.180 3.720 1.00 72.53 C ATOM 313 O LEU A 21 15.083 0.699 3.028 1.00 35.45 O ATOM 314 CB LEU A 21 12.457 1.161 5.215 1.00 72.22 C ATOM 315 CG LEU A 21 11.781 0.995 6.577 1.00 42.45 C ATOM 316 CD1 LEU A 21 12.589 1.691 7.661 1.00 21.11 C ATOM 317 CD2 LEU A 21 10.360 1.538 6.536 1.00 2.43 C ATOM 0 H LEU A 21 14.735 2.607 4.889 1.00 41.34 H new ATOM 0 HA LEU A 21 14.068 -0.124 5.830 1.00 15.12 H new ATOM 0 HB2 LEU A 21 12.418 2.215 4.938 1.00 72.22 H new ATOM 0 HB3 LEU A 21 11.874 0.615 4.473 1.00 72.22 H new ATOM 0 HG LEU A 21 11.735 -0.068 6.813 1.00 42.45 H new ATOM 0 HD11 LEU A 21 12.093 1.563 8.623 1.00 21.11 H new ATOM 0 HD12 LEU A 21 13.588 1.256 7.706 1.00 21.11 H new ATOM 0 HD13 LEU A 21 12.666 2.754 7.432 1.00 21.11 H new ATOM 0 HD21 LEU A 21 9.894 1.412 7.513 1.00 2.43 H new ATOM 0 HD22 LEU A 21 10.382 2.597 6.279 1.00 2.43 H new ATOM 0 HD23 LEU A 21 9.784 0.995 5.787 1.00 2.43 H new ATOM 329 N LYS A 22 13.467 -0.842 3.301 1.00 33.34 N ATOM 330 CA LYS A 22 13.646 -1.425 1.977 1.00 73.11 C ATOM 331 C LYS A 22 12.299 -1.745 1.337 1.00 73.33 C ATOM 332 O LYS A 22 11.502 -2.505 1.888 1.00 24.41 O ATOM 333 CB LYS A 22 14.494 -2.695 2.067 1.00 65.44 C ATOM 334 CG LYS A 22 15.750 -2.649 1.213 1.00 22.33 C ATOM 335 CD LYS A 22 16.448 -3.999 1.174 1.00 14.21 C ATOM 336 CE LYS A 22 17.500 -4.114 2.266 1.00 21.21 C ATOM 337 NZ LYS A 22 18.872 -3.870 1.742 1.00 43.22 N ATOM 0 H LYS A 22 12.738 -1.284 3.860 1.00 33.34 H new ATOM 0 HA LYS A 22 14.161 -0.695 1.353 1.00 73.11 H new ATOM 0 HB2 LYS A 22 14.777 -2.860 3.107 1.00 65.44 H new ATOM 0 HB3 LYS A 22 13.889 -3.549 1.762 1.00 65.44 H new ATOM 0 HG2 LYS A 22 15.491 -2.343 0.199 1.00 22.33 H new ATOM 0 HG3 LYS A 22 16.433 -1.897 1.608 1.00 22.33 H new ATOM 0 HD2 LYS A 22 15.712 -4.794 1.291 1.00 14.21 H new ATOM 0 HD3 LYS A 22 16.916 -4.140 0.200 1.00 14.21 H new ATOM 0 HE2 LYS A 22 17.281 -3.398 3.058 1.00 21.21 H new ATOM 0 HE3 LYS A 22 17.453 -5.107 2.712 1.00 21.21 H new ATOM 0 HZ1 LYS A 22 19.560 -3.957 2.517 1.00 43.22 H new ATOM 0 HZ2 LYS A 22 19.091 -4.569 1.004 1.00 43.22 H new ATOM 0 HZ3 LYS A 22 18.924 -2.913 1.339 1.00 43.22 H new ATOM 351 N LYS A 23 12.050 -1.162 0.169 1.00 1.22 N ATOM 352 CA LYS A 23 10.801 -1.386 -0.548 1.00 72.44 C ATOM 353 C LYS A 23 10.787 -2.767 -1.198 1.00 11.43 C ATOM 354 O LYS A 23 10.708 -2.887 -2.420 1.00 75.03 O ATOM 355 CB LYS A 23 10.600 -0.307 -1.615 1.00 22.42 C ATOM 356 CG LYS A 23 11.759 -0.193 -2.590 1.00 3.44 C ATOM 357 CD LYS A 23 12.315 1.221 -2.632 1.00 14.13 C ATOM 358 CE LYS A 23 13.308 1.396 -3.770 1.00 50.12 C ATOM 359 NZ LYS A 23 12.878 2.457 -4.723 1.00 24.10 N ATOM 0 H LYS A 23 12.698 -0.530 -0.301 1.00 1.22 H new ATOM 0 HA LYS A 23 9.984 -1.333 0.172 1.00 72.44 H new ATOM 0 HB2 LYS A 23 9.688 -0.523 -2.171 1.00 22.42 H new ATOM 0 HB3 LYS A 23 10.453 0.655 -1.124 1.00 22.42 H new ATOM 0 HG2 LYS A 23 12.548 -0.887 -2.301 1.00 3.44 H new ATOM 0 HG3 LYS A 23 11.427 -0.484 -3.587 1.00 3.44 H new ATOM 0 HD2 LYS A 23 11.497 1.931 -2.749 1.00 14.13 H new ATOM 0 HD3 LYS A 23 12.802 1.450 -1.684 1.00 14.13 H new ATOM 0 HE2 LYS A 23 14.287 1.649 -3.362 1.00 50.12 H new ATOM 0 HE3 LYS A 23 13.419 0.452 -4.303 1.00 50.12 H new ATOM 0 HZ1 LYS A 23 13.581 2.546 -5.484 1.00 24.10 H new ATOM 0 HZ2 LYS A 23 11.956 2.204 -5.131 1.00 24.10 H new ATOM 0 HZ3 LYS A 23 12.796 3.363 -4.220 1.00 24.10 H new ATOM 373 N ASP A 24 10.863 -3.804 -0.372 1.00 62.50 N ATOM 374 CA ASP A 24 10.857 -5.177 -0.866 1.00 15.40 C ATOM 375 C ASP A 24 10.820 -6.170 0.291 1.00 72.42 C ATOM 376 O ASP A 24 10.227 -7.244 0.183 1.00 53.12 O ATOM 377 CB ASP A 24 12.087 -5.434 -1.737 1.00 4.33 C ATOM 378 CG ASP A 24 11.916 -6.639 -2.641 1.00 13.35 C ATOM 379 OD1 ASP A 24 10.838 -6.768 -3.257 1.00 70.25 O ATOM 380 OD2 ASP A 24 12.859 -7.453 -2.730 1.00 51.33 O ATOM 0 H ASP A 24 10.929 -3.721 0.642 1.00 62.50 H new ATOM 0 HA ASP A 24 9.960 -5.316 -1.469 1.00 15.40 H new ATOM 0 HB2 ASP A 24 12.288 -4.552 -2.346 1.00 4.33 H new ATOM 0 HB3 ASP A 24 12.957 -5.584 -1.097 1.00 4.33 H new ATOM 385 N LYS A 25 11.458 -5.806 1.397 1.00 25.25 N ATOM 386 CA LYS A 25 11.500 -6.665 2.575 1.00 14.54 C ATOM 387 C LYS A 25 10.735 -6.034 3.735 1.00 1.00 C ATOM 388 O LYS A 25 10.594 -4.814 3.827 1.00 24.41 O ATOM 389 CB LYS A 25 12.949 -6.928 2.990 1.00 41.05 C ATOM 390 CG LYS A 25 13.902 -7.067 1.815 1.00 53.54 C ATOM 391 CD LYS A 25 15.137 -7.867 2.190 1.00 24.11 C ATOM 392 CE LYS A 25 15.205 -9.180 1.425 1.00 34.00 C ATOM 393 NZ LYS A 25 16.598 -9.518 1.024 1.00 5.31 N ATOM 0 H LYS A 25 11.954 -4.921 1.503 1.00 25.25 H new ATOM 0 HA LYS A 25 11.025 -7.612 2.320 1.00 14.54 H new ATOM 0 HB2 LYS A 25 13.289 -6.113 3.628 1.00 41.05 H new ATOM 0 HB3 LYS A 25 12.987 -7.838 3.588 1.00 41.05 H new ATOM 0 HG2 LYS A 25 13.390 -7.555 0.986 1.00 53.54 H new ATOM 0 HG3 LYS A 25 14.200 -6.078 1.468 1.00 53.54 H new ATOM 0 HD2 LYS A 25 16.030 -7.278 1.983 1.00 24.11 H new ATOM 0 HD3 LYS A 25 15.130 -8.069 3.261 1.00 24.11 H new ATOM 0 HE2 LYS A 25 14.801 -9.982 2.043 1.00 34.00 H new ATOM 0 HE3 LYS A 25 14.577 -9.115 0.536 1.00 34.00 H new ATOM 0 HZ1 LYS A 25 16.601 -10.419 0.505 1.00 5.31 H new ATOM 0 HZ2 LYS A 25 16.976 -8.766 0.413 1.00 5.31 H new ATOM 0 HZ3 LYS A 25 17.192 -9.605 1.873 1.00 5.31 H new ATOM 407 N PRO A 26 10.230 -6.882 4.643 1.00 61.41 N ATOM 408 CA PRO A 26 9.473 -6.430 5.814 1.00 23.01 C ATOM 409 C PRO A 26 10.353 -5.711 6.831 1.00 64.50 C ATOM 410 O PRO A 26 11.486 -6.121 7.087 1.00 45.32 O ATOM 411 CB PRO A 26 8.925 -7.731 6.406 1.00 11.20 C ATOM 412 CG PRO A 26 9.876 -8.784 5.952 1.00 75.11 C ATOM 413 CD PRO A 26 10.359 -8.348 4.596 1.00 25.54 C ATOM 0 HA PRO A 26 8.701 -5.709 5.547 1.00 23.01 H new ATOM 0 HB2 PRO A 26 8.878 -7.682 7.494 1.00 11.20 H new ATOM 0 HB3 PRO A 26 7.914 -7.932 6.052 1.00 11.20 H new ATOM 0 HG2 PRO A 26 10.708 -8.885 6.649 1.00 75.11 H new ATOM 0 HG3 PRO A 26 9.386 -9.756 5.898 1.00 75.11 H new ATOM 0 HD2 PRO A 26 11.390 -8.655 4.419 1.00 25.54 H new ATOM 0 HD3 PRO A 26 9.756 -8.779 3.797 1.00 25.54 H new ATOM 421 N THR A 27 9.825 -4.637 7.410 1.00 64.33 N ATOM 422 CA THR A 27 10.563 -3.861 8.398 1.00 23.23 C ATOM 423 C THR A 27 9.979 -4.051 9.794 1.00 43.15 C ATOM 424 O THR A 27 8.762 -4.127 9.963 1.00 14.11 O ATOM 425 CB THR A 27 10.558 -2.360 8.052 1.00 65.32 C ATOM 426 OG1 THR A 27 10.864 -2.177 6.665 1.00 3.31 O ATOM 427 CG2 THR A 27 11.568 -1.605 8.903 1.00 31.23 C ATOM 0 H THR A 27 8.889 -4.285 7.211 1.00 64.33 H new ATOM 0 HA THR A 27 11.590 -4.226 8.383 1.00 23.23 H new ATOM 0 HB THR A 27 9.564 -1.965 8.260 1.00 65.32 H new ATOM 0 HG1 THR A 27 10.196 -1.587 6.258 1.00 3.31 H new ATOM 0 HG21 THR A 27 11.546 -0.547 8.641 1.00 31.23 H new ATOM 0 HG22 THR A 27 11.316 -1.723 9.957 1.00 31.23 H new ATOM 0 HG23 THR A 27 12.566 -2.003 8.722 1.00 31.23 H new ATOM 435 N LEU A 28 10.854 -4.126 10.790 1.00 20.25 N ATOM 436 CA LEU A 28 10.425 -4.306 12.173 1.00 33.30 C ATOM 437 C LEU A 28 10.677 -3.043 12.990 1.00 31.44 C ATOM 438 O LEU A 28 11.812 -2.577 13.096 1.00 33.10 O ATOM 439 CB LEU A 28 11.157 -5.491 12.805 1.00 60.30 C ATOM 440 CG LEU A 28 10.448 -6.843 12.717 1.00 73.11 C ATOM 441 CD1 LEU A 28 11.252 -7.814 11.866 1.00 40.51 C ATOM 442 CD2 LEU A 28 10.216 -7.416 14.108 1.00 44.43 C ATOM 0 H LEU A 28 11.865 -4.065 10.666 1.00 20.25 H new ATOM 0 HA LEU A 28 9.354 -4.508 12.172 1.00 33.30 H new ATOM 0 HB2 LEU A 28 12.134 -5.584 12.330 1.00 60.30 H new ATOM 0 HB3 LEU A 28 11.334 -5.264 13.856 1.00 60.30 H new ATOM 0 HG LEU A 28 9.479 -6.692 12.242 1.00 73.11 H new ATOM 0 HD11 LEU A 28 10.732 -8.770 11.815 1.00 40.51 H new ATOM 0 HD12 LEU A 28 11.366 -7.409 10.861 1.00 40.51 H new ATOM 0 HD13 LEU A 28 12.236 -7.960 12.312 1.00 40.51 H new ATOM 0 HD21 LEU A 28 9.710 -8.378 14.025 1.00 44.43 H new ATOM 0 HD22 LEU A 28 11.174 -7.551 14.610 1.00 44.43 H new ATOM 0 HD23 LEU A 28 9.597 -6.729 14.686 1.00 44.43 H new ATOM 454 N ILE A 29 9.613 -2.496 13.568 1.00 33.51 N ATOM 455 CA ILE A 29 9.720 -1.290 14.379 1.00 52.12 C ATOM 456 C ILE A 29 9.596 -1.613 15.864 1.00 2.30 C ATOM 457 O ILE A 29 8.681 -2.321 16.283 1.00 74.52 O ATOM 458 CB ILE A 29 8.642 -0.258 13.998 1.00 72.02 C ATOM 459 CG1 ILE A 29 8.709 0.053 12.501 1.00 34.41 C ATOM 460 CG2 ILE A 29 8.812 1.013 14.816 1.00 24.03 C ATOM 461 CD1 ILE A 29 10.004 0.708 12.077 1.00 3.23 C ATOM 0 H ILE A 29 8.667 -2.869 13.490 1.00 33.51 H new ATOM 0 HA ILE A 29 10.704 -0.865 14.183 1.00 52.12 H new ATOM 0 HB ILE A 29 7.662 -0.681 14.219 1.00 72.02 H new ATOM 0 HG12 ILE A 29 8.579 -0.872 11.940 1.00 34.41 H new ATOM 0 HG13 ILE A 29 7.877 0.706 12.236 1.00 34.41 H new ATOM 0 HG21 ILE A 29 8.043 1.732 14.535 1.00 24.03 H new ATOM 0 HG22 ILE A 29 8.719 0.778 15.876 1.00 24.03 H new ATOM 0 HG23 ILE A 29 9.796 1.441 14.624 1.00 24.03 H new ATOM 0 HD11 ILE A 29 9.981 0.899 11.004 1.00 3.23 H new ATOM 0 HD12 ILE A 29 10.127 1.650 12.611 1.00 3.23 H new ATOM 0 HD13 ILE A 29 10.839 0.047 12.310 1.00 3.23 H new ATOM 473 N LYS A 30 10.523 -1.087 16.657 1.00 0.54 N ATOM 474 CA LYS A 30 10.518 -1.315 18.097 1.00 13.04 C ATOM 475 C LYS A 30 10.392 0.002 18.857 1.00 72.12 C ATOM 476 O LYS A 30 11.195 0.916 18.671 1.00 2.24 O ATOM 477 CB LYS A 30 11.795 -2.042 18.524 1.00 1.20 C ATOM 478 CG LYS A 30 12.013 -2.058 20.027 1.00 13.21 C ATOM 479 CD LYS A 30 13.290 -2.793 20.398 1.00 40.31 C ATOM 480 CE LYS A 30 13.130 -3.569 21.696 1.00 12.42 C ATOM 481 NZ LYS A 30 13.957 -2.993 22.792 1.00 4.12 N ATOM 0 H LYS A 30 11.288 -0.499 16.326 1.00 0.54 H new ATOM 0 HA LYS A 30 9.656 -1.937 18.337 1.00 13.04 H new ATOM 0 HB2 LYS A 30 11.757 -3.069 18.160 1.00 1.20 H new ATOM 0 HB3 LYS A 30 12.651 -1.566 18.046 1.00 1.20 H new ATOM 0 HG2 LYS A 30 12.060 -1.035 20.400 1.00 13.21 H new ATOM 0 HG3 LYS A 30 11.163 -2.536 20.514 1.00 13.21 H new ATOM 0 HD2 LYS A 30 13.563 -3.478 19.595 1.00 40.31 H new ATOM 0 HD3 LYS A 30 14.106 -2.078 20.499 1.00 40.31 H new ATOM 0 HE2 LYS A 30 12.081 -3.567 21.993 1.00 12.42 H new ATOM 0 HE3 LYS A 30 13.414 -4.609 21.535 1.00 12.42 H new ATOM 0 HZ1 LYS A 30 13.833 -3.560 23.655 1.00 4.12 H new ATOM 0 HZ2 LYS A 30 14.959 -3.002 22.512 1.00 4.12 H new ATOM 0 HZ3 LYS A 30 13.657 -2.014 22.975 1.00 4.12 H new ATOM 495 N PHE A 31 9.380 0.091 19.713 1.00 14.42 N ATOM 496 CA PHE A 31 9.149 1.297 20.501 1.00 22.53 C ATOM 497 C PHE A 31 9.812 1.186 21.871 1.00 23.30 C ATOM 498 O PHE A 31 9.605 0.212 22.595 1.00 4.14 O ATOM 499 CB PHE A 31 7.648 1.544 20.667 1.00 23.22 C ATOM 500 CG PHE A 31 6.891 1.527 19.370 1.00 1.22 C ATOM 501 CD1 PHE A 31 6.497 0.328 18.798 1.00 41.51 C ATOM 502 CD2 PHE A 31 6.574 2.711 18.723 1.00 73.41 C ATOM 503 CE1 PHE A 31 5.800 0.310 17.605 1.00 72.34 C ATOM 504 CE2 PHE A 31 5.876 2.698 17.530 1.00 63.02 C ATOM 505 CZ PHE A 31 5.490 1.496 16.969 1.00 10.13 C ATOM 0 H PHE A 31 8.707 -0.657 19.879 1.00 14.42 H new ATOM 0 HA PHE A 31 9.592 2.139 19.969 1.00 22.53 H new ATOM 0 HB2 PHE A 31 7.234 0.784 21.330 1.00 23.22 H new ATOM 0 HB3 PHE A 31 7.498 2.508 21.153 1.00 23.22 H new ATOM 0 HD1 PHE A 31 6.737 -0.603 19.290 1.00 41.51 H new ATOM 0 HD2 PHE A 31 6.875 3.654 19.155 1.00 73.41 H new ATOM 0 HE1 PHE A 31 5.498 -0.631 17.170 1.00 72.34 H new ATOM 0 HE2 PHE A 31 5.632 3.627 17.037 1.00 63.02 H new ATOM 0 HZ PHE A 31 4.947 1.484 16.035 1.00 10.13 H new ATOM 515 N TRP A 32 10.610 2.189 22.218 1.00 13.32 N ATOM 516 CA TRP A 32 11.304 2.205 23.501 1.00 63.24 C ATOM 517 C TRP A 32 11.329 3.611 24.089 1.00 12.04 C ATOM 518 O TRP A 32 10.690 4.524 23.567 1.00 60.33 O ATOM 519 CB TRP A 32 12.732 1.682 23.337 1.00 45.22 C ATOM 520 CG TRP A 32 13.542 2.467 22.349 1.00 24.42 C ATOM 521 CD1 TRP A 32 13.362 2.515 20.996 1.00 4.13 C ATOM 522 CD2 TRP A 32 14.661 3.313 22.638 1.00 75.11 C ATOM 523 NE1 TRP A 32 14.302 3.341 20.426 1.00 35.45 N ATOM 524 CE2 TRP A 32 15.109 3.843 21.412 1.00 0.13 C ATOM 525 CE3 TRP A 32 15.325 3.676 23.812 1.00 2.12 C ATOM 526 CZ2 TRP A 32 16.192 4.715 21.330 1.00 34.23 C ATOM 527 CZ3 TRP A 32 16.400 4.541 23.729 1.00 13.11 C ATOM 528 CH2 TRP A 32 16.824 5.053 22.496 1.00 51.33 C ATOM 0 H TRP A 32 10.793 3.002 21.629 1.00 13.32 H new ATOM 0 HA TRP A 32 10.762 1.554 24.188 1.00 63.24 H new ATOM 0 HB2 TRP A 32 13.233 1.703 24.305 1.00 45.22 H new ATOM 0 HB3 TRP A 32 12.696 0.640 23.020 1.00 45.22 H new ATOM 0 HD1 TRP A 32 12.595 1.983 20.454 1.00 4.13 H new ATOM 0 HE1 TRP A 32 14.385 3.546 19.430 1.00 35.45 H new ATOM 0 HE3 TRP A 32 15.004 3.288 24.767 1.00 2.12 H new ATOM 0 HZ2 TRP A 32 16.521 5.110 20.380 1.00 34.23 H new ATOM 0 HZ3 TRP A 32 16.922 4.827 24.630 1.00 13.11 H new ATOM 0 HH2 TRP A 32 17.667 5.728 22.465 1.00 51.33 H new ATOM 539 N ALA A 33 12.070 3.779 25.180 1.00 61.33 N ATOM 540 CA ALA A 33 12.179 5.075 25.838 1.00 72.24 C ATOM 541 C ALA A 33 13.433 5.148 26.702 1.00 40.21 C ATOM 542 O ALA A 33 13.928 4.129 27.183 1.00 74.32 O ATOM 543 CB ALA A 33 10.940 5.346 26.678 1.00 32.41 C ATOM 0 H ALA A 33 12.604 3.033 25.627 1.00 61.33 H new ATOM 0 HA ALA A 33 12.256 5.841 25.067 1.00 72.24 H new ATOM 0 HB1 ALA A 33 11.035 6.317 27.164 1.00 32.41 H new ATOM 0 HB2 ALA A 33 10.059 5.346 26.037 1.00 32.41 H new ATOM 0 HB3 ALA A 33 10.838 4.570 27.436 1.00 32.41 H new ATOM 549 N SER A 34 13.943 6.360 26.895 1.00 42.35 N ATOM 550 CA SER A 34 15.143 6.566 27.697 1.00 20.14 C ATOM 551 C SER A 34 14.878 6.240 29.164 1.00 33.20 C ATOM 552 O SER A 34 15.805 5.986 29.932 1.00 4.23 O ATOM 553 CB SER A 34 15.630 8.010 27.564 1.00 0.14 C ATOM 554 OG SER A 34 15.622 8.428 26.210 1.00 14.55 O ATOM 0 H SER A 34 13.544 7.214 26.507 1.00 42.35 H new ATOM 0 HA SER A 34 15.917 5.894 27.327 1.00 20.14 H new ATOM 0 HB2 SER A 34 14.993 8.668 28.155 1.00 0.14 H new ATOM 0 HB3 SER A 34 16.639 8.096 27.968 1.00 0.14 H new ATOM 0 HG SER A 34 16.367 8.006 25.733 1.00 14.55 H new ATOM 560 N TRP A 35 13.605 6.249 29.544 1.00 23.23 N ATOM 561 CA TRP A 35 13.217 5.954 30.919 1.00 54.11 C ATOM 562 C TRP A 35 12.850 4.483 31.078 1.00 63.45 C ATOM 563 O TRP A 35 12.075 4.117 31.962 1.00 42.32 O ATOM 564 CB TRP A 35 12.037 6.834 31.337 1.00 62.12 C ATOM 565 CG TRP A 35 10.842 6.689 30.444 1.00 21.41 C ATOM 566 CD1 TRP A 35 10.617 7.338 29.264 1.00 13.42 C ATOM 567 CD2 TRP A 35 9.709 5.841 30.661 1.00 55.42 C ATOM 568 NE1 TRP A 35 9.411 6.946 28.734 1.00 0.24 N ATOM 569 CE2 TRP A 35 8.835 6.028 29.572 1.00 72.24 C ATOM 570 CE3 TRP A 35 9.347 4.942 31.667 1.00 3.05 C ATOM 571 CZ2 TRP A 35 7.624 5.349 29.464 1.00 22.41 C ATOM 572 CZ3 TRP A 35 8.145 4.269 31.559 1.00 23.15 C ATOM 573 CH2 TRP A 35 7.296 4.474 30.464 1.00 12.22 C ATOM 0 H TRP A 35 12.825 6.457 28.920 1.00 23.23 H new ATOM 0 HA TRP A 35 14.069 6.168 31.564 1.00 54.11 H new ATOM 0 HB2 TRP A 35 11.751 6.584 32.359 1.00 62.12 H new ATOM 0 HB3 TRP A 35 12.354 7.877 31.341 1.00 62.12 H new ATOM 0 HD1 TRP A 35 11.288 8.054 28.813 1.00 13.42 H new ATOM 0 HE1 TRP A 35 9.010 7.284 27.859 1.00 0.24 H new ATOM 0 HE3 TRP A 35 9.995 4.776 32.515 1.00 3.05 H new ATOM 0 HZ2 TRP A 35 6.967 5.507 28.621 1.00 22.41 H new ATOM 0 HZ3 TRP A 35 7.855 3.573 32.332 1.00 23.15 H new ATOM 0 HH2 TRP A 35 6.364 3.931 30.408 1.00 12.22 H new ATOM 584 N CYS A 36 13.412 3.641 30.216 1.00 3.21 N ATOM 585 CA CYS A 36 13.145 2.209 30.260 1.00 32.22 C ATOM 586 C CYS A 36 14.441 1.418 30.412 1.00 32.24 C ATOM 587 O CYS A 36 15.338 1.480 29.571 1.00 33.12 O ATOM 588 CB CYS A 36 12.410 1.767 28.993 1.00 64.31 C ATOM 589 SG CYS A 36 12.070 -0.021 28.916 1.00 33.35 S ATOM 0 H CYS A 36 14.056 3.927 29.478 1.00 3.21 H new ATOM 0 HA CYS A 36 12.515 2.009 31.126 1.00 32.22 H new ATOM 0 HB2 CYS A 36 11.466 2.309 28.926 1.00 64.31 H new ATOM 0 HB3 CYS A 36 13.003 2.051 28.124 1.00 64.31 H new ATOM 594 N PRO A 37 14.543 0.655 31.511 1.00 0.41 N ATOM 595 CA PRO A 37 15.724 -0.163 31.800 1.00 64.14 C ATOM 596 C PRO A 37 15.856 -1.347 30.847 1.00 4.51 C ATOM 597 O PRO A 37 16.926 -1.590 30.288 1.00 45.14 O ATOM 598 CB PRO A 37 15.477 -0.652 33.229 1.00 73.22 C ATOM 599 CG PRO A 37 13.996 -0.623 33.388 1.00 52.30 C ATOM 600 CD PRO A 37 13.513 0.533 32.556 1.00 12.22 C ATOM 0 HA PRO A 37 16.649 0.401 31.683 1.00 64.14 H new ATOM 0 HB2 PRO A 37 15.872 -1.657 33.377 1.00 73.22 H new ATOM 0 HB3 PRO A 37 15.966 -0.007 33.959 1.00 73.22 H new ATOM 0 HG2 PRO A 37 13.549 -1.559 33.053 1.00 52.30 H new ATOM 0 HG3 PRO A 37 13.718 -0.494 34.434 1.00 52.30 H new ATOM 0 HD2 PRO A 37 12.529 0.338 32.130 1.00 12.22 H new ATOM 0 HD3 PRO A 37 13.429 1.446 33.146 1.00 12.22 H new ATOM 608 N LEU A 38 14.763 -2.079 30.666 1.00 22.23 N ATOM 609 CA LEU A 38 14.757 -3.238 29.780 1.00 54.11 C ATOM 610 C LEU A 38 14.985 -2.817 28.332 1.00 44.12 C ATOM 611 O LEU A 38 15.272 -3.649 27.470 1.00 12.40 O ATOM 612 CB LEU A 38 13.430 -3.990 29.901 1.00 40.30 C ATOM 613 CG LEU A 38 13.004 -4.375 31.318 1.00 14.20 C ATOM 614 CD1 LEU A 38 11.579 -4.908 31.321 1.00 43.14 C ATOM 615 CD2 LEU A 38 13.961 -5.403 31.902 1.00 21.41 C ATOM 0 H LEU A 38 13.869 -1.891 31.121 1.00 22.23 H new ATOM 0 HA LEU A 38 15.571 -3.898 30.080 1.00 54.11 H new ATOM 0 HB2 LEU A 38 12.645 -3.374 29.462 1.00 40.30 H new ATOM 0 HB3 LEU A 38 13.495 -4.899 29.303 1.00 40.30 H new ATOM 0 HG LEU A 38 13.037 -3.482 31.942 1.00 14.20 H new ATOM 0 HD11 LEU A 38 11.293 -5.177 32.338 1.00 43.14 H new ATOM 0 HD12 LEU A 38 10.903 -4.140 30.945 1.00 43.14 H new ATOM 0 HD13 LEU A 38 11.519 -5.789 30.682 1.00 43.14 H new ATOM 0 HD21 LEU A 38 13.642 -5.665 32.911 1.00 21.41 H new ATOM 0 HD22 LEU A 38 13.961 -6.296 31.278 1.00 21.41 H new ATOM 0 HD23 LEU A 38 14.967 -4.985 31.937 1.00 21.41 H new ATOM 627 N CYS A 39 14.859 -1.520 28.071 1.00 22.10 N ATOM 628 CA CYS A 39 15.054 -0.987 26.728 1.00 34.11 C ATOM 629 C CYS A 39 16.450 -0.391 26.576 1.00 23.52 C ATOM 630 O CYS A 39 17.205 -0.771 25.680 1.00 23.52 O ATOM 631 CB CYS A 39 13.997 0.076 26.421 1.00 5.50 C ATOM 632 SG CYS A 39 12.298 -0.416 26.855 1.00 2.01 S ATOM 0 H CYS A 39 14.623 -0.818 28.773 1.00 22.10 H new ATOM 0 HA CYS A 39 14.951 -1.809 26.019 1.00 34.11 H new ATOM 0 HB2 CYS A 39 14.248 0.989 26.961 1.00 5.50 H new ATOM 0 HB3 CYS A 39 14.034 0.314 25.358 1.00 5.50 H new ATOM 637 N LEU A 40 16.787 0.544 27.457 1.00 25.44 N ATOM 638 CA LEU A 40 18.094 1.192 27.422 1.00 14.55 C ATOM 639 C LEU A 40 19.216 0.162 27.499 1.00 53.10 C ATOM 640 O LEU A 40 20.237 0.291 26.824 1.00 23.14 O ATOM 641 CB LEU A 40 18.221 2.189 28.576 1.00 21.22 C ATOM 642 CG LEU A 40 19.152 3.378 28.337 1.00 61.25 C ATOM 643 CD1 LEU A 40 18.350 4.620 27.982 1.00 45.51 C ATOM 644 CD2 LEU A 40 20.019 3.632 29.561 1.00 21.41 C ATOM 0 H LEU A 40 16.174 0.871 28.204 1.00 25.44 H new ATOM 0 HA LEU A 40 18.182 1.726 26.476 1.00 14.55 H new ATOM 0 HB2 LEU A 40 17.228 2.572 28.809 1.00 21.22 H new ATOM 0 HB3 LEU A 40 18.570 1.651 29.457 1.00 21.22 H new ATOM 0 HG LEU A 40 19.806 3.140 27.498 1.00 61.25 H new ATOM 0 HD11 LEU A 40 19.029 5.456 27.815 1.00 45.51 H new ATOM 0 HD12 LEU A 40 17.774 4.434 27.076 1.00 45.51 H new ATOM 0 HD13 LEU A 40 17.671 4.861 28.800 1.00 45.51 H new ATOM 0 HD21 LEU A 40 20.675 4.482 29.372 1.00 21.41 H new ATOM 0 HD22 LEU A 40 19.383 3.848 30.419 1.00 21.41 H new ATOM 0 HD23 LEU A 40 20.621 2.748 29.770 1.00 21.41 H new ATOM 656 N SER A 41 19.017 -0.861 28.324 1.00 63.34 N ATOM 657 CA SER A 41 20.013 -1.914 28.489 1.00 1.55 C ATOM 658 C SER A 41 20.012 -2.856 27.290 1.00 62.21 C ATOM 659 O SER A 41 21.000 -3.541 27.025 1.00 52.30 O ATOM 660 CB SER A 41 19.744 -2.702 29.772 1.00 32.15 C ATOM 661 OG SER A 41 20.951 -3.181 30.340 1.00 51.22 O ATOM 0 H SER A 41 18.176 -0.983 28.888 1.00 63.34 H new ATOM 0 HA SER A 41 20.994 -1.444 28.558 1.00 1.55 H new ATOM 0 HB2 SER A 41 19.227 -2.066 30.491 1.00 32.15 H new ATOM 0 HB3 SER A 41 19.083 -3.541 29.555 1.00 32.15 H new ATOM 0 HG SER A 41 20.751 -3.680 31.160 1.00 51.22 H new ATOM 667 N GLU A 42 18.896 -2.885 26.569 1.00 72.13 N ATOM 668 CA GLU A 42 18.766 -3.744 25.398 1.00 72.33 C ATOM 669 C GLU A 42 19.179 -3.002 24.130 1.00 73.21 C ATOM 670 O GLU A 42 19.106 -3.546 23.027 1.00 51.20 O ATOM 671 CB GLU A 42 17.326 -4.245 25.263 1.00 63.44 C ATOM 672 CG GLU A 42 17.061 -5.542 26.009 1.00 73.14 C ATOM 673 CD GLU A 42 15.933 -6.349 25.394 1.00 43.53 C ATOM 674 OE1 GLU A 42 15.364 -5.894 24.379 1.00 5.21 O ATOM 675 OE2 GLU A 42 15.620 -7.433 25.927 1.00 73.33 O ATOM 0 H GLU A 42 18.069 -2.324 26.775 1.00 72.13 H new ATOM 0 HA GLU A 42 19.430 -4.598 25.530 1.00 72.33 H new ATOM 0 HB2 GLU A 42 16.647 -3.477 25.633 1.00 63.44 H new ATOM 0 HB3 GLU A 42 17.098 -4.390 24.207 1.00 63.44 H new ATOM 0 HG2 GLU A 42 17.970 -6.144 26.018 1.00 73.14 H new ATOM 0 HG3 GLU A 42 16.817 -5.316 27.047 1.00 73.14 H new ATOM 682 N LEU A 43 19.612 -1.757 24.295 1.00 74.21 N ATOM 683 CA LEU A 43 20.036 -0.939 23.164 1.00 2.34 C ATOM 684 C LEU A 43 21.029 -1.695 22.287 1.00 11.31 C ATOM 685 O LEU A 43 20.854 -1.788 21.073 1.00 44.32 O ATOM 686 CB LEU A 43 20.666 0.364 23.661 1.00 52.14 C ATOM 687 CG LEU A 43 19.696 1.412 24.208 1.00 3.14 C ATOM 688 CD1 LEU A 43 20.452 2.497 24.961 1.00 72.44 C ATOM 689 CD2 LEU A 43 18.873 2.017 23.081 1.00 15.32 C ATOM 0 H LEU A 43 19.679 -1.292 25.200 1.00 74.21 H new ATOM 0 HA LEU A 43 19.156 -0.705 22.565 1.00 2.34 H new ATOM 0 HB2 LEU A 43 21.386 0.121 24.443 1.00 52.14 H new ATOM 0 HB3 LEU A 43 21.226 0.810 22.839 1.00 52.14 H new ATOM 0 HG LEU A 43 19.016 0.922 24.904 1.00 3.14 H new ATOM 0 HD11 LEU A 43 19.746 3.234 25.343 1.00 72.44 H new ATOM 0 HD12 LEU A 43 20.996 2.051 25.793 1.00 72.44 H new ATOM 0 HD13 LEU A 43 21.156 2.985 24.287 1.00 72.44 H new ATOM 0 HD21 LEU A 43 18.188 2.761 23.489 1.00 15.32 H new ATOM 0 HD22 LEU A 43 19.538 2.493 22.360 1.00 15.32 H new ATOM 0 HD23 LEU A 43 18.302 1.232 22.585 1.00 15.32 H new ATOM 701 N GLY A 44 22.071 -2.235 22.912 1.00 72.44 N ATOM 702 CA GLY A 44 23.075 -2.978 22.173 1.00 72.33 C ATOM 703 C GLY A 44 22.484 -4.141 21.401 1.00 61.34 C ATOM 704 O GLY A 44 22.821 -4.356 20.236 1.00 14.25 O ATOM 0 H GLY A 44 22.238 -2.171 23.916 1.00 72.44 H new ATOM 0 HA2 GLY A 44 23.583 -2.307 21.480 1.00 72.33 H new ATOM 0 HA3 GLY A 44 23.829 -3.351 22.866 1.00 72.33 H new ATOM 708 N GLN A 45 21.603 -4.894 22.051 1.00 74.34 N ATOM 709 CA GLN A 45 20.966 -6.043 21.417 1.00 22.34 C ATOM 710 C GLN A 45 20.377 -5.662 20.064 1.00 51.35 C ATOM 711 O GLN A 45 20.712 -6.256 19.038 1.00 34.12 O ATOM 712 CB GLN A 45 19.871 -6.609 22.323 1.00 73.34 C ATOM 713 CG GLN A 45 19.013 -7.669 21.650 1.00 52.31 C ATOM 714 CD GLN A 45 18.354 -8.604 22.645 1.00 71.04 C ATOM 715 OE1 GLN A 45 17.426 -8.218 23.356 1.00 74.52 O ATOM 716 NE2 GLN A 45 18.831 -9.842 22.700 1.00 44.14 N ATOM 0 H GLN A 45 21.314 -4.730 23.015 1.00 74.34 H new ATOM 0 HA GLN A 45 21.727 -6.807 21.258 1.00 22.34 H new ATOM 0 HB2 GLN A 45 20.332 -7.038 23.213 1.00 73.34 H new ATOM 0 HB3 GLN A 45 19.230 -5.793 22.658 1.00 73.34 H new ATOM 0 HG2 GLN A 45 18.244 -7.182 21.051 1.00 52.31 H new ATOM 0 HG3 GLN A 45 19.631 -8.250 20.965 1.00 52.31 H new ATOM 0 HE21 GLN A 45 19.602 -10.119 22.092 1.00 44.14 H new ATOM 0 HE22 GLN A 45 18.427 -10.516 23.350 1.00 44.14 H new ATOM 725 N THR A 46 19.496 -4.666 20.066 1.00 3.44 N ATOM 726 CA THR A 46 18.859 -4.205 18.839 1.00 31.42 C ATOM 727 C THR A 46 19.893 -3.714 17.833 1.00 4.33 C ATOM 728 O THR A 46 19.743 -3.912 16.628 1.00 21.23 O ATOM 729 CB THR A 46 17.853 -3.073 19.119 1.00 1.12 C ATOM 730 OG1 THR A 46 16.813 -3.544 19.983 1.00 74.12 O ATOM 731 CG2 THR A 46 17.248 -2.554 17.824 1.00 74.35 C ATOM 0 H THR A 46 19.207 -4.163 20.905 1.00 3.44 H new ATOM 0 HA THR A 46 18.326 -5.059 18.420 1.00 31.42 H new ATOM 0 HB THR A 46 18.386 -2.256 19.605 1.00 1.12 H new ATOM 0 HG1 THR A 46 16.179 -2.818 20.157 1.00 74.12 H new ATOM 0 HG21 THR A 46 16.541 -1.755 18.047 1.00 74.35 H new ATOM 0 HG22 THR A 46 18.040 -2.169 17.181 1.00 74.35 H new ATOM 0 HG23 THR A 46 16.729 -3.366 17.314 1.00 74.35 H new ATOM 739 N GLU A 47 20.943 -3.072 18.337 1.00 63.23 N ATOM 740 CA GLU A 47 22.003 -2.552 17.480 1.00 33.41 C ATOM 741 C GLU A 47 22.689 -3.682 16.717 1.00 11.11 C ATOM 742 O GLU A 47 23.144 -3.497 15.588 1.00 21.31 O ATOM 743 CB GLU A 47 23.032 -1.786 18.313 1.00 42.42 C ATOM 744 CG GLU A 47 24.350 -1.557 17.592 1.00 70.24 C ATOM 745 CD GLU A 47 24.910 -0.168 17.826 1.00 2.22 C ATOM 746 OE1 GLU A 47 25.544 0.045 18.881 1.00 12.42 O ATOM 747 OE2 GLU A 47 24.715 0.706 16.956 1.00 41.01 O ATOM 0 H GLU A 47 21.082 -2.900 19.333 1.00 63.23 H new ATOM 0 HA GLU A 47 21.551 -1.872 16.758 1.00 33.41 H new ATOM 0 HB2 GLU A 47 22.611 -0.822 18.598 1.00 42.42 H new ATOM 0 HB3 GLU A 47 23.223 -2.336 19.235 1.00 42.42 H new ATOM 0 HG2 GLU A 47 25.076 -2.298 17.926 1.00 70.24 H new ATOM 0 HG3 GLU A 47 24.206 -1.711 16.523 1.00 70.24 H new ATOM 754 N LYS A 48 22.760 -4.852 17.342 1.00 30.22 N ATOM 755 CA LYS A 48 23.389 -6.013 16.724 1.00 24.23 C ATOM 756 C LYS A 48 22.429 -6.705 15.762 1.00 42.11 C ATOM 757 O LYS A 48 22.851 -7.299 14.770 1.00 41.03 O ATOM 758 CB LYS A 48 23.851 -7.001 17.798 1.00 3.33 C ATOM 759 CG LYS A 48 24.685 -6.361 18.895 1.00 14.31 C ATOM 760 CD LYS A 48 26.085 -6.948 18.946 1.00 30.22 C ATOM 761 CE LYS A 48 26.950 -6.239 19.977 1.00 53.21 C ATOM 762 NZ LYS A 48 27.349 -4.878 19.524 1.00 53.52 N ATOM 0 H LYS A 48 22.389 -5.021 18.277 1.00 30.22 H new ATOM 0 HA LYS A 48 24.255 -5.667 16.160 1.00 24.23 H new ATOM 0 HB2 LYS A 48 22.977 -7.473 18.246 1.00 3.33 H new ATOM 0 HB3 LYS A 48 24.433 -7.792 17.326 1.00 3.33 H new ATOM 0 HG2 LYS A 48 24.746 -5.286 18.726 1.00 14.31 H new ATOM 0 HG3 LYS A 48 24.194 -6.505 19.857 1.00 14.31 H new ATOM 0 HD2 LYS A 48 26.027 -8.010 19.187 1.00 30.22 H new ATOM 0 HD3 LYS A 48 26.550 -6.869 17.963 1.00 30.22 H new ATOM 0 HE2 LYS A 48 26.405 -6.163 20.918 1.00 53.21 H new ATOM 0 HE3 LYS A 48 27.843 -6.833 20.172 1.00 53.21 H new ATOM 0 HZ1 LYS A 48 28.032 -4.474 20.197 1.00 53.52 H new ATOM 0 HZ2 LYS A 48 27.786 -4.940 18.582 1.00 53.52 H new ATOM 0 HZ3 LYS A 48 26.508 -4.268 19.476 1.00 53.52 H new ATOM 776 N TRP A 49 21.138 -6.622 16.061 1.00 71.31 N ATOM 777 CA TRP A 49 20.118 -7.240 15.221 1.00 50.44 C ATOM 778 C TRP A 49 20.077 -6.584 13.844 1.00 32.45 C ATOM 779 O TRP A 49 20.149 -7.264 12.821 1.00 1.11 O ATOM 780 CB TRP A 49 18.746 -7.137 15.889 1.00 2.33 C ATOM 781 CG TRP A 49 18.611 -8.005 17.104 1.00 52.34 C ATOM 782 CD1 TRP A 49 19.619 -8.631 17.780 1.00 54.10 C ATOM 783 CD2 TRP A 49 17.397 -8.344 17.784 1.00 44.51 C ATOM 784 NE1 TRP A 49 19.105 -9.339 18.840 1.00 54.33 N ATOM 785 CE2 TRP A 49 17.745 -9.178 18.864 1.00 14.14 C ATOM 786 CE3 TRP A 49 16.052 -8.022 17.587 1.00 51.32 C ATOM 787 CZ2 TRP A 49 16.794 -9.694 19.741 1.00 1.34 C ATOM 788 CZ3 TRP A 49 15.110 -8.535 18.458 1.00 52.31 C ATOM 789 CH2 TRP A 49 15.484 -9.362 19.525 1.00 62.43 C ATOM 0 H TRP A 49 20.772 -6.133 16.878 1.00 71.31 H new ATOM 0 HA TRP A 49 20.375 -8.292 15.095 1.00 50.44 H new ATOM 0 HB2 TRP A 49 18.563 -6.100 16.170 1.00 2.33 H new ATOM 0 HB3 TRP A 49 17.977 -7.412 15.167 1.00 2.33 H new ATOM 0 HD1 TRP A 49 20.666 -8.578 17.520 1.00 54.10 H new ATOM 0 HE1 TRP A 49 19.648 -9.894 19.501 1.00 54.33 H new ATOM 0 HE3 TRP A 49 15.754 -7.384 16.769 1.00 51.32 H new ATOM 0 HZ2 TRP A 49 17.080 -10.334 20.563 1.00 1.34 H new ATOM 0 HZ3 TRP A 49 14.067 -8.294 18.314 1.00 52.31 H new ATOM 0 HH2 TRP A 49 14.724 -9.745 20.190 1.00 62.43 H new ATOM 800 N ALA A 50 19.961 -5.261 13.827 1.00 14.43 N ATOM 801 CA ALA A 50 19.912 -4.514 12.576 1.00 22.23 C ATOM 802 C ALA A 50 21.225 -4.641 11.810 1.00 13.23 C ATOM 803 O ALA A 50 21.316 -4.243 10.649 1.00 24.52 O ATOM 804 CB ALA A 50 19.596 -3.051 12.847 1.00 51.33 C ATOM 0 H ALA A 50 19.899 -4.684 14.666 1.00 14.43 H new ATOM 0 HA ALA A 50 19.119 -4.937 11.959 1.00 22.23 H new ATOM 0 HB1 ALA A 50 19.563 -2.505 11.904 1.00 51.33 H new ATOM 0 HB2 ALA A 50 18.630 -2.974 13.345 1.00 51.33 H new ATOM 0 HB3 ALA A 50 20.369 -2.624 13.486 1.00 51.33 H new ATOM 810 N GLN A 51 22.237 -5.196 12.468 1.00 4.24 N ATOM 811 CA GLN A 51 23.545 -5.373 11.848 1.00 2.25 C ATOM 812 C GLN A 51 23.802 -6.842 11.530 1.00 24.13 C ATOM 813 O GLN A 51 24.719 -7.173 10.777 1.00 34.15 O ATOM 814 CB GLN A 51 24.645 -4.837 12.767 1.00 61.51 C ATOM 815 CG GLN A 51 24.530 -3.348 13.050 1.00 31.41 C ATOM 816 CD GLN A 51 25.390 -2.510 12.125 1.00 73.23 C ATOM 817 OE1 GLN A 51 26.615 -2.634 12.115 1.00 73.02 O ATOM 818 NE2 GLN A 51 24.751 -1.650 11.340 1.00 71.31 N ATOM 0 H GLN A 51 22.177 -5.531 13.430 1.00 4.24 H new ATOM 0 HA GLN A 51 23.556 -4.811 10.914 1.00 2.25 H new ATOM 0 HB2 GLN A 51 24.615 -5.381 13.711 1.00 61.51 H new ATOM 0 HB3 GLN A 51 25.616 -5.038 12.314 1.00 61.51 H new ATOM 0 HG2 GLN A 51 23.489 -3.042 12.948 1.00 31.41 H new ATOM 0 HG3 GLN A 51 24.819 -3.155 14.083 1.00 31.41 H new ATOM 0 HE21 GLN A 51 23.734 -1.580 11.381 1.00 71.31 H new ATOM 0 HE22 GLN A 51 25.277 -1.059 10.696 1.00 71.31 H new ATOM 827 N ASP A 52 22.989 -7.719 12.109 1.00 52.44 N ATOM 828 CA ASP A 52 23.128 -9.153 11.886 1.00 32.12 C ATOM 829 C ASP A 52 22.789 -9.515 10.443 1.00 11.35 C ATOM 830 O ASP A 52 21.697 -9.218 9.959 1.00 20.51 O ATOM 831 CB ASP A 52 22.224 -9.929 12.845 1.00 22.44 C ATOM 832 CG ASP A 52 22.867 -11.212 13.336 1.00 74.14 C ATOM 833 OD1 ASP A 52 23.949 -11.135 13.955 1.00 74.32 O ATOM 834 OD2 ASP A 52 22.287 -12.293 13.101 1.00 50.11 O ATOM 0 H ASP A 52 22.227 -7.462 12.736 1.00 52.44 H new ATOM 0 HA ASP A 52 24.166 -9.426 12.075 1.00 32.12 H new ATOM 0 HB2 ASP A 52 21.979 -9.298 13.700 1.00 22.44 H new ATOM 0 HB3 ASP A 52 21.285 -10.165 12.344 1.00 22.44 H new ATOM 839 N ALA A 53 23.733 -10.156 9.762 1.00 51.50 N ATOM 840 CA ALA A 53 23.534 -10.558 8.375 1.00 30.02 C ATOM 841 C ALA A 53 22.266 -11.391 8.222 1.00 71.01 C ATOM 842 O ALA A 53 21.581 -11.317 7.201 1.00 3.22 O ATOM 843 CB ALA A 53 24.742 -11.335 7.873 1.00 50.33 C ATOM 0 H ALA A 53 24.643 -10.408 10.148 1.00 51.50 H new ATOM 0 HA ALA A 53 23.420 -9.656 7.773 1.00 30.02 H new ATOM 0 HB1 ALA A 53 24.580 -11.629 6.836 1.00 50.33 H new ATOM 0 HB2 ALA A 53 25.631 -10.707 7.938 1.00 50.33 H new ATOM 0 HB3 ALA A 53 24.882 -12.226 8.485 1.00 50.33 H new ATOM 849 N LYS A 54 21.958 -12.185 9.242 1.00 41.21 N ATOM 850 CA LYS A 54 20.772 -13.032 9.222 1.00 73.22 C ATOM 851 C LYS A 54 19.501 -12.190 9.258 1.00 53.42 C ATOM 852 O LYS A 54 18.445 -12.621 8.793 1.00 10.54 O ATOM 853 CB LYS A 54 20.790 -13.998 10.408 1.00 34.44 C ATOM 854 CG LYS A 54 21.404 -15.349 10.084 1.00 40.01 C ATOM 855 CD LYS A 54 21.390 -16.272 11.291 1.00 65.24 C ATOM 856 CE LYS A 54 20.118 -17.104 11.342 1.00 63.44 C ATOM 857 NZ LYS A 54 20.184 -18.275 10.424 1.00 64.40 N ATOM 0 H LYS A 54 22.514 -12.259 10.094 1.00 41.21 H new ATOM 0 HA LYS A 54 20.781 -13.605 8.295 1.00 73.22 H new ATOM 0 HB2 LYS A 54 21.346 -13.543 11.228 1.00 34.44 H new ATOM 0 HB3 LYS A 54 19.769 -14.147 10.759 1.00 34.44 H new ATOM 0 HG2 LYS A 54 20.855 -15.812 9.264 1.00 40.01 H new ATOM 0 HG3 LYS A 54 22.430 -15.211 9.742 1.00 40.01 H new ATOM 0 HD2 LYS A 54 22.257 -16.932 11.255 1.00 65.24 H new ATOM 0 HD3 LYS A 54 21.476 -15.681 12.203 1.00 65.24 H new ATOM 0 HE2 LYS A 54 19.952 -17.451 12.362 1.00 63.44 H new ATOM 0 HE3 LYS A 54 19.265 -16.480 11.074 1.00 63.44 H new ATOM 0 HZ1 LYS A 54 19.298 -18.817 10.488 1.00 64.40 H new ATOM 0 HZ2 LYS A 54 20.317 -17.943 9.447 1.00 64.40 H new ATOM 0 HZ3 LYS A 54 20.982 -18.884 10.695 1.00 64.40 H new ATOM 871 N PHE A 55 19.609 -10.986 9.811 1.00 65.21 N ATOM 872 CA PHE A 55 18.469 -10.083 9.907 1.00 54.13 C ATOM 873 C PHE A 55 18.232 -9.363 8.582 1.00 32.51 C ATOM 874 O PHE A 55 17.202 -8.716 8.390 1.00 24.33 O ATOM 875 CB PHE A 55 18.693 -9.060 11.022 1.00 22.24 C ATOM 876 CG PHE A 55 17.958 -9.386 12.291 1.00 24.22 C ATOM 877 CD1 PHE A 55 16.573 -9.412 12.318 1.00 24.31 C ATOM 878 CD2 PHE A 55 18.653 -9.666 13.457 1.00 12.11 C ATOM 879 CE1 PHE A 55 15.894 -9.712 13.484 1.00 60.31 C ATOM 880 CE2 PHE A 55 17.979 -9.967 14.626 1.00 50.13 C ATOM 881 CZ PHE A 55 16.598 -9.989 14.639 1.00 10.14 C ATOM 0 H PHE A 55 20.475 -10.614 10.200 1.00 65.21 H new ATOM 0 HA PHE A 55 17.586 -10.678 10.141 1.00 54.13 H new ATOM 0 HB2 PHE A 55 19.760 -8.995 11.236 1.00 22.24 H new ATOM 0 HB3 PHE A 55 18.378 -8.077 10.671 1.00 22.24 H new ATOM 0 HD1 PHE A 55 16.017 -9.195 11.418 1.00 24.31 H new ATOM 0 HD2 PHE A 55 19.733 -9.649 13.452 1.00 12.11 H new ATOM 0 HE1 PHE A 55 14.814 -9.730 13.492 1.00 60.31 H new ATOM 0 HE2 PHE A 55 18.532 -10.185 15.528 1.00 50.13 H new ATOM 0 HZ PHE A 55 16.070 -10.223 15.551 1.00 10.14 H new ATOM 891 N SER A 56 19.193 -9.481 7.671 1.00 33.44 N ATOM 892 CA SER A 56 19.092 -8.839 6.366 1.00 32.21 C ATOM 893 C SER A 56 17.820 -9.274 5.643 1.00 25.25 C ATOM 894 O SER A 56 17.345 -8.592 4.736 1.00 33.00 O ATOM 895 CB SER A 56 20.317 -9.175 5.513 1.00 11.51 C ATOM 896 OG SER A 56 20.482 -8.234 4.466 1.00 72.42 O ATOM 0 H SER A 56 20.050 -10.015 7.813 1.00 33.44 H new ATOM 0 HA SER A 56 19.050 -7.761 6.521 1.00 32.21 H new ATOM 0 HB2 SER A 56 21.209 -9.187 6.140 1.00 11.51 H new ATOM 0 HB3 SER A 56 20.209 -10.175 5.094 1.00 11.51 H new ATOM 0 HG SER A 56 21.272 -8.469 3.936 1.00 72.42 H new ATOM 902 N SER A 57 17.275 -10.415 6.053 1.00 24.22 N ATOM 903 CA SER A 57 16.061 -10.945 5.443 1.00 3.33 C ATOM 904 C SER A 57 14.872 -10.030 5.719 1.00 35.41 C ATOM 905 O SER A 57 13.824 -10.147 5.083 1.00 24.32 O ATOM 906 CB SER A 57 15.771 -12.351 5.971 1.00 25.04 C ATOM 907 OG SER A 57 16.873 -13.215 5.751 1.00 34.42 O ATOM 0 H SER A 57 17.655 -10.990 6.805 1.00 24.22 H new ATOM 0 HA SER A 57 16.217 -10.995 4.365 1.00 3.33 H new ATOM 0 HB2 SER A 57 15.549 -12.304 7.037 1.00 25.04 H new ATOM 0 HB3 SER A 57 14.886 -12.753 5.478 1.00 25.04 H new ATOM 0 HG SER A 57 16.664 -14.107 6.099 1.00 34.42 H new ATOM 913 N ALA A 58 15.041 -9.120 6.672 1.00 5.02 N ATOM 914 CA ALA A 58 13.984 -8.184 7.032 1.00 54.01 C ATOM 915 C ALA A 58 14.550 -6.965 7.752 1.00 24.33 C ATOM 916 O ALA A 58 15.310 -7.097 8.711 1.00 61.02 O ATOM 917 CB ALA A 58 12.941 -8.874 7.899 1.00 74.04 C ATOM 0 H ALA A 58 15.901 -9.011 7.209 1.00 5.02 H new ATOM 0 HA ALA A 58 13.509 -7.841 6.113 1.00 54.01 H new ATOM 0 HB1 ALA A 58 12.157 -8.163 8.161 1.00 74.04 H new ATOM 0 HB2 ALA A 58 12.505 -9.708 7.349 1.00 74.04 H new ATOM 0 HB3 ALA A 58 13.412 -9.245 8.809 1.00 74.04 H new ATOM 923 N ASN A 59 14.176 -5.779 7.283 1.00 20.34 N ATOM 924 CA ASN A 59 14.649 -4.537 7.883 1.00 52.43 C ATOM 925 C ASN A 59 14.299 -4.481 9.367 1.00 52.34 C ATOM 926 O ASN A 59 13.244 -4.959 9.785 1.00 14.44 O ATOM 927 CB ASN A 59 14.042 -3.333 7.158 1.00 35.53 C ATOM 928 CG ASN A 59 14.055 -3.499 5.651 1.00 43.21 C ATOM 929 OD1 ASN A 59 15.041 -3.960 5.075 1.00 74.21 O ATOM 930 ND2 ASN A 59 12.958 -3.121 5.004 1.00 25.35 N ATOM 0 H ASN A 59 13.547 -5.652 6.490 1.00 20.34 H new ATOM 0 HA ASN A 59 15.734 -4.504 7.783 1.00 52.43 H new ATOM 0 HB2 ASN A 59 13.016 -3.188 7.496 1.00 35.53 H new ATOM 0 HB3 ASN A 59 14.596 -2.433 7.427 1.00 35.53 H new ATOM 0 HD21 ASN A 59 12.909 -3.208 3.989 1.00 25.35 H new ATOM 0 HD22 ASN A 59 12.164 -2.744 5.522 1.00 25.35 H new ATOM 937 N LEU A 60 15.191 -3.894 10.157 1.00 15.22 N ATOM 938 CA LEU A 60 14.976 -3.774 11.595 1.00 25.23 C ATOM 939 C LEU A 60 15.447 -2.416 12.105 1.00 40.43 C ATOM 940 O LEU A 60 16.612 -2.050 11.941 1.00 35.05 O ATOM 941 CB LEU A 60 15.713 -4.892 12.335 1.00 21.13 C ATOM 942 CG LEU A 60 15.126 -5.303 13.686 1.00 5.23 C ATOM 943 CD1 LEU A 60 15.764 -6.594 14.174 1.00 33.55 C ATOM 944 CD2 LEU A 60 15.316 -4.193 14.710 1.00 52.54 C ATOM 0 H LEU A 60 16.069 -3.494 9.827 1.00 15.22 H new ATOM 0 HA LEU A 60 13.907 -3.862 11.786 1.00 25.23 H new ATOM 0 HB2 LEU A 60 15.740 -5.771 11.691 1.00 21.13 H new ATOM 0 HB3 LEU A 60 16.745 -4.579 12.490 1.00 21.13 H new ATOM 0 HG LEU A 60 14.057 -5.475 13.559 1.00 5.23 H new ATOM 0 HD11 LEU A 60 15.334 -6.871 15.137 1.00 33.55 H new ATOM 0 HD12 LEU A 60 15.577 -7.388 13.451 1.00 33.55 H new ATOM 0 HD13 LEU A 60 16.839 -6.450 14.285 1.00 33.55 H new ATOM 0 HD21 LEU A 60 14.892 -4.503 15.665 1.00 52.54 H new ATOM 0 HD22 LEU A 60 16.380 -3.990 14.834 1.00 52.54 H new ATOM 0 HD23 LEU A 60 14.812 -3.290 14.365 1.00 52.54 H new ATOM 956 N ILE A 61 14.535 -1.673 12.724 1.00 61.44 N ATOM 957 CA ILE A 61 14.858 -0.357 13.260 1.00 61.03 C ATOM 958 C ILE A 61 13.996 -0.032 14.475 1.00 51.44 C ATOM 959 O ILE A 61 12.913 -0.591 14.650 1.00 71.21 O ATOM 960 CB ILE A 61 14.669 0.744 12.200 1.00 12.41 C ATOM 961 CG1 ILE A 61 13.194 0.858 11.809 1.00 61.25 C ATOM 962 CG2 ILE A 61 15.527 0.456 10.977 1.00 35.21 C ATOM 963 CD1 ILE A 61 12.912 1.980 10.834 1.00 21.02 C ATOM 0 H ILE A 61 13.567 -1.960 12.866 1.00 61.44 H new ATOM 0 HA ILE A 61 15.906 -0.386 13.559 1.00 61.03 H new ATOM 0 HB ILE A 61 14.987 1.696 12.626 1.00 12.41 H new ATOM 0 HG12 ILE A 61 12.869 -0.085 11.369 1.00 61.25 H new ATOM 0 HG13 ILE A 61 12.599 1.012 12.709 1.00 61.25 H new ATOM 0 HG21 ILE A 61 15.382 1.243 10.237 1.00 35.21 H new ATOM 0 HG22 ILE A 61 16.577 0.421 11.269 1.00 35.21 H new ATOM 0 HG23 ILE A 61 15.238 -0.503 10.547 1.00 35.21 H new ATOM 0 HD11 ILE A 61 11.847 2.001 10.602 1.00 21.02 H new ATOM 0 HD12 ILE A 61 13.205 2.931 11.279 1.00 21.02 H new ATOM 0 HD13 ILE A 61 13.480 1.817 9.918 1.00 21.02 H new ATOM 975 N THR A 62 14.482 0.879 15.312 1.00 5.12 N ATOM 976 CA THR A 62 13.757 1.280 16.511 1.00 51.43 C ATOM 977 C THR A 62 13.051 2.615 16.305 1.00 54.53 C ATOM 978 O THR A 62 13.200 3.254 15.263 1.00 71.02 O ATOM 979 CB THR A 62 14.697 1.392 17.726 1.00 41.03 C ATOM 980 OG1 THR A 62 15.515 2.561 17.606 1.00 2.22 O ATOM 981 CG2 THR A 62 15.580 0.159 17.842 1.00 61.33 C ATOM 0 H THR A 62 15.375 1.353 15.181 1.00 5.12 H new ATOM 0 HA THR A 62 13.015 0.505 16.705 1.00 51.43 H new ATOM 0 HB THR A 62 14.086 1.468 18.625 1.00 41.03 H new ATOM 0 HG1 THR A 62 16.133 2.452 16.853 1.00 2.22 H new ATOM 0 HG21 THR A 62 16.235 0.261 18.707 1.00 61.33 H new ATOM 0 HG22 THR A 62 14.955 -0.726 17.962 1.00 61.33 H new ATOM 0 HG23 THR A 62 16.183 0.057 16.940 1.00 61.33 H new ATOM 989 N VAL A 63 12.281 3.033 17.305 1.00 51.12 N ATOM 990 CA VAL A 63 11.553 4.294 17.234 1.00 53.22 C ATOM 991 C VAL A 63 11.268 4.844 18.627 1.00 31.52 C ATOM 992 O VAL A 63 10.787 4.125 19.503 1.00 61.45 O ATOM 993 CB VAL A 63 10.222 4.132 16.476 1.00 35.31 C ATOM 994 CG1 VAL A 63 9.331 3.114 17.173 1.00 42.03 C ATOM 995 CG2 VAL A 63 9.514 5.473 16.349 1.00 63.50 C ATOM 0 H VAL A 63 12.145 2.516 18.174 1.00 51.12 H new ATOM 0 HA VAL A 63 12.188 4.995 16.693 1.00 53.22 H new ATOM 0 HB VAL A 63 10.438 3.765 15.473 1.00 35.31 H new ATOM 0 HG11 VAL A 63 8.395 3.013 16.623 1.00 42.03 H new ATOM 0 HG12 VAL A 63 9.838 2.150 17.207 1.00 42.03 H new ATOM 0 HG13 VAL A 63 9.121 3.449 18.189 1.00 42.03 H new ATOM 0 HG21 VAL A 63 8.576 5.339 15.811 1.00 63.50 H new ATOM 0 HG22 VAL A 63 9.309 5.872 17.343 1.00 63.50 H new ATOM 0 HG23 VAL A 63 10.150 6.170 15.803 1.00 63.50 H new ATOM 1005 N ALA A 64 11.568 6.123 18.825 1.00 31.04 N ATOM 1006 CA ALA A 64 11.342 6.770 20.112 1.00 52.12 C ATOM 1007 C ALA A 64 10.189 7.765 20.031 1.00 71.12 C ATOM 1008 O ALA A 64 9.659 8.029 18.951 1.00 4.45 O ATOM 1009 CB ALA A 64 12.610 7.466 20.582 1.00 2.35 C ATOM 0 H ALA A 64 11.968 6.732 18.111 1.00 31.04 H new ATOM 0 HA ALA A 64 11.073 6.001 20.836 1.00 52.12 H new ATOM 0 HB1 ALA A 64 12.427 7.945 21.544 1.00 2.35 H new ATOM 0 HB2 ALA A 64 13.410 6.733 20.688 1.00 2.35 H new ATOM 0 HB3 ALA A 64 12.903 8.220 19.851 1.00 2.35 H new ATOM 1015 N SER A 65 9.804 8.313 21.179 1.00 23.21 N ATOM 1016 CA SER A 65 8.711 9.275 21.238 1.00 15.43 C ATOM 1017 C SER A 65 9.072 10.453 22.138 1.00 14.23 C ATOM 1018 O SER A 65 8.685 10.517 23.306 1.00 50.15 O ATOM 1019 CB SER A 65 7.436 8.600 21.749 1.00 2.42 C ATOM 1020 OG SER A 65 7.638 7.212 21.946 1.00 62.44 O ATOM 0 H SER A 65 10.233 8.107 22.081 1.00 23.21 H new ATOM 0 HA SER A 65 8.536 9.651 20.230 1.00 15.43 H new ATOM 0 HB2 SER A 65 7.127 9.062 22.686 1.00 2.42 H new ATOM 0 HB3 SER A 65 6.627 8.755 21.035 1.00 2.42 H new ATOM 0 HG SER A 65 6.810 6.804 22.274 1.00 62.44 H new ATOM 1026 N PRO A 66 9.832 11.409 21.584 1.00 55.32 N ATOM 1027 CA PRO A 66 10.262 12.603 22.317 1.00 11.23 C ATOM 1028 C PRO A 66 9.105 13.554 22.607 1.00 24.22 C ATOM 1029 O PRO A 66 8.466 14.067 21.690 1.00 41.00 O ATOM 1030 CB PRO A 66 11.268 13.259 21.368 1.00 1.14 C ATOM 1031 CG PRO A 66 10.872 12.788 20.012 1.00 54.53 C ATOM 1032 CD PRO A 66 10.329 11.399 20.198 1.00 73.43 C ATOM 0 HA PRO A 66 10.676 12.354 23.294 1.00 11.23 H new ATOM 0 HB2 PRO A 66 11.227 14.346 21.437 1.00 1.14 H new ATOM 0 HB3 PRO A 66 12.289 12.963 21.607 1.00 1.14 H new ATOM 0 HG2 PRO A 66 10.121 13.445 19.575 1.00 54.53 H new ATOM 0 HG3 PRO A 66 11.726 12.786 19.335 1.00 54.53 H new ATOM 0 HD2 PRO A 66 9.532 11.181 19.487 1.00 73.43 H new ATOM 0 HD3 PRO A 66 11.101 10.643 20.053 1.00 73.43 H new ATOM 1040 N GLY A 67 8.842 13.785 23.890 1.00 70.50 N ATOM 1041 CA GLY A 67 7.762 14.674 24.277 1.00 24.43 C ATOM 1042 C GLY A 67 6.448 13.943 24.463 1.00 75.44 C ATOM 1043 O GLY A 67 5.386 14.564 24.519 1.00 60.21 O ATOM 0 H GLY A 67 9.357 13.373 24.668 1.00 70.50 H new ATOM 0 HA2 GLY A 67 8.027 15.180 25.205 1.00 24.43 H new ATOM 0 HA3 GLY A 67 7.641 15.446 23.517 1.00 24.43 H new ATOM 1047 N PHE A 68 6.516 12.619 24.556 1.00 24.21 N ATOM 1048 CA PHE A 68 5.322 11.802 24.733 1.00 34.32 C ATOM 1049 C PHE A 68 5.515 10.794 25.862 1.00 35.52 C ATOM 1050 O PHE A 68 6.627 10.324 26.108 1.00 54.23 O ATOM 1051 CB PHE A 68 4.981 11.070 23.433 1.00 22.33 C ATOM 1052 CG PHE A 68 3.636 10.402 23.456 1.00 22.41 C ATOM 1053 CD1 PHE A 68 2.534 11.051 23.988 1.00 1.51 C ATOM 1054 CD2 PHE A 68 3.474 9.124 22.945 1.00 53.10 C ATOM 1055 CE1 PHE A 68 1.296 10.439 24.011 1.00 74.40 C ATOM 1056 CE2 PHE A 68 2.237 8.506 22.965 1.00 44.33 C ATOM 1057 CZ PHE A 68 1.147 9.165 23.498 1.00 72.05 C ATOM 0 H PHE A 68 7.386 12.089 24.512 1.00 24.21 H new ATOM 0 HA PHE A 68 4.496 12.463 24.997 1.00 34.32 H new ATOM 0 HB2 PHE A 68 5.011 11.780 22.607 1.00 22.33 H new ATOM 0 HB3 PHE A 68 5.747 10.320 23.236 1.00 22.33 H new ATOM 0 HD1 PHE A 68 2.644 12.047 24.390 1.00 1.51 H new ATOM 0 HD2 PHE A 68 4.323 8.605 22.526 1.00 53.10 H new ATOM 0 HE1 PHE A 68 0.445 10.956 24.430 1.00 74.40 H new ATOM 0 HE2 PHE A 68 2.124 7.509 22.564 1.00 44.33 H new ATOM 0 HZ PHE A 68 0.180 8.685 23.514 1.00 72.05 H new ATOM 1067 N LEU A 69 4.424 10.465 26.547 1.00 44.33 N ATOM 1068 CA LEU A 69 4.472 9.513 27.651 1.00 40.11 C ATOM 1069 C LEU A 69 5.330 10.047 28.794 1.00 61.25 C ATOM 1070 O LEU A 69 4.817 10.628 29.750 1.00 32.13 O ATOM 1071 CB LEU A 69 5.023 8.170 27.169 1.00 51.04 C ATOM 1072 CG LEU A 69 3.983 7.108 26.811 1.00 70.42 C ATOM 1073 CD1 LEU A 69 3.440 6.447 28.069 1.00 42.15 C ATOM 1074 CD2 LEU A 69 2.852 7.721 25.998 1.00 62.44 C ATOM 0 H LEU A 69 3.496 10.844 26.357 1.00 44.33 H new ATOM 0 HA LEU A 69 3.456 9.371 28.020 1.00 40.11 H new ATOM 0 HB2 LEU A 69 5.647 8.349 26.293 1.00 51.04 H new ATOM 0 HB3 LEU A 69 5.673 7.767 27.946 1.00 51.04 H new ATOM 0 HG LEU A 69 4.467 6.344 26.203 1.00 70.42 H new ATOM 0 HD11 LEU A 69 2.701 5.694 27.794 1.00 42.15 H new ATOM 0 HD12 LEU A 69 4.257 5.972 28.612 1.00 42.15 H new ATOM 0 HD13 LEU A 69 2.972 7.200 28.703 1.00 42.15 H new ATOM 0 HD21 LEU A 69 2.121 6.950 25.752 1.00 62.44 H new ATOM 0 HD22 LEU A 69 2.370 8.506 26.580 1.00 62.44 H new ATOM 0 HD23 LEU A 69 3.254 8.146 25.078 1.00 62.44 H new ATOM 1086 N HIS A 70 6.640 9.848 28.686 1.00 30.41 N ATOM 1087 CA HIS A 70 7.570 10.311 29.709 1.00 2.54 C ATOM 1088 C HIS A 70 8.983 10.429 29.146 1.00 41.41 C ATOM 1089 O HIS A 70 9.963 10.375 29.888 1.00 62.42 O ATOM 1090 CB HIS A 70 7.563 9.358 30.905 1.00 43.22 C ATOM 1091 CG HIS A 70 7.123 10.003 32.183 1.00 41.22 C ATOM 1092 ND1 HIS A 70 7.686 11.163 32.673 1.00 33.43 N ATOM 1093 CD2 HIS A 70 6.167 9.645 33.072 1.00 41.43 C ATOM 1094 CE1 HIS A 70 7.096 11.489 33.810 1.00 42.04 C ATOM 1095 NE2 HIS A 70 6.170 10.585 34.073 1.00 24.44 N ATOM 0 H HIS A 70 7.081 9.369 27.901 1.00 30.41 H new ATOM 0 HA HIS A 70 7.246 11.298 30.039 1.00 2.54 H new ATOM 0 HB2 HIS A 70 6.904 8.518 30.686 1.00 43.22 H new ATOM 0 HB3 HIS A 70 8.565 8.950 31.040 1.00 43.22 H new ATOM 0 HD2 HIS A 70 5.522 8.781 33.006 1.00 41.43 H new ATOM 0 HE1 HIS A 70 7.331 12.349 34.420 1.00 42.04 H new ATOM 0 HE2 HIS A 70 5.556 10.585 34.888 1.00 24.44 H new ATOM 1103 N GLU A 71 9.079 10.591 27.830 1.00 73.32 N ATOM 1104 CA GLU A 71 10.372 10.714 27.168 1.00 41.40 C ATOM 1105 C GLU A 71 10.825 12.171 27.127 1.00 50.14 C ATOM 1106 O GLU A 71 10.023 13.088 27.302 1.00 15.22 O ATOM 1107 CB GLU A 71 10.299 10.151 25.747 1.00 0.12 C ATOM 1108 CG GLU A 71 10.958 8.790 25.597 1.00 15.04 C ATOM 1109 CD GLU A 71 12.425 8.889 25.227 1.00 54.30 C ATOM 1110 OE1 GLU A 71 13.125 9.749 25.801 1.00 42.02 O ATOM 1111 OE2 GLU A 71 12.872 8.106 24.363 1.00 51.31 O ATOM 0 H GLU A 71 8.277 10.640 27.202 1.00 73.32 H new ATOM 0 HA GLU A 71 11.101 10.140 27.741 1.00 41.40 H new ATOM 0 HB2 GLU A 71 9.253 10.074 25.449 1.00 0.12 H new ATOM 0 HB3 GLU A 71 10.775 10.853 25.062 1.00 0.12 H new ATOM 0 HG2 GLU A 71 10.860 8.238 26.532 1.00 15.04 H new ATOM 0 HG3 GLU A 71 10.432 8.218 24.832 1.00 15.04 H new ATOM 1118 N LYS A 72 12.117 12.376 26.894 1.00 51.42 N ATOM 1119 CA LYS A 72 12.679 13.720 26.828 1.00 11.23 C ATOM 1120 C LYS A 72 12.043 14.522 25.697 1.00 33.41 C ATOM 1121 O LYS A 72 11.366 13.965 24.832 1.00 31.02 O ATOM 1122 CB LYS A 72 14.195 13.652 26.629 1.00 12.25 C ATOM 1123 CG LYS A 72 14.903 12.774 27.647 1.00 51.14 C ATOM 1124 CD LYS A 72 16.271 12.338 27.150 1.00 3.24 C ATOM 1125 CE LYS A 72 17.347 13.346 27.525 1.00 21.02 C ATOM 1126 NZ LYS A 72 17.518 14.390 26.477 1.00 11.45 N ATOM 0 H LYS A 72 12.795 11.628 26.748 1.00 51.42 H new ATOM 0 HA LYS A 72 12.464 14.223 27.771 1.00 11.23 H new ATOM 0 HB2 LYS A 72 14.405 13.275 25.628 1.00 12.25 H new ATOM 0 HB3 LYS A 72 14.606 14.660 26.683 1.00 12.25 H new ATOM 0 HG2 LYS A 72 15.012 13.318 28.585 1.00 51.14 H new ATOM 0 HG3 LYS A 72 14.294 11.895 27.857 1.00 51.14 H new ATOM 0 HD2 LYS A 72 16.520 11.364 27.573 1.00 3.24 H new ATOM 0 HD3 LYS A 72 16.245 12.218 26.067 1.00 3.24 H new ATOM 0 HE2 LYS A 72 17.086 13.820 28.471 1.00 21.02 H new ATOM 0 HE3 LYS A 72 18.293 12.827 27.679 1.00 21.02 H new ATOM 0 HZ1 LYS A 72 17.861 15.269 26.915 1.00 11.45 H new ATOM 0 HZ2 LYS A 72 18.208 14.063 25.771 1.00 11.45 H new ATOM 0 HZ3 LYS A 72 16.605 14.568 26.012 1.00 11.45 H new ATOM 1140 N LYS A 73 12.265 15.831 25.708 1.00 1.52 N ATOM 1141 CA LYS A 73 11.716 16.710 24.682 1.00 3.01 C ATOM 1142 C LYS A 73 12.537 16.627 23.399 1.00 0.11 C ATOM 1143 O LYS A 73 13.715 16.271 23.427 1.00 62.14 O ATOM 1144 CB LYS A 73 11.680 18.155 25.185 1.00 44.03 C ATOM 1145 CG LYS A 73 13.043 18.694 25.584 1.00 0.05 C ATOM 1146 CD LYS A 73 12.967 19.508 26.865 1.00 31.24 C ATOM 1147 CE LYS A 73 13.530 18.737 28.050 1.00 41.24 C ATOM 1148 NZ LYS A 73 13.424 19.512 29.317 1.00 54.01 N ATOM 0 H LYS A 73 12.822 16.308 26.417 1.00 1.52 H new ATOM 0 HA LYS A 73 10.699 16.383 24.464 1.00 3.01 H new ATOM 0 HB2 LYS A 73 11.261 18.792 24.406 1.00 44.03 H new ATOM 0 HB3 LYS A 73 11.009 18.216 26.042 1.00 44.03 H new ATOM 0 HG2 LYS A 73 13.738 17.865 25.719 1.00 0.05 H new ATOM 0 HG3 LYS A 73 13.439 19.315 24.780 1.00 0.05 H new ATOM 0 HD2 LYS A 73 13.520 20.439 26.739 1.00 31.24 H new ATOM 0 HD3 LYS A 73 11.930 19.778 27.065 1.00 31.24 H new ATOM 0 HE2 LYS A 73 12.996 17.793 28.156 1.00 41.24 H new ATOM 0 HE3 LYS A 73 14.575 18.492 27.860 1.00 41.24 H new ATOM 0 HZ1 LYS A 73 13.818 18.953 30.100 1.00 54.01 H new ATOM 0 HZ2 LYS A 73 13.955 20.401 29.225 1.00 54.01 H new ATOM 0 HZ3 LYS A 73 12.425 19.724 29.512 1.00 54.01 H new ATOM 1162 N ASP A 74 11.908 16.959 22.277 1.00 12.33 N ATOM 1163 CA ASP A 74 12.581 16.925 20.984 1.00 31.11 C ATOM 1164 C ASP A 74 13.891 17.705 21.032 1.00 21.15 C ATOM 1165 O ASP A 74 13.992 18.726 21.710 1.00 4.53 O ATOM 1166 CB ASP A 74 11.671 17.498 19.896 1.00 5.43 C ATOM 1167 CG ASP A 74 12.302 17.431 18.519 1.00 20.43 C ATOM 1168 OD1 ASP A 74 13.021 18.382 18.148 1.00 23.02 O ATOM 1169 OD2 ASP A 74 12.077 16.426 17.813 1.00 20.20 O ATOM 0 H ASP A 74 10.933 17.255 22.237 1.00 12.33 H new ATOM 0 HA ASP A 74 12.807 15.885 20.747 1.00 31.11 H new ATOM 0 HB2 ASP A 74 10.729 16.949 19.888 1.00 5.43 H new ATOM 0 HB3 ASP A 74 11.434 18.535 20.134 1.00 5.43 H new ATOM 1174 N GLY A 75 14.893 17.215 20.309 1.00 61.32 N ATOM 1175 CA GLY A 75 16.184 17.877 20.284 1.00 11.42 C ATOM 1176 C GLY A 75 17.110 17.385 21.379 1.00 74.34 C ATOM 1177 O GLY A 75 18.291 17.135 21.136 1.00 34.14 O ATOM 0 H GLY A 75 14.834 16.371 19.740 1.00 61.32 H new ATOM 0 HA2 GLY A 75 16.654 17.713 19.314 1.00 11.42 H new ATOM 0 HA3 GLY A 75 16.040 18.952 20.391 1.00 11.42 H new ATOM 1181 N ASP A 76 16.574 17.246 22.586 1.00 11.03 N ATOM 1182 CA ASP A 76 17.360 16.781 23.723 1.00 64.53 C ATOM 1183 C ASP A 76 17.639 15.285 23.614 1.00 25.32 C ATOM 1184 O ASP A 76 18.791 14.852 23.669 1.00 72.15 O ATOM 1185 CB ASP A 76 16.631 17.082 25.033 1.00 51.12 C ATOM 1186 CG ASP A 76 17.560 17.622 26.102 1.00 63.01 C ATOM 1187 OD1 ASP A 76 18.636 17.022 26.312 1.00 53.21 O ATOM 1188 OD2 ASP A 76 17.213 18.645 26.728 1.00 32.22 O ATOM 0 H ASP A 76 15.598 17.449 22.803 1.00 11.03 H new ATOM 0 HA ASP A 76 18.312 17.312 23.717 1.00 64.53 H new ATOM 0 HB2 ASP A 76 15.838 17.806 24.846 1.00 51.12 H new ATOM 0 HB3 ASP A 76 16.153 16.172 25.397 1.00 51.12 H new ATOM 1193 N PHE A 77 16.578 14.499 23.462 1.00 43.53 N ATOM 1194 CA PHE A 77 16.709 13.052 23.348 1.00 74.43 C ATOM 1195 C PHE A 77 17.747 12.680 22.293 1.00 52.32 C ATOM 1196 O PHE A 77 18.507 11.728 22.464 1.00 20.14 O ATOM 1197 CB PHE A 77 15.359 12.423 22.995 1.00 61.13 C ATOM 1198 CG PHE A 77 15.454 10.973 22.613 1.00 5.40 C ATOM 1199 CD1 PHE A 77 15.395 9.983 23.580 1.00 1.24 C ATOM 1200 CD2 PHE A 77 15.604 10.601 21.287 1.00 61.02 C ATOM 1201 CE1 PHE A 77 15.482 8.648 23.233 1.00 42.35 C ATOM 1202 CE2 PHE A 77 15.691 9.268 20.933 1.00 63.20 C ATOM 1203 CZ PHE A 77 15.632 8.290 21.907 1.00 14.41 C ATOM 0 H PHE A 77 15.618 14.840 23.415 1.00 43.53 H new ATOM 0 HA PHE A 77 17.042 12.666 24.311 1.00 74.43 H new ATOM 0 HB2 PHE A 77 14.687 12.523 23.847 1.00 61.13 H new ATOM 0 HB3 PHE A 77 14.913 12.979 22.171 1.00 61.13 H new ATOM 0 HD1 PHE A 77 15.280 10.258 24.618 1.00 1.24 H new ATOM 0 HD2 PHE A 77 15.653 11.361 20.521 1.00 61.02 H new ATOM 0 HE1 PHE A 77 15.433 7.886 23.997 1.00 42.35 H new ATOM 0 HE2 PHE A 77 15.805 8.991 19.895 1.00 63.20 H new ATOM 0 HZ PHE A 77 15.703 7.248 21.633 1.00 14.41 H new ATOM 1213 N GLN A 78 17.771 13.439 21.202 1.00 12.41 N ATOM 1214 CA GLN A 78 18.714 13.189 20.119 1.00 43.52 C ATOM 1215 C GLN A 78 20.149 13.416 20.583 1.00 22.35 C ATOM 1216 O GLN A 78 21.019 12.568 20.383 1.00 62.11 O ATOM 1217 CB GLN A 78 18.404 14.094 18.925 1.00 73.01 C ATOM 1218 CG GLN A 78 16.976 13.965 18.419 1.00 11.23 C ATOM 1219 CD GLN A 78 16.619 15.031 17.402 1.00 15.34 C ATOM 1220 OE1 GLN A 78 15.849 15.948 17.692 1.00 44.44 O ATOM 1221 NE2 GLN A 78 17.176 14.916 16.203 1.00 45.51 N ATOM 0 H GLN A 78 17.148 14.232 21.045 1.00 12.41 H new ATOM 0 HA GLN A 78 18.610 12.148 19.814 1.00 43.52 H new ATOM 0 HB2 GLN A 78 18.588 15.130 19.208 1.00 73.01 H new ATOM 0 HB3 GLN A 78 19.091 13.858 18.113 1.00 73.01 H new ATOM 0 HG2 GLN A 78 16.841 12.981 17.971 1.00 11.23 H new ATOM 0 HG3 GLN A 78 16.289 14.028 19.263 1.00 11.23 H new ATOM 0 HE21 GLN A 78 17.808 14.140 16.007 1.00 45.51 H new ATOM 0 HE22 GLN A 78 16.972 15.604 15.478 1.00 45.51 H new ATOM 1230 N LYS A 79 20.390 14.565 21.205 1.00 21.13 N ATOM 1231 CA LYS A 79 21.719 14.904 21.700 1.00 62.31 C ATOM 1232 C LYS A 79 22.114 13.999 22.863 1.00 14.53 C ATOM 1233 O LYS A 79 23.298 13.800 23.133 1.00 42.15 O ATOM 1234 CB LYS A 79 21.764 16.369 22.141 1.00 73.51 C ATOM 1235 CG LYS A 79 21.520 16.564 23.627 1.00 22.13 C ATOM 1236 CD LYS A 79 20.972 17.950 23.925 1.00 24.42 C ATOM 1237 CE LYS A 79 22.085 18.984 24.004 1.00 70.34 C ATOM 1238 NZ LYS A 79 22.848 18.882 25.279 1.00 52.34 N ATOM 0 H LYS A 79 19.681 15.278 21.378 1.00 21.13 H new ATOM 0 HA LYS A 79 22.431 14.754 20.888 1.00 62.31 H new ATOM 0 HB2 LYS A 79 22.737 16.788 21.883 1.00 73.51 H new ATOM 0 HB3 LYS A 79 21.016 16.931 21.582 1.00 73.51 H new ATOM 0 HG2 LYS A 79 20.818 15.810 23.983 1.00 22.13 H new ATOM 0 HG3 LYS A 79 22.452 16.415 24.172 1.00 22.13 H new ATOM 0 HD2 LYS A 79 20.262 18.236 23.149 1.00 24.42 H new ATOM 0 HD3 LYS A 79 20.424 17.931 24.867 1.00 24.42 H new ATOM 0 HE2 LYS A 79 22.765 18.851 23.162 1.00 70.34 H new ATOM 0 HE3 LYS A 79 21.659 19.983 23.915 1.00 70.34 H new ATOM 0 HZ1 LYS A 79 23.468 19.711 25.379 1.00 52.34 H new ATOM 0 HZ2 LYS A 79 22.184 18.847 26.079 1.00 52.34 H new ATOM 0 HZ3 LYS A 79 23.425 18.017 25.270 1.00 52.34 H new ATOM 1252 N TRP A 80 21.115 13.454 23.548 1.00 54.53 N ATOM 1253 CA TRP A 80 21.358 12.570 24.681 1.00 22.25 C ATOM 1254 C TRP A 80 21.655 11.150 24.210 1.00 0.44 C ATOM 1255 O TRP A 80 22.554 10.489 24.730 1.00 2.12 O ATOM 1256 CB TRP A 80 20.151 12.567 25.621 1.00 61.31 C ATOM 1257 CG TRP A 80 20.085 11.354 26.499 1.00 73.33 C ATOM 1258 CD1 TRP A 80 20.604 11.222 27.755 1.00 34.21 C ATOM 1259 CD2 TRP A 80 19.465 10.102 26.185 1.00 65.53 C ATOM 1260 NE1 TRP A 80 20.344 9.963 28.241 1.00 23.00 N ATOM 1261 CE2 TRP A 80 19.647 9.257 27.297 1.00 33.33 C ATOM 1262 CE3 TRP A 80 18.774 9.612 25.073 1.00 10.43 C ATOM 1263 CZ2 TRP A 80 19.162 7.952 27.327 1.00 21.23 C ATOM 1264 CZ3 TRP A 80 18.294 8.317 25.105 1.00 51.04 C ATOM 1265 CH2 TRP A 80 18.489 7.499 26.225 1.00 31.13 C ATOM 0 H TRP A 80 20.129 13.609 23.338 1.00 54.53 H new ATOM 0 HA TRP A 80 22.228 12.943 25.221 1.00 22.25 H new ATOM 0 HB2 TRP A 80 20.185 13.459 26.247 1.00 61.31 H new ATOM 0 HB3 TRP A 80 19.238 12.628 25.029 1.00 61.31 H new ATOM 0 HD1 TRP A 80 21.140 11.993 28.288 1.00 34.21 H new ATOM 0 HE1 TRP A 80 20.625 9.611 29.156 1.00 23.00 H new ATOM 0 HE3 TRP A 80 18.618 10.235 24.204 1.00 10.43 H new ATOM 0 HZ2 TRP A 80 19.312 7.320 28.190 1.00 21.23 H new ATOM 0 HZ3 TRP A 80 17.759 7.928 24.251 1.00 51.04 H new ATOM 0 HH2 TRP A 80 18.101 6.491 26.219 1.00 31.13 H new ATOM 1276 N TYR A 81 20.895 10.688 23.224 1.00 31.02 N ATOM 1277 CA TYR A 81 21.076 9.345 22.685 1.00 52.52 C ATOM 1278 C TYR A 81 22.311 9.279 21.792 1.00 22.02 C ATOM 1279 O TYR A 81 22.917 8.220 21.630 1.00 42.32 O ATOM 1280 CB TYR A 81 19.838 8.920 21.894 1.00 72.22 C ATOM 1281 CG TYR A 81 20.135 7.928 20.792 1.00 52.12 C ATOM 1282 CD1 TYR A 81 20.388 6.593 21.081 1.00 32.01 C ATOM 1283 CD2 TYR A 81 20.161 8.326 19.461 1.00 44.32 C ATOM 1284 CE1 TYR A 81 20.660 5.684 20.077 1.00 24.24 C ATOM 1285 CE2 TYR A 81 20.432 7.424 18.450 1.00 34.24 C ATOM 1286 CZ TYR A 81 20.681 6.104 18.764 1.00 71.12 C ATOM 1287 OH TYR A 81 20.951 5.201 17.761 1.00 74.01 O ATOM 0 H TYR A 81 20.148 11.223 22.782 1.00 31.02 H new ATOM 0 HA TYR A 81 21.218 8.661 23.521 1.00 52.52 H new ATOM 0 HB2 TYR A 81 19.112 8.483 22.579 1.00 72.22 H new ATOM 0 HB3 TYR A 81 19.373 9.805 21.459 1.00 72.22 H new ATOM 0 HD1 TYR A 81 20.372 6.260 22.108 1.00 32.01 H new ATOM 0 HD2 TYR A 81 19.966 9.359 19.212 1.00 44.32 H new ATOM 0 HE1 TYR A 81 20.855 4.650 20.319 1.00 24.24 H new ATOM 0 HE2 TYR A 81 20.449 7.750 17.421 1.00 34.24 H new ATOM 0 HH TYR A 81 20.398 5.407 16.978 1.00 74.01 H new ATOM 1297 N ALA A 82 22.679 10.419 21.216 1.00 72.30 N ATOM 1298 CA ALA A 82 23.843 10.492 20.342 1.00 50.11 C ATOM 1299 C ALA A 82 25.137 10.376 21.140 1.00 1.32 C ATOM 1300 O ALA A 82 26.222 10.273 20.570 1.00 4.12 O ATOM 1301 CB ALA A 82 23.825 11.789 19.547 1.00 2.41 C ATOM 0 H ALA A 82 22.188 11.304 21.339 1.00 72.30 H new ATOM 0 HA ALA A 82 23.799 9.653 19.648 1.00 50.11 H new ATOM 0 HB1 ALA A 82 24.700 11.830 18.898 1.00 2.41 H new ATOM 0 HB2 ALA A 82 22.921 11.831 18.940 1.00 2.41 H new ATOM 0 HB3 ALA A 82 23.841 12.636 20.233 1.00 2.41 H new ATOM 1307 N GLY A 83 25.014 10.395 22.464 1.00 22.11 N ATOM 1308 CA GLY A 83 26.182 10.292 23.319 1.00 44.00 C ATOM 1309 C GLY A 83 26.158 9.050 24.187 1.00 32.15 C ATOM 1310 O GLY A 83 26.758 9.023 25.263 1.00 54.10 O ATOM 0 H GLY A 83 24.126 10.480 22.959 1.00 22.11 H new ATOM 0 HA2 GLY A 83 27.080 10.283 22.702 1.00 44.00 H new ATOM 0 HA3 GLY A 83 26.242 11.175 23.955 1.00 44.00 H new ATOM 1314 N LEU A 84 25.461 8.019 23.722 1.00 24.34 N ATOM 1315 CA LEU A 84 25.359 6.767 24.465 1.00 1.21 C ATOM 1316 C LEU A 84 26.483 5.811 24.079 1.00 50.24 C ATOM 1317 O LEU A 84 27.530 5.776 24.724 1.00 70.55 O ATOM 1318 CB LEU A 84 24.003 6.108 24.208 1.00 13.33 C ATOM 1319 CG LEU A 84 22.917 6.379 25.250 1.00 11.14 C ATOM 1320 CD1 LEU A 84 23.004 7.812 25.752 1.00 1.12 C ATOM 1321 CD2 LEU A 84 21.539 6.098 24.670 1.00 54.32 C ATOM 0 H LEU A 84 24.958 8.025 22.835 1.00 24.34 H new ATOM 0 HA LEU A 84 25.450 6.995 25.527 1.00 1.21 H new ATOM 0 HB2 LEU A 84 23.638 6.441 23.237 1.00 13.33 H new ATOM 0 HB3 LEU A 84 24.152 5.030 24.140 1.00 13.33 H new ATOM 0 HG LEU A 84 23.077 5.709 26.095 1.00 11.14 H new ATOM 0 HD11 LEU A 84 22.223 7.986 26.493 1.00 1.12 H new ATOM 0 HD12 LEU A 84 23.980 7.979 26.207 1.00 1.12 H new ATOM 0 HD13 LEU A 84 22.871 8.499 24.916 1.00 1.12 H new ATOM 0 HD21 LEU A 84 20.779 6.296 25.426 1.00 54.32 H new ATOM 0 HD22 LEU A 84 21.369 6.742 23.807 1.00 54.32 H new ATOM 0 HD23 LEU A 84 21.480 5.054 24.361 1.00 54.32 H new ATOM 1333 N ASN A 85 26.258 5.039 23.020 1.00 4.13 N ATOM 1334 CA ASN A 85 27.253 4.084 22.546 1.00 21.45 C ATOM 1335 C ASN A 85 26.688 3.223 21.420 1.00 12.34 C ATOM 1336 O ASN A 85 27.013 2.041 21.305 1.00 13.31 O ATOM 1337 CB ASN A 85 27.723 3.192 23.698 1.00 43.14 C ATOM 1338 CG ASN A 85 29.226 3.246 23.894 1.00 0.11 C ATOM 1339 OD1 ASN A 85 29.994 2.903 22.995 1.00 75.31 O ATOM 1340 ND2 ASN A 85 29.653 3.679 25.075 1.00 70.42 N ATOM 0 H ASN A 85 25.396 5.056 22.475 1.00 4.13 H new ATOM 0 HA ASN A 85 28.103 4.645 22.159 1.00 21.45 H new ATOM 0 HB2 ASN A 85 27.228 3.501 24.619 1.00 43.14 H new ATOM 0 HB3 ASN A 85 27.421 2.163 23.504 1.00 43.14 H new ATOM 0 HD21 ASN A 85 30.653 3.737 25.266 1.00 70.42 H new ATOM 0 HD22 ASN A 85 28.981 3.953 25.791 1.00 70.42 H new ATOM 1347 N TYR A 86 25.841 3.825 20.592 1.00 21.42 N ATOM 1348 CA TYR A 86 25.229 3.114 19.476 1.00 31.31 C ATOM 1349 C TYR A 86 25.067 4.032 18.268 1.00 32.25 C ATOM 1350 O TYR A 86 23.957 4.379 17.865 1.00 52.41 O ATOM 1351 CB TYR A 86 23.868 2.550 19.888 1.00 22.42 C ATOM 1352 CG TYR A 86 23.829 2.042 21.312 1.00 62.21 C ATOM 1353 CD1 TYR A 86 23.552 2.900 22.369 1.00 25.41 C ATOM 1354 CD2 TYR A 86 24.068 0.703 21.599 1.00 2.55 C ATOM 1355 CE1 TYR A 86 23.517 2.440 23.671 1.00 33.03 C ATOM 1356 CE2 TYR A 86 24.033 0.235 22.899 1.00 70.35 C ATOM 1357 CZ TYR A 86 23.757 1.107 23.931 1.00 63.11 C ATOM 1358 OH TYR A 86 23.721 0.645 25.227 1.00 62.14 O ATOM 0 H TYR A 86 25.563 4.803 20.673 1.00 21.42 H new ATOM 0 HA TYR A 86 25.887 2.291 19.198 1.00 31.31 H new ATOM 0 HB2 TYR A 86 23.111 3.325 19.767 1.00 22.42 H new ATOM 0 HB3 TYR A 86 23.602 1.736 19.213 1.00 22.42 H new ATOM 0 HD1 TYR A 86 23.361 3.944 22.169 1.00 25.41 H new ATOM 0 HD2 TYR A 86 24.285 0.017 20.793 1.00 2.55 H new ATOM 0 HE1 TYR A 86 23.303 3.121 24.481 1.00 33.03 H new ATOM 0 HE2 TYR A 86 24.221 -0.808 23.106 1.00 70.35 H new ATOM 0 HH TYR A 86 23.911 -0.316 25.237 1.00 62.14 H new ATOM 1368 N PRO A 87 26.201 4.434 17.676 1.00 11.43 N ATOM 1369 CA PRO A 87 26.213 5.316 16.505 1.00 13.55 C ATOM 1370 C PRO A 87 25.689 4.623 15.252 1.00 11.53 C ATOM 1371 O PRO A 87 25.483 5.260 14.218 1.00 32.54 O ATOM 1372 CB PRO A 87 27.693 5.669 16.342 1.00 1.52 C ATOM 1373 CG PRO A 87 28.425 4.533 16.969 1.00 11.44 C ATOM 1374 CD PRO A 87 27.559 4.059 18.104 1.00 42.13 C ATOM 0 HA PRO A 87 25.567 6.183 16.641 1.00 13.55 H new ATOM 0 HB2 PRO A 87 27.960 5.780 15.291 1.00 1.52 H new ATOM 0 HB3 PRO A 87 27.931 6.613 16.833 1.00 1.52 H new ATOM 0 HG2 PRO A 87 28.596 3.733 16.248 1.00 11.44 H new ATOM 0 HG3 PRO A 87 29.403 4.851 17.331 1.00 11.44 H new ATOM 0 HD2 PRO A 87 27.650 2.984 18.257 1.00 42.13 H new ATOM 0 HD3 PRO A 87 27.831 4.539 19.044 1.00 42.13 H new ATOM 1382 N LYS A 88 25.475 3.316 15.351 1.00 73.23 N ATOM 1383 CA LYS A 88 24.973 2.535 14.226 1.00 51.52 C ATOM 1384 C LYS A 88 23.624 1.906 14.559 1.00 22.31 C ATOM 1385 O LYS A 88 23.234 0.899 13.966 1.00 1.00 O ATOM 1386 CB LYS A 88 25.977 1.445 13.847 1.00 63.22 C ATOM 1387 CG LYS A 88 26.532 1.591 12.440 1.00 34.42 C ATOM 1388 CD LYS A 88 27.506 0.474 12.106 1.00 21.43 C ATOM 1389 CE LYS A 88 28.623 0.962 11.196 1.00 34.40 C ATOM 1390 NZ LYS A 88 28.915 -0.010 10.106 1.00 33.53 N ATOM 0 H LYS A 88 25.641 2.774 16.199 1.00 73.23 H new ATOM 0 HA LYS A 88 24.840 3.208 13.379 1.00 51.52 H new ATOM 0 HB2 LYS A 88 26.803 1.461 14.558 1.00 63.22 H new ATOM 0 HB3 LYS A 88 25.496 0.471 13.939 1.00 63.22 H new ATOM 0 HG2 LYS A 88 25.712 1.586 11.722 1.00 34.42 H new ATOM 0 HG3 LYS A 88 27.034 2.554 12.344 1.00 34.42 H new ATOM 0 HD2 LYS A 88 27.933 0.075 13.026 1.00 21.43 H new ATOM 0 HD3 LYS A 88 26.972 -0.343 11.622 1.00 21.43 H new ATOM 0 HE2 LYS A 88 28.344 1.922 10.761 1.00 34.40 H new ATOM 0 HE3 LYS A 88 29.525 1.129 11.785 1.00 34.40 H new ATOM 0 HZ1 LYS A 88 29.682 0.359 9.508 1.00 33.53 H new ATOM 0 HZ2 LYS A 88 29.206 -0.919 10.520 1.00 33.53 H new ATOM 0 HZ3 LYS A 88 28.062 -0.150 9.528 1.00 33.53 H new ATOM 1404 N LEU A 89 22.916 2.505 15.510 1.00 74.42 N ATOM 1405 CA LEU A 89 21.609 2.003 15.921 1.00 51.01 C ATOM 1406 C LEU A 89 20.488 2.826 15.295 1.00 51.44 C ATOM 1407 O LEU A 89 20.357 4.027 15.536 1.00 71.44 O ATOM 1408 CB LEU A 89 21.487 2.030 17.445 1.00 13.44 C ATOM 1409 CG LEU A 89 20.138 1.595 18.019 1.00 73.24 C ATOM 1410 CD1 LEU A 89 19.822 0.163 17.613 1.00 44.52 C ATOM 1411 CD2 LEU A 89 20.132 1.735 19.534 1.00 53.12 C ATOM 0 H LEU A 89 23.224 3.338 16.011 1.00 74.42 H new ATOM 0 HA LEU A 89 21.517 0.974 15.573 1.00 51.01 H new ATOM 0 HB2 LEU A 89 22.261 1.387 17.863 1.00 13.44 H new ATOM 0 HB3 LEU A 89 21.695 3.043 17.788 1.00 13.44 H new ATOM 0 HG LEU A 89 19.365 2.246 17.611 1.00 73.24 H new ATOM 0 HD11 LEU A 89 18.858 -0.129 18.030 1.00 44.52 H new ATOM 0 HD12 LEU A 89 19.783 0.093 16.526 1.00 44.52 H new ATOM 0 HD13 LEU A 89 20.598 -0.502 17.991 1.00 44.52 H new ATOM 0 HD21 LEU A 89 19.164 1.421 19.925 1.00 53.12 H new ATOM 0 HD22 LEU A 89 20.916 1.109 19.960 1.00 53.12 H new ATOM 0 HD23 LEU A 89 20.312 2.776 19.804 1.00 53.12 H new ATOM 1423 N PRO A 90 19.658 2.168 14.473 1.00 73.54 N ATOM 1424 CA PRO A 90 18.531 2.818 13.797 1.00 2.31 C ATOM 1425 C PRO A 90 17.420 3.207 14.766 1.00 3.54 C ATOM 1426 O PRO A 90 16.814 2.350 15.408 1.00 20.44 O ATOM 1427 CB PRO A 90 18.038 1.749 12.820 1.00 73.43 C ATOM 1428 CG PRO A 90 18.460 0.456 13.428 1.00 33.12 C ATOM 1429 CD PRO A 90 19.754 0.736 14.140 1.00 44.32 C ATOM 0 HA PRO A 90 18.828 3.750 13.316 1.00 2.31 H new ATOM 0 HB2 PRO A 90 16.956 1.794 12.697 1.00 73.43 H new ATOM 0 HB3 PRO A 90 18.477 1.884 11.831 1.00 73.43 H new ATOM 0 HG2 PRO A 90 17.705 0.086 14.122 1.00 33.12 H new ATOM 0 HG3 PRO A 90 18.593 -0.310 12.664 1.00 33.12 H new ATOM 0 HD2 PRO A 90 19.862 0.122 15.034 1.00 44.32 H new ATOM 0 HD3 PRO A 90 20.615 0.528 13.505 1.00 44.32 H new ATOM 1437 N VAL A 91 17.158 4.507 14.868 1.00 74.42 N ATOM 1438 CA VAL A 91 16.118 5.009 15.758 1.00 2.30 C ATOM 1439 C VAL A 91 15.313 6.119 15.091 1.00 33.32 C ATOM 1440 O VAL A 91 15.869 7.120 14.641 1.00 63.04 O ATOM 1441 CB VAL A 91 16.716 5.543 17.073 1.00 13.34 C ATOM 1442 CG1 VAL A 91 15.613 5.852 18.074 1.00 31.05 C ATOM 1443 CG2 VAL A 91 17.708 4.545 17.651 1.00 13.23 C ATOM 0 H VAL A 91 17.652 5.231 14.345 1.00 74.42 H new ATOM 0 HA VAL A 91 15.459 4.170 15.981 1.00 2.30 H new ATOM 0 HB VAL A 91 17.250 6.469 16.860 1.00 13.34 H new ATOM 0 HG11 VAL A 91 16.054 6.228 18.997 1.00 31.05 H new ATOM 0 HG12 VAL A 91 14.945 6.606 17.658 1.00 31.05 H new ATOM 0 HG13 VAL A 91 15.049 4.944 18.285 1.00 31.05 H new ATOM 0 HG21 VAL A 91 18.121 4.939 18.580 1.00 13.23 H new ATOM 0 HG22 VAL A 91 17.200 3.601 17.851 1.00 13.23 H new ATOM 0 HG23 VAL A 91 18.515 4.379 16.937 1.00 13.23 H new ATOM 1453 N VAL A 92 13.998 5.934 15.032 1.00 54.00 N ATOM 1454 CA VAL A 92 13.114 6.920 14.421 1.00 11.05 C ATOM 1455 C VAL A 92 12.438 7.783 15.481 1.00 32.21 C ATOM 1456 O VAL A 92 11.788 7.271 16.393 1.00 34.22 O ATOM 1457 CB VAL A 92 12.032 6.245 13.558 1.00 51.34 C ATOM 1458 CG1 VAL A 92 11.199 7.291 12.832 1.00 63.15 C ATOM 1459 CG2 VAL A 92 12.666 5.277 12.570 1.00 0.14 C ATOM 0 H VAL A 92 13.521 5.111 15.400 1.00 54.00 H new ATOM 0 HA VAL A 92 13.735 7.551 13.784 1.00 11.05 H new ATOM 0 HB VAL A 92 11.370 5.678 14.213 1.00 51.34 H new ATOM 0 HG11 VAL A 92 10.440 6.796 12.227 1.00 63.15 H new ATOM 0 HG12 VAL A 92 10.715 7.941 13.561 1.00 63.15 H new ATOM 0 HG13 VAL A 92 11.845 7.887 12.187 1.00 63.15 H new ATOM 0 HG21 VAL A 92 11.887 4.809 11.968 1.00 0.14 H new ATOM 0 HG22 VAL A 92 13.351 5.819 11.918 1.00 0.14 H new ATOM 0 HG23 VAL A 92 13.215 4.509 13.115 1.00 0.14 H new ATOM 1469 N THR A 93 12.595 9.097 15.355 1.00 31.11 N ATOM 1470 CA THR A 93 12.000 10.032 16.302 1.00 65.02 C ATOM 1471 C THR A 93 10.544 10.316 15.953 1.00 32.24 C ATOM 1472 O THR A 93 10.202 10.513 14.787 1.00 13.33 O ATOM 1473 CB THR A 93 12.776 11.362 16.340 1.00 40.34 C ATOM 1474 OG1 THR A 93 13.531 11.524 15.134 1.00 70.34 O ATOM 1475 CG2 THR A 93 13.710 11.410 17.539 1.00 4.10 C ATOM 0 H THR A 93 13.129 9.538 14.606 1.00 31.11 H new ATOM 0 HA THR A 93 12.050 9.562 17.284 1.00 65.02 H new ATOM 0 HB THR A 93 12.055 12.175 16.429 1.00 40.34 H new ATOM 0 HG1 THR A 93 14.020 12.373 15.166 1.00 70.34 H new ATOM 0 HG21 THR A 93 14.247 12.359 17.544 1.00 4.10 H new ATOM 0 HG22 THR A 93 13.129 11.317 18.457 1.00 4.10 H new ATOM 0 HG23 THR A 93 14.424 10.589 17.477 1.00 4.10 H new ATOM 1483 N ASP A 94 9.690 10.335 16.971 1.00 41.31 N ATOM 1484 CA ASP A 94 8.269 10.597 16.772 1.00 3.11 C ATOM 1485 C ASP A 94 7.796 11.737 17.669 1.00 31.51 C ATOM 1486 O ASP A 94 7.412 11.517 18.817 1.00 1.11 O ATOM 1487 CB ASP A 94 7.452 9.336 17.055 1.00 60.42 C ATOM 1488 CG ASP A 94 6.677 8.864 15.840 1.00 20.43 C ATOM 1489 OD1 ASP A 94 6.039 9.709 15.178 1.00 35.32 O ATOM 1490 OD2 ASP A 94 6.710 7.649 15.551 1.00 14.43 O ATOM 0 H ASP A 94 9.957 10.172 17.942 1.00 41.31 H new ATOM 0 HA ASP A 94 8.121 10.891 15.733 1.00 3.11 H new ATOM 0 HB2 ASP A 94 8.119 8.541 17.388 1.00 60.42 H new ATOM 0 HB3 ASP A 94 6.757 9.532 17.872 1.00 60.42 H new ATOM 1495 N ASN A 95 7.827 12.954 17.137 1.00 44.00 N ATOM 1496 CA ASN A 95 7.403 14.129 17.890 1.00 20.52 C ATOM 1497 C ASN A 95 5.945 14.000 18.322 1.00 4.42 C ATOM 1498 O ASN A 95 5.035 14.401 17.598 1.00 10.24 O ATOM 1499 CB ASN A 95 7.588 15.394 17.050 1.00 62.53 C ATOM 1500 CG ASN A 95 7.080 15.224 15.631 1.00 42.32 C ATOM 1501 OD1 ASN A 95 5.896 15.420 15.356 1.00 43.50 O ATOM 1502 ND2 ASN A 95 7.976 14.858 14.722 1.00 41.14 N ATOM 0 H ASN A 95 8.141 13.153 16.187 1.00 44.00 H new ATOM 0 HA ASN A 95 8.024 14.201 18.783 1.00 20.52 H new ATOM 0 HB2 ASN A 95 7.062 16.222 17.525 1.00 62.53 H new ATOM 0 HB3 ASN A 95 8.645 15.660 17.026 1.00 62.53 H new ATOM 0 HD21 ASN A 95 7.693 14.728 13.751 1.00 41.14 H new ATOM 0 HD22 ASN A 95 8.947 14.707 14.995 1.00 41.14 H new ATOM 1509 N GLY A 96 5.732 13.439 19.508 1.00 24.44 N ATOM 1510 CA GLY A 96 4.384 13.268 20.017 1.00 70.10 C ATOM 1511 C GLY A 96 3.913 11.829 19.939 1.00 12.33 C ATOM 1512 O GLY A 96 2.754 11.532 20.225 1.00 54.12 O ATOM 0 H GLY A 96 6.469 13.100 20.126 1.00 24.44 H new ATOM 0 HA2 GLY A 96 4.345 13.604 21.053 1.00 70.10 H new ATOM 0 HA3 GLY A 96 3.702 13.902 19.450 1.00 70.10 H new ATOM 1516 N GLY A 97 4.814 10.933 19.550 1.00 63.13 N ATOM 1517 CA GLY A 97 4.465 9.529 19.440 1.00 31.31 C ATOM 1518 C GLY A 97 3.323 9.289 18.473 1.00 52.24 C ATOM 1519 O GLY A 97 2.265 8.792 18.859 1.00 34.13 O ATOM 0 H GLY A 97 5.780 11.154 19.309 1.00 63.13 H new ATOM 0 HA2 GLY A 97 5.339 8.965 19.113 1.00 31.31 H new ATOM 0 HA3 GLY A 97 4.190 9.148 20.424 1.00 31.31 H new ATOM 1523 N THR A 98 3.535 9.645 17.209 1.00 13.23 N ATOM 1524 CA THR A 98 2.514 9.469 16.184 1.00 0.01 C ATOM 1525 C THR A 98 2.323 7.995 15.846 1.00 32.12 C ATOM 1526 O THR A 98 1.195 7.505 15.778 1.00 11.53 O ATOM 1527 CB THR A 98 2.872 10.237 14.897 1.00 33.35 C ATOM 1528 OG1 THR A 98 3.924 11.172 15.161 1.00 32.43 O ATOM 1529 CG2 THR A 98 1.658 10.973 14.351 1.00 34.32 C ATOM 0 H THR A 98 4.405 10.057 16.871 1.00 13.23 H new ATOM 0 HA THR A 98 1.585 9.869 16.591 1.00 0.01 H new ATOM 0 HB THR A 98 3.206 9.516 14.151 1.00 33.35 H new ATOM 0 HG1 THR A 98 4.777 10.801 14.851 1.00 32.43 H new ATOM 0 HG21 THR A 98 1.935 11.508 13.443 1.00 34.32 H new ATOM 0 HG22 THR A 98 0.869 10.256 14.124 1.00 34.32 H new ATOM 0 HG23 THR A 98 1.298 11.684 15.095 1.00 34.32 H new ATOM 1537 N ILE A 99 3.431 7.292 15.636 1.00 52.40 N ATOM 1538 CA ILE A 99 3.384 5.873 15.307 1.00 50.20 C ATOM 1539 C ILE A 99 2.910 5.048 16.498 1.00 13.04 C ATOM 1540 O ILE A 99 1.994 4.235 16.378 1.00 60.30 O ATOM 1541 CB ILE A 99 4.761 5.355 14.853 1.00 24.35 C ATOM 1542 CG1 ILE A 99 5.231 6.111 13.609 1.00 73.43 C ATOM 1543 CG2 ILE A 99 4.701 3.859 14.580 1.00 13.22 C ATOM 1544 CD1 ILE A 99 6.604 5.693 13.130 1.00 14.20 C ATOM 0 H ILE A 99 4.372 7.682 15.688 1.00 52.40 H new ATOM 0 HA ILE A 99 2.675 5.762 14.487 1.00 50.20 H new ATOM 0 HB ILE A 99 5.480 5.530 15.654 1.00 24.35 H new ATOM 0 HG12 ILE A 99 4.512 5.954 12.805 1.00 73.43 H new ATOM 0 HG13 ILE A 99 5.240 7.179 13.825 1.00 73.43 H new ATOM 0 HG21 ILE A 99 5.682 3.508 14.260 1.00 13.22 H new ATOM 0 HG22 ILE A 99 4.407 3.335 15.489 1.00 13.22 H new ATOM 0 HG23 ILE A 99 3.971 3.661 13.795 1.00 13.22 H new ATOM 0 HD11 ILE A 99 6.872 6.270 12.245 1.00 14.20 H new ATOM 0 HD12 ILE A 99 7.335 5.876 13.917 1.00 14.20 H new ATOM 0 HD13 ILE A 99 6.595 4.632 12.882 1.00 14.20 H new ATOM 1556 N ALA A 100 3.538 5.265 17.649 1.00 23.21 N ATOM 1557 CA ALA A 100 3.178 4.544 18.864 1.00 42.12 C ATOM 1558 C ALA A 100 1.690 4.686 19.165 1.00 21.53 C ATOM 1559 O ALA A 100 1.004 3.697 19.426 1.00 5.52 O ATOM 1560 CB ALA A 100 4.006 5.043 20.039 1.00 44.14 C ATOM 0 H ALA A 100 4.299 5.934 17.766 1.00 23.21 H new ATOM 0 HA ALA A 100 3.391 3.487 18.707 1.00 42.12 H new ATOM 0 HB1 ALA A 100 3.727 4.496 20.939 1.00 44.14 H new ATOM 0 HB2 ALA A 100 5.064 4.884 19.832 1.00 44.14 H new ATOM 0 HB3 ALA A 100 3.821 6.107 20.189 1.00 44.14 H new ATOM 1566 N GLN A 101 1.198 5.920 19.128 1.00 22.31 N ATOM 1567 CA GLN A 101 -0.209 6.189 19.399 1.00 50.01 C ATOM 1568 C GLN A 101 -1.093 5.632 18.288 1.00 54.50 C ATOM 1569 O GLN A 101 -2.206 5.169 18.540 1.00 44.00 O ATOM 1570 CB GLN A 101 -0.443 7.693 19.548 1.00 43.44 C ATOM 1571 CG GLN A 101 -1.685 8.040 20.353 1.00 24.51 C ATOM 1572 CD GLN A 101 -2.847 8.467 19.479 1.00 41.03 C ATOM 1573 OE1 GLN A 101 -2.881 9.591 18.977 1.00 0.24 O ATOM 1574 NE2 GLN A 101 -3.808 7.570 19.291 1.00 41.13 N ATOM 0 H GLN A 101 1.752 6.749 18.913 1.00 22.31 H new ATOM 0 HA GLN A 101 -0.475 5.693 20.333 1.00 50.01 H new ATOM 0 HB2 GLN A 101 0.427 8.142 20.027 1.00 43.44 H new ATOM 0 HB3 GLN A 101 -0.526 8.139 18.557 1.00 43.44 H new ATOM 0 HG2 GLN A 101 -1.981 7.176 20.947 1.00 24.51 H new ATOM 0 HG3 GLN A 101 -1.448 8.842 21.052 1.00 24.51 H new ATOM 0 HE21 GLN A 101 -3.739 6.650 19.726 1.00 41.13 H new ATOM 0 HE22 GLN A 101 -4.615 7.801 18.711 1.00 41.13 H new ATOM 1583 N SER A 102 -0.592 5.682 17.058 1.00 23.21 N ATOM 1584 CA SER A 102 -1.338 5.186 15.908 1.00 50.34 C ATOM 1585 C SER A 102 -1.476 3.668 15.962 1.00 21.15 C ATOM 1586 O SER A 102 -2.452 3.103 15.467 1.00 62.13 O ATOM 1587 CB SER A 102 -0.646 5.600 14.607 1.00 12.34 C ATOM 1588 OG SER A 102 -0.978 6.932 14.255 1.00 43.21 O ATOM 0 H SER A 102 0.328 6.061 16.832 1.00 23.21 H new ATOM 0 HA SER A 102 -2.335 5.625 15.937 1.00 50.34 H new ATOM 0 HB2 SER A 102 0.434 5.509 14.721 1.00 12.34 H new ATOM 0 HB3 SER A 102 -0.940 4.924 13.804 1.00 12.34 H new ATOM 0 HG SER A 102 -0.338 7.549 14.668 1.00 43.21 H new ATOM 1594 N LEU A 103 -0.492 3.013 16.569 1.00 72.44 N ATOM 1595 CA LEU A 103 -0.502 1.559 16.690 1.00 60.25 C ATOM 1596 C LEU A 103 -1.074 1.128 18.037 1.00 42.35 C ATOM 1597 O LEU A 103 -1.294 -0.058 18.278 1.00 55.34 O ATOM 1598 CB LEU A 103 0.914 1.004 16.523 1.00 73.12 C ATOM 1599 CG LEU A 103 1.315 0.604 15.102 1.00 0.44 C ATOM 1600 CD1 LEU A 103 0.391 -0.481 14.572 1.00 51.42 C ATOM 1601 CD2 LEU A 103 1.300 1.817 14.183 1.00 60.10 C ATOM 0 H LEU A 103 0.322 3.465 16.985 1.00 72.44 H new ATOM 0 HA LEU A 103 -1.138 1.158 15.901 1.00 60.25 H new ATOM 0 HB2 LEU A 103 1.621 1.752 16.881 1.00 73.12 H new ATOM 0 HB3 LEU A 103 1.019 0.132 17.168 1.00 73.12 H new ATOM 0 HG LEU A 103 2.329 0.206 15.129 1.00 0.44 H new ATOM 0 HD11 LEU A 103 0.692 -0.753 13.560 1.00 51.42 H new ATOM 0 HD12 LEU A 103 0.452 -1.358 15.217 1.00 51.42 H new ATOM 0 HD13 LEU A 103 -0.634 -0.111 14.559 1.00 51.42 H new ATOM 0 HD21 LEU A 103 1.588 1.514 13.176 1.00 60.10 H new ATOM 0 HD22 LEU A 103 0.298 2.244 14.161 1.00 60.10 H new ATOM 0 HD23 LEU A 103 2.004 2.562 14.553 1.00 60.10 H new ATOM 1613 N ASN A 104 -1.313 2.101 18.910 1.00 32.01 N ATOM 1614 CA ASN A 104 -1.861 1.823 20.233 1.00 72.34 C ATOM 1615 C ASN A 104 -0.895 0.975 21.054 1.00 30.24 C ATOM 1616 O ASN A 104 -1.253 -0.100 21.538 1.00 52.34 O ATOM 1617 CB ASN A 104 -3.208 1.107 20.109 1.00 23.43 C ATOM 1618 CG ASN A 104 -3.971 1.520 18.866 1.00 43.23 C ATOM 1619 OD1 ASN A 104 -4.104 2.708 18.572 1.00 0.42 O ATOM 1620 ND2 ASN A 104 -4.476 0.539 18.128 1.00 33.51 N ATOM 0 H ASN A 104 -1.136 3.088 18.726 1.00 32.01 H new ATOM 0 HA ASN A 104 -2.008 2.773 20.746 1.00 72.34 H new ATOM 0 HB2 ASN A 104 -3.043 0.030 20.089 1.00 23.43 H new ATOM 0 HB3 ASN A 104 -3.812 1.321 20.991 1.00 23.43 H new ATOM 0 HD21 ASN A 104 -4.999 0.756 17.279 1.00 33.51 H new ATOM 0 HD22 ASN A 104 -4.341 -0.432 18.409 1.00 33.51 H new ATOM 1627 N ILE A 105 0.330 1.466 21.209 1.00 70.32 N ATOM 1628 CA ILE A 105 1.347 0.754 21.973 1.00 13.24 C ATOM 1629 C ILE A 105 1.304 1.149 23.446 1.00 41.14 C ATOM 1630 O ILE A 105 0.792 0.407 24.284 1.00 65.45 O ATOM 1631 CB ILE A 105 2.759 1.026 21.421 1.00 33.54 C ATOM 1632 CG1 ILE A 105 2.888 0.478 19.998 1.00 15.34 C ATOM 1633 CG2 ILE A 105 3.810 0.407 22.330 1.00 65.21 C ATOM 1634 CD1 ILE A 105 2.674 -1.016 19.904 1.00 21.31 C ATOM 0 H ILE A 105 0.642 2.354 20.816 1.00 70.32 H new ATOM 0 HA ILE A 105 1.127 -0.309 21.877 1.00 13.24 H new ATOM 0 HB ILE A 105 2.921 2.103 21.391 1.00 33.54 H new ATOM 0 HG12 ILE A 105 2.165 0.981 19.357 1.00 15.34 H new ATOM 0 HG13 ILE A 105 3.878 0.720 19.613 1.00 15.34 H new ATOM 0 HG21 ILE A 105 4.803 0.607 21.927 1.00 65.21 H new ATOM 0 HG22 ILE A 105 3.729 0.839 23.327 1.00 65.21 H new ATOM 0 HG23 ILE A 105 3.652 -0.670 22.388 1.00 65.21 H new ATOM 0 HD11 ILE A 105 2.780 -1.334 18.867 1.00 21.31 H new ATOM 0 HD12 ILE A 105 3.414 -1.529 20.519 1.00 21.31 H new ATOM 0 HD13 ILE A 105 1.673 -1.263 20.259 1.00 21.31 H new ATOM 1646 N SER A 106 1.844 2.324 23.753 1.00 13.33 N ATOM 1647 CA SER A 106 1.869 2.818 25.125 1.00 23.12 C ATOM 1648 C SER A 106 2.887 2.047 25.961 1.00 52.30 C ATOM 1649 O SER A 106 3.875 2.610 26.431 1.00 3.53 O ATOM 1650 CB SER A 106 0.481 2.702 25.757 1.00 11.23 C ATOM 1651 OG SER A 106 0.061 3.944 26.296 1.00 32.32 O ATOM 0 H SER A 106 2.270 2.951 23.071 1.00 13.33 H new ATOM 0 HA SER A 106 2.163 3.867 25.102 1.00 23.12 H new ATOM 0 HB2 SER A 106 -0.236 2.366 25.008 1.00 11.23 H new ATOM 0 HB3 SER A 106 0.498 1.948 26.544 1.00 11.23 H new ATOM 0 HG SER A 106 -0.830 3.844 26.693 1.00 32.32 H new ATOM 1657 N VAL A 107 2.637 0.754 26.142 1.00 51.23 N ATOM 1658 CA VAL A 107 3.531 -0.096 26.920 1.00 55.35 C ATOM 1659 C VAL A 107 4.826 -0.367 26.164 1.00 64.41 C ATOM 1660 O VAL A 107 4.807 -0.731 24.988 1.00 71.32 O ATOM 1661 CB VAL A 107 2.863 -1.438 27.271 1.00 30.53 C ATOM 1662 CG1 VAL A 107 1.629 -1.212 28.132 1.00 24.40 C ATOM 1663 CG2 VAL A 107 2.507 -2.204 26.006 1.00 42.24 C ATOM 0 H VAL A 107 1.823 0.272 25.761 1.00 51.23 H new ATOM 0 HA VAL A 107 3.757 0.440 27.841 1.00 55.35 H new ATOM 0 HB VAL A 107 3.571 -2.037 27.843 1.00 30.53 H new ATOM 0 HG11 VAL A 107 1.171 -2.172 28.370 1.00 24.40 H new ATOM 0 HG12 VAL A 107 1.917 -0.709 29.055 1.00 24.40 H new ATOM 0 HG13 VAL A 107 0.915 -0.593 27.589 1.00 24.40 H new ATOM 0 HG21 VAL A 107 2.036 -3.150 26.274 1.00 42.24 H new ATOM 0 HG22 VAL A 107 1.817 -1.612 25.404 1.00 42.24 H new ATOM 0 HG23 VAL A 107 3.413 -2.400 25.432 1.00 42.24 H new ATOM 1673 N TYR A 108 5.951 -0.189 26.847 1.00 45.20 N ATOM 1674 CA TYR A 108 7.258 -0.413 26.240 1.00 41.32 C ATOM 1675 C TYR A 108 8.096 -1.367 27.086 1.00 52.40 C ATOM 1676 O TYR A 108 7.913 -1.486 28.298 1.00 63.03 O ATOM 1677 CB TYR A 108 7.997 0.915 26.065 1.00 1.15 C ATOM 1678 CG TYR A 108 7.216 1.944 25.281 1.00 53.54 C ATOM 1679 CD1 TYR A 108 6.761 1.669 23.997 1.00 50.23 C ATOM 1680 CD2 TYR A 108 6.933 3.192 25.822 1.00 41.40 C ATOM 1681 CE1 TYR A 108 6.047 2.607 23.275 1.00 23.34 C ATOM 1682 CE2 TYR A 108 6.219 4.135 25.109 1.00 51.34 C ATOM 1683 CZ TYR A 108 5.778 3.838 23.836 1.00 64.02 C ATOM 1684 OH TYR A 108 5.068 4.775 23.121 1.00 11.24 O ATOM 0 H TYR A 108 5.984 0.110 27.822 1.00 45.20 H new ATOM 0 HA TYR A 108 7.102 -0.866 25.261 1.00 41.32 H new ATOM 0 HB2 TYR A 108 8.233 1.322 27.048 1.00 1.15 H new ATOM 0 HB3 TYR A 108 8.945 0.730 25.561 1.00 1.15 H new ATOM 0 HD1 TYR A 108 6.969 0.706 23.555 1.00 50.23 H new ATOM 0 HD2 TYR A 108 7.277 3.429 26.818 1.00 41.40 H new ATOM 0 HE1 TYR A 108 5.702 2.377 22.278 1.00 23.34 H new ATOM 0 HE2 TYR A 108 6.007 5.100 25.546 1.00 51.34 H new ATOM 0 HH TYR A 108 4.964 5.587 23.659 1.00 11.24 H new ATOM 1694 N PRO A 109 9.038 -2.063 26.433 1.00 2.40 N ATOM 1695 CA PRO A 109 9.264 -1.929 24.991 1.00 62.22 C ATOM 1696 C PRO A 109 8.122 -2.516 24.168 1.00 0.03 C ATOM 1697 O PRO A 109 7.146 -3.025 24.719 1.00 60.52 O ATOM 1698 CB PRO A 109 10.553 -2.722 24.759 1.00 73.33 C ATOM 1699 CG PRO A 109 10.594 -3.712 25.872 1.00 40.24 C ATOM 1700 CD PRO A 109 9.955 -3.034 27.052 1.00 24.03 C ATOM 0 HA PRO A 109 9.328 -0.885 24.684 1.00 62.22 H new ATOM 0 HB2 PRO A 109 10.544 -3.218 23.788 1.00 73.33 H new ATOM 0 HB3 PRO A 109 11.427 -2.071 24.776 1.00 73.33 H new ATOM 0 HG2 PRO A 109 10.055 -4.621 25.606 1.00 40.24 H new ATOM 0 HG3 PRO A 109 11.620 -4.004 26.098 1.00 40.24 H new ATOM 0 HD2 PRO A 109 9.421 -3.745 27.683 1.00 24.03 H new ATOM 0 HD3 PRO A 109 10.696 -2.542 27.682 1.00 24.03 H new ATOM 1708 N SER A 110 8.251 -2.441 22.847 1.00 32.25 N ATOM 1709 CA SER A 110 7.227 -2.962 21.949 1.00 22.20 C ATOM 1710 C SER A 110 7.817 -3.275 20.577 1.00 53.31 C ATOM 1711 O SER A 110 8.913 -2.824 20.243 1.00 32.53 O ATOM 1712 CB SER A 110 6.083 -1.957 21.808 1.00 53.10 C ATOM 1713 OG SER A 110 5.087 -2.177 22.792 1.00 54.14 O ATOM 0 H SER A 110 9.054 -2.025 22.375 1.00 32.25 H new ATOM 0 HA SER A 110 6.838 -3.886 22.378 1.00 22.20 H new ATOM 0 HB2 SER A 110 6.472 -0.943 21.900 1.00 53.10 H new ATOM 0 HB3 SER A 110 5.642 -2.040 20.815 1.00 53.10 H new ATOM 0 HG SER A 110 5.252 -1.593 23.561 1.00 54.14 H new ATOM 1719 N TRP A 111 7.081 -4.048 19.787 1.00 64.33 N ATOM 1720 CA TRP A 111 7.531 -4.422 18.450 1.00 13.23 C ATOM 1721 C TRP A 111 6.381 -4.357 17.452 1.00 75.25 C ATOM 1722 O TRP A 111 5.212 -4.363 17.836 1.00 34.00 O ATOM 1723 CB TRP A 111 8.130 -5.829 18.466 1.00 2.12 C ATOM 1724 CG TRP A 111 9.538 -5.869 18.980 1.00 72.05 C ATOM 1725 CD1 TRP A 111 9.933 -5.927 20.286 1.00 55.14 C ATOM 1726 CD2 TRP A 111 10.736 -5.852 18.196 1.00 23.35 C ATOM 1727 NE1 TRP A 111 11.304 -5.947 20.362 1.00 64.03 N ATOM 1728 CE2 TRP A 111 11.821 -5.903 19.094 1.00 70.12 C ATOM 1729 CE3 TRP A 111 10.999 -5.801 16.825 1.00 71.51 C ATOM 1730 CZ2 TRP A 111 13.145 -5.903 18.662 1.00 74.01 C ATOM 1731 CZ3 TRP A 111 12.313 -5.801 16.398 1.00 61.21 C ATOM 1732 CH2 TRP A 111 13.373 -5.853 17.314 1.00 55.54 C ATOM 0 H TRP A 111 6.171 -4.428 20.048 1.00 64.33 H new ATOM 0 HA TRP A 111 8.298 -3.712 18.140 1.00 13.23 H new ATOM 0 HB2 TRP A 111 7.506 -6.475 19.084 1.00 2.12 H new ATOM 0 HB3 TRP A 111 8.108 -6.237 17.456 1.00 2.12 H new ATOM 0 HD1 TRP A 111 9.265 -5.953 21.134 1.00 55.14 H new ATOM 0 HE1 TRP A 111 11.849 -5.988 21.223 1.00 64.03 H new ATOM 0 HE3 TRP A 111 10.189 -5.762 16.111 1.00 71.51 H new ATOM 0 HZ2 TRP A 111 13.963 -5.941 19.366 1.00 74.01 H new ATOM 0 HZ3 TRP A 111 12.527 -5.760 15.340 1.00 61.21 H new ATOM 0 HH2 TRP A 111 14.389 -5.854 16.948 1.00 55.54 H new ATOM 1743 N ALA A 112 6.720 -4.296 16.168 1.00 13.10 N ATOM 1744 CA ALA A 112 5.715 -4.233 15.114 1.00 15.44 C ATOM 1745 C ALA A 112 6.343 -4.452 13.742 1.00 33.13 C ATOM 1746 O ALA A 112 7.130 -3.631 13.270 1.00 52.21 O ATOM 1747 CB ALA A 112 4.989 -2.896 15.157 1.00 52.00 C ATOM 0 H ALA A 112 7.683 -4.289 15.833 1.00 13.10 H new ATOM 0 HA ALA A 112 4.994 -5.032 15.286 1.00 15.44 H new ATOM 0 HB1 ALA A 112 4.241 -2.862 14.365 1.00 52.00 H new ATOM 0 HB2 ALA A 112 4.499 -2.779 16.124 1.00 52.00 H new ATOM 0 HB3 ALA A 112 5.706 -2.088 15.014 1.00 52.00 H new ATOM 1753 N LEU A 113 5.991 -5.565 13.107 1.00 2.42 N ATOM 1754 CA LEU A 113 6.522 -5.893 11.788 1.00 15.33 C ATOM 1755 C LEU A 113 5.584 -5.406 10.688 1.00 42.20 C ATOM 1756 O LEU A 113 4.364 -5.527 10.800 1.00 31.00 O ATOM 1757 CB LEU A 113 6.733 -7.403 11.663 1.00 14.40 C ATOM 1758 CG LEU A 113 7.633 -7.861 10.516 1.00 61.54 C ATOM 1759 CD1 LEU A 113 8.142 -9.272 10.768 1.00 61.22 C ATOM 1760 CD2 LEU A 113 6.887 -7.790 9.191 1.00 22.51 C ATOM 0 H LEU A 113 5.341 -6.255 13.484 1.00 2.42 H new ATOM 0 HA LEU A 113 7.481 -5.388 11.673 1.00 15.33 H new ATOM 0 HB2 LEU A 113 7.156 -7.769 12.599 1.00 14.40 H new ATOM 0 HB3 LEU A 113 5.759 -7.878 11.546 1.00 14.40 H new ATOM 0 HG LEU A 113 8.491 -7.191 10.463 1.00 61.54 H new ATOM 0 HD11 LEU A 113 8.781 -9.581 9.941 1.00 61.22 H new ATOM 0 HD12 LEU A 113 8.714 -9.292 11.696 1.00 61.22 H new ATOM 0 HD13 LEU A 113 7.296 -9.955 10.848 1.00 61.22 H new ATOM 0 HD21 LEU A 113 7.543 -8.120 8.386 1.00 22.51 H new ATOM 0 HD22 LEU A 113 6.010 -8.436 9.232 1.00 22.51 H new ATOM 0 HD23 LEU A 113 6.572 -6.763 9.005 1.00 22.51 H new ATOM 1772 N ILE A 114 6.163 -4.857 9.625 1.00 14.11 N ATOM 1773 CA ILE A 114 5.379 -4.355 8.503 1.00 31.13 C ATOM 1774 C ILE A 114 5.775 -5.046 7.203 1.00 23.10 C ATOM 1775 O ILE A 114 6.914 -4.934 6.750 1.00 34.12 O ATOM 1776 CB ILE A 114 5.547 -2.834 8.335 1.00 42.51 C ATOM 1777 CG1 ILE A 114 5.357 -2.126 9.678 1.00 55.41 C ATOM 1778 CG2 ILE A 114 4.561 -2.302 7.305 1.00 21.42 C ATOM 1779 CD1 ILE A 114 3.968 -2.290 10.256 1.00 43.12 C ATOM 0 H ILE A 114 7.171 -4.749 9.517 1.00 14.11 H new ATOM 0 HA ILE A 114 4.335 -4.574 8.724 1.00 31.13 H new ATOM 0 HB ILE A 114 6.557 -2.633 7.979 1.00 42.51 H new ATOM 0 HG12 ILE A 114 6.086 -2.513 10.390 1.00 55.41 H new ATOM 0 HG13 ILE A 114 5.567 -1.064 9.553 1.00 55.41 H new ATOM 0 HG21 ILE A 114 4.692 -1.225 7.198 1.00 21.42 H new ATOM 0 HG22 ILE A 114 4.740 -2.787 6.345 1.00 21.42 H new ATOM 0 HG23 ILE A 114 3.543 -2.512 7.633 1.00 21.42 H new ATOM 0 HD11 ILE A 114 3.905 -1.762 11.208 1.00 43.12 H new ATOM 0 HD12 ILE A 114 3.235 -1.877 9.563 1.00 43.12 H new ATOM 0 HD13 ILE A 114 3.762 -3.349 10.414 1.00 43.12 H new ATOM 1791 N GLY A 115 4.826 -5.760 6.605 1.00 22.44 N ATOM 1792 CA GLY A 115 5.095 -6.458 5.361 1.00 0.25 C ATOM 1793 C GLY A 115 5.719 -5.556 4.315 1.00 60.54 C ATOM 1794 O GLY A 115 5.648 -4.332 4.417 1.00 43.52 O ATOM 0 H GLY A 115 3.876 -5.868 6.960 1.00 22.44 H new ATOM 0 HA2 GLY A 115 5.761 -7.298 5.556 1.00 0.25 H new ATOM 0 HA3 GLY A 115 4.165 -6.872 4.972 1.00 0.25 H new ATOM 1798 N LYS A 116 6.334 -6.163 3.305 1.00 51.32 N ATOM 1799 CA LYS A 116 6.974 -5.408 2.234 1.00 1.11 C ATOM 1800 C LYS A 116 5.985 -4.451 1.576 1.00 32.31 C ATOM 1801 O LYS A 116 6.363 -3.376 1.112 1.00 55.54 O ATOM 1802 CB LYS A 116 7.552 -6.361 1.186 1.00 45.14 C ATOM 1803 CG LYS A 116 6.500 -6.988 0.287 1.00 4.40 C ATOM 1804 CD LYS A 116 7.112 -8.004 -0.662 1.00 71.24 C ATOM 1805 CE LYS A 116 6.953 -9.423 -0.138 1.00 13.02 C ATOM 1806 NZ LYS A 116 5.640 -10.012 -0.521 1.00 14.12 N ATOM 0 H LYS A 116 6.403 -7.176 3.206 1.00 51.32 H new ATOM 0 HA LYS A 116 7.783 -4.822 2.670 1.00 1.11 H new ATOM 0 HB2 LYS A 116 8.268 -5.818 0.569 1.00 45.14 H new ATOM 0 HB3 LYS A 116 8.104 -7.153 1.692 1.00 45.14 H new ATOM 0 HG2 LYS A 116 5.739 -7.472 0.899 1.00 4.40 H new ATOM 0 HG3 LYS A 116 5.999 -6.208 -0.287 1.00 4.40 H new ATOM 0 HD2 LYS A 116 6.638 -7.921 -1.640 1.00 71.24 H new ATOM 0 HD3 LYS A 116 8.170 -7.783 -0.801 1.00 71.24 H new ATOM 0 HE2 LYS A 116 7.758 -10.046 -0.527 1.00 13.02 H new ATOM 0 HE3 LYS A 116 7.048 -9.422 0.948 1.00 13.02 H new ATOM 0 HZ1 LYS A 116 5.571 -10.979 -0.145 1.00 14.12 H new ATOM 0 HZ2 LYS A 116 4.871 -9.432 -0.128 1.00 14.12 H new ATOM 0 HZ3 LYS A 116 5.560 -10.037 -1.558 1.00 14.12 H new ATOM 1820 N ASP A 117 4.718 -4.849 1.541 1.00 30.43 N ATOM 1821 CA ASP A 117 3.674 -4.026 0.943 1.00 51.15 C ATOM 1822 C ASP A 117 3.499 -2.723 1.716 1.00 1.31 C ATOM 1823 O ASP A 117 2.887 -1.775 1.225 1.00 21.04 O ATOM 1824 CB ASP A 117 2.350 -4.792 0.903 1.00 5.42 C ATOM 1825 CG ASP A 117 1.928 -5.145 -0.509 1.00 72.11 C ATOM 1826 OD1 ASP A 117 2.311 -6.233 -0.989 1.00 12.12 O ATOM 1827 OD2 ASP A 117 1.213 -4.334 -1.135 1.00 23.34 O ATOM 0 H ASP A 117 4.389 -5.737 1.920 1.00 30.43 H new ATOM 0 HA ASP A 117 3.976 -3.785 -0.076 1.00 51.15 H new ATOM 0 HB2 ASP A 117 2.444 -5.706 1.490 1.00 5.42 H new ATOM 0 HB3 ASP A 117 1.571 -4.191 1.372 1.00 5.42 H new ATOM 1832 N GLY A 118 4.041 -2.683 2.930 1.00 73.51 N ATOM 1833 CA GLY A 118 3.932 -1.493 3.752 1.00 5.33 C ATOM 1834 C GLY A 118 2.734 -1.535 4.679 1.00 54.12 C ATOM 1835 O GLY A 118 2.247 -0.495 5.123 1.00 53.02 O ATOM 0 H GLY A 118 4.553 -3.454 3.358 1.00 73.51 H new ATOM 0 HA2 GLY A 118 4.841 -1.379 4.343 1.00 5.33 H new ATOM 0 HA3 GLY A 118 3.859 -0.616 3.108 1.00 5.33 H new ATOM 1839 N ASP A 119 2.255 -2.740 4.970 1.00 4.41 N ATOM 1840 CA ASP A 119 1.105 -2.913 5.850 1.00 61.45 C ATOM 1841 C ASP A 119 1.486 -3.714 7.091 1.00 60.44 C ATOM 1842 O ASP A 119 2.435 -4.499 7.069 1.00 12.42 O ATOM 1843 CB ASP A 119 -0.032 -3.614 5.104 1.00 12.14 C ATOM 1844 CG ASP A 119 -1.333 -3.593 5.882 1.00 14.22 C ATOM 1845 OD1 ASP A 119 -1.494 -2.706 6.747 1.00 24.33 O ATOM 1846 OD2 ASP A 119 -2.192 -4.462 5.625 1.00 21.21 O ATOM 0 H ASP A 119 2.645 -3.611 4.609 1.00 4.41 H new ATOM 0 HA ASP A 119 0.768 -1.926 6.167 1.00 61.45 H new ATOM 0 HB2 ASP A 119 -0.181 -3.131 4.138 1.00 12.14 H new ATOM 0 HB3 ASP A 119 0.251 -4.647 4.903 1.00 12.14 H new ATOM 1851 N VAL A 120 0.740 -3.511 8.172 1.00 3.11 N ATOM 1852 CA VAL A 120 1.000 -4.214 9.423 1.00 55.02 C ATOM 1853 C VAL A 120 0.889 -5.723 9.238 1.00 62.21 C ATOM 1854 O VAL A 120 0.032 -6.206 8.499 1.00 32.30 O ATOM 1855 CB VAL A 120 0.023 -3.771 10.529 1.00 43.44 C ATOM 1856 CG1 VAL A 120 0.342 -4.478 11.837 1.00 12.42 C ATOM 1857 CG2 VAL A 120 0.069 -2.260 10.704 1.00 35.24 C ATOM 0 H VAL A 120 -0.049 -2.866 8.207 1.00 3.11 H new ATOM 0 HA VAL A 120 2.017 -3.961 9.723 1.00 55.02 H new ATOM 0 HB VAL A 120 -0.988 -4.049 10.231 1.00 43.44 H new ATOM 0 HG11 VAL A 120 -0.358 -4.153 12.607 1.00 12.42 H new ATOM 0 HG12 VAL A 120 0.254 -5.556 11.699 1.00 12.42 H new ATOM 0 HG13 VAL A 120 1.359 -4.233 12.144 1.00 12.42 H new ATOM 0 HG21 VAL A 120 -0.627 -1.963 11.489 1.00 35.24 H new ATOM 0 HG22 VAL A 120 1.079 -1.956 10.980 1.00 35.24 H new ATOM 0 HG23 VAL A 120 -0.212 -1.777 9.768 1.00 35.24 H new ATOM 1867 N GLN A 121 1.762 -6.462 9.915 1.00 65.14 N ATOM 1868 CA GLN A 121 1.763 -7.917 9.824 1.00 31.53 C ATOM 1869 C GLN A 121 1.724 -8.549 11.212 1.00 5.00 C ATOM 1870 O GLN A 121 1.030 -9.541 11.434 1.00 24.21 O ATOM 1871 CB GLN A 121 2.999 -8.402 9.065 1.00 71.05 C ATOM 1872 CG GLN A 121 2.810 -9.754 8.395 1.00 3.30 C ATOM 1873 CD GLN A 121 3.754 -9.963 7.227 1.00 32.20 C ATOM 1874 OE1 GLN A 121 4.763 -9.269 7.097 1.00 75.13 O ATOM 1875 NE2 GLN A 121 3.431 -10.924 6.369 1.00 35.15 N ATOM 0 H GLN A 121 2.477 -6.077 10.532 1.00 65.14 H new ATOM 0 HA GLN A 121 0.869 -8.222 9.280 1.00 31.53 H new ATOM 0 HB2 GLN A 121 3.263 -7.664 8.307 1.00 71.05 H new ATOM 0 HB3 GLN A 121 3.839 -8.463 9.757 1.00 71.05 H new ATOM 0 HG2 GLN A 121 2.966 -10.544 9.129 1.00 3.30 H new ATOM 0 HG3 GLN A 121 1.781 -9.842 8.046 1.00 3.30 H new ATOM 0 HE21 GLN A 121 2.585 -11.475 6.515 1.00 35.15 H new ATOM 0 HE22 GLN A 121 4.029 -11.111 5.564 1.00 35.15 H new ATOM 1884 N ARG A 122 2.475 -7.968 12.142 1.00 12.43 N ATOM 1885 CA ARG A 122 2.528 -8.475 13.508 1.00 14.31 C ATOM 1886 C ARG A 122 2.888 -7.362 14.488 1.00 50.32 C ATOM 1887 O ARG A 122 3.595 -6.417 14.136 1.00 54.41 O ATOM 1888 CB ARG A 122 3.546 -9.611 13.614 1.00 62.23 C ATOM 1889 CG ARG A 122 2.952 -10.987 13.361 1.00 60.12 C ATOM 1890 CD ARG A 122 1.883 -11.330 14.387 1.00 43.40 C ATOM 1891 NE ARG A 122 2.319 -11.036 15.750 1.00 51.13 N ATOM 1892 CZ ARG A 122 1.483 -10.865 16.768 1.00 72.52 C ATOM 1893 NH1 ARG A 122 0.174 -10.960 16.578 1.00 50.40 N ATOM 1894 NH2 ARG A 122 1.956 -10.601 17.979 1.00 53.10 N ATOM 0 H ARG A 122 3.055 -7.146 11.974 1.00 12.43 H new ATOM 0 HA ARG A 122 1.540 -8.857 13.765 1.00 14.31 H new ATOM 0 HB2 ARG A 122 4.350 -9.435 12.899 1.00 62.23 H new ATOM 0 HB3 ARG A 122 3.993 -9.595 14.608 1.00 62.23 H new ATOM 0 HG2 ARG A 122 2.521 -11.020 12.360 1.00 60.12 H new ATOM 0 HG3 ARG A 122 3.742 -11.737 13.393 1.00 60.12 H new ATOM 0 HD2 ARG A 122 0.976 -10.767 14.167 1.00 43.40 H new ATOM 0 HD3 ARG A 122 1.630 -12.387 14.307 1.00 43.40 H new ATOM 0 HE ARG A 122 3.320 -10.958 15.930 1.00 51.13 H new ATOM 0 HH11 ARG A 122 -0.193 -11.165 15.649 1.00 50.40 H new ATOM 0 HH12 ARG A 122 -0.466 -10.828 17.361 1.00 50.40 H new ATOM 0 HH21 ARG A 122 2.962 -10.529 18.129 1.00 53.10 H new ATOM 0 HH22 ARG A 122 1.313 -10.470 18.760 1.00 53.10 H new ATOM 1908 N ILE A 123 2.397 -7.481 15.717 1.00 43.32 N ATOM 1909 CA ILE A 123 2.668 -6.485 16.747 1.00 62.34 C ATOM 1910 C ILE A 123 2.756 -7.131 18.125 1.00 11.44 C ATOM 1911 O ILE A 123 1.833 -7.820 18.560 1.00 1.11 O ATOM 1912 CB ILE A 123 1.584 -5.392 16.772 1.00 73.01 C ATOM 1913 CG1 ILE A 123 1.678 -4.520 15.518 1.00 4.02 C ATOM 1914 CG2 ILE A 123 1.718 -4.542 18.026 1.00 12.14 C ATOM 1915 CD1 ILE A 123 0.494 -3.597 15.333 1.00 21.31 C ATOM 0 H ILE A 123 1.810 -8.257 16.024 1.00 43.32 H new ATOM 0 HA ILE A 123 3.626 -6.028 16.501 1.00 62.34 H new ATOM 0 HB ILE A 123 0.605 -5.872 16.785 1.00 73.01 H new ATOM 0 HG12 ILE A 123 2.589 -3.923 15.568 1.00 4.02 H new ATOM 0 HG13 ILE A 123 1.766 -5.164 14.643 1.00 4.02 H new ATOM 0 HG21 ILE A 123 0.945 -3.774 18.029 1.00 12.14 H new ATOM 0 HG22 ILE A 123 1.606 -5.173 18.907 1.00 12.14 H new ATOM 0 HG23 ILE A 123 2.700 -4.069 18.042 1.00 12.14 H new ATOM 0 HD11 ILE A 123 0.629 -3.010 14.425 1.00 21.31 H new ATOM 0 HD12 ILE A 123 -0.418 -4.188 15.251 1.00 21.31 H new ATOM 0 HD13 ILE A 123 0.417 -2.928 16.190 1.00 21.31 H new ATOM 1927 N VAL A 124 3.872 -6.901 18.810 1.00 13.14 N ATOM 1928 CA VAL A 124 4.080 -7.457 20.142 1.00 75.20 C ATOM 1929 C VAL A 124 4.303 -6.354 21.170 1.00 52.41 C ATOM 1930 O VAL A 124 4.902 -5.321 20.869 1.00 64.31 O ATOM 1931 CB VAL A 124 5.283 -8.418 20.167 1.00 31.33 C ATOM 1932 CG1 VAL A 124 5.569 -8.879 21.588 1.00 0.35 C ATOM 1933 CG2 VAL A 124 5.033 -9.608 19.253 1.00 43.03 C ATOM 0 H VAL A 124 4.646 -6.333 18.464 1.00 13.14 H new ATOM 0 HA VAL A 124 3.177 -8.010 20.398 1.00 75.20 H new ATOM 0 HB VAL A 124 6.160 -7.884 19.800 1.00 31.33 H new ATOM 0 HG11 VAL A 124 6.422 -9.557 21.586 1.00 0.35 H new ATOM 0 HG12 VAL A 124 5.794 -8.015 22.213 1.00 0.35 H new ATOM 0 HG13 VAL A 124 4.696 -9.396 21.986 1.00 0.35 H new ATOM 0 HG21 VAL A 124 5.893 -10.277 19.283 1.00 43.03 H new ATOM 0 HG22 VAL A 124 4.145 -10.144 19.588 1.00 43.03 H new ATOM 0 HG23 VAL A 124 4.881 -9.257 18.232 1.00 43.03 H new ATOM 1943 N LYS A 125 3.817 -6.578 22.386 1.00 73.31 N ATOM 1944 CA LYS A 125 3.964 -5.605 23.461 1.00 12.51 C ATOM 1945 C LYS A 125 5.021 -6.056 24.463 1.00 20.35 C ATOM 1946 O LYS A 125 4.697 -6.502 25.563 1.00 2.15 O ATOM 1947 CB LYS A 125 2.626 -5.396 24.174 1.00 11.52 C ATOM 1948 CG LYS A 125 1.948 -6.690 24.587 1.00 21.54 C ATOM 1949 CD LYS A 125 0.804 -7.044 23.652 1.00 12.13 C ATOM 1950 CE LYS A 125 0.409 -8.507 23.782 1.00 24.12 C ATOM 1951 NZ LYS A 125 -0.998 -8.742 23.356 1.00 30.11 N ATOM 0 H LYS A 125 3.317 -7.426 22.652 1.00 73.31 H new ATOM 0 HA LYS A 125 4.286 -4.661 23.021 1.00 12.51 H new ATOM 0 HB2 LYS A 125 2.788 -4.782 25.060 1.00 11.52 H new ATOM 0 HB3 LYS A 125 1.957 -4.839 23.518 1.00 11.52 H new ATOM 0 HG2 LYS A 125 2.679 -7.499 24.592 1.00 21.54 H new ATOM 0 HG3 LYS A 125 1.571 -6.595 25.605 1.00 21.54 H new ATOM 0 HD2 LYS A 125 -0.057 -6.413 23.873 1.00 12.13 H new ATOM 0 HD3 LYS A 125 1.096 -6.835 22.623 1.00 12.13 H new ATOM 0 HE2 LYS A 125 1.078 -9.119 23.177 1.00 24.12 H new ATOM 0 HE3 LYS A 125 0.533 -8.826 24.817 1.00 24.12 H new ATOM 0 HZ1 LYS A 125 -1.228 -9.751 23.460 1.00 30.11 H new ATOM 0 HZ2 LYS A 125 -1.639 -8.178 23.949 1.00 30.11 H new ATOM 0 HZ3 LYS A 125 -1.111 -8.462 22.361 1.00 30.11 H new ATOM 1965 N GLY A 126 6.287 -5.937 24.076 1.00 43.42 N ATOM 1966 CA GLY A 126 7.372 -6.336 24.953 1.00 45.31 C ATOM 1967 C GLY A 126 8.727 -6.245 24.278 1.00 73.11 C ATOM 1968 O GLY A 126 8.910 -5.469 23.340 1.00 74.53 O ATOM 0 H GLY A 126 6.581 -5.571 23.170 1.00 43.42 H new ATOM 0 HA2 GLY A 126 7.369 -5.704 25.841 1.00 45.31 H new ATOM 0 HA3 GLY A 126 7.205 -7.359 25.290 1.00 45.31 H new ATOM 1972 N SER A 127 9.679 -7.039 24.757 1.00 42.21 N ATOM 1973 CA SER A 127 11.026 -7.041 24.197 1.00 13.00 C ATOM 1974 C SER A 127 11.448 -8.453 23.804 1.00 62.23 C ATOM 1975 O SER A 127 12.028 -9.185 24.606 1.00 25.21 O ATOM 1976 CB SER A 127 12.020 -6.461 25.204 1.00 5.41 C ATOM 1977 OG SER A 127 12.719 -5.358 24.653 1.00 1.31 O ATOM 0 H SER A 127 9.543 -7.689 25.531 1.00 42.21 H new ATOM 0 HA SER A 127 11.022 -6.419 23.302 1.00 13.00 H new ATOM 0 HB2 SER A 127 11.490 -6.147 26.103 1.00 5.41 H new ATOM 0 HB3 SER A 127 12.730 -7.232 25.505 1.00 5.41 H new ATOM 0 HG SER A 127 13.649 -5.614 24.479 1.00 1.31 H new ATOM 1983 N ILE A 128 11.153 -8.829 22.564 1.00 52.42 N ATOM 1984 CA ILE A 128 11.502 -10.152 22.063 1.00 25.01 C ATOM 1985 C ILE A 128 13.002 -10.404 22.175 1.00 3.34 C ATOM 1986 O ILE A 128 13.796 -9.466 22.246 1.00 75.10 O ATOM 1987 CB ILE A 128 11.072 -10.330 20.595 1.00 31.42 C ATOM 1988 CG1 ILE A 128 11.784 -9.310 19.705 1.00 55.14 C ATOM 1989 CG2 ILE A 128 9.562 -10.193 20.466 1.00 63.14 C ATOM 1990 CD1 ILE A 128 11.711 -9.640 18.230 1.00 13.12 C ATOM 0 H ILE A 128 10.673 -8.235 21.888 1.00 52.42 H new ATOM 0 HA ILE A 128 10.967 -10.874 22.680 1.00 25.01 H new ATOM 0 HB ILE A 128 11.356 -11.330 20.267 1.00 31.42 H new ATOM 0 HG12 ILE A 128 11.345 -8.326 19.871 1.00 55.14 H new ATOM 0 HG13 ILE A 128 12.830 -9.247 20.004 1.00 55.14 H new ATOM 0 HG21 ILE A 128 9.273 -10.321 19.423 1.00 63.14 H new ATOM 0 HG22 ILE A 128 9.074 -10.955 21.074 1.00 63.14 H new ATOM 0 HG23 ILE A 128 9.256 -9.205 20.809 1.00 63.14 H new ATOM 0 HD11 ILE A 128 12.237 -8.874 17.659 1.00 13.12 H new ATOM 0 HD12 ILE A 128 12.176 -10.609 18.051 1.00 13.12 H new ATOM 0 HD13 ILE A 128 10.668 -9.674 17.916 1.00 13.12 H new ATOM 2002 N ASN A 129 13.384 -11.677 22.190 1.00 53.24 N ATOM 2003 CA ASN A 129 14.789 -12.053 22.292 1.00 41.41 C ATOM 2004 C ASN A 129 15.372 -12.359 20.916 1.00 72.43 C ATOM 2005 O ASN A 129 14.690 -12.230 19.900 1.00 73.22 O ATOM 2006 CB ASN A 129 14.948 -13.268 23.208 1.00 43.30 C ATOM 2007 CG ASN A 129 15.545 -12.903 24.554 1.00 72.03 C ATOM 2008 OD1 ASN A 129 16.735 -12.608 24.658 1.00 25.11 O ATOM 2009 ND2 ASN A 129 14.717 -12.922 25.592 1.00 2.11 N ATOM 0 H ASN A 129 12.740 -12.466 22.133 1.00 53.24 H new ATOM 0 HA ASN A 129 15.335 -11.211 22.718 1.00 41.41 H new ATOM 0 HB2 ASN A 129 13.975 -13.735 23.360 1.00 43.30 H new ATOM 0 HB3 ASN A 129 15.584 -14.007 22.720 1.00 43.30 H new ATOM 0 HD21 ASN A 129 15.061 -12.686 26.523 1.00 2.11 H new ATOM 0 HD22 ASN A 129 13.737 -13.173 25.458 1.00 2.11 H new ATOM 2016 N GLU A 130 16.637 -12.767 20.892 1.00 10.30 N ATOM 2017 CA GLU A 130 17.311 -13.092 19.640 1.00 11.44 C ATOM 2018 C GLU A 130 16.514 -14.121 18.845 1.00 60.42 C ATOM 2019 O GLU A 130 15.813 -13.779 17.893 1.00 21.11 O ATOM 2020 CB GLU A 130 18.719 -13.623 19.917 1.00 41.45 C ATOM 2021 CG GLU A 130 19.722 -12.536 20.264 1.00 43.53 C ATOM 2022 CD GLU A 130 20.383 -12.760 21.610 1.00 10.30 C ATOM 2023 OE1 GLU A 130 19.662 -13.079 22.578 1.00 15.03 O ATOM 2024 OE2 GLU A 130 21.620 -12.616 21.696 1.00 43.23 O ATOM 0 H GLU A 130 17.215 -12.880 21.724 1.00 10.30 H new ATOM 0 HA GLU A 130 17.385 -12.180 19.048 1.00 11.44 H new ATOM 0 HB2 GLU A 130 18.673 -14.339 20.738 1.00 41.45 H new ATOM 0 HB3 GLU A 130 19.073 -14.165 19.040 1.00 41.45 H new ATOM 0 HG2 GLU A 130 20.488 -12.493 19.490 1.00 43.53 H new ATOM 0 HG3 GLU A 130 19.218 -11.570 20.267 1.00 43.53 H new ATOM 2031 N ALA A 131 16.628 -15.385 19.242 1.00 10.51 N ATOM 2032 CA ALA A 131 15.918 -16.464 18.568 1.00 31.41 C ATOM 2033 C ALA A 131 14.452 -16.106 18.351 1.00 13.11 C ATOM 2034 O ALA A 131 13.876 -16.414 17.308 1.00 64.31 O ATOM 2035 CB ALA A 131 16.035 -17.753 19.368 1.00 63.30 C ATOM 0 H ALA A 131 17.206 -15.686 20.027 1.00 10.51 H new ATOM 0 HA ALA A 131 16.377 -16.612 17.591 1.00 31.41 H new ATOM 0 HB1 ALA A 131 15.500 -18.551 18.853 1.00 63.30 H new ATOM 0 HB2 ALA A 131 17.086 -18.026 19.467 1.00 63.30 H new ATOM 0 HB3 ALA A 131 15.603 -17.607 20.358 1.00 63.30 H new ATOM 2041 N GLN A 132 13.854 -15.454 19.343 1.00 33.11 N ATOM 2042 CA GLN A 132 12.454 -15.055 19.260 1.00 74.41 C ATOM 2043 C GLN A 132 12.183 -14.283 17.973 1.00 71.53 C ATOM 2044 O GLN A 132 11.196 -14.535 17.283 1.00 74.04 O ATOM 2045 CB GLN A 132 12.072 -14.202 20.470 1.00 13.24 C ATOM 2046 CG GLN A 132 11.096 -14.886 21.414 1.00 24.43 C ATOM 2047 CD GLN A 132 11.569 -14.870 22.855 1.00 50.53 C ATOM 2048 OE1 GLN A 132 11.588 -13.822 23.502 1.00 72.13 O ATOM 2049 NE2 GLN A 132 11.954 -16.033 23.365 1.00 31.33 N ATOM 0 H GLN A 132 14.317 -15.191 20.213 1.00 33.11 H new ATOM 0 HA GLN A 132 11.845 -15.959 19.255 1.00 74.41 H new ATOM 0 HB2 GLN A 132 12.976 -13.943 21.021 1.00 13.24 H new ATOM 0 HB3 GLN A 132 11.632 -13.268 20.121 1.00 13.24 H new ATOM 0 HG2 GLN A 132 10.126 -14.392 21.348 1.00 24.43 H new ATOM 0 HG3 GLN A 132 10.950 -15.918 21.095 1.00 24.43 H new ATOM 0 HE21 GLN A 132 11.922 -16.877 22.793 1.00 31.33 H new ATOM 0 HE22 GLN A 132 12.282 -16.083 24.329 1.00 31.33 H new ATOM 2058 N ALA A 133 13.066 -13.342 17.656 1.00 24.50 N ATOM 2059 CA ALA A 133 12.923 -12.535 16.451 1.00 44.00 C ATOM 2060 C ALA A 133 13.022 -13.397 15.197 1.00 30.53 C ATOM 2061 O ALA A 133 12.274 -13.204 14.238 1.00 42.03 O ATOM 2062 CB ALA A 133 13.977 -11.438 16.423 1.00 11.51 C ATOM 0 H ALA A 133 13.888 -13.120 18.217 1.00 24.50 H new ATOM 0 HA ALA A 133 11.935 -12.075 16.467 1.00 44.00 H new ATOM 0 HB1 ALA A 133 13.859 -10.843 15.518 1.00 11.51 H new ATOM 0 HB2 ALA A 133 13.858 -10.797 17.297 1.00 11.51 H new ATOM 0 HB3 ALA A 133 14.970 -11.887 16.435 1.00 11.51 H new ATOM 2068 N LEU A 134 13.949 -14.349 15.211 1.00 33.10 N ATOM 2069 CA LEU A 134 14.146 -15.242 14.074 1.00 14.21 C ATOM 2070 C LEU A 134 12.853 -15.971 13.724 1.00 34.54 C ATOM 2071 O LEU A 134 12.460 -16.036 12.560 1.00 63.12 O ATOM 2072 CB LEU A 134 15.249 -16.255 14.381 1.00 24.24 C ATOM 2073 CG LEU A 134 16.684 -15.733 14.293 1.00 12.11 C ATOM 2074 CD1 LEU A 134 16.956 -15.150 12.915 1.00 15.41 C ATOM 2075 CD2 LEU A 134 16.940 -14.693 15.374 1.00 23.33 C ATOM 0 H LEU A 134 14.576 -14.522 15.997 1.00 33.10 H new ATOM 0 HA LEU A 134 14.444 -14.638 13.217 1.00 14.21 H new ATOM 0 HB2 LEU A 134 15.087 -16.645 15.386 1.00 24.24 H new ATOM 0 HB3 LEU A 134 15.146 -17.094 13.693 1.00 24.24 H new ATOM 0 HG LEU A 134 17.365 -16.569 14.452 1.00 12.11 H new ATOM 0 HD11 LEU A 134 17.982 -14.784 12.871 1.00 15.41 H new ATOM 0 HD12 LEU A 134 16.814 -15.922 12.159 1.00 15.41 H new ATOM 0 HD13 LEU A 134 16.268 -14.326 12.726 1.00 15.41 H new ATOM 0 HD21 LEU A 134 17.966 -14.333 15.296 1.00 23.33 H new ATOM 0 HD22 LEU A 134 16.251 -13.858 15.246 1.00 23.33 H new ATOM 0 HD23 LEU A 134 16.787 -15.143 16.355 1.00 23.33 H new ATOM 2087 N ALA A 135 12.194 -16.518 14.741 1.00 12.32 N ATOM 2088 CA ALA A 135 10.943 -17.239 14.542 1.00 52.32 C ATOM 2089 C ALA A 135 9.781 -16.274 14.328 1.00 63.11 C ATOM 2090 O ALA A 135 8.781 -16.621 13.698 1.00 10.41 O ATOM 2091 CB ALA A 135 10.664 -18.149 15.728 1.00 34.34 C ATOM 0 H ALA A 135 12.506 -16.475 15.711 1.00 12.32 H new ATOM 0 HA ALA A 135 11.043 -17.850 13.645 1.00 52.32 H new ATOM 0 HB1 ALA A 135 9.727 -18.681 15.566 1.00 34.34 H new ATOM 0 HB2 ALA A 135 11.476 -18.868 15.834 1.00 34.34 H new ATOM 0 HB3 ALA A 135 10.589 -17.551 16.636 1.00 34.34 H new ATOM 2097 N LEU A 136 9.919 -15.063 14.856 1.00 64.01 N ATOM 2098 CA LEU A 136 8.881 -14.048 14.723 1.00 15.52 C ATOM 2099 C LEU A 136 8.797 -13.538 13.288 1.00 70.42 C ATOM 2100 O LEU A 136 7.733 -13.122 12.828 1.00 45.33 O ATOM 2101 CB LEU A 136 9.155 -12.882 15.675 1.00 51.32 C ATOM 2102 CG LEU A 136 8.149 -11.731 15.634 1.00 34.12 C ATOM 2103 CD1 LEU A 136 6.940 -12.048 16.502 1.00 44.21 C ATOM 2104 CD2 LEU A 136 8.804 -10.433 16.083 1.00 61.12 C ATOM 0 H LEU A 136 10.740 -14.760 15.380 1.00 64.01 H new ATOM 0 HA LEU A 136 7.926 -14.505 14.983 1.00 15.52 H new ATOM 0 HB2 LEU A 136 9.191 -13.271 16.693 1.00 51.32 H new ATOM 0 HB3 LEU A 136 10.144 -12.482 15.452 1.00 51.32 H new ATOM 0 HG LEU A 136 7.810 -11.607 14.605 1.00 34.12 H new ATOM 0 HD11 LEU A 136 6.235 -11.218 16.461 1.00 44.21 H new ATOM 0 HD12 LEU A 136 6.456 -12.954 16.136 1.00 44.21 H new ATOM 0 HD13 LEU A 136 7.262 -12.200 17.532 1.00 44.21 H new ATOM 0 HD21 LEU A 136 8.073 -9.625 16.047 1.00 61.12 H new ATOM 0 HD22 LEU A 136 9.172 -10.545 17.103 1.00 61.12 H new ATOM 0 HD23 LEU A 136 9.637 -10.198 15.421 1.00 61.12 H new ATOM 2116 N ILE A 137 9.924 -13.577 12.585 1.00 21.03 N ATOM 2117 CA ILE A 137 9.977 -13.123 11.201 1.00 10.23 C ATOM 2118 C ILE A 137 9.787 -14.286 10.233 1.00 1.24 C ATOM 2119 O ILE A 137 9.038 -14.182 9.262 1.00 62.22 O ATOM 2120 CB ILE A 137 11.313 -12.423 10.889 1.00 12.21 C ATOM 2121 CG1 ILE A 137 11.499 -11.204 11.795 1.00 30.25 C ATOM 2122 CG2 ILE A 137 11.367 -12.014 9.425 1.00 50.22 C ATOM 2123 CD1 ILE A 137 12.941 -10.947 12.173 1.00 50.40 C ATOM 0 H ILE A 137 10.813 -13.918 12.951 1.00 21.03 H new ATOM 0 HA ILE A 137 9.163 -12.409 11.072 1.00 10.23 H new ATOM 0 HB ILE A 137 12.126 -13.123 11.081 1.00 12.21 H new ATOM 0 HG12 ILE A 137 11.101 -10.323 11.291 1.00 30.25 H new ATOM 0 HG13 ILE A 137 10.913 -11.344 12.703 1.00 30.25 H new ATOM 0 HG21 ILE A 137 12.317 -11.521 9.220 1.00 50.22 H new ATOM 0 HG22 ILE A 137 11.275 -12.900 8.796 1.00 50.22 H new ATOM 0 HG23 ILE A 137 10.548 -11.328 9.208 1.00 50.22 H new ATOM 0 HD11 ILE A 137 12.998 -10.068 12.816 1.00 50.40 H new ATOM 0 HD12 ILE A 137 13.337 -11.812 12.705 1.00 50.40 H new ATOM 0 HD13 ILE A 137 13.529 -10.775 11.271 1.00 50.40 H new ATOM 2135 N ARG A 138 10.469 -15.393 10.507 1.00 61.33 N ATOM 2136 CA ARG A 138 10.375 -16.577 9.660 1.00 2.25 C ATOM 2137 C ARG A 138 8.953 -17.129 9.654 1.00 32.23 C ATOM 2138 O ARG A 138 8.536 -17.787 8.701 1.00 70.30 O ATOM 2139 CB ARG A 138 11.350 -17.653 10.142 1.00 34.15 C ATOM 2140 CG ARG A 138 11.360 -18.899 9.272 1.00 60.10 C ATOM 2141 CD ARG A 138 12.760 -19.479 9.146 1.00 42.10 C ATOM 2142 NE ARG A 138 13.018 -20.002 7.807 1.00 54.21 N ATOM 2143 CZ ARG A 138 12.564 -21.174 7.376 1.00 42.41 C ATOM 2144 NH1 ARG A 138 11.834 -21.940 8.174 1.00 21.02 N ATOM 2145 NH2 ARG A 138 12.841 -21.581 6.144 1.00 54.34 N ATOM 0 H ARG A 138 11.092 -15.495 11.308 1.00 61.33 H new ATOM 0 HA ARG A 138 10.638 -16.288 8.643 1.00 2.25 H new ATOM 0 HB2 ARG A 138 12.355 -17.233 10.172 1.00 34.15 H new ATOM 0 HB3 ARG A 138 11.091 -17.935 11.163 1.00 34.15 H new ATOM 0 HG2 ARG A 138 10.692 -19.647 9.699 1.00 60.10 H new ATOM 0 HG3 ARG A 138 10.975 -18.656 8.282 1.00 60.10 H new ATOM 0 HD2 ARG A 138 13.494 -18.708 9.382 1.00 42.10 H new ATOM 0 HD3 ARG A 138 12.889 -20.277 9.878 1.00 42.10 H new ATOM 0 HE ARG A 138 13.577 -19.437 7.168 1.00 54.21 H new ATOM 0 HH11 ARG A 138 11.619 -21.630 9.122 1.00 21.02 H new ATOM 0 HH12 ARG A 138 11.487 -22.839 7.840 1.00 21.02 H new ATOM 0 HH21 ARG A 138 13.403 -20.994 5.527 1.00 54.34 H new ATOM 0 HH22 ARG A 138 12.492 -22.481 5.814 1.00 54.34 H new ATOM 2159 N ASP A 139 8.214 -16.857 10.724 1.00 75.21 N ATOM 2160 CA ASP A 139 6.838 -17.326 10.842 1.00 73.21 C ATOM 2161 C ASP A 139 5.852 -16.194 10.570 1.00 44.14 C ATOM 2162 O ASP A 139 5.818 -15.185 11.274 1.00 21.04 O ATOM 2163 CB ASP A 139 6.592 -17.908 12.235 1.00 65.52 C ATOM 2164 CG ASP A 139 5.259 -18.622 12.338 1.00 54.35 C ATOM 2165 OD1 ASP A 139 4.409 -18.424 11.444 1.00 41.34 O ATOM 2166 OD2 ASP A 139 5.065 -19.379 13.311 1.00 14.44 O ATOM 0 H ASP A 139 8.545 -16.314 11.522 1.00 75.21 H new ATOM 0 HA ASP A 139 6.682 -18.107 10.097 1.00 73.21 H new ATOM 0 HB2 ASP A 139 7.394 -18.604 12.481 1.00 65.52 H new ATOM 0 HB3 ASP A 139 6.629 -17.106 12.972 1.00 65.52 H new ATOM 2171 N PRO A 140 5.032 -16.362 9.522 1.00 33.31 N ATOM 2172 CA PRO A 140 4.031 -15.365 9.132 1.00 10.42 C ATOM 2173 C PRO A 140 2.888 -15.267 10.137 1.00 41.41 C ATOM 2174 O PRO A 140 2.210 -14.244 10.221 1.00 11.35 O ATOM 2175 CB PRO A 140 3.517 -15.884 7.787 1.00 24.31 C ATOM 2176 CG PRO A 140 3.763 -17.353 7.830 1.00 61.13 C ATOM 2177 CD PRO A 140 5.017 -17.540 8.638 1.00 1.11 C ATOM 0 HA PRO A 140 4.454 -14.361 9.083 1.00 10.42 H new ATOM 0 HB2 PRO A 140 2.458 -15.663 7.656 1.00 24.31 H new ATOM 0 HB3 PRO A 140 4.045 -15.418 6.955 1.00 24.31 H new ATOM 0 HG2 PRO A 140 2.923 -17.876 8.287 1.00 61.13 H new ATOM 0 HG3 PRO A 140 3.882 -17.758 6.825 1.00 61.13 H new ATOM 0 HD2 PRO A 140 4.993 -18.469 9.207 1.00 1.11 H new ATOM 0 HD3 PRO A 140 5.902 -17.577 8.003 1.00 1.11 H new ATOM 2185 N ASN A 141 2.681 -16.337 10.897 1.00 72.12 N ATOM 2186 CA ASN A 141 1.619 -16.371 11.896 1.00 4.04 C ATOM 2187 C ASN A 141 2.200 -16.355 13.307 1.00 11.12 C ATOM 2188 O ASN A 141 1.571 -16.826 14.254 1.00 74.53 O ATOM 2189 CB ASN A 141 0.750 -17.615 11.705 1.00 75.02 C ATOM 2190 CG ASN A 141 0.384 -17.847 10.251 1.00 2.14 C ATOM 2191 OD1 ASN A 141 0.480 -18.966 9.746 1.00 4.54 O ATOM 2192 ND2 ASN A 141 -0.038 -16.787 9.571 1.00 23.23 N ATOM 0 H ASN A 141 3.234 -17.192 10.840 1.00 72.12 H new ATOM 0 HA ASN A 141 1.002 -15.482 11.765 1.00 4.04 H new ATOM 0 HB2 ASN A 141 1.280 -18.487 12.087 1.00 75.02 H new ATOM 0 HB3 ASN A 141 -0.161 -17.512 12.294 1.00 75.02 H new ATOM 0 HD21 ASN A 141 -0.298 -16.881 8.589 1.00 23.23 H new ATOM 0 HD22 ASN A 141 -0.102 -15.879 10.031 1.00 23.23 H new ATOM 2199 N ALA A 142 3.404 -15.808 13.439 1.00 21.54 N ATOM 2200 CA ALA A 142 4.069 -15.728 14.734 1.00 34.32 C ATOM 2201 C ALA A 142 3.377 -14.719 15.645 1.00 42.05 C ATOM 2202 O ALA A 142 3.475 -13.510 15.434 1.00 4.13 O ATOM 2203 CB ALA A 142 5.534 -15.362 14.553 1.00 2.45 C ATOM 0 H ALA A 142 3.939 -15.414 12.665 1.00 21.54 H new ATOM 0 HA ALA A 142 4.007 -16.708 15.208 1.00 34.32 H new ATOM 0 HB1 ALA A 142 6.018 -15.306 15.528 1.00 2.45 H new ATOM 0 HB2 ALA A 142 6.027 -16.122 13.947 1.00 2.45 H new ATOM 0 HB3 ALA A 142 5.609 -14.396 14.055 1.00 2.45 H new ATOM 2209 N ASP A 143 2.678 -15.223 16.655 1.00 10.03 N ATOM 2210 CA ASP A 143 1.970 -14.365 17.598 1.00 1.13 C ATOM 2211 C ASP A 143 2.548 -14.508 19.003 1.00 73.51 C ATOM 2212 O ASP A 143 3.604 -15.113 19.193 1.00 70.24 O ATOM 2213 CB ASP A 143 0.479 -14.705 17.609 1.00 12.45 C ATOM 2214 CG ASP A 143 0.182 -15.985 18.365 1.00 4.25 C ATOM 2215 OD1 ASP A 143 0.766 -17.031 18.012 1.00 55.31 O ATOM 2216 OD2 ASP A 143 -0.634 -15.941 19.310 1.00 25.12 O ATOM 0 H ASP A 143 2.586 -16.221 16.842 1.00 10.03 H new ATOM 0 HA ASP A 143 2.097 -13.331 17.276 1.00 1.13 H new ATOM 0 HB2 ASP A 143 -0.075 -13.882 18.062 1.00 12.45 H new ATOM 0 HB3 ASP A 143 0.124 -14.802 16.583 1.00 12.45 H new ATOM 2221 N LEU A 144 1.849 -13.948 19.984 1.00 24.12 N ATOM 2222 CA LEU A 144 2.293 -14.013 21.372 1.00 1.54 C ATOM 2223 C LEU A 144 1.147 -13.689 22.326 1.00 44.31 C ATOM 2224 O LEU A 144 0.454 -12.686 22.161 1.00 54.52 O ATOM 2225 CB LEU A 144 3.453 -13.043 21.603 1.00 3.41 C ATOM 2226 CG LEU A 144 4.065 -13.050 23.004 1.00 4.43 C ATOM 2227 CD1 LEU A 144 3.238 -12.196 23.953 1.00 71.04 C ATOM 2228 CD2 LEU A 144 4.181 -14.473 23.529 1.00 62.54 C ATOM 0 H LEU A 144 0.973 -13.444 19.844 1.00 24.12 H new ATOM 0 HA LEU A 144 2.632 -15.029 21.572 1.00 1.54 H new ATOM 0 HB2 LEU A 144 4.240 -13.271 20.884 1.00 3.41 H new ATOM 0 HB3 LEU A 144 3.105 -12.033 21.385 1.00 3.41 H new ATOM 0 HG LEU A 144 5.066 -12.624 22.943 1.00 4.43 H new ATOM 0 HD11 LEU A 144 3.689 -12.213 24.945 1.00 71.04 H new ATOM 0 HD12 LEU A 144 3.207 -11.170 23.586 1.00 71.04 H new ATOM 0 HD13 LEU A 144 2.224 -12.592 24.009 1.00 71.04 H new ATOM 0 HD21 LEU A 144 4.619 -14.458 24.527 1.00 62.54 H new ATOM 0 HD22 LEU A 144 3.191 -14.926 23.574 1.00 62.54 H new ATOM 0 HD23 LEU A 144 4.817 -15.056 22.863 1.00 62.54 H new TER 2240 LEU A 144