USER MOD reduce.3.24.130724 H: found=0, std=0, add=1276, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1068 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 119 ASN :FLIP amide:sc= -2.72 F(o=-3.3,f=-2.7) USER MOD Set 1.2: A 120 ASN : amide:sc= 0.0241 K(o=-2.7,f=-3.3) USER MOD Set 2.1: A 90 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 124 LYS NZ :NH3+ -167:sc= -0.0705 (180deg=-0.278) USER MOD Set 3.1: A 86 TYR OH : rot -63:sc= 0.00243 USER MOD Set 3.2: A 144 HIS : no HD1:sc= 0.00151 X(o=0.0039,f=-0.0031) USER MOD Set 4.1: A 42 ASN : amide:sc= -4.17 X(o=-6.9,f=-7!) USER MOD Set 4.2: A 47 ASN : amide:sc= -2.74 K(o=-6.9,f=-12!) USER MOD Set 5.1: A 20 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 21 SER OG : rot 7:sc= 1.15 USER MOD Set 6.1: A 16 GLN : amide:sc= -6.27! C(o=-9.1!,f=-12!) USER MOD Set 6.2: A 36 HIS : no HD1:sc= -2.79 K(o=-9.1,f=-10) USER MOD Single : A 2 SER OG : rot 180:sc= -0.133 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -3 SER OG : rot 180:sc= 0 USER MOD Single : A -4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A -5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -5 MET N :NH3+ -119:sc= 0.0829 (180deg=-0.152) USER MOD Single : A 10 ASN :FLIP amide:sc= -0.496 F(o=-2.2,f=-0.5) USER MOD Single : A 11 THR OG1 : rot -67:sc= 0.987 USER MOD Single : A 15 SER OG : rot -55:sc= 0.617 USER MOD Single : A 17 MET CE :methyl -157:sc= -0.056 (180deg=-0.31) USER MOD Single : A 18 SER OG : rot 25:sc= 1.12 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 180:sc= -0.692 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= -0.96 K(o=-0.96,f=-1.6) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -161:sc= -2.9! USER MOD Single : A 52 GLN : amide:sc= -0.731 X(o=-0.73,f=-0.54) USER MOD Single : A 53 SER OG : rot -43:sc= 0.0186 USER MOD Single : A 54 ASN :FLIP amide:sc= -2.66 F(o=-3.3,f=-2.7) USER MOD Single : A 55 SER OG : rot 170:sc= 0.279 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN :FLIP amide:sc= -4.3 F(o=-4.9,f=-4.3) USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -0.491 X(o=-0.49,f=0) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.07) USER MOD Single : A 71 THR OG1 : rot -166:sc= -0.442 USER MOD Single : A 75 THR OG1 : rot 5:sc= -2.41! USER MOD Single : A 76 GLN : amide:sc= -5.67! C(o=-5.7!,f=-13!) USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 85 GLN :FLIP amide:sc= -0.507 F(o=-1.6,f=-0.51) USER MOD Single : A 89 SER OG : rot 180:sc= -0.428 USER MOD Single : A 91 LYS NZ :NH3+ 157:sc= -0.29 (180deg=-0.969) USER MOD Single : A 94 HIS :FLIP no HD1:sc= -3.09 F(o=-3.7,f=-3.1) USER MOD Single : A 95 SER OG : rot 177:sc= -0.101 USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 109 SER OG : rot -36:sc= 0.992 USER MOD Single : A 110 SER OG : rot 54:sc= -0.021 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 GLN : amide:sc= -0.22 X(o=-0.22,f=-0.047) USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 SER OG : rot 180:sc= -0.549 USER MOD Single : A 122 HIS : no HD1:sc= -1.92 K(o=-1.9,f=-3.4!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 135 TYR OH : rot 180:sc= -1.94 USER MOD Single : A 142 SER OG : rot 180:sc= -0.543 USER MOD Single : A 145 ASN : amide:sc= -3.3 K(o=-3.3,f=-6.3!) USER MOD Single : A 148 THR OG1 : rot 180:sc= -0.921 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A -5 18.597 25.899 -15.239 1.00 65.22 N ATOM 2 CA MET A -5 17.964 24.647 -15.642 1.00 13.44 C ATOM 3 C MET A -5 17.679 24.640 -17.141 1.00 75.13 C ATOM 4 O MET A -5 17.861 25.650 -17.822 1.00 3.33 O ATOM 5 CB MET A -5 16.666 24.432 -14.863 1.00 34.22 C ATOM 6 CG MET A -5 15.560 25.403 -15.245 1.00 20.32 C ATOM 7 SD MET A -5 14.165 25.351 -14.103 1.00 10.54 S ATOM 8 CE MET A -5 12.791 25.292 -15.250 1.00 50.43 C ATOM 0 H1 MET A -5 19.536 25.700 -14.839 1.00 65.22 H new ATOM 0 H2 MET A -5 18.698 26.519 -16.068 1.00 65.22 H new ATOM 0 H3 MET A -5 18.008 26.371 -14.523 1.00 65.22 H new ATOM 0 HA MET A -5 18.652 23.832 -15.417 1.00 13.44 H new ATOM 0 HB2 MET A -5 16.317 23.413 -15.029 1.00 34.22 H new ATOM 0 HB3 MET A -5 16.871 24.529 -13.797 1.00 34.22 H new ATOM 0 HG2 MET A -5 15.964 26.415 -15.273 1.00 20.32 H new ATOM 0 HG3 MET A -5 15.210 25.171 -16.251 1.00 20.32 H new ATOM 0 HE1 MET A -5 11.854 25.256 -14.694 1.00 50.43 H new ATOM 0 HE2 MET A -5 12.805 26.181 -15.881 1.00 50.43 H new ATOM 0 HE3 MET A -5 12.876 24.403 -15.874 1.00 50.43 H new ATOM 16 N LYS A -4 17.232 23.497 -17.648 1.00 71.34 N ATOM 17 CA LYS A -4 16.919 23.358 -19.065 1.00 13.20 C ATOM 18 C LYS A -4 16.184 22.049 -19.335 1.00 15.22 C ATOM 19 O LYS A -4 16.602 21.253 -20.175 1.00 11.51 O ATOM 20 CB LYS A -4 18.201 23.417 -19.899 1.00 3.10 C ATOM 21 CG LYS A -4 19.231 22.372 -19.506 1.00 31.51 C ATOM 22 CD LYS A -4 20.317 22.963 -18.623 1.00 43.35 C ATOM 23 CE LYS A -4 21.457 23.535 -19.451 1.00 15.42 C ATOM 24 NZ LYS A -4 22.123 24.677 -18.763 1.00 22.21 N ATOM 0 H LYS A -4 17.078 22.652 -17.098 1.00 71.34 H new ATOM 0 HA LYS A -4 16.268 24.184 -19.350 1.00 13.20 H new ATOM 0 HB2 LYS A -4 17.947 23.287 -20.951 1.00 3.10 H new ATOM 0 HB3 LYS A -4 18.644 24.408 -19.799 1.00 3.10 H new ATOM 0 HG2 LYS A -4 18.738 21.554 -18.980 1.00 31.51 H new ATOM 0 HG3 LYS A -4 19.681 21.948 -20.404 1.00 31.51 H new ATOM 0 HD2 LYS A -4 19.892 23.747 -17.996 1.00 43.35 H new ATOM 0 HD3 LYS A -4 20.702 22.194 -17.954 1.00 43.35 H new ATOM 0 HE2 LYS A -4 22.190 22.753 -19.649 1.00 15.42 H new ATOM 0 HE3 LYS A -4 21.074 23.866 -20.417 1.00 15.42 H new ATOM 0 HZ1 LYS A -4 22.894 25.039 -19.359 1.00 22.21 H new ATOM 0 HZ2 LYS A -4 21.430 25.434 -18.596 1.00 22.21 H new ATOM 0 HZ3 LYS A -4 22.510 24.356 -17.853 1.00 22.21 H new ATOM 34 N SER A -3 15.085 21.835 -18.619 1.00 31.45 N ATOM 35 CA SER A -3 14.293 20.621 -18.779 1.00 21.15 C ATOM 36 C SER A -3 12.816 20.899 -18.525 1.00 63.44 C ATOM 37 O SER A -3 12.437 22.006 -18.142 1.00 23.45 O ATOM 38 CB SER A -3 14.790 19.532 -17.827 1.00 33.42 C ATOM 39 OG SER A -3 16.108 19.128 -18.156 1.00 40.21 O ATOM 0 H SER A -3 14.723 22.486 -17.923 1.00 31.45 H new ATOM 0 HA SER A -3 14.408 20.275 -19.806 1.00 21.15 H new ATOM 0 HB2 SER A -3 14.765 19.902 -16.802 1.00 33.42 H new ATOM 0 HB3 SER A -3 14.121 18.673 -17.872 1.00 33.42 H new ATOM 0 HG SER A -3 16.402 18.433 -17.532 1.00 40.21 H new ATOM 44 N GLY A -2 11.982 19.886 -18.741 1.00 21.43 N ATOM 45 CA GLY A -2 10.554 20.040 -18.531 1.00 11.43 C ATOM 46 C GLY A -2 10.059 19.268 -17.324 1.00 14.11 C ATOM 47 O GLY A -2 10.566 18.187 -17.017 1.00 53.54 O ATOM 0 H GLY A -2 12.270 18.960 -19.058 1.00 21.43 H new ATOM 0 HA2 GLY A -2 10.321 21.097 -18.403 1.00 11.43 H new ATOM 0 HA3 GLY A -2 10.021 19.701 -19.419 1.00 11.43 H new ATOM 51 N HIS A -1 9.068 19.824 -16.634 1.00 22.03 N ATOM 52 CA HIS A -1 8.505 19.181 -15.452 1.00 32.42 C ATOM 53 C HIS A -1 7.493 18.110 -15.846 1.00 43.23 C ATOM 54 O HIS A -1 6.842 18.210 -16.885 1.00 31.53 O ATOM 55 CB HIS A -1 7.841 20.220 -14.549 1.00 62.52 C ATOM 56 CG HIS A -1 8.727 20.711 -13.446 1.00 11.22 C ATOM 57 ND1 HIS A -1 9.312 21.960 -13.451 1.00 3.13 N ATOM 58 CD2 HIS A -1 9.127 20.114 -12.299 1.00 51.41 C ATOM 59 CE1 HIS A -1 10.034 22.110 -12.355 1.00 4.05 C ATOM 60 NE2 HIS A -1 9.939 21.004 -11.638 1.00 42.15 N ATOM 0 H HIS A -1 8.639 20.718 -16.873 1.00 22.03 H new ATOM 0 HA HIS A -1 9.318 18.703 -14.906 1.00 32.42 H new ATOM 0 HB2 HIS A -1 7.527 21.069 -15.156 1.00 62.52 H new ATOM 0 HB3 HIS A -1 6.940 19.788 -14.114 1.00 62.52 H new ATOM 0 HD2 HIS A -1 8.858 19.123 -11.965 1.00 51.41 H new ATOM 0 HE1 HIS A -1 10.605 22.988 -12.090 1.00 4.05 H new ATOM 0 HE2 HIS A -1 10.394 20.838 -10.740 1.00 42.15 H new ATOM 67 N GLY A 0 7.368 17.084 -15.010 1.00 34.11 N ATOM 68 CA GLY A 0 6.434 16.009 -15.289 1.00 43.11 C ATOM 69 C GLY A 0 5.949 15.320 -14.029 1.00 62.23 C ATOM 70 O GLY A 0 6.670 15.249 -13.033 1.00 14.32 O ATOM 0 H GLY A 0 7.897 16.978 -14.144 1.00 34.11 H new ATOM 0 HA2 GLY A 0 5.578 16.408 -15.834 1.00 43.11 H new ATOM 0 HA3 GLY A 0 6.912 15.276 -15.939 1.00 43.11 H new ATOM 74 N CYS A 1 4.721 14.812 -14.070 1.00 20.33 N ATOM 75 CA CYS A 1 4.139 14.127 -12.922 1.00 72.02 C ATOM 76 C CYS A 1 4.405 12.627 -12.991 1.00 63.20 C ATOM 77 O CYS A 1 5.090 12.148 -13.894 1.00 11.40 O ATOM 78 CB CYS A 1 2.632 14.387 -12.858 1.00 20.34 C ATOM 79 SG CYS A 1 2.187 16.036 -12.224 1.00 33.14 S ATOM 0 H CYS A 1 4.110 14.862 -14.886 1.00 20.33 H new ATOM 0 HA CYS A 1 4.608 14.519 -12.020 1.00 72.02 H new ATOM 0 HB2 CYS A 1 2.211 14.268 -13.856 1.00 20.34 H new ATOM 0 HB3 CYS A 1 2.170 13.629 -12.225 1.00 20.34 H new ATOM 83 N SER A 2 3.857 11.888 -12.030 1.00 55.34 N ATOM 84 CA SER A 2 4.038 10.443 -11.979 1.00 62.03 C ATOM 85 C SER A 2 5.507 10.086 -11.779 1.00 1.24 C ATOM 86 O SER A 2 6.057 9.250 -12.497 1.00 75.51 O ATOM 87 CB SER A 2 3.515 9.797 -13.263 1.00 42.34 C ATOM 88 OG SER A 2 2.914 8.542 -12.995 1.00 42.34 O ATOM 0 H SER A 2 3.284 12.268 -11.276 1.00 55.34 H new ATOM 0 HA SER A 2 3.471 10.060 -11.131 1.00 62.03 H new ATOM 0 HB2 SER A 2 2.789 10.458 -13.736 1.00 42.34 H new ATOM 0 HB3 SER A 2 4.335 9.667 -13.969 1.00 42.34 H new ATOM 0 HG SER A 2 2.587 8.151 -13.832 1.00 42.34 H new ATOM 93 N GLU A 3 6.137 10.726 -10.800 1.00 32.42 N ATOM 94 CA GLU A 3 7.544 10.477 -10.505 1.00 74.02 C ATOM 95 C GLU A 3 7.692 9.438 -9.396 1.00 1.41 C ATOM 96 O GLU A 3 7.115 9.560 -8.316 1.00 13.02 O ATOM 97 CB GLU A 3 8.240 11.777 -10.098 1.00 33.33 C ATOM 98 CG GLU A 3 7.733 12.355 -8.787 1.00 41.12 C ATOM 99 CD GLU A 3 8.543 11.891 -7.592 1.00 75.31 C ATOM 100 OE1 GLU A 3 9.784 11.823 -7.709 1.00 33.22 O ATOM 101 OE2 GLU A 3 7.936 11.598 -6.541 1.00 1.04 O ATOM 0 H GLU A 3 5.696 11.421 -10.197 1.00 32.42 H new ATOM 0 HA GLU A 3 8.015 10.089 -11.408 1.00 74.02 H new ATOM 0 HB2 GLU A 3 9.311 11.595 -10.015 1.00 33.33 H new ATOM 0 HB3 GLU A 3 8.103 12.515 -10.888 1.00 33.33 H new ATOM 0 HG2 GLU A 3 7.761 13.443 -8.839 1.00 41.12 H new ATOM 0 HG3 GLU A 3 6.690 12.069 -8.647 1.00 41.12 H new ATOM 106 N PRO A 4 8.484 8.390 -9.671 1.00 73.02 N ATOM 107 CA PRO A 4 8.727 7.310 -8.710 1.00 62.20 C ATOM 108 C PRO A 4 9.573 7.766 -7.527 1.00 31.04 C ATOM 109 O PRO A 4 9.044 8.185 -6.496 1.00 20.33 O ATOM 110 CB PRO A 4 9.480 6.265 -9.537 1.00 33.34 C ATOM 111 CG PRO A 4 10.134 7.042 -10.626 1.00 72.52 C ATOM 112 CD PRO A 4 9.202 8.181 -10.938 1.00 31.15 C ATOM 0 HA PRO A 4 7.802 6.939 -8.269 1.00 62.20 H new ATOM 0 HB2 PRO A 4 10.216 5.736 -8.931 1.00 33.34 H new ATOM 0 HB3 PRO A 4 8.800 5.514 -9.940 1.00 33.34 H new ATOM 0 HG2 PRO A 4 11.110 7.411 -10.310 1.00 72.52 H new ATOM 0 HG3 PRO A 4 10.298 6.419 -11.506 1.00 72.52 H new ATOM 0 HD2 PRO A 4 9.747 9.074 -11.243 1.00 31.15 H new ATOM 0 HD3 PRO A 4 8.520 7.931 -11.750 1.00 31.15 H new ATOM 117 N LEU A 5 10.890 7.682 -7.680 1.00 42.41 N ATOM 118 CA LEU A 5 11.811 8.088 -6.624 1.00 24.21 C ATOM 119 C LEU A 5 13.022 8.811 -7.205 1.00 41.11 C ATOM 120 O LEU A 5 13.116 10.036 -7.138 1.00 23.14 O ATOM 121 CB LEU A 5 12.268 6.866 -5.824 1.00 32.12 C ATOM 122 CG LEU A 5 12.231 5.528 -6.562 1.00 22.41 C ATOM 123 CD1 LEU A 5 13.401 4.653 -6.140 1.00 25.21 C ATOM 124 CD2 LEU A 5 10.911 4.815 -6.307 1.00 43.11 C ATOM 0 H LEU A 5 11.344 7.336 -8.525 1.00 42.41 H new ATOM 0 HA LEU A 5 11.285 8.775 -5.961 1.00 24.21 H new ATOM 0 HB2 LEU A 5 13.288 7.041 -5.482 1.00 32.12 H new ATOM 0 HB3 LEU A 5 11.643 6.785 -4.934 1.00 32.12 H new ATOM 0 HG LEU A 5 12.316 5.722 -7.631 1.00 22.41 H new ATOM 0 HD11 LEU A 5 13.358 3.705 -6.676 1.00 25.21 H new ATOM 0 HD12 LEU A 5 14.337 5.160 -6.374 1.00 25.21 H new ATOM 0 HD13 LEU A 5 13.348 4.466 -5.067 1.00 25.21 H new ATOM 0 HD21 LEU A 5 10.902 3.864 -6.840 1.00 43.11 H new ATOM 0 HD22 LEU A 5 10.796 4.633 -5.238 1.00 43.11 H new ATOM 0 HD23 LEU A 5 10.088 5.436 -6.660 1.00 43.11 H new ATOM 135 N GLY A 6 13.945 8.044 -7.778 1.00 75.03 N ATOM 136 CA GLY A 6 15.136 8.630 -8.364 1.00 13.34 C ATOM 137 C GLY A 6 15.329 8.225 -9.812 1.00 13.40 C ATOM 138 O GLY A 6 16.216 8.738 -10.495 1.00 11.23 O ATOM 0 H GLY A 6 13.889 7.028 -7.847 1.00 75.03 H new ATOM 0 HA2 GLY A 6 15.072 9.716 -8.299 1.00 13.34 H new ATOM 0 HA3 GLY A 6 16.009 8.327 -7.786 1.00 13.34 H new ATOM 142 N LEU A 7 14.498 7.302 -10.282 1.00 70.14 N ATOM 143 CA LEU A 7 14.581 6.827 -11.659 1.00 13.12 C ATOM 144 C LEU A 7 14.173 7.922 -12.638 1.00 43.04 C ATOM 145 O LEU A 7 14.363 7.792 -13.848 1.00 42.01 O ATOM 146 CB LEU A 7 13.691 5.598 -11.850 1.00 21.15 C ATOM 147 CG LEU A 7 13.937 4.434 -10.889 1.00 12.22 C ATOM 148 CD1 LEU A 7 12.659 3.640 -10.674 1.00 22.14 C ATOM 149 CD2 LEU A 7 15.046 3.534 -11.415 1.00 32.34 C ATOM 0 H LEU A 7 13.759 6.867 -9.730 1.00 70.14 H new ATOM 0 HA LEU A 7 15.616 6.553 -11.861 1.00 13.12 H new ATOM 0 HB2 LEU A 7 12.651 5.909 -11.753 1.00 21.15 H new ATOM 0 HB3 LEU A 7 13.821 5.235 -12.869 1.00 21.15 H new ATOM 0 HG LEU A 7 14.252 4.841 -9.928 1.00 12.22 H new ATOM 0 HD11 LEU A 7 12.854 2.816 -9.988 1.00 22.14 H new ATOM 0 HD12 LEU A 7 11.893 4.291 -10.252 1.00 22.14 H new ATOM 0 HD13 LEU A 7 12.312 3.243 -11.628 1.00 22.14 H new ATOM 0 HD21 LEU A 7 15.208 2.711 -10.719 1.00 32.34 H new ATOM 0 HD22 LEU A 7 14.760 3.135 -12.388 1.00 32.34 H new ATOM 0 HD23 LEU A 7 15.966 4.110 -11.515 1.00 32.34 H new ATOM 160 N LYS A 8 13.611 9.003 -12.109 1.00 35.02 N ATOM 161 CA LYS A 8 13.178 10.125 -12.935 1.00 4.15 C ATOM 162 C LYS A 8 14.377 10.910 -13.458 1.00 25.34 C ATOM 163 O LYS A 8 14.451 11.232 -14.643 1.00 73.34 O ATOM 164 CB LYS A 8 12.259 11.049 -12.134 1.00 54.30 C ATOM 165 CG LYS A 8 10.910 11.283 -12.791 1.00 74.34 C ATOM 166 CD LYS A 8 11.029 12.192 -14.004 1.00 33.34 C ATOM 167 CE LYS A 8 10.128 13.410 -13.878 1.00 40.20 C ATOM 168 NZ LYS A 8 10.505 14.480 -14.843 1.00 53.24 N ATOM 0 H LYS A 8 13.444 9.127 -11.110 1.00 35.02 H new ATOM 0 HA LYS A 8 12.628 9.726 -13.787 1.00 4.15 H new ATOM 0 HB2 LYS A 8 12.102 10.622 -11.143 1.00 54.30 H new ATOM 0 HB3 LYS A 8 12.756 12.009 -11.992 1.00 54.30 H new ATOM 0 HG2 LYS A 8 10.481 10.327 -13.092 1.00 74.34 H new ATOM 0 HG3 LYS A 8 10.225 11.727 -12.069 1.00 74.34 H new ATOM 0 HD2 LYS A 8 12.064 12.514 -14.118 1.00 33.34 H new ATOM 0 HD3 LYS A 8 10.767 11.636 -14.904 1.00 33.34 H new ATOM 0 HE2 LYS A 8 9.093 13.115 -14.049 1.00 40.20 H new ATOM 0 HE3 LYS A 8 10.185 13.801 -12.862 1.00 40.20 H new ATOM 0 HZ1 LYS A 8 9.868 15.293 -14.726 1.00 53.24 H new ATOM 0 HZ2 LYS A 8 11.485 14.779 -14.664 1.00 53.24 H new ATOM 0 HZ3 LYS A 8 10.426 14.115 -15.814 1.00 53.24 H new ATOM 178 N ASN A 9 15.314 11.213 -12.566 1.00 14.41 N ATOM 179 CA ASN A 9 16.511 11.960 -12.939 1.00 11.00 C ATOM 180 C ASN A 9 17.422 12.166 -11.732 1.00 45.30 C ATOM 181 O ASN A 9 18.110 13.179 -11.628 1.00 14.32 O ATOM 182 CB ASN A 9 16.126 13.313 -13.538 1.00 53.34 C ATOM 183 CG ASN A 9 16.645 13.488 -14.952 1.00 61.35 C ATOM 184 OD1 ASN A 9 15.867 13.586 -15.902 1.00 44.10 O ATOM 185 ND2 ASN A 9 17.964 13.529 -15.098 1.00 64.32 N ATOM 0 H ASN A 9 15.268 10.953 -11.581 1.00 14.41 H new ATOM 0 HA ASN A 9 17.053 11.380 -13.686 1.00 11.00 H new ATOM 0 HB2 ASN A 9 15.040 13.412 -13.538 1.00 53.34 H new ATOM 0 HB3 ASN A 9 16.519 14.111 -12.908 1.00 53.34 H new ATOM 0 HD21 ASN A 9 18.371 13.646 -16.026 1.00 64.32 H new ATOM 0 HD22 ASN A 9 18.570 13.444 -14.282 1.00 64.32 H new ATOM 191 N ASN A 10 17.420 11.195 -10.824 1.00 65.32 N ATOM 192 CA ASN A 10 18.246 11.270 -9.624 1.00 22.23 C ATOM 193 C ASN A 10 18.959 9.945 -9.372 1.00 5.32 C ATOM 194 O ASN A 10 19.779 9.504 -10.179 1.00 41.44 O ATOM 195 CB ASN A 10 17.388 11.638 -8.412 1.00 12.44 C ATOM 196 CG ASN A 10 16.719 12.990 -8.567 1.00 12.13 C ATOM 197 OD1 ASN A 10 15.782 13.082 -9.503 1.00 64.44 O flip ATOM 198 ND2 ASN A 10 17.042 13.940 -7.853 1.00 32.04 N flip ATOM 0 H ASN A 10 16.856 10.348 -10.896 1.00 65.32 H new ATOM 0 HA ASN A 10 18.998 12.044 -9.778 1.00 22.23 H new ATOM 0 HB2 ASN A 10 16.626 10.873 -8.264 1.00 12.44 H new ATOM 0 HB3 ASN A 10 18.011 11.644 -7.518 1.00 12.44 H new ATOM 0 HD21 ASN A 10 17.768 13.823 -7.146 1.00 32.04 H new ATOM 0 HD22 ASN A 10 16.584 14.844 -7.969 1.00 32.04 H new ATOM 204 N THR A 11 18.642 9.312 -8.247 1.00 45.14 N ATOM 205 CA THR A 11 19.253 8.038 -7.888 1.00 44.03 C ATOM 206 C THR A 11 18.931 7.662 -6.446 1.00 5.21 C ATOM 207 O THR A 11 19.760 7.829 -5.552 1.00 55.33 O ATOM 208 CB THR A 11 20.782 8.078 -8.068 1.00 70.12 C ATOM 209 OG1 THR A 11 21.393 7.045 -7.286 1.00 55.31 O ATOM 210 CG2 THR A 11 21.340 9.432 -7.656 1.00 23.43 C ATOM 0 H THR A 11 17.965 9.661 -7.568 1.00 45.14 H new ATOM 0 HA THR A 11 18.836 7.286 -8.558 1.00 44.03 H new ATOM 0 HB THR A 11 21.007 7.917 -9.122 1.00 70.12 H new ATOM 0 HG1 THR A 11 21.265 7.237 -6.334 1.00 55.31 H new ATOM 0 HG21 THR A 11 22.421 9.436 -7.792 1.00 23.43 H new ATOM 0 HG22 THR A 11 20.894 10.212 -8.272 1.00 23.43 H new ATOM 0 HG23 THR A 11 21.105 9.619 -6.608 1.00 23.43 H new ATOM 218 N ILE A 12 17.723 7.152 -6.228 1.00 33.15 N ATOM 219 CA ILE A 12 17.295 6.750 -4.894 1.00 42.04 C ATOM 220 C ILE A 12 17.661 5.296 -4.613 1.00 50.31 C ATOM 221 O ILE A 12 17.399 4.399 -5.414 1.00 4.15 O ATOM 222 CB ILE A 12 15.776 6.928 -4.714 1.00 60.54 C ATOM 223 CG1 ILE A 12 15.395 8.404 -4.844 1.00 62.35 C ATOM 224 CG2 ILE A 12 15.334 6.378 -3.366 1.00 15.21 C ATOM 225 CD1 ILE A 12 16.090 9.298 -3.843 1.00 13.43 C ATOM 0 H ILE A 12 17.025 7.008 -6.957 1.00 33.15 H new ATOM 0 HA ILE A 12 17.816 7.396 -4.187 1.00 42.04 H new ATOM 0 HB ILE A 12 15.264 6.369 -5.498 1.00 60.54 H new ATOM 0 HG12 ILE A 12 15.634 8.745 -5.851 1.00 62.35 H new ATOM 0 HG13 ILE A 12 14.317 8.505 -4.721 1.00 62.35 H new ATOM 0 HG21 ILE A 12 14.258 6.511 -3.254 1.00 15.21 H new ATOM 0 HG22 ILE A 12 15.576 5.317 -3.309 1.00 15.21 H new ATOM 0 HG23 ILE A 12 15.851 6.911 -2.568 1.00 15.21 H new ATOM 0 HD11 ILE A 12 15.772 10.330 -3.994 1.00 13.43 H new ATOM 0 HD12 ILE A 12 15.831 8.983 -2.832 1.00 13.43 H new ATOM 0 HD13 ILE A 12 17.169 9.227 -3.980 1.00 13.43 H new ATOM 236 N PRO A 13 18.280 5.057 -3.448 1.00 11.45 N ATOM 237 CA PRO A 13 18.695 3.714 -3.033 1.00 21.14 C ATOM 238 C PRO A 13 17.507 2.819 -2.697 1.00 42.12 C ATOM 239 O PRO A 13 16.358 3.170 -2.965 1.00 45.14 O ATOM 240 CB PRO A 13 19.539 3.972 -1.782 1.00 54.35 C ATOM 241 CG PRO A 13 19.035 5.269 -1.248 1.00 22.23 C ATOM 242 CD PRO A 13 18.624 6.080 -2.446 1.00 21.10 C ATOM 0 HA PRO A 13 19.231 3.191 -3.825 1.00 21.14 H new ATOM 0 HB2 PRO A 13 19.421 3.171 -1.053 1.00 54.35 H new ATOM 0 HB3 PRO A 13 20.600 4.029 -2.025 1.00 54.35 H new ATOM 0 HG2 PRO A 13 18.192 5.112 -0.575 1.00 22.23 H new ATOM 0 HG3 PRO A 13 19.808 5.782 -0.676 1.00 22.23 H new ATOM 0 HD2 PRO A 13 17.774 6.725 -2.222 1.00 21.10 H new ATOM 0 HD3 PRO A 13 19.432 6.725 -2.791 1.00 21.10 H new ATOM 247 N ASP A 14 17.791 1.662 -2.109 1.00 1.21 N ATOM 248 CA ASP A 14 16.745 0.717 -1.735 1.00 4.02 C ATOM 249 C ASP A 14 16.339 0.904 -0.277 1.00 21.11 C ATOM 250 O ASP A 14 15.774 0.002 0.341 1.00 42.00 O ATOM 251 CB ASP A 14 17.219 -0.719 -1.967 1.00 31.42 C ATOM 252 CG ASP A 14 18.563 -0.996 -1.320 1.00 43.14 C ATOM 253 OD1 ASP A 14 19.596 -0.633 -1.922 1.00 23.31 O ATOM 254 OD2 ASP A 14 18.581 -1.573 -0.214 1.00 71.43 O ATOM 0 H ASP A 14 18.737 1.356 -1.881 1.00 1.21 H new ATOM 0 HA ASP A 14 15.874 0.909 -2.362 1.00 4.02 H new ATOM 0 HB2 ASP A 14 16.478 -1.412 -1.569 1.00 31.42 H new ATOM 0 HB3 ASP A 14 17.289 -0.907 -3.038 1.00 31.42 H new ATOM 258 N SER A 15 16.634 2.080 0.267 1.00 73.43 N ATOM 259 CA SER A 15 16.305 2.384 1.655 1.00 60.23 C ATOM 260 C SER A 15 14.953 3.086 1.752 1.00 3.13 C ATOM 261 O SER A 15 14.793 4.043 2.507 1.00 35.40 O ATOM 262 CB SER A 15 17.392 3.259 2.280 1.00 10.10 C ATOM 263 OG SER A 15 17.145 3.475 3.658 1.00 33.33 O ATOM 0 H SER A 15 17.100 2.838 -0.232 1.00 73.43 H new ATOM 0 HA SER A 15 16.247 1.443 2.202 1.00 60.23 H new ATOM 0 HB2 SER A 15 18.364 2.783 2.152 1.00 10.10 H new ATOM 0 HB3 SER A 15 17.435 4.216 1.761 1.00 10.10 H new ATOM 0 HG SER A 15 16.248 3.852 3.774 1.00 33.33 H new ATOM 268 N GLN A 16 13.985 2.601 0.980 1.00 13.04 N ATOM 269 CA GLN A 16 12.648 3.182 0.978 1.00 33.20 C ATOM 270 C GLN A 16 11.620 2.183 1.501 1.00 52.54 C ATOM 271 O GLN A 16 10.772 2.525 2.324 1.00 35.24 O ATOM 272 CB GLN A 16 12.267 3.632 -0.433 1.00 12.40 C ATOM 273 CG GLN A 16 12.414 2.540 -1.481 1.00 50.31 C ATOM 274 CD GLN A 16 12.242 3.061 -2.894 1.00 71.15 C ATOM 275 OE1 GLN A 16 13.026 3.884 -3.365 1.00 1.33 O ATOM 276 NE2 GLN A 16 11.210 2.582 -3.580 1.00 14.32 N ATOM 0 H GLN A 16 14.102 1.808 0.349 1.00 13.04 H new ATOM 0 HA GLN A 16 12.655 4.049 1.639 1.00 33.20 H new ATOM 0 HB2 GLN A 16 11.235 3.982 -0.427 1.00 12.40 H new ATOM 0 HB3 GLN A 16 12.890 4.481 -0.715 1.00 12.40 H new ATOM 0 HG2 GLN A 16 13.397 2.079 -1.385 1.00 50.31 H new ATOM 0 HG3 GLN A 16 11.677 1.760 -1.293 1.00 50.31 H new ATOM 0 HE21 GLN A 16 10.584 1.900 -3.151 1.00 14.32 H new ATOM 0 HE22 GLN A 16 11.043 2.896 -4.536 1.00 14.32 H new ATOM 283 N MET A 17 11.702 0.949 1.015 1.00 73.43 N ATOM 284 CA MET A 17 10.779 -0.099 1.434 1.00 74.01 C ATOM 285 C MET A 17 11.284 -0.796 2.694 1.00 24.02 C ATOM 286 O MET A 17 12.481 -1.042 2.841 1.00 44.21 O ATOM 287 CB MET A 17 10.590 -1.121 0.312 1.00 43.33 C ATOM 288 CG MET A 17 9.859 -0.565 -0.898 1.00 45.54 C ATOM 289 SD MET A 17 8.372 -1.502 -1.303 1.00 60.12 S ATOM 290 CE MET A 17 8.994 -2.588 -2.584 1.00 50.44 C ATOM 0 H MET A 17 12.398 0.650 0.331 1.00 73.43 H new ATOM 0 HA MET A 17 9.818 0.365 1.657 1.00 74.01 H new ATOM 0 HB2 MET A 17 11.567 -1.489 -0.001 1.00 43.33 H new ATOM 0 HB3 MET A 17 10.036 -1.976 0.700 1.00 43.33 H new ATOM 0 HG2 MET A 17 9.589 0.474 -0.709 1.00 45.54 H new ATOM 0 HG3 MET A 17 10.531 -0.568 -1.756 1.00 45.54 H new ATOM 0 HE1 MET A 17 8.167 -2.925 -3.208 1.00 50.44 H new ATOM 0 HE2 MET A 17 9.716 -2.050 -3.198 1.00 50.44 H new ATOM 0 HE3 MET A 17 9.478 -3.451 -2.126 1.00 50.44 H new ATOM 298 N SER A 18 10.363 -1.114 3.598 1.00 33.23 N ATOM 299 CA SER A 18 10.717 -1.780 4.847 1.00 33.01 C ATOM 300 C SER A 18 9.501 -2.469 5.459 1.00 64.15 C ATOM 301 O SER A 18 8.583 -1.812 5.949 1.00 44.24 O ATOM 302 CB SER A 18 11.299 -0.772 5.840 1.00 0.34 C ATOM 303 OG SER A 18 10.615 0.467 5.771 1.00 63.00 O ATOM 0 H SER A 18 9.367 -0.922 3.490 1.00 33.23 H new ATOM 0 HA SER A 18 11.469 -2.537 4.626 1.00 33.01 H new ATOM 0 HB2 SER A 18 11.231 -1.173 6.851 1.00 0.34 H new ATOM 0 HB3 SER A 18 12.357 -0.619 5.629 1.00 0.34 H new ATOM 0 HG SER A 18 9.711 0.322 5.422 1.00 63.00 H new ATOM 308 N ALA A 19 9.502 -3.797 5.426 1.00 2.54 N ATOM 309 CA ALA A 19 8.401 -4.577 5.978 1.00 43.01 C ATOM 310 C ALA A 19 8.843 -5.350 7.215 1.00 61.10 C ATOM 311 O ALA A 19 10.025 -5.373 7.556 1.00 3.43 O ATOM 312 CB ALA A 19 7.850 -5.529 4.926 1.00 62.33 C ATOM 0 H ALA A 19 10.254 -4.356 5.022 1.00 2.54 H new ATOM 0 HA ALA A 19 7.612 -3.887 6.276 1.00 43.01 H new ATOM 0 HB1 ALA A 19 7.028 -6.105 5.351 1.00 62.33 H new ATOM 0 HB2 ALA A 19 7.488 -4.957 4.072 1.00 62.33 H new ATOM 0 HB3 ALA A 19 8.639 -6.207 4.600 1.00 62.33 H new ATOM 318 N SER A 20 7.884 -5.982 7.885 1.00 21.20 N ATOM 319 CA SER A 20 8.174 -6.753 9.088 1.00 31.13 C ATOM 320 C SER A 20 9.314 -7.738 8.841 1.00 72.42 C ATOM 321 O SER A 20 10.271 -7.801 9.612 1.00 34.12 O ATOM 322 CB SER A 20 6.925 -7.508 9.550 1.00 51.43 C ATOM 323 OG SER A 20 7.261 -8.785 10.063 1.00 74.13 O ATOM 0 H SER A 20 6.900 -5.975 7.615 1.00 21.20 H new ATOM 0 HA SER A 20 8.480 -6.058 9.870 1.00 31.13 H new ATOM 0 HB2 SER A 20 6.409 -6.929 10.316 1.00 51.43 H new ATOM 0 HB3 SER A 20 6.234 -7.619 8.715 1.00 51.43 H new ATOM 0 HG SER A 20 6.446 -9.246 10.353 1.00 74.13 H new ATOM 328 N SER A 21 9.202 -8.504 7.761 1.00 34.23 N ATOM 329 CA SER A 21 10.220 -9.489 7.415 1.00 42.24 C ATOM 330 C SER A 21 10.058 -9.951 5.970 1.00 41.42 C ATOM 331 O SER A 21 9.022 -9.722 5.345 1.00 21.20 O ATOM 332 CB SER A 21 10.141 -10.690 8.358 1.00 13.21 C ATOM 333 OG SER A 21 10.606 -10.352 9.654 1.00 4.24 O ATOM 0 H SER A 21 8.417 -8.462 7.111 1.00 34.23 H new ATOM 0 HA SER A 21 11.197 -9.018 7.521 1.00 42.24 H new ATOM 0 HB2 SER A 21 9.111 -11.042 8.418 1.00 13.21 H new ATOM 0 HB3 SER A 21 10.736 -11.511 7.957 1.00 13.21 H new ATOM 0 HG SER A 21 10.780 -9.389 9.698 1.00 4.24 H new ATOM 338 N SER A 22 11.090 -10.602 5.445 1.00 4.34 N ATOM 339 CA SER A 22 11.066 -11.095 4.072 1.00 13.30 C ATOM 340 C SER A 22 11.188 -12.615 4.038 1.00 43.43 C ATOM 341 O SER A 22 11.654 -13.233 4.995 1.00 4.10 O ATOM 342 CB SER A 22 12.198 -10.462 3.260 1.00 13.30 C ATOM 343 OG SER A 22 13.083 -9.738 4.098 1.00 40.31 O ATOM 0 H SER A 22 11.954 -10.801 5.949 1.00 4.34 H new ATOM 0 HA SER A 22 10.110 -10.815 3.629 1.00 13.30 H new ATOM 0 HB2 SER A 22 12.748 -11.239 2.730 1.00 13.30 H new ATOM 0 HB3 SER A 22 11.780 -9.796 2.505 1.00 13.30 H new ATOM 0 HG SER A 22 13.798 -9.345 3.556 1.00 40.31 H new ATOM 348 N TYR A 23 10.766 -13.211 2.928 1.00 44.43 N ATOM 349 CA TYR A 23 10.825 -14.659 2.768 1.00 11.51 C ATOM 350 C TYR A 23 12.215 -15.188 3.109 1.00 1.45 C ATOM 351 O TYR A 23 13.216 -14.491 2.943 1.00 11.31 O ATOM 352 CB TYR A 23 10.455 -15.051 1.336 1.00 12.24 C ATOM 353 CG TYR A 23 11.555 -14.789 0.333 1.00 1.23 C ATOM 354 CD1 TYR A 23 11.953 -13.492 0.031 1.00 22.01 C ATOM 355 CD2 TYR A 23 12.199 -15.838 -0.312 1.00 43.04 C ATOM 356 CE1 TYR A 23 12.958 -13.249 -0.885 1.00 44.54 C ATOM 357 CE2 TYR A 23 13.204 -15.604 -1.229 1.00 14.12 C ATOM 358 CZ TYR A 23 13.581 -14.308 -1.513 1.00 61.43 C ATOM 359 OH TYR A 23 14.583 -14.070 -2.426 1.00 75.32 O ATOM 0 H TYR A 23 10.379 -12.714 2.126 1.00 44.43 H new ATOM 0 HA TYR A 23 10.107 -15.105 3.456 1.00 11.51 H new ATOM 0 HB2 TYR A 23 10.199 -16.110 1.313 1.00 12.24 H new ATOM 0 HB3 TYR A 23 9.563 -14.501 1.037 1.00 12.24 H new ATOM 0 HD1 TYR A 23 11.468 -12.660 0.521 1.00 22.01 H new ATOM 0 HD2 TYR A 23 11.908 -16.855 -0.092 1.00 43.04 H new ATOM 0 HE1 TYR A 23 13.255 -12.235 -1.109 1.00 44.54 H new ATOM 0 HE2 TYR A 23 13.693 -16.432 -1.722 1.00 14.12 H new ATOM 0 HH TYR A 23 14.917 -14.923 -2.775 1.00 75.32 H new ATOM 368 N LYS A 24 12.268 -16.427 3.587 1.00 4.42 N ATOM 369 CA LYS A 24 13.533 -17.054 3.949 1.00 1.25 C ATOM 370 C LYS A 24 14.257 -17.575 2.712 1.00 2.35 C ATOM 371 O LYS A 24 13.729 -17.522 1.602 1.00 42.34 O ATOM 372 CB LYS A 24 13.295 -18.201 4.935 1.00 41.44 C ATOM 373 CG LYS A 24 12.393 -19.294 4.387 1.00 74.12 C ATOM 374 CD LYS A 24 13.160 -20.584 4.152 1.00 73.22 C ATOM 375 CE LYS A 24 12.256 -21.678 3.604 1.00 1.25 C ATOM 376 NZ LYS A 24 13.031 -22.733 2.894 1.00 60.40 N ATOM 0 H LYS A 24 11.449 -17.017 3.733 1.00 4.42 H new ATOM 0 HA LYS A 24 14.160 -16.299 4.424 1.00 1.25 H new ATOM 0 HB2 LYS A 24 14.255 -18.637 5.211 1.00 41.44 H new ATOM 0 HB3 LYS A 24 12.853 -17.800 5.847 1.00 41.44 H new ATOM 0 HG2 LYS A 24 11.576 -19.477 5.085 1.00 74.12 H new ATOM 0 HG3 LYS A 24 11.944 -18.961 3.451 1.00 74.12 H new ATOM 0 HD2 LYS A 24 13.976 -20.401 3.453 1.00 73.22 H new ATOM 0 HD3 LYS A 24 13.610 -20.917 5.087 1.00 73.22 H new ATOM 0 HE2 LYS A 24 11.694 -22.129 4.422 1.00 1.25 H new ATOM 0 HE3 LYS A 24 11.528 -21.240 2.921 1.00 1.25 H new ATOM 0 HZ1 LYS A 24 12.380 -23.460 2.535 1.00 60.40 H new ATOM 0 HZ2 LYS A 24 13.548 -22.308 2.098 1.00 60.40 H new ATOM 0 HZ3 LYS A 24 13.708 -23.169 3.552 1.00 60.40 H new ATOM 386 N THR A 25 15.471 -18.081 2.911 1.00 14.42 N ATOM 387 CA THR A 25 16.267 -18.612 1.811 1.00 15.13 C ATOM 388 C THR A 25 16.473 -20.115 1.958 1.00 51.45 C ATOM 389 O THR A 25 16.328 -20.867 0.995 1.00 44.53 O ATOM 390 CB THR A 25 17.643 -17.923 1.730 1.00 55.30 C ATOM 391 OG1 THR A 25 17.991 -17.371 3.005 1.00 61.32 O ATOM 392 CG2 THR A 25 17.635 -16.822 0.681 1.00 53.11 C ATOM 0 H THR A 25 15.924 -18.134 3.823 1.00 14.42 H new ATOM 0 HA THR A 25 15.713 -18.411 0.894 1.00 15.13 H new ATOM 0 HB THR A 25 18.383 -18.671 1.444 1.00 55.30 H new ATOM 0 HG1 THR A 25 18.867 -16.937 2.945 1.00 61.32 H new ATOM 0 HG21 THR A 25 18.617 -16.350 0.642 1.00 53.11 H new ATOM 0 HG22 THR A 25 17.399 -17.250 -0.293 1.00 53.11 H new ATOM 0 HG23 THR A 25 16.884 -16.076 0.942 1.00 53.11 H new ATOM 400 N TRP A 26 16.811 -20.546 3.167 1.00 34.11 N ATOM 401 CA TRP A 26 17.036 -21.962 3.439 1.00 72.45 C ATOM 402 C TRP A 26 17.083 -22.227 4.940 1.00 40.01 C ATOM 403 O TRP A 26 17.846 -23.071 5.407 1.00 44.55 O ATOM 404 CB TRP A 26 18.337 -22.427 2.785 1.00 34.25 C ATOM 405 CG TRP A 26 19.563 -21.837 3.414 1.00 54.04 C ATOM 406 CD1 TRP A 26 20.008 -20.550 3.293 1.00 44.02 C ATOM 407 CD2 TRP A 26 20.500 -22.509 4.262 1.00 51.51 C ATOM 408 NE1 TRP A 26 21.165 -20.384 4.013 1.00 1.34 N ATOM 409 CE2 TRP A 26 21.489 -21.571 4.618 1.00 52.55 C ATOM 410 CE3 TRP A 26 20.601 -23.812 4.755 1.00 1.21 C ATOM 411 CZ2 TRP A 26 22.562 -21.897 5.442 1.00 75.54 C ATOM 412 CZ3 TRP A 26 21.666 -24.134 5.574 1.00 2.02 C ATOM 413 CH2 TRP A 26 22.635 -23.180 5.911 1.00 32.03 C ATOM 0 H TRP A 26 16.936 -19.936 3.975 1.00 34.11 H new ATOM 0 HA TRP A 26 16.204 -22.525 3.016 1.00 72.45 H new ATOM 0 HB2 TRP A 26 18.396 -23.514 2.842 1.00 34.25 H new ATOM 0 HB3 TRP A 26 18.318 -22.164 1.727 1.00 34.25 H new ATOM 0 HD1 TRP A 26 19.521 -19.778 2.716 1.00 44.02 H new ATOM 0 HE1 TRP A 26 21.698 -19.517 4.086 1.00 1.34 H new ATOM 0 HE3 TRP A 26 19.859 -24.555 4.500 1.00 1.21 H new ATOM 0 HZ2 TRP A 26 23.311 -21.163 5.702 1.00 75.54 H new ATOM 0 HZ3 TRP A 26 21.753 -25.138 5.961 1.00 2.02 H new ATOM 0 HH2 TRP A 26 23.456 -23.463 6.554 1.00 32.03 H new ATOM 423 N ASN A 27 16.261 -21.500 5.692 1.00 5.31 N ATOM 424 CA ASN A 27 16.211 -21.658 7.141 1.00 42.45 C ATOM 425 C ASN A 27 14.922 -21.070 7.706 1.00 72.12 C ATOM 426 O ASN A 27 14.425 -20.053 7.222 1.00 55.41 O ATOM 427 CB ASN A 27 17.421 -20.984 7.790 1.00 31.22 C ATOM 428 CG ASN A 27 18.186 -21.925 8.701 1.00 53.53 C ATOM 429 OD1 ASN A 27 17.600 -22.607 9.541 1.00 32.11 O ATOM 430 ND2 ASN A 27 19.504 -21.965 8.537 1.00 52.22 N ATOM 0 H ASN A 27 15.622 -20.797 5.322 1.00 5.31 H new ATOM 0 HA ASN A 27 16.234 -22.724 7.368 1.00 42.45 H new ATOM 0 HB2 ASN A 27 18.088 -20.613 7.012 1.00 31.22 H new ATOM 0 HB3 ASN A 27 17.088 -20.119 8.363 1.00 31.22 H new ATOM 0 HD21 ASN A 27 20.072 -22.579 9.121 1.00 52.22 H new ATOM 0 HD22 ASN A 27 19.948 -21.382 7.828 1.00 52.22 H new ATOM 436 N LEU A 28 14.386 -21.716 8.736 1.00 70.14 N ATOM 437 CA LEU A 28 13.154 -21.257 9.369 1.00 71.22 C ATOM 438 C LEU A 28 13.254 -19.784 9.751 1.00 71.00 C ATOM 439 O LEU A 28 12.289 -19.032 9.623 1.00 42.05 O ATOM 440 CB LEU A 28 12.853 -22.098 10.611 1.00 62.23 C ATOM 441 CG LEU A 28 13.971 -22.187 11.650 1.00 30.41 C ATOM 442 CD1 LEU A 28 13.626 -21.360 12.878 1.00 51.25 C ATOM 443 CD2 LEU A 28 14.227 -23.636 12.036 1.00 22.03 C ATOM 0 H LEU A 28 14.785 -22.558 9.150 1.00 70.14 H new ATOM 0 HA LEU A 28 12.341 -21.373 8.652 1.00 71.22 H new ATOM 0 HB2 LEU A 28 11.966 -21.689 11.095 1.00 62.23 H new ATOM 0 HB3 LEU A 28 12.603 -23.109 10.289 1.00 62.23 H new ATOM 0 HG LEU A 28 14.882 -21.783 11.209 1.00 30.41 H new ATOM 0 HD11 LEU A 28 14.433 -21.436 13.606 1.00 51.25 H new ATOM 0 HD12 LEU A 28 13.494 -20.317 12.589 1.00 51.25 H new ATOM 0 HD13 LEU A 28 12.702 -21.733 13.320 1.00 51.25 H new ATOM 0 HD21 LEU A 28 15.026 -23.680 12.776 1.00 22.03 H new ATOM 0 HD22 LEU A 28 13.318 -24.066 12.457 1.00 22.03 H new ATOM 0 HD23 LEU A 28 14.521 -24.202 11.152 1.00 22.03 H new ATOM 454 N ARG A 29 14.430 -19.378 10.220 1.00 44.41 N ATOM 455 CA ARG A 29 14.657 -17.994 10.618 1.00 20.43 C ATOM 456 C ARG A 29 15.814 -17.384 9.833 1.00 3.03 C ATOM 457 O ARG A 29 16.978 -17.537 10.204 1.00 43.44 O ATOM 458 CB ARG A 29 14.948 -17.916 12.118 1.00 33.11 C ATOM 459 CG ARG A 29 13.974 -17.032 12.882 1.00 24.51 C ATOM 460 CD ARG A 29 14.532 -16.631 14.238 1.00 20.31 C ATOM 461 NE ARG A 29 13.924 -17.391 15.326 1.00 33.42 N ATOM 462 CZ ARG A 29 12.704 -17.156 15.796 1.00 2.21 C ATOM 463 NH1 ARG A 29 11.964 -16.188 15.273 1.00 43.02 N ATOM 464 NH2 ARG A 29 12.221 -17.892 16.789 1.00 62.44 N ATOM 0 H ARG A 29 15.240 -19.988 10.333 1.00 44.41 H new ATOM 0 HA ARG A 29 13.753 -17.426 10.398 1.00 20.43 H new ATOM 0 HB2 ARG A 29 14.919 -18.921 12.538 1.00 33.11 H new ATOM 0 HB3 ARG A 29 15.960 -17.538 12.264 1.00 33.11 H new ATOM 0 HG2 ARG A 29 13.757 -16.138 12.298 1.00 24.51 H new ATOM 0 HG3 ARG A 29 13.030 -17.561 13.017 1.00 24.51 H new ATOM 0 HD2 ARG A 29 15.611 -16.786 14.246 1.00 20.31 H new ATOM 0 HD3 ARG A 29 14.362 -15.567 14.400 1.00 20.31 H new ATOM 0 HE ARG A 29 14.466 -18.144 15.749 1.00 33.42 H new ATOM 0 HH11 ARG A 29 12.331 -15.622 14.508 1.00 43.02 H new ATOM 0 HH12 ARG A 29 11.027 -16.009 15.636 1.00 43.02 H new ATOM 0 HH21 ARG A 29 12.787 -18.639 17.192 1.00 62.44 H new ATOM 0 HH22 ARG A 29 11.284 -17.711 17.149 1.00 62.44 H new ATOM 475 N ALA A 30 15.486 -16.696 8.745 1.00 54.45 N ATOM 476 CA ALA A 30 16.496 -16.062 7.908 1.00 13.30 C ATOM 477 C ALA A 30 16.364 -14.542 7.941 1.00 20.44 C ATOM 478 O ALA A 30 15.589 -13.994 8.726 1.00 22.11 O ATOM 479 CB ALA A 30 16.392 -16.570 6.478 1.00 1.44 C ATOM 0 H ALA A 30 14.527 -16.563 8.422 1.00 54.45 H new ATOM 0 HA ALA A 30 17.476 -16.324 8.306 1.00 13.30 H new ATOM 0 HB1 ALA A 30 17.153 -16.088 5.864 1.00 1.44 H new ATOM 0 HB2 ALA A 30 16.545 -17.649 6.463 1.00 1.44 H new ATOM 0 HB3 ALA A 30 15.404 -16.338 6.080 1.00 1.44 H new ATOM 485 N PHE A 31 17.126 -13.867 7.088 1.00 62.10 N ATOM 486 CA PHE A 31 17.095 -12.411 7.021 1.00 23.20 C ATOM 487 C PHE A 31 16.586 -11.939 5.661 1.00 21.43 C ATOM 488 O PHE A 31 16.037 -10.845 5.537 1.00 31.23 O ATOM 489 CB PHE A 31 18.488 -11.838 7.284 1.00 74.11 C ATOM 490 CG PHE A 31 18.522 -10.832 8.399 1.00 71.41 C ATOM 491 CD1 PHE A 31 17.654 -9.752 8.403 1.00 55.30 C ATOM 492 CD2 PHE A 31 19.422 -10.967 9.444 1.00 31.12 C ATOM 493 CE1 PHE A 31 17.683 -8.825 9.428 1.00 51.05 C ATOM 494 CE2 PHE A 31 19.454 -10.044 10.473 1.00 44.41 C ATOM 495 CZ PHE A 31 18.585 -8.971 10.464 1.00 43.12 C ATOM 0 H PHE A 31 17.773 -14.305 6.433 1.00 62.10 H new ATOM 0 HA PHE A 31 16.411 -12.051 7.789 1.00 23.20 H new ATOM 0 HB2 PHE A 31 19.169 -12.655 7.522 1.00 74.11 H new ATOM 0 HB3 PHE A 31 18.858 -11.370 6.372 1.00 74.11 H new ATOM 0 HD1 PHE A 31 16.946 -9.633 7.596 1.00 55.30 H new ATOM 0 HD2 PHE A 31 20.106 -11.803 9.455 1.00 31.12 H new ATOM 0 HE1 PHE A 31 17.001 -7.987 9.419 1.00 51.05 H new ATOM 0 HE2 PHE A 31 20.158 -10.162 11.283 1.00 44.41 H new ATOM 0 HZ PHE A 31 18.610 -8.247 11.265 1.00 43.12 H new ATOM 504 N GLY A 32 16.774 -12.774 4.644 1.00 13.13 N ATOM 505 CA GLY A 32 16.330 -12.426 3.307 1.00 72.41 C ATOM 506 C GLY A 32 17.255 -11.434 2.629 1.00 11.42 C ATOM 507 O GLY A 32 18.331 -11.129 3.142 1.00 33.23 O ATOM 0 H GLY A 32 17.226 -13.685 4.722 1.00 13.13 H new ATOM 0 HA2 GLY A 32 16.266 -13.330 2.702 1.00 72.41 H new ATOM 0 HA3 GLY A 32 15.326 -12.005 3.359 1.00 72.41 H new ATOM 511 N TRP A 33 16.836 -10.932 1.473 1.00 72.03 N ATOM 512 CA TRP A 33 17.636 -9.970 0.723 1.00 52.11 C ATOM 513 C TRP A 33 17.052 -8.566 0.842 1.00 25.43 C ATOM 514 O TRP A 33 17.285 -7.713 -0.014 1.00 43.14 O ATOM 515 CB TRP A 33 17.716 -10.380 -0.748 1.00 42.44 C ATOM 516 CG TRP A 33 19.112 -10.661 -1.211 1.00 12.23 C ATOM 517 CD1 TRP A 33 19.560 -11.800 -1.818 1.00 12.45 C ATOM 518 CD2 TRP A 33 20.243 -9.790 -1.103 1.00 23.04 C ATOM 519 NE1 TRP A 33 20.902 -11.688 -2.094 1.00 3.12 N ATOM 520 CE2 TRP A 33 21.345 -10.465 -1.665 1.00 44.23 C ATOM 521 CE3 TRP A 33 20.433 -8.505 -0.587 1.00 41.11 C ATOM 522 CZ2 TRP A 33 22.615 -9.897 -1.725 1.00 70.31 C ATOM 523 CZ3 TRP A 33 21.694 -7.942 -0.647 1.00 22.45 C ATOM 524 CH2 TRP A 33 22.772 -8.637 -1.212 1.00 63.22 C ATOM 0 H TRP A 33 15.948 -11.175 1.035 1.00 72.03 H new ATOM 0 HA TRP A 33 18.641 -9.962 1.146 1.00 52.11 H new ATOM 0 HB2 TRP A 33 17.104 -11.268 -0.904 1.00 42.44 H new ATOM 0 HB3 TRP A 33 17.290 -9.587 -1.362 1.00 42.44 H new ATOM 0 HD1 TRP A 33 18.950 -12.661 -2.047 1.00 12.45 H new ATOM 0 HE1 TRP A 33 21.475 -12.401 -2.545 1.00 3.12 H new ATOM 0 HE3 TRP A 33 19.609 -7.961 -0.149 1.00 41.11 H new ATOM 0 HZ2 TRP A 33 23.447 -10.431 -2.161 1.00 70.31 H new ATOM 0 HZ3 TRP A 33 21.851 -6.949 -0.252 1.00 22.45 H new ATOM 0 HH2 TRP A 33 23.745 -8.170 -1.243 1.00 63.22 H new ATOM 534 N TYR A 34 16.294 -8.334 1.909 1.00 1.41 N ATOM 535 CA TYR A 34 15.676 -7.033 2.137 1.00 24.10 C ATOM 536 C TYR A 34 14.687 -6.698 1.026 1.00 53.41 C ATOM 537 O TYR A 34 14.726 -7.263 -0.067 1.00 25.00 O ATOM 538 CB TYR A 34 16.746 -5.945 2.229 1.00 11.24 C ATOM 539 CG TYR A 34 17.072 -5.533 3.648 1.00 65.12 C ATOM 540 CD1 TYR A 34 17.253 -6.484 4.644 1.00 71.14 C ATOM 541 CD2 TYR A 34 17.197 -4.193 3.990 1.00 34.14 C ATOM 542 CE1 TYR A 34 17.549 -6.112 5.941 1.00 74.44 C ATOM 543 CE2 TYR A 34 17.495 -3.812 5.284 1.00 15.12 C ATOM 544 CZ TYR A 34 17.668 -4.775 6.256 1.00 33.01 C ATOM 545 OH TYR A 34 17.965 -4.400 7.547 1.00 22.40 O ATOM 0 H TYR A 34 16.093 -9.029 2.628 1.00 1.41 H new ATOM 0 HA TYR A 34 15.132 -7.078 3.081 1.00 24.10 H new ATOM 0 HB2 TYR A 34 17.656 -6.300 1.745 1.00 11.24 H new ATOM 0 HB3 TYR A 34 16.410 -5.069 1.674 1.00 11.24 H new ATOM 0 HD1 TYR A 34 17.161 -7.532 4.400 1.00 71.14 H new ATOM 0 HD2 TYR A 34 17.059 -3.436 3.232 1.00 34.14 H new ATOM 0 HE1 TYR A 34 17.686 -6.864 6.704 1.00 74.44 H new ATOM 0 HE2 TYR A 34 17.592 -2.766 5.533 1.00 15.12 H new ATOM 0 HH TYR A 34 18.014 -3.423 7.601 1.00 22.40 H new ATOM 554 N PRO A 35 13.779 -5.752 1.309 1.00 65.53 N ATOM 555 CA PRO A 35 12.762 -5.317 0.347 1.00 70.44 C ATOM 556 C PRO A 35 13.361 -4.530 -0.813 1.00 1.23 C ATOM 557 O PRO A 35 14.581 -4.479 -0.978 1.00 43.43 O ATOM 558 CB PRO A 35 11.843 -4.421 1.182 1.00 3.14 C ATOM 559 CG PRO A 35 12.705 -3.926 2.292 1.00 61.24 C ATOM 560 CD PRO A 35 13.674 -5.035 2.591 1.00 62.53 C ATOM 0 HA PRO A 35 12.251 -6.162 -0.115 1.00 70.44 H new ATOM 0 HB2 PRO A 35 11.448 -3.596 0.589 1.00 3.14 H new ATOM 0 HB3 PRO A 35 10.987 -4.978 1.563 1.00 3.14 H new ATOM 0 HG2 PRO A 35 13.231 -3.016 2.002 1.00 61.24 H new ATOM 0 HG3 PRO A 35 12.108 -3.682 3.171 1.00 61.24 H new ATOM 0 HD2 PRO A 35 14.640 -4.648 2.915 1.00 62.53 H new ATOM 0 HD3 PRO A 35 13.308 -5.685 3.386 1.00 62.53 H new ATOM 565 N HIS A 36 12.497 -3.917 -1.616 1.00 51.52 N ATOM 566 CA HIS A 36 12.942 -3.131 -2.762 1.00 15.25 C ATOM 567 C HIS A 36 13.616 -4.021 -3.802 1.00 51.23 C ATOM 568 O HIS A 36 14.796 -3.850 -4.111 1.00 50.10 O ATOM 569 CB HIS A 36 13.908 -2.034 -2.310 1.00 21.31 C ATOM 570 CG HIS A 36 14.018 -0.898 -3.278 1.00 73.05 C ATOM 571 ND1 HIS A 36 15.051 -0.774 -4.182 1.00 21.15 N ATOM 572 CD2 HIS A 36 13.213 0.172 -3.483 1.00 34.33 C ATOM 573 CE1 HIS A 36 14.880 0.322 -4.898 1.00 2.44 C ATOM 574 NE2 HIS A 36 13.771 0.914 -4.494 1.00 31.22 N ATOM 0 H HIS A 36 11.485 -3.949 -1.494 1.00 51.52 H new ATOM 0 HA HIS A 36 12.066 -2.669 -3.217 1.00 15.25 H new ATOM 0 HB2 HIS A 36 13.580 -1.648 -1.345 1.00 21.31 H new ATOM 0 HB3 HIS A 36 14.896 -2.470 -2.160 1.00 21.31 H new ATOM 0 HD2 HIS A 36 12.302 0.399 -2.950 1.00 34.33 H new ATOM 0 HE1 HIS A 36 15.535 0.674 -5.681 1.00 2.44 H new ATOM 0 HE2 HIS A 36 13.391 1.782 -4.872 1.00 31.22 H new ATOM 581 N LEU A 37 12.859 -4.971 -4.340 1.00 21.21 N ATOM 582 CA LEU A 37 13.382 -5.889 -5.346 1.00 33.41 C ATOM 583 C LEU A 37 12.729 -5.640 -6.702 1.00 34.34 C ATOM 584 O LEU A 37 13.321 -5.909 -7.746 1.00 20.35 O ATOM 585 CB LEU A 37 13.149 -7.338 -4.913 1.00 53.51 C ATOM 586 CG LEU A 37 13.689 -7.721 -3.535 1.00 24.41 C ATOM 587 CD1 LEU A 37 14.996 -6.997 -3.253 1.00 23.31 C ATOM 588 CD2 LEU A 37 12.662 -7.413 -2.455 1.00 3.21 C ATOM 0 H LEU A 37 11.881 -5.126 -4.096 1.00 21.21 H new ATOM 0 HA LEU A 37 14.453 -5.713 -5.441 1.00 33.41 H new ATOM 0 HB2 LEU A 37 12.077 -7.533 -4.928 1.00 53.51 H new ATOM 0 HB3 LEU A 37 13.603 -7.995 -5.655 1.00 53.51 H new ATOM 0 HG LEU A 37 13.883 -8.793 -3.528 1.00 24.41 H new ATOM 0 HD11 LEU A 37 15.365 -7.282 -2.268 1.00 23.31 H new ATOM 0 HD12 LEU A 37 15.733 -7.269 -4.009 1.00 23.31 H new ATOM 0 HD13 LEU A 37 14.829 -5.920 -3.280 1.00 23.31 H new ATOM 0 HD21 LEU A 37 13.064 -7.692 -1.481 1.00 3.21 H new ATOM 0 HD22 LEU A 37 12.435 -6.347 -2.462 1.00 3.21 H new ATOM 0 HD23 LEU A 37 11.751 -7.979 -2.647 1.00 3.21 H new ATOM 599 N GLY A 38 11.505 -5.121 -6.678 1.00 21.21 N ATOM 600 CA GLY A 38 10.793 -4.842 -7.911 1.00 2.15 C ATOM 601 C GLY A 38 11.498 -3.808 -8.766 1.00 4.32 C ATOM 602 O GLY A 38 11.139 -3.603 -9.925 1.00 42.25 O ATOM 0 H GLY A 38 10.994 -4.889 -5.826 1.00 21.21 H new ATOM 0 HA2 GLY A 38 10.682 -5.765 -8.480 1.00 2.15 H new ATOM 0 HA3 GLY A 38 9.789 -4.490 -7.675 1.00 2.15 H new ATOM 606 N ARG A 39 12.503 -3.155 -8.193 1.00 74.02 N ATOM 607 CA ARG A 39 13.258 -2.133 -8.910 1.00 25.32 C ATOM 608 C ARG A 39 13.549 -2.578 -10.340 1.00 51.22 C ATOM 609 O ARG A 39 13.635 -3.772 -10.626 1.00 12.05 O ATOM 610 CB ARG A 39 14.569 -1.832 -8.181 1.00 21.54 C ATOM 611 CG ARG A 39 15.527 -3.012 -8.139 1.00 55.40 C ATOM 612 CD ARG A 39 16.974 -2.551 -8.060 1.00 45.20 C ATOM 613 NE ARG A 39 17.406 -2.341 -6.681 1.00 11.24 N ATOM 614 CZ ARG A 39 18.631 -1.951 -6.347 1.00 13.34 C ATOM 615 NH1 ARG A 39 19.540 -1.728 -7.286 1.00 71.15 N ATOM 616 NH2 ARG A 39 18.950 -1.782 -5.069 1.00 64.01 N ATOM 0 H ARG A 39 12.814 -3.315 -7.235 1.00 74.02 H new ATOM 0 HA ARG A 39 12.654 -1.226 -8.945 1.00 25.32 H new ATOM 0 HB2 ARG A 39 15.062 -0.992 -8.670 1.00 21.54 H new ATOM 0 HB3 ARG A 39 14.345 -1.520 -7.161 1.00 21.54 H new ATOM 0 HG2 ARG A 39 15.296 -3.639 -7.278 1.00 55.40 H new ATOM 0 HG3 ARG A 39 15.388 -3.627 -9.028 1.00 55.40 H new ATOM 0 HD2 ARG A 39 17.617 -3.293 -8.533 1.00 45.20 H new ATOM 0 HD3 ARG A 39 17.091 -1.624 -8.622 1.00 45.20 H new ATOM 0 HE ARG A 39 16.731 -2.503 -5.934 1.00 11.24 H new ATOM 0 HH11 ARG A 39 19.300 -1.856 -8.269 1.00 71.15 H new ATOM 0 HH12 ARG A 39 20.480 -1.429 -7.025 1.00 71.15 H new ATOM 0 HH21 ARG A 39 18.254 -1.952 -4.343 1.00 64.01 H new ATOM 0 HH22 ARG A 39 19.891 -1.483 -4.814 1.00 64.01 H new ATOM 627 N LEU A 40 13.699 -1.608 -11.236 1.00 52.44 N ATOM 628 CA LEU A 40 13.980 -1.897 -12.638 1.00 72.52 C ATOM 629 C LEU A 40 15.170 -2.842 -12.770 1.00 41.23 C ATOM 630 O LEU A 40 15.988 -2.957 -11.858 1.00 33.44 O ATOM 631 CB LEU A 40 14.255 -0.600 -13.401 1.00 23.11 C ATOM 632 CG LEU A 40 13.541 -0.449 -14.745 1.00 52.24 C ATOM 633 CD1 LEU A 40 12.137 0.099 -14.544 1.00 14.20 C ATOM 634 CD2 LEU A 40 14.339 0.453 -15.674 1.00 12.43 C ATOM 0 H LEU A 40 13.631 -0.614 -11.016 1.00 52.44 H new ATOM 0 HA LEU A 40 13.104 -2.384 -13.067 1.00 72.52 H new ATOM 0 HB2 LEU A 40 13.972 0.239 -12.765 1.00 23.11 H new ATOM 0 HB3 LEU A 40 15.329 -0.523 -13.572 1.00 23.11 H new ATOM 0 HG LEU A 40 13.463 -1.434 -15.206 1.00 52.24 H new ATOM 0 HD11 LEU A 40 11.644 0.200 -15.511 1.00 14.20 H new ATOM 0 HD12 LEU A 40 11.566 -0.584 -13.915 1.00 14.20 H new ATOM 0 HD13 LEU A 40 12.193 1.075 -14.062 1.00 14.20 H new ATOM 0 HD21 LEU A 40 13.816 0.549 -16.626 1.00 12.43 H new ATOM 0 HD22 LEU A 40 14.449 1.438 -15.219 1.00 12.43 H new ATOM 0 HD23 LEU A 40 15.325 0.020 -15.844 1.00 12.43 H new ATOM 645 N ASP A 41 15.261 -3.512 -13.914 1.00 22.45 N ATOM 646 CA ASP A 41 16.354 -4.445 -14.168 1.00 31.40 C ATOM 647 C ASP A 41 16.136 -5.754 -13.415 1.00 11.24 C ATOM 648 O ASP A 41 16.110 -6.829 -14.015 1.00 54.14 O ATOM 649 CB ASP A 41 17.690 -3.822 -13.757 1.00 44.15 C ATOM 650 CG ASP A 41 18.763 -4.009 -14.812 1.00 13.01 C ATOM 651 OD1 ASP A 41 18.990 -5.164 -15.229 1.00 2.32 O ATOM 652 OD2 ASP A 41 19.374 -3.000 -15.221 1.00 71.02 O ATOM 0 H ASP A 41 14.592 -3.427 -14.679 1.00 22.45 H new ATOM 0 HA ASP A 41 16.376 -4.660 -15.236 1.00 31.40 H new ATOM 0 HB2 ASP A 41 17.549 -2.757 -13.570 1.00 44.15 H new ATOM 0 HB3 ASP A 41 18.023 -4.269 -12.820 1.00 44.15 H new ATOM 656 N ASN A 42 15.984 -5.657 -12.099 1.00 74.43 N ATOM 657 CA ASN A 42 15.770 -6.833 -11.264 1.00 4.12 C ATOM 658 C ASN A 42 16.562 -8.025 -11.793 1.00 64.13 C ATOM 659 O ASN A 42 16.050 -9.143 -11.856 1.00 2.53 O ATOM 660 CB ASN A 42 14.281 -7.180 -11.206 1.00 4.44 C ATOM 661 CG ASN A 42 13.736 -7.616 -12.553 1.00 35.52 C ATOM 662 OD1 ASN A 42 13.672 -8.809 -12.852 1.00 42.14 O ATOM 663 ND2 ASN A 42 13.342 -6.649 -13.372 1.00 55.14 N ATOM 0 H ASN A 42 16.005 -4.775 -11.587 1.00 74.43 H new ATOM 0 HA ASN A 42 16.121 -6.603 -10.258 1.00 4.12 H new ATOM 0 HB2 ASN A 42 14.124 -7.977 -10.479 1.00 4.44 H new ATOM 0 HB3 ASN A 42 13.722 -6.313 -10.854 1.00 4.44 H new ATOM 0 HD21 ASN A 42 12.967 -6.881 -14.292 1.00 55.14 H new ATOM 0 HD22 ASN A 42 13.414 -5.674 -13.081 1.00 55.14 H new ATOM 669 N GLN A 43 17.812 -7.779 -12.171 1.00 43.34 N ATOM 670 CA GLN A 43 18.674 -8.832 -12.695 1.00 64.12 C ATOM 671 C GLN A 43 18.661 -10.051 -11.779 1.00 14.15 C ATOM 672 O GLN A 43 18.905 -11.173 -12.219 1.00 32.44 O ATOM 673 CB GLN A 43 20.104 -8.316 -12.858 1.00 0.42 C ATOM 674 CG GLN A 43 20.580 -7.461 -11.694 1.00 44.12 C ATOM 675 CD GLN A 43 20.444 -5.976 -11.966 1.00 4.13 C ATOM 676 OE1 GLN A 43 19.698 -5.273 -11.283 1.00 4.13 O ATOM 677 NE2 GLN A 43 21.166 -5.489 -12.969 1.00 71.41 N ATOM 0 H GLN A 43 18.251 -6.859 -12.124 1.00 43.34 H new ATOM 0 HA GLN A 43 18.290 -9.129 -13.671 1.00 64.12 H new ATOM 0 HB2 GLN A 43 20.777 -9.166 -12.973 1.00 0.42 H new ATOM 0 HB3 GLN A 43 20.168 -7.732 -13.776 1.00 0.42 H new ATOM 0 HG2 GLN A 43 20.008 -7.717 -10.802 1.00 44.12 H new ATOM 0 HG3 GLN A 43 21.623 -7.693 -11.481 1.00 44.12 H new ATOM 0 HE21 GLN A 43 21.771 -6.107 -13.509 1.00 71.41 H new ATOM 0 HE22 GLN A 43 21.115 -4.497 -13.199 1.00 71.41 H new ATOM 684 N GLY A 44 18.378 -9.821 -10.500 1.00 74.10 N ATOM 685 CA GLY A 44 18.341 -10.910 -9.541 1.00 73.02 C ATOM 686 C GLY A 44 17.447 -12.047 -9.990 1.00 63.23 C ATOM 687 O GLY A 44 17.867 -12.911 -10.760 1.00 42.24 O ATOM 0 H GLY A 44 18.174 -8.900 -10.111 1.00 74.10 H new ATOM 0 HA2 GLY A 44 19.352 -11.287 -9.385 1.00 73.02 H new ATOM 0 HA3 GLY A 44 17.989 -10.533 -8.581 1.00 73.02 H new ATOM 691 N LYS A 45 16.209 -12.051 -9.507 1.00 25.52 N ATOM 692 CA LYS A 45 15.251 -13.092 -9.863 1.00 32.23 C ATOM 693 C LYS A 45 13.908 -12.851 -9.182 1.00 43.15 C ATOM 694 O LYS A 45 12.855 -13.174 -9.734 1.00 54.11 O ATOM 695 CB LYS A 45 15.793 -14.468 -9.471 1.00 23.31 C ATOM 696 CG LYS A 45 15.975 -14.646 -7.973 1.00 62.23 C ATOM 697 CD LYS A 45 17.147 -13.831 -7.453 1.00 23.44 C ATOM 698 CE LYS A 45 17.780 -14.483 -6.232 1.00 54.32 C ATOM 699 NZ LYS A 45 18.914 -13.677 -5.700 1.00 75.22 N ATOM 0 H LYS A 45 15.845 -11.345 -8.868 1.00 25.52 H new ATOM 0 HA LYS A 45 15.102 -13.060 -10.942 1.00 32.23 H new ATOM 0 HB2 LYS A 45 15.113 -15.236 -9.840 1.00 23.31 H new ATOM 0 HB3 LYS A 45 16.751 -14.627 -9.966 1.00 23.31 H new ATOM 0 HG2 LYS A 45 15.064 -14.345 -7.457 1.00 62.23 H new ATOM 0 HG3 LYS A 45 16.135 -15.700 -7.748 1.00 62.23 H new ATOM 0 HD2 LYS A 45 17.895 -13.724 -8.239 1.00 23.44 H new ATOM 0 HD3 LYS A 45 16.809 -12.827 -7.197 1.00 23.44 H new ATOM 0 HE2 LYS A 45 17.026 -14.607 -5.455 1.00 54.32 H new ATOM 0 HE3 LYS A 45 18.134 -15.480 -6.495 1.00 54.32 H new ATOM 0 HZ1 LYS A 45 19.319 -14.154 -4.869 1.00 75.22 H new ATOM 0 HZ2 LYS A 45 19.645 -13.579 -6.434 1.00 75.22 H new ATOM 0 HZ3 LYS A 45 18.571 -12.734 -5.425 1.00 75.22 H new ATOM 709 N ILE A 46 13.951 -12.280 -7.983 1.00 40.13 N ATOM 710 CA ILE A 46 12.736 -11.993 -7.230 1.00 1.14 C ATOM 711 C ILE A 46 11.935 -10.873 -7.885 1.00 34.11 C ATOM 712 O ILE A 46 10.739 -11.016 -8.135 1.00 70.03 O ATOM 713 CB ILE A 46 13.055 -11.599 -5.776 1.00 54.11 C ATOM 714 CG1 ILE A 46 14.152 -12.501 -5.208 1.00 5.23 C ATOM 715 CG2 ILE A 46 11.801 -11.676 -4.919 1.00 33.24 C ATOM 716 CD1 ILE A 46 15.512 -11.843 -5.158 1.00 53.23 C ATOM 0 H ILE A 46 14.814 -12.007 -7.512 1.00 40.13 H new ATOM 0 HA ILE A 46 12.142 -12.907 -7.228 1.00 1.14 H new ATOM 0 HB ILE A 46 13.416 -10.571 -5.765 1.00 54.11 H new ATOM 0 HG12 ILE A 46 13.871 -12.811 -4.202 1.00 5.23 H new ATOM 0 HG13 ILE A 46 14.217 -13.405 -5.814 1.00 5.23 H new ATOM 0 HG21 ILE A 46 12.043 -11.395 -3.894 1.00 33.24 H new ATOM 0 HG22 ILE A 46 11.048 -10.994 -5.314 1.00 33.24 H new ATOM 0 HG23 ILE A 46 11.412 -12.694 -4.934 1.00 33.24 H new ATOM 0 HD11 ILE A 46 16.239 -12.542 -4.744 1.00 53.23 H new ATOM 0 HD12 ILE A 46 15.815 -11.558 -6.165 1.00 53.23 H new ATOM 0 HD13 ILE A 46 15.463 -10.955 -4.528 1.00 53.23 H new ATOM 727 N ASN A 47 12.603 -9.758 -8.161 1.00 3.32 N ATOM 728 CA ASN A 47 11.954 -8.612 -8.789 1.00 25.55 C ATOM 729 C ASN A 47 10.681 -8.232 -8.039 1.00 45.33 C ATOM 730 O ASN A 47 9.699 -7.801 -8.644 1.00 61.22 O ATOM 731 CB ASN A 47 11.626 -8.924 -10.250 1.00 62.23 C ATOM 732 CG ASN A 47 12.368 -10.143 -10.763 1.00 51.13 C ATOM 733 OD1 ASN A 47 13.594 -10.220 -10.676 1.00 42.53 O ATOM 734 ND2 ASN A 47 11.626 -11.104 -11.300 1.00 63.31 N ATOM 0 H ASN A 47 13.594 -9.623 -7.960 1.00 3.32 H new ATOM 0 HA ASN A 47 12.643 -7.768 -8.751 1.00 25.55 H new ATOM 0 HB2 ASN A 47 10.553 -9.086 -10.352 1.00 62.23 H new ATOM 0 HB3 ASN A 47 11.878 -8.062 -10.868 1.00 62.23 H new ATOM 0 HD21 ASN A 47 12.069 -11.949 -11.661 1.00 63.31 H new ATOM 0 HD22 ASN A 47 10.613 -10.998 -11.351 1.00 63.31 H new ATOM 740 N ALA A 48 10.705 -8.394 -6.721 1.00 72.32 N ATOM 741 CA ALA A 48 9.554 -8.065 -5.890 1.00 33.33 C ATOM 742 C ALA A 48 9.824 -8.391 -4.425 1.00 54.11 C ATOM 743 O ALA A 48 10.689 -9.209 -4.110 1.00 41.31 O ATOM 744 CB ALA A 48 8.320 -8.808 -6.379 1.00 62.42 C ATOM 0 H ALA A 48 11.509 -8.751 -6.205 1.00 72.32 H new ATOM 0 HA ALA A 48 9.374 -6.993 -5.970 1.00 33.33 H new ATOM 0 HB1 ALA A 48 7.468 -8.553 -5.749 1.00 62.42 H new ATOM 0 HB2 ALA A 48 8.108 -8.522 -7.409 1.00 62.42 H new ATOM 0 HB3 ALA A 48 8.499 -9.882 -6.330 1.00 62.42 H new ATOM 750 N TRP A 49 9.080 -7.747 -3.533 1.00 33.12 N ATOM 751 CA TRP A 49 9.241 -7.968 -2.100 1.00 41.01 C ATOM 752 C TRP A 49 8.308 -9.070 -1.612 1.00 43.15 C ATOM 753 O TRP A 49 7.099 -9.023 -1.845 1.00 40.01 O ATOM 754 CB TRP A 49 8.970 -6.675 -1.330 1.00 1.52 C ATOM 755 CG TRP A 49 8.600 -6.903 0.104 1.00 21.42 C ATOM 756 CD1 TRP A 49 9.455 -7.033 1.161 1.00 63.31 C ATOM 757 CD2 TRP A 49 7.277 -7.032 0.637 1.00 0.34 C ATOM 758 NE1 TRP A 49 8.743 -7.234 2.319 1.00 23.24 N ATOM 759 CE2 TRP A 49 7.406 -7.237 2.025 1.00 42.05 C ATOM 760 CE3 TRP A 49 5.997 -6.991 0.077 1.00 1.13 C ATOM 761 CZ2 TRP A 49 6.302 -7.402 2.857 1.00 42.12 C ATOM 762 CZ3 TRP A 49 4.903 -7.155 0.905 1.00 2.04 C ATOM 763 CH2 TRP A 49 5.060 -7.357 2.283 1.00 24.32 C ATOM 0 H TRP A 49 8.359 -7.068 -3.776 1.00 33.12 H new ATOM 0 HA TRP A 49 10.269 -8.281 -1.919 1.00 41.01 H new ATOM 0 HB2 TRP A 49 9.857 -6.043 -1.373 1.00 1.52 H new ATOM 0 HB3 TRP A 49 8.165 -6.129 -1.823 1.00 1.52 H new ATOM 0 HD1 TRP A 49 10.532 -6.985 1.096 1.00 63.31 H new ATOM 0 HE1 TRP A 49 9.146 -7.361 3.248 1.00 23.24 H new ATOM 0 HE3 TRP A 49 5.865 -6.834 -0.983 1.00 1.13 H new ATOM 0 HZ2 TRP A 49 6.421 -7.560 3.919 1.00 42.12 H new ATOM 0 HZ3 TRP A 49 3.909 -7.127 0.483 1.00 2.04 H new ATOM 0 HH2 TRP A 49 4.185 -7.479 2.904 1.00 24.32 H new ATOM 773 N THR A 50 8.874 -10.063 -0.933 1.00 53.02 N ATOM 774 CA THR A 50 8.092 -11.176 -0.412 1.00 30.32 C ATOM 775 C THR A 50 8.007 -11.126 1.109 1.00 73.30 C ATOM 776 O THR A 50 8.821 -10.475 1.764 1.00 53.24 O ATOM 777 CB THR A 50 8.692 -12.531 -0.836 1.00 42.44 C ATOM 778 OG1 THR A 50 9.367 -12.395 -2.092 1.00 63.44 O ATOM 779 CG2 THR A 50 7.607 -13.591 -0.949 1.00 23.35 C ATOM 0 H THR A 50 9.872 -10.118 -0.731 1.00 53.02 H new ATOM 0 HA THR A 50 7.091 -11.081 -0.832 1.00 30.32 H new ATOM 0 HB THR A 50 9.405 -12.844 -0.073 1.00 42.44 H new ATOM 0 HG1 THR A 50 9.480 -13.279 -2.500 1.00 63.44 H new ATOM 0 HG21 THR A 50 8.054 -14.539 -1.249 1.00 23.35 H new ATOM 0 HG22 THR A 50 7.114 -13.712 0.016 1.00 23.35 H new ATOM 0 HG23 THR A 50 6.874 -13.283 -1.695 1.00 23.35 H new ATOM 787 N ALA A 51 7.018 -11.817 1.665 1.00 72.20 N ATOM 788 CA ALA A 51 6.829 -11.852 3.110 1.00 2.12 C ATOM 789 C ALA A 51 7.604 -13.006 3.737 1.00 23.42 C ATOM 790 O ALA A 51 8.055 -13.913 3.040 1.00 45.51 O ATOM 791 CB ALA A 51 5.349 -11.963 3.447 1.00 42.25 C ATOM 0 H ALA A 51 6.335 -12.360 1.137 1.00 72.20 H new ATOM 0 HA ALA A 51 7.216 -10.921 3.524 1.00 2.12 H new ATOM 0 HB1 ALA A 51 5.223 -11.988 4.529 1.00 42.25 H new ATOM 0 HB2 ALA A 51 4.818 -11.103 3.040 1.00 42.25 H new ATOM 0 HB3 ALA A 51 4.945 -12.878 3.013 1.00 42.25 H new ATOM 797 N GLN A 52 7.754 -12.963 5.057 1.00 24.23 N ATOM 798 CA GLN A 52 8.477 -14.006 5.776 1.00 74.52 C ATOM 799 C GLN A 52 7.509 -14.971 6.454 1.00 72.23 C ATOM 800 O GLN A 52 7.625 -16.188 6.308 1.00 54.53 O ATOM 801 CB GLN A 52 9.408 -13.384 6.819 1.00 42.32 C ATOM 802 CG GLN A 52 10.433 -14.358 7.377 1.00 40.21 C ATOM 803 CD GLN A 52 9.889 -15.184 8.526 1.00 13.10 C ATOM 804 OE1 GLN A 52 9.929 -16.414 8.495 1.00 61.52 O ATOM 805 NE2 GLN A 52 9.377 -14.509 9.549 1.00 13.35 N ATOM 0 H GLN A 52 7.385 -12.219 5.649 1.00 24.23 H new ATOM 0 HA GLN A 52 9.072 -14.564 5.053 1.00 74.52 H new ATOM 0 HB2 GLN A 52 9.929 -12.538 6.370 1.00 42.32 H new ATOM 0 HB3 GLN A 52 8.809 -12.990 7.640 1.00 42.32 H new ATOM 0 HG2 GLN A 52 10.766 -15.024 6.581 1.00 40.21 H new ATOM 0 HG3 GLN A 52 11.308 -13.804 7.716 1.00 40.21 H new ATOM 0 HE21 GLN A 52 9.365 -13.489 9.532 1.00 13.35 H new ATOM 0 HE22 GLN A 52 8.996 -15.010 10.351 1.00 13.35 H new ATOM 812 N SER A 53 6.553 -14.418 7.195 1.00 24.45 N ATOM 813 CA SER A 53 5.567 -15.230 7.899 1.00 23.22 C ATOM 814 C SER A 53 4.509 -15.758 6.934 1.00 75.05 C ATOM 815 O SER A 53 3.641 -16.543 7.315 1.00 13.32 O ATOM 816 CB SER A 53 4.901 -14.415 9.008 1.00 12.01 C ATOM 817 OG SER A 53 4.338 -15.260 9.997 1.00 4.35 O ATOM 0 H SER A 53 6.441 -13.412 7.323 1.00 24.45 H new ATOM 0 HA SER A 53 6.084 -16.080 8.344 1.00 23.22 H new ATOM 0 HB2 SER A 53 5.635 -13.752 9.467 1.00 12.01 H new ATOM 0 HB3 SER A 53 4.123 -13.782 8.581 1.00 12.01 H new ATOM 0 HG SER A 53 3.870 -16.004 9.564 1.00 4.35 H new ATOM 822 N ASN A 54 4.588 -15.318 5.682 1.00 70.21 N ATOM 823 CA ASN A 54 3.637 -15.743 4.661 1.00 22.44 C ATOM 824 C ASN A 54 2.219 -15.785 5.223 1.00 64.42 C ATOM 825 O ASN A 54 1.456 -16.710 4.942 1.00 32.15 O ATOM 826 CB ASN A 54 4.023 -17.121 4.118 1.00 42.05 C ATOM 827 CG ASN A 54 3.934 -18.205 5.173 1.00 73.53 C ATOM 828 OD1 ASN A 54 5.038 -18.446 5.869 1.00 54.51 O flip ATOM 829 ND2 ASN A 54 2.883 -18.819 5.362 1.00 13.14 N flip ATOM 0 H ASN A 54 5.300 -14.668 5.350 1.00 70.21 H new ATOM 0 HA ASN A 54 3.666 -15.018 3.848 1.00 22.44 H new ATOM 0 HB2 ASN A 54 3.369 -17.376 3.284 1.00 42.05 H new ATOM 0 HB3 ASN A 54 5.039 -17.082 3.726 1.00 42.05 H new ATOM 0 HD21 ASN A 54 2.058 -18.601 4.804 1.00 13.14 H new ATOM 0 HD22 ASN A 54 2.838 -19.545 6.077 1.00 13.14 H new ATOM 835 N SER A 55 1.872 -14.777 6.016 1.00 32.34 N ATOM 836 CA SER A 55 0.547 -14.700 6.620 1.00 70.51 C ATOM 837 C SER A 55 -0.093 -13.340 6.355 1.00 22.05 C ATOM 838 O SER A 55 0.407 -12.554 5.552 1.00 14.30 O ATOM 839 CB SER A 55 0.634 -14.950 8.128 1.00 43.42 C ATOM 840 OG SER A 55 -0.638 -15.264 8.666 1.00 72.23 O ATOM 0 H SER A 55 2.490 -14.002 6.255 1.00 32.34 H new ATOM 0 HA SER A 55 -0.077 -15.471 6.167 1.00 70.51 H new ATOM 0 HB2 SER A 55 1.328 -15.767 8.325 1.00 43.42 H new ATOM 0 HB3 SER A 55 1.034 -14.066 8.624 1.00 43.42 H new ATOM 0 HG SER A 55 -0.535 -15.575 9.589 1.00 72.23 H new ATOM 845 N ALA A 56 -1.201 -13.072 7.037 1.00 41.15 N ATOM 846 CA ALA A 56 -1.909 -11.808 6.877 1.00 31.11 C ATOM 847 C ALA A 56 -1.446 -10.785 7.909 1.00 24.44 C ATOM 848 O ALA A 56 -1.638 -9.582 7.736 1.00 73.41 O ATOM 849 CB ALA A 56 -3.411 -12.026 6.984 1.00 30.31 C ATOM 0 H ALA A 56 -1.628 -13.713 7.706 1.00 41.15 H new ATOM 0 HA ALA A 56 -1.680 -11.415 5.886 1.00 31.11 H new ATOM 0 HB1 ALA A 56 -3.926 -11.073 6.863 1.00 30.31 H new ATOM 0 HB2 ALA A 56 -3.735 -12.716 6.205 1.00 30.31 H new ATOM 0 HB3 ALA A 56 -3.649 -12.445 7.962 1.00 30.31 H new ATOM 855 N LYS A 57 -0.836 -11.273 8.985 1.00 51.12 N ATOM 856 CA LYS A 57 -0.345 -10.401 10.046 1.00 3.35 C ATOM 857 C LYS A 57 0.838 -9.569 9.562 1.00 12.43 C ATOM 858 O LYS A 57 1.219 -8.587 10.199 1.00 52.12 O ATOM 859 CB LYS A 57 0.066 -11.231 11.264 1.00 74.22 C ATOM 860 CG LYS A 57 -0.997 -12.218 11.715 1.00 41.13 C ATOM 861 CD LYS A 57 -0.495 -13.650 11.639 1.00 72.23 C ATOM 862 CE LYS A 57 0.311 -14.024 12.873 1.00 70.32 C ATOM 863 NZ LYS A 57 1.531 -14.804 12.523 1.00 61.12 N ATOM 0 H LYS A 57 -0.670 -12.267 9.145 1.00 51.12 H new ATOM 0 HA LYS A 57 -1.151 -9.724 10.329 1.00 3.35 H new ATOM 0 HB2 LYS A 57 0.980 -11.776 11.030 1.00 74.22 H new ATOM 0 HB3 LYS A 57 0.299 -10.558 12.090 1.00 74.22 H new ATOM 0 HG2 LYS A 57 -1.296 -11.990 12.738 1.00 41.13 H new ATOM 0 HG3 LYS A 57 -1.884 -12.109 11.092 1.00 41.13 H new ATOM 0 HD2 LYS A 57 -1.342 -14.329 11.537 1.00 72.23 H new ATOM 0 HD3 LYS A 57 0.122 -13.774 10.749 1.00 72.23 H new ATOM 0 HE2 LYS A 57 0.600 -13.118 13.407 1.00 70.32 H new ATOM 0 HE3 LYS A 57 -0.312 -14.608 13.550 1.00 70.32 H new ATOM 0 HZ1 LYS A 57 2.053 -15.040 13.391 1.00 61.12 H new ATOM 0 HZ2 LYS A 57 1.255 -15.681 12.036 1.00 61.12 H new ATOM 0 HZ3 LYS A 57 2.138 -14.237 11.897 1.00 61.12 H new ATOM 873 N GLU A 58 1.414 -9.967 8.432 1.00 12.04 N ATOM 874 CA GLU A 58 2.554 -9.256 7.865 1.00 42.54 C ATOM 875 C GLU A 58 2.143 -7.866 7.385 1.00 12.10 C ATOM 876 O GLU A 58 0.990 -7.641 7.017 1.00 13.03 O ATOM 877 CB GLU A 58 3.153 -10.051 6.703 1.00 24.11 C ATOM 878 CG GLU A 58 3.936 -11.277 7.145 1.00 71.35 C ATOM 879 CD GLU A 58 5.416 -10.994 7.314 1.00 3.13 C ATOM 880 OE1 GLU A 58 5.974 -10.245 6.486 1.00 51.51 O ATOM 881 OE2 GLU A 58 6.016 -11.523 8.273 1.00 52.54 O ATOM 0 H GLU A 58 1.110 -10.777 7.892 1.00 12.04 H new ATOM 0 HA GLU A 58 3.306 -9.146 8.646 1.00 42.54 H new ATOM 0 HB2 GLU A 58 2.350 -10.364 6.036 1.00 24.11 H new ATOM 0 HB3 GLU A 58 3.810 -9.399 6.128 1.00 24.11 H new ATOM 0 HG2 GLU A 58 3.530 -11.642 8.088 1.00 71.35 H new ATOM 0 HG3 GLU A 58 3.803 -12.072 6.411 1.00 71.35 H new ATOM 886 N TRP A 59 3.095 -6.940 7.393 1.00 62.12 N ATOM 887 CA TRP A 59 2.833 -5.572 6.959 1.00 53.11 C ATOM 888 C TRP A 59 4.090 -4.937 6.373 1.00 73.30 C ATOM 889 O TRP A 59 5.194 -5.140 6.879 1.00 22.44 O ATOM 890 CB TRP A 59 2.321 -4.733 8.131 1.00 13.41 C ATOM 891 CG TRP A 59 3.371 -4.449 9.163 1.00 5.12 C ATOM 892 CD1 TRP A 59 4.253 -5.343 9.702 1.00 45.33 C ATOM 893 CD2 TRP A 59 3.648 -3.188 9.779 1.00 21.50 C ATOM 894 NE1 TRP A 59 5.060 -4.712 10.617 1.00 23.23 N ATOM 895 CE2 TRP A 59 4.710 -3.390 10.683 1.00 43.25 C ATOM 896 CE3 TRP A 59 3.103 -1.907 9.657 1.00 44.20 C ATOM 897 CZ2 TRP A 59 5.235 -2.359 11.456 1.00 55.02 C ATOM 898 CZ3 TRP A 59 3.625 -0.884 10.425 1.00 61.55 C ATOM 899 CH2 TRP A 59 4.682 -1.114 11.315 1.00 33.24 C ATOM 0 H TRP A 59 4.054 -7.111 7.695 1.00 62.12 H new ATOM 0 HA TRP A 59 2.069 -5.603 6.183 1.00 53.11 H new ATOM 0 HB2 TRP A 59 1.932 -3.789 7.750 1.00 13.41 H new ATOM 0 HB3 TRP A 59 1.488 -5.253 8.604 1.00 13.41 H new ATOM 0 HD1 TRP A 59 4.307 -6.391 9.446 1.00 45.33 H new ATOM 0 HE1 TRP A 59 5.800 -5.157 11.160 1.00 23.23 H new ATOM 0 HE3 TRP A 59 2.288 -1.720 8.974 1.00 44.20 H new ATOM 0 HZ2 TRP A 59 6.050 -2.534 12.143 1.00 55.02 H new ATOM 0 HZ3 TRP A 59 3.211 0.110 10.338 1.00 61.55 H new ATOM 0 HH2 TRP A 59 5.068 -0.294 11.901 1.00 33.24 H new ATOM 909 N LEU A 60 3.915 -4.166 5.306 1.00 44.32 N ATOM 910 CA LEU A 60 5.035 -3.500 4.651 1.00 33.13 C ATOM 911 C LEU A 60 4.894 -1.984 4.738 1.00 20.54 C ATOM 912 O LEU A 60 3.848 -1.429 4.403 1.00 4.55 O ATOM 913 CB LEU A 60 5.127 -3.932 3.186 1.00 60.44 C ATOM 914 CG LEU A 60 5.951 -3.027 2.269 1.00 32.55 C ATOM 915 CD1 LEU A 60 7.393 -2.955 2.748 1.00 73.44 C ATOM 916 CD2 LEU A 60 5.889 -3.525 0.833 1.00 44.12 C ATOM 0 H LEU A 60 3.008 -3.986 4.876 1.00 44.32 H new ATOM 0 HA LEU A 60 5.950 -3.792 5.167 1.00 33.13 H new ATOM 0 HB2 LEU A 60 5.552 -4.935 3.150 1.00 60.44 H new ATOM 0 HB3 LEU A 60 4.116 -3.999 2.784 1.00 60.44 H new ATOM 0 HG LEU A 60 5.527 -2.023 2.303 1.00 32.55 H new ATOM 0 HD11 LEU A 60 7.965 -2.307 2.084 1.00 73.44 H new ATOM 0 HD12 LEU A 60 7.420 -2.552 3.760 1.00 73.44 H new ATOM 0 HD13 LEU A 60 7.828 -3.954 2.743 1.00 73.44 H new ATOM 0 HD21 LEU A 60 6.481 -2.869 0.195 1.00 44.12 H new ATOM 0 HD22 LEU A 60 6.288 -4.538 0.782 1.00 44.12 H new ATOM 0 HD23 LEU A 60 4.854 -3.525 0.492 1.00 44.12 H new ATOM 927 N GLN A 61 5.955 -1.321 5.188 1.00 74.33 N ATOM 928 CA GLN A 61 5.948 0.132 5.318 1.00 22.24 C ATOM 929 C GLN A 61 7.059 0.757 4.482 1.00 43.01 C ATOM 930 O GLN A 61 8.200 0.294 4.498 1.00 35.40 O ATOM 931 CB GLN A 61 6.110 0.534 6.785 1.00 60.21 C ATOM 932 CG GLN A 61 5.285 -0.311 7.743 1.00 52.22 C ATOM 933 CD GLN A 61 6.085 -1.437 8.366 1.00 40.53 C ATOM 934 OE1 GLN A 61 5.927 -2.642 7.830 1.00 73.10 O flip ATOM 935 NE2 GLN A 61 6.838 -1.227 9.317 1.00 71.41 N flip ATOM 0 H GLN A 61 6.829 -1.766 5.468 1.00 74.33 H new ATOM 0 HA GLN A 61 4.990 0.501 4.951 1.00 22.24 H new ATOM 0 HB2 GLN A 61 7.162 0.457 7.060 1.00 60.21 H new ATOM 0 HB3 GLN A 61 5.826 1.580 6.900 1.00 60.21 H new ATOM 0 HG2 GLN A 61 4.887 0.326 8.532 1.00 52.22 H new ATOM 0 HG3 GLN A 61 4.431 -0.729 7.210 1.00 52.22 H new ATOM 0 HE21 GLN A 61 6.929 -0.285 9.697 1.00 71.41 H new ATOM 0 HE22 GLN A 61 7.371 -1.995 9.725 1.00 71.41 H new ATOM 942 N VAL A 62 6.718 1.812 3.749 1.00 44.31 N ATOM 943 CA VAL A 62 7.687 2.502 2.904 1.00 71.23 C ATOM 944 C VAL A 62 7.935 3.922 3.401 1.00 70.40 C ATOM 945 O VAL A 62 7.033 4.761 3.389 1.00 12.22 O ATOM 946 CB VAL A 62 7.216 2.557 1.439 1.00 61.32 C ATOM 947 CG1 VAL A 62 8.377 2.903 0.518 1.00 61.12 C ATOM 948 CG2 VAL A 62 6.579 1.236 1.035 1.00 52.14 C ATOM 0 H VAL A 62 5.778 2.208 3.723 1.00 44.31 H new ATOM 0 HA VAL A 62 8.616 1.934 2.957 1.00 71.23 H new ATOM 0 HB VAL A 62 6.464 3.340 1.346 1.00 61.32 H new ATOM 0 HG11 VAL A 62 8.026 2.937 -0.513 1.00 61.12 H new ATOM 0 HG12 VAL A 62 8.784 3.875 0.795 1.00 61.12 H new ATOM 0 HG13 VAL A 62 9.154 2.144 0.611 1.00 61.12 H new ATOM 0 HG21 VAL A 62 6.252 1.292 -0.003 1.00 52.14 H new ATOM 0 HG22 VAL A 62 7.308 0.433 1.143 1.00 52.14 H new ATOM 0 HG23 VAL A 62 5.720 1.035 1.676 1.00 52.14 H new ATOM 958 N ASP A 63 9.161 4.185 3.836 1.00 21.30 N ATOM 959 CA ASP A 63 9.529 5.505 4.336 1.00 71.33 C ATOM 960 C ASP A 63 10.400 6.245 3.326 1.00 13.32 C ATOM 961 O ASP A 63 11.460 5.757 2.929 1.00 13.21 O ATOM 962 CB ASP A 63 10.266 5.382 5.671 1.00 60.33 C ATOM 963 CG ASP A 63 11.256 4.233 5.682 1.00 65.22 C ATOM 964 OD1 ASP A 63 12.257 4.305 4.939 1.00 42.42 O ATOM 965 OD2 ASP A 63 11.028 3.263 6.434 1.00 44.00 O ATOM 0 H ASP A 63 9.918 3.502 3.853 1.00 21.30 H new ATOM 0 HA ASP A 63 8.614 6.077 4.487 1.00 71.33 H new ATOM 0 HB2 ASP A 63 10.792 6.313 5.879 1.00 60.33 H new ATOM 0 HB3 ASP A 63 9.540 5.240 6.472 1.00 60.33 H new ATOM 969 N LEU A 64 9.948 7.424 2.913 1.00 2.02 N ATOM 970 CA LEU A 64 10.685 8.231 1.948 1.00 12.05 C ATOM 971 C LEU A 64 11.350 9.423 2.630 1.00 63.33 C ATOM 972 O LEU A 64 12.446 9.835 2.253 1.00 40.50 O ATOM 973 CB LEU A 64 9.750 8.718 0.841 1.00 42.52 C ATOM 974 CG LEU A 64 8.490 7.882 0.608 1.00 14.23 C ATOM 975 CD1 LEU A 64 7.500 8.639 -0.261 1.00 55.14 C ATOM 976 CD2 LEU A 64 8.848 6.547 -0.027 1.00 24.33 C ATOM 0 H LEU A 64 9.074 7.842 3.232 1.00 2.02 H new ATOM 0 HA LEU A 64 11.463 7.607 1.509 1.00 12.05 H new ATOM 0 HB2 LEU A 64 9.446 9.739 1.073 1.00 42.52 H new ATOM 0 HB3 LEU A 64 10.313 8.757 -0.091 1.00 42.52 H new ATOM 0 HG LEU A 64 8.021 7.690 1.573 1.00 14.23 H new ATOM 0 HD11 LEU A 64 6.610 8.028 -0.416 1.00 55.14 H new ATOM 0 HD12 LEU A 64 7.220 9.570 0.233 1.00 55.14 H new ATOM 0 HD13 LEU A 64 7.958 8.863 -1.224 1.00 55.14 H new ATOM 0 HD21 LEU A 64 7.940 5.965 -0.186 1.00 24.33 H new ATOM 0 HD22 LEU A 64 9.341 6.720 -0.984 1.00 24.33 H new ATOM 0 HD23 LEU A 64 9.520 5.999 0.633 1.00 24.33 H new ATOM 987 N GLY A 65 10.677 9.971 3.638 1.00 10.34 N ATOM 988 CA GLY A 65 11.219 11.109 4.357 1.00 32.41 C ATOM 989 C GLY A 65 11.414 12.320 3.466 1.00 73.21 C ATOM 990 O GLY A 65 12.154 13.241 3.811 1.00 14.20 O ATOM 0 H GLY A 65 9.768 9.648 3.969 1.00 10.34 H new ATOM 0 HA2 GLY A 65 10.549 11.369 5.177 1.00 32.41 H new ATOM 0 HA3 GLY A 65 12.175 10.832 4.802 1.00 32.41 H new ATOM 994 N THR A 66 10.748 12.319 2.316 1.00 14.42 N ATOM 995 CA THR A 66 10.854 13.424 1.371 1.00 31.51 C ATOM 996 C THR A 66 9.673 14.378 1.508 1.00 43.24 C ATOM 997 O THR A 66 9.784 15.564 1.196 1.00 64.53 O ATOM 998 CB THR A 66 10.924 12.917 -0.082 1.00 22.50 C ATOM 999 OG1 THR A 66 11.655 13.845 -0.891 1.00 22.54 O ATOM 1000 CG2 THR A 66 9.528 12.725 -0.656 1.00 42.21 C ATOM 0 H THR A 66 10.129 11.565 2.016 1.00 14.42 H new ATOM 0 HA THR A 66 11.776 13.955 1.607 1.00 31.51 H new ATOM 0 HB THR A 66 11.436 11.955 -0.083 1.00 22.50 H new ATOM 0 HG1 THR A 66 11.696 13.514 -1.813 1.00 22.54 H new ATOM 0 HG21 THR A 66 9.603 12.367 -1.683 1.00 42.21 H new ATOM 0 HG22 THR A 66 8.985 11.995 -0.056 1.00 42.21 H new ATOM 0 HG23 THR A 66 8.995 13.676 -0.642 1.00 42.21 H new ATOM 1008 N GLN A 67 8.545 13.853 1.975 1.00 71.14 N ATOM 1009 CA GLN A 67 7.344 14.661 2.153 1.00 43.32 C ATOM 1010 C GLN A 67 6.931 15.318 0.839 1.00 70.12 C ATOM 1011 O GLN A 67 7.017 16.536 0.690 1.00 52.22 O ATOM 1012 CB GLN A 67 7.576 15.731 3.220 1.00 72.12 C ATOM 1013 CG GLN A 67 6.328 16.528 3.565 1.00 62.42 C ATOM 1014 CD GLN A 67 6.355 17.071 4.981 1.00 41.54 C ATOM 1015 OE1 GLN A 67 7.317 17.722 5.389 1.00 40.21 O ATOM 1016 NE2 GLN A 67 5.297 16.808 5.737 1.00 22.41 N ATOM 0 H GLN A 67 8.437 12.873 2.237 1.00 71.14 H new ATOM 0 HA GLN A 67 6.539 14.002 2.479 1.00 43.32 H new ATOM 0 HB2 GLN A 67 7.954 15.254 4.124 1.00 72.12 H new ATOM 0 HB3 GLN A 67 8.350 16.416 2.873 1.00 72.12 H new ATOM 0 HG2 GLN A 67 6.225 17.356 2.864 1.00 62.42 H new ATOM 0 HG3 GLN A 67 5.450 15.894 3.440 1.00 62.42 H new ATOM 0 HE21 GLN A 67 4.522 16.264 5.358 1.00 22.41 H new ATOM 0 HE22 GLN A 67 5.259 17.149 6.697 1.00 22.41 H new ATOM 1023 N ARG A 68 6.481 14.502 -0.109 1.00 22.21 N ATOM 1024 CA ARG A 68 6.055 15.003 -1.410 1.00 14.35 C ATOM 1025 C ARG A 68 4.585 14.684 -1.661 1.00 54.20 C ATOM 1026 O ARG A 68 3.993 13.856 -0.969 1.00 14.13 O ATOM 1027 CB ARG A 68 6.917 14.398 -2.520 1.00 73.11 C ATOM 1028 CG ARG A 68 8.201 15.168 -2.783 1.00 11.21 C ATOM 1029 CD ARG A 68 7.923 16.496 -3.471 1.00 70.31 C ATOM 1030 NE ARG A 68 9.154 17.216 -3.788 1.00 21.30 N ATOM 1031 CZ ARG A 68 9.181 18.481 -4.194 1.00 61.31 C ATOM 1032 NH1 ARG A 68 8.051 19.161 -4.332 1.00 11.42 N ATOM 1033 NH2 ARG A 68 10.341 19.067 -4.464 1.00 60.51 N ATOM 0 H ARG A 68 6.402 13.491 -0.000 1.00 22.21 H new ATOM 0 HA ARG A 68 6.179 16.086 -1.413 1.00 14.35 H new ATOM 0 HB2 ARG A 68 7.167 13.371 -2.255 1.00 73.11 H new ATOM 0 HB3 ARG A 68 6.333 14.357 -3.440 1.00 73.11 H new ATOM 0 HG2 ARG A 68 8.719 15.347 -1.841 1.00 11.21 H new ATOM 0 HG3 ARG A 68 8.866 14.568 -3.404 1.00 11.21 H new ATOM 0 HD2 ARG A 68 7.360 16.319 -4.388 1.00 70.31 H new ATOM 0 HD3 ARG A 68 7.297 17.114 -2.827 1.00 70.31 H new ATOM 0 HE ARG A 68 10.041 16.721 -3.693 1.00 21.30 H new ATOM 0 HH11 ARG A 68 7.158 18.713 -4.126 1.00 11.42 H new ATOM 0 HH12 ARG A 68 8.075 20.132 -4.644 1.00 11.42 H new ATOM 0 HH21 ARG A 68 11.212 18.546 -4.360 1.00 60.51 H new ATOM 0 HH22 ARG A 68 10.362 20.038 -4.776 1.00 60.51 H new ATOM 1044 N GLN A 69 4.003 15.347 -2.656 1.00 20.23 N ATOM 1045 CA GLN A 69 2.601 15.134 -2.996 1.00 1.42 C ATOM 1046 C GLN A 69 2.450 13.976 -3.977 1.00 70.13 C ATOM 1047 O GLN A 69 2.962 14.024 -5.095 1.00 11.33 O ATOM 1048 CB GLN A 69 2.001 16.408 -3.597 1.00 32.54 C ATOM 1049 CG GLN A 69 0.699 16.173 -4.343 1.00 62.24 C ATOM 1050 CD GLN A 69 -0.195 17.398 -4.357 1.00 1.54 C ATOM 1051 OE1 GLN A 69 -0.709 17.816 -3.320 1.00 73.10 O ATOM 1052 NE2 GLN A 69 -0.384 17.980 -5.536 1.00 24.13 N ATOM 0 H GLN A 69 4.480 16.035 -3.239 1.00 20.23 H new ATOM 0 HA GLN A 69 2.064 14.884 -2.081 1.00 1.42 H new ATOM 0 HB2 GLN A 69 1.828 17.130 -2.799 1.00 32.54 H new ATOM 0 HB3 GLN A 69 2.725 16.854 -4.278 1.00 32.54 H new ATOM 0 HG2 GLN A 69 0.921 15.878 -5.369 1.00 62.24 H new ATOM 0 HG3 GLN A 69 0.165 15.343 -3.881 1.00 62.24 H new ATOM 0 HE21 GLN A 69 0.062 17.599 -6.370 1.00 24.13 H new ATOM 0 HE22 GLN A 69 -0.975 18.808 -5.607 1.00 24.13 H new ATOM 1059 N VAL A 70 1.741 12.935 -3.551 1.00 52.44 N ATOM 1060 CA VAL A 70 1.521 11.764 -4.392 1.00 11.13 C ATOM 1061 C VAL A 70 0.333 11.974 -5.324 1.00 5.41 C ATOM 1062 O VAL A 70 -0.639 12.643 -4.972 1.00 31.34 O ATOM 1063 CB VAL A 70 1.277 10.503 -3.543 1.00 23.52 C ATOM 1064 CG1 VAL A 70 2.433 10.273 -2.582 1.00 5.14 C ATOM 1065 CG2 VAL A 70 -0.039 10.614 -2.789 1.00 62.44 C ATOM 0 H VAL A 70 1.309 12.879 -2.629 1.00 52.44 H new ATOM 0 HA VAL A 70 2.425 11.624 -4.985 1.00 11.13 H new ATOM 0 HB VAL A 70 1.215 9.644 -4.211 1.00 23.52 H new ATOM 0 HG11 VAL A 70 2.242 9.377 -1.991 1.00 5.14 H new ATOM 0 HG12 VAL A 70 3.356 10.145 -3.147 1.00 5.14 H new ATOM 0 HG13 VAL A 70 2.531 11.132 -1.918 1.00 5.14 H new ATOM 0 HG21 VAL A 70 -0.195 9.714 -2.194 1.00 62.44 H new ATOM 0 HG22 VAL A 70 -0.009 11.483 -2.131 1.00 62.44 H new ATOM 0 HG23 VAL A 70 -0.858 10.725 -3.500 1.00 62.44 H new ATOM 1075 N THR A 71 0.418 11.395 -6.519 1.00 41.25 N ATOM 1076 CA THR A 71 -0.649 11.519 -7.504 1.00 4.31 C ATOM 1077 C THR A 71 -1.113 10.148 -7.987 1.00 54.44 C ATOM 1078 O THR A 71 -1.918 10.045 -8.911 1.00 60.21 O ATOM 1079 CB THR A 71 -0.199 12.353 -8.719 1.00 4.05 C ATOM 1080 OG1 THR A 71 0.970 13.110 -8.386 1.00 43.11 O ATOM 1081 CG2 THR A 71 -1.306 13.293 -9.170 1.00 62.22 C ATOM 0 H THR A 71 1.214 10.836 -6.827 1.00 41.25 H new ATOM 0 HA THR A 71 -1.477 12.028 -7.010 1.00 4.31 H new ATOM 0 HB THR A 71 0.031 11.670 -9.537 1.00 4.05 H new ATOM 0 HG1 THR A 71 1.123 13.793 -9.071 1.00 43.11 H new ATOM 0 HG21 THR A 71 -0.965 13.871 -10.029 1.00 62.22 H new ATOM 0 HG22 THR A 71 -2.185 12.712 -9.449 1.00 62.22 H new ATOM 0 HG23 THR A 71 -1.563 13.970 -8.355 1.00 62.22 H new ATOM 1089 N GLY A 72 -0.598 9.098 -7.354 1.00 55.44 N ATOM 1090 CA GLY A 72 -0.972 7.748 -7.733 1.00 54.22 C ATOM 1091 C GLY A 72 0.107 6.735 -7.408 1.00 71.23 C ATOM 1092 O GLY A 72 1.254 7.101 -7.150 1.00 33.33 O ATOM 0 H GLY A 72 0.071 9.158 -6.586 1.00 55.44 H new ATOM 0 HA2 GLY A 72 -1.892 7.471 -7.219 1.00 54.22 H new ATOM 0 HA3 GLY A 72 -1.183 7.719 -8.802 1.00 54.22 H new ATOM 1096 N ILE A 73 -0.261 5.458 -7.419 1.00 15.25 N ATOM 1097 CA ILE A 73 0.686 4.389 -7.121 1.00 44.42 C ATOM 1098 C ILE A 73 0.394 3.148 -7.958 1.00 55.33 C ATOM 1099 O ILE A 73 -0.750 2.900 -8.341 1.00 55.35 O ATOM 1100 CB ILE A 73 0.654 4.007 -5.630 1.00 55.34 C ATOM 1101 CG1 ILE A 73 -0.560 3.125 -5.333 1.00 72.43 C ATOM 1102 CG2 ILE A 73 0.632 5.258 -4.763 1.00 41.15 C ATOM 1103 CD1 ILE A 73 -1.881 3.781 -5.671 1.00 1.21 C ATOM 0 H ILE A 73 -1.206 5.138 -7.631 1.00 15.25 H new ATOM 0 HA ILE A 73 1.678 4.768 -7.369 1.00 44.42 H new ATOM 0 HB ILE A 73 1.556 3.442 -5.395 1.00 55.34 H new ATOM 0 HG12 ILE A 73 -0.470 2.196 -5.896 1.00 72.43 H new ATOM 0 HG13 ILE A 73 -0.556 2.859 -4.276 1.00 72.43 H new ATOM 0 HG21 ILE A 73 0.609 4.972 -3.712 1.00 41.15 H new ATOM 0 HG22 ILE A 73 1.525 5.852 -4.958 1.00 41.15 H new ATOM 0 HG23 ILE A 73 -0.254 5.848 -4.997 1.00 41.15 H new ATOM 0 HD11 ILE A 73 -2.697 3.098 -5.435 1.00 1.21 H new ATOM 0 HD12 ILE A 73 -1.993 4.696 -5.089 1.00 1.21 H new ATOM 0 HD13 ILE A 73 -1.906 4.022 -6.734 1.00 1.21 H new ATOM 1114 N ILE A 74 1.435 2.371 -8.238 1.00 73.55 N ATOM 1115 CA ILE A 74 1.289 1.154 -9.027 1.00 54.24 C ATOM 1116 C ILE A 74 1.980 -0.025 -8.350 1.00 62.12 C ATOM 1117 O ILE A 74 3.072 0.114 -7.797 1.00 71.43 O ATOM 1118 CB ILE A 74 1.866 1.330 -10.443 1.00 4.42 C ATOM 1119 CG1 ILE A 74 1.290 0.271 -11.386 1.00 2.52 C ATOM 1120 CG2 ILE A 74 3.386 1.248 -10.410 1.00 62.35 C ATOM 1121 CD1 ILE A 74 0.175 0.788 -12.267 1.00 54.24 C ATOM 0 H ILE A 74 2.388 2.563 -7.930 1.00 73.55 H new ATOM 0 HA ILE A 74 0.221 0.951 -9.102 1.00 54.24 H new ATOM 0 HB ILE A 74 1.583 2.315 -10.816 1.00 4.42 H new ATOM 0 HG12 ILE A 74 2.090 -0.116 -12.017 1.00 2.52 H new ATOM 0 HG13 ILE A 74 0.917 -0.566 -10.795 1.00 2.52 H new ATOM 0 HG21 ILE A 74 3.779 1.374 -11.419 1.00 62.35 H new ATOM 0 HG22 ILE A 74 3.779 2.035 -9.766 1.00 62.35 H new ATOM 0 HG23 ILE A 74 3.690 0.276 -10.021 1.00 62.35 H new ATOM 0 HD11 ILE A 74 -0.185 -0.017 -12.909 1.00 54.24 H new ATOM 0 HD12 ILE A 74 -0.643 1.149 -11.644 1.00 54.24 H new ATOM 0 HD13 ILE A 74 0.548 1.605 -12.884 1.00 54.24 H new ATOM 1132 N THR A 75 1.338 -1.188 -8.400 1.00 51.22 N ATOM 1133 CA THR A 75 1.890 -2.392 -7.794 1.00 25.03 C ATOM 1134 C THR A 75 1.912 -3.548 -8.788 1.00 20.34 C ATOM 1135 O THR A 75 1.092 -3.606 -9.703 1.00 62.15 O ATOM 1136 CB THR A 75 1.085 -2.816 -6.550 1.00 40.54 C ATOM 1137 OG1 THR A 75 1.908 -3.597 -5.677 1.00 73.33 O ATOM 1138 CG2 THR A 75 -0.144 -3.617 -6.949 1.00 63.55 C ATOM 0 H THR A 75 0.435 -1.321 -8.854 1.00 51.22 H new ATOM 0 HA THR A 75 2.911 -2.154 -7.494 1.00 25.03 H new ATOM 0 HB THR A 75 0.759 -1.915 -6.030 1.00 40.54 H new ATOM 0 HG1 THR A 75 2.824 -3.620 -6.025 1.00 73.33 H new ATOM 0 HG21 THR A 75 -0.696 -3.905 -6.055 1.00 63.55 H new ATOM 0 HG22 THR A 75 -0.783 -3.009 -7.590 1.00 63.55 H new ATOM 0 HG23 THR A 75 0.165 -4.512 -7.489 1.00 63.55 H new ATOM 1146 N GLN A 76 2.855 -4.466 -8.600 1.00 63.04 N ATOM 1147 CA GLN A 76 2.982 -5.620 -9.481 1.00 3.52 C ATOM 1148 C GLN A 76 3.356 -6.870 -8.691 1.00 3.35 C ATOM 1149 O GLN A 76 4.175 -6.815 -7.774 1.00 41.33 O ATOM 1150 CB GLN A 76 4.033 -5.351 -10.560 1.00 4.21 C ATOM 1151 CG GLN A 76 3.708 -4.156 -11.441 1.00 54.02 C ATOM 1152 CD GLN A 76 4.007 -2.833 -10.763 1.00 65.44 C ATOM 1153 OE1 GLN A 76 3.171 -1.929 -10.745 1.00 51.00 O ATOM 1154 NE2 GLN A 76 5.203 -2.713 -10.200 1.00 72.01 N ATOM 0 H GLN A 76 3.541 -4.433 -7.846 1.00 63.04 H new ATOM 0 HA GLN A 76 2.017 -5.789 -9.958 1.00 3.52 H new ATOM 0 HB2 GLN A 76 4.999 -5.187 -10.082 1.00 4.21 H new ATOM 0 HB3 GLN A 76 4.133 -6.237 -11.187 1.00 4.21 H new ATOM 0 HG2 GLN A 76 4.282 -4.224 -12.365 1.00 54.02 H new ATOM 0 HG3 GLN A 76 2.654 -4.189 -11.717 1.00 54.02 H new ATOM 0 HE21 GLN A 76 5.865 -3.488 -10.239 1.00 72.01 H new ATOM 0 HE22 GLN A 76 5.460 -1.846 -9.728 1.00 72.01 H new ATOM 1161 N GLY A 77 2.751 -7.997 -9.054 1.00 73.52 N ATOM 1162 CA GLY A 77 3.032 -9.245 -8.367 1.00 52.10 C ATOM 1163 C GLY A 77 4.293 -9.915 -8.877 1.00 54.43 C ATOM 1164 O GLY A 77 4.851 -9.507 -9.895 1.00 15.44 O ATOM 0 H GLY A 77 2.071 -8.068 -9.811 1.00 73.52 H new ATOM 0 HA2 GLY A 77 3.132 -9.054 -7.299 1.00 52.10 H new ATOM 0 HA3 GLY A 77 2.188 -9.923 -8.492 1.00 52.10 H new ATOM 1168 N ALA A 78 4.743 -10.943 -8.167 1.00 61.51 N ATOM 1169 CA ALA A 78 5.946 -11.671 -8.554 1.00 71.45 C ATOM 1170 C ALA A 78 5.645 -13.150 -8.772 1.00 10.25 C ATOM 1171 O ALA A 78 4.872 -13.753 -8.027 1.00 51.13 O ATOM 1172 CB ALA A 78 7.028 -11.500 -7.500 1.00 34.51 C ATOM 0 H ALA A 78 4.293 -11.291 -7.320 1.00 61.51 H new ATOM 0 HA ALA A 78 6.305 -11.257 -9.496 1.00 71.45 H new ATOM 0 HB1 ALA A 78 7.920 -12.049 -7.802 1.00 34.51 H new ATOM 0 HB2 ALA A 78 7.270 -10.442 -7.396 1.00 34.51 H new ATOM 0 HB3 ALA A 78 6.670 -11.886 -6.545 1.00 34.51 H new ATOM 1178 N ARG A 79 6.263 -13.730 -9.795 1.00 44.11 N ATOM 1179 CA ARG A 79 6.061 -15.138 -10.112 1.00 24.15 C ATOM 1180 C ARG A 79 7.388 -15.892 -10.110 1.00 45.22 C ATOM 1181 O ARG A 79 8.432 -15.330 -10.438 1.00 12.32 O ATOM 1182 CB ARG A 79 5.380 -15.285 -11.474 1.00 12.43 C ATOM 1183 CG ARG A 79 6.287 -14.950 -12.647 1.00 11.20 C ATOM 1184 CD ARG A 79 5.612 -15.248 -13.977 1.00 24.53 C ATOM 1185 NE ARG A 79 6.528 -15.092 -15.103 1.00 20.41 N ATOM 1186 CZ ARG A 79 6.141 -15.120 -16.374 1.00 13.32 C ATOM 1187 NH1 ARG A 79 4.863 -15.296 -16.678 1.00 62.42 N ATOM 1188 NH2 ARG A 79 7.035 -14.970 -17.344 1.00 34.13 N ATOM 0 H ARG A 79 6.908 -13.246 -10.419 1.00 44.11 H new ATOM 0 HA ARG A 79 5.417 -15.568 -9.344 1.00 24.15 H new ATOM 0 HB2 ARG A 79 5.022 -16.309 -11.583 1.00 12.43 H new ATOM 0 HB3 ARG A 79 4.505 -14.636 -11.505 1.00 12.43 H new ATOM 0 HG2 ARG A 79 6.562 -13.896 -12.606 1.00 11.20 H new ATOM 0 HG3 ARG A 79 7.210 -15.524 -12.570 1.00 11.20 H new ATOM 0 HD2 ARG A 79 5.222 -16.266 -13.965 1.00 24.53 H new ATOM 0 HD3 ARG A 79 4.760 -14.581 -14.108 1.00 24.53 H new ATOM 0 HE ARG A 79 7.519 -14.954 -14.903 1.00 20.41 H new ATOM 0 HH11 ARG A 79 4.173 -15.410 -15.935 1.00 62.42 H new ATOM 0 HH12 ARG A 79 4.569 -15.317 -17.655 1.00 62.42 H new ATOM 0 HH21 ARG A 79 8.019 -14.833 -17.114 1.00 34.13 H new ATOM 0 HH22 ARG A 79 6.738 -14.992 -18.319 1.00 34.13 H new ATOM 1199 N ASP A 80 7.337 -17.167 -9.740 1.00 11.50 N ATOM 1200 CA ASP A 80 8.535 -17.999 -9.697 1.00 52.32 C ATOM 1201 C ASP A 80 8.460 -19.114 -10.735 1.00 20.34 C ATOM 1202 O ASP A 80 8.886 -20.241 -10.482 1.00 35.42 O ATOM 1203 CB ASP A 80 8.717 -18.595 -8.300 1.00 1.41 C ATOM 1204 CG ASP A 80 9.253 -17.586 -7.305 1.00 52.35 C ATOM 1205 OD1 ASP A 80 9.130 -16.370 -7.567 1.00 2.42 O ATOM 1206 OD2 ASP A 80 9.793 -18.010 -6.263 1.00 71.43 O ATOM 0 H ASP A 80 6.480 -17.647 -9.466 1.00 11.50 H new ATOM 0 HA ASP A 80 9.394 -17.370 -9.929 1.00 52.32 H new ATOM 0 HB2 ASP A 80 7.761 -18.978 -7.945 1.00 1.41 H new ATOM 0 HB3 ASP A 80 9.399 -19.443 -8.356 1.00 1.41 H new ATOM 1210 N PHE A 81 7.914 -18.793 -11.903 1.00 50.34 N ATOM 1211 CA PHE A 81 7.780 -19.769 -12.978 1.00 2.11 C ATOM 1212 C PHE A 81 6.836 -20.897 -12.575 1.00 23.32 C ATOM 1213 O PHE A 81 7.249 -21.874 -11.953 1.00 25.13 O ATOM 1214 CB PHE A 81 9.151 -20.342 -13.348 1.00 62.34 C ATOM 1215 CG PHE A 81 10.214 -19.295 -13.512 1.00 32.01 C ATOM 1216 CD1 PHE A 81 10.295 -18.546 -14.675 1.00 23.11 C ATOM 1217 CD2 PHE A 81 11.133 -19.058 -12.502 1.00 53.24 C ATOM 1218 CE1 PHE A 81 11.273 -17.583 -14.829 1.00 12.13 C ATOM 1219 CE2 PHE A 81 12.114 -18.095 -12.650 1.00 61.43 C ATOM 1220 CZ PHE A 81 12.183 -17.356 -13.815 1.00 32.23 C ATOM 0 H PHE A 81 7.557 -17.865 -12.129 1.00 50.34 H new ATOM 0 HA PHE A 81 7.359 -19.261 -13.846 1.00 2.11 H new ATOM 0 HB2 PHE A 81 9.462 -21.046 -12.576 1.00 62.34 H new ATOM 0 HB3 PHE A 81 9.062 -20.906 -14.276 1.00 62.34 H new ATOM 0 HD1 PHE A 81 9.585 -18.717 -15.471 1.00 23.11 H new ATOM 0 HD2 PHE A 81 11.082 -19.632 -11.589 1.00 53.24 H new ATOM 0 HE1 PHE A 81 11.326 -17.008 -15.742 1.00 12.13 H new ATOM 0 HE2 PHE A 81 12.825 -17.921 -11.856 1.00 61.43 H new ATOM 0 HZ PHE A 81 12.947 -16.602 -13.933 1.00 32.23 H new ATOM 1229 N GLY A 82 5.564 -20.754 -12.935 1.00 52.11 N ATOM 1230 CA GLY A 82 4.580 -21.767 -12.602 1.00 71.12 C ATOM 1231 C GLY A 82 3.901 -21.502 -11.273 1.00 14.33 C ATOM 1232 O GLY A 82 2.686 -21.649 -11.148 1.00 73.54 O ATOM 0 H GLY A 82 5.198 -19.954 -13.451 1.00 52.11 H new ATOM 0 HA2 GLY A 82 3.827 -21.810 -13.389 1.00 71.12 H new ATOM 0 HA3 GLY A 82 5.064 -22.743 -12.571 1.00 71.12 H new ATOM 1236 N HIS A 83 4.689 -21.111 -10.275 1.00 61.10 N ATOM 1237 CA HIS A 83 4.157 -20.826 -8.947 1.00 44.50 C ATOM 1238 C HIS A 83 3.859 -19.339 -8.789 1.00 52.45 C ATOM 1239 O HIS A 83 4.075 -18.761 -7.723 1.00 25.10 O ATOM 1240 CB HIS A 83 5.145 -21.278 -7.871 1.00 54.55 C ATOM 1241 CG HIS A 83 4.486 -21.716 -6.599 1.00 52.24 C ATOM 1242 ND1 HIS A 83 4.024 -23.000 -6.395 1.00 74.04 N ATOM 1243 CD2 HIS A 83 4.213 -21.034 -5.462 1.00 43.40 C ATOM 1244 CE1 HIS A 83 3.495 -23.087 -5.187 1.00 65.12 C ATOM 1245 NE2 HIS A 83 3.598 -21.908 -4.602 1.00 34.55 N ATOM 0 H HIS A 83 5.697 -20.985 -10.361 1.00 61.10 H new ATOM 0 HA HIS A 83 3.225 -21.379 -8.829 1.00 44.50 H new ATOM 0 HB2 HIS A 83 5.744 -22.100 -8.262 1.00 54.55 H new ATOM 0 HB3 HIS A 83 5.831 -20.460 -7.652 1.00 54.55 H new ATOM 0 HD2 HIS A 83 4.438 -19.996 -5.268 1.00 43.40 H new ATOM 0 HE1 HIS A 83 3.054 -23.972 -4.752 1.00 65.12 H new ATOM 0 HE2 HIS A 83 3.273 -21.683 -3.662 1.00 34.55 H new ATOM 1252 N ILE A 84 3.363 -18.722 -9.858 1.00 1.45 N ATOM 1253 CA ILE A 84 3.035 -17.302 -9.837 1.00 12.53 C ATOM 1254 C ILE A 84 2.376 -16.910 -8.520 1.00 52.14 C ATOM 1255 O ILE A 84 1.431 -17.558 -8.072 1.00 73.22 O ATOM 1256 CB ILE A 84 2.101 -16.923 -11.000 1.00 21.00 C ATOM 1257 CG1 ILE A 84 2.751 -17.272 -12.341 1.00 24.35 C ATOM 1258 CG2 ILE A 84 1.757 -15.442 -10.943 1.00 15.43 C ATOM 1259 CD1 ILE A 84 1.909 -18.189 -13.200 1.00 61.55 C ATOM 0 H ILE A 84 3.180 -19.184 -10.749 1.00 1.45 H new ATOM 0 HA ILE A 84 3.974 -16.759 -9.946 1.00 12.53 H new ATOM 0 HB ILE A 84 1.178 -17.495 -10.905 1.00 21.00 H new ATOM 0 HG12 ILE A 84 2.948 -16.352 -12.891 1.00 24.35 H new ATOM 0 HG13 ILE A 84 3.715 -17.745 -12.156 1.00 24.35 H new ATOM 0 HG21 ILE A 84 1.096 -15.190 -11.772 1.00 15.43 H new ATOM 0 HG22 ILE A 84 1.257 -15.221 -10.000 1.00 15.43 H new ATOM 0 HG23 ILE A 84 2.671 -14.853 -11.016 1.00 15.43 H new ATOM 0 HD11 ILE A 84 2.432 -18.394 -14.134 1.00 61.55 H new ATOM 0 HD12 ILE A 84 1.734 -19.125 -12.670 1.00 61.55 H new ATOM 0 HD13 ILE A 84 0.954 -17.710 -13.416 1.00 61.55 H new ATOM 1270 N GLN A 85 2.879 -15.843 -7.907 1.00 22.21 N ATOM 1271 CA GLN A 85 2.337 -15.363 -6.641 1.00 22.11 C ATOM 1272 C GLN A 85 1.908 -13.905 -6.751 1.00 51.14 C ATOM 1273 O GLN A 85 2.416 -13.159 -7.589 1.00 70.11 O ATOM 1274 CB GLN A 85 3.372 -15.520 -5.526 1.00 1.42 C ATOM 1275 CG GLN A 85 3.835 -16.954 -5.322 1.00 62.22 C ATOM 1276 CD GLN A 85 5.299 -17.150 -5.665 1.00 65.23 C ATOM 1277 OE1 GLN A 85 5.722 -16.591 -6.793 1.00 60.41 O flip ATOM 1278 NE2 GLN A 85 6.040 -17.796 -4.925 1.00 22.21 N flip ATOM 0 H GLN A 85 3.661 -15.295 -8.266 1.00 22.21 H new ATOM 0 HA GLN A 85 1.460 -15.963 -6.399 1.00 22.11 H new ATOM 0 HB2 GLN A 85 4.237 -14.897 -5.754 1.00 1.42 H new ATOM 0 HB3 GLN A 85 2.948 -15.148 -4.593 1.00 1.42 H new ATOM 0 HG2 GLN A 85 3.667 -17.241 -4.284 1.00 62.22 H new ATOM 0 HG3 GLN A 85 3.229 -17.618 -5.938 1.00 62.22 H new ATOM 0 HE21 GLN A 85 5.672 -18.208 -4.068 1.00 22.21 H new ATOM 0 HE22 GLN A 85 7.023 -17.920 -5.169 1.00 22.21 H new ATOM 1285 N TYR A 86 0.969 -13.503 -5.901 1.00 74.20 N ATOM 1286 CA TYR A 86 0.469 -12.134 -5.904 1.00 33.01 C ATOM 1287 C TYR A 86 -0.600 -11.942 -4.833 1.00 52.04 C ATOM 1288 O TYR A 86 -1.412 -12.833 -4.583 1.00 74.10 O ATOM 1289 CB TYR A 86 -0.100 -11.780 -7.279 1.00 14.23 C ATOM 1290 CG TYR A 86 -1.060 -12.814 -7.821 1.00 4.13 C ATOM 1291 CD1 TYR A 86 -2.363 -12.896 -7.349 1.00 41.14 C ATOM 1292 CD2 TYR A 86 -0.663 -13.710 -8.807 1.00 14.32 C ATOM 1293 CE1 TYR A 86 -3.244 -13.840 -7.842 1.00 32.51 C ATOM 1294 CE2 TYR A 86 -1.536 -14.657 -9.306 1.00 53.22 C ATOM 1295 CZ TYR A 86 -2.826 -14.718 -8.820 1.00 1.43 C ATOM 1296 OH TYR A 86 -3.699 -15.659 -9.314 1.00 60.53 O ATOM 0 H TYR A 86 0.539 -14.107 -5.201 1.00 74.20 H new ATOM 0 HA TYR A 86 1.303 -11.469 -5.681 1.00 33.01 H new ATOM 0 HB2 TYR A 86 -0.612 -10.820 -7.215 1.00 14.23 H new ATOM 0 HB3 TYR A 86 0.723 -11.656 -7.983 1.00 14.23 H new ATOM 0 HD1 TYR A 86 -2.694 -12.210 -6.583 1.00 41.14 H new ATOM 0 HD2 TYR A 86 0.346 -13.665 -9.190 1.00 14.32 H new ATOM 0 HE1 TYR A 86 -4.254 -13.890 -7.463 1.00 32.51 H new ATOM 0 HE2 TYR A 86 -1.211 -15.346 -10.072 1.00 53.22 H new ATOM 0 HH TYR A 86 -3.962 -16.270 -8.595 1.00 60.53 H new ATOM 1305 N VAL A 87 -0.596 -10.770 -4.205 1.00 2.33 N ATOM 1306 CA VAL A 87 -1.566 -10.458 -3.163 1.00 20.23 C ATOM 1307 C VAL A 87 -2.830 -9.843 -3.753 1.00 3.31 C ATOM 1308 O VAL A 87 -2.816 -9.324 -4.869 1.00 2.22 O ATOM 1309 CB VAL A 87 -0.977 -9.489 -2.119 1.00 44.20 C ATOM 1310 CG1 VAL A 87 -1.828 -9.479 -0.859 1.00 61.15 C ATOM 1311 CG2 VAL A 87 0.462 -9.865 -1.797 1.00 54.44 C ATOM 0 H VAL A 87 0.069 -10.021 -4.400 1.00 2.33 H new ATOM 0 HA VAL A 87 -1.818 -11.399 -2.674 1.00 20.23 H new ATOM 0 HB VAL A 87 -0.981 -8.483 -2.539 1.00 44.20 H new ATOM 0 HG11 VAL A 87 -1.396 -8.789 -0.134 1.00 61.15 H new ATOM 0 HG12 VAL A 87 -2.840 -9.159 -1.106 1.00 61.15 H new ATOM 0 HG13 VAL A 87 -1.858 -10.482 -0.432 1.00 61.15 H new ATOM 0 HG21 VAL A 87 0.863 -9.171 -1.058 1.00 54.44 H new ATOM 0 HG22 VAL A 87 0.492 -10.878 -1.397 1.00 54.44 H new ATOM 0 HG23 VAL A 87 1.063 -9.815 -2.705 1.00 54.44 H new ATOM 1321 N ALA A 88 -3.921 -9.906 -2.998 1.00 42.10 N ATOM 1322 CA ALA A 88 -5.193 -9.354 -3.446 1.00 43.32 C ATOM 1323 C ALA A 88 -5.729 -8.331 -2.449 1.00 43.54 C ATOM 1324 O ALA A 88 -5.613 -7.124 -2.662 1.00 13.25 O ATOM 1325 CB ALA A 88 -6.207 -10.468 -3.658 1.00 33.13 C ATOM 0 H ALA A 88 -3.950 -10.334 -2.073 1.00 42.10 H new ATOM 0 HA ALA A 88 -5.026 -8.845 -4.395 1.00 43.32 H new ATOM 0 HB1 ALA A 88 -7.152 -10.041 -3.993 1.00 33.13 H new ATOM 0 HB2 ALA A 88 -5.834 -11.160 -4.413 1.00 33.13 H new ATOM 0 HB3 ALA A 88 -6.362 -11.002 -2.721 1.00 33.13 H new ATOM 1331 N SER A 89 -6.317 -8.821 -1.363 1.00 61.01 N ATOM 1332 CA SER A 89 -6.874 -7.949 -0.336 1.00 50.04 C ATOM 1333 C SER A 89 -5.775 -7.407 0.571 1.00 54.13 C ATOM 1334 O SER A 89 -5.121 -8.161 1.292 1.00 52.42 O ATOM 1335 CB SER A 89 -7.912 -8.705 0.496 1.00 50.32 C ATOM 1336 OG SER A 89 -8.941 -7.837 0.937 1.00 63.41 O ATOM 0 H SER A 89 -6.420 -9.818 -1.171 1.00 61.01 H new ATOM 0 HA SER A 89 -7.359 -7.108 -0.832 1.00 50.04 H new ATOM 0 HB2 SER A 89 -8.342 -9.511 -0.098 1.00 50.32 H new ATOM 0 HB3 SER A 89 -7.427 -9.166 1.356 1.00 50.32 H new ATOM 0 HG SER A 89 -9.593 -8.344 1.465 1.00 63.41 H new ATOM 1341 N TYR A 90 -5.578 -6.093 0.530 1.00 0.01 N ATOM 1342 CA TYR A 90 -4.556 -5.448 1.346 1.00 71.10 C ATOM 1343 C TYR A 90 -4.926 -3.996 1.635 1.00 21.43 C ATOM 1344 O TYR A 90 -5.527 -3.318 0.802 1.00 43.11 O ATOM 1345 CB TYR A 90 -3.199 -5.509 0.645 1.00 4.40 C ATOM 1346 CG TYR A 90 -3.206 -4.906 -0.741 1.00 43.34 C ATOM 1347 CD1 TYR A 90 -3.169 -3.529 -0.921 1.00 43.23 C ATOM 1348 CD2 TYR A 90 -3.248 -5.713 -1.872 1.00 12.11 C ATOM 1349 CE1 TYR A 90 -3.177 -2.973 -2.186 1.00 41.21 C ATOM 1350 CE2 TYR A 90 -3.254 -5.165 -3.140 1.00 4.12 C ATOM 1351 CZ TYR A 90 -3.219 -3.795 -3.293 1.00 32.32 C ATOM 1352 OH TYR A 90 -3.225 -3.245 -4.554 1.00 21.44 O ATOM 0 H TYR A 90 -6.112 -5.455 -0.059 1.00 0.01 H new ATOM 0 HA TYR A 90 -4.493 -5.984 2.293 1.00 71.10 H new ATOM 0 HB2 TYR A 90 -2.461 -4.988 1.255 1.00 4.40 H new ATOM 0 HB3 TYR A 90 -2.881 -6.549 0.578 1.00 4.40 H new ATOM 0 HD1 TYR A 90 -3.133 -2.882 -0.057 1.00 43.23 H new ATOM 0 HD2 TYR A 90 -3.276 -6.787 -1.757 1.00 12.11 H new ATOM 0 HE1 TYR A 90 -3.151 -1.900 -2.307 1.00 41.21 H new ATOM 0 HE2 TYR A 90 -3.286 -5.807 -4.008 1.00 4.12 H new ATOM 0 HH TYR A 90 -3.255 -3.961 -5.223 1.00 21.44 H new ATOM 1361 N LYS A 91 -4.562 -3.525 2.824 1.00 23.14 N ATOM 1362 CA LYS A 91 -4.853 -2.154 3.225 1.00 25.44 C ATOM 1363 C LYS A 91 -3.599 -1.288 3.149 1.00 71.51 C ATOM 1364 O LYS A 91 -2.772 -1.294 4.061 1.00 41.05 O ATOM 1365 CB LYS A 91 -5.419 -2.127 4.647 1.00 43.22 C ATOM 1366 CG LYS A 91 -6.757 -1.415 4.755 1.00 64.14 C ATOM 1367 CD LYS A 91 -6.593 0.008 5.261 1.00 22.33 C ATOM 1368 CE LYS A 91 -6.593 0.062 6.781 1.00 21.51 C ATOM 1369 NZ LYS A 91 -5.244 -0.218 7.346 1.00 33.41 N ATOM 0 H LYS A 91 -4.065 -4.073 3.526 1.00 23.14 H new ATOM 0 HA LYS A 91 -5.595 -1.749 2.537 1.00 25.44 H new ATOM 0 HB2 LYS A 91 -5.532 -3.151 5.004 1.00 43.22 H new ATOM 0 HB3 LYS A 91 -4.702 -1.637 5.305 1.00 43.22 H new ATOM 0 HG2 LYS A 91 -7.242 -1.401 3.779 1.00 64.14 H new ATOM 0 HG3 LYS A 91 -7.411 -1.968 5.429 1.00 64.14 H new ATOM 0 HD2 LYS A 91 -5.661 0.425 4.881 1.00 22.33 H new ATOM 0 HD3 LYS A 91 -7.401 0.629 4.874 1.00 22.33 H new ATOM 0 HE2 LYS A 91 -6.927 1.046 7.109 1.00 21.51 H new ATOM 0 HE3 LYS A 91 -7.307 -0.663 7.170 1.00 21.51 H new ATOM 0 HZ1 LYS A 91 -5.175 0.193 8.299 1.00 33.41 H new ATOM 0 HZ2 LYS A 91 -5.097 -1.246 7.401 1.00 33.41 H new ATOM 0 HZ3 LYS A 91 -4.517 0.203 6.733 1.00 33.41 H new ATOM 1379 N VAL A 92 -3.467 -0.542 2.057 1.00 4.35 N ATOM 1380 CA VAL A 92 -2.315 0.331 1.863 1.00 71.53 C ATOM 1381 C VAL A 92 -2.719 1.799 1.948 1.00 33.42 C ATOM 1382 O VAL A 92 -3.469 2.297 1.109 1.00 5.24 O ATOM 1383 CB VAL A 92 -1.638 0.075 0.503 1.00 23.35 C ATOM 1384 CG1 VAL A 92 -2.677 0.001 -0.605 1.00 51.42 C ATOM 1385 CG2 VAL A 92 -0.608 1.155 0.209 1.00 32.53 C ATOM 0 H VAL A 92 -4.143 -0.525 1.293 1.00 4.35 H new ATOM 0 HA VAL A 92 -1.608 0.104 2.661 1.00 71.53 H new ATOM 0 HB VAL A 92 -1.122 -0.884 0.548 1.00 23.35 H new ATOM 0 HG11 VAL A 92 -2.180 -0.180 -1.558 1.00 51.42 H new ATOM 0 HG12 VAL A 92 -3.373 -0.812 -0.398 1.00 51.42 H new ATOM 0 HG13 VAL A 92 -3.224 0.943 -0.654 1.00 51.42 H new ATOM 0 HG21 VAL A 92 -0.140 0.958 -0.755 1.00 32.53 H new ATOM 0 HG22 VAL A 92 -1.099 2.128 0.182 1.00 32.53 H new ATOM 0 HG23 VAL A 92 0.153 1.154 0.989 1.00 32.53 H new ATOM 1395 N ALA A 93 -2.217 2.487 2.969 1.00 3.41 N ATOM 1396 CA ALA A 93 -2.523 3.899 3.162 1.00 20.13 C ATOM 1397 C ALA A 93 -1.247 4.733 3.227 1.00 23.40 C ATOM 1398 O ALA A 93 -0.189 4.236 3.611 1.00 13.35 O ATOM 1399 CB ALA A 93 -3.347 4.091 4.426 1.00 31.31 C ATOM 0 H ALA A 93 -1.597 2.089 3.675 1.00 3.41 H new ATOM 0 HA ALA A 93 -3.105 4.241 2.306 1.00 20.13 H new ATOM 0 HB1 ALA A 93 -3.569 5.150 4.558 1.00 31.31 H new ATOM 0 HB2 ALA A 93 -4.279 3.533 4.341 1.00 31.31 H new ATOM 0 HB3 ALA A 93 -2.784 3.728 5.286 1.00 31.31 H new ATOM 1405 N HIS A 94 -1.357 6.002 2.850 1.00 53.33 N ATOM 1406 CA HIS A 94 -0.212 6.906 2.865 1.00 13.03 C ATOM 1407 C HIS A 94 -0.363 7.955 3.963 1.00 32.04 C ATOM 1408 O HIS A 94 -1.450 8.490 4.179 1.00 0.43 O ATOM 1409 CB HIS A 94 -0.057 7.590 1.508 1.00 74.05 C ATOM 1410 CG HIS A 94 0.282 6.646 0.396 1.00 14.20 C ATOM 1411 ND1 HIS A 94 -0.153 5.391 0.136 1.00 4.03 N flip ATOM 1412 CD2 HIS A 94 1.173 6.958 -0.610 1.00 54.22 C flip ATOM 1413 CE1 HIS A 94 0.474 4.973 -1.012 1.00 3.44 C flip ATOM 1414 NE2 HIS A 94 1.269 5.936 -1.441 1.00 21.25 N flip ATOM 0 H HIS A 94 -2.227 6.428 2.530 1.00 53.33 H new ATOM 0 HA HIS A 94 0.682 6.317 3.070 1.00 13.03 H new ATOM 0 HB2 HIS A 94 -0.984 8.108 1.264 1.00 74.05 H new ATOM 0 HB3 HIS A 94 0.722 8.349 1.580 1.00 74.05 H new ATOM 0 HD2 HIS A 94 1.708 7.891 -0.703 1.00 54.22 H new ATOM 0 HE1 HIS A 94 0.339 4.012 -1.487 1.00 3.44 H new ATOM 0 HE2 HIS A 94 1.858 5.897 -2.273 1.00 21.25 H new ATOM 1421 N SER A 95 0.736 8.243 4.655 1.00 4.00 N ATOM 1422 CA SER A 95 0.724 9.224 5.734 1.00 43.30 C ATOM 1423 C SER A 95 1.830 10.257 5.540 1.00 50.43 C ATOM 1424 O SER A 95 2.946 9.922 5.142 1.00 70.04 O ATOM 1425 CB SER A 95 0.893 8.529 7.086 1.00 44.20 C ATOM 1426 OG SER A 95 0.128 7.337 7.146 1.00 51.04 O ATOM 0 H SER A 95 1.645 7.811 4.487 1.00 4.00 H new ATOM 0 HA SER A 95 -0.238 9.737 5.715 1.00 43.30 H new ATOM 0 HB2 SER A 95 1.945 8.298 7.251 1.00 44.20 H new ATOM 0 HB3 SER A 95 0.586 9.203 7.886 1.00 44.20 H new ATOM 0 HG SER A 95 0.291 6.886 8.001 1.00 51.04 H new ATOM 1431 N ASP A 96 1.510 11.515 5.823 1.00 12.51 N ATOM 1432 CA ASP A 96 2.476 12.599 5.681 1.00 41.03 C ATOM 1433 C ASP A 96 3.066 12.983 7.035 1.00 44.40 C ATOM 1434 O ASP A 96 4.284 13.076 7.188 1.00 53.21 O ATOM 1435 CB ASP A 96 1.815 13.818 5.035 1.00 63.12 C ATOM 1436 CG ASP A 96 2.827 14.792 4.463 1.00 24.43 C ATOM 1437 OD1 ASP A 96 3.872 14.332 3.955 1.00 64.23 O ATOM 1438 OD2 ASP A 96 2.576 16.013 4.524 1.00 71.22 O ATOM 0 H ASP A 96 0.590 11.809 6.152 1.00 12.51 H new ATOM 0 HA ASP A 96 3.284 12.250 5.039 1.00 41.03 H new ATOM 0 HB2 ASP A 96 1.146 13.486 4.241 1.00 63.12 H new ATOM 0 HB3 ASP A 96 1.201 14.330 5.776 1.00 63.12 H new ATOM 1442 N ASP A 97 2.194 13.204 8.012 1.00 31.11 N ATOM 1443 CA ASP A 97 2.629 13.578 9.353 1.00 21.21 C ATOM 1444 C ASP A 97 2.683 12.357 10.266 1.00 72.25 C ATOM 1445 O ASP A 97 3.223 12.419 11.370 1.00 24.52 O ATOM 1446 CB ASP A 97 1.688 14.630 9.943 1.00 50.32 C ATOM 1447 CG ASP A 97 1.483 15.810 9.012 1.00 25.22 C ATOM 1448 OD1 ASP A 97 0.559 15.750 8.174 1.00 64.41 O ATOM 1449 OD2 ASP A 97 2.247 16.791 9.121 1.00 73.13 O ATOM 0 H ASP A 97 1.183 13.131 7.901 1.00 31.11 H new ATOM 0 HA ASP A 97 3.631 13.999 9.279 1.00 21.21 H new ATOM 0 HB2 ASP A 97 0.724 14.170 10.160 1.00 50.32 H new ATOM 0 HB3 ASP A 97 2.093 14.985 10.891 1.00 50.32 H new ATOM 1453 N GLY A 98 2.117 11.248 9.799 1.00 44.44 N ATOM 1454 CA GLY A 98 2.110 10.029 10.586 1.00 13.33 C ATOM 1455 C GLY A 98 0.785 9.797 11.284 1.00 13.02 C ATOM 1456 O GLY A 98 0.508 8.694 11.754 1.00 61.13 O ATOM 0 H GLY A 98 1.663 11.172 8.889 1.00 44.44 H new ATOM 0 HA2 GLY A 98 2.329 9.181 9.938 1.00 13.33 H new ATOM 0 HA3 GLY A 98 2.906 10.076 11.330 1.00 13.33 H new ATOM 1460 N VAL A 99 -0.035 10.841 11.355 1.00 1.25 N ATOM 1461 CA VAL A 99 -1.338 10.746 12.002 1.00 31.13 C ATOM 1462 C VAL A 99 -2.453 10.589 10.974 1.00 30.14 C ATOM 1463 O VAL A 99 -3.446 9.907 11.222 1.00 52.55 O ATOM 1464 CB VAL A 99 -1.625 11.987 12.870 1.00 44.33 C ATOM 1465 CG1 VAL A 99 -0.587 12.120 13.972 1.00 12.11 C ATOM 1466 CG2 VAL A 99 -1.666 13.240 12.008 1.00 14.53 C ATOM 0 H VAL A 99 0.180 11.762 10.973 1.00 1.25 H new ATOM 0 HA VAL A 99 -1.311 9.863 12.641 1.00 31.13 H new ATOM 0 HB VAL A 99 -2.601 11.864 13.339 1.00 44.33 H new ATOM 0 HG11 VAL A 99 -0.806 13.002 14.574 1.00 12.11 H new ATOM 0 HG12 VAL A 99 -0.613 11.233 14.605 1.00 12.11 H new ATOM 0 HG13 VAL A 99 0.404 12.221 13.529 1.00 12.11 H new ATOM 0 HG21 VAL A 99 -1.870 14.107 12.636 1.00 14.53 H new ATOM 0 HG22 VAL A 99 -0.705 13.370 11.510 1.00 14.53 H new ATOM 0 HG23 VAL A 99 -2.452 13.141 11.260 1.00 14.53 H new ATOM 1476 N GLN A 100 -2.278 11.223 9.818 1.00 74.41 N ATOM 1477 CA GLN A 100 -3.270 11.154 8.753 1.00 1.53 C ATOM 1478 C GLN A 100 -2.979 9.987 7.814 1.00 23.32 C ATOM 1479 O GLN A 100 -2.113 10.078 6.945 1.00 3.30 O ATOM 1480 CB GLN A 100 -3.294 12.464 7.963 1.00 53.12 C ATOM 1481 CG GLN A 100 -3.530 13.692 8.828 1.00 2.03 C ATOM 1482 CD GLN A 100 -3.783 14.942 8.010 1.00 73.13 C ATOM 1483 OE1 GLN A 100 -4.888 15.485 8.012 1.00 63.23 O ATOM 1484 NE2 GLN A 100 -2.759 15.407 7.305 1.00 72.11 N ATOM 0 H GLN A 100 -1.459 11.789 9.596 1.00 74.41 H new ATOM 0 HA GLN A 100 -4.247 10.996 9.210 1.00 1.53 H new ATOM 0 HB2 GLN A 100 -2.347 12.578 7.436 1.00 53.12 H new ATOM 0 HB3 GLN A 100 -4.076 12.408 7.206 1.00 53.12 H new ATOM 0 HG2 GLN A 100 -4.383 13.512 9.483 1.00 2.03 H new ATOM 0 HG3 GLN A 100 -2.664 13.852 9.470 1.00 2.03 H new ATOM 0 HE21 GLN A 100 -1.860 14.925 7.332 1.00 72.11 H new ATOM 0 HE22 GLN A 100 -2.871 16.246 6.736 1.00 72.11 H new ATOM 1491 N TRP A 101 -3.708 8.892 7.998 1.00 2.30 N ATOM 1492 CA TRP A 101 -3.528 7.706 7.167 1.00 73.35 C ATOM 1493 C TRP A 101 -4.531 7.688 6.020 1.00 60.43 C ATOM 1494 O TRP A 101 -5.699 7.341 6.207 1.00 5.45 O ATOM 1495 CB TRP A 101 -3.678 6.440 8.012 1.00 52.31 C ATOM 1496 CG TRP A 101 -3.015 6.539 9.353 1.00 41.01 C ATOM 1497 CD1 TRP A 101 -1.851 7.189 9.646 1.00 71.31 C ATOM 1498 CD2 TRP A 101 -3.478 5.967 10.581 1.00 30.12 C ATOM 1499 NE1 TRP A 101 -1.562 7.057 10.983 1.00 22.34 N ATOM 1500 CE2 TRP A 101 -2.545 6.312 11.579 1.00 24.43 C ATOM 1501 CE3 TRP A 101 -4.591 5.199 10.937 1.00 10.55 C ATOM 1502 CZ2 TRP A 101 -2.692 5.913 12.905 1.00 54.45 C ATOM 1503 CZ3 TRP A 101 -4.735 4.805 12.253 1.00 4.43 C ATOM 1504 CH2 TRP A 101 -3.790 5.163 13.224 1.00 21.23 C ATOM 0 H TRP A 101 -4.429 8.800 8.714 1.00 2.30 H new ATOM 0 HA TRP A 101 -2.523 7.737 6.745 1.00 73.35 H new ATOM 0 HB2 TRP A 101 -4.738 6.230 8.153 1.00 52.31 H new ATOM 0 HB3 TRP A 101 -3.255 5.596 7.467 1.00 52.31 H new ATOM 0 HD1 TRP A 101 -1.246 7.728 8.932 1.00 71.31 H new ATOM 0 HE1 TRP A 101 -0.748 7.450 11.455 1.00 22.34 H new ATOM 0 HE3 TRP A 101 -5.325 4.919 10.196 1.00 10.55 H new ATOM 0 HZ2 TRP A 101 -1.964 6.186 13.655 1.00 54.45 H new ATOM 0 HZ3 TRP A 101 -5.590 4.211 12.539 1.00 4.43 H new ATOM 0 HH2 TRP A 101 -3.932 4.840 14.245 1.00 21.23 H new ATOM 1514 N THR A 102 -4.071 8.065 4.831 1.00 65.42 N ATOM 1515 CA THR A 102 -4.929 8.092 3.653 1.00 40.22 C ATOM 1516 C THR A 102 -5.138 6.690 3.092 1.00 44.24 C ATOM 1517 O THR A 102 -4.311 6.185 2.332 1.00 42.13 O ATOM 1518 CB THR A 102 -4.340 8.991 2.549 1.00 15.03 C ATOM 1519 OG1 THR A 102 -4.083 10.300 3.070 1.00 43.44 O ATOM 1520 CG2 THR A 102 -5.289 9.087 1.365 1.00 35.20 C ATOM 0 H THR A 102 -3.109 8.356 4.659 1.00 65.42 H new ATOM 0 HA THR A 102 -5.888 8.500 3.971 1.00 40.22 H new ATOM 0 HB THR A 102 -3.405 8.546 2.208 1.00 15.03 H new ATOM 0 HG1 THR A 102 -3.707 10.865 2.363 1.00 43.44 H new ATOM 0 HG21 THR A 102 -4.851 9.727 0.599 1.00 35.20 H new ATOM 0 HG22 THR A 102 -5.459 8.092 0.953 1.00 35.20 H new ATOM 0 HG23 THR A 102 -6.238 9.511 1.693 1.00 35.20 H new ATOM 1528 N VAL A 103 -6.248 6.065 3.471 1.00 22.31 N ATOM 1529 CA VAL A 103 -6.567 4.721 3.004 1.00 30.24 C ATOM 1530 C VAL A 103 -7.466 4.766 1.773 1.00 5.14 C ATOM 1531 O VAL A 103 -7.734 5.836 1.226 1.00 3.21 O ATOM 1532 CB VAL A 103 -7.262 3.895 4.103 1.00 11.24 C ATOM 1533 CG1 VAL A 103 -6.395 3.833 5.353 1.00 50.53 C ATOM 1534 CG2 VAL A 103 -8.630 4.477 4.422 1.00 73.24 C ATOM 0 H VAL A 103 -6.942 6.468 4.101 1.00 22.31 H new ATOM 0 HA VAL A 103 -5.622 4.244 2.744 1.00 30.24 H new ATOM 0 HB VAL A 103 -7.402 2.878 3.736 1.00 11.24 H new ATOM 0 HG11 VAL A 103 -6.902 3.246 6.119 1.00 50.53 H new ATOM 0 HG12 VAL A 103 -5.440 3.367 5.111 1.00 50.53 H new ATOM 0 HG13 VAL A 103 -6.221 4.842 5.726 1.00 50.53 H new ATOM 0 HG21 VAL A 103 -9.107 3.881 5.200 1.00 73.24 H new ATOM 0 HG22 VAL A 103 -8.516 5.504 4.770 1.00 73.24 H new ATOM 0 HG23 VAL A 103 -9.249 4.464 3.525 1.00 73.24 H new ATOM 1544 N TYR A 104 -7.927 3.597 1.343 1.00 62.34 N ATOM 1545 CA TYR A 104 -8.795 3.502 0.175 1.00 2.00 C ATOM 1546 C TYR A 104 -10.049 2.693 0.491 1.00 34.31 C ATOM 1547 O TYR A 104 -10.259 1.612 -0.057 1.00 34.23 O ATOM 1548 CB TYR A 104 -8.043 2.861 -0.994 1.00 63.41 C ATOM 1549 CG TYR A 104 -6.965 3.745 -1.577 1.00 45.35 C ATOM 1550 CD1 TYR A 104 -7.254 5.035 -2.007 1.00 24.45 C ATOM 1551 CD2 TYR A 104 -5.658 3.291 -1.700 1.00 1.33 C ATOM 1552 CE1 TYR A 104 -6.272 5.845 -2.542 1.00 15.51 C ATOM 1553 CE2 TYR A 104 -4.669 4.095 -2.233 1.00 2.13 C ATOM 1554 CZ TYR A 104 -4.981 5.371 -2.653 1.00 72.11 C ATOM 1555 OH TYR A 104 -4.000 6.177 -3.184 1.00 42.22 O ATOM 0 H TYR A 104 -7.715 2.703 1.785 1.00 62.34 H new ATOM 0 HA TYR A 104 -9.097 4.511 -0.104 1.00 2.00 H new ATOM 0 HB2 TYR A 104 -7.593 1.927 -0.657 1.00 63.41 H new ATOM 0 HB3 TYR A 104 -8.756 2.607 -1.778 1.00 63.41 H new ATOM 0 HD1 TYR A 104 -8.263 5.410 -1.921 1.00 24.45 H new ATOM 0 HD2 TYR A 104 -5.411 2.292 -1.373 1.00 1.33 H new ATOM 0 HE1 TYR A 104 -6.513 6.845 -2.872 1.00 15.51 H new ATOM 0 HE2 TYR A 104 -3.658 3.726 -2.320 1.00 2.13 H new ATOM 0 HH TYR A 104 -3.148 5.694 -3.191 1.00 42.22 H new ATOM 1564 N GLU A 105 -10.881 3.228 1.381 1.00 21.12 N ATOM 1565 CA GLU A 105 -12.114 2.557 1.772 1.00 62.50 C ATOM 1566 C GLU A 105 -12.897 2.100 0.545 1.00 45.11 C ATOM 1567 O GLU A 105 -12.909 2.775 -0.484 1.00 31.03 O ATOM 1568 CB GLU A 105 -12.979 3.487 2.625 1.00 24.41 C ATOM 1569 CG GLU A 105 -13.655 4.591 1.828 1.00 24.21 C ATOM 1570 CD GLU A 105 -13.764 5.888 2.606 1.00 64.51 C ATOM 1571 OE1 GLU A 105 -14.720 6.023 3.400 1.00 52.52 O ATOM 1572 OE2 GLU A 105 -12.897 6.766 2.421 1.00 3.30 O ATOM 0 H GLU A 105 -10.723 4.123 1.844 1.00 21.12 H new ATOM 0 HA GLU A 105 -11.848 1.679 2.360 1.00 62.50 H new ATOM 0 HB2 GLU A 105 -13.742 2.896 3.131 1.00 24.41 H new ATOM 0 HB3 GLU A 105 -12.359 3.937 3.400 1.00 24.41 H new ATOM 0 HG2 GLU A 105 -13.094 4.768 0.911 1.00 24.21 H new ATOM 0 HG3 GLU A 105 -14.652 4.263 1.533 1.00 24.21 H new ATOM 1577 N GLU A 106 -13.550 0.947 0.662 1.00 23.02 N ATOM 1578 CA GLU A 106 -14.335 0.399 -0.439 1.00 40.41 C ATOM 1579 C GLU A 106 -15.775 0.139 -0.005 1.00 14.23 C ATOM 1580 O GLU A 106 -16.711 0.336 -0.778 1.00 44.41 O ATOM 1581 CB GLU A 106 -13.702 -0.897 -0.949 1.00 61.50 C ATOM 1582 CG GLU A 106 -14.113 -1.259 -2.366 1.00 42.54 C ATOM 1583 CD GLU A 106 -13.323 -0.499 -3.414 1.00 52.31 C ATOM 1584 OE1 GLU A 106 -12.617 0.462 -3.042 1.00 62.11 O ATOM 1585 OE2 GLU A 106 -13.411 -0.864 -4.605 1.00 1.52 O ATOM 0 H GLU A 106 -13.551 0.375 1.507 1.00 23.02 H new ATOM 0 HA GLU A 106 -14.345 1.132 -1.245 1.00 40.41 H new ATOM 0 HB2 GLU A 106 -12.617 -0.802 -0.908 1.00 61.50 H new ATOM 0 HB3 GLU A 106 -13.976 -1.713 -0.280 1.00 61.50 H new ATOM 0 HG2 GLU A 106 -13.975 -2.330 -2.518 1.00 42.54 H new ATOM 0 HG3 GLU A 106 -15.175 -1.052 -2.496 1.00 42.54 H new ATOM 1590 N GLN A 107 -15.941 -0.303 1.237 1.00 20.24 N ATOM 1591 CA GLN A 107 -17.265 -0.591 1.774 1.00 73.33 C ATOM 1592 C GLN A 107 -17.733 0.528 2.699 1.00 64.23 C ATOM 1593 O GLN A 107 -18.931 0.724 2.896 1.00 73.21 O ATOM 1594 CB GLN A 107 -17.255 -1.921 2.529 1.00 64.42 C ATOM 1595 CG GLN A 107 -16.418 -1.896 3.797 1.00 51.51 C ATOM 1596 CD GLN A 107 -16.358 -3.245 4.485 1.00 12.51 C ATOM 1597 OE1 GLN A 107 -16.175 -4.277 3.838 1.00 71.11 O ATOM 1598 NE2 GLN A 107 -16.512 -3.244 5.804 1.00 5.12 N ATOM 0 H GLN A 107 -15.175 -0.469 1.890 1.00 20.24 H new ATOM 0 HA GLN A 107 -17.960 -0.661 0.938 1.00 73.33 H new ATOM 0 HB2 GLN A 107 -18.279 -2.191 2.785 1.00 64.42 H new ATOM 0 HB3 GLN A 107 -16.876 -2.701 1.869 1.00 64.42 H new ATOM 0 HG2 GLN A 107 -15.406 -1.572 3.553 1.00 51.51 H new ATOM 0 HG3 GLN A 107 -16.831 -1.159 4.486 1.00 51.51 H new ATOM 0 HE21 GLN A 107 -16.661 -2.365 6.299 1.00 5.12 H new ATOM 0 HE22 GLN A 107 -16.481 -4.122 6.322 1.00 5.12 H new ATOM 1605 N GLY A 108 -16.778 1.259 3.264 1.00 55.44 N ATOM 1606 CA GLY A 108 -17.112 2.350 4.162 1.00 52.33 C ATOM 1607 C GLY A 108 -16.452 2.206 5.519 1.00 74.54 C ATOM 1608 O GLY A 108 -16.754 2.959 6.446 1.00 25.04 O ATOM 0 H GLY A 108 -15.779 1.116 3.116 1.00 55.44 H new ATOM 0 HA2 GLY A 108 -16.807 3.294 3.711 1.00 52.33 H new ATOM 0 HA3 GLY A 108 -18.194 2.393 4.290 1.00 52.33 H new ATOM 1612 N SER A 109 -15.551 1.237 5.638 1.00 61.02 N ATOM 1613 CA SER A 109 -14.851 0.993 6.894 1.00 65.11 C ATOM 1614 C SER A 109 -13.346 1.172 6.721 1.00 40.35 C ATOM 1615 O SER A 109 -12.562 0.814 7.599 1.00 52.11 O ATOM 1616 CB SER A 109 -15.152 -0.418 7.404 1.00 50.24 C ATOM 1617 OG SER A 109 -14.499 -0.664 8.638 1.00 44.32 O ATOM 0 H SER A 109 -15.288 0.607 4.880 1.00 61.02 H new ATOM 0 HA SER A 109 -15.204 1.720 7.625 1.00 65.11 H new ATOM 0 HB2 SER A 109 -16.228 -0.542 7.527 1.00 50.24 H new ATOM 0 HB3 SER A 109 -14.829 -1.152 6.665 1.00 50.24 H new ATOM 0 HG SER A 109 -13.625 -0.220 8.640 1.00 44.32 H new ATOM 1622 N SER A 110 -12.951 1.730 5.581 1.00 14.44 N ATOM 1623 CA SER A 110 -11.540 1.955 5.289 1.00 13.34 C ATOM 1624 C SER A 110 -10.713 0.716 5.617 1.00 2.13 C ATOM 1625 O SER A 110 -9.649 0.808 6.229 1.00 22.52 O ATOM 1626 CB SER A 110 -11.017 3.155 6.083 1.00 22.44 C ATOM 1627 OG SER A 110 -11.582 3.190 7.383 1.00 41.41 O ATOM 0 H SER A 110 -13.588 2.034 4.845 1.00 14.44 H new ATOM 0 HA SER A 110 -11.444 2.164 4.223 1.00 13.34 H new ATOM 0 HB2 SER A 110 -9.931 3.102 6.156 1.00 22.44 H new ATOM 0 HB3 SER A 110 -11.256 4.078 5.554 1.00 22.44 H new ATOM 0 HG SER A 110 -11.428 2.332 7.830 1.00 41.41 H new ATOM 1632 N LYS A 111 -11.210 -0.445 5.203 1.00 1.21 N ATOM 1633 CA LYS A 111 -10.519 -1.706 5.449 1.00 75.13 C ATOM 1634 C LYS A 111 -9.759 -2.160 4.208 1.00 25.41 C ATOM 1635 O LYS A 111 -9.770 -1.486 3.179 1.00 3.41 O ATOM 1636 CB LYS A 111 -11.519 -2.785 5.873 1.00 54.10 C ATOM 1637 CG LYS A 111 -11.415 -3.169 7.338 1.00 53.00 C ATOM 1638 CD LYS A 111 -11.964 -4.562 7.590 1.00 24.10 C ATOM 1639 CE LYS A 111 -12.411 -4.734 9.033 1.00 14.05 C ATOM 1640 NZ LYS A 111 -13.224 -5.967 9.220 1.00 61.05 N ATOM 0 H LYS A 111 -12.090 -0.539 4.695 1.00 1.21 H new ATOM 0 HA LYS A 111 -9.802 -1.548 6.255 1.00 75.13 H new ATOM 0 HB2 LYS A 111 -12.530 -2.432 5.670 1.00 54.10 H new ATOM 0 HB3 LYS A 111 -11.363 -3.674 5.261 1.00 54.10 H new ATOM 0 HG2 LYS A 111 -10.372 -3.125 7.653 1.00 53.00 H new ATOM 0 HG3 LYS A 111 -11.962 -2.446 7.944 1.00 53.00 H new ATOM 0 HD2 LYS A 111 -12.806 -4.748 6.923 1.00 24.10 H new ATOM 0 HD3 LYS A 111 -11.200 -5.303 7.354 1.00 24.10 H new ATOM 0 HE2 LYS A 111 -11.536 -4.775 9.682 1.00 14.05 H new ATOM 0 HE3 LYS A 111 -12.994 -3.865 9.338 1.00 14.05 H new ATOM 0 HZ1 LYS A 111 -13.509 -6.047 10.217 1.00 61.05 H new ATOM 0 HZ2 LYS A 111 -14.072 -5.918 8.621 1.00 61.05 H new ATOM 0 HZ3 LYS A 111 -12.660 -6.799 8.953 1.00 61.05 H new ATOM 1650 N VAL A 112 -9.101 -3.311 4.311 1.00 23.35 N ATOM 1651 CA VAL A 112 -8.337 -3.858 3.196 1.00 34.12 C ATOM 1652 C VAL A 112 -9.181 -3.916 1.929 1.00 44.32 C ATOM 1653 O VAL A 112 -10.398 -4.098 1.987 1.00 31.21 O ATOM 1654 CB VAL A 112 -7.811 -5.271 3.515 1.00 74.23 C ATOM 1655 CG1 VAL A 112 -7.025 -5.267 4.817 1.00 54.41 C ATOM 1656 CG2 VAL A 112 -8.962 -6.264 3.581 1.00 12.45 C ATOM 0 H VAL A 112 -9.082 -3.883 5.156 1.00 23.35 H new ATOM 0 HA VAL A 112 -7.490 -3.191 3.035 1.00 34.12 H new ATOM 0 HB VAL A 112 -7.139 -5.580 2.714 1.00 74.23 H new ATOM 0 HG11 VAL A 112 -6.662 -6.273 5.026 1.00 54.41 H new ATOM 0 HG12 VAL A 112 -6.178 -4.586 4.729 1.00 54.41 H new ATOM 0 HG13 VAL A 112 -7.671 -4.938 5.631 1.00 54.41 H new ATOM 0 HG21 VAL A 112 -8.573 -7.257 3.807 1.00 12.45 H new ATOM 0 HG22 VAL A 112 -9.660 -5.961 4.362 1.00 12.45 H new ATOM 0 HG23 VAL A 112 -9.479 -6.286 2.621 1.00 12.45 H new ATOM 1666 N PHE A 113 -8.528 -3.762 0.781 1.00 73.53 N ATOM 1667 CA PHE A 113 -9.219 -3.797 -0.502 1.00 53.25 C ATOM 1668 C PHE A 113 -8.512 -4.735 -1.475 1.00 24.43 C ATOM 1669 O PHE A 113 -7.284 -4.776 -1.531 1.00 2.24 O ATOM 1670 CB PHE A 113 -9.299 -2.390 -1.100 1.00 41.20 C ATOM 1671 CG PHE A 113 -7.962 -1.829 -1.491 1.00 52.51 C ATOM 1672 CD1 PHE A 113 -7.148 -1.220 -0.548 1.00 64.30 C ATOM 1673 CD2 PHE A 113 -7.518 -1.908 -2.801 1.00 41.45 C ATOM 1674 CE1 PHE A 113 -5.918 -0.702 -0.906 1.00 30.32 C ATOM 1675 CE2 PHE A 113 -6.289 -1.391 -3.165 1.00 31.34 C ATOM 1676 CZ PHE A 113 -5.487 -0.788 -2.215 1.00 61.21 C ATOM 0 H PHE A 113 -7.521 -3.612 0.714 1.00 73.53 H new ATOM 0 HA PHE A 113 -10.229 -4.171 -0.333 1.00 53.25 H new ATOM 0 HB2 PHE A 113 -9.945 -2.413 -1.977 1.00 41.20 H new ATOM 0 HB3 PHE A 113 -9.767 -1.722 -0.377 1.00 41.20 H new ATOM 0 HD1 PHE A 113 -7.479 -1.150 0.478 1.00 64.30 H new ATOM 0 HD2 PHE A 113 -8.140 -2.380 -3.547 1.00 41.45 H new ATOM 0 HE1 PHE A 113 -5.294 -0.230 -0.162 1.00 30.32 H new ATOM 0 HE2 PHE A 113 -5.956 -1.458 -4.190 1.00 31.34 H new ATOM 0 HZ PHE A 113 -4.525 -0.385 -2.496 1.00 61.21 H new ATOM 1685 N GLN A 114 -9.298 -5.488 -2.238 1.00 4.01 N ATOM 1686 CA GLN A 114 -8.748 -6.429 -3.207 1.00 13.43 C ATOM 1687 C GLN A 114 -8.037 -5.691 -4.338 1.00 74.34 C ATOM 1688 O GLN A 114 -8.462 -4.614 -4.752 1.00 54.34 O ATOM 1689 CB GLN A 114 -9.857 -7.314 -3.778 1.00 54.43 C ATOM 1690 CG GLN A 114 -10.683 -8.017 -2.713 1.00 34.04 C ATOM 1691 CD GLN A 114 -12.167 -7.743 -2.849 1.00 50.23 C ATOM 1692 OE1 GLN A 114 -12.851 -7.458 -1.865 1.00 20.23 O ATOM 1693 NE2 GLN A 114 -12.675 -7.829 -4.073 1.00 54.23 N ATOM 0 H GLN A 114 -10.317 -5.465 -2.204 1.00 4.01 H new ATOM 0 HA GLN A 114 -8.021 -7.058 -2.693 1.00 13.43 H new ATOM 0 HB2 GLN A 114 -10.517 -6.703 -4.394 1.00 54.43 H new ATOM 0 HB3 GLN A 114 -9.412 -8.062 -4.434 1.00 54.43 H new ATOM 0 HG2 GLN A 114 -10.509 -9.091 -2.774 1.00 34.04 H new ATOM 0 HG3 GLN A 114 -10.347 -7.695 -1.727 1.00 34.04 H new ATOM 0 HE21 GLN A 114 -12.072 -8.068 -4.860 1.00 54.23 H new ATOM 0 HE22 GLN A 114 -13.668 -7.656 -4.226 1.00 54.23 H new ATOM 1700 N GLY A 115 -6.953 -6.280 -4.832 1.00 44.34 N ATOM 1701 CA GLY A 115 -6.201 -5.665 -5.911 1.00 50.35 C ATOM 1702 C GLY A 115 -6.545 -6.250 -7.266 1.00 21.54 C ATOM 1703 O GLY A 115 -7.599 -5.957 -7.828 1.00 1.11 O ATOM 0 H GLY A 115 -6.582 -7.172 -4.505 1.00 44.34 H new ATOM 0 HA2 GLY A 115 -6.398 -4.593 -5.921 1.00 50.35 H new ATOM 0 HA3 GLY A 115 -5.135 -5.792 -5.724 1.00 50.35 H new ATOM 1707 N ASN A 116 -5.651 -7.081 -7.793 1.00 11.12 N ATOM 1708 CA ASN A 116 -5.864 -7.709 -9.092 1.00 14.42 C ATOM 1709 C ASN A 116 -5.711 -9.223 -8.996 1.00 43.32 C ATOM 1710 O ASN A 116 -5.631 -9.783 -7.901 1.00 40.42 O ATOM 1711 CB ASN A 116 -4.877 -7.149 -10.119 1.00 40.12 C ATOM 1712 CG ASN A 116 -4.719 -5.645 -10.011 1.00 64.31 C ATOM 1713 OD1 ASN A 116 -5.623 -4.888 -10.366 1.00 3.11 O ATOM 1714 ND2 ASN A 116 -3.568 -5.204 -9.518 1.00 30.35 N ATOM 0 H ASN A 116 -4.773 -7.335 -7.341 1.00 11.12 H new ATOM 0 HA ASN A 116 -6.881 -7.485 -9.414 1.00 14.42 H new ATOM 0 HB2 ASN A 116 -3.906 -7.624 -9.981 1.00 40.12 H new ATOM 0 HB3 ASN A 116 -5.218 -7.404 -11.122 1.00 40.12 H new ATOM 0 HD21 ASN A 116 -3.405 -4.202 -9.421 1.00 30.35 H new ATOM 0 HD22 ASN A 116 -2.846 -5.867 -9.236 1.00 30.35 H new ATOM 1720 N LEU A 117 -5.670 -9.882 -10.149 1.00 63.00 N ATOM 1721 CA LEU A 117 -5.526 -11.334 -10.196 1.00 41.05 C ATOM 1722 C LEU A 117 -4.405 -11.739 -11.147 1.00 14.24 C ATOM 1723 O LEU A 117 -4.465 -12.793 -11.780 1.00 63.23 O ATOM 1724 CB LEU A 117 -6.841 -11.982 -10.634 1.00 5.51 C ATOM 1725 CG LEU A 117 -8.084 -11.584 -9.837 1.00 22.14 C ATOM 1726 CD1 LEU A 117 -9.277 -11.406 -10.763 1.00 11.12 C ATOM 1727 CD2 LEU A 117 -8.387 -12.624 -8.768 1.00 73.04 C ATOM 0 H LEU A 117 -5.734 -9.435 -11.063 1.00 63.00 H new ATOM 0 HA LEU A 117 -5.272 -11.682 -9.195 1.00 41.05 H new ATOM 0 HB2 LEU A 117 -7.012 -11.737 -11.682 1.00 5.51 H new ATOM 0 HB3 LEU A 117 -6.727 -13.064 -10.574 1.00 5.51 H new ATOM 0 HG LEU A 117 -7.887 -10.632 -9.344 1.00 22.14 H new ATOM 0 HD11 LEU A 117 -10.152 -11.123 -10.178 1.00 11.12 H new ATOM 0 HD12 LEU A 117 -9.059 -10.625 -11.491 1.00 11.12 H new ATOM 0 HD13 LEU A 117 -9.476 -12.342 -11.284 1.00 11.12 H new ATOM 0 HD21 LEU A 117 -9.275 -12.325 -8.210 1.00 73.04 H new ATOM 0 HD22 LEU A 117 -8.564 -13.590 -9.240 1.00 73.04 H new ATOM 0 HD23 LEU A 117 -7.540 -12.703 -8.087 1.00 73.04 H new ATOM 1738 N ASP A 118 -3.382 -10.897 -11.239 1.00 44.21 N ATOM 1739 CA ASP A 118 -2.243 -11.169 -12.110 1.00 75.25 C ATOM 1740 C ASP A 118 -0.963 -10.577 -11.531 1.00 54.41 C ATOM 1741 O ASP A 118 -0.963 -9.461 -11.011 1.00 3.32 O ATOM 1742 CB ASP A 118 -2.496 -10.601 -13.507 1.00 63.04 C ATOM 1743 CG ASP A 118 -2.760 -11.686 -14.534 1.00 33.41 C ATOM 1744 OD1 ASP A 118 -3.621 -12.552 -14.273 1.00 25.23 O ATOM 1745 OD2 ASP A 118 -2.106 -11.668 -15.597 1.00 13.22 O ATOM 0 H ASP A 118 -3.317 -10.020 -10.722 1.00 44.21 H new ATOM 0 HA ASP A 118 -2.122 -12.250 -12.182 1.00 75.25 H new ATOM 0 HB2 ASP A 118 -3.349 -9.923 -13.472 1.00 63.04 H new ATOM 0 HB3 ASP A 118 -1.633 -10.012 -13.818 1.00 63.04 H new ATOM 1749 N ASN A 119 0.128 -11.331 -11.624 1.00 72.05 N ATOM 1750 CA ASN A 119 1.415 -10.881 -11.107 1.00 41.34 C ATOM 1751 C ASN A 119 2.104 -9.951 -12.101 1.00 51.42 C ATOM 1752 O ASN A 119 2.797 -9.012 -11.711 1.00 32.13 O ATOM 1753 CB ASN A 119 2.315 -12.081 -10.807 1.00 52.11 C ATOM 1754 CG ASN A 119 3.064 -12.564 -12.033 1.00 52.21 C ATOM 1755 OD1 ASN A 119 2.352 -13.218 -12.942 1.00 70.52 O flip ATOM 1756 ND2 ASN A 119 4.270 -12.350 -12.162 1.00 44.52 N flip ATOM 0 H ASN A 119 0.146 -12.256 -12.053 1.00 72.05 H new ATOM 0 HA ASN A 119 1.236 -10.330 -10.184 1.00 41.34 H new ATOM 0 HB2 ASN A 119 3.031 -11.810 -10.031 1.00 52.11 H new ATOM 0 HB3 ASN A 119 1.709 -12.896 -10.411 1.00 52.11 H new ATOM 0 HD21 ASN A 119 4.778 -11.843 -11.438 1.00 44.52 H new ATOM 0 HD22 ASN A 119 4.760 -12.680 -12.993 1.00 44.52 H new ATOM 1762 N ASN A 120 1.908 -10.219 -13.388 1.00 50.24 N ATOM 1763 CA ASN A 120 2.510 -9.405 -14.439 1.00 2.25 C ATOM 1764 C ASN A 120 1.710 -8.126 -14.663 1.00 25.33 C ATOM 1765 O ASN A 120 2.223 -7.147 -15.205 1.00 25.34 O ATOM 1766 CB ASN A 120 2.597 -10.202 -15.742 1.00 44.35 C ATOM 1767 CG ASN A 120 3.312 -11.528 -15.564 1.00 53.22 C ATOM 1768 OD1 ASN A 120 4.385 -11.591 -14.965 1.00 12.02 O ATOM 1769 ND2 ASN A 120 2.717 -12.595 -16.084 1.00 2.12 N ATOM 0 H ASN A 120 1.337 -10.993 -13.729 1.00 50.24 H new ATOM 0 HA ASN A 120 3.516 -9.131 -14.121 1.00 2.25 H new ATOM 0 HB2 ASN A 120 1.591 -10.383 -16.121 1.00 44.35 H new ATOM 0 HB3 ASN A 120 3.119 -9.609 -16.493 1.00 44.35 H new ATOM 0 HD21 ASN A 120 3.150 -13.514 -15.995 1.00 2.12 H new ATOM 0 HD22 ASN A 120 1.827 -12.495 -16.573 1.00 2.12 H new ATOM 1775 N SER A 121 0.449 -8.142 -14.242 1.00 10.33 N ATOM 1776 CA SER A 121 -0.424 -6.985 -14.399 1.00 2.31 C ATOM 1777 C SER A 121 -0.096 -5.912 -13.365 1.00 45.31 C ATOM 1778 O SER A 121 -0.021 -6.189 -12.168 1.00 62.40 O ATOM 1779 CB SER A 121 -1.889 -7.404 -14.269 1.00 50.50 C ATOM 1780 OG SER A 121 -2.261 -8.291 -15.310 1.00 12.45 O ATOM 0 H SER A 121 0.009 -8.944 -13.790 1.00 10.33 H new ATOM 0 HA SER A 121 -0.259 -6.569 -15.393 1.00 2.31 H new ATOM 0 HB2 SER A 121 -2.049 -7.884 -13.304 1.00 50.50 H new ATOM 0 HB3 SER A 121 -2.527 -6.520 -14.295 1.00 50.50 H new ATOM 0 HG SER A 121 -3.201 -8.545 -15.203 1.00 12.45 H new ATOM 1785 N HIS A 122 0.100 -4.684 -13.837 1.00 3.33 N ATOM 1786 CA HIS A 122 0.420 -3.568 -12.953 1.00 44.24 C ATOM 1787 C HIS A 122 -0.793 -2.662 -12.763 1.00 63.22 C ATOM 1788 O HIS A 122 -1.499 -2.342 -13.720 1.00 74.24 O ATOM 1789 CB HIS A 122 1.590 -2.762 -13.519 1.00 44.23 C ATOM 1790 CG HIS A 122 1.190 -1.809 -14.603 1.00 15.34 C ATOM 1791 ND1 HIS A 122 0.350 -2.156 -15.639 1.00 40.42 N ATOM 1792 CD2 HIS A 122 1.522 -0.512 -14.807 1.00 1.12 C ATOM 1793 CE1 HIS A 122 0.182 -1.114 -16.435 1.00 43.11 C ATOM 1794 NE2 HIS A 122 0.883 -0.104 -15.953 1.00 31.24 N ATOM 0 H HIS A 122 0.043 -4.437 -14.825 1.00 3.33 H new ATOM 0 HA HIS A 122 0.704 -3.974 -11.982 1.00 44.24 H new ATOM 0 HB2 HIS A 122 2.061 -2.203 -12.710 1.00 44.23 H new ATOM 0 HB3 HIS A 122 2.340 -3.450 -13.909 1.00 44.23 H new ATOM 0 HD2 HIS A 122 2.168 0.089 -14.185 1.00 1.12 H new ATOM 0 HE1 HIS A 122 -0.425 -1.092 -17.328 1.00 43.11 H new ATOM 0 HE2 HIS A 122 0.941 0.828 -16.364 1.00 31.24 H new ATOM 1801 N LYS A 123 -1.030 -2.253 -11.522 1.00 15.03 N ATOM 1802 CA LYS A 123 -2.156 -1.383 -11.204 1.00 15.12 C ATOM 1803 C LYS A 123 -2.236 -1.122 -9.703 1.00 30.33 C ATOM 1804 O LYS A 123 -1.509 -1.731 -8.917 1.00 63.11 O ATOM 1805 CB LYS A 123 -3.464 -2.009 -11.694 1.00 33.22 C ATOM 1806 CG LYS A 123 -4.286 -1.088 -12.578 1.00 52.51 C ATOM 1807 CD LYS A 123 -5.736 -1.532 -12.652 1.00 65.01 C ATOM 1808 CE LYS A 123 -6.618 -0.718 -11.719 1.00 55.21 C ATOM 1809 NZ LYS A 123 -7.922 -1.387 -11.462 1.00 72.53 N ATOM 0 H LYS A 123 -0.457 -2.510 -10.719 1.00 15.03 H new ATOM 0 HA LYS A 123 -2.002 -0.431 -11.712 1.00 15.12 H new ATOM 0 HB2 LYS A 123 -3.236 -2.921 -12.246 1.00 33.22 H new ATOM 0 HB3 LYS A 123 -4.063 -2.300 -10.831 1.00 33.22 H new ATOM 0 HG2 LYS A 123 -4.236 -0.070 -12.190 1.00 52.51 H new ATOM 0 HG3 LYS A 123 -3.859 -1.069 -13.581 1.00 52.51 H new ATOM 0 HD2 LYS A 123 -6.097 -1.430 -13.676 1.00 65.01 H new ATOM 0 HD3 LYS A 123 -5.808 -2.588 -12.392 1.00 65.01 H new ATOM 0 HE2 LYS A 123 -6.098 -0.561 -10.774 1.00 55.21 H new ATOM 0 HE3 LYS A 123 -6.794 0.266 -12.153 1.00 55.21 H new ATOM 0 HZ1 LYS A 123 -8.493 -0.800 -10.822 1.00 72.53 H new ATOM 0 HZ2 LYS A 123 -8.430 -1.514 -12.361 1.00 72.53 H new ATOM 0 HZ3 LYS A 123 -7.755 -2.315 -11.024 1.00 72.53 H new ATOM 1819 N LYS A 124 -3.123 -0.214 -9.311 1.00 70.32 N ATOM 1820 CA LYS A 124 -3.300 0.126 -7.904 1.00 52.44 C ATOM 1821 C LYS A 124 -4.304 1.263 -7.742 1.00 32.33 C ATOM 1822 O LYS A 124 -5.448 1.043 -7.345 1.00 1.45 O ATOM 1823 CB LYS A 124 -1.960 0.522 -7.282 1.00 21.33 C ATOM 1824 CG LYS A 124 -1.579 -0.317 -6.073 1.00 72.24 C ATOM 1825 CD LYS A 124 -2.060 0.320 -4.780 1.00 20.42 C ATOM 1826 CE LYS A 124 -0.951 0.375 -3.740 1.00 44.53 C ATOM 1827 NZ LYS A 124 -0.564 -0.983 -3.269 1.00 2.32 N ATOM 0 H LYS A 124 -3.731 0.300 -9.948 1.00 70.32 H new ATOM 0 HA LYS A 124 -3.687 -0.753 -7.389 1.00 52.44 H new ATOM 0 HB2 LYS A 124 -1.178 0.433 -8.036 1.00 21.33 H new ATOM 0 HB3 LYS A 124 -2.001 1.571 -6.988 1.00 21.33 H new ATOM 0 HG2 LYS A 124 -2.009 -1.314 -6.171 1.00 72.24 H new ATOM 0 HG3 LYS A 124 -0.496 -0.438 -6.039 1.00 72.24 H new ATOM 0 HD2 LYS A 124 -2.421 1.328 -4.982 1.00 20.42 H new ATOM 0 HD3 LYS A 124 -2.903 -0.247 -4.385 1.00 20.42 H new ATOM 0 HE2 LYS A 124 -0.080 0.874 -4.164 1.00 44.53 H new ATOM 0 HE3 LYS A 124 -1.279 0.974 -2.891 1.00 44.53 H new ATOM 0 HZ1 LYS A 124 0.026 -0.900 -2.417 1.00 2.32 H new ATOM 0 HZ2 LYS A 124 -1.420 -1.530 -3.046 1.00 2.32 H new ATOM 0 HZ3 LYS A 124 -0.027 -1.469 -4.015 1.00 2.32 H new ATOM 1837 N ASN A 125 -3.868 2.480 -8.052 1.00 61.02 N ATOM 1838 CA ASN A 125 -4.729 3.652 -7.941 1.00 3.01 C ATOM 1839 C ASN A 125 -4.120 4.846 -8.669 1.00 0.42 C ATOM 1840 O ASN A 125 -2.899 4.957 -8.787 1.00 70.42 O ATOM 1841 CB ASN A 125 -4.962 4.002 -6.471 1.00 73.54 C ATOM 1842 CG ASN A 125 -6.428 3.937 -6.085 1.00 2.11 C ATOM 1843 OD1 ASN A 125 -7.234 4.752 -6.531 1.00 53.14 O ATOM 1844 ND2 ASN A 125 -6.778 2.963 -5.252 1.00 13.54 N ATOM 0 H ASN A 125 -2.924 2.680 -8.382 1.00 61.02 H new ATOM 0 HA ASN A 125 -5.685 3.414 -8.407 1.00 3.01 H new ATOM 0 HB2 ASN A 125 -4.393 3.316 -5.843 1.00 73.54 H new ATOM 0 HB3 ASN A 125 -4.582 5.004 -6.275 1.00 73.54 H new ATOM 0 HD21 ASN A 125 -7.750 2.869 -4.957 1.00 13.54 H new ATOM 0 HD22 ASN A 125 -6.075 2.309 -4.907 1.00 13.54 H new ATOM 1850 N ILE A 126 -4.978 5.736 -9.155 1.00 53.52 N ATOM 1851 CA ILE A 126 -4.523 6.922 -9.870 1.00 75.04 C ATOM 1852 C ILE A 126 -4.558 8.154 -8.970 1.00 11.15 C ATOM 1853 O ILE A 126 -4.490 8.043 -7.746 1.00 23.22 O ATOM 1854 CB ILE A 126 -5.383 7.190 -11.120 1.00 52.32 C ATOM 1855 CG1 ILE A 126 -6.115 5.916 -11.544 1.00 41.40 C ATOM 1856 CG2 ILE A 126 -4.517 7.714 -12.256 1.00 31.21 C ATOM 1857 CD1 ILE A 126 -5.187 4.787 -11.934 1.00 33.21 C ATOM 0 H ILE A 126 -5.991 5.659 -9.067 1.00 53.52 H new ATOM 0 HA ILE A 126 -3.496 6.729 -10.179 1.00 75.04 H new ATOM 0 HB ILE A 126 -6.126 7.949 -10.876 1.00 52.32 H new ATOM 0 HG12 ILE A 126 -6.754 5.584 -10.725 1.00 41.40 H new ATOM 0 HG13 ILE A 126 -6.769 6.145 -12.386 1.00 41.40 H new ATOM 0 HG21 ILE A 126 -5.139 7.899 -13.132 1.00 31.21 H new ATOM 0 HG22 ILE A 126 -4.037 8.643 -11.949 1.00 31.21 H new ATOM 0 HG23 ILE A 126 -3.754 6.976 -12.502 1.00 31.21 H new ATOM 0 HD11 ILE A 126 -5.775 3.916 -12.223 1.00 33.21 H new ATOM 0 HD12 ILE A 126 -4.566 5.100 -12.773 1.00 33.21 H new ATOM 0 HD13 ILE A 126 -4.550 4.530 -11.087 1.00 33.21 H new ATOM 1868 N PHE A 127 -4.665 9.327 -9.585 1.00 64.25 N ATOM 1869 CA PHE A 127 -4.710 10.579 -8.841 1.00 32.14 C ATOM 1870 C PHE A 127 -6.123 10.867 -8.344 1.00 63.43 C ATOM 1871 O PHE A 127 -6.579 12.010 -8.365 1.00 44.04 O ATOM 1872 CB PHE A 127 -4.219 11.735 -9.715 1.00 32.11 C ATOM 1873 CG PHE A 127 -4.894 11.801 -11.054 1.00 43.04 C ATOM 1874 CD1 PHE A 127 -6.093 12.479 -11.209 1.00 15.42 C ATOM 1875 CD2 PHE A 127 -4.330 11.186 -12.160 1.00 42.13 C ATOM 1876 CE1 PHE A 127 -6.716 12.541 -12.441 1.00 51.10 C ATOM 1877 CE2 PHE A 127 -4.948 11.245 -13.395 1.00 44.00 C ATOM 1878 CZ PHE A 127 -6.143 11.924 -13.536 1.00 74.13 C ATOM 0 H PHE A 127 -4.722 9.436 -10.598 1.00 64.25 H new ATOM 0 HA PHE A 127 -4.053 10.482 -7.977 1.00 32.14 H new ATOM 0 HB2 PHE A 127 -4.383 12.674 -9.187 1.00 32.11 H new ATOM 0 HB3 PHE A 127 -3.144 11.637 -9.863 1.00 32.11 H new ATOM 0 HD1 PHE A 127 -6.546 12.964 -10.357 1.00 15.42 H new ATOM 0 HD2 PHE A 127 -3.396 10.654 -12.056 1.00 42.13 H new ATOM 0 HE1 PHE A 127 -7.651 13.072 -12.548 1.00 51.10 H new ATOM 0 HE2 PHE A 127 -4.497 10.761 -14.249 1.00 44.00 H new ATOM 0 HZ PHE A 127 -6.628 11.972 -14.500 1.00 74.13 H new ATOM 1887 N GLU A 128 -6.812 9.821 -7.898 1.00 24.35 N ATOM 1888 CA GLU A 128 -8.175 9.961 -7.397 1.00 11.24 C ATOM 1889 C GLU A 128 -8.229 10.949 -6.236 1.00 11.12 C ATOM 1890 O GLU A 128 -9.287 11.493 -5.917 1.00 54.41 O ATOM 1891 CB GLU A 128 -8.720 8.603 -6.951 1.00 2.44 C ATOM 1892 CG GLU A 128 -10.183 8.639 -6.540 1.00 13.23 C ATOM 1893 CD GLU A 128 -10.971 7.464 -7.085 1.00 21.23 C ATOM 1894 OE1 GLU A 128 -10.973 7.271 -8.319 1.00 22.22 O ATOM 1895 OE2 GLU A 128 -11.586 6.737 -6.276 1.00 43.33 O ATOM 0 H GLU A 128 -6.449 8.868 -7.873 1.00 24.35 H new ATOM 0 HA GLU A 128 -8.795 10.345 -8.207 1.00 11.24 H new ATOM 0 HB2 GLU A 128 -8.597 7.887 -7.764 1.00 2.44 H new ATOM 0 HB3 GLU A 128 -8.125 8.239 -6.113 1.00 2.44 H new ATOM 0 HG2 GLU A 128 -10.251 8.644 -5.452 1.00 13.23 H new ATOM 0 HG3 GLU A 128 -10.633 9.568 -6.892 1.00 13.23 H new ATOM 1900 N LYS A 129 -7.081 11.177 -5.607 1.00 41.51 N ATOM 1901 CA LYS A 129 -6.995 12.100 -4.481 1.00 12.22 C ATOM 1902 C LYS A 129 -5.547 12.284 -4.038 1.00 43.11 C ATOM 1903 O LYS A 129 -5.090 11.687 -3.062 1.00 64.13 O ATOM 1904 CB LYS A 129 -7.836 11.589 -3.310 1.00 64.25 C ATOM 1905 CG LYS A 129 -7.547 10.146 -2.937 1.00 31.13 C ATOM 1906 CD LYS A 129 -8.686 9.225 -3.340 1.00 60.23 C ATOM 1907 CE LYS A 129 -9.436 8.702 -2.124 1.00 75.02 C ATOM 1908 NZ LYS A 129 -10.575 7.824 -2.511 1.00 51.52 N ATOM 0 H LYS A 129 -6.197 10.735 -5.858 1.00 41.51 H new ATOM 0 HA LYS A 129 -7.383 13.066 -4.805 1.00 12.22 H new ATOM 0 HB2 LYS A 129 -7.657 12.223 -2.441 1.00 64.25 H new ATOM 0 HB3 LYS A 129 -8.892 11.686 -3.563 1.00 64.25 H new ATOM 0 HG2 LYS A 129 -6.627 9.821 -3.423 1.00 31.13 H new ATOM 0 HG3 LYS A 129 -7.383 10.073 -1.862 1.00 31.13 H new ATOM 0 HD2 LYS A 129 -9.376 9.761 -3.992 1.00 60.23 H new ATOM 0 HD3 LYS A 129 -8.292 8.387 -3.914 1.00 60.23 H new ATOM 0 HE2 LYS A 129 -8.750 8.146 -1.485 1.00 75.02 H new ATOM 0 HE3 LYS A 129 -9.808 9.542 -1.537 1.00 75.02 H new ATOM 0 HZ1 LYS A 129 -11.061 7.488 -1.655 1.00 51.52 H new ATOM 0 HZ2 LYS A 129 -11.243 8.361 -3.100 1.00 51.52 H new ATOM 0 HZ3 LYS A 129 -10.218 7.009 -3.049 1.00 51.52 H new ATOM 1918 N PRO A 130 -4.807 13.130 -4.769 1.00 13.11 N ATOM 1919 CA PRO A 130 -3.400 13.414 -4.468 1.00 12.11 C ATOM 1920 C PRO A 130 -3.233 14.221 -3.185 1.00 10.34 C ATOM 1921 O PRO A 130 -4.166 14.882 -2.729 1.00 23.43 O ATOM 1922 CB PRO A 130 -2.936 14.230 -5.677 1.00 74.21 C ATOM 1923 CG PRO A 130 -4.177 14.859 -6.208 1.00 63.32 C ATOM 1924 CD PRO A 130 -5.285 13.876 -5.945 1.00 51.13 C ATOM 0 HA PRO A 130 -2.826 12.502 -4.307 1.00 12.11 H new ATOM 0 HB2 PRO A 130 -2.203 14.983 -5.388 1.00 74.21 H new ATOM 0 HB3 PRO A 130 -2.463 13.595 -6.426 1.00 74.21 H new ATOM 0 HG2 PRO A 130 -4.374 15.811 -5.714 1.00 63.32 H new ATOM 0 HG3 PRO A 130 -4.084 15.066 -7.274 1.00 63.32 H new ATOM 0 HD2 PRO A 130 -6.230 14.380 -5.744 1.00 51.13 H new ATOM 0 HD3 PRO A 130 -5.450 13.218 -6.798 1.00 51.13 H new ATOM 1929 N PHE A 131 -2.037 14.162 -2.606 1.00 53.44 N ATOM 1930 CA PHE A 131 -1.748 14.889 -1.375 1.00 23.50 C ATOM 1931 C PHE A 131 -0.329 14.599 -0.894 1.00 34.21 C ATOM 1932 O PHE A 131 0.305 13.642 -1.337 1.00 3.31 O ATOM 1933 CB PHE A 131 -2.755 14.510 -0.287 1.00 23.23 C ATOM 1934 CG PHE A 131 -3.693 15.625 0.077 1.00 10.22 C ATOM 1935 CD1 PHE A 131 -3.202 16.874 0.425 1.00 65.32 C ATOM 1936 CD2 PHE A 131 -5.064 15.426 0.071 1.00 2.15 C ATOM 1937 CE1 PHE A 131 -4.064 17.901 0.761 1.00 1.41 C ATOM 1938 CE2 PHE A 131 -5.929 16.449 0.405 1.00 74.21 C ATOM 1939 CZ PHE A 131 -5.428 17.690 0.750 1.00 41.12 C ATOM 0 H PHE A 131 -1.254 13.619 -2.969 1.00 53.44 H new ATOM 0 HA PHE A 131 -1.832 15.956 -1.583 1.00 23.50 H new ATOM 0 HB2 PHE A 131 -3.337 13.652 -0.625 1.00 23.23 H new ATOM 0 HB3 PHE A 131 -2.213 14.196 0.605 1.00 23.23 H new ATOM 0 HD1 PHE A 131 -2.136 17.046 0.434 1.00 65.32 H new ATOM 0 HD2 PHE A 131 -5.461 14.458 -0.198 1.00 2.15 H new ATOM 0 HE1 PHE A 131 -3.670 18.869 1.032 1.00 1.41 H new ATOM 0 HE2 PHE A 131 -6.996 16.280 0.397 1.00 74.21 H new ATOM 0 HZ PHE A 131 -6.102 18.493 1.010 1.00 41.12 H new ATOM 1948 N MET A 132 0.163 15.434 0.016 1.00 61.43 N ATOM 1949 CA MET A 132 1.506 15.269 0.558 1.00 2.03 C ATOM 1950 C MET A 132 1.628 13.949 1.313 1.00 43.31 C ATOM 1951 O MET A 132 0.632 13.389 1.768 1.00 33.33 O ATOM 1952 CB MET A 132 1.852 16.434 1.486 1.00 41.22 C ATOM 1953 CG MET A 132 2.468 17.622 0.765 1.00 13.04 C ATOM 1954 SD MET A 132 1.791 19.199 1.321 1.00 1.34 S ATOM 1955 CE MET A 132 0.353 19.342 0.264 1.00 44.00 C ATOM 0 H MET A 132 -0.349 16.232 0.393 1.00 61.43 H new ATOM 0 HA MET A 132 2.208 15.258 -0.275 1.00 2.03 H new ATOM 0 HB2 MET A 132 0.947 16.760 1.999 1.00 41.22 H new ATOM 0 HB3 MET A 132 2.545 16.085 2.252 1.00 41.22 H new ATOM 0 HG2 MET A 132 3.547 17.618 0.922 1.00 13.04 H new ATOM 0 HG3 MET A 132 2.302 17.517 -0.307 1.00 13.04 H new ATOM 0 HE1 MET A 132 -0.173 20.270 0.489 1.00 44.00 H new ATOM 0 HE2 MET A 132 0.668 19.347 -0.780 1.00 44.00 H new ATOM 0 HE3 MET A 132 -0.312 18.497 0.439 1.00 44.00 H new ATOM 1963 N ALA A 133 2.857 13.457 1.440 1.00 31.31 N ATOM 1964 CA ALA A 133 3.109 12.204 2.142 1.00 62.02 C ATOM 1965 C ALA A 133 4.605 11.956 2.302 1.00 43.21 C ATOM 1966 O ALA A 133 5.402 12.341 1.446 1.00 30.44 O ATOM 1967 CB ALA A 133 2.455 11.046 1.404 1.00 4.13 C ATOM 0 H ALA A 133 3.693 13.907 1.066 1.00 31.31 H new ATOM 0 HA ALA A 133 2.672 12.279 3.138 1.00 62.02 H new ATOM 0 HB1 ALA A 133 2.651 10.117 1.939 1.00 4.13 H new ATOM 0 HB2 ALA A 133 1.379 11.212 1.347 1.00 4.13 H new ATOM 0 HB3 ALA A 133 2.866 10.978 0.397 1.00 4.13 H new ATOM 1973 N ARG A 134 4.978 11.313 3.403 1.00 34.21 N ATOM 1974 CA ARG A 134 6.379 11.015 3.676 1.00 14.14 C ATOM 1975 C ARG A 134 6.613 9.509 3.739 1.00 40.42 C ATOM 1976 O ARG A 134 7.666 9.017 3.334 1.00 3.45 O ATOM 1977 CB ARG A 134 6.814 11.665 4.991 1.00 1.44 C ATOM 1978 CG ARG A 134 7.926 10.913 5.703 1.00 60.12 C ATOM 1979 CD ARG A 134 8.413 11.669 6.930 1.00 62.13 C ATOM 1980 NE ARG A 134 9.349 10.878 7.725 1.00 63.22 N ATOM 1981 CZ ARG A 134 9.951 11.332 8.818 1.00 74.33 C ATOM 1982 NH1 ARG A 134 9.717 12.566 9.244 1.00 1.02 N ATOM 1983 NH2 ARG A 134 10.790 10.552 9.488 1.00 24.20 N ATOM 0 H ARG A 134 4.330 10.988 4.121 1.00 34.21 H new ATOM 0 HA ARG A 134 6.976 11.424 2.861 1.00 14.14 H new ATOM 0 HB2 ARG A 134 7.146 12.684 4.791 1.00 1.44 H new ATOM 0 HB3 ARG A 134 5.952 11.736 5.654 1.00 1.44 H new ATOM 0 HG2 ARG A 134 7.568 9.927 6.000 1.00 60.12 H new ATOM 0 HG3 ARG A 134 8.758 10.756 5.017 1.00 60.12 H new ATOM 0 HD2 ARG A 134 8.896 12.595 6.617 1.00 62.13 H new ATOM 0 HD3 ARG A 134 7.559 11.947 7.547 1.00 62.13 H new ATOM 0 HE ARG A 134 9.551 9.925 7.424 1.00 63.22 H new ATOM 0 HH11 ARG A 134 9.073 13.169 8.732 1.00 1.02 H new ATOM 0 HH12 ARG A 134 10.181 12.912 10.084 1.00 1.02 H new ATOM 0 HH21 ARG A 134 10.973 9.602 9.163 1.00 24.20 H new ATOM 0 HH22 ARG A 134 11.252 10.902 10.327 1.00 24.20 H new ATOM 1994 N TYR A 135 5.625 8.783 4.250 1.00 43.41 N ATOM 1995 CA TYR A 135 5.724 7.333 4.369 1.00 61.32 C ATOM 1996 C TYR A 135 4.372 6.672 4.120 1.00 74.03 C ATOM 1997 O TYR A 135 3.324 7.304 4.260 1.00 31.32 O ATOM 1998 CB TYR A 135 6.245 6.949 5.754 1.00 70.11 C ATOM 1999 CG TYR A 135 5.863 7.931 6.839 1.00 22.32 C ATOM 2000 CD1 TYR A 135 4.559 8.397 6.954 1.00 14.25 C ATOM 2001 CD2 TYR A 135 6.806 8.392 7.749 1.00 23.04 C ATOM 2002 CE1 TYR A 135 4.207 9.294 7.942 1.00 75.33 C ATOM 2003 CE2 TYR A 135 6.462 9.287 8.743 1.00 54.44 C ATOM 2004 CZ TYR A 135 5.161 9.737 8.835 1.00 1.53 C ATOM 2005 OH TYR A 135 4.813 10.631 9.822 1.00 22.24 O ATOM 0 H TYR A 135 4.746 9.175 4.589 1.00 43.41 H new ATOM 0 HA TYR A 135 6.425 6.979 3.613 1.00 61.32 H new ATOM 0 HB2 TYR A 135 5.861 5.963 6.017 1.00 70.11 H new ATOM 0 HB3 TYR A 135 7.331 6.868 5.715 1.00 70.11 H new ATOM 0 HD1 TYR A 135 3.808 8.051 6.259 1.00 14.25 H new ATOM 0 HD2 TYR A 135 7.826 8.044 7.678 1.00 23.04 H new ATOM 0 HE1 TYR A 135 3.189 9.648 8.016 1.00 75.33 H new ATOM 0 HE2 TYR A 135 7.207 9.633 9.444 1.00 54.44 H new ATOM 0 HH TYR A 135 5.601 10.840 10.366 1.00 22.24 H new ATOM 2014 N VAL A 136 4.403 5.397 3.751 1.00 25.24 N ATOM 2015 CA VAL A 136 3.181 4.647 3.485 1.00 45.53 C ATOM 2016 C VAL A 136 3.164 3.330 4.252 1.00 50.23 C ATOM 2017 O VAL A 136 4.210 2.721 4.482 1.00 74.33 O ATOM 2018 CB VAL A 136 3.019 4.355 1.980 1.00 21.32 C ATOM 2019 CG1 VAL A 136 3.338 5.593 1.158 1.00 10.11 C ATOM 2020 CG2 VAL A 136 3.902 3.187 1.568 1.00 11.11 C ATOM 0 H VAL A 136 5.262 4.860 3.629 1.00 25.24 H new ATOM 0 HA VAL A 136 2.350 5.268 3.820 1.00 45.53 H new ATOM 0 HB VAL A 136 1.981 4.081 1.789 1.00 21.32 H new ATOM 0 HG11 VAL A 136 3.218 5.367 0.098 1.00 10.11 H new ATOM 0 HG12 VAL A 136 2.659 6.399 1.436 1.00 10.11 H new ATOM 0 HG13 VAL A 136 4.366 5.902 1.349 1.00 10.11 H new ATOM 0 HG21 VAL A 136 3.776 2.994 0.503 1.00 11.11 H new ATOM 0 HG22 VAL A 136 4.945 3.430 1.772 1.00 11.11 H new ATOM 0 HG23 VAL A 136 3.619 2.299 2.134 1.00 11.11 H new ATOM 2030 N ARG A 137 1.972 2.896 4.645 1.00 63.23 N ATOM 2031 CA ARG A 137 1.819 1.650 5.388 1.00 74.35 C ATOM 2032 C ARG A 137 0.871 0.699 4.664 1.00 64.51 C ATOM 2033 O ARG A 137 -0.190 1.104 4.189 1.00 5.12 O ATOM 2034 CB ARG A 137 1.296 1.934 6.797 1.00 34.22 C ATOM 2035 CG ARG A 137 1.164 0.689 7.660 1.00 33.00 C ATOM 2036 CD ARG A 137 0.320 0.955 8.896 1.00 12.25 C ATOM 2037 NE ARG A 137 0.788 2.124 9.638 1.00 45.31 N ATOM 2038 CZ ARG A 137 0.097 2.698 10.615 1.00 35.11 C ATOM 2039 NH1 ARG A 137 -1.086 2.214 10.969 1.00 50.22 N ATOM 2040 NH2 ARG A 137 0.589 3.759 11.242 1.00 52.42 N ATOM 0 H ARG A 137 1.097 3.388 4.462 1.00 63.23 H new ATOM 0 HA ARG A 137 2.798 1.175 5.460 1.00 74.35 H new ATOM 0 HB2 ARG A 137 1.967 2.638 7.290 1.00 34.22 H new ATOM 0 HB3 ARG A 137 0.323 2.420 6.723 1.00 34.22 H new ATOM 0 HG2 ARG A 137 0.713 -0.114 7.076 1.00 33.00 H new ATOM 0 HG3 ARG A 137 2.154 0.347 7.961 1.00 33.00 H new ATOM 0 HD2 ARG A 137 -0.718 1.105 8.600 1.00 12.25 H new ATOM 0 HD3 ARG A 137 0.343 0.080 9.546 1.00 12.25 H new ATOM 0 HE ARG A 137 1.695 2.520 9.392 1.00 45.31 H new ATOM 0 HH11 ARG A 137 -1.467 1.398 10.490 1.00 50.22 H new ATOM 0 HH12 ARG A 137 -1.614 2.658 11.720 1.00 50.22 H new ATOM 0 HH21 ARG A 137 1.499 4.134 10.973 1.00 52.42 H new ATOM 0 HH22 ARG A 137 0.057 4.200 11.993 1.00 52.42 H new ATOM 2051 N VAL A 138 1.261 -0.569 4.584 1.00 31.34 N ATOM 2052 CA VAL A 138 0.447 -1.579 3.920 1.00 3.04 C ATOM 2053 C VAL A 138 0.272 -2.812 4.801 1.00 4.30 C ATOM 2054 O VAL A 138 1.212 -3.252 5.464 1.00 25.04 O ATOM 2055 CB VAL A 138 1.067 -2.006 2.576 1.00 20.15 C ATOM 2056 CG1 VAL A 138 0.106 -2.895 1.801 1.00 11.22 C ATOM 2057 CG2 VAL A 138 1.455 -0.784 1.757 1.00 30.25 C ATOM 0 H VAL A 138 2.136 -0.921 4.971 1.00 31.34 H new ATOM 0 HA VAL A 138 -0.528 -1.127 3.735 1.00 3.04 H new ATOM 0 HB VAL A 138 1.970 -2.581 2.779 1.00 20.15 H new ATOM 0 HG11 VAL A 138 0.562 -3.186 0.855 1.00 11.22 H new ATOM 0 HG12 VAL A 138 -0.116 -3.787 2.386 1.00 11.22 H new ATOM 0 HG13 VAL A 138 -0.817 -2.350 1.606 1.00 11.22 H new ATOM 0 HG21 VAL A 138 1.891 -1.104 0.811 1.00 30.25 H new ATOM 0 HG22 VAL A 138 0.569 -0.180 1.562 1.00 30.25 H new ATOM 0 HG23 VAL A 138 2.183 -0.191 2.311 1.00 30.25 H new ATOM 2067 N LEU A 139 -0.935 -3.365 4.802 1.00 41.33 N ATOM 2068 CA LEU A 139 -1.235 -4.548 5.601 1.00 0.24 C ATOM 2069 C LEU A 139 -2.097 -5.531 4.817 1.00 42.41 C ATOM 2070 O LEU A 139 -3.326 -5.468 4.835 1.00 45.45 O ATOM 2071 CB LEU A 139 -1.946 -4.147 6.895 1.00 44.22 C ATOM 2072 CG LEU A 139 -1.771 -5.099 8.079 1.00 31.50 C ATOM 2073 CD1 LEU A 139 -2.013 -4.369 9.391 1.00 11.15 C ATOM 2074 CD2 LEU A 139 -2.710 -6.290 7.949 1.00 31.21 C ATOM 0 H LEU A 139 -1.723 -3.013 4.258 1.00 41.33 H new ATOM 0 HA LEU A 139 -0.293 -5.037 5.848 1.00 0.24 H new ATOM 0 HB2 LEU A 139 -1.589 -3.161 7.192 1.00 44.22 H new ATOM 0 HB3 LEU A 139 -3.011 -4.051 6.686 1.00 44.22 H new ATOM 0 HG LEU A 139 -0.745 -5.468 8.075 1.00 31.50 H new ATOM 0 HD11 LEU A 139 -1.884 -5.062 10.222 1.00 11.15 H new ATOM 0 HD12 LEU A 139 -1.301 -3.550 9.488 1.00 11.15 H new ATOM 0 HD13 LEU A 139 -3.028 -3.971 9.404 1.00 11.15 H new ATOM 0 HD21 LEU A 139 -2.572 -6.957 8.800 1.00 31.21 H new ATOM 0 HD22 LEU A 139 -3.742 -5.939 7.927 1.00 31.21 H new ATOM 0 HD23 LEU A 139 -2.490 -6.828 7.027 1.00 31.21 H new ATOM 2085 N PRO A 140 -1.439 -6.464 4.113 1.00 44.04 N ATOM 2086 CA PRO A 140 -2.126 -7.481 3.310 1.00 62.01 C ATOM 2087 C PRO A 140 -2.855 -8.506 4.174 1.00 41.42 C ATOM 2088 O PRO A 140 -2.376 -8.883 5.243 1.00 60.10 O ATOM 2089 CB PRO A 140 -0.989 -8.149 2.533 1.00 53.30 C ATOM 2090 CG PRO A 140 0.223 -7.929 3.373 1.00 42.14 C ATOM 2091 CD PRO A 140 0.025 -6.599 4.045 1.00 3.32 C ATOM 0 HA PRO A 140 -2.896 -7.045 2.674 1.00 62.01 H new ATOM 0 HB2 PRO A 140 -1.181 -9.212 2.385 1.00 53.30 H new ATOM 0 HB3 PRO A 140 -0.871 -7.706 1.544 1.00 53.30 H new ATOM 0 HG2 PRO A 140 0.337 -8.725 4.109 1.00 42.14 H new ATOM 0 HG3 PRO A 140 1.126 -7.927 2.762 1.00 42.14 H new ATOM 0 HD2 PRO A 140 0.477 -6.579 5.037 1.00 3.32 H new ATOM 0 HD3 PRO A 140 0.477 -5.789 3.473 1.00 3.32 H new ATOM 2096 N VAL A 141 -4.014 -8.953 3.702 1.00 43.32 N ATOM 2097 CA VAL A 141 -4.808 -9.936 4.430 1.00 51.31 C ATOM 2098 C VAL A 141 -5.108 -11.152 3.561 1.00 62.33 C ATOM 2099 O VAL A 141 -4.964 -12.293 4.001 1.00 54.01 O ATOM 2100 CB VAL A 141 -6.136 -9.330 4.924 1.00 5.34 C ATOM 2101 CG1 VAL A 141 -6.941 -10.366 5.692 1.00 63.11 C ATOM 2102 CG2 VAL A 141 -5.874 -8.102 5.782 1.00 74.21 C ATOM 0 H VAL A 141 -4.424 -8.650 2.819 1.00 43.32 H new ATOM 0 HA VAL A 141 -4.217 -10.246 5.291 1.00 51.31 H new ATOM 0 HB VAL A 141 -6.720 -9.021 4.057 1.00 5.34 H new ATOM 0 HG11 VAL A 141 -7.876 -9.921 6.033 1.00 63.11 H new ATOM 0 HG12 VAL A 141 -7.159 -11.213 5.041 1.00 63.11 H new ATOM 0 HG13 VAL A 141 -6.366 -10.708 6.553 1.00 63.11 H new ATOM 0 HG21 VAL A 141 -6.823 -7.687 6.122 1.00 74.21 H new ATOM 0 HG22 VAL A 141 -5.270 -8.383 6.645 1.00 74.21 H new ATOM 0 HG23 VAL A 141 -5.341 -7.355 5.194 1.00 74.21 H new ATOM 2112 N SER A 142 -5.526 -10.901 2.325 1.00 0.41 N ATOM 2113 CA SER A 142 -5.850 -11.976 1.395 1.00 64.33 C ATOM 2114 C SER A 142 -4.921 -11.946 0.185 1.00 1.44 C ATOM 2115 O SER A 142 -4.971 -11.023 -0.628 1.00 65.50 O ATOM 2116 CB SER A 142 -7.305 -11.861 0.936 1.00 70.24 C ATOM 2117 OG SER A 142 -8.120 -11.313 1.958 1.00 2.32 O ATOM 0 H SER A 142 -5.648 -9.963 1.944 1.00 0.41 H new ATOM 0 HA SER A 142 -5.713 -12.925 1.914 1.00 64.33 H new ATOM 0 HB2 SER A 142 -7.361 -11.234 0.046 1.00 70.24 H new ATOM 0 HB3 SER A 142 -7.680 -12.845 0.656 1.00 70.24 H new ATOM 0 HG SER A 142 -9.045 -11.248 1.640 1.00 2.32 H new ATOM 2122 N TRP A 143 -4.072 -12.962 0.075 1.00 72.35 N ATOM 2123 CA TRP A 143 -3.130 -13.054 -1.035 1.00 61.22 C ATOM 2124 C TRP A 143 -3.294 -14.373 -1.781 1.00 23.11 C ATOM 2125 O TRP A 143 -4.123 -15.206 -1.414 1.00 22.33 O ATOM 2126 CB TRP A 143 -1.695 -12.916 -0.525 1.00 22.02 C ATOM 2127 CG TRP A 143 -1.267 -14.050 0.359 1.00 4.20 C ATOM 2128 CD1 TRP A 143 -0.476 -15.107 0.010 1.00 54.32 C ATOM 2129 CD2 TRP A 143 -1.610 -14.240 1.735 1.00 65.43 C ATOM 2130 NE1 TRP A 143 -0.306 -15.943 1.087 1.00 54.51 N ATOM 2131 CE2 TRP A 143 -0.992 -15.432 2.158 1.00 0.13 C ATOM 2132 CE3 TRP A 143 -2.378 -13.518 2.652 1.00 74.24 C ATOM 2133 CZ2 TRP A 143 -1.119 -15.917 3.457 1.00 52.12 C ATOM 2134 CZ3 TRP A 143 -2.505 -14.000 3.942 1.00 3.33 C ATOM 2135 CH2 TRP A 143 -1.877 -15.190 4.334 1.00 21.20 C ATOM 0 H TRP A 143 -4.017 -13.733 0.740 1.00 72.35 H new ATOM 0 HA TRP A 143 -3.342 -12.239 -1.727 1.00 61.22 H new ATOM 0 HB2 TRP A 143 -1.018 -12.854 -1.377 1.00 22.02 H new ATOM 0 HB3 TRP A 143 -1.601 -11.980 0.026 1.00 22.02 H new ATOM 0 HD1 TRP A 143 -0.047 -15.263 -0.969 1.00 54.32 H new ATOM 0 HE1 TRP A 143 0.241 -16.804 1.089 1.00 54.51 H new ATOM 0 HE3 TRP A 143 -2.864 -12.599 2.359 1.00 74.24 H new ATOM 0 HZ2 TRP A 143 -0.637 -16.834 3.761 1.00 52.12 H new ATOM 0 HZ3 TRP A 143 -3.097 -13.451 4.659 1.00 3.33 H new ATOM 0 HH2 TRP A 143 -1.994 -15.540 5.349 1.00 21.20 H new ATOM 2145 N HIS A 144 -2.498 -14.558 -2.829 1.00 0.11 N ATOM 2146 CA HIS A 144 -2.555 -15.778 -3.627 1.00 32.42 C ATOM 2147 C HIS A 144 -1.180 -16.433 -3.718 1.00 13.43 C ATOM 2148 O HIS A 144 -0.209 -15.803 -4.137 1.00 71.32 O ATOM 2149 CB HIS A 144 -3.082 -15.473 -5.029 1.00 43.13 C ATOM 2150 CG HIS A 144 -4.312 -16.248 -5.389 1.00 53.52 C ATOM 2151 ND1 HIS A 144 -4.311 -17.277 -6.307 1.00 2.13 N ATOM 2152 CD2 HIS A 144 -5.587 -16.140 -4.949 1.00 33.13 C ATOM 2153 CE1 HIS A 144 -5.532 -17.768 -6.416 1.00 73.55 C ATOM 2154 NE2 HIS A 144 -6.326 -17.095 -5.601 1.00 3.00 N ATOM 0 H HIS A 144 -1.806 -13.879 -3.146 1.00 0.11 H new ATOM 0 HA HIS A 144 -3.236 -16.472 -3.135 1.00 32.42 H new ATOM 0 HB2 HIS A 144 -3.300 -14.407 -5.102 1.00 43.13 H new ATOM 0 HB3 HIS A 144 -2.300 -15.690 -5.757 1.00 43.13 H new ATOM 0 HD2 HIS A 144 -5.955 -15.433 -4.220 1.00 33.13 H new ATOM 0 HE1 HIS A 144 -5.831 -18.581 -7.061 1.00 73.55 H new ATOM 0 HE2 HIS A 144 -7.325 -17.259 -5.477 1.00 3.00 H new ATOM 2161 N ASN A 145 -1.105 -17.700 -3.323 1.00 54.34 N ATOM 2162 CA ASN A 145 0.153 -18.438 -3.360 1.00 72.43 C ATOM 2163 C ASN A 145 1.080 -17.987 -2.235 1.00 4.41 C ATOM 2164 O ASN A 145 1.353 -18.743 -1.302 1.00 14.40 O ATOM 2165 CB ASN A 145 0.842 -18.247 -4.712 1.00 62.12 C ATOM 2166 CG ASN A 145 -0.143 -18.236 -5.866 1.00 33.20 C ATOM 2167 OD1 ASN A 145 -0.511 -17.176 -6.373 1.00 14.13 O ATOM 2168 ND2 ASN A 145 -0.575 -19.419 -6.286 1.00 1.44 N ATOM 0 H ASN A 145 -1.899 -18.237 -2.974 1.00 54.34 H new ATOM 0 HA ASN A 145 -0.071 -19.496 -3.221 1.00 72.43 H new ATOM 0 HB2 ASN A 145 1.399 -17.310 -4.704 1.00 62.12 H new ATOM 0 HB3 ASN A 145 1.567 -19.047 -4.864 1.00 62.12 H new ATOM 0 HD21 ASN A 145 -1.239 -19.475 -7.058 1.00 1.44 H new ATOM 0 HD22 ASN A 145 -0.243 -20.272 -5.836 1.00 1.44 H new ATOM 2174 N ARG A 146 1.562 -16.753 -2.332 1.00 75.21 N ATOM 2175 CA ARG A 146 2.459 -16.201 -1.324 1.00 1.03 C ATOM 2176 C ARG A 146 2.603 -14.692 -1.490 1.00 44.11 C ATOM 2177 O ARG A 146 2.579 -14.176 -2.609 1.00 61.32 O ATOM 2178 CB ARG A 146 3.834 -16.869 -1.414 1.00 41.05 C ATOM 2179 CG ARG A 146 4.854 -16.296 -0.444 1.00 43.43 C ATOM 2180 CD ARG A 146 4.529 -16.673 0.993 1.00 51.22 C ATOM 2181 NE ARG A 146 5.194 -17.908 1.398 1.00 70.44 N ATOM 2182 CZ ARG A 146 6.488 -17.987 1.684 1.00 44.12 C ATOM 2183 NH1 ARG A 146 7.254 -16.907 1.609 1.00 32.11 N ATOM 2184 NH2 ARG A 146 7.019 -19.148 2.045 1.00 31.00 N ATOM 0 H ARG A 146 1.346 -16.116 -3.099 1.00 75.21 H new ATOM 0 HA ARG A 146 2.028 -16.401 -0.343 1.00 1.03 H new ATOM 0 HB2 ARG A 146 3.723 -17.936 -1.223 1.00 41.05 H new ATOM 0 HB3 ARG A 146 4.213 -16.765 -2.431 1.00 41.05 H new ATOM 0 HG2 ARG A 146 5.848 -16.662 -0.701 1.00 43.43 H new ATOM 0 HG3 ARG A 146 4.879 -15.211 -0.540 1.00 43.43 H new ATOM 0 HD2 ARG A 146 4.831 -15.864 1.657 1.00 51.22 H new ATOM 0 HD3 ARG A 146 3.451 -16.789 1.102 1.00 51.22 H new ATOM 0 HE ARG A 146 4.633 -18.757 1.465 1.00 70.44 H new ATOM 0 HH11 ARG A 146 6.849 -16.013 1.331 1.00 32.11 H new ATOM 0 HH12 ARG A 146 8.248 -16.970 1.829 1.00 32.11 H new ATOM 0 HH21 ARG A 146 6.433 -19.981 2.103 1.00 31.00 H new ATOM 0 HH22 ARG A 146 8.013 -19.208 2.265 1.00 31.00 H new ATOM 2195 N ILE A 147 2.753 -13.990 -0.372 1.00 43.34 N ATOM 2196 CA ILE A 147 2.900 -12.540 -0.395 1.00 52.10 C ATOM 2197 C ILE A 147 4.163 -12.128 -1.146 1.00 73.44 C ATOM 2198 O ILE A 147 5.239 -12.017 -0.558 1.00 2.44 O ATOM 2199 CB ILE A 147 2.950 -11.956 1.029 1.00 2.15 C ATOM 2200 CG1 ILE A 147 1.618 -12.188 1.745 1.00 33.14 C ATOM 2201 CG2 ILE A 147 3.281 -10.472 0.982 1.00 73.43 C ATOM 2202 CD1 ILE A 147 1.547 -13.512 2.474 1.00 61.33 C ATOM 0 H ILE A 147 2.776 -14.402 0.561 1.00 43.34 H new ATOM 0 HA ILE A 147 2.026 -12.142 -0.911 1.00 52.10 H new ATOM 0 HB ILE A 147 3.735 -12.465 1.588 1.00 2.15 H new ATOM 0 HG12 ILE A 147 1.452 -11.380 2.458 1.00 33.14 H new ATOM 0 HG13 ILE A 147 0.809 -12.140 1.016 1.00 33.14 H new ATOM 0 HG21 ILE A 147 3.313 -10.074 1.996 1.00 73.43 H new ATOM 0 HG22 ILE A 147 4.251 -10.331 0.506 1.00 73.43 H new ATOM 0 HG23 ILE A 147 2.516 -9.947 0.410 1.00 73.43 H new ATOM 0 HD11 ILE A 147 0.575 -13.609 2.958 1.00 61.33 H new ATOM 0 HD12 ILE A 147 1.681 -14.327 1.762 1.00 61.33 H new ATOM 0 HD13 ILE A 147 2.334 -13.555 3.227 1.00 61.33 H new ATOM 2213 N THR A 148 4.023 -11.900 -2.448 1.00 72.24 N ATOM 2214 CA THR A 148 5.150 -11.500 -3.279 1.00 55.21 C ATOM 2215 C THR A 148 4.728 -10.469 -4.319 1.00 50.34 C ATOM 2216 O THR A 148 4.047 -10.797 -5.293 1.00 71.24 O ATOM 2217 CB THR A 148 5.777 -12.710 -3.997 1.00 41.03 C ATOM 2218 OG1 THR A 148 5.456 -13.916 -3.295 1.00 1.23 O ATOM 2219 CG2 THR A 148 7.288 -12.559 -4.094 1.00 73.23 C ATOM 0 H THR A 148 3.139 -11.986 -2.950 1.00 72.24 H new ATOM 0 HA THR A 148 5.891 -11.058 -2.613 1.00 55.21 H new ATOM 0 HB THR A 148 5.368 -12.758 -5.006 1.00 41.03 H new ATOM 0 HG1 THR A 148 5.857 -14.681 -3.758 1.00 1.23 H new ATOM 0 HG21 THR A 148 7.708 -13.425 -4.605 1.00 73.23 H new ATOM 0 HG22 THR A 148 7.528 -11.656 -4.655 1.00 73.23 H new ATOM 0 HG23 THR A 148 7.712 -12.488 -3.092 1.00 73.23 H new ATOM 2227 N LEU A 149 5.136 -9.222 -4.111 1.00 62.41 N ATOM 2228 CA LEU A 149 4.800 -8.142 -5.032 1.00 51.13 C ATOM 2229 C LEU A 149 5.608 -6.887 -4.718 1.00 73.40 C ATOM 2230 O LEU A 149 6.321 -6.830 -3.715 1.00 70.21 O ATOM 2231 CB LEU A 149 3.304 -7.830 -4.959 1.00 44.21 C ATOM 2232 CG LEU A 149 2.833 -7.090 -3.707 1.00 44.53 C ATOM 2233 CD1 LEU A 149 3.506 -7.655 -2.468 1.00 34.52 C ATOM 2234 CD2 LEU A 149 3.109 -5.598 -3.834 1.00 5.50 C ATOM 0 H LEU A 149 5.701 -8.934 -3.312 1.00 62.41 H new ATOM 0 HA LEU A 149 5.048 -8.469 -6.042 1.00 51.13 H new ATOM 0 HB2 LEU A 149 3.034 -7.235 -5.831 1.00 44.21 H new ATOM 0 HB3 LEU A 149 2.754 -8.768 -5.031 1.00 44.21 H new ATOM 0 HG LEU A 149 1.757 -7.233 -3.607 1.00 44.53 H new ATOM 0 HD11 LEU A 149 3.158 -7.116 -1.587 1.00 34.52 H new ATOM 0 HD12 LEU A 149 3.257 -8.711 -2.368 1.00 34.52 H new ATOM 0 HD13 LEU A 149 4.587 -7.544 -2.558 1.00 34.52 H new ATOM 0 HD21 LEU A 149 2.767 -5.087 -2.934 1.00 5.50 H new ATOM 0 HD22 LEU A 149 4.179 -5.435 -3.959 1.00 5.50 H new ATOM 0 HD23 LEU A 149 2.578 -5.202 -4.700 1.00 5.50 H new ATOM 2245 N ARG A 150 5.491 -5.883 -5.580 1.00 54.24 N ATOM 2246 CA ARG A 150 6.209 -4.628 -5.393 1.00 54.44 C ATOM 2247 C ARG A 150 5.268 -3.435 -5.533 1.00 64.35 C ATOM 2248 O ARG A 150 4.695 -3.205 -6.600 1.00 73.23 O ATOM 2249 CB ARG A 150 7.349 -4.513 -6.408 1.00 12.04 C ATOM 2250 CG ARG A 150 7.974 -3.129 -6.467 1.00 41.22 C ATOM 2251 CD ARG A 150 7.665 -2.434 -7.785 1.00 21.21 C ATOM 2252 NE ARG A 150 8.081 -3.233 -8.934 1.00 24.21 N ATOM 2253 CZ ARG A 150 8.251 -2.734 -10.154 1.00 62.51 C ATOM 2254 NH1 ARG A 150 8.041 -1.445 -10.380 1.00 4.24 N ATOM 2255 NH2 ARG A 150 8.630 -3.526 -11.149 1.00 52.13 N ATOM 0 H ARG A 150 4.906 -5.914 -6.415 1.00 54.24 H new ATOM 0 HA ARG A 150 6.625 -4.624 -4.385 1.00 54.44 H new ATOM 0 HB2 ARG A 150 8.121 -5.241 -6.159 1.00 12.04 H new ATOM 0 HB3 ARG A 150 6.972 -4.775 -7.397 1.00 12.04 H new ATOM 0 HG2 ARG A 150 7.602 -2.525 -5.640 1.00 41.22 H new ATOM 0 HG3 ARG A 150 9.054 -3.210 -6.342 1.00 41.22 H new ATOM 0 HD2 ARG A 150 6.595 -2.237 -7.849 1.00 21.21 H new ATOM 0 HD3 ARG A 150 8.170 -1.468 -7.813 1.00 21.21 H new ATOM 0 HE ARG A 150 8.250 -4.229 -8.793 1.00 24.21 H new ATOM 0 HH11 ARG A 150 7.749 -0.834 -9.617 1.00 4.24 H new ATOM 0 HH12 ARG A 150 8.172 -1.064 -11.317 1.00 4.24 H new ATOM 0 HH21 ARG A 150 8.791 -4.519 -10.978 1.00 52.13 H new ATOM 0 HH22 ARG A 150 8.760 -3.142 -12.085 1.00 52.13 H new ATOM 2266 N LEU A 151 5.111 -2.682 -4.451 1.00 51.32 N ATOM 2267 CA LEU A 151 4.237 -1.513 -4.453 1.00 54.52 C ATOM 2268 C LEU A 151 5.053 -0.224 -4.501 1.00 64.21 C ATOM 2269 O LEU A 151 5.814 0.075 -3.581 1.00 64.43 O ATOM 2270 CB LEU A 151 3.344 -1.518 -3.211 1.00 1.21 C ATOM 2271 CG LEU A 151 4.064 -1.612 -1.866 1.00 24.12 C ATOM 2272 CD1 LEU A 151 4.095 -0.256 -1.180 1.00 15.31 C ATOM 2273 CD2 LEU A 151 3.394 -2.648 -0.974 1.00 64.33 C ATOM 0 H LEU A 151 5.577 -2.859 -3.561 1.00 51.32 H new ATOM 0 HA LEU A 151 3.611 -1.559 -5.344 1.00 54.52 H new ATOM 0 HB2 LEU A 151 2.744 -0.608 -3.216 1.00 1.21 H new ATOM 0 HB3 LEU A 151 2.652 -2.357 -3.289 1.00 1.21 H new ATOM 0 HG LEU A 151 5.092 -1.927 -2.047 1.00 24.12 H new ATOM 0 HD11 LEU A 151 4.612 -0.344 -0.224 1.00 15.31 H new ATOM 0 HD12 LEU A 151 4.620 0.460 -1.812 1.00 15.31 H new ATOM 0 HD13 LEU A 151 3.075 0.090 -1.011 1.00 15.31 H new ATOM 0 HD21 LEU A 151 3.920 -2.702 -0.021 1.00 64.33 H new ATOM 0 HD22 LEU A 151 2.356 -2.363 -0.801 1.00 64.33 H new ATOM 0 HD23 LEU A 151 3.426 -3.623 -1.461 1.00 64.33 H new ATOM 2284 N GLU A 152 4.886 0.536 -5.579 1.00 24.22 N ATOM 2285 CA GLU A 152 5.606 1.793 -5.746 1.00 62.22 C ATOM 2286 C GLU A 152 4.638 2.971 -5.790 1.00 55.53 C ATOM 2287 O GLU A 152 3.543 2.870 -6.344 1.00 40.14 O ATOM 2288 CB GLU A 152 6.446 1.759 -7.025 1.00 73.44 C ATOM 2289 CG GLU A 152 7.859 2.286 -6.838 1.00 41.11 C ATOM 2290 CD GLU A 152 8.914 1.310 -7.322 1.00 65.24 C ATOM 2291 OE1 GLU A 152 9.132 1.235 -8.550 1.00 31.41 O ATOM 2292 OE2 GLU A 152 9.519 0.621 -6.475 1.00 11.21 O ATOM 0 H GLU A 152 4.259 0.303 -6.349 1.00 24.22 H new ATOM 0 HA GLU A 152 6.268 1.921 -4.889 1.00 62.22 H new ATOM 0 HB2 GLU A 152 6.495 0.733 -7.391 1.00 73.44 H new ATOM 0 HB3 GLU A 152 5.946 2.348 -7.794 1.00 73.44 H new ATOM 0 HG2 GLU A 152 7.966 3.228 -7.377 1.00 41.11 H new ATOM 0 HG3 GLU A 152 8.026 2.502 -5.783 1.00 41.11 H new ATOM 2297 N LEU A 153 5.050 4.089 -5.203 1.00 54.00 N ATOM 2298 CA LEU A 153 4.221 5.289 -5.175 1.00 75.45 C ATOM 2299 C LEU A 153 4.800 6.374 -6.076 1.00 35.34 C ATOM 2300 O LEU A 153 6.015 6.576 -6.119 1.00 40.14 O ATOM 2301 CB LEU A 153 4.095 5.812 -3.743 1.00 32.22 C ATOM 2302 CG LEU A 153 5.372 6.378 -3.120 1.00 21.23 C ATOM 2303 CD1 LEU A 153 5.223 7.867 -2.854 1.00 70.12 C ATOM 2304 CD2 LEU A 153 5.714 5.636 -1.836 1.00 61.50 C ATOM 0 H LEU A 153 5.953 4.190 -4.740 1.00 54.00 H new ATOM 0 HA LEU A 153 3.231 5.025 -5.548 1.00 75.45 H new ATOM 0 HB2 LEU A 153 3.331 6.590 -3.727 1.00 32.22 H new ATOM 0 HB3 LEU A 153 3.736 5.000 -3.111 1.00 32.22 H new ATOM 0 HG LEU A 153 6.190 6.237 -3.826 1.00 21.23 H new ATOM 0 HD11 LEU A 153 6.142 8.251 -2.411 1.00 70.12 H new ATOM 0 HD12 LEU A 153 5.028 8.386 -3.792 1.00 70.12 H new ATOM 0 HD13 LEU A 153 4.392 8.033 -2.168 1.00 70.12 H new ATOM 0 HD21 LEU A 153 6.625 6.052 -1.407 1.00 61.50 H new ATOM 0 HD22 LEU A 153 4.896 5.744 -1.124 1.00 61.50 H new ATOM 0 HD23 LEU A 153 5.866 4.579 -2.056 1.00 61.50 H new ATOM 2315 N LEU A 154 3.926 7.072 -6.791 1.00 4.50 N ATOM 2316 CA LEU A 154 4.351 8.139 -7.690 1.00 11.01 C ATOM 2317 C LEU A 154 3.704 9.465 -7.305 1.00 75.11 C ATOM 2318 O LEU A 154 2.577 9.498 -6.813 1.00 54.54 O ATOM 2319 CB LEU A 154 3.996 7.787 -9.136 1.00 12.42 C ATOM 2320 CG LEU A 154 4.404 6.390 -9.605 1.00 42.12 C ATOM 2321 CD1 LEU A 154 3.327 5.374 -9.257 1.00 15.21 C ATOM 2322 CD2 LEU A 154 4.676 6.389 -11.103 1.00 23.41 C ATOM 0 H LEU A 154 2.918 6.919 -6.766 1.00 4.50 H new ATOM 0 HA LEU A 154 5.432 8.244 -7.603 1.00 11.01 H new ATOM 0 HB2 LEU A 154 2.918 7.890 -9.260 1.00 12.42 H new ATOM 0 HB3 LEU A 154 4.464 8.520 -9.793 1.00 12.42 H new ATOM 0 HG LEU A 154 5.321 6.108 -9.088 1.00 42.12 H new ATOM 0 HD11 LEU A 154 3.635 4.386 -9.599 1.00 15.21 H new ATOM 0 HD12 LEU A 154 3.180 5.355 -8.177 1.00 15.21 H new ATOM 0 HD13 LEU A 154 2.393 5.652 -9.746 1.00 15.21 H new ATOM 0 HD21 LEU A 154 4.965 5.387 -11.420 1.00 23.41 H new ATOM 0 HD22 LEU A 154 3.775 6.692 -11.637 1.00 23.41 H new ATOM 0 HD23 LEU A 154 5.483 7.087 -11.327 1.00 23.41 H new ATOM 2333 N GLY A 155 4.425 10.559 -7.534 1.00 3.22 N ATOM 2334 CA GLY A 155 3.904 11.874 -7.207 1.00 2.53 C ATOM 2335 C GLY A 155 3.994 12.839 -8.372 1.00 40.53 C ATOM 2336 O GLY A 155 4.485 12.485 -9.445 1.00 51.14 O ATOM 0 H GLY A 155 5.361 10.558 -7.940 1.00 3.22 H new ATOM 0 HA2 GLY A 155 2.864 11.782 -6.895 1.00 2.53 H new ATOM 0 HA3 GLY A 155 4.456 12.280 -6.359 1.00 2.53 H new ATOM 2340 N CYS A 156 3.517 14.062 -8.163 1.00 44.05 N ATOM 2341 CA CYS A 156 3.542 15.081 -9.205 1.00 11.22 C ATOM 2342 C CYS A 156 4.795 15.946 -9.089 1.00 42.34 C ATOM 2343 O CYS A 156 5.109 16.726 -9.990 1.00 31.45 O ATOM 2344 CB CYS A 156 2.292 15.960 -9.119 1.00 12.23 C ATOM 2345 SG CYS A 156 1.130 15.736 -10.504 1.00 13.01 S ATOM 0 H CYS A 156 3.108 14.371 -7.281 1.00 44.05 H new ATOM 0 HA CYS A 156 3.557 14.577 -10.171 1.00 11.22 H new ATOM 0 HB2 CYS A 156 1.773 15.745 -8.185 1.00 12.23 H new ATOM 0 HB3 CYS A 156 2.598 17.006 -9.081 1.00 12.23 H new ATOM 2349 N LEU A 157 5.504 15.802 -7.976 1.00 11.32 N ATOM 2350 CA LEU A 157 6.723 16.569 -7.741 1.00 1.11 C ATOM 2351 C LEU A 157 6.431 18.066 -7.731 1.00 45.13 C ATOM 2352 O LEU A 157 7.313 18.882 -7.997 1.00 34.15 O ATOM 2353 CB LEU A 157 7.766 16.248 -8.813 1.00 74.02 C ATOM 2354 CG LEU A 157 9.197 16.043 -8.317 1.00 0.45 C ATOM 2355 CD1 LEU A 157 9.745 17.330 -7.721 1.00 13.44 C ATOM 2356 CD2 LEU A 157 9.251 14.915 -7.297 1.00 32.31 C ATOM 0 H LEU A 157 5.257 15.162 -7.222 1.00 11.32 H new ATOM 0 HA LEU A 157 7.117 16.288 -6.764 1.00 1.11 H new ATOM 0 HB2 LEU A 157 7.452 15.346 -9.338 1.00 74.02 H new ATOM 0 HB3 LEU A 157 7.768 17.057 -9.543 1.00 74.02 H new ATOM 0 HG LEU A 157 9.820 15.767 -9.168 1.00 0.45 H new ATOM 0 HD11 LEU A 157 10.765 17.165 -7.373 1.00 13.44 H new ATOM 0 HD12 LEU A 157 9.743 18.112 -8.480 1.00 13.44 H new ATOM 0 HD13 LEU A 157 9.121 17.637 -6.882 1.00 13.44 H new ATOM 0 HD21 LEU A 157 10.277 14.783 -6.955 1.00 32.31 H new ATOM 0 HD22 LEU A 157 8.614 15.162 -6.448 1.00 32.31 H new ATOM 0 HD23 LEU A 157 8.900 13.991 -7.757 1.00 32.31 H new ATOM 2367 N GLU A 158 5.187 18.419 -7.423 1.00 31.24 N ATOM 2368 CA GLU A 158 4.779 19.818 -7.377 1.00 41.51 C ATOM 2369 C GLU A 158 4.041 20.129 -6.079 1.00 22.35 C ATOM 2370 O GLU A 158 3.771 19.234 -5.279 1.00 71.11 O ATOM 2371 CB GLU A 158 3.889 20.152 -8.576 1.00 70.43 C ATOM 2372 CG GLU A 158 3.647 21.641 -8.759 1.00 74.32 C ATOM 2373 CD GLU A 158 3.817 22.088 -10.198 1.00 61.44 C ATOM 2374 OE1 GLU A 158 3.575 21.267 -11.107 1.00 31.22 O ATOM 2375 OE2 GLU A 158 4.192 23.259 -10.413 1.00 41.34 O ATOM 0 H GLU A 158 4.445 17.756 -7.202 1.00 31.24 H new ATOM 0 HA GLU A 158 5.678 20.433 -7.418 1.00 41.51 H new ATOM 0 HB2 GLU A 158 4.348 19.753 -9.481 1.00 70.43 H new ATOM 0 HB3 GLU A 158 2.930 19.649 -8.457 1.00 70.43 H new ATOM 0 HG2 GLU A 158 2.639 21.885 -8.423 1.00 74.32 H new ATOM 0 HG3 GLU A 158 4.338 22.198 -8.126 1.00 74.32 H new TER 2380 GLU A 158