USER MOD reduce.3.24.130724 H: found=0, std=0, add=1131, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1118 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 71 SER OG : rot 170:sc= -2.6! USER MOD Set 1.2: A 78 CYS SG : rot 60:sc= -2.6! USER MOD Set 2.1: A 73 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 75 ASN : amide:sc= -0.107 X(o=-0.11,f=0) USER MOD Set 3.1: A 53 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 56 THR OG1 : rot 180:sc= -0.0353 USER MOD Set 4.1: A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 59 TYR OH : rot 165:sc=-0.00319 USER MOD Set 5.1: A 3 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 35 GLN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -179:sc= 0 (180deg=-0.0022) USER MOD Single : A 2 ASN : amide:sc= -0.339 K(o=-0.34,f=-2.6!) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ -160:sc= 0.557 (180deg=0.287) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 CYS SG : rot -165:sc= -2.66 USER MOD Single : A 12 SER OG : rot -155:sc= -0.921 USER MOD Single : A 13 ASN : amide:sc= -1.92 K(o=-1.9,f=-6.2!) USER MOD Single : A 16 HIS : no HD1:sc= -2.27! C(o=-2.3!,f=-5.2!) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 36 HIS : no HD1:sc= -2.22 K(o=-2.2,f=-5!) USER MOD Single : A 38 GLN : amide:sc= -0.248 K(o=-0.25,f=-2.3!) USER MOD Single : A 40 GLN : amide:sc= -1.11 K(o=-1.1,f=-2.8!) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 162:sc= -0.63 USER MOD Single : A 50 TYR OH : rot 0:sc= -0.681 USER MOD Single : A 54 THR OG1 : rot -92:sc= 0.693 USER MOD Single : A 58 GLN : amide:sc= -0.228 X(o=-0.23,f=-0.38) USER MOD Single : A 62 MET CE :methyl -153:sc= -0.807 (180deg=-1.87!) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0.0329 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 GLN :FLIP amide:sc= 0 F(o=-1.9!,f=0) USER MOD Single : A 87 ASN : amide:sc= -0.229 K(o=-0.23,f=-2.1!) USER MOD Single : A 88 HIS : no HD1:sc= -0.148 X(o=-0.15,f=-0.49) USER MOD Single : A 89 TYR OH : rot 180:sc= -0.963 USER MOD Single : A 90 ASN : amide:sc= -0.731 K(o=-0.73,f=-2.9!) USER MOD Single : A 91 THR OG1 : rot 166:sc= -0.741 USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 67:sc= 0.638 USER MOD Single : A 95 LYS NZ :NH3+ -174:sc= -1.12 (180deg=-1.29) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 HIS : no HE2:sc= -4.74! X(o=-4.7!,f=-4.4) USER MOD Single : A 100 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.00855) USER MOD Single : A 101 ASN : amide:sc= -2.68 K(o=-2.7,f=-7!) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 CYS SG : rot 30:sc= 0.148 USER MOD Single : A 113 LYS NZ :NH3+ -135:sc= 0 (180deg=-0.126) USER MOD Single : A 118 THR OG1 : rot -82:sc= 0.988 USER MOD Single : A 119 HIS : no HD1:sc= -0.475 X(o=-0.47,f=-0.18) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 GLN :FLIP amide:sc= -1.04 F(o=-2,f=-1) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 138 HIS : no HD1:sc= -0.344 X(o=-0.34,f=-0.68) USER MOD Single : A 139 HIS : no HD1:sc= -0.0514 X(o=-0.051,f=-0.014) USER MOD Single : A 140 HIS : no HD1:sc= -0.16 X(o=-0.16,f=-0.0096) USER MOD Single : A 141 HIS :FLIP no HD1:sc= -0.316 F(o=-0.99,f=-0.32) USER MOD Single : A 142 HIS : no HD1:sc=-0.00543 X(o=-0.0054,f=-0.26) USER MOD Single : A 143 HIS : no HD1:sc= -0.578 K(o=-0.58,f=-1.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 23.074 -9.382 2.169 1.00 0.00 N ATOM 2 CA MET A 1 21.986 -9.912 1.365 1.00 0.00 C ATOM 3 C MET A 1 20.984 -10.677 2.234 1.00 0.00 C ATOM 4 O MET A 1 21.216 -11.833 2.582 1.00 0.00 O ATOM 5 CB MET A 1 22.550 -10.846 0.293 1.00 0.00 C ATOM 6 CG MET A 1 23.258 -10.054 -0.807 1.00 0.00 C ATOM 7 SD MET A 1 22.426 -10.299 -2.367 1.00 0.00 S ATOM 8 CE MET A 1 22.000 -8.611 -2.760 1.00 0.00 C ATOM 0 H1 MET A 1 23.730 -8.854 1.560 1.00 0.00 H new ATOM 0 H2 MET A 1 22.690 -8.747 2.897 1.00 0.00 H new ATOM 0 H3 MET A 1 23.581 -10.166 2.626 1.00 0.00 H new ATOM 0 HA MET A 1 21.467 -9.077 0.894 1.00 0.00 H new ATOM 0 HB2 MET A 1 23.249 -11.548 0.748 1.00 0.00 H new ATOM 0 HB3 MET A 1 21.743 -11.436 -0.141 1.00 0.00 H new ATOM 0 HG2 MET A 1 23.269 -8.994 -0.554 1.00 0.00 H new ATOM 0 HG3 MET A 1 24.297 -10.374 -0.885 1.00 0.00 H new ATOM 0 HE1 MET A 1 21.470 -8.582 -3.712 1.00 0.00 H new ATOM 0 HE2 MET A 1 21.360 -8.205 -1.976 1.00 0.00 H new ATOM 0 HE3 MET A 1 22.909 -8.014 -2.832 1.00 0.00 H new ATOM 18 N ASN A 2 19.893 -10.000 2.558 1.00 0.00 N ATOM 19 CA ASN A 2 18.856 -10.601 3.379 1.00 0.00 C ATOM 20 C ASN A 2 17.788 -9.551 3.695 1.00 0.00 C ATOM 21 O ASN A 2 18.109 -8.389 3.940 1.00 0.00 O ATOM 22 CB ASN A 2 19.427 -11.107 4.705 1.00 0.00 C ATOM 23 CG ASN A 2 18.908 -12.511 5.025 1.00 0.00 C ATOM 24 OD1 ASN A 2 18.113 -13.087 4.301 1.00 0.00 O ATOM 25 ND2 ASN A 2 19.402 -13.027 6.147 1.00 0.00 N ATOM 0 H ASN A 2 19.704 -9.041 2.267 1.00 0.00 H new ATOM 0 HA ASN A 2 18.432 -11.439 2.825 1.00 0.00 H new ATOM 0 HB2 ASN A 2 20.516 -11.120 4.655 1.00 0.00 H new ATOM 0 HB3 ASN A 2 19.153 -10.422 5.508 1.00 0.00 H new ATOM 0 HD21 ASN A 2 19.118 -13.959 6.448 1.00 0.00 H new ATOM 0 HD22 ASN A 2 20.065 -12.490 6.707 1.00 0.00 H new ATOM 32 N TYR A 3 16.541 -9.998 3.678 1.00 0.00 N ATOM 33 CA TYR A 3 15.425 -9.111 3.959 1.00 0.00 C ATOM 34 C TYR A 3 14.426 -9.772 4.912 1.00 0.00 C ATOM 35 O TYR A 3 14.673 -10.868 5.414 1.00 0.00 O ATOM 36 CB TYR A 3 14.738 -8.858 2.616 1.00 0.00 C ATOM 37 CG TYR A 3 15.480 -7.869 1.715 1.00 0.00 C ATOM 38 CD1 TYR A 3 15.261 -6.513 1.851 1.00 0.00 C ATOM 39 CD2 TYR A 3 16.369 -8.332 0.766 1.00 0.00 C ATOM 40 CE1 TYR A 3 15.959 -5.582 1.003 1.00 0.00 C ATOM 41 CE2 TYR A 3 17.067 -7.401 -0.082 1.00 0.00 C ATOM 42 CZ TYR A 3 16.828 -6.072 0.078 1.00 0.00 C ATOM 43 OH TYR A 3 17.487 -5.192 -0.723 1.00 0.00 O ATOM 0 H TYR A 3 16.279 -10.962 3.474 1.00 0.00 H new ATOM 0 HA TYR A 3 15.775 -8.192 4.429 1.00 0.00 H new ATOM 0 HB2 TYR A 3 14.633 -9.806 2.089 1.00 0.00 H new ATOM 0 HB3 TYR A 3 13.731 -8.482 2.799 1.00 0.00 H new ATOM 0 HD1 TYR A 3 14.566 -6.150 2.594 1.00 0.00 H new ATOM 0 HD2 TYR A 3 16.541 -9.393 0.660 1.00 0.00 H new ATOM 0 HE1 TYR A 3 15.796 -4.519 1.099 1.00 0.00 H new ATOM 0 HE2 TYR A 3 17.765 -7.750 -0.829 1.00 0.00 H new ATOM 0 HH TYR A 3 18.075 -5.683 -1.334 1.00 0.00 H new ATOM 53 N LYS A 4 13.319 -9.078 5.132 1.00 0.00 N ATOM 54 CA LYS A 4 12.282 -9.584 6.016 1.00 0.00 C ATOM 55 C LYS A 4 11.064 -9.991 5.185 1.00 0.00 C ATOM 56 O LYS A 4 10.688 -11.162 5.159 1.00 0.00 O ATOM 57 CB LYS A 4 11.967 -8.564 7.111 1.00 0.00 C ATOM 58 CG LYS A 4 13.133 -8.435 8.093 1.00 0.00 C ATOM 59 CD LYS A 4 13.744 -7.033 8.038 1.00 0.00 C ATOM 60 CE LYS A 4 14.988 -6.942 8.924 1.00 0.00 C ATOM 61 NZ LYS A 4 14.603 -6.836 10.349 1.00 0.00 N ATOM 0 H LYS A 4 13.117 -8.170 4.714 1.00 0.00 H new ATOM 0 HA LYS A 4 12.627 -10.478 6.536 1.00 0.00 H new ATOM 0 HB2 LYS A 4 11.758 -7.594 6.660 1.00 0.00 H new ATOM 0 HB3 LYS A 4 11.067 -8.867 7.647 1.00 0.00 H new ATOM 0 HG2 LYS A 4 12.786 -8.645 9.105 1.00 0.00 H new ATOM 0 HG3 LYS A 4 13.895 -9.177 7.857 1.00 0.00 H new ATOM 0 HD2 LYS A 4 14.007 -6.787 7.009 1.00 0.00 H new ATOM 0 HD3 LYS A 4 13.007 -6.298 8.363 1.00 0.00 H new ATOM 0 HE2 LYS A 4 15.613 -7.822 8.775 1.00 0.00 H new ATOM 0 HE3 LYS A 4 15.584 -6.076 8.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 15.459 -6.775 10.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 14.025 -5.983 10.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 14.054 -7.675 10.624 1.00 0.00 H new ATOM 75 N LYS A 5 10.480 -9.001 4.525 1.00 0.00 N ATOM 76 CA LYS A 5 9.312 -9.241 3.695 1.00 0.00 C ATOM 77 C LYS A 5 9.128 -8.068 2.729 1.00 0.00 C ATOM 78 O LYS A 5 8.197 -7.278 2.877 1.00 0.00 O ATOM 79 CB LYS A 5 8.085 -9.519 4.565 1.00 0.00 C ATOM 80 CG LYS A 5 6.825 -9.658 3.708 1.00 0.00 C ATOM 81 CD LYS A 5 5.642 -8.932 4.350 1.00 0.00 C ATOM 82 CE LYS A 5 4.535 -9.917 4.730 1.00 0.00 C ATOM 83 NZ LYS A 5 3.239 -9.488 4.157 1.00 0.00 N ATOM 0 H LYS A 5 10.794 -8.031 4.548 1.00 0.00 H new ATOM 0 HA LYS A 5 9.453 -10.135 3.088 1.00 0.00 H new ATOM 0 HB2 LYS A 5 8.241 -10.432 5.139 1.00 0.00 H new ATOM 0 HB3 LYS A 5 7.953 -8.710 5.283 1.00 0.00 H new ATOM 0 HG2 LYS A 5 7.010 -9.251 2.714 1.00 0.00 H new ATOM 0 HG3 LYS A 5 6.583 -10.713 3.580 1.00 0.00 H new ATOM 0 HD2 LYS A 5 5.978 -8.397 5.238 1.00 0.00 H new ATOM 0 HD3 LYS A 5 5.249 -8.187 3.658 1.00 0.00 H new ATOM 0 HE2 LYS A 5 4.787 -10.914 4.368 1.00 0.00 H new ATOM 0 HE3 LYS A 5 4.455 -9.983 5.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 2.499 -10.168 4.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 2.993 -8.546 4.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 3.314 -9.448 3.120 1.00 0.00 H new ATOM 97 N PRO A 6 10.055 -7.990 1.737 1.00 0.00 N ATOM 98 CA PRO A 6 10.004 -6.928 0.747 1.00 0.00 C ATOM 99 C PRO A 6 8.887 -7.177 -0.268 1.00 0.00 C ATOM 100 O PRO A 6 8.623 -8.320 -0.638 1.00 0.00 O ATOM 101 CB PRO A 6 11.387 -6.911 0.117 1.00 0.00 C ATOM 102 CG PRO A 6 12.011 -8.258 0.444 1.00 0.00 C ATOM 103 CD PRO A 6 11.172 -8.908 1.531 1.00 0.00 C ATOM 0 HA PRO A 6 9.768 -5.957 1.183 1.00 0.00 H new ATOM 0 HB2 PRO A 6 11.323 -6.762 -0.961 1.00 0.00 H new ATOM 0 HB3 PRO A 6 11.988 -6.095 0.517 1.00 0.00 H new ATOM 0 HG2 PRO A 6 12.042 -8.890 -0.444 1.00 0.00 H new ATOM 0 HG3 PRO A 6 13.040 -8.131 0.781 1.00 0.00 H new ATOM 0 HD2 PRO A 6 10.823 -9.894 1.225 1.00 0.00 H new ATOM 0 HD3 PRO A 6 11.747 -9.044 2.447 1.00 0.00 H new ATOM 111 N LYS A 7 8.261 -6.088 -0.690 1.00 0.00 N ATOM 112 CA LYS A 7 7.178 -6.175 -1.655 1.00 0.00 C ATOM 113 C LYS A 7 7.271 -4.996 -2.626 1.00 0.00 C ATOM 114 O LYS A 7 7.985 -4.028 -2.367 1.00 0.00 O ATOM 115 CB LYS A 7 5.829 -6.277 -0.940 1.00 0.00 C ATOM 116 CG LYS A 7 4.905 -7.268 -1.651 1.00 0.00 C ATOM 117 CD LYS A 7 5.274 -8.710 -1.298 1.00 0.00 C ATOM 118 CE LYS A 7 4.630 -9.134 0.023 1.00 0.00 C ATOM 119 NZ LYS A 7 4.620 -10.608 0.146 1.00 0.00 N ATOM 0 H LYS A 7 8.483 -5.141 -0.382 1.00 0.00 H new ATOM 0 HA LYS A 7 7.268 -7.086 -2.247 1.00 0.00 H new ATOM 0 HB2 LYS A 7 5.983 -6.594 0.091 1.00 0.00 H new ATOM 0 HB3 LYS A 7 5.357 -5.295 -0.905 1.00 0.00 H new ATOM 0 HG2 LYS A 7 3.870 -7.074 -1.368 1.00 0.00 H new ATOM 0 HG3 LYS A 7 4.973 -7.125 -2.729 1.00 0.00 H new ATOM 0 HD2 LYS A 7 4.949 -9.378 -2.096 1.00 0.00 H new ATOM 0 HD3 LYS A 7 6.357 -8.804 -1.225 1.00 0.00 H new ATOM 0 HE2 LYS A 7 5.178 -8.697 0.858 1.00 0.00 H new ATOM 0 HE3 LYS A 7 3.611 -8.752 0.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 3.906 -10.893 0.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 4.390 -11.032 -0.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 5.557 -10.937 0.454 1.00 0.00 H new ATOM 133 N LEU A 8 6.540 -5.116 -3.724 1.00 0.00 N ATOM 134 CA LEU A 8 6.531 -4.073 -4.736 1.00 0.00 C ATOM 135 C LEU A 8 5.091 -3.622 -4.985 1.00 0.00 C ATOM 136 O LEU A 8 4.182 -4.448 -5.059 1.00 0.00 O ATOM 137 CB LEU A 8 7.256 -4.544 -5.998 1.00 0.00 C ATOM 138 CG LEU A 8 8.587 -5.265 -5.778 1.00 0.00 C ATOM 139 CD1 LEU A 8 9.078 -5.918 -7.072 1.00 0.00 C ATOM 140 CD2 LEU A 8 9.631 -4.318 -5.182 1.00 0.00 C ATOM 0 H LEU A 8 5.949 -5.920 -3.935 1.00 0.00 H new ATOM 0 HA LEU A 8 7.082 -3.200 -4.388 1.00 0.00 H new ATOM 0 HB2 LEU A 8 6.591 -5.210 -6.547 1.00 0.00 H new ATOM 0 HB3 LEU A 8 7.436 -3.677 -6.634 1.00 0.00 H new ATOM 0 HG LEU A 8 8.427 -6.065 -5.055 1.00 0.00 H new ATOM 0 HD11 LEU A 8 10.026 -6.424 -6.887 1.00 0.00 H new ATOM 0 HD12 LEU A 8 8.341 -6.643 -7.416 1.00 0.00 H new ATOM 0 HD13 LEU A 8 9.218 -5.153 -7.836 1.00 0.00 H new ATOM 0 HD21 LEU A 8 10.568 -4.855 -5.035 1.00 0.00 H new ATOM 0 HD22 LEU A 8 9.795 -3.482 -5.862 1.00 0.00 H new ATOM 0 HD23 LEU A 8 9.275 -3.941 -4.223 1.00 0.00 H new ATOM 152 N LEU A 9 4.927 -2.313 -5.108 1.00 0.00 N ATOM 153 CA LEU A 9 3.612 -1.743 -5.348 1.00 0.00 C ATOM 154 C LEU A 9 3.390 -1.598 -6.855 1.00 0.00 C ATOM 155 O LEU A 9 3.987 -0.732 -7.493 1.00 0.00 O ATOM 156 CB LEU A 9 3.446 -0.434 -4.573 1.00 0.00 C ATOM 157 CG LEU A 9 2.489 -0.477 -3.380 1.00 0.00 C ATOM 158 CD1 LEU A 9 2.877 -1.592 -2.406 1.00 0.00 C ATOM 159 CD2 LEU A 9 2.412 0.886 -2.690 1.00 0.00 C ATOM 0 H LEU A 9 5.683 -1.631 -5.046 1.00 0.00 H new ATOM 0 HA LEU A 9 2.834 -2.409 -4.974 1.00 0.00 H new ATOM 0 HB2 LEU A 9 4.427 -0.120 -4.216 1.00 0.00 H new ATOM 0 HB3 LEU A 9 3.098 0.333 -5.265 1.00 0.00 H new ATOM 0 HG LEU A 9 1.490 -0.707 -3.751 1.00 0.00 H new ATOM 0 HD11 LEU A 9 2.181 -1.601 -1.567 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.839 -2.553 -2.919 1.00 0.00 H new ATOM 0 HD13 LEU A 9 3.888 -1.417 -2.037 1.00 0.00 H new ATOM 0 HD21 LEU A 9 1.725 0.828 -1.846 1.00 0.00 H new ATOM 0 HD22 LEU A 9 3.402 1.170 -2.334 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.054 1.633 -3.399 1.00 0.00 H new ATOM 171 N TYR A 10 2.531 -2.459 -7.380 1.00 0.00 N ATOM 172 CA TYR A 10 2.224 -2.437 -8.800 1.00 0.00 C ATOM 173 C TYR A 10 1.101 -1.442 -9.103 1.00 0.00 C ATOM 174 O TYR A 10 0.255 -1.178 -8.251 1.00 0.00 O ATOM 175 CB TYR A 10 1.746 -3.848 -9.149 1.00 0.00 C ATOM 176 CG TYR A 10 1.664 -4.123 -10.652 1.00 0.00 C ATOM 177 CD1 TYR A 10 2.776 -3.940 -11.449 1.00 0.00 C ATOM 178 CD2 TYR A 10 0.478 -4.554 -11.211 1.00 0.00 C ATOM 179 CE1 TYR A 10 2.699 -4.199 -12.863 1.00 0.00 C ATOM 180 CE2 TYR A 10 0.401 -4.813 -12.626 1.00 0.00 C ATOM 181 CZ TYR A 10 1.515 -4.622 -13.382 1.00 0.00 C ATOM 182 OH TYR A 10 1.442 -4.867 -14.718 1.00 0.00 O ATOM 0 H TYR A 10 2.038 -3.176 -6.848 1.00 0.00 H new ATOM 0 HA TYR A 10 3.098 -2.136 -9.377 1.00 0.00 H new ATOM 0 HB2 TYR A 10 2.421 -4.572 -8.694 1.00 0.00 H new ATOM 0 HB3 TYR A 10 0.763 -4.007 -8.707 1.00 0.00 H new ATOM 0 HD1 TYR A 10 3.704 -3.602 -11.012 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -0.392 -4.697 -10.588 1.00 0.00 H new ATOM 0 HE1 TYR A 10 3.562 -4.061 -13.497 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -0.521 -5.151 -13.076 1.00 0.00 H new ATOM 0 HH TYR A 10 0.537 -5.164 -14.947 1.00 0.00 H new ATOM 192 N CYS A 11 1.131 -0.918 -10.320 1.00 0.00 N ATOM 193 CA CYS A 11 0.127 0.042 -10.746 1.00 0.00 C ATOM 194 C CYS A 11 -0.425 -0.409 -12.099 1.00 0.00 C ATOM 195 O CYS A 11 -0.063 0.144 -13.137 1.00 0.00 O ATOM 196 CB CYS A 11 0.692 1.462 -10.804 1.00 0.00 C ATOM 197 SG CYS A 11 -0.580 2.616 -11.438 1.00 0.00 S ATOM 0 H CYS A 11 1.835 -1.140 -11.024 1.00 0.00 H new ATOM 0 HA CYS A 11 -0.683 0.073 -10.017 1.00 0.00 H new ATOM 0 HB2 CYS A 11 1.016 1.774 -9.811 1.00 0.00 H new ATOM 0 HB3 CYS A 11 1.571 1.487 -11.448 1.00 0.00 H new ATOM 0 HG CYS A 11 -0.016 3.733 -11.789 1.00 0.00 H new ATOM 203 N SER A 12 -1.291 -1.410 -12.046 1.00 0.00 N ATOM 204 CA SER A 12 -1.897 -1.942 -13.255 1.00 0.00 C ATOM 205 C SER A 12 -2.134 -0.814 -14.261 1.00 0.00 C ATOM 206 O SER A 12 -2.002 -1.015 -15.467 1.00 0.00 O ATOM 207 CB SER A 12 -3.211 -2.660 -12.943 1.00 0.00 C ATOM 208 OG SER A 12 -4.045 -1.895 -12.077 1.00 0.00 O ATOM 0 H SER A 12 -1.588 -1.867 -11.184 1.00 0.00 H new ATOM 0 HA SER A 12 -1.212 -2.670 -13.689 1.00 0.00 H new ATOM 0 HB2 SER A 12 -3.743 -2.863 -13.873 1.00 0.00 H new ATOM 0 HB3 SER A 12 -2.997 -3.624 -12.482 1.00 0.00 H new ATOM 0 HG SER A 12 -4.651 -2.494 -11.593 1.00 0.00 H new ATOM 214 N ASN A 13 -2.480 0.349 -13.727 1.00 0.00 N ATOM 215 CA ASN A 13 -2.737 1.509 -14.564 1.00 0.00 C ATOM 216 C ASN A 13 -1.682 1.578 -15.670 1.00 0.00 C ATOM 217 O ASN A 13 -2.019 1.687 -16.848 1.00 0.00 O ATOM 218 CB ASN A 13 -2.656 2.802 -13.751 1.00 0.00 C ATOM 219 CG ASN A 13 -3.589 3.870 -14.325 1.00 0.00 C ATOM 220 OD1 ASN A 13 -4.552 3.583 -15.017 1.00 0.00 O ATOM 221 ND2 ASN A 13 -3.252 5.115 -14.001 1.00 0.00 N ATOM 0 H ASN A 13 -2.588 0.512 -12.726 1.00 0.00 H new ATOM 0 HA ASN A 13 -3.738 1.408 -14.983 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -2.923 2.601 -12.713 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -1.631 3.172 -13.751 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -3.813 5.899 -14.336 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -2.433 5.286 -13.418 1.00 0.00 H new ATOM 228 N GLY A 14 -0.427 1.514 -15.251 1.00 0.00 N ATOM 229 CA GLY A 14 0.680 1.568 -16.191 1.00 0.00 C ATOM 230 C GLY A 14 1.561 0.323 -16.073 1.00 0.00 C ATOM 231 O GLY A 14 2.077 -0.174 -17.073 1.00 0.00 O ATOM 0 H GLY A 14 -0.152 1.425 -14.273 1.00 0.00 H new ATOM 0 HA2 GLY A 14 0.295 1.650 -17.207 1.00 0.00 H new ATOM 0 HA3 GLY A 14 1.278 2.460 -16.003 1.00 0.00 H new ATOM 235 N GLY A 15 1.708 -0.145 -14.842 1.00 0.00 N ATOM 236 CA GLY A 15 2.518 -1.322 -14.581 1.00 0.00 C ATOM 237 C GLY A 15 3.940 -0.929 -14.175 1.00 0.00 C ATOM 238 O GLY A 15 4.889 -1.165 -14.922 1.00 0.00 O ATOM 0 H GLY A 15 1.280 0.270 -14.015 1.00 0.00 H new ATOM 0 HA2 GLY A 15 2.060 -1.915 -13.789 1.00 0.00 H new ATOM 0 HA3 GLY A 15 2.550 -1.950 -15.471 1.00 0.00 H new ATOM 242 N HIS A 16 4.043 -0.338 -12.994 1.00 0.00 N ATOM 243 CA HIS A 16 5.333 0.089 -12.481 1.00 0.00 C ATOM 244 C HIS A 16 5.396 -0.165 -10.974 1.00 0.00 C ATOM 245 O HIS A 16 4.392 -0.521 -10.358 1.00 0.00 O ATOM 246 CB HIS A 16 5.608 1.549 -12.847 1.00 0.00 C ATOM 247 CG HIS A 16 5.697 1.803 -14.333 1.00 0.00 C ATOM 248 ND1 HIS A 16 4.630 1.608 -15.193 1.00 0.00 N ATOM 249 CD2 HIS A 16 6.736 2.238 -15.102 1.00 0.00 C ATOM 250 CE1 HIS A 16 5.021 1.915 -16.421 1.00 0.00 C ATOM 251 NE2 HIS A 16 6.327 2.304 -16.363 1.00 0.00 N ATOM 0 H HIS A 16 3.254 -0.145 -12.378 1.00 0.00 H new ATOM 0 HA HIS A 16 6.125 -0.497 -12.947 1.00 0.00 H new ATOM 0 HB2 HIS A 16 4.818 2.173 -12.429 1.00 0.00 H new ATOM 0 HB3 HIS A 16 6.542 1.861 -12.379 1.00 0.00 H new ATOM 0 HD2 HIS A 16 7.725 2.487 -14.745 1.00 0.00 H new ATOM 0 HE1 HIS A 16 4.412 1.866 -17.312 1.00 0.00 H new ATOM 0 HE2 HIS A 16 6.896 2.597 -17.157 1.00 0.00 H new ATOM 259 N PHE A 17 6.585 0.027 -10.422 1.00 0.00 N ATOM 260 CA PHE A 17 6.792 -0.177 -8.999 1.00 0.00 C ATOM 261 C PHE A 17 7.057 1.151 -8.287 1.00 0.00 C ATOM 262 O PHE A 17 7.735 2.024 -8.827 1.00 0.00 O ATOM 263 CB PHE A 17 8.020 -1.076 -8.849 1.00 0.00 C ATOM 264 CG PHE A 17 7.835 -2.484 -9.421 1.00 0.00 C ATOM 265 CD1 PHE A 17 6.774 -3.241 -9.032 1.00 0.00 C ATOM 266 CD2 PHE A 17 8.730 -2.977 -10.318 1.00 0.00 C ATOM 267 CE1 PHE A 17 6.602 -4.547 -9.562 1.00 0.00 C ATOM 268 CE2 PHE A 17 8.558 -4.283 -10.848 1.00 0.00 C ATOM 269 CZ PHE A 17 7.497 -5.040 -10.459 1.00 0.00 C ATOM 0 H PHE A 17 7.416 0.322 -10.935 1.00 0.00 H new ATOM 0 HA PHE A 17 5.903 -0.625 -8.555 1.00 0.00 H new ATOM 0 HB2 PHE A 17 8.867 -0.602 -9.345 1.00 0.00 H new ATOM 0 HB3 PHE A 17 8.273 -1.155 -7.792 1.00 0.00 H new ATOM 0 HD1 PHE A 17 6.063 -2.849 -8.320 1.00 0.00 H new ATOM 0 HD2 PHE A 17 9.572 -2.375 -10.627 1.00 0.00 H new ATOM 0 HE1 PHE A 17 5.760 -5.149 -9.253 1.00 0.00 H new ATOM 0 HE2 PHE A 17 9.269 -4.675 -11.560 1.00 0.00 H new ATOM 0 HZ PHE A 17 7.365 -6.033 -10.863 1.00 0.00 H new ATOM 279 N LEU A 18 6.509 1.262 -7.086 1.00 0.00 N ATOM 280 CA LEU A 18 6.678 2.469 -6.295 1.00 0.00 C ATOM 281 C LEU A 18 8.048 2.440 -5.614 1.00 0.00 C ATOM 282 O LEU A 18 8.278 1.641 -4.708 1.00 0.00 O ATOM 283 CB LEU A 18 5.510 2.638 -5.320 1.00 0.00 C ATOM 284 CG LEU A 18 5.261 4.060 -4.813 1.00 0.00 C ATOM 285 CD1 LEU A 18 4.784 4.970 -5.947 1.00 0.00 C ATOM 286 CD2 LEU A 18 4.289 4.059 -3.632 1.00 0.00 C ATOM 0 H LEU A 18 5.948 0.536 -6.641 1.00 0.00 H new ATOM 0 HA LEU A 18 6.659 3.350 -6.936 1.00 0.00 H new ATOM 0 HB2 LEU A 18 4.602 2.283 -5.807 1.00 0.00 H new ATOM 0 HB3 LEU A 18 5.684 1.992 -4.460 1.00 0.00 H new ATOM 0 HG LEU A 18 6.206 4.464 -4.451 1.00 0.00 H new ATOM 0 HD11 LEU A 18 4.614 5.975 -5.560 1.00 0.00 H new ATOM 0 HD12 LEU A 18 5.543 5.005 -6.729 1.00 0.00 H new ATOM 0 HD13 LEU A 18 3.855 4.579 -6.361 1.00 0.00 H new ATOM 0 HD21 LEU A 18 4.130 5.082 -3.291 1.00 0.00 H new ATOM 0 HD22 LEU A 18 3.338 3.628 -3.944 1.00 0.00 H new ATOM 0 HD23 LEU A 18 4.706 3.466 -2.818 1.00 0.00 H new ATOM 298 N ARG A 19 8.922 3.322 -6.077 1.00 0.00 N ATOM 299 CA ARG A 19 10.263 3.407 -5.525 1.00 0.00 C ATOM 300 C ARG A 19 10.439 4.720 -4.760 1.00 0.00 C ATOM 301 O ARG A 19 9.784 5.715 -5.068 1.00 0.00 O ATOM 302 CB ARG A 19 11.320 3.322 -6.628 1.00 0.00 C ATOM 303 CG ARG A 19 11.572 4.696 -7.253 1.00 0.00 C ATOM 304 CD ARG A 19 12.243 4.561 -8.621 1.00 0.00 C ATOM 305 NE ARG A 19 13.714 4.524 -8.462 1.00 0.00 N ATOM 306 CZ ARG A 19 14.582 4.859 -9.426 1.00 0.00 C ATOM 307 NH1 ARG A 19 14.133 5.258 -10.624 1.00 0.00 N ATOM 308 NH2 ARG A 19 15.900 4.795 -9.192 1.00 0.00 N ATOM 0 H ARG A 19 8.727 3.984 -6.828 1.00 0.00 H new ATOM 0 HA ARG A 19 10.396 2.565 -4.845 1.00 0.00 H new ATOM 0 HB2 ARG A 19 12.250 2.930 -6.216 1.00 0.00 H new ATOM 0 HB3 ARG A 19 10.992 2.623 -7.398 1.00 0.00 H new ATOM 0 HG2 ARG A 19 10.628 5.230 -7.358 1.00 0.00 H new ATOM 0 HG3 ARG A 19 12.203 5.290 -6.592 1.00 0.00 H new ATOM 0 HD2 ARG A 19 11.899 3.652 -9.116 1.00 0.00 H new ATOM 0 HD3 ARG A 19 11.959 5.398 -9.259 1.00 0.00 H new ATOM 0 HE ARG A 19 14.090 4.225 -7.562 1.00 0.00 H new ATOM 0 HH11 ARG A 19 13.130 5.307 -10.802 1.00 0.00 H new ATOM 0 HH12 ARG A 19 14.794 5.513 -11.357 1.00 0.00 H new ATOM 0 HH21 ARG A 19 16.242 4.491 -8.280 1.00 0.00 H new ATOM 0 HH22 ARG A 19 16.561 5.050 -9.926 1.00 0.00 H new ATOM 322 N ILE A 20 11.326 4.681 -3.776 1.00 0.00 N ATOM 323 CA ILE A 20 11.597 5.855 -2.965 1.00 0.00 C ATOM 324 C ILE A 20 13.094 6.167 -3.010 1.00 0.00 C ATOM 325 O ILE A 20 13.914 5.352 -2.590 1.00 0.00 O ATOM 326 CB ILE A 20 11.050 5.665 -1.548 1.00 0.00 C ATOM 327 CG1 ILE A 20 9.625 5.110 -1.580 1.00 0.00 C ATOM 328 CG2 ILE A 20 11.142 6.964 -0.746 1.00 0.00 C ATOM 329 CD1 ILE A 20 9.047 5.001 -0.168 1.00 0.00 C ATOM 0 H ILE A 20 11.866 3.854 -3.522 1.00 0.00 H new ATOM 0 HA ILE A 20 11.078 6.725 -3.368 1.00 0.00 H new ATOM 0 HB ILE A 20 11.671 4.928 -1.038 1.00 0.00 H new ATOM 0 HG12 ILE A 20 8.992 5.758 -2.187 1.00 0.00 H new ATOM 0 HG13 ILE A 20 9.624 4.128 -2.054 1.00 0.00 H new ATOM 0 HG21 ILE A 20 10.747 6.801 0.257 1.00 0.00 H new ATOM 0 HG22 ILE A 20 12.184 7.277 -0.679 1.00 0.00 H new ATOM 0 HG23 ILE A 20 10.561 7.741 -1.243 1.00 0.00 H new ATOM 0 HD11 ILE A 20 8.033 4.604 -0.219 1.00 0.00 H new ATOM 0 HD12 ILE A 20 9.668 4.333 0.429 1.00 0.00 H new ATOM 0 HD13 ILE A 20 9.027 5.988 0.294 1.00 0.00 H new ATOM 341 N LEU A 21 13.404 7.349 -3.522 1.00 0.00 N ATOM 342 CA LEU A 21 14.788 7.779 -3.627 1.00 0.00 C ATOM 343 C LEU A 21 15.223 8.413 -2.304 1.00 0.00 C ATOM 344 O LEU A 21 14.388 8.881 -1.532 1.00 0.00 O ATOM 345 CB LEU A 21 14.974 8.694 -4.839 1.00 0.00 C ATOM 346 CG LEU A 21 14.314 8.230 -6.138 1.00 0.00 C ATOM 347 CD1 LEU A 21 14.469 9.282 -7.238 1.00 0.00 C ATOM 348 CD2 LEU A 21 14.855 6.865 -6.570 1.00 0.00 C ATOM 0 H LEU A 21 12.721 8.022 -3.869 1.00 0.00 H new ATOM 0 HA LEU A 21 15.441 6.923 -3.800 1.00 0.00 H new ATOM 0 HB2 LEU A 21 14.583 9.680 -4.588 1.00 0.00 H new ATOM 0 HB3 LEU A 21 16.042 8.812 -5.020 1.00 0.00 H new ATOM 0 HG LEU A 21 13.246 8.110 -5.955 1.00 0.00 H new ATOM 0 HD11 LEU A 21 13.991 8.927 -8.151 1.00 0.00 H new ATOM 0 HD12 LEU A 21 13.999 10.213 -6.920 1.00 0.00 H new ATOM 0 HD13 LEU A 21 15.528 9.457 -7.428 1.00 0.00 H new ATOM 0 HD21 LEU A 21 14.369 6.558 -7.496 1.00 0.00 H new ATOM 0 HD22 LEU A 21 15.931 6.934 -6.730 1.00 0.00 H new ATOM 0 HD23 LEU A 21 14.650 6.130 -5.792 1.00 0.00 H new ATOM 360 N PRO A 22 16.564 8.407 -2.077 1.00 0.00 N ATOM 361 CA PRO A 22 17.119 8.976 -0.861 1.00 0.00 C ATOM 362 C PRO A 22 17.099 10.505 -0.912 1.00 0.00 C ATOM 363 O PRO A 22 17.478 11.167 0.053 1.00 0.00 O ATOM 364 CB PRO A 22 18.524 8.403 -0.765 1.00 0.00 C ATOM 365 CG PRO A 22 18.869 7.908 -2.160 1.00 0.00 C ATOM 366 CD PRO A 22 17.583 7.861 -2.969 1.00 0.00 C ATOM 0 HA PRO A 22 16.538 8.722 0.026 1.00 0.00 H new ATOM 0 HB2 PRO A 22 19.233 9.161 -0.433 1.00 0.00 H new ATOM 0 HB3 PRO A 22 18.565 7.590 -0.041 1.00 0.00 H new ATOM 0 HG2 PRO A 22 19.593 8.572 -2.632 1.00 0.00 H new ATOM 0 HG3 PRO A 22 19.326 6.920 -2.112 1.00 0.00 H new ATOM 0 HD2 PRO A 22 17.668 8.451 -3.882 1.00 0.00 H new ATOM 0 HD3 PRO A 22 17.341 6.842 -3.270 1.00 0.00 H new ATOM 374 N ASP A 23 16.654 11.022 -2.048 1.00 0.00 N ATOM 375 CA ASP A 23 16.580 12.460 -2.238 1.00 0.00 C ATOM 376 C ASP A 23 15.170 12.944 -1.890 1.00 0.00 C ATOM 377 O ASP A 23 14.892 14.141 -1.939 1.00 0.00 O ATOM 378 CB ASP A 23 16.864 12.840 -3.692 1.00 0.00 C ATOM 379 CG ASP A 23 17.586 14.175 -3.883 1.00 0.00 C ATOM 380 OD1 ASP A 23 18.795 14.217 -3.570 1.00 0.00 O ATOM 381 OD2 ASP A 23 16.912 15.124 -4.339 1.00 0.00 O ATOM 0 H ASP A 23 16.341 10.470 -2.846 1.00 0.00 H new ATOM 0 HA ASP A 23 17.326 12.924 -1.592 1.00 0.00 H new ATOM 0 HB2 ASP A 23 17.464 12.052 -4.147 1.00 0.00 H new ATOM 0 HB3 ASP A 23 15.919 12.875 -4.234 1.00 0.00 H new ATOM 386 N GLY A 24 14.319 11.989 -1.547 1.00 0.00 N ATOM 387 CA GLY A 24 12.946 12.303 -1.191 1.00 0.00 C ATOM 388 C GLY A 24 12.067 12.410 -2.439 1.00 0.00 C ATOM 389 O GLY A 24 11.230 13.307 -2.538 1.00 0.00 O ATOM 0 H GLY A 24 14.554 10.997 -1.508 1.00 0.00 H new ATOM 0 HA2 GLY A 24 12.552 11.531 -0.530 1.00 0.00 H new ATOM 0 HA3 GLY A 24 12.915 13.242 -0.639 1.00 0.00 H new ATOM 393 N THR A 25 12.287 11.484 -3.360 1.00 0.00 N ATOM 394 CA THR A 25 11.526 11.464 -4.598 1.00 0.00 C ATOM 395 C THR A 25 10.809 10.122 -4.761 1.00 0.00 C ATOM 396 O THR A 25 11.311 9.088 -4.323 1.00 0.00 O ATOM 397 CB THR A 25 12.483 11.785 -5.747 1.00 0.00 C ATOM 398 OG1 THR A 25 12.655 13.198 -5.671 1.00 0.00 O ATOM 399 CG2 THR A 25 11.845 11.561 -7.120 1.00 0.00 C ATOM 0 H THR A 25 12.981 10.742 -3.274 1.00 0.00 H new ATOM 0 HA THR A 25 10.740 12.219 -4.591 1.00 0.00 H new ATOM 0 HB THR A 25 13.378 11.169 -5.657 1.00 0.00 H new ATOM 0 HG1 THR A 25 13.264 13.492 -6.380 1.00 0.00 H new ATOM 0 HG21 THR A 25 12.566 11.803 -7.900 1.00 0.00 H new ATOM 0 HG22 THR A 25 11.544 10.518 -7.215 1.00 0.00 H new ATOM 0 HG23 THR A 25 10.970 12.202 -7.223 1.00 0.00 H new ATOM 407 N VAL A 26 9.646 10.182 -5.393 1.00 0.00 N ATOM 408 CA VAL A 26 8.855 8.984 -5.619 1.00 0.00 C ATOM 409 C VAL A 26 8.459 8.911 -7.096 1.00 0.00 C ATOM 410 O VAL A 26 7.793 9.808 -7.608 1.00 0.00 O ATOM 411 CB VAL A 26 7.650 8.966 -4.676 1.00 0.00 C ATOM 412 CG1 VAL A 26 6.950 7.606 -4.707 1.00 0.00 C ATOM 413 CG2 VAL A 26 8.065 9.337 -3.251 1.00 0.00 C ATOM 0 H VAL A 26 9.233 11.041 -5.756 1.00 0.00 H new ATOM 0 HA VAL A 26 9.440 8.092 -5.394 1.00 0.00 H new ATOM 0 HB VAL A 26 6.940 9.716 -5.024 1.00 0.00 H new ATOM 0 HG11 VAL A 26 6.097 7.620 -4.028 1.00 0.00 H new ATOM 0 HG12 VAL A 26 6.604 7.398 -5.720 1.00 0.00 H new ATOM 0 HG13 VAL A 26 7.649 6.830 -4.395 1.00 0.00 H new ATOM 0 HG21 VAL A 26 7.191 9.317 -2.601 1.00 0.00 H new ATOM 0 HG22 VAL A 26 8.803 8.621 -2.889 1.00 0.00 H new ATOM 0 HG23 VAL A 26 8.497 10.338 -3.247 1.00 0.00 H new ATOM 423 N ASP A 27 8.887 7.834 -7.737 1.00 0.00 N ATOM 424 CA ASP A 27 8.586 7.632 -9.144 1.00 0.00 C ATOM 425 C ASP A 27 8.375 6.139 -9.407 1.00 0.00 C ATOM 426 O ASP A 27 8.778 5.301 -8.603 1.00 0.00 O ATOM 427 CB ASP A 27 9.740 8.109 -10.028 1.00 0.00 C ATOM 428 CG ASP A 27 10.571 9.253 -9.445 1.00 0.00 C ATOM 429 OD1 ASP A 27 10.048 10.388 -9.437 1.00 0.00 O ATOM 430 OD2 ASP A 27 11.711 8.966 -9.020 1.00 0.00 O ATOM 0 H ASP A 27 9.440 7.092 -7.308 1.00 0.00 H new ATOM 0 HA ASP A 27 7.689 8.203 -9.382 1.00 0.00 H new ATOM 0 HB2 ASP A 27 10.400 7.264 -10.225 1.00 0.00 H new ATOM 0 HB3 ASP A 27 9.335 8.427 -10.988 1.00 0.00 H new ATOM 435 N GLY A 28 7.744 5.853 -10.537 1.00 0.00 N ATOM 436 CA GLY A 28 7.475 4.477 -10.916 1.00 0.00 C ATOM 437 C GLY A 28 8.606 3.914 -11.778 1.00 0.00 C ATOM 438 O GLY A 28 9.291 4.661 -12.475 1.00 0.00 O ATOM 0 H GLY A 28 7.412 6.551 -11.202 1.00 0.00 H new ATOM 0 HA2 GLY A 28 7.357 3.866 -10.021 1.00 0.00 H new ATOM 0 HA3 GLY A 28 6.534 4.424 -11.464 1.00 0.00 H new ATOM 442 N THR A 29 8.768 2.601 -11.702 1.00 0.00 N ATOM 443 CA THR A 29 9.805 1.930 -12.467 1.00 0.00 C ATOM 444 C THR A 29 9.442 0.459 -12.681 1.00 0.00 C ATOM 445 O THR A 29 9.158 -0.260 -11.724 1.00 0.00 O ATOM 446 CB THR A 29 11.135 2.127 -11.736 1.00 0.00 C ATOM 447 OG1 THR A 29 12.119 1.792 -12.710 1.00 0.00 O ATOM 448 CG2 THR A 29 11.348 1.100 -10.621 1.00 0.00 C ATOM 0 H THR A 29 8.199 1.984 -11.123 1.00 0.00 H new ATOM 0 HA THR A 29 9.900 2.358 -13.465 1.00 0.00 H new ATOM 0 HB THR A 29 11.173 3.132 -11.315 1.00 0.00 H new ATOM 0 HG1 THR A 29 13.013 1.894 -12.321 1.00 0.00 H new ATOM 0 HG21 THR A 29 12.306 1.284 -10.135 1.00 0.00 H new ATOM 0 HG22 THR A 29 10.546 1.187 -9.888 1.00 0.00 H new ATOM 0 HG23 THR A 29 11.344 0.096 -11.045 1.00 0.00 H new ATOM 456 N ARG A 30 9.462 0.055 -13.943 1.00 0.00 N ATOM 457 CA ARG A 30 9.138 -1.317 -14.295 1.00 0.00 C ATOM 458 C ARG A 30 10.418 -2.112 -14.561 1.00 0.00 C ATOM 459 O ARG A 30 10.579 -2.696 -15.632 1.00 0.00 O ATOM 460 CB ARG A 30 8.245 -1.371 -15.536 1.00 0.00 C ATOM 461 CG ARG A 30 7.307 -2.578 -15.485 1.00 0.00 C ATOM 462 CD ARG A 30 6.498 -2.700 -16.778 1.00 0.00 C ATOM 463 NE ARG A 30 5.906 -4.052 -16.879 1.00 0.00 N ATOM 464 CZ ARG A 30 6.595 -5.151 -17.217 1.00 0.00 C ATOM 465 NH1 ARG A 30 7.904 -5.063 -17.489 1.00 0.00 N ATOM 466 NH2 ARG A 30 5.975 -6.337 -17.284 1.00 0.00 N ATOM 0 H ARG A 30 9.698 0.654 -14.734 1.00 0.00 H new ATOM 0 HA ARG A 30 8.600 -1.757 -13.455 1.00 0.00 H new ATOM 0 HB2 ARG A 30 7.660 -0.454 -15.607 1.00 0.00 H new ATOM 0 HB3 ARG A 30 8.864 -1.425 -16.432 1.00 0.00 H new ATOM 0 HG2 ARG A 30 7.887 -3.487 -15.328 1.00 0.00 H new ATOM 0 HG3 ARG A 30 6.630 -2.481 -14.636 1.00 0.00 H new ATOM 0 HD2 ARG A 30 5.710 -1.947 -16.796 1.00 0.00 H new ATOM 0 HD3 ARG A 30 7.140 -2.510 -17.638 1.00 0.00 H new ATOM 0 HE ARG A 30 4.911 -4.154 -16.679 1.00 0.00 H new ATOM 0 HH11 ARG A 30 8.376 -4.160 -17.439 1.00 0.00 H new ATOM 0 HH12 ARG A 30 8.429 -5.899 -17.746 1.00 0.00 H new ATOM 0 HH21 ARG A 30 4.978 -6.404 -17.078 1.00 0.00 H new ATOM 0 HH22 ARG A 30 6.500 -7.173 -17.541 1.00 0.00 H new ATOM 480 N ASP A 31 11.295 -2.110 -13.568 1.00 0.00 N ATOM 481 CA ASP A 31 12.555 -2.825 -13.681 1.00 0.00 C ATOM 482 C ASP A 31 12.922 -3.421 -12.321 1.00 0.00 C ATOM 483 O ASP A 31 13.403 -2.713 -11.438 1.00 0.00 O ATOM 484 CB ASP A 31 13.685 -1.885 -14.106 1.00 0.00 C ATOM 485 CG ASP A 31 14.674 -2.476 -15.113 1.00 0.00 C ATOM 486 OD1 ASP A 31 14.216 -3.280 -15.953 1.00 0.00 O ATOM 487 OD2 ASP A 31 15.866 -2.111 -15.019 1.00 0.00 O ATOM 0 H ASP A 31 11.158 -1.625 -12.681 1.00 0.00 H new ATOM 0 HA ASP A 31 12.434 -3.606 -14.432 1.00 0.00 H new ATOM 0 HB2 ASP A 31 13.246 -0.985 -14.536 1.00 0.00 H new ATOM 0 HB3 ASP A 31 14.235 -1.578 -13.217 1.00 0.00 H new ATOM 492 N ARG A 32 12.682 -4.718 -12.194 1.00 0.00 N ATOM 493 CA ARG A 32 12.981 -5.418 -10.957 1.00 0.00 C ATOM 494 C ARG A 32 14.494 -5.496 -10.744 1.00 0.00 C ATOM 495 O ARG A 32 15.058 -6.587 -10.670 1.00 0.00 O ATOM 496 CB ARG A 32 12.400 -6.833 -10.970 1.00 0.00 C ATOM 497 CG ARG A 32 10.871 -6.799 -10.945 1.00 0.00 C ATOM 498 CD ARG A 32 10.294 -7.041 -12.341 1.00 0.00 C ATOM 499 NE ARG A 32 10.093 -8.491 -12.561 1.00 0.00 N ATOM 500 CZ ARG A 32 9.465 -9.009 -13.625 1.00 0.00 C ATOM 501 NH1 ARG A 32 8.973 -8.200 -14.573 1.00 0.00 N ATOM 502 NH2 ARG A 32 9.328 -10.337 -13.741 1.00 0.00 N ATOM 0 H ARG A 32 12.283 -5.303 -12.929 1.00 0.00 H new ATOM 0 HA ARG A 32 12.524 -4.859 -10.141 1.00 0.00 H new ATOM 0 HB2 ARG A 32 12.741 -7.362 -11.860 1.00 0.00 H new ATOM 0 HB3 ARG A 32 12.769 -7.389 -10.108 1.00 0.00 H new ATOM 0 HG2 ARG A 32 10.498 -7.558 -10.257 1.00 0.00 H new ATOM 0 HG3 ARG A 32 10.531 -5.834 -10.570 1.00 0.00 H new ATOM 0 HD2 ARG A 32 9.346 -6.514 -12.448 1.00 0.00 H new ATOM 0 HD3 ARG A 32 10.969 -6.640 -13.097 1.00 0.00 H new ATOM 0 HE ARG A 32 10.455 -9.136 -11.859 1.00 0.00 H new ATOM 0 HH11 ARG A 32 9.077 -7.189 -14.485 1.00 0.00 H new ATOM 0 HH12 ARG A 32 8.495 -8.595 -15.383 1.00 0.00 H new ATOM 0 HH21 ARG A 32 9.702 -10.953 -13.019 1.00 0.00 H new ATOM 0 HH22 ARG A 32 8.850 -10.732 -14.551 1.00 0.00 H new ATOM 516 N SER A 33 15.108 -4.326 -10.652 1.00 0.00 N ATOM 517 CA SER A 33 16.545 -4.249 -10.449 1.00 0.00 C ATOM 518 C SER A 33 16.865 -3.224 -9.359 1.00 0.00 C ATOM 519 O SER A 33 17.662 -3.495 -8.462 1.00 0.00 O ATOM 520 CB SER A 33 17.266 -3.884 -11.748 1.00 0.00 C ATOM 521 OG SER A 33 18.400 -4.715 -11.981 1.00 0.00 O ATOM 0 H SER A 33 14.637 -3.423 -10.714 1.00 0.00 H new ATOM 0 HA SER A 33 16.899 -5.230 -10.132 1.00 0.00 H new ATOM 0 HB2 SER A 33 16.573 -3.973 -12.585 1.00 0.00 H new ATOM 0 HB3 SER A 33 17.583 -2.842 -11.706 1.00 0.00 H new ATOM 0 HG SER A 33 18.832 -4.451 -12.820 1.00 0.00 H new ATOM 527 N ASP A 34 16.228 -2.068 -9.473 1.00 0.00 N ATOM 528 CA ASP A 34 16.435 -1.001 -8.508 1.00 0.00 C ATOM 529 C ASP A 34 16.418 -1.587 -7.095 1.00 0.00 C ATOM 530 O ASP A 34 15.530 -2.367 -6.753 1.00 0.00 O ATOM 531 CB ASP A 34 15.324 0.047 -8.599 1.00 0.00 C ATOM 532 CG ASP A 34 15.794 1.499 -8.488 1.00 0.00 C ATOM 533 OD1 ASP A 34 16.514 1.789 -7.509 1.00 0.00 O ATOM 534 OD2 ASP A 34 15.423 2.285 -9.386 1.00 0.00 O ATOM 0 H ASP A 34 15.568 -1.847 -10.219 1.00 0.00 H new ATOM 0 HA ASP A 34 17.393 -0.530 -8.726 1.00 0.00 H new ATOM 0 HB2 ASP A 34 14.803 -0.079 -9.548 1.00 0.00 H new ATOM 0 HB3 ASP A 34 14.598 -0.145 -7.809 1.00 0.00 H new ATOM 539 N GLN A 35 17.410 -1.189 -6.312 1.00 0.00 N ATOM 540 CA GLN A 35 17.520 -1.665 -4.943 1.00 0.00 C ATOM 541 C GLN A 35 16.776 -0.725 -3.993 1.00 0.00 C ATOM 542 O GLN A 35 17.139 -0.603 -2.824 1.00 0.00 O ATOM 543 CB GLN A 35 18.986 -1.813 -4.531 1.00 0.00 C ATOM 544 CG GLN A 35 19.663 -2.943 -5.309 1.00 0.00 C ATOM 545 CD GLN A 35 19.471 -4.287 -4.604 1.00 0.00 C ATOM 546 OE1 GLN A 35 18.531 -4.495 -3.855 1.00 0.00 O ATOM 547 NE2 GLN A 35 20.411 -5.185 -4.885 1.00 0.00 N ATOM 0 H GLN A 35 18.145 -0.542 -6.599 1.00 0.00 H new ATOM 0 HA GLN A 35 17.058 -2.651 -4.883 1.00 0.00 H new ATOM 0 HB2 GLN A 35 19.514 -0.876 -4.710 1.00 0.00 H new ATOM 0 HB3 GLN A 35 19.048 -2.015 -3.462 1.00 0.00 H new ATOM 0 HG2 GLN A 35 19.249 -2.994 -6.316 1.00 0.00 H new ATOM 0 HG3 GLN A 35 20.727 -2.731 -5.412 1.00 0.00 H new ATOM 0 HE21 GLN A 35 21.171 -4.945 -5.521 1.00 0.00 H new ATOM 0 HE22 GLN A 35 20.371 -6.113 -4.464 1.00 0.00 H new ATOM 556 N HIS A 36 15.748 -0.085 -4.530 1.00 0.00 N ATOM 557 CA HIS A 36 14.949 0.840 -3.744 1.00 0.00 C ATOM 558 C HIS A 36 13.472 0.451 -3.838 1.00 0.00 C ATOM 559 O HIS A 36 12.765 0.437 -2.831 1.00 0.00 O ATOM 560 CB HIS A 36 15.210 2.285 -4.175 1.00 0.00 C ATOM 561 CG HIS A 36 16.673 2.654 -4.234 1.00 0.00 C ATOM 562 ND1 HIS A 36 17.586 1.975 -5.021 1.00 0.00 N ATOM 563 CD2 HIS A 36 17.370 3.637 -3.596 1.00 0.00 C ATOM 564 CE1 HIS A 36 18.777 2.532 -4.856 1.00 0.00 C ATOM 565 NE2 HIS A 36 18.641 3.562 -3.972 1.00 0.00 N ATOM 0 H HIS A 36 15.450 -0.189 -5.500 1.00 0.00 H new ATOM 0 HA HIS A 36 15.239 0.777 -2.695 1.00 0.00 H new ATOM 0 HB2 HIS A 36 14.765 2.446 -5.157 1.00 0.00 H new ATOM 0 HB3 HIS A 36 14.704 2.957 -3.482 1.00 0.00 H new ATOM 0 HD2 HIS A 36 16.958 4.355 -2.902 1.00 0.00 H new ATOM 0 HE1 HIS A 36 19.694 2.225 -5.337 1.00 0.00 H new ATOM 0 HE2 HIS A 36 19.392 4.174 -3.653 1.00 0.00 H new ATOM 573 N ILE A 37 13.050 0.144 -5.056 1.00 0.00 N ATOM 574 CA ILE A 37 11.671 -0.244 -5.294 1.00 0.00 C ATOM 575 C ILE A 37 11.249 -1.280 -4.250 1.00 0.00 C ATOM 576 O ILE A 37 10.073 -1.372 -3.901 1.00 0.00 O ATOM 577 CB ILE A 37 11.489 -0.717 -6.737 1.00 0.00 C ATOM 578 CG1 ILE A 37 12.290 -1.994 -7.001 1.00 0.00 C ATOM 579 CG2 ILE A 37 11.840 0.395 -7.727 1.00 0.00 C ATOM 580 CD1 ILE A 37 11.916 -2.607 -8.352 1.00 0.00 C ATOM 0 H ILE A 37 13.639 0.156 -5.888 1.00 0.00 H new ATOM 0 HA ILE A 37 11.009 0.614 -5.178 1.00 0.00 H new ATOM 0 HB ILE A 37 10.437 -0.960 -6.886 1.00 0.00 H new ATOM 0 HG12 ILE A 37 13.356 -1.769 -6.983 1.00 0.00 H new ATOM 0 HG13 ILE A 37 12.103 -2.716 -6.206 1.00 0.00 H new ATOM 0 HG21 ILE A 37 11.702 0.032 -8.746 1.00 0.00 H new ATOM 0 HG22 ILE A 37 11.190 1.253 -7.556 1.00 0.00 H new ATOM 0 HG23 ILE A 37 12.879 0.693 -7.586 1.00 0.00 H new ATOM 0 HD11 ILE A 37 12.500 -3.513 -8.515 1.00 0.00 H new ATOM 0 HD12 ILE A 37 10.854 -2.853 -8.358 1.00 0.00 H new ATOM 0 HD13 ILE A 37 12.127 -1.892 -9.147 1.00 0.00 H new ATOM 592 N GLN A 38 12.233 -2.034 -3.780 1.00 0.00 N ATOM 593 CA GLN A 38 11.979 -3.059 -2.783 1.00 0.00 C ATOM 594 C GLN A 38 11.443 -2.428 -1.496 1.00 0.00 C ATOM 595 O GLN A 38 12.197 -2.198 -0.552 1.00 0.00 O ATOM 596 CB GLN A 38 13.240 -3.880 -2.506 1.00 0.00 C ATOM 597 CG GLN A 38 13.353 -5.056 -3.479 1.00 0.00 C ATOM 598 CD GLN A 38 13.984 -6.272 -2.797 1.00 0.00 C ATOM 599 OE1 GLN A 38 13.909 -6.449 -1.593 1.00 0.00 O ATOM 600 NE2 GLN A 38 14.607 -7.098 -3.633 1.00 0.00 N ATOM 0 H GLN A 38 13.207 -1.955 -4.072 1.00 0.00 H new ATOM 0 HA GLN A 38 11.222 -3.738 -3.175 1.00 0.00 H new ATOM 0 HB2 GLN A 38 14.120 -3.243 -2.596 1.00 0.00 H new ATOM 0 HB3 GLN A 38 13.219 -4.252 -1.482 1.00 0.00 H new ATOM 0 HG2 GLN A 38 12.364 -5.318 -3.855 1.00 0.00 H new ATOM 0 HG3 GLN A 38 13.955 -4.764 -4.340 1.00 0.00 H new ATOM 0 HE21 GLN A 38 14.632 -6.890 -4.631 1.00 0.00 H new ATOM 0 HE22 GLN A 38 15.059 -7.940 -3.276 1.00 0.00 H new ATOM 609 N LEU A 39 10.144 -2.165 -1.500 1.00 0.00 N ATOM 610 CA LEU A 39 9.498 -1.565 -0.345 1.00 0.00 C ATOM 611 C LEU A 39 8.985 -2.671 0.579 1.00 0.00 C ATOM 612 O LEU A 39 8.591 -3.739 0.115 1.00 0.00 O ATOM 613 CB LEU A 39 8.413 -0.581 -0.789 1.00 0.00 C ATOM 614 CG LEU A 39 8.889 0.832 -1.132 1.00 0.00 C ATOM 615 CD1 LEU A 39 7.744 1.673 -1.701 1.00 0.00 C ATOM 616 CD2 LEU A 39 9.543 1.499 0.079 1.00 0.00 C ATOM 0 H LEU A 39 9.522 -2.357 -2.285 1.00 0.00 H new ATOM 0 HA LEU A 39 10.214 -0.977 0.229 1.00 0.00 H new ATOM 0 HB2 LEU A 39 7.910 -0.996 -1.663 1.00 0.00 H new ATOM 0 HB3 LEU A 39 7.668 -0.510 0.004 1.00 0.00 H new ATOM 0 HG LEU A 39 9.650 0.757 -1.908 1.00 0.00 H new ATOM 0 HD11 LEU A 39 8.109 2.673 -1.936 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.363 1.203 -2.608 1.00 0.00 H new ATOM 0 HD13 LEU A 39 6.943 1.743 -0.965 1.00 0.00 H new ATOM 0 HD21 LEU A 39 9.872 2.502 -0.192 1.00 0.00 H new ATOM 0 HD22 LEU A 39 8.822 1.562 0.894 1.00 0.00 H new ATOM 0 HD23 LEU A 39 10.402 0.909 0.399 1.00 0.00 H new ATOM 628 N GLN A 40 9.007 -2.376 1.870 1.00 0.00 N ATOM 629 CA GLN A 40 8.549 -3.332 2.864 1.00 0.00 C ATOM 630 C GLN A 40 7.179 -2.919 3.406 1.00 0.00 C ATOM 631 O GLN A 40 7.049 -1.880 4.050 1.00 0.00 O ATOM 632 CB GLN A 40 9.566 -3.474 3.998 1.00 0.00 C ATOM 633 CG GLN A 40 10.202 -4.866 3.992 1.00 0.00 C ATOM 634 CD GLN A 40 9.813 -5.651 5.246 1.00 0.00 C ATOM 635 OE1 GLN A 40 8.991 -6.552 5.215 1.00 0.00 O ATOM 636 NE2 GLN A 40 10.447 -5.261 6.348 1.00 0.00 N ATOM 0 H GLN A 40 9.335 -1.488 2.251 1.00 0.00 H new ATOM 0 HA GLN A 40 8.450 -4.306 2.384 1.00 0.00 H new ATOM 0 HB2 GLN A 40 10.342 -2.715 3.893 1.00 0.00 H new ATOM 0 HB3 GLN A 40 9.076 -3.298 4.955 1.00 0.00 H new ATOM 0 HG2 GLN A 40 9.884 -5.412 3.104 1.00 0.00 H new ATOM 0 HG3 GLN A 40 11.287 -4.774 3.938 1.00 0.00 H new ATOM 0 HE21 GLN A 40 11.124 -4.499 6.304 1.00 0.00 H new ATOM 0 HE22 GLN A 40 10.256 -5.724 7.237 1.00 0.00 H new ATOM 645 N LEU A 41 6.190 -3.755 3.123 1.00 0.00 N ATOM 646 CA LEU A 41 4.834 -3.490 3.574 1.00 0.00 C ATOM 647 C LEU A 41 4.604 -4.184 4.918 1.00 0.00 C ATOM 648 O LEU A 41 4.982 -5.340 5.097 1.00 0.00 O ATOM 649 CB LEU A 41 3.824 -3.887 2.495 1.00 0.00 C ATOM 650 CG LEU A 41 3.646 -2.894 1.345 1.00 0.00 C ATOM 651 CD1 LEU A 41 4.865 -1.979 1.217 1.00 0.00 C ATOM 652 CD2 LEU A 41 3.335 -3.622 0.036 1.00 0.00 C ATOM 0 H LEU A 41 6.301 -4.616 2.587 1.00 0.00 H new ATOM 0 HA LEU A 41 4.688 -2.422 3.737 1.00 0.00 H new ATOM 0 HB2 LEU A 41 4.128 -4.846 2.076 1.00 0.00 H new ATOM 0 HB3 LEU A 41 2.855 -4.039 2.971 1.00 0.00 H new ATOM 0 HG LEU A 41 2.790 -2.259 1.571 1.00 0.00 H new ATOM 0 HD11 LEU A 41 4.712 -1.283 0.392 1.00 0.00 H new ATOM 0 HD12 LEU A 41 4.999 -1.420 2.143 1.00 0.00 H new ATOM 0 HD13 LEU A 41 5.753 -2.581 1.024 1.00 0.00 H new ATOM 0 HD21 LEU A 41 3.213 -2.893 -0.765 1.00 0.00 H new ATOM 0 HD22 LEU A 41 4.155 -4.297 -0.209 1.00 0.00 H new ATOM 0 HD23 LEU A 41 2.415 -4.195 0.148 1.00 0.00 H new ATOM 664 N SER A 42 3.984 -3.448 5.829 1.00 0.00 N ATOM 665 CA SER A 42 3.698 -3.978 7.151 1.00 0.00 C ATOM 666 C SER A 42 2.308 -3.529 7.605 1.00 0.00 C ATOM 667 O SER A 42 1.786 -2.526 7.121 1.00 0.00 O ATOM 668 CB SER A 42 4.756 -3.534 8.163 1.00 0.00 C ATOM 669 OG SER A 42 6.078 -3.666 7.646 1.00 0.00 O ATOM 0 H SER A 42 3.672 -2.489 5.677 1.00 0.00 H new ATOM 0 HA SER A 42 3.721 -5.066 7.096 1.00 0.00 H new ATOM 0 HB2 SER A 42 4.578 -2.495 8.442 1.00 0.00 H new ATOM 0 HB3 SER A 42 4.661 -4.129 9.071 1.00 0.00 H new ATOM 0 HG SER A 42 6.724 -3.371 8.321 1.00 0.00 H new ATOM 675 N ALA A 43 1.747 -4.294 8.531 1.00 0.00 N ATOM 676 CA ALA A 43 0.427 -3.987 9.056 1.00 0.00 C ATOM 677 C ALA A 43 0.544 -3.632 10.540 1.00 0.00 C ATOM 678 O ALA A 43 1.087 -4.406 11.326 1.00 0.00 O ATOM 679 CB ALA A 43 -0.508 -5.173 8.812 1.00 0.00 C ATOM 0 H ALA A 43 2.182 -5.125 8.931 1.00 0.00 H new ATOM 0 HA ALA A 43 0.000 -3.125 8.543 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -1.498 -4.943 9.206 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -0.579 -5.366 7.742 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -0.114 -6.056 9.315 1.00 0.00 H new ATOM 685 N GLU A 44 0.024 -2.461 10.877 1.00 0.00 N ATOM 686 CA GLU A 44 0.063 -1.993 12.253 1.00 0.00 C ATOM 687 C GLU A 44 -1.351 -1.935 12.833 1.00 0.00 C ATOM 688 O GLU A 44 -1.562 -2.269 13.998 1.00 0.00 O ATOM 689 CB GLU A 44 0.752 -0.631 12.350 1.00 0.00 C ATOM 690 CG GLU A 44 0.057 0.264 13.378 1.00 0.00 C ATOM 691 CD GLU A 44 0.974 1.405 13.822 1.00 0.00 C ATOM 692 OE1 GLU A 44 2.189 1.139 13.950 1.00 0.00 O ATOM 693 OE2 GLU A 44 0.440 2.517 14.024 1.00 0.00 O ATOM 0 H GLU A 44 -0.427 -1.822 10.222 1.00 0.00 H new ATOM 0 HA GLU A 44 0.647 -2.701 12.841 1.00 0.00 H new ATOM 0 HB2 GLU A 44 1.797 -0.767 12.629 1.00 0.00 H new ATOM 0 HB3 GLU A 44 0.743 -0.145 11.374 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -0.857 0.674 12.949 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -0.235 -0.330 14.244 1.00 0.00 H new ATOM 700 N SER A 45 -2.284 -1.508 11.995 1.00 0.00 N ATOM 701 CA SER A 45 -3.672 -1.402 12.410 1.00 0.00 C ATOM 702 C SER A 45 -4.574 -2.130 11.412 1.00 0.00 C ATOM 703 O SER A 45 -4.146 -2.457 10.306 1.00 0.00 O ATOM 704 CB SER A 45 -4.098 0.062 12.540 1.00 0.00 C ATOM 705 OG SER A 45 -2.979 0.944 12.548 1.00 0.00 O ATOM 0 H SER A 45 -2.106 -1.231 11.030 1.00 0.00 H new ATOM 0 HA SER A 45 -3.772 -1.870 13.389 1.00 0.00 H new ATOM 0 HB2 SER A 45 -4.759 0.322 11.713 1.00 0.00 H new ATOM 0 HB3 SER A 45 -4.670 0.193 13.459 1.00 0.00 H new ATOM 0 HG SER A 45 -3.279 1.855 12.345 1.00 0.00 H new ATOM 711 N VAL A 46 -5.807 -2.364 11.839 1.00 0.00 N ATOM 712 CA VAL A 46 -6.773 -3.048 10.996 1.00 0.00 C ATOM 713 C VAL A 46 -7.103 -2.168 9.789 1.00 0.00 C ATOM 714 O VAL A 46 -7.617 -1.061 9.944 1.00 0.00 O ATOM 715 CB VAL A 46 -8.008 -3.425 11.816 1.00 0.00 C ATOM 716 CG1 VAL A 46 -8.482 -2.246 12.668 1.00 0.00 C ATOM 717 CG2 VAL A 46 -9.132 -3.935 10.912 1.00 0.00 C ATOM 0 H VAL A 46 -6.159 -2.092 12.757 1.00 0.00 H new ATOM 0 HA VAL A 46 -6.355 -3.980 10.615 1.00 0.00 H new ATOM 0 HB VAL A 46 -7.727 -4.234 12.490 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -9.361 -2.541 13.241 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -7.687 -1.948 13.351 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -8.736 -1.408 12.020 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -9.998 -4.196 11.520 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -9.409 -3.156 10.201 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -8.791 -4.817 10.369 1.00 0.00 H new ATOM 727 N GLY A 47 -6.795 -2.694 8.612 1.00 0.00 N ATOM 728 CA GLY A 47 -7.052 -1.970 7.379 1.00 0.00 C ATOM 729 C GLY A 47 -5.978 -0.910 7.130 1.00 0.00 C ATOM 730 O GLY A 47 -6.133 -0.056 6.259 1.00 0.00 O ATOM 0 H GLY A 47 -6.370 -3.613 8.487 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -7.079 -2.668 6.542 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.032 -1.495 7.430 1.00 0.00 H new ATOM 734 N GLU A 48 -4.911 -1.000 7.912 1.00 0.00 N ATOM 735 CA GLU A 48 -3.811 -0.059 7.787 1.00 0.00 C ATOM 736 C GLU A 48 -2.520 -0.797 7.428 1.00 0.00 C ATOM 737 O GLU A 48 -2.253 -1.878 7.950 1.00 0.00 O ATOM 738 CB GLU A 48 -3.638 0.755 9.071 1.00 0.00 C ATOM 739 CG GLU A 48 -4.932 1.484 9.437 1.00 0.00 C ATOM 740 CD GLU A 48 -4.652 2.666 10.368 1.00 0.00 C ATOM 741 OE1 GLU A 48 -4.186 3.702 9.846 1.00 0.00 O ATOM 742 OE2 GLU A 48 -4.909 2.506 11.580 1.00 0.00 O ATOM 0 H GLU A 48 -4.786 -1.710 8.634 1.00 0.00 H new ATOM 0 HA GLU A 48 -4.044 0.638 6.982 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -3.345 0.095 9.887 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -2.833 1.478 8.941 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -5.422 1.839 8.531 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -5.620 0.791 9.921 1.00 0.00 H new ATOM 749 N VAL A 49 -1.753 -0.183 6.538 1.00 0.00 N ATOM 750 CA VAL A 49 -0.497 -0.768 6.103 1.00 0.00 C ATOM 751 C VAL A 49 0.576 0.321 6.048 1.00 0.00 C ATOM 752 O VAL A 49 0.269 1.490 5.818 1.00 0.00 O ATOM 753 CB VAL A 49 -0.689 -1.485 4.765 1.00 0.00 C ATOM 754 CG1 VAL A 49 -1.700 -2.626 4.895 1.00 0.00 C ATOM 755 CG2 VAL A 49 -1.110 -0.501 3.671 1.00 0.00 C ATOM 0 H VAL A 49 -1.978 0.714 6.107 1.00 0.00 H new ATOM 0 HA VAL A 49 -0.160 -1.521 6.815 1.00 0.00 H new ATOM 0 HB VAL A 49 0.269 -1.917 4.476 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -1.818 -3.119 3.930 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -1.342 -3.347 5.630 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -2.661 -2.226 5.218 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -1.240 -1.036 2.730 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -2.050 -0.026 3.951 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -0.340 0.261 3.551 1.00 0.00 H new ATOM 765 N TYR A 50 1.814 -0.100 6.264 1.00 0.00 N ATOM 766 CA TYR A 50 2.934 0.825 6.243 1.00 0.00 C ATOM 767 C TYR A 50 3.921 0.464 5.131 1.00 0.00 C ATOM 768 O TYR A 50 4.312 -0.694 4.994 1.00 0.00 O ATOM 769 CB TYR A 50 3.631 0.674 7.596 1.00 0.00 C ATOM 770 CG TYR A 50 3.223 1.728 8.627 1.00 0.00 C ATOM 771 CD1 TYR A 50 3.594 3.045 8.451 1.00 0.00 C ATOM 772 CD2 TYR A 50 2.483 1.361 9.733 1.00 0.00 C ATOM 773 CE1 TYR A 50 3.209 4.037 9.422 1.00 0.00 C ATOM 774 CE2 TYR A 50 2.099 2.353 10.704 1.00 0.00 C ATOM 775 CZ TYR A 50 2.481 3.642 10.500 1.00 0.00 C ATOM 776 OH TYR A 50 2.118 4.579 11.417 1.00 0.00 O ATOM 0 H TYR A 50 2.066 -1.070 6.454 1.00 0.00 H new ATOM 0 HA TYR A 50 2.588 1.843 6.062 1.00 0.00 H new ATOM 0 HB2 TYR A 50 3.413 -0.316 7.997 1.00 0.00 H new ATOM 0 HB3 TYR A 50 4.709 0.726 7.446 1.00 0.00 H new ATOM 0 HD1 TYR A 50 4.173 3.332 7.586 1.00 0.00 H new ATOM 0 HD2 TYR A 50 2.192 0.330 9.870 1.00 0.00 H new ATOM 0 HE1 TYR A 50 3.492 5.072 9.296 1.00 0.00 H new ATOM 0 HE2 TYR A 50 1.521 2.079 11.574 1.00 0.00 H new ATOM 0 HH TYR A 50 2.461 5.455 11.143 1.00 0.00 H new ATOM 786 N ILE A 51 4.296 1.478 4.365 1.00 0.00 N ATOM 787 CA ILE A 51 5.230 1.282 3.269 1.00 0.00 C ATOM 788 C ILE A 51 6.515 2.063 3.554 1.00 0.00 C ATOM 789 O ILE A 51 6.527 3.291 3.487 1.00 0.00 O ATOM 790 CB ILE A 51 4.575 1.644 1.935 1.00 0.00 C ATOM 791 CG1 ILE A 51 3.080 1.316 1.951 1.00 0.00 C ATOM 792 CG2 ILE A 51 5.297 0.968 0.768 1.00 0.00 C ATOM 793 CD1 ILE A 51 2.409 1.750 0.646 1.00 0.00 C ATOM 0 H ILE A 51 3.970 2.438 4.482 1.00 0.00 H new ATOM 0 HA ILE A 51 5.506 0.231 3.188 1.00 0.00 H new ATOM 0 HB ILE A 51 4.667 2.720 1.791 1.00 0.00 H new ATOM 0 HG12 ILE A 51 2.941 0.245 2.097 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.603 1.817 2.793 1.00 0.00 H new ATOM 0 HG21 ILE A 51 4.811 1.242 -0.168 1.00 0.00 H new ATOM 0 HG22 ILE A 51 6.337 1.293 0.746 1.00 0.00 H new ATOM 0 HG23 ILE A 51 5.258 -0.114 0.894 1.00 0.00 H new ATOM 0 HD11 ILE A 51 1.347 1.505 0.684 1.00 0.00 H new ATOM 0 HD12 ILE A 51 2.529 2.825 0.515 1.00 0.00 H new ATOM 0 HD13 ILE A 51 2.872 1.229 -0.192 1.00 0.00 H new ATOM 805 N LYS A 52 7.565 1.318 3.867 1.00 0.00 N ATOM 806 CA LYS A 52 8.852 1.925 4.163 1.00 0.00 C ATOM 807 C LYS A 52 9.927 1.283 3.285 1.00 0.00 C ATOM 808 O LYS A 52 9.856 0.094 2.979 1.00 0.00 O ATOM 809 CB LYS A 52 9.151 1.842 5.662 1.00 0.00 C ATOM 810 CG LYS A 52 10.574 2.315 5.963 1.00 0.00 C ATOM 811 CD LYS A 52 11.070 1.749 7.296 1.00 0.00 C ATOM 812 CE LYS A 52 12.094 2.684 7.941 1.00 0.00 C ATOM 813 NZ LYS A 52 12.649 2.075 9.171 1.00 0.00 N ATOM 0 H LYS A 52 7.551 0.300 3.922 1.00 0.00 H new ATOM 0 HA LYS A 52 8.837 2.988 3.923 1.00 0.00 H new ATOM 0 HB2 LYS A 52 8.436 2.453 6.214 1.00 0.00 H new ATOM 0 HB3 LYS A 52 9.025 0.815 6.006 1.00 0.00 H new ATOM 0 HG2 LYS A 52 11.242 2.003 5.160 1.00 0.00 H new ATOM 0 HG3 LYS A 52 10.600 3.404 5.994 1.00 0.00 H new ATOM 0 HD2 LYS A 52 10.226 1.607 7.971 1.00 0.00 H new ATOM 0 HD3 LYS A 52 11.518 0.769 7.135 1.00 0.00 H new ATOM 0 HE2 LYS A 52 12.899 2.893 7.236 1.00 0.00 H new ATOM 0 HE3 LYS A 52 11.624 3.638 8.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 13.343 2.723 9.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 11.880 1.898 9.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 13.115 1.176 8.934 1.00 0.00 H new ATOM 827 N SER A 53 10.899 2.099 2.903 1.00 0.00 N ATOM 828 CA SER A 53 11.988 1.626 2.066 1.00 0.00 C ATOM 829 C SER A 53 13.009 0.866 2.915 1.00 0.00 C ATOM 830 O SER A 53 13.361 1.305 4.009 1.00 0.00 O ATOM 831 CB SER A 53 12.665 2.787 1.334 1.00 0.00 C ATOM 832 OG SER A 53 13.109 2.412 0.033 1.00 0.00 O ATOM 0 H SER A 53 10.955 3.085 3.158 1.00 0.00 H new ATOM 0 HA SER A 53 11.575 0.951 1.316 1.00 0.00 H new ATOM 0 HB2 SER A 53 11.967 3.620 1.253 1.00 0.00 H new ATOM 0 HB3 SER A 53 13.514 3.139 1.920 1.00 0.00 H new ATOM 0 HG SER A 53 13.534 3.181 -0.402 1.00 0.00 H new ATOM 838 N THR A 54 13.455 -0.260 2.379 1.00 0.00 N ATOM 839 CA THR A 54 14.429 -1.085 3.073 1.00 0.00 C ATOM 840 C THR A 54 15.849 -0.711 2.643 1.00 0.00 C ATOM 841 O THR A 54 16.817 -1.333 3.078 1.00 0.00 O ATOM 842 CB THR A 54 14.081 -2.551 2.810 1.00 0.00 C ATOM 843 OG1 THR A 54 14.212 -2.691 1.398 1.00 0.00 O ATOM 844 CG2 THR A 54 12.606 -2.860 3.079 1.00 0.00 C ATOM 0 H THR A 54 13.160 -0.621 1.472 1.00 0.00 H new ATOM 0 HA THR A 54 14.394 -0.916 4.149 1.00 0.00 H new ATOM 0 HB THR A 54 14.706 -3.190 3.434 1.00 0.00 H new ATOM 0 HG1 THR A 54 13.347 -2.520 0.971 1.00 0.00 H new ATOM 0 HG21 THR A 54 12.412 -3.913 2.877 1.00 0.00 H new ATOM 0 HG22 THR A 54 12.373 -2.641 4.121 1.00 0.00 H new ATOM 0 HG23 THR A 54 11.981 -2.245 2.431 1.00 0.00 H new ATOM 852 N GLU A 55 15.928 0.303 1.794 1.00 0.00 N ATOM 853 CA GLU A 55 17.213 0.767 1.301 1.00 0.00 C ATOM 854 C GLU A 55 17.608 2.073 1.994 1.00 0.00 C ATOM 855 O GLU A 55 18.490 2.083 2.852 1.00 0.00 O ATOM 856 CB GLU A 55 17.187 0.940 -0.219 1.00 0.00 C ATOM 857 CG GLU A 55 18.512 1.510 -0.730 1.00 0.00 C ATOM 858 CD GLU A 55 19.557 0.404 -0.893 1.00 0.00 C ATOM 859 OE1 GLU A 55 19.133 -0.767 -0.996 1.00 0.00 O ATOM 860 OE2 GLU A 55 20.757 0.756 -0.912 1.00 0.00 O ATOM 0 H GLU A 55 15.123 0.816 1.435 1.00 0.00 H new ATOM 0 HA GLU A 55 17.964 0.012 1.536 1.00 0.00 H new ATOM 0 HB2 GLU A 55 16.993 -0.022 -0.695 1.00 0.00 H new ATOM 0 HB3 GLU A 55 16.369 1.604 -0.499 1.00 0.00 H new ATOM 0 HG2 GLU A 55 18.353 2.009 -1.686 1.00 0.00 H new ATOM 0 HG3 GLU A 55 18.880 2.264 -0.034 1.00 0.00 H new ATOM 867 N THR A 56 16.936 3.143 1.596 1.00 0.00 N ATOM 868 CA THR A 56 17.206 4.451 2.169 1.00 0.00 C ATOM 869 C THR A 56 16.856 4.464 3.658 1.00 0.00 C ATOM 870 O THR A 56 17.707 4.757 4.497 1.00 0.00 O ATOM 871 CB THR A 56 16.434 5.492 1.354 1.00 0.00 C ATOM 872 OG1 THR A 56 15.100 4.992 1.326 1.00 0.00 O ATOM 873 CG2 THR A 56 16.855 5.514 -0.117 1.00 0.00 C ATOM 0 H THR A 56 16.206 3.131 0.884 1.00 0.00 H new ATOM 0 HA THR A 56 18.267 4.695 2.115 1.00 0.00 H new ATOM 0 HB THR A 56 16.586 6.479 1.790 1.00 0.00 H new ATOM 0 HG1 THR A 56 14.531 5.607 0.819 1.00 0.00 H new ATOM 0 HG21 THR A 56 16.277 6.269 -0.650 1.00 0.00 H new ATOM 0 HG22 THR A 56 17.916 5.752 -0.188 1.00 0.00 H new ATOM 0 HG23 THR A 56 16.672 4.536 -0.563 1.00 0.00 H new ATOM 881 N GLY A 57 15.602 4.143 3.941 1.00 0.00 N ATOM 882 CA GLY A 57 15.129 4.114 5.315 1.00 0.00 C ATOM 883 C GLY A 57 14.058 5.182 5.549 1.00 0.00 C ATOM 884 O GLY A 57 13.894 5.667 6.667 1.00 0.00 O ATOM 0 H GLY A 57 14.899 3.901 3.243 1.00 0.00 H new ATOM 0 HA2 GLY A 57 14.721 3.129 5.542 1.00 0.00 H new ATOM 0 HA3 GLY A 57 15.965 4.277 5.995 1.00 0.00 H new ATOM 888 N GLN A 58 13.358 5.517 4.476 1.00 0.00 N ATOM 889 CA GLN A 58 12.307 6.518 4.550 1.00 0.00 C ATOM 890 C GLN A 58 10.934 5.858 4.407 1.00 0.00 C ATOM 891 O GLN A 58 10.825 4.752 3.880 1.00 0.00 O ATOM 892 CB GLN A 58 12.507 7.602 3.489 1.00 0.00 C ATOM 893 CG GLN A 58 13.994 7.900 3.283 1.00 0.00 C ATOM 894 CD GLN A 58 14.206 8.826 2.084 1.00 0.00 C ATOM 895 OE1 GLN A 58 14.817 9.878 2.180 1.00 0.00 O ATOM 896 NE2 GLN A 58 13.670 8.377 0.952 1.00 0.00 N ATOM 0 H GLN A 58 13.498 5.113 3.550 1.00 0.00 H new ATOM 0 HA GLN A 58 12.358 6.998 5.527 1.00 0.00 H new ATOM 0 HB2 GLN A 58 12.063 7.280 2.547 1.00 0.00 H new ATOM 0 HB3 GLN A 58 11.989 8.512 3.791 1.00 0.00 H new ATOM 0 HG2 GLN A 58 14.404 8.362 4.181 1.00 0.00 H new ATOM 0 HG3 GLN A 58 14.537 6.968 3.128 1.00 0.00 H new ATOM 0 HE21 GLN A 58 13.171 7.487 0.942 1.00 0.00 H new ATOM 0 HE22 GLN A 58 13.758 8.922 0.095 1.00 0.00 H new ATOM 905 N TYR A 59 9.921 6.565 4.886 1.00 0.00 N ATOM 906 CA TYR A 59 8.559 6.061 4.818 1.00 0.00 C ATOM 907 C TYR A 59 7.770 6.763 3.711 1.00 0.00 C ATOM 908 O TYR A 59 7.995 7.940 3.434 1.00 0.00 O ATOM 909 CB TYR A 59 7.921 6.389 6.169 1.00 0.00 C ATOM 910 CG TYR A 59 8.791 6.022 7.374 1.00 0.00 C ATOM 911 CD1 TYR A 59 8.751 4.743 7.889 1.00 0.00 C ATOM 912 CD2 TYR A 59 9.615 6.971 7.944 1.00 0.00 C ATOM 913 CE1 TYR A 59 9.570 4.397 9.023 1.00 0.00 C ATOM 914 CE2 TYR A 59 10.434 6.626 9.077 1.00 0.00 C ATOM 915 CZ TYR A 59 10.371 5.356 9.561 1.00 0.00 C ATOM 916 OH TYR A 59 11.144 5.030 10.631 1.00 0.00 O ATOM 0 H TYR A 59 10.016 7.482 5.322 1.00 0.00 H new ATOM 0 HA TYR A 59 8.555 4.993 4.602 1.00 0.00 H new ATOM 0 HB2 TYR A 59 7.700 7.456 6.205 1.00 0.00 H new ATOM 0 HB3 TYR A 59 6.970 5.863 6.247 1.00 0.00 H new ATOM 0 HD1 TYR A 59 8.106 4.001 7.442 1.00 0.00 H new ATOM 0 HD2 TYR A 59 9.646 7.972 7.540 1.00 0.00 H new ATOM 0 HE1 TYR A 59 9.548 3.399 9.436 1.00 0.00 H new ATOM 0 HE2 TYR A 59 11.084 7.359 9.532 1.00 0.00 H new ATOM 0 HH TYR A 59 11.830 5.718 10.761 1.00 0.00 H new ATOM 926 N LEU A 60 6.861 6.011 3.108 1.00 0.00 N ATOM 927 CA LEU A 60 6.037 6.546 2.038 1.00 0.00 C ATOM 928 C LEU A 60 4.872 7.333 2.642 1.00 0.00 C ATOM 929 O LEU A 60 4.026 6.766 3.331 1.00 0.00 O ATOM 930 CB LEU A 60 5.598 5.428 1.090 1.00 0.00 C ATOM 931 CG LEU A 60 4.682 5.847 -0.062 1.00 0.00 C ATOM 932 CD1 LEU A 60 5.498 6.284 -1.280 1.00 0.00 C ATOM 933 CD2 LEU A 60 3.690 4.734 -0.406 1.00 0.00 C ATOM 0 H LEU A 60 6.677 5.035 3.340 1.00 0.00 H new ATOM 0 HA LEU A 60 6.611 7.243 1.428 1.00 0.00 H new ATOM 0 HB2 LEU A 60 6.490 4.965 0.669 1.00 0.00 H new ATOM 0 HB3 LEU A 60 5.087 4.663 1.674 1.00 0.00 H new ATOM 0 HG LEU A 60 4.099 6.709 0.261 1.00 0.00 H new ATOM 0 HD11 LEU A 60 4.823 6.577 -2.084 1.00 0.00 H new ATOM 0 HD12 LEU A 60 6.129 7.130 -1.010 1.00 0.00 H new ATOM 0 HD13 LEU A 60 6.124 5.457 -1.615 1.00 0.00 H new ATOM 0 HD21 LEU A 60 3.051 5.057 -1.228 1.00 0.00 H new ATOM 0 HD22 LEU A 60 4.236 3.838 -0.702 1.00 0.00 H new ATOM 0 HD23 LEU A 60 3.075 4.512 0.466 1.00 0.00 H new ATOM 945 N ALA A 61 4.867 8.628 2.361 1.00 0.00 N ATOM 946 CA ALA A 61 3.820 9.499 2.868 1.00 0.00 C ATOM 947 C ALA A 61 3.391 10.469 1.765 1.00 0.00 C ATOM 948 O ALA A 61 4.172 10.776 0.865 1.00 0.00 O ATOM 949 CB ALA A 61 4.320 10.223 4.119 1.00 0.00 C ATOM 0 H ALA A 61 5.571 9.095 1.789 1.00 0.00 H new ATOM 0 HA ALA A 61 2.943 8.919 3.156 1.00 0.00 H new ATOM 0 HB1 ALA A 61 3.535 10.876 4.499 1.00 0.00 H new ATOM 0 HB2 ALA A 61 4.584 9.491 4.882 1.00 0.00 H new ATOM 0 HB3 ALA A 61 5.198 10.819 3.868 1.00 0.00 H new ATOM 955 N MET A 62 2.152 10.925 1.871 1.00 0.00 N ATOM 956 CA MET A 62 1.610 11.854 0.894 1.00 0.00 C ATOM 957 C MET A 62 1.382 13.233 1.516 1.00 0.00 C ATOM 958 O MET A 62 0.573 13.379 2.431 1.00 0.00 O ATOM 959 CB MET A 62 0.285 11.312 0.353 1.00 0.00 C ATOM 960 CG MET A 62 -0.373 12.318 -0.593 1.00 0.00 C ATOM 961 SD MET A 62 -1.817 11.590 -1.349 1.00 0.00 S ATOM 962 CE MET A 62 -1.069 10.186 -2.158 1.00 0.00 C ATOM 0 H MET A 62 1.507 10.668 2.619 1.00 0.00 H new ATOM 0 HA MET A 62 2.329 11.957 0.081 1.00 0.00 H new ATOM 0 HB2 MET A 62 0.459 10.373 -0.173 1.00 0.00 H new ATOM 0 HB3 MET A 62 -0.388 11.093 1.182 1.00 0.00 H new ATOM 0 HG2 MET A 62 -0.654 13.217 -0.044 1.00 0.00 H new ATOM 0 HG3 MET A 62 0.336 12.623 -1.363 1.00 0.00 H new ATOM 0 HE1 MET A 62 -1.666 9.906 -3.026 1.00 0.00 H new ATOM 0 HE2 MET A 62 -0.061 10.446 -2.480 1.00 0.00 H new ATOM 0 HE3 MET A 62 -1.023 9.348 -1.463 1.00 0.00 H new ATOM 972 N ASP A 63 2.110 14.210 0.995 1.00 0.00 N ATOM 973 CA ASP A 63 1.997 15.572 1.488 1.00 0.00 C ATOM 974 C ASP A 63 0.623 16.133 1.114 1.00 0.00 C ATOM 975 O ASP A 63 -0.296 15.377 0.802 1.00 0.00 O ATOM 976 CB ASP A 63 3.062 16.475 0.862 1.00 0.00 C ATOM 977 CG ASP A 63 3.902 17.272 1.861 1.00 0.00 C ATOM 978 OD1 ASP A 63 3.410 17.459 2.995 1.00 0.00 O ATOM 979 OD2 ASP A 63 5.018 17.678 1.469 1.00 0.00 O ATOM 0 H ASP A 63 2.780 14.085 0.236 1.00 0.00 H new ATOM 0 HA ASP A 63 2.132 15.551 2.569 1.00 0.00 H new ATOM 0 HB2 ASP A 63 3.729 15.860 0.258 1.00 0.00 H new ATOM 0 HB3 ASP A 63 2.572 17.173 0.184 1.00 0.00 H new ATOM 984 N THR A 64 0.527 17.454 1.158 1.00 0.00 N ATOM 985 CA THR A 64 -0.719 18.125 0.828 1.00 0.00 C ATOM 986 C THR A 64 -0.825 18.340 -0.683 1.00 0.00 C ATOM 987 O THR A 64 -1.922 18.341 -1.238 1.00 0.00 O ATOM 988 CB THR A 64 -0.784 19.424 1.633 1.00 0.00 C ATOM 989 OG1 THR A 64 0.411 20.113 1.278 1.00 0.00 O ATOM 990 CG2 THR A 64 -0.645 19.188 3.139 1.00 0.00 C ATOM 0 H THR A 64 1.292 18.077 1.417 1.00 0.00 H new ATOM 0 HA THR A 64 -1.581 17.515 1.099 1.00 0.00 H new ATOM 0 HB THR A 64 -1.729 19.929 1.431 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.449 20.969 1.754 1.00 0.00 H new ATOM 0 HG21 THR A 64 -0.698 20.142 3.663 1.00 0.00 H new ATOM 0 HG22 THR A 64 -1.452 18.540 3.482 1.00 0.00 H new ATOM 0 HG23 THR A 64 0.314 18.713 3.346 1.00 0.00 H new ATOM 998 N ASP A 65 0.332 18.518 -1.305 1.00 0.00 N ATOM 999 CA ASP A 65 0.383 18.734 -2.741 1.00 0.00 C ATOM 1000 C ASP A 65 -0.282 17.555 -3.454 1.00 0.00 C ATOM 1001 O ASP A 65 -0.656 17.662 -4.621 1.00 0.00 O ATOM 1002 CB ASP A 65 1.829 18.829 -3.232 1.00 0.00 C ATOM 1003 CG ASP A 65 2.674 19.907 -2.550 1.00 0.00 C ATOM 1004 OD1 ASP A 65 3.191 19.612 -1.451 1.00 0.00 O ATOM 1005 OD2 ASP A 65 2.784 21.002 -3.143 1.00 0.00 O ATOM 0 H ASP A 65 1.240 18.517 -0.841 1.00 0.00 H new ATOM 0 HA ASP A 65 -0.135 19.668 -2.960 1.00 0.00 H new ATOM 0 HB2 ASP A 65 2.311 17.863 -3.084 1.00 0.00 H new ATOM 0 HB3 ASP A 65 1.821 19.020 -4.305 1.00 0.00 H new ATOM 1010 N GLY A 66 -0.409 16.458 -2.723 1.00 0.00 N ATOM 1011 CA GLY A 66 -1.023 15.260 -3.271 1.00 0.00 C ATOM 1012 C GLY A 66 0.038 14.298 -3.808 1.00 0.00 C ATOM 1013 O GLY A 66 -0.282 13.188 -4.230 1.00 0.00 O ATOM 0 H GLY A 66 -0.097 16.373 -1.756 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -1.612 14.764 -2.500 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.710 15.533 -4.072 1.00 0.00 H new ATOM 1017 N LEU A 67 1.280 14.758 -3.776 1.00 0.00 N ATOM 1018 CA LEU A 67 2.390 13.952 -4.254 1.00 0.00 C ATOM 1019 C LEU A 67 2.919 13.088 -3.108 1.00 0.00 C ATOM 1020 O LEU A 67 2.640 13.360 -1.941 1.00 0.00 O ATOM 1021 CB LEU A 67 3.458 14.839 -4.899 1.00 0.00 C ATOM 1022 CG LEU A 67 3.029 15.598 -6.156 1.00 0.00 C ATOM 1023 CD1 LEU A 67 1.811 14.938 -6.807 1.00 0.00 C ATOM 1024 CD2 LEU A 67 2.783 17.076 -5.847 1.00 0.00 C ATOM 0 H LEU A 67 1.542 15.680 -3.426 1.00 0.00 H new ATOM 0 HA LEU A 67 2.056 13.272 -5.038 1.00 0.00 H new ATOM 0 HB2 LEU A 67 3.796 15.564 -4.158 1.00 0.00 H new ATOM 0 HB3 LEU A 67 4.316 14.216 -5.150 1.00 0.00 H new ATOM 0 HG LEU A 67 3.844 15.551 -6.878 1.00 0.00 H new ATOM 0 HD11 LEU A 67 1.527 15.498 -7.698 1.00 0.00 H new ATOM 0 HD12 LEU A 67 2.058 13.913 -7.085 1.00 0.00 H new ATOM 0 HD13 LEU A 67 0.980 14.933 -6.102 1.00 0.00 H new ATOM 0 HD21 LEU A 67 2.479 17.592 -6.758 1.00 0.00 H new ATOM 0 HD22 LEU A 67 1.995 17.165 -5.099 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.699 17.525 -5.464 1.00 0.00 H new ATOM 1036 N LEU A 68 3.674 12.065 -3.480 1.00 0.00 N ATOM 1037 CA LEU A 68 4.244 11.159 -2.497 1.00 0.00 C ATOM 1038 C LEU A 68 5.702 11.546 -2.239 1.00 0.00 C ATOM 1039 O LEU A 68 6.404 11.977 -3.152 1.00 0.00 O ATOM 1040 CB LEU A 68 4.063 9.705 -2.939 1.00 0.00 C ATOM 1041 CG LEU A 68 2.633 9.164 -2.893 1.00 0.00 C ATOM 1042 CD1 LEU A 68 2.373 8.202 -4.054 1.00 0.00 C ATOM 1043 CD2 LEU A 68 2.334 8.520 -1.538 1.00 0.00 C ATOM 0 H LEU A 68 3.904 11.843 -4.449 1.00 0.00 H new ATOM 0 HA LEU A 68 3.717 11.247 -1.547 1.00 0.00 H new ATOM 0 HB2 LEU A 68 4.435 9.607 -3.959 1.00 0.00 H new ATOM 0 HB3 LEU A 68 4.690 9.074 -2.309 1.00 0.00 H new ATOM 0 HG LEU A 68 1.947 10.003 -3.010 1.00 0.00 H new ATOM 0 HD11 LEU A 68 1.349 7.832 -3.998 1.00 0.00 H new ATOM 0 HD12 LEU A 68 2.518 8.725 -4.999 1.00 0.00 H new ATOM 0 HD13 LEU A 68 3.066 7.363 -3.993 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.311 8.144 -1.532 1.00 0.00 H new ATOM 0 HD22 LEU A 68 3.025 7.695 -1.367 1.00 0.00 H new ATOM 0 HD23 LEU A 68 2.452 9.262 -0.748 1.00 0.00 H new ATOM 1055 N TYR A 69 6.113 11.378 -0.991 1.00 0.00 N ATOM 1056 CA TYR A 69 7.474 11.705 -0.601 1.00 0.00 C ATOM 1057 C TYR A 69 7.927 10.846 0.582 1.00 0.00 C ATOM 1058 O TYR A 69 7.106 10.413 1.389 1.00 0.00 O ATOM 1059 CB TYR A 69 7.449 13.172 -0.170 1.00 0.00 C ATOM 1060 CG TYR A 69 6.803 13.409 1.197 1.00 0.00 C ATOM 1061 CD1 TYR A 69 7.430 12.962 2.343 1.00 0.00 C ATOM 1062 CD2 TYR A 69 5.594 14.068 1.284 1.00 0.00 C ATOM 1063 CE1 TYR A 69 6.822 13.184 3.629 1.00 0.00 C ATOM 1064 CE2 TYR A 69 4.986 14.291 2.571 1.00 0.00 C ATOM 1065 CZ TYR A 69 5.630 13.837 3.680 1.00 0.00 C ATOM 1066 OH TYR A 69 5.056 14.047 4.895 1.00 0.00 O ATOM 0 H TYR A 69 5.527 11.020 -0.237 1.00 0.00 H new ATOM 0 HA TYR A 69 8.163 11.524 -1.426 1.00 0.00 H new ATOM 0 HB2 TYR A 69 8.471 13.551 -0.148 1.00 0.00 H new ATOM 0 HB3 TYR A 69 6.910 13.751 -0.920 1.00 0.00 H new ATOM 0 HD1 TYR A 69 8.376 12.446 2.275 1.00 0.00 H new ATOM 0 HD2 TYR A 69 5.103 14.417 0.387 1.00 0.00 H new ATOM 0 HE1 TYR A 69 7.302 12.840 4.533 1.00 0.00 H new ATOM 0 HE2 TYR A 69 4.041 14.807 2.653 1.00 0.00 H new ATOM 0 HH TYR A 69 4.209 14.526 4.778 1.00 0.00 H new ATOM 1076 N GLY A 70 9.231 10.625 0.646 1.00 0.00 N ATOM 1077 CA GLY A 70 9.803 9.825 1.717 1.00 0.00 C ATOM 1078 C GLY A 70 9.921 10.640 3.006 1.00 0.00 C ATOM 1079 O GLY A 70 10.576 11.681 3.030 1.00 0.00 O ATOM 0 H GLY A 70 9.909 10.985 -0.026 1.00 0.00 H new ATOM 0 HA2 GLY A 70 9.181 8.948 1.893 1.00 0.00 H new ATOM 0 HA3 GLY A 70 10.787 9.463 1.420 1.00 0.00 H new ATOM 1083 N SER A 71 9.276 10.136 4.048 1.00 0.00 N ATOM 1084 CA SER A 71 9.301 10.804 5.338 1.00 0.00 C ATOM 1085 C SER A 71 10.536 10.369 6.130 1.00 0.00 C ATOM 1086 O SER A 71 10.877 9.187 6.155 1.00 0.00 O ATOM 1087 CB SER A 71 8.029 10.508 6.136 1.00 0.00 C ATOM 1088 OG SER A 71 8.181 9.371 6.981 1.00 0.00 O ATOM 0 H SER A 71 8.733 9.273 4.025 1.00 0.00 H new ATOM 0 HA SER A 71 9.348 11.879 5.165 1.00 0.00 H new ATOM 0 HB2 SER A 71 7.770 11.377 6.741 1.00 0.00 H new ATOM 0 HB3 SER A 71 7.200 10.340 5.448 1.00 0.00 H new ATOM 0 HG SER A 71 7.412 9.307 7.585 1.00 0.00 H new ATOM 1094 N GLN A 72 11.173 11.347 6.756 1.00 0.00 N ATOM 1095 CA GLN A 72 12.363 11.081 7.546 1.00 0.00 C ATOM 1096 C GLN A 72 12.002 10.269 8.792 1.00 0.00 C ATOM 1097 O GLN A 72 12.793 9.446 9.252 1.00 0.00 O ATOM 1098 CB GLN A 72 13.073 12.382 7.925 1.00 0.00 C ATOM 1099 CG GLN A 72 12.071 13.429 8.416 1.00 0.00 C ATOM 1100 CD GLN A 72 12.774 14.524 9.222 1.00 0.00 C ATOM 1101 OE1 GLN A 72 13.189 14.130 10.422 1.00 0.00 O flip ATOM 1102 NE2 GLN A 72 12.928 15.652 8.783 1.00 0.00 N flip ATOM 0 H GLN A 72 10.887 12.326 6.732 1.00 0.00 H new ATOM 0 HA GLN A 72 13.053 10.493 6.941 1.00 0.00 H new ATOM 0 HB2 GLN A 72 13.810 12.185 8.704 1.00 0.00 H new ATOM 0 HB3 GLN A 72 13.616 12.769 7.063 1.00 0.00 H new ATOM 0 HG2 GLN A 72 11.556 13.873 7.564 1.00 0.00 H new ATOM 0 HG3 GLN A 72 11.311 12.949 9.033 1.00 0.00 H new ATOM 0 HE21 GLN A 72 12.585 15.888 7.852 1.00 0.00 H new ATOM 0 HE22 GLN A 72 13.400 16.359 9.347 1.00 0.00 H new ATOM 1111 N THR A 73 10.808 10.530 9.303 1.00 0.00 N ATOM 1112 CA THR A 73 10.333 9.834 10.487 1.00 0.00 C ATOM 1113 C THR A 73 8.963 9.207 10.224 1.00 0.00 C ATOM 1114 O THR A 73 8.235 9.647 9.335 1.00 0.00 O ATOM 1115 CB THR A 73 10.333 10.827 11.651 1.00 0.00 C ATOM 1116 OG1 THR A 73 9.694 11.985 11.120 1.00 0.00 O ATOM 1117 CG2 THR A 73 11.740 11.310 12.009 1.00 0.00 C ATOM 0 H THR A 73 10.155 11.213 8.919 1.00 0.00 H new ATOM 0 HA THR A 73 10.990 9.005 10.748 1.00 0.00 H new ATOM 0 HB THR A 73 9.876 10.362 12.524 1.00 0.00 H new ATOM 0 HG1 THR A 73 9.650 12.680 11.810 1.00 0.00 H new ATOM 0 HG21 THR A 73 11.683 12.012 12.841 1.00 0.00 H new ATOM 0 HG22 THR A 73 12.355 10.457 12.296 1.00 0.00 H new ATOM 0 HG23 THR A 73 12.185 11.805 11.146 1.00 0.00 H new ATOM 1125 N PRO A 74 8.643 8.163 11.033 1.00 0.00 N ATOM 1126 CA PRO A 74 7.373 7.471 10.896 1.00 0.00 C ATOM 1127 C PRO A 74 6.227 8.309 11.468 1.00 0.00 C ATOM 1128 O PRO A 74 6.131 8.490 12.681 1.00 0.00 O ATOM 1129 CB PRO A 74 7.563 6.150 11.625 1.00 0.00 C ATOM 1130 CG PRO A 74 8.766 6.346 12.534 1.00 0.00 C ATOM 1131 CD PRO A 74 9.480 7.614 12.097 1.00 0.00 C ATOM 0 HA PRO A 74 7.098 7.301 9.855 1.00 0.00 H new ATOM 0 HB2 PRO A 74 6.675 5.891 12.202 1.00 0.00 H new ATOM 0 HB3 PRO A 74 7.734 5.336 10.921 1.00 0.00 H new ATOM 0 HG2 PRO A 74 8.449 6.426 13.574 1.00 0.00 H new ATOM 0 HG3 PRO A 74 9.437 5.489 12.470 1.00 0.00 H new ATOM 0 HD2 PRO A 74 9.581 8.317 12.924 1.00 0.00 H new ATOM 0 HD3 PRO A 74 10.486 7.398 11.738 1.00 0.00 H new ATOM 1139 N ASN A 75 5.388 8.798 10.567 1.00 0.00 N ATOM 1140 CA ASN A 75 4.253 9.613 10.967 1.00 0.00 C ATOM 1141 C ASN A 75 2.970 9.010 10.391 1.00 0.00 C ATOM 1142 O ASN A 75 3.014 8.272 9.408 1.00 0.00 O ATOM 1143 CB ASN A 75 4.385 11.041 10.433 1.00 0.00 C ATOM 1144 CG ASN A 75 5.681 11.692 10.923 1.00 0.00 C ATOM 1145 OD1 ASN A 75 5.848 12.000 12.092 1.00 0.00 O ATOM 1146 ND2 ASN A 75 6.585 11.883 9.967 1.00 0.00 N ATOM 0 H ASN A 75 5.471 8.646 9.562 1.00 0.00 H new ATOM 0 HA ASN A 75 4.222 9.637 12.056 1.00 0.00 H new ATOM 0 HB2 ASN A 75 4.370 11.028 9.343 1.00 0.00 H new ATOM 0 HB3 ASN A 75 3.530 11.635 10.757 1.00 0.00 H new ATOM 0 HD21 ASN A 75 7.483 12.311 10.192 1.00 0.00 H new ATOM 0 HD22 ASN A 75 6.380 11.602 9.008 1.00 0.00 H new ATOM 1153 N GLU A 76 1.859 9.347 11.028 1.00 0.00 N ATOM 1154 CA GLU A 76 0.566 8.848 10.592 1.00 0.00 C ATOM 1155 C GLU A 76 0.426 8.991 9.075 1.00 0.00 C ATOM 1156 O GLU A 76 -0.195 8.152 8.423 1.00 0.00 O ATOM 1157 CB GLU A 76 -0.573 9.568 11.317 1.00 0.00 C ATOM 1158 CG GLU A 76 -0.832 8.941 12.689 1.00 0.00 C ATOM 1159 CD GLU A 76 -2.195 9.367 13.238 1.00 0.00 C ATOM 1160 OE1 GLU A 76 -3.201 8.792 12.768 1.00 0.00 O ATOM 1161 OE2 GLU A 76 -2.201 10.257 14.115 1.00 0.00 O ATOM 0 H GLU A 76 1.827 9.960 11.843 1.00 0.00 H new ATOM 0 HA GLU A 76 0.503 7.790 10.846 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -0.324 10.622 11.436 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -1.480 9.521 10.714 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -0.791 7.855 12.610 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -0.047 9.240 13.383 1.00 0.00 H new ATOM 1168 N GLU A 77 1.014 10.059 8.556 1.00 0.00 N ATOM 1169 CA GLU A 77 0.963 10.323 7.128 1.00 0.00 C ATOM 1170 C GLU A 77 1.536 9.137 6.349 1.00 0.00 C ATOM 1171 O GLU A 77 1.162 8.905 5.201 1.00 0.00 O ATOM 1172 CB GLU A 77 1.703 11.616 6.783 1.00 0.00 C ATOM 1173 CG GLU A 77 0.958 12.837 7.326 1.00 0.00 C ATOM 1174 CD GLU A 77 1.348 14.103 6.562 1.00 0.00 C ATOM 1175 OE1 GLU A 77 1.514 13.993 5.328 1.00 0.00 O ATOM 1176 OE2 GLU A 77 1.472 15.153 7.229 1.00 0.00 O ATOM 0 H GLU A 77 1.529 10.752 9.099 1.00 0.00 H new ATOM 0 HA GLU A 77 -0.080 10.453 6.838 1.00 0.00 H new ATOM 0 HB2 GLU A 77 2.710 11.585 7.200 1.00 0.00 H new ATOM 0 HB3 GLU A 77 1.808 11.701 5.701 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -0.117 12.677 7.246 1.00 0.00 H new ATOM 0 HG3 GLU A 77 1.183 12.963 8.385 1.00 0.00 H new ATOM 1183 N CYS A 78 2.436 8.419 7.005 1.00 0.00 N ATOM 1184 CA CYS A 78 3.065 7.263 6.388 1.00 0.00 C ATOM 1185 C CYS A 78 2.102 6.079 6.493 1.00 0.00 C ATOM 1186 O CYS A 78 2.233 5.101 5.758 1.00 0.00 O ATOM 1187 CB CYS A 78 4.423 6.953 7.021 1.00 0.00 C ATOM 1188 SG CYS A 78 5.463 8.459 7.040 1.00 0.00 S ATOM 0 H CYS A 78 2.745 8.615 7.957 1.00 0.00 H new ATOM 0 HA CYS A 78 3.267 7.473 5.338 1.00 0.00 H new ATOM 0 HB2 CYS A 78 4.284 6.584 8.037 1.00 0.00 H new ATOM 0 HB3 CYS A 78 4.923 6.163 6.461 1.00 0.00 H new ATOM 0 HG CYS A 78 4.870 9.387 7.730 1.00 0.00 H new ATOM 1194 N LEU A 79 1.157 6.206 7.413 1.00 0.00 N ATOM 1195 CA LEU A 79 0.173 5.158 7.624 1.00 0.00 C ATOM 1196 C LEU A 79 -0.998 5.363 6.661 1.00 0.00 C ATOM 1197 O LEU A 79 -1.661 6.398 6.697 1.00 0.00 O ATOM 1198 CB LEU A 79 -0.243 5.102 9.095 1.00 0.00 C ATOM 1199 CG LEU A 79 -1.044 3.869 9.519 1.00 0.00 C ATOM 1200 CD1 LEU A 79 -0.615 2.635 8.723 1.00 0.00 C ATOM 1201 CD2 LEU A 79 -0.943 3.641 11.029 1.00 0.00 C ATOM 0 H LEU A 79 1.052 7.019 8.021 1.00 0.00 H new ATOM 0 HA LEU A 79 0.603 4.181 7.401 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.656 5.155 9.709 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -0.835 5.990 9.319 1.00 0.00 H new ATOM 0 HG LEU A 79 -2.094 4.050 9.290 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.200 1.773 9.044 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.782 2.811 7.660 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.443 2.440 8.896 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -1.521 2.759 11.303 1.00 0.00 H new ATOM 0 HD22 LEU A 79 0.101 3.491 11.305 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -1.336 4.511 11.555 1.00 0.00 H new ATOM 1213 N PHE A 80 -1.217 4.360 5.824 1.00 0.00 N ATOM 1214 CA PHE A 80 -2.297 4.417 4.853 1.00 0.00 C ATOM 1215 C PHE A 80 -3.344 3.337 5.133 1.00 0.00 C ATOM 1216 O PHE A 80 -3.086 2.397 5.883 1.00 0.00 O ATOM 1217 CB PHE A 80 -1.676 4.164 3.478 1.00 0.00 C ATOM 1218 CG PHE A 80 -0.893 5.355 2.920 1.00 0.00 C ATOM 1219 CD1 PHE A 80 0.139 5.883 3.631 1.00 0.00 C ATOM 1220 CD2 PHE A 80 -1.229 5.884 1.713 1.00 0.00 C ATOM 1221 CE1 PHE A 80 0.866 6.987 3.113 1.00 0.00 C ATOM 1222 CE2 PHE A 80 -0.503 6.989 1.196 1.00 0.00 C ATOM 1223 CZ PHE A 80 0.529 7.517 1.906 1.00 0.00 C ATOM 0 H PHE A 80 -0.665 3.503 5.798 1.00 0.00 H new ATOM 0 HA PHE A 80 -2.792 5.387 4.904 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -1.010 3.303 3.544 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -2.467 3.902 2.776 1.00 0.00 H new ATOM 0 HD1 PHE A 80 0.405 5.463 4.589 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -2.048 5.464 1.148 1.00 0.00 H new ATOM 0 HE1 PHE A 80 1.686 7.406 3.677 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -0.771 7.410 0.238 1.00 0.00 H new ATOM 0 HZ PHE A 80 1.081 8.357 1.512 1.00 0.00 H new ATOM 1233 N LEU A 81 -4.504 3.509 4.516 1.00 0.00 N ATOM 1234 CA LEU A 81 -5.591 2.561 4.690 1.00 0.00 C ATOM 1235 C LEU A 81 -5.700 1.682 3.442 1.00 0.00 C ATOM 1236 O LEU A 81 -5.820 2.191 2.329 1.00 0.00 O ATOM 1237 CB LEU A 81 -6.888 3.291 5.043 1.00 0.00 C ATOM 1238 CG LEU A 81 -6.769 4.403 6.088 1.00 0.00 C ATOM 1239 CD1 LEU A 81 -5.945 3.938 7.290 1.00 0.00 C ATOM 1240 CD2 LEU A 81 -6.205 5.682 5.466 1.00 0.00 C ATOM 0 H LEU A 81 -4.715 4.290 3.895 1.00 0.00 H new ATOM 0 HA LEU A 81 -5.387 1.898 5.531 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -7.300 3.720 4.130 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.608 2.557 5.403 1.00 0.00 H new ATOM 0 HG LEU A 81 -7.769 4.637 6.454 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -5.875 4.746 8.018 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.427 3.076 7.750 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.944 3.660 6.959 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -6.131 6.456 6.230 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.215 5.481 5.055 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.866 6.021 4.669 1.00 0.00 H new ATOM 1252 N GLU A 82 -5.654 0.378 3.670 1.00 0.00 N ATOM 1253 CA GLU A 82 -5.746 -0.576 2.577 1.00 0.00 C ATOM 1254 C GLU A 82 -7.091 -1.305 2.621 1.00 0.00 C ATOM 1255 O GLU A 82 -7.653 -1.514 3.695 1.00 0.00 O ATOM 1256 CB GLU A 82 -4.583 -1.569 2.617 1.00 0.00 C ATOM 1257 CG GLU A 82 -4.878 -2.794 1.748 1.00 0.00 C ATOM 1258 CD GLU A 82 -5.640 -3.858 2.541 1.00 0.00 C ATOM 1259 OE1 GLU A 82 -4.986 -4.521 3.375 1.00 0.00 O ATOM 1260 OE2 GLU A 82 -6.859 -3.984 2.295 1.00 0.00 O ATOM 0 H GLU A 82 -5.554 -0.041 4.595 1.00 0.00 H new ATOM 0 HA GLU A 82 -5.682 -0.029 1.636 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -3.672 -1.082 2.268 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -4.403 -1.883 3.645 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -5.463 -2.495 0.878 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -3.944 -3.213 1.375 1.00 0.00 H new ATOM 1267 N ARG A 83 -7.568 -1.671 1.440 1.00 0.00 N ATOM 1268 CA ARG A 83 -8.836 -2.371 1.330 1.00 0.00 C ATOM 1269 C ARG A 83 -8.828 -3.294 0.110 1.00 0.00 C ATOM 1270 O ARG A 83 -7.960 -3.180 -0.754 1.00 0.00 O ATOM 1271 CB ARG A 83 -10.001 -1.386 1.208 1.00 0.00 C ATOM 1272 CG ARG A 83 -11.066 -1.664 2.270 1.00 0.00 C ATOM 1273 CD ARG A 83 -12.447 -1.827 1.632 1.00 0.00 C ATOM 1274 NE ARG A 83 -13.503 -1.551 2.631 1.00 0.00 N ATOM 1275 CZ ARG A 83 -13.893 -0.321 2.992 1.00 0.00 C ATOM 1276 NH1 ARG A 83 -13.318 0.754 2.437 1.00 0.00 N ATOM 1277 NH2 ARG A 83 -14.860 -0.166 3.907 1.00 0.00 N ATOM 0 H ARG A 83 -7.099 -1.496 0.551 1.00 0.00 H new ATOM 0 HA ARG A 83 -8.968 -2.962 2.237 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -9.632 -0.366 1.316 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -10.444 -1.462 0.215 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -10.807 -2.568 2.822 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -11.088 -0.846 2.990 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -12.548 -1.147 0.786 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -12.559 -2.839 1.242 1.00 0.00 H new ATOM 0 HE ARG A 83 -13.963 -2.347 3.073 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -12.583 0.636 1.739 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -13.615 1.690 2.712 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -15.299 -0.984 4.329 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -15.157 0.770 4.182 1.00 0.00 H new ATOM 1291 N LEU A 84 -9.805 -4.188 0.078 1.00 0.00 N ATOM 1292 CA LEU A 84 -9.922 -5.130 -1.022 1.00 0.00 C ATOM 1293 C LEU A 84 -10.882 -4.566 -2.072 1.00 0.00 C ATOM 1294 O LEU A 84 -12.089 -4.505 -1.844 1.00 0.00 O ATOM 1295 CB LEU A 84 -10.322 -6.513 -0.504 1.00 0.00 C ATOM 1296 CG LEU A 84 -10.031 -7.690 -1.438 1.00 0.00 C ATOM 1297 CD1 LEU A 84 -10.793 -7.544 -2.757 1.00 0.00 C ATOM 1298 CD2 LEU A 84 -8.526 -7.855 -1.659 1.00 0.00 C ATOM 0 H LEU A 84 -10.523 -4.280 0.796 1.00 0.00 H new ATOM 0 HA LEU A 84 -8.957 -5.265 -1.511 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -9.807 -6.688 0.440 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -11.390 -6.503 -0.287 1.00 0.00 H new ATOM 0 HG LEU A 84 -10.387 -8.603 -0.960 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -10.569 -8.393 -3.403 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -11.864 -7.513 -2.557 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -10.490 -6.622 -3.252 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -8.346 -8.698 -2.326 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -8.122 -6.946 -2.106 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -8.036 -8.038 -0.703 1.00 0.00 H new ATOM 1310 N GLU A 85 -10.309 -4.169 -3.198 1.00 0.00 N ATOM 1311 CA GLU A 85 -11.099 -3.612 -4.283 1.00 0.00 C ATOM 1312 C GLU A 85 -11.361 -4.676 -5.350 1.00 0.00 C ATOM 1313 O GLU A 85 -10.602 -5.637 -5.473 1.00 0.00 O ATOM 1314 CB GLU A 85 -10.412 -2.386 -4.888 1.00 0.00 C ATOM 1315 CG GLU A 85 -10.648 -1.144 -4.027 1.00 0.00 C ATOM 1316 CD GLU A 85 -11.161 0.022 -4.874 1.00 0.00 C ATOM 1317 OE1 GLU A 85 -10.711 0.120 -6.036 1.00 0.00 O ATOM 1318 OE2 GLU A 85 -11.992 0.789 -4.341 1.00 0.00 O ATOM 0 H GLU A 85 -9.307 -4.222 -3.383 1.00 0.00 H new ATOM 0 HA GLU A 85 -12.058 -3.288 -3.879 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -9.342 -2.572 -4.978 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -10.791 -2.212 -5.895 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -11.369 -1.373 -3.242 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -9.719 -0.858 -3.533 1.00 0.00 H new ATOM 1325 N GLU A 86 -12.436 -4.470 -6.096 1.00 0.00 N ATOM 1326 CA GLU A 86 -12.807 -5.400 -7.149 1.00 0.00 C ATOM 1327 C GLU A 86 -11.634 -5.612 -8.107 1.00 0.00 C ATOM 1328 O GLU A 86 -10.530 -5.128 -7.860 1.00 0.00 O ATOM 1329 CB GLU A 86 -14.047 -4.912 -7.900 1.00 0.00 C ATOM 1330 CG GLU A 86 -15.310 -5.605 -7.382 1.00 0.00 C ATOM 1331 CD GLU A 86 -16.548 -5.126 -8.142 1.00 0.00 C ATOM 1332 OE1 GLU A 86 -16.854 -3.919 -8.026 1.00 0.00 O ATOM 1333 OE2 GLU A 86 -17.162 -5.977 -8.821 1.00 0.00 O ATOM 0 H GLU A 86 -13.063 -3.672 -5.992 1.00 0.00 H new ATOM 0 HA GLU A 86 -13.054 -6.358 -6.691 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -14.146 -3.833 -7.783 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -13.932 -5.108 -8.966 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -15.207 -6.685 -7.490 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -15.431 -5.402 -6.318 1.00 0.00 H new ATOM 1340 N ASN A 87 -11.912 -6.336 -9.181 1.00 0.00 N ATOM 1341 CA ASN A 87 -10.893 -6.618 -10.178 1.00 0.00 C ATOM 1342 C ASN A 87 -9.691 -7.278 -9.500 1.00 0.00 C ATOM 1343 O ASN A 87 -8.587 -7.272 -10.042 1.00 0.00 O ATOM 1344 CB ASN A 87 -10.409 -5.332 -10.850 1.00 0.00 C ATOM 1345 CG ASN A 87 -11.575 -4.575 -11.489 1.00 0.00 C ATOM 1346 OD1 ASN A 87 -12.718 -5.002 -11.458 1.00 0.00 O ATOM 1347 ND2 ASN A 87 -11.225 -3.430 -12.069 1.00 0.00 N ATOM 0 H ASN A 87 -12.828 -6.736 -9.383 1.00 0.00 H new ATOM 0 HA ASN A 87 -11.330 -7.275 -10.930 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -9.917 -4.696 -10.114 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -9.666 -5.572 -11.611 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -11.932 -2.852 -12.524 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -10.250 -3.130 -12.059 1.00 0.00 H new ATOM 1354 N HIS A 88 -9.946 -7.832 -8.324 1.00 0.00 N ATOM 1355 CA HIS A 88 -8.898 -8.495 -7.566 1.00 0.00 C ATOM 1356 C HIS A 88 -7.696 -7.560 -7.426 1.00 0.00 C ATOM 1357 O HIS A 88 -6.606 -7.868 -7.907 1.00 0.00 O ATOM 1358 CB HIS A 88 -8.534 -9.838 -8.202 1.00 0.00 C ATOM 1359 CG HIS A 88 -8.187 -10.917 -7.204 1.00 0.00 C ATOM 1360 ND1 HIS A 88 -8.958 -11.179 -6.085 1.00 0.00 N ATOM 1361 CD2 HIS A 88 -7.145 -11.796 -7.168 1.00 0.00 C ATOM 1362 CE1 HIS A 88 -8.396 -12.173 -5.413 1.00 0.00 C ATOM 1363 NE2 HIS A 88 -7.272 -12.554 -6.086 1.00 0.00 N ATOM 0 H HIS A 88 -10.863 -7.836 -7.877 1.00 0.00 H new ATOM 0 HA HIS A 88 -9.258 -8.720 -6.562 1.00 0.00 H new ATOM 0 HB2 HIS A 88 -9.371 -10.178 -8.813 1.00 0.00 H new ATOM 0 HB3 HIS A 88 -7.688 -9.693 -8.873 1.00 0.00 H new ATOM 0 HD2 HIS A 88 -6.351 -11.864 -7.897 1.00 0.00 H new ATOM 0 HE1 HIS A 88 -8.763 -12.606 -4.494 1.00 0.00 H new ATOM 0 HE2 HIS A 88 -6.634 -13.299 -5.804 1.00 0.00 H new ATOM 1371 N TYR A 89 -7.934 -6.436 -6.766 1.00 0.00 N ATOM 1372 CA TYR A 89 -6.884 -5.454 -6.557 1.00 0.00 C ATOM 1373 C TYR A 89 -6.999 -4.815 -5.172 1.00 0.00 C ATOM 1374 O TYR A 89 -8.038 -4.919 -4.520 1.00 0.00 O ATOM 1375 CB TYR A 89 -7.096 -4.377 -7.622 1.00 0.00 C ATOM 1376 CG TYR A 89 -6.363 -4.649 -8.937 1.00 0.00 C ATOM 1377 CD1 TYR A 89 -5.073 -5.140 -8.919 1.00 0.00 C ATOM 1378 CD2 TYR A 89 -6.990 -4.403 -10.141 1.00 0.00 C ATOM 1379 CE1 TYR A 89 -4.383 -5.396 -10.156 1.00 0.00 C ATOM 1380 CE2 TYR A 89 -6.300 -4.659 -11.378 1.00 0.00 C ATOM 1381 CZ TYR A 89 -5.030 -5.143 -11.325 1.00 0.00 C ATOM 1382 OH TYR A 89 -4.378 -5.385 -12.494 1.00 0.00 O ATOM 0 H TYR A 89 -8.839 -6.184 -6.369 1.00 0.00 H new ATOM 0 HA TYR A 89 -5.902 -5.922 -6.625 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -8.163 -4.286 -7.825 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -6.764 -3.418 -7.225 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -4.581 -5.332 -7.977 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -7.999 -4.018 -10.155 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -3.374 -5.781 -10.156 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -6.780 -4.471 -12.327 1.00 0.00 H new ATOM 0 HH TYR A 89 -4.963 -5.159 -13.247 1.00 0.00 H new ATOM 1392 N ASN A 90 -5.919 -4.167 -4.762 1.00 0.00 N ATOM 1393 CA ASN A 90 -5.885 -3.510 -3.466 1.00 0.00 C ATOM 1394 C ASN A 90 -5.746 -2.000 -3.668 1.00 0.00 C ATOM 1395 O ASN A 90 -5.355 -1.547 -4.743 1.00 0.00 O ATOM 1396 CB ASN A 90 -4.692 -3.989 -2.637 1.00 0.00 C ATOM 1397 CG ASN A 90 -4.626 -5.517 -2.603 1.00 0.00 C ATOM 1398 OD1 ASN A 90 -4.658 -6.188 -3.622 1.00 0.00 O ATOM 1399 ND2 ASN A 90 -4.531 -6.028 -1.379 1.00 0.00 N ATOM 0 H ASN A 90 -5.060 -4.083 -5.305 1.00 0.00 H new ATOM 0 HA ASN A 90 -6.809 -3.752 -2.941 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -3.769 -3.591 -3.058 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -4.772 -3.602 -1.621 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -4.480 -7.039 -1.251 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -4.509 -5.409 -0.568 1.00 0.00 H new ATOM 1406 N THR A 91 -6.073 -1.262 -2.617 1.00 0.00 N ATOM 1407 CA THR A 91 -5.989 0.187 -2.665 1.00 0.00 C ATOM 1408 C THR A 91 -5.249 0.720 -1.436 1.00 0.00 C ATOM 1409 O THR A 91 -5.051 -0.007 -0.464 1.00 0.00 O ATOM 1410 CB THR A 91 -7.409 0.739 -2.805 1.00 0.00 C ATOM 1411 OG1 THR A 91 -8.202 -0.139 -2.012 1.00 0.00 O ATOM 1412 CG2 THR A 91 -7.966 0.568 -4.220 1.00 0.00 C ATOM 0 H THR A 91 -6.397 -1.641 -1.727 1.00 0.00 H new ATOM 0 HA THR A 91 -5.409 0.521 -3.525 1.00 0.00 H new ATOM 0 HB THR A 91 -7.416 1.795 -2.537 1.00 0.00 H new ATOM 0 HG1 THR A 91 -9.083 0.263 -1.860 1.00 0.00 H new ATOM 0 HG21 THR A 91 -8.976 0.976 -4.265 1.00 0.00 H new ATOM 0 HG22 THR A 91 -7.329 1.097 -4.928 1.00 0.00 H new ATOM 0 HG23 THR A 91 -7.991 -0.491 -4.476 1.00 0.00 H new ATOM 1420 N TYR A 92 -4.861 1.984 -1.521 1.00 0.00 N ATOM 1421 CA TYR A 92 -4.147 2.622 -0.428 1.00 0.00 C ATOM 1422 C TYR A 92 -4.479 4.114 -0.353 1.00 0.00 C ATOM 1423 O TYR A 92 -4.459 4.809 -1.367 1.00 0.00 O ATOM 1424 CB TYR A 92 -2.659 2.458 -0.743 1.00 0.00 C ATOM 1425 CG TYR A 92 -2.207 1.002 -0.871 1.00 0.00 C ATOM 1426 CD1 TYR A 92 -2.410 0.121 0.172 1.00 0.00 C ATOM 1427 CD2 TYR A 92 -1.595 0.569 -2.030 1.00 0.00 C ATOM 1428 CE1 TYR A 92 -1.985 -1.249 0.051 1.00 0.00 C ATOM 1429 CE2 TYR A 92 -1.170 -0.802 -2.151 1.00 0.00 C ATOM 1430 CZ TYR A 92 -1.386 -1.643 -1.104 1.00 0.00 C ATOM 1431 OH TYR A 92 -0.984 -2.937 -1.219 1.00 0.00 O ATOM 0 H TYR A 92 -5.027 2.583 -2.329 1.00 0.00 H new ATOM 0 HA TYR A 92 -4.424 2.172 0.525 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -2.435 2.980 -1.673 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -2.077 2.941 0.042 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -2.888 0.460 1.079 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -1.435 1.258 -2.846 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -2.139 -1.948 0.860 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -0.691 -1.154 -3.053 1.00 0.00 H new ATOM 0 HH TYR A 92 -0.574 -3.075 -2.098 1.00 0.00 H new ATOM 1441 N ILE A 93 -4.776 4.561 0.858 1.00 0.00 N ATOM 1442 CA ILE A 93 -5.112 5.957 1.079 1.00 0.00 C ATOM 1443 C ILE A 93 -4.366 6.468 2.314 1.00 0.00 C ATOM 1444 O ILE A 93 -4.136 5.716 3.259 1.00 0.00 O ATOM 1445 CB ILE A 93 -6.629 6.138 1.158 1.00 0.00 C ATOM 1446 CG1 ILE A 93 -7.287 5.846 -0.192 1.00 0.00 C ATOM 1447 CG2 ILE A 93 -6.989 7.529 1.682 1.00 0.00 C ATOM 1448 CD1 ILE A 93 -8.728 5.366 -0.008 1.00 0.00 C ATOM 0 H ILE A 93 -4.791 3.981 1.697 1.00 0.00 H new ATOM 0 HA ILE A 93 -4.786 6.565 0.235 1.00 0.00 H new ATOM 0 HB ILE A 93 -7.022 5.414 1.871 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -7.275 6.745 -0.808 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -6.713 5.088 -0.724 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -8.073 7.631 1.728 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -6.569 7.662 2.679 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -6.581 8.287 1.013 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -9.172 5.166 -0.983 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -8.734 4.453 0.588 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -9.306 6.137 0.502 1.00 0.00 H new ATOM 1460 N SER A 94 -4.010 7.743 2.265 1.00 0.00 N ATOM 1461 CA SER A 94 -3.296 8.363 3.368 1.00 0.00 C ATOM 1462 C SER A 94 -4.246 8.591 4.545 1.00 0.00 C ATOM 1463 O SER A 94 -5.389 9.003 4.353 1.00 0.00 O ATOM 1464 CB SER A 94 -2.657 9.685 2.937 1.00 0.00 C ATOM 1465 OG SER A 94 -1.321 9.814 3.416 1.00 0.00 O ATOM 0 H SER A 94 -4.203 8.364 1.479 1.00 0.00 H new ATOM 0 HA SER A 94 -2.498 7.690 3.680 1.00 0.00 H new ATOM 0 HB2 SER A 94 -2.660 9.751 1.849 1.00 0.00 H new ATOM 0 HB3 SER A 94 -3.257 10.516 3.309 1.00 0.00 H new ATOM 0 HG SER A 94 -0.749 9.153 2.973 1.00 0.00 H new ATOM 1471 N LYS A 95 -3.739 8.313 5.737 1.00 0.00 N ATOM 1472 CA LYS A 95 -4.528 8.483 6.945 1.00 0.00 C ATOM 1473 C LYS A 95 -4.892 9.960 7.108 1.00 0.00 C ATOM 1474 O LYS A 95 -6.046 10.343 6.927 1.00 0.00 O ATOM 1475 CB LYS A 95 -3.796 7.893 8.151 1.00 0.00 C ATOM 1476 CG LYS A 95 -4.692 7.894 9.391 1.00 0.00 C ATOM 1477 CD LYS A 95 -4.348 6.725 10.317 1.00 0.00 C ATOM 1478 CE LYS A 95 -5.575 6.279 11.115 1.00 0.00 C ATOM 1479 NZ LYS A 95 -6.520 5.543 10.246 1.00 0.00 N ATOM 0 H LYS A 95 -2.791 7.971 5.892 1.00 0.00 H new ATOM 0 HA LYS A 95 -5.464 7.930 6.869 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -3.481 6.874 7.927 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -2.893 8.470 8.350 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -4.574 8.835 9.928 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -5.737 7.828 9.089 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -3.969 5.889 9.729 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -3.552 7.020 11.001 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -5.265 5.644 11.945 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -6.071 7.148 11.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -7.391 5.337 10.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -6.751 6.123 9.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -6.084 4.651 9.936 1.00 0.00 H new ATOM 1493 N LYS A 96 -3.884 10.750 7.448 1.00 0.00 N ATOM 1494 CA LYS A 96 -4.083 12.177 7.638 1.00 0.00 C ATOM 1495 C LYS A 96 -4.873 12.739 6.455 1.00 0.00 C ATOM 1496 O LYS A 96 -5.616 13.708 6.604 1.00 0.00 O ATOM 1497 CB LYS A 96 -2.743 12.878 7.872 1.00 0.00 C ATOM 1498 CG LYS A 96 -2.756 13.661 9.186 1.00 0.00 C ATOM 1499 CD LYS A 96 -1.346 14.116 9.567 1.00 0.00 C ATOM 1500 CE LYS A 96 -1.183 14.182 11.087 1.00 0.00 C ATOM 1501 NZ LYS A 96 0.224 14.471 11.445 1.00 0.00 N ATOM 0 H LYS A 96 -2.927 10.429 7.597 1.00 0.00 H new ATOM 0 HA LYS A 96 -4.675 12.364 8.534 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -1.941 12.140 7.892 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -2.533 13.554 7.044 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -3.408 14.529 9.090 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -3.168 13.039 9.980 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -0.612 13.427 9.149 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -1.147 15.096 9.133 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -1.834 14.955 11.495 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -1.491 13.236 11.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 0.317 14.512 12.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 0.839 13.720 11.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 0.506 15.384 11.035 1.00 0.00 H new ATOM 1515 N HIS A 97 -4.686 12.107 5.305 1.00 0.00 N ATOM 1516 CA HIS A 97 -5.372 12.532 4.097 1.00 0.00 C ATOM 1517 C HIS A 97 -6.259 11.396 3.584 1.00 0.00 C ATOM 1518 O HIS A 97 -6.100 10.942 2.452 1.00 0.00 O ATOM 1519 CB HIS A 97 -4.372 13.023 3.048 1.00 0.00 C ATOM 1520 CG HIS A 97 -3.187 13.760 3.627 1.00 0.00 C ATOM 1521 ND1 HIS A 97 -2.734 14.966 3.121 1.00 0.00 N ATOM 1522 CD2 HIS A 97 -2.368 13.449 4.673 1.00 0.00 C ATOM 1523 CE1 HIS A 97 -1.689 15.354 3.838 1.00 0.00 C ATOM 1524 NE2 HIS A 97 -1.464 14.412 4.798 1.00 0.00 N ATOM 0 H HIS A 97 -4.069 11.304 5.185 1.00 0.00 H new ATOM 0 HA HIS A 97 -6.020 13.379 4.322 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -4.011 12.168 2.476 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -4.888 13.679 2.348 1.00 0.00 H new ATOM 0 HD1 HIS A 97 -3.136 15.470 2.331 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -2.443 12.568 5.294 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -1.116 16.257 3.688 1.00 0.00 H new ATOM 1532 N ALA A 98 -7.174 10.969 4.442 1.00 0.00 N ATOM 1533 CA ALA A 98 -8.087 9.895 4.090 1.00 0.00 C ATOM 1534 C ALA A 98 -9.424 10.492 3.648 1.00 0.00 C ATOM 1535 O ALA A 98 -9.916 10.186 2.563 1.00 0.00 O ATOM 1536 CB ALA A 98 -8.237 8.943 5.278 1.00 0.00 C ATOM 0 H ALA A 98 -7.303 11.348 5.380 1.00 0.00 H new ATOM 0 HA ALA A 98 -7.694 9.315 3.255 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -8.922 8.137 5.014 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -7.264 8.523 5.533 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -8.632 9.489 6.134 1.00 0.00 H new ATOM 1542 N GLU A 99 -9.974 11.334 4.511 1.00 0.00 N ATOM 1543 CA GLU A 99 -11.245 11.976 4.223 1.00 0.00 C ATOM 1544 C GLU A 99 -11.176 12.713 2.884 1.00 0.00 C ATOM 1545 O GLU A 99 -12.202 12.950 2.248 1.00 0.00 O ATOM 1546 CB GLU A 99 -11.647 12.928 5.352 1.00 0.00 C ATOM 1547 CG GLU A 99 -12.171 12.152 6.562 1.00 0.00 C ATOM 1548 CD GLU A 99 -11.406 12.534 7.831 1.00 0.00 C ATOM 1549 OE1 GLU A 99 -10.320 11.950 8.037 1.00 0.00 O ATOM 1550 OE2 GLU A 99 -11.925 13.401 8.567 1.00 0.00 O ATOM 0 H GLU A 99 -9.563 11.586 5.410 1.00 0.00 H new ATOM 0 HA GLU A 99 -12.012 11.204 4.152 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -10.789 13.532 5.646 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -12.414 13.616 4.997 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -13.233 12.357 6.698 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -12.073 11.081 6.382 1.00 0.00 H new ATOM 1557 N LYS A 100 -9.956 13.055 2.495 1.00 0.00 N ATOM 1558 CA LYS A 100 -9.740 13.760 1.243 1.00 0.00 C ATOM 1559 C LYS A 100 -9.876 12.777 0.079 1.00 0.00 C ATOM 1560 O LYS A 100 -9.839 13.177 -1.084 1.00 0.00 O ATOM 1561 CB LYS A 100 -8.401 14.501 1.270 1.00 0.00 C ATOM 1562 CG LYS A 100 -8.367 15.531 2.400 1.00 0.00 C ATOM 1563 CD LYS A 100 -7.747 16.846 1.924 1.00 0.00 C ATOM 1564 CE LYS A 100 -8.827 17.827 1.464 1.00 0.00 C ATOM 1565 NZ LYS A 100 -8.222 18.949 0.711 1.00 0.00 N ATOM 0 H LYS A 100 -9.107 12.857 3.025 1.00 0.00 H new ATOM 0 HA LYS A 100 -10.500 14.528 1.102 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -7.588 13.786 1.400 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -8.238 14.999 0.314 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -9.379 15.712 2.763 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -7.794 15.137 3.239 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -7.166 17.292 2.732 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -7.056 16.650 1.104 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -9.553 17.310 0.837 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -9.369 18.212 2.328 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -8.957 19.648 0.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -7.486 19.400 1.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -7.798 18.589 -0.168 1.00 0.00 H new ATOM 1579 N ASN A 101 -10.029 11.509 0.432 1.00 0.00 N ATOM 1580 CA ASN A 101 -10.171 10.465 -0.569 1.00 0.00 C ATOM 1581 C ASN A 101 -9.041 10.591 -1.593 1.00 0.00 C ATOM 1582 O ASN A 101 -9.290 10.859 -2.768 1.00 0.00 O ATOM 1583 CB ASN A 101 -11.501 10.593 -1.314 1.00 0.00 C ATOM 1584 CG ASN A 101 -12.576 11.205 -0.414 1.00 0.00 C ATOM 1585 OD1 ASN A 101 -12.570 12.386 -0.110 1.00 0.00 O ATOM 1586 ND2 ASN A 101 -13.498 10.337 -0.007 1.00 0.00 N ATOM 0 H ASN A 101 -10.058 11.181 1.397 1.00 0.00 H new ATOM 0 HA ASN A 101 -10.135 9.502 -0.060 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -11.367 11.213 -2.200 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -11.825 9.611 -1.658 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -14.259 10.647 0.597 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -13.444 9.361 -0.299 1.00 0.00 H new ATOM 1593 N TRP A 102 -7.823 10.390 -1.112 1.00 0.00 N ATOM 1594 CA TRP A 102 -6.655 10.478 -1.971 1.00 0.00 C ATOM 1595 C TRP A 102 -6.053 9.076 -2.094 1.00 0.00 C ATOM 1596 O TRP A 102 -5.856 8.391 -1.092 1.00 0.00 O ATOM 1597 CB TRP A 102 -5.660 11.511 -1.439 1.00 0.00 C ATOM 1598 CG TRP A 102 -6.169 12.953 -1.496 1.00 0.00 C ATOM 1599 CD1 TRP A 102 -7.344 13.394 -1.966 1.00 0.00 C ATOM 1600 CD2 TRP A 102 -5.467 14.131 -1.047 1.00 0.00 C ATOM 1601 NE1 TRP A 102 -7.450 14.766 -1.852 1.00 0.00 N ATOM 1602 CE2 TRP A 102 -6.273 15.228 -1.275 1.00 0.00 C ATOM 1603 CE3 TRP A 102 -4.194 14.265 -0.466 1.00 0.00 C ATOM 1604 CZ2 TRP A 102 -5.895 16.537 -0.954 1.00 0.00 C ATOM 1605 CZ3 TRP A 102 -3.831 15.580 -0.151 1.00 0.00 C ATOM 1606 CH2 TRP A 102 -4.631 16.695 -0.374 1.00 0.00 C ATOM 0 H TRP A 102 -7.620 10.166 -0.138 1.00 0.00 H new ATOM 0 HA TRP A 102 -6.933 10.827 -2.966 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -5.413 11.264 -0.406 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -4.736 11.440 -2.013 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -8.111 12.757 -2.381 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -8.246 15.336 -2.139 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -3.547 13.421 -0.278 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -6.544 17.379 -1.144 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -2.861 15.739 0.297 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -4.279 17.679 -0.101 1.00 0.00 H new ATOM 1617 N PHE A 103 -5.778 8.692 -3.332 1.00 0.00 N ATOM 1618 CA PHE A 103 -5.202 7.385 -3.600 1.00 0.00 C ATOM 1619 C PHE A 103 -3.789 7.515 -4.171 1.00 0.00 C ATOM 1620 O PHE A 103 -3.492 8.465 -4.893 1.00 0.00 O ATOM 1621 CB PHE A 103 -6.099 6.706 -4.637 1.00 0.00 C ATOM 1622 CG PHE A 103 -7.548 6.524 -4.183 1.00 0.00 C ATOM 1623 CD1 PHE A 103 -8.440 7.541 -4.332 1.00 0.00 C ATOM 1624 CD2 PHE A 103 -7.946 5.347 -3.630 1.00 0.00 C ATOM 1625 CE1 PHE A 103 -9.785 7.372 -3.910 1.00 0.00 C ATOM 1626 CE2 PHE A 103 -9.291 5.178 -3.209 1.00 0.00 C ATOM 1627 CZ PHE A 103 -10.183 6.195 -3.358 1.00 0.00 C ATOM 0 H PHE A 103 -5.943 9.263 -4.161 1.00 0.00 H new ATOM 0 HA PHE A 103 -5.139 6.809 -2.677 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -6.088 7.296 -5.554 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -5.680 5.730 -4.881 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -8.125 8.476 -4.771 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -7.238 4.540 -3.511 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -10.493 8.179 -4.028 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -9.606 4.243 -2.771 1.00 0.00 H new ATOM 0 HZ PHE A 103 -11.207 6.067 -3.038 1.00 0.00 H new ATOM 1637 N VAL A 104 -2.955 6.545 -3.826 1.00 0.00 N ATOM 1638 CA VAL A 104 -1.580 6.539 -4.296 1.00 0.00 C ATOM 1639 C VAL A 104 -1.568 6.476 -5.825 1.00 0.00 C ATOM 1640 O VAL A 104 -1.649 7.506 -6.493 1.00 0.00 O ATOM 1641 CB VAL A 104 -0.809 5.389 -3.644 1.00 0.00 C ATOM 1642 CG1 VAL A 104 0.595 5.263 -4.239 1.00 0.00 C ATOM 1643 CG2 VAL A 104 -0.748 5.561 -2.125 1.00 0.00 C ATOM 0 H VAL A 104 -3.205 5.758 -3.227 1.00 0.00 H new ATOM 0 HA VAL A 104 -1.073 7.459 -4.005 1.00 0.00 H new ATOM 0 HB VAL A 104 -1.346 4.464 -3.855 1.00 0.00 H new ATOM 0 HG11 VAL A 104 1.121 4.438 -3.758 1.00 0.00 H new ATOM 0 HG12 VAL A 104 0.521 5.071 -5.309 1.00 0.00 H new ATOM 0 HG13 VAL A 104 1.145 6.190 -4.074 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -0.195 4.730 -1.687 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -0.246 6.498 -1.885 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -1.760 5.577 -1.720 1.00 0.00 H new ATOM 1653 N GLY A 105 -1.465 5.257 -6.334 1.00 0.00 N ATOM 1654 CA GLY A 105 -1.442 5.046 -7.772 1.00 0.00 C ATOM 1655 C GLY A 105 -0.340 5.880 -8.430 1.00 0.00 C ATOM 1656 O GLY A 105 0.226 6.774 -7.802 1.00 0.00 O ATOM 0 H GLY A 105 -1.397 4.405 -5.777 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -1.280 3.989 -7.986 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -2.409 5.313 -8.198 1.00 0.00 H new ATOM 1660 N LEU A 106 -0.069 5.558 -9.686 1.00 0.00 N ATOM 1661 CA LEU A 106 0.954 6.265 -10.437 1.00 0.00 C ATOM 1662 C LEU A 106 0.444 6.540 -11.853 1.00 0.00 C ATOM 1663 O LEU A 106 -0.106 5.651 -12.501 1.00 0.00 O ATOM 1664 CB LEU A 106 2.276 5.496 -10.398 1.00 0.00 C ATOM 1665 CG LEU A 106 2.843 5.207 -9.006 1.00 0.00 C ATOM 1666 CD1 LEU A 106 3.472 3.813 -8.949 1.00 0.00 C ATOM 1667 CD2 LEU A 106 3.826 6.297 -8.577 1.00 0.00 C ATOM 0 H LEU A 106 -0.541 4.816 -10.203 1.00 0.00 H new ATOM 0 HA LEU A 106 1.161 7.232 -9.979 1.00 0.00 H new ATOM 0 HB2 LEU A 106 2.137 4.547 -10.916 1.00 0.00 H new ATOM 0 HB3 LEU A 106 3.019 6.061 -10.961 1.00 0.00 H new ATOM 0 HG LEU A 106 2.019 5.218 -8.293 1.00 0.00 H new ATOM 0 HD11 LEU A 106 3.867 3.633 -7.949 1.00 0.00 H new ATOM 0 HD12 LEU A 106 2.716 3.063 -9.181 1.00 0.00 H new ATOM 0 HD13 LEU A 106 4.281 3.749 -9.676 1.00 0.00 H new ATOM 0 HD21 LEU A 106 4.214 6.067 -7.585 1.00 0.00 H new ATOM 0 HD22 LEU A 106 4.651 6.343 -9.288 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.314 7.259 -8.553 1.00 0.00 H new ATOM 1679 N LYS A 107 0.644 7.774 -12.290 1.00 0.00 N ATOM 1680 CA LYS A 107 0.212 8.177 -13.618 1.00 0.00 C ATOM 1681 C LYS A 107 0.744 7.179 -14.648 1.00 0.00 C ATOM 1682 O LYS A 107 1.387 6.194 -14.288 1.00 0.00 O ATOM 1683 CB LYS A 107 0.619 9.625 -13.897 1.00 0.00 C ATOM 1684 CG LYS A 107 -0.042 10.582 -12.903 1.00 0.00 C ATOM 1685 CD LYS A 107 -0.077 12.009 -13.455 1.00 0.00 C ATOM 1686 CE LYS A 107 1.147 12.805 -12.998 1.00 0.00 C ATOM 1687 NZ LYS A 107 1.662 13.642 -14.104 1.00 0.00 N ATOM 0 H LYS A 107 1.099 8.509 -11.748 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.876 8.157 -13.687 1.00 0.00 H new ATOM 0 HB2 LYS A 107 1.703 9.720 -13.833 1.00 0.00 H new ATOM 0 HB3 LYS A 107 0.334 9.897 -14.913 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -1.057 10.246 -12.689 1.00 0.00 H new ATOM 0 HG3 LYS A 107 0.504 10.567 -11.960 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -0.111 11.980 -14.544 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -0.986 12.509 -13.121 1.00 0.00 H new ATOM 0 HE2 LYS A 107 0.882 13.436 -12.149 1.00 0.00 H new ATOM 0 HE3 LYS A 107 1.926 12.123 -12.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 2.493 14.176 -13.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 1.933 13.033 -14.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 0.922 14.306 -14.410 1.00 0.00 H new ATOM 1701 N LYS A 108 0.456 7.468 -15.908 1.00 0.00 N ATOM 1702 CA LYS A 108 0.898 6.608 -16.993 1.00 0.00 C ATOM 1703 C LYS A 108 2.312 7.012 -17.415 1.00 0.00 C ATOM 1704 O LYS A 108 2.932 6.343 -18.240 1.00 0.00 O ATOM 1705 CB LYS A 108 -0.115 6.628 -18.139 1.00 0.00 C ATOM 1706 CG LYS A 108 -0.558 5.210 -18.506 1.00 0.00 C ATOM 1707 CD LYS A 108 0.318 4.633 -19.619 1.00 0.00 C ATOM 1708 CE LYS A 108 -0.037 5.251 -20.973 1.00 0.00 C ATOM 1709 NZ LYS A 108 -0.123 4.204 -22.015 1.00 0.00 N ATOM 0 H LYS A 108 -0.078 8.286 -16.202 1.00 0.00 H new ATOM 0 HA LYS A 108 0.948 5.571 -16.661 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -0.983 7.221 -17.851 1.00 0.00 H new ATOM 0 HB3 LYS A 108 0.326 7.112 -19.010 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -0.503 4.569 -17.626 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -1.599 5.222 -18.827 1.00 0.00 H new ATOM 0 HD2 LYS A 108 1.368 4.820 -19.394 1.00 0.00 H new ATOM 0 HD3 LYS A 108 0.189 3.552 -19.664 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -0.988 5.779 -20.900 1.00 0.00 H new ATOM 0 HE3 LYS A 108 0.716 5.988 -21.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -0.365 4.641 -22.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 0.793 3.718 -22.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -0.858 3.516 -21.755 1.00 0.00 H new ATOM 1723 N ASN A 109 2.780 8.104 -16.829 1.00 0.00 N ATOM 1724 CA ASN A 109 4.110 8.605 -17.134 1.00 0.00 C ATOM 1725 C ASN A 109 5.114 8.007 -16.147 1.00 0.00 C ATOM 1726 O ASN A 109 6.234 8.500 -16.020 1.00 0.00 O ATOM 1727 CB ASN A 109 4.168 10.128 -17.003 1.00 0.00 C ATOM 1728 CG ASN A 109 4.186 10.797 -18.379 1.00 0.00 C ATOM 1729 OD1 ASN A 109 3.175 11.249 -18.892 1.00 0.00 O ATOM 1730 ND2 ASN A 109 5.388 10.833 -18.947 1.00 0.00 N ATOM 0 H ASN A 109 2.263 8.656 -16.145 1.00 0.00 H new ATOM 0 HA ASN A 109 4.350 8.322 -18.159 1.00 0.00 H new ATOM 0 HB2 ASN A 109 3.307 10.481 -16.435 1.00 0.00 H new ATOM 0 HB3 ASN A 109 5.059 10.415 -16.444 1.00 0.00 H new ATOM 0 HD21 ASN A 109 5.505 11.258 -19.867 1.00 0.00 H new ATOM 0 HD22 ASN A 109 6.193 10.436 -18.463 1.00 0.00 H new ATOM 1737 N GLY A 110 4.678 6.952 -15.474 1.00 0.00 N ATOM 1738 CA GLY A 110 5.524 6.281 -14.502 1.00 0.00 C ATOM 1739 C GLY A 110 5.829 7.198 -13.315 1.00 0.00 C ATOM 1740 O GLY A 110 6.891 7.096 -12.704 1.00 0.00 O ATOM 0 H GLY A 110 3.749 6.545 -15.583 1.00 0.00 H new ATOM 0 HA2 GLY A 110 5.031 5.375 -14.149 1.00 0.00 H new ATOM 0 HA3 GLY A 110 6.455 5.973 -14.977 1.00 0.00 H new ATOM 1744 N SER A 111 4.877 8.072 -13.025 1.00 0.00 N ATOM 1745 CA SER A 111 5.029 9.005 -11.922 1.00 0.00 C ATOM 1746 C SER A 111 3.855 8.865 -10.951 1.00 0.00 C ATOM 1747 O SER A 111 2.853 8.228 -11.271 1.00 0.00 O ATOM 1748 CB SER A 111 5.129 10.445 -12.429 1.00 0.00 C ATOM 1749 OG SER A 111 6.110 10.584 -13.453 1.00 0.00 O ATOM 0 H SER A 111 3.997 8.154 -13.535 1.00 0.00 H new ATOM 0 HA SER A 111 5.955 8.767 -11.399 1.00 0.00 H new ATOM 0 HB2 SER A 111 4.159 10.763 -12.811 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.376 11.105 -11.598 1.00 0.00 H new ATOM 0 HG SER A 111 6.142 11.517 -13.751 1.00 0.00 H new ATOM 1755 N CYS A 112 4.018 9.470 -9.784 1.00 0.00 N ATOM 1756 CA CYS A 112 2.984 9.421 -8.764 1.00 0.00 C ATOM 1757 C CYS A 112 1.829 10.322 -9.207 1.00 0.00 C ATOM 1758 O CYS A 112 2.052 11.442 -9.665 1.00 0.00 O ATOM 1759 CB CYS A 112 3.525 9.820 -7.390 1.00 0.00 C ATOM 1760 SG CYS A 112 4.311 11.470 -7.482 1.00 0.00 S ATOM 0 H CYS A 112 4.851 9.997 -9.522 1.00 0.00 H new ATOM 0 HA CYS A 112 2.624 8.398 -8.656 1.00 0.00 H new ATOM 0 HB2 CYS A 112 2.715 9.834 -6.661 1.00 0.00 H new ATOM 0 HB3 CYS A 112 4.250 9.082 -7.047 1.00 0.00 H new ATOM 0 HG CYS A 112 3.735 12.174 -8.411 1.00 0.00 H new ATOM 1766 N LYS A 113 0.621 9.800 -9.053 1.00 0.00 N ATOM 1767 CA LYS A 113 -0.569 10.543 -9.431 1.00 0.00 C ATOM 1768 C LYS A 113 -1.061 11.355 -8.231 1.00 0.00 C ATOM 1769 O LYS A 113 -1.266 10.807 -7.149 1.00 0.00 O ATOM 1770 CB LYS A 113 -1.626 9.603 -10.013 1.00 0.00 C ATOM 1771 CG LYS A 113 -2.970 10.317 -10.167 1.00 0.00 C ATOM 1772 CD LYS A 113 -4.090 9.319 -10.466 1.00 0.00 C ATOM 1773 CE LYS A 113 -4.467 9.345 -11.949 1.00 0.00 C ATOM 1774 NZ LYS A 113 -3.604 8.422 -12.719 1.00 0.00 N ATOM 0 H LYS A 113 0.441 8.871 -8.672 1.00 0.00 H new ATOM 0 HA LYS A 113 -0.338 11.254 -10.224 1.00 0.00 H new ATOM 0 HB2 LYS A 113 -1.294 9.233 -10.983 1.00 0.00 H new ATOM 0 HB3 LYS A 113 -1.743 8.735 -9.364 1.00 0.00 H new ATOM 0 HG2 LYS A 113 -3.201 10.866 -9.254 1.00 0.00 H new ATOM 0 HG3 LYS A 113 -2.907 11.050 -10.972 1.00 0.00 H new ATOM 0 HD2 LYS A 113 -3.772 8.315 -10.186 1.00 0.00 H new ATOM 0 HD3 LYS A 113 -4.965 9.557 -9.861 1.00 0.00 H new ATOM 0 HE2 LYS A 113 -5.512 9.061 -12.070 1.00 0.00 H new ATOM 0 HE3 LYS A 113 -4.365 10.358 -12.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 -3.281 8.893 -13.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 -2.780 8.155 -12.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 -4.144 7.568 -12.968 1.00 0.00 H new ATOM 1788 N ARG A 114 -1.235 12.648 -8.463 1.00 0.00 N ATOM 1789 CA ARG A 114 -1.699 13.540 -7.415 1.00 0.00 C ATOM 1790 C ARG A 114 -2.755 12.844 -6.554 1.00 0.00 C ATOM 1791 O ARG A 114 -3.555 12.059 -7.061 1.00 0.00 O ATOM 1792 CB ARG A 114 -2.295 14.820 -8.004 1.00 0.00 C ATOM 1793 CG ARG A 114 -1.231 15.912 -8.131 1.00 0.00 C ATOM 1794 CD ARG A 114 -0.558 15.865 -9.504 1.00 0.00 C ATOM 1795 NE ARG A 114 -0.756 17.152 -10.209 1.00 0.00 N ATOM 1796 CZ ARG A 114 -0.318 17.403 -11.450 1.00 0.00 C ATOM 1797 NH1 ARG A 114 0.345 16.459 -12.131 1.00 0.00 N ATOM 1798 NH2 ARG A 114 -0.543 18.600 -12.010 1.00 0.00 N ATOM 0 H ARG A 114 -1.063 13.099 -9.362 1.00 0.00 H new ATOM 0 HA ARG A 114 -0.839 13.803 -6.800 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -2.723 14.609 -8.984 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -3.109 15.172 -7.370 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -1.688 16.890 -7.980 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -0.481 15.787 -7.350 1.00 0.00 H new ATOM 0 HD2 ARG A 114 0.507 15.664 -9.389 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -0.975 15.049 -10.095 1.00 0.00 H new ATOM 0 HE ARG A 114 -1.257 17.893 -9.719 1.00 0.00 H new ATOM 0 HH11 ARG A 114 0.517 15.548 -11.705 1.00 0.00 H new ATOM 0 HH12 ARG A 114 0.678 16.651 -13.076 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -1.047 19.319 -11.491 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -0.210 18.792 -12.955 1.00 0.00 H new ATOM 1812 N GLY A 115 -2.724 13.156 -5.267 1.00 0.00 N ATOM 1813 CA GLY A 115 -3.668 12.570 -4.331 1.00 0.00 C ATOM 1814 C GLY A 115 -5.099 13.011 -4.647 1.00 0.00 C ATOM 1815 O GLY A 115 -5.968 12.178 -4.897 1.00 0.00 O ATOM 0 H GLY A 115 -2.059 13.808 -4.850 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -3.601 11.483 -4.374 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -3.409 12.866 -3.314 1.00 0.00 H new ATOM 1819 N PRO A 116 -5.304 14.355 -4.625 1.00 0.00 N ATOM 1820 CA PRO A 116 -6.614 14.917 -4.906 1.00 0.00 C ATOM 1821 C PRO A 116 -6.925 14.859 -6.403 1.00 0.00 C ATOM 1822 O PRO A 116 -7.479 15.804 -6.963 1.00 0.00 O ATOM 1823 CB PRO A 116 -6.558 16.337 -4.366 1.00 0.00 C ATOM 1824 CG PRO A 116 -5.082 16.670 -4.223 1.00 0.00 C ATOM 1825 CD PRO A 116 -4.298 15.372 -4.333 1.00 0.00 C ATOM 0 HA PRO A 116 -7.422 14.358 -4.434 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -7.051 17.033 -5.045 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -7.070 16.411 -3.406 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -4.772 17.370 -4.999 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -4.891 17.151 -3.264 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -3.550 15.427 -5.124 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -3.768 15.150 -3.407 1.00 0.00 H new ATOM 1833 N ARG A 117 -6.556 13.740 -7.009 1.00 0.00 N ATOM 1834 CA ARG A 117 -6.790 13.546 -8.430 1.00 0.00 C ATOM 1835 C ARG A 117 -7.148 12.086 -8.715 1.00 0.00 C ATOM 1836 O ARG A 117 -7.044 11.628 -9.852 1.00 0.00 O ATOM 1837 CB ARG A 117 -5.555 13.930 -9.248 1.00 0.00 C ATOM 1838 CG ARG A 117 -5.352 15.447 -9.256 1.00 0.00 C ATOM 1839 CD ARG A 117 -5.417 16.001 -10.681 1.00 0.00 C ATOM 1840 NE ARG A 117 -5.109 17.448 -10.675 1.00 0.00 N ATOM 1841 CZ ARG A 117 -5.148 18.229 -11.764 1.00 0.00 C ATOM 1842 NH1 ARG A 117 -5.483 17.706 -12.951 1.00 0.00 N ATOM 1843 NH2 ARG A 117 -4.854 19.532 -11.664 1.00 0.00 N ATOM 0 H ARG A 117 -6.097 12.958 -6.542 1.00 0.00 H new ATOM 0 HA ARG A 117 -7.620 14.190 -8.721 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -4.673 13.444 -8.831 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -5.665 13.569 -10.271 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -6.116 15.923 -8.642 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -4.387 15.691 -8.811 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -4.708 15.472 -11.318 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -6.409 15.834 -11.100 1.00 0.00 H new ATOM 0 HE ARG A 117 -4.851 17.878 -9.787 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -5.708 16.714 -13.026 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -5.513 18.300 -13.780 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -4.601 19.930 -10.760 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -4.884 20.127 -12.492 1.00 0.00 H new ATOM 1857 N THR A 118 -7.563 11.396 -7.663 1.00 0.00 N ATOM 1858 CA THR A 118 -7.937 9.997 -7.786 1.00 0.00 C ATOM 1859 C THR A 118 -9.429 9.817 -7.495 1.00 0.00 C ATOM 1860 O THR A 118 -10.062 10.697 -6.914 1.00 0.00 O ATOM 1861 CB THR A 118 -7.034 9.183 -6.858 1.00 0.00 C ATOM 1862 OG1 THR A 118 -6.873 10.015 -5.712 1.00 0.00 O ATOM 1863 CG2 THR A 118 -5.615 9.028 -7.408 1.00 0.00 C ATOM 0 H THR A 118 -7.649 11.779 -6.722 1.00 0.00 H new ATOM 0 HA THR A 118 -7.790 9.636 -8.804 1.00 0.00 H new ATOM 0 HB THR A 118 -7.471 8.197 -6.700 1.00 0.00 H new ATOM 0 HG1 THR A 118 -6.173 10.679 -5.885 1.00 0.00 H new ATOM 0 HG21 THR A 118 -5.016 8.442 -6.710 1.00 0.00 H new ATOM 0 HG22 THR A 118 -5.652 8.519 -8.371 1.00 0.00 H new ATOM 0 HG23 THR A 118 -5.164 10.012 -7.535 1.00 0.00 H new ATOM 1871 N HIS A 119 -9.946 8.671 -7.912 1.00 0.00 N ATOM 1872 CA HIS A 119 -11.350 8.363 -7.703 1.00 0.00 C ATOM 1873 C HIS A 119 -11.601 6.882 -7.993 1.00 0.00 C ATOM 1874 O HIS A 119 -10.692 6.165 -8.409 1.00 0.00 O ATOM 1875 CB HIS A 119 -12.239 9.289 -8.537 1.00 0.00 C ATOM 1876 CG HIS A 119 -12.978 10.326 -7.725 1.00 0.00 C ATOM 1877 ND1 HIS A 119 -13.284 11.583 -8.216 1.00 0.00 N ATOM 1878 CD2 HIS A 119 -13.470 10.278 -6.454 1.00 0.00 C ATOM 1879 CE1 HIS A 119 -13.929 12.254 -7.273 1.00 0.00 C ATOM 1880 NE2 HIS A 119 -14.043 11.444 -6.182 1.00 0.00 N ATOM 0 H HIS A 119 -9.417 7.944 -8.394 1.00 0.00 H new ATOM 0 HA HIS A 119 -11.613 8.542 -6.661 1.00 0.00 H new ATOM 0 HB2 HIS A 119 -11.623 9.796 -9.280 1.00 0.00 H new ATOM 0 HB3 HIS A 119 -12.964 8.685 -9.083 1.00 0.00 H new ATOM 0 HD2 HIS A 119 -13.405 9.434 -5.783 1.00 0.00 H new ATOM 0 HE1 HIS A 119 -14.300 13.265 -7.354 1.00 0.00 H new ATOM 0 HE2 HIS A 119 -14.494 11.693 -5.302 1.00 0.00 H new ATOM 1888 N TYR A 120 -12.838 6.467 -7.762 1.00 0.00 N ATOM 1889 CA TYR A 120 -13.219 5.085 -7.994 1.00 0.00 C ATOM 1890 C TYR A 120 -13.533 4.842 -9.471 1.00 0.00 C ATOM 1891 O TYR A 120 -14.379 5.522 -10.049 1.00 0.00 O ATOM 1892 CB TYR A 120 -14.487 4.854 -7.170 1.00 0.00 C ATOM 1893 CG TYR A 120 -14.296 5.048 -5.665 1.00 0.00 C ATOM 1894 CD1 TYR A 120 -13.343 4.313 -4.990 1.00 0.00 C ATOM 1895 CD2 TYR A 120 -15.078 5.958 -4.982 1.00 0.00 C ATOM 1896 CE1 TYR A 120 -13.163 4.496 -3.573 1.00 0.00 C ATOM 1897 CE2 TYR A 120 -14.898 6.141 -3.565 1.00 0.00 C ATOM 1898 CZ TYR A 120 -13.950 5.401 -2.930 1.00 0.00 C ATOM 1899 OH TYR A 120 -13.780 5.574 -1.592 1.00 0.00 O ATOM 0 H TYR A 120 -13.589 7.064 -7.416 1.00 0.00 H new ATOM 0 HA TYR A 120 -12.409 4.412 -7.714 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -15.263 5.536 -7.518 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -14.847 3.841 -7.352 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -12.732 3.601 -5.524 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -15.825 6.532 -5.510 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -12.420 3.928 -3.033 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -15.502 6.850 -3.019 1.00 0.00 H new ATOM 0 HH TYR A 120 -14.409 6.252 -1.267 1.00 0.00 H new ATOM 1909 N GLY A 121 -12.834 3.871 -10.040 1.00 0.00 N ATOM 1910 CA GLY A 121 -13.027 3.531 -11.439 1.00 0.00 C ATOM 1911 C GLY A 121 -11.715 3.642 -12.218 1.00 0.00 C ATOM 1912 O GLY A 121 -11.648 3.267 -13.387 1.00 0.00 O ATOM 0 H GLY A 121 -12.133 3.309 -9.557 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -13.417 2.516 -11.520 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -13.772 4.194 -11.878 1.00 0.00 H new ATOM 1916 N GLN A 122 -10.703 4.160 -11.537 1.00 0.00 N ATOM 1917 CA GLN A 122 -9.396 4.326 -12.150 1.00 0.00 C ATOM 1918 C GLN A 122 -8.529 3.091 -11.895 1.00 0.00 C ATOM 1919 O GLN A 122 -8.674 2.427 -10.869 1.00 0.00 O ATOM 1920 CB GLN A 122 -8.708 5.593 -11.639 1.00 0.00 C ATOM 1921 CG GLN A 122 -9.570 6.829 -11.904 1.00 0.00 C ATOM 1922 CD GLN A 122 -8.743 8.111 -11.779 1.00 0.00 C ATOM 1923 OE1 GLN A 122 -9.079 8.873 -10.742 1.00 0.00 O flip ATOM 1924 NE2 GLN A 122 -7.859 8.390 -12.572 1.00 0.00 N flip ATOM 0 H GLN A 122 -10.762 4.470 -10.567 1.00 0.00 H new ATOM 0 HA GLN A 122 -9.532 4.434 -13.226 1.00 0.00 H new ATOM 0 HB2 GLN A 122 -8.516 5.501 -10.570 1.00 0.00 H new ATOM 0 HB3 GLN A 122 -7.740 5.708 -12.128 1.00 0.00 H new ATOM 0 HG2 GLN A 122 -10.003 6.767 -12.902 1.00 0.00 H new ATOM 0 HG3 GLN A 122 -10.400 6.857 -11.197 1.00 0.00 H new ATOM 0 HE21 GLN A 122 -7.652 7.760 -13.347 1.00 0.00 H new ATOM 0 HE22 GLN A 122 -7.327 9.253 -12.460 1.00 0.00 H new ATOM 1933 N LYS A 123 -7.647 2.820 -12.845 1.00 0.00 N ATOM 1934 CA LYS A 123 -6.757 1.676 -12.736 1.00 0.00 C ATOM 1935 C LYS A 123 -5.509 2.080 -11.949 1.00 0.00 C ATOM 1936 O LYS A 123 -4.538 1.328 -11.890 1.00 0.00 O ATOM 1937 CB LYS A 123 -6.451 1.101 -14.121 1.00 0.00 C ATOM 1938 CG LYS A 123 -5.832 -0.293 -14.011 1.00 0.00 C ATOM 1939 CD LYS A 123 -6.853 -1.308 -13.492 1.00 0.00 C ATOM 1940 CE LYS A 123 -7.235 -2.308 -14.585 1.00 0.00 C ATOM 1941 NZ LYS A 123 -8.621 -2.068 -15.046 1.00 0.00 N ATOM 0 H LYS A 123 -7.529 3.373 -13.694 1.00 0.00 H new ATOM 0 HA LYS A 123 -7.238 0.871 -12.181 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -7.368 1.050 -14.708 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -5.769 1.765 -14.652 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -5.464 -0.609 -14.987 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -4.973 -0.261 -13.341 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -6.439 -1.840 -12.636 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -7.744 -0.787 -13.143 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -6.546 -2.219 -15.425 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -7.143 -3.325 -14.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -8.864 -2.755 -15.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -9.277 -2.176 -14.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -8.698 -1.104 -15.429 1.00 0.00 H new ATOM 1955 N ALA A 124 -5.576 3.266 -11.363 1.00 0.00 N ATOM 1956 CA ALA A 124 -4.464 3.779 -10.581 1.00 0.00 C ATOM 1957 C ALA A 124 -4.636 3.359 -9.120 1.00 0.00 C ATOM 1958 O ALA A 124 -3.683 2.914 -8.482 1.00 0.00 O ATOM 1959 CB ALA A 124 -4.381 5.298 -10.745 1.00 0.00 C ATOM 0 H ALA A 124 -6.384 3.887 -11.414 1.00 0.00 H new ATOM 0 HA ALA A 124 -3.522 3.361 -10.935 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -3.547 5.682 -10.158 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -4.228 5.543 -11.796 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -5.309 5.753 -10.398 1.00 0.00 H new ATOM 1965 N ILE A 125 -5.858 3.515 -8.633 1.00 0.00 N ATOM 1966 CA ILE A 125 -6.167 3.157 -7.259 1.00 0.00 C ATOM 1967 C ILE A 125 -5.932 1.658 -7.062 1.00 0.00 C ATOM 1968 O ILE A 125 -5.487 1.231 -5.997 1.00 0.00 O ATOM 1969 CB ILE A 125 -7.582 3.611 -6.893 1.00 0.00 C ATOM 1970 CG1 ILE A 125 -8.615 2.550 -7.276 1.00 0.00 C ATOM 1971 CG2 ILE A 125 -7.899 4.972 -7.516 1.00 0.00 C ATOM 1972 CD1 ILE A 125 -10.038 3.073 -7.076 1.00 0.00 C ATOM 0 H ILE A 125 -6.646 3.884 -9.165 1.00 0.00 H new ATOM 0 HA ILE A 125 -5.501 3.678 -6.570 1.00 0.00 H new ATOM 0 HB ILE A 125 -7.633 3.733 -5.811 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -8.474 2.259 -8.317 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -8.464 1.656 -6.672 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -8.910 5.272 -7.241 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -7.189 5.714 -7.151 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -7.824 4.902 -8.601 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -10.753 2.299 -7.356 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -10.184 3.340 -6.029 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -10.193 3.953 -7.700 1.00 0.00 H new ATOM 1984 N LEU A 126 -6.241 0.901 -8.104 1.00 0.00 N ATOM 1985 CA LEU A 126 -6.069 -0.541 -8.058 1.00 0.00 C ATOM 1986 C LEU A 126 -4.575 -0.872 -8.042 1.00 0.00 C ATOM 1987 O LEU A 126 -3.875 -0.647 -9.028 1.00 0.00 O ATOM 1988 CB LEU A 126 -6.834 -1.209 -9.203 1.00 0.00 C ATOM 1989 CG LEU A 126 -8.312 -0.834 -9.330 1.00 0.00 C ATOM 1990 CD1 LEU A 126 -8.853 -1.201 -10.713 1.00 0.00 C ATOM 1991 CD2 LEU A 126 -9.136 -1.466 -8.206 1.00 0.00 C ATOM 0 H LEU A 126 -6.609 1.259 -8.985 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.496 -0.946 -7.141 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -6.335 -0.962 -10.140 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -6.763 -2.290 -9.079 1.00 0.00 H new ATOM 0 HG LEU A 126 -8.401 0.247 -9.226 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -9.905 -0.924 -10.777 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -8.290 -0.666 -11.478 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -8.750 -2.275 -10.871 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -10.183 -1.184 -8.319 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -9.045 -2.551 -8.254 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -8.768 -1.114 -7.243 1.00 0.00 H new ATOM 2003 N PHE A 127 -4.131 -1.400 -6.911 1.00 0.00 N ATOM 2004 CA PHE A 127 -2.733 -1.764 -6.753 1.00 0.00 C ATOM 2005 C PHE A 127 -2.591 -3.234 -6.353 1.00 0.00 C ATOM 2006 O PHE A 127 -3.419 -3.763 -5.614 1.00 0.00 O ATOM 2007 CB PHE A 127 -2.166 -0.887 -5.635 1.00 0.00 C ATOM 2008 CG PHE A 127 -1.242 0.229 -6.127 1.00 0.00 C ATOM 2009 CD1 PHE A 127 -1.401 0.742 -7.376 1.00 0.00 C ATOM 2010 CD2 PHE A 127 -0.261 0.707 -5.315 1.00 0.00 C ATOM 2011 CE1 PHE A 127 -0.543 1.777 -7.833 1.00 0.00 C ATOM 2012 CE2 PHE A 127 0.597 1.742 -5.772 1.00 0.00 C ATOM 2013 CZ PHE A 127 0.438 2.255 -7.021 1.00 0.00 C ATOM 0 H PHE A 127 -4.715 -1.585 -6.095 1.00 0.00 H new ATOM 0 HA PHE A 127 -2.202 -1.618 -7.694 1.00 0.00 H new ATOM 0 HB2 PHE A 127 -2.993 -0.442 -5.081 1.00 0.00 H new ATOM 0 HB3 PHE A 127 -1.617 -1.518 -4.936 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -2.180 0.362 -8.021 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -0.135 0.299 -4.323 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -0.669 2.185 -8.825 1.00 0.00 H new ATOM 0 HE2 PHE A 127 1.376 2.122 -5.127 1.00 0.00 H new ATOM 0 HZ PHE A 127 1.091 3.042 -7.368 1.00 0.00 H new ATOM 2023 N LEU A 128 -1.534 -3.852 -6.860 1.00 0.00 N ATOM 2024 CA LEU A 128 -1.273 -5.251 -6.566 1.00 0.00 C ATOM 2025 C LEU A 128 0.175 -5.407 -6.098 1.00 0.00 C ATOM 2026 O LEU A 128 1.108 -5.131 -6.852 1.00 0.00 O ATOM 2027 CB LEU A 128 -1.629 -6.127 -7.768 1.00 0.00 C ATOM 2028 CG LEU A 128 -2.184 -7.516 -7.445 1.00 0.00 C ATOM 2029 CD1 LEU A 128 -3.624 -7.427 -6.936 1.00 0.00 C ATOM 2030 CD2 LEU A 128 -2.059 -8.451 -8.651 1.00 0.00 C ATOM 0 H LEU A 128 -0.849 -3.410 -7.472 1.00 0.00 H new ATOM 0 HA LEU A 128 -1.911 -5.595 -5.752 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -2.363 -5.596 -8.374 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -0.736 -6.248 -8.381 1.00 0.00 H new ATOM 0 HG LEU A 128 -1.585 -7.944 -6.642 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -3.994 -8.428 -6.714 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -3.653 -6.820 -6.031 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -4.252 -6.969 -7.700 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -2.461 -9.431 -8.395 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -2.618 -8.038 -9.491 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -1.009 -8.550 -8.927 1.00 0.00 H new ATOM 2042 N PRO A 129 0.322 -5.861 -4.825 1.00 0.00 N ATOM 2043 CA PRO A 129 1.642 -6.057 -4.248 1.00 0.00 C ATOM 2044 C PRO A 129 2.304 -7.317 -4.810 1.00 0.00 C ATOM 2045 O PRO A 129 1.904 -8.432 -4.480 1.00 0.00 O ATOM 2046 CB PRO A 129 1.408 -6.128 -2.748 1.00 0.00 C ATOM 2047 CG PRO A 129 -0.070 -6.434 -2.570 1.00 0.00 C ATOM 2048 CD PRO A 129 -0.759 -6.198 -3.904 1.00 0.00 C ATOM 0 HA PRO A 129 2.333 -5.250 -4.493 1.00 0.00 H new ATOM 0 HB2 PRO A 129 2.025 -6.903 -2.293 1.00 0.00 H new ATOM 0 HB3 PRO A 129 1.673 -5.187 -2.267 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -0.210 -7.465 -2.245 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -0.502 -5.796 -1.799 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -1.298 -7.086 -4.234 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -1.488 -5.390 -3.836 1.00 0.00 H new ATOM 2056 N LEU A 130 3.305 -7.096 -5.649 1.00 0.00 N ATOM 2057 CA LEU A 130 4.027 -8.199 -6.260 1.00 0.00 C ATOM 2058 C LEU A 130 5.180 -8.618 -5.346 1.00 0.00 C ATOM 2059 O LEU A 130 5.925 -7.772 -4.854 1.00 0.00 O ATOM 2060 CB LEU A 130 4.469 -7.831 -7.678 1.00 0.00 C ATOM 2061 CG LEU A 130 3.353 -7.700 -8.716 1.00 0.00 C ATOM 2062 CD1 LEU A 130 3.870 -7.047 -9.999 1.00 0.00 C ATOM 2063 CD2 LEU A 130 2.695 -9.055 -8.987 1.00 0.00 C ATOM 0 H LEU A 130 3.633 -6.169 -5.920 1.00 0.00 H new ATOM 0 HA LEU A 130 3.375 -9.066 -6.369 1.00 0.00 H new ATOM 0 HB2 LEU A 130 5.010 -6.886 -7.635 1.00 0.00 H new ATOM 0 HB3 LEU A 130 5.174 -8.587 -8.025 1.00 0.00 H new ATOM 0 HG LEU A 130 2.584 -7.044 -8.309 1.00 0.00 H new ATOM 0 HD11 LEU A 130 3.056 -6.966 -10.720 1.00 0.00 H new ATOM 0 HD12 LEU A 130 4.254 -6.052 -9.772 1.00 0.00 H new ATOM 0 HD13 LEU A 130 4.669 -7.657 -10.421 1.00 0.00 H new ATOM 0 HD21 LEU A 130 1.905 -8.934 -9.728 1.00 0.00 H new ATOM 0 HD22 LEU A 130 3.442 -9.754 -9.364 1.00 0.00 H new ATOM 0 HD23 LEU A 130 2.268 -9.444 -8.062 1.00 0.00 H new ATOM 2075 N PRO A 131 5.293 -9.957 -5.140 1.00 0.00 N ATOM 2076 CA PRO A 131 6.342 -10.498 -4.293 1.00 0.00 C ATOM 2077 C PRO A 131 7.696 -10.458 -5.004 1.00 0.00 C ATOM 2078 O PRO A 131 7.800 -10.836 -6.170 1.00 0.00 O ATOM 2079 CB PRO A 131 5.889 -11.909 -3.957 1.00 0.00 C ATOM 2080 CG PRO A 131 4.841 -12.269 -4.998 1.00 0.00 C ATOM 2081 CD PRO A 131 4.428 -10.988 -5.705 1.00 0.00 C ATOM 0 HA PRO A 131 6.491 -9.915 -3.384 1.00 0.00 H new ATOM 0 HB2 PRO A 131 6.726 -12.606 -3.989 1.00 0.00 H new ATOM 0 HB3 PRO A 131 5.473 -11.956 -2.951 1.00 0.00 H new ATOM 0 HG2 PRO A 131 5.244 -12.987 -5.713 1.00 0.00 H new ATOM 0 HG3 PRO A 131 3.979 -12.739 -4.525 1.00 0.00 H new ATOM 0 HD2 PRO A 131 4.562 -11.070 -6.784 1.00 0.00 H new ATOM 0 HD3 PRO A 131 3.376 -10.761 -5.531 1.00 0.00 H new ATOM 2089 N VAL A 132 8.700 -9.997 -4.273 1.00 0.00 N ATOM 2090 CA VAL A 132 10.043 -9.902 -4.820 1.00 0.00 C ATOM 2091 C VAL A 132 10.975 -10.828 -4.034 1.00 0.00 C ATOM 2092 O VAL A 132 12.146 -10.975 -4.381 1.00 0.00 O ATOM 2093 CB VAL A 132 10.508 -8.445 -4.818 1.00 0.00 C ATOM 2094 CG1 VAL A 132 10.937 -8.008 -3.416 1.00 0.00 C ATOM 2095 CG2 VAL A 132 11.635 -8.227 -5.829 1.00 0.00 C ATOM 0 H VAL A 132 8.610 -9.685 -3.306 1.00 0.00 H new ATOM 0 HA VAL A 132 10.056 -10.231 -5.859 1.00 0.00 H new ATOM 0 HB VAL A 132 9.664 -7.824 -5.119 1.00 0.00 H new ATOM 0 HG11 VAL A 132 11.263 -6.968 -3.443 1.00 0.00 H new ATOM 0 HG12 VAL A 132 10.095 -8.107 -2.731 1.00 0.00 H new ATOM 0 HG13 VAL A 132 11.759 -8.637 -3.074 1.00 0.00 H new ATOM 0 HG21 VAL A 132 11.947 -7.183 -5.807 1.00 0.00 H new ATOM 0 HG22 VAL A 132 12.482 -8.864 -5.573 1.00 0.00 H new ATOM 0 HG23 VAL A 132 11.281 -8.479 -6.829 1.00 0.00 H new ATOM 2105 N SER A 133 10.419 -11.428 -2.991 1.00 0.00 N ATOM 2106 CA SER A 133 11.186 -12.335 -2.154 1.00 0.00 C ATOM 2107 C SER A 133 10.249 -13.104 -1.222 1.00 0.00 C ATOM 2108 O SER A 133 9.408 -12.508 -0.551 1.00 0.00 O ATOM 2109 CB SER A 133 12.239 -11.578 -1.342 1.00 0.00 C ATOM 2110 OG SER A 133 13.507 -12.227 -1.376 1.00 0.00 O ATOM 0 H SER A 133 9.447 -11.304 -2.707 1.00 0.00 H new ATOM 0 HA SER A 133 11.705 -13.042 -2.801 1.00 0.00 H new ATOM 0 HB2 SER A 133 12.339 -10.565 -1.733 1.00 0.00 H new ATOM 0 HB3 SER A 133 11.905 -11.489 -0.308 1.00 0.00 H new ATOM 0 HG SER A 133 14.152 -11.712 -0.848 1.00 0.00 H new ATOM 2116 N SER A 134 10.426 -14.417 -1.209 1.00 0.00 N ATOM 2117 CA SER A 134 9.606 -15.275 -0.369 1.00 0.00 C ATOM 2118 C SER A 134 9.365 -14.605 0.985 1.00 0.00 C ATOM 2119 O SER A 134 10.125 -13.728 1.392 1.00 0.00 O ATOM 2120 CB SER A 134 10.261 -16.644 -0.175 1.00 0.00 C ATOM 2121 OG SER A 134 9.873 -17.569 -1.188 1.00 0.00 O ATOM 0 H SER A 134 11.125 -14.908 -1.766 1.00 0.00 H new ATOM 0 HA SER A 134 8.649 -15.428 -0.867 1.00 0.00 H new ATOM 0 HB2 SER A 134 11.345 -16.532 -0.182 1.00 0.00 H new ATOM 0 HB3 SER A 134 9.988 -17.041 0.803 1.00 0.00 H new ATOM 0 HG SER A 134 10.313 -18.430 -1.030 1.00 0.00 H new ATOM 2127 N ASP A 135 8.304 -15.044 1.646 1.00 0.00 N ATOM 2128 CA ASP A 135 7.953 -14.498 2.946 1.00 0.00 C ATOM 2129 C ASP A 135 7.085 -15.507 3.701 1.00 0.00 C ATOM 2130 O ASP A 135 6.312 -16.244 3.091 1.00 0.00 O ATOM 2131 CB ASP A 135 7.154 -13.201 2.802 1.00 0.00 C ATOM 2132 CG ASP A 135 6.010 -13.257 1.788 1.00 0.00 C ATOM 2133 OD1 ASP A 135 5.036 -13.988 2.070 1.00 0.00 O ATOM 2134 OD2 ASP A 135 6.134 -12.566 0.753 1.00 0.00 O ATOM 0 H ASP A 135 7.676 -15.772 1.305 1.00 0.00 H new ATOM 0 HA ASP A 135 8.877 -14.294 3.486 1.00 0.00 H new ATOM 0 HB2 ASP A 135 6.744 -12.934 3.776 1.00 0.00 H new ATOM 0 HB3 ASP A 135 7.836 -12.401 2.514 1.00 0.00 H new ATOM 2139 N LEU A 136 7.242 -15.507 5.016 1.00 0.00 N ATOM 2140 CA LEU A 136 6.483 -16.413 5.861 1.00 0.00 C ATOM 2141 C LEU A 136 4.988 -16.205 5.609 1.00 0.00 C ATOM 2142 O LEU A 136 4.603 -15.378 4.784 1.00 0.00 O ATOM 2143 CB LEU A 136 6.888 -16.246 7.327 1.00 0.00 C ATOM 2144 CG LEU A 136 6.070 -15.240 8.139 1.00 0.00 C ATOM 2145 CD1 LEU A 136 5.538 -14.118 7.245 1.00 0.00 C ATOM 2146 CD2 LEU A 136 4.947 -15.940 8.908 1.00 0.00 C ATOM 0 H LEU A 136 7.884 -14.894 5.518 1.00 0.00 H new ATOM 0 HA LEU A 136 6.709 -17.449 5.608 1.00 0.00 H new ATOM 0 HB2 LEU A 136 6.819 -17.218 7.815 1.00 0.00 H new ATOM 0 HB3 LEU A 136 7.935 -15.945 7.362 1.00 0.00 H new ATOM 0 HG LEU A 136 6.728 -14.781 8.876 1.00 0.00 H new ATOM 0 HD11 LEU A 136 4.960 -13.416 7.847 1.00 0.00 H new ATOM 0 HD12 LEU A 136 6.374 -13.595 6.781 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.900 -14.542 6.470 1.00 0.00 H new ATOM 0 HD21 LEU A 136 4.381 -15.202 9.477 1.00 0.00 H new ATOM 0 HD22 LEU A 136 4.283 -16.443 8.205 1.00 0.00 H new ATOM 0 HD23 LEU A 136 5.376 -16.674 9.591 1.00 0.00 H new ATOM 2158 N GLU A 137 4.186 -16.971 6.334 1.00 0.00 N ATOM 2159 CA GLU A 137 2.742 -16.881 6.200 1.00 0.00 C ATOM 2160 C GLU A 137 2.315 -15.423 6.022 1.00 0.00 C ATOM 2161 O GLU A 137 2.164 -14.949 4.896 1.00 0.00 O ATOM 2162 CB GLU A 137 2.039 -17.515 7.402 1.00 0.00 C ATOM 2163 CG GLU A 137 1.333 -18.812 7.002 1.00 0.00 C ATOM 2164 CD GLU A 137 0.556 -19.400 8.182 1.00 0.00 C ATOM 2165 OE1 GLU A 137 0.324 -18.637 9.145 1.00 0.00 O ATOM 2166 OE2 GLU A 137 0.212 -20.598 8.095 1.00 0.00 O ATOM 0 H GLU A 137 4.509 -17.657 7.016 1.00 0.00 H new ATOM 0 HA GLU A 137 2.444 -17.438 5.311 1.00 0.00 H new ATOM 0 HB2 GLU A 137 2.767 -17.720 8.187 1.00 0.00 H new ATOM 0 HB3 GLU A 137 1.314 -16.814 7.815 1.00 0.00 H new ATOM 0 HG2 GLU A 137 0.652 -18.619 6.173 1.00 0.00 H new ATOM 0 HG3 GLU A 137 2.067 -19.536 6.649 1.00 0.00 H new ATOM 2173 N HIS A 138 2.133 -14.751 7.149 1.00 0.00 N ATOM 2174 CA HIS A 138 1.726 -13.356 7.131 1.00 0.00 C ATOM 2175 C HIS A 138 2.215 -12.663 8.405 1.00 0.00 C ATOM 2176 O HIS A 138 3.093 -11.802 8.350 1.00 0.00 O ATOM 2177 CB HIS A 138 0.214 -13.233 6.932 1.00 0.00 C ATOM 2178 CG HIS A 138 -0.202 -13.038 5.494 1.00 0.00 C ATOM 2179 ND1 HIS A 138 0.578 -12.360 4.573 1.00 0.00 N ATOM 2180 CD2 HIS A 138 -1.323 -13.438 4.828 1.00 0.00 C ATOM 2181 CE1 HIS A 138 -0.055 -12.359 3.409 1.00 0.00 C ATOM 2182 NE2 HIS A 138 -1.233 -13.027 3.570 1.00 0.00 N ATOM 0 H HIS A 138 2.260 -15.146 8.081 1.00 0.00 H new ATOM 0 HA HIS A 138 2.187 -12.850 6.283 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -0.267 -14.131 7.320 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -0.153 -12.394 7.523 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -2.145 -13.995 5.253 1.00 0.00 H new ATOM 0 HE1 HIS A 138 0.300 -11.908 2.494 1.00 0.00 H new ATOM 0 HE2 HIS A 138 -1.930 -13.185 2.843 1.00 0.00 H new ATOM 2190 N HIS A 139 1.626 -13.063 9.522 1.00 0.00 N ATOM 2191 CA HIS A 139 1.990 -12.492 10.807 1.00 0.00 C ATOM 2192 C HIS A 139 1.409 -13.349 11.933 1.00 0.00 C ATOM 2193 O HIS A 139 0.381 -14.000 11.755 1.00 0.00 O ATOM 2194 CB HIS A 139 1.556 -11.027 10.892 1.00 0.00 C ATOM 2195 CG HIS A 139 0.089 -10.803 10.614 1.00 0.00 C ATOM 2196 ND1 HIS A 139 -0.378 -10.297 9.414 1.00 0.00 N ATOM 2197 CD2 HIS A 139 -1.009 -11.023 11.393 1.00 0.00 C ATOM 2198 CE1 HIS A 139 -1.699 -10.219 9.479 1.00 0.00 C ATOM 2199 NE2 HIS A 139 -2.088 -10.669 10.706 1.00 0.00 N ATOM 0 H HIS A 139 0.898 -13.777 9.564 1.00 0.00 H new ATOM 0 HA HIS A 139 3.074 -12.497 10.917 1.00 0.00 H new ATOM 0 HB2 HIS A 139 1.789 -10.647 11.887 1.00 0.00 H new ATOM 0 HB3 HIS A 139 2.143 -10.443 10.183 1.00 0.00 H new ATOM 0 HD2 HIS A 139 -1.002 -11.418 12.398 1.00 0.00 H new ATOM 0 HE1 HIS A 139 -2.353 -9.862 8.697 1.00 0.00 H new ATOM 0 HE2 HIS A 139 -3.050 -10.724 11.041 1.00 0.00 H new ATOM 2207 N HIS A 140 2.092 -13.320 13.068 1.00 0.00 N ATOM 2208 CA HIS A 140 1.656 -14.086 14.223 1.00 0.00 C ATOM 2209 C HIS A 140 0.265 -13.618 14.654 1.00 0.00 C ATOM 2210 O HIS A 140 -0.181 -12.541 14.262 1.00 0.00 O ATOM 2211 CB HIS A 140 2.686 -14.001 15.351 1.00 0.00 C ATOM 2212 CG HIS A 140 2.651 -15.172 16.304 1.00 0.00 C ATOM 2213 ND1 HIS A 140 2.819 -15.031 17.671 1.00 0.00 N ATOM 2214 CD2 HIS A 140 2.465 -16.503 16.074 1.00 0.00 C ATOM 2215 CE1 HIS A 140 2.737 -16.231 18.228 1.00 0.00 C ATOM 2216 NE2 HIS A 140 2.518 -17.142 17.237 1.00 0.00 N ATOM 0 H HIS A 140 2.944 -12.778 13.212 1.00 0.00 H new ATOM 0 HA HIS A 140 1.580 -15.140 13.957 1.00 0.00 H new ATOM 0 HB2 HIS A 140 3.682 -13.930 14.915 1.00 0.00 H new ATOM 0 HB3 HIS A 140 2.519 -13.083 15.914 1.00 0.00 H new ATOM 0 HD2 HIS A 140 2.302 -16.960 15.109 1.00 0.00 H new ATOM 0 HE1 HIS A 140 2.828 -16.449 19.282 1.00 0.00 H new ATOM 0 HE2 HIS A 140 2.412 -18.148 17.368 1.00 0.00 H new ATOM 2224 N HIS A 141 -0.382 -14.451 15.456 1.00 0.00 N ATOM 2225 CA HIS A 141 -1.714 -14.136 15.945 1.00 0.00 C ATOM 2226 C HIS A 141 -1.733 -14.221 17.472 1.00 0.00 C ATOM 2227 O HIS A 141 -0.733 -14.582 18.090 1.00 0.00 O ATOM 2228 CB HIS A 141 -2.761 -15.037 15.287 1.00 0.00 C ATOM 2229 CG HIS A 141 -3.057 -16.300 16.061 1.00 0.00 C ATOM 2230 ND1 HIS A 141 -2.237 -17.116 16.783 1.00 0.00 N flip ATOM 2231 CD2 HIS A 141 -4.325 -16.848 16.144 1.00 0.00 C flip ATOM 2232 CE1 HIS A 141 -2.964 -18.108 17.282 1.00 0.00 C flip ATOM 2233 NE2 HIS A 141 -4.259 -17.944 16.886 1.00 0.00 N flip ATOM 0 H HIS A 141 -0.009 -15.343 15.779 1.00 0.00 H new ATOM 0 HA HIS A 141 -1.975 -13.114 15.670 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -3.686 -14.473 15.164 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -2.417 -15.307 14.288 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -5.217 -16.450 15.683 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -2.592 -18.912 17.899 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -5.040 -18.557 17.120 1.00 0.00 H new ATOM 2241 N HIS A 142 -2.883 -13.883 18.037 1.00 0.00 N ATOM 2242 CA HIS A 142 -3.046 -13.917 19.481 1.00 0.00 C ATOM 2243 C HIS A 142 -4.505 -14.223 19.825 1.00 0.00 C ATOM 2244 O HIS A 142 -5.362 -14.254 18.943 1.00 0.00 O ATOM 2245 CB HIS A 142 -2.548 -12.617 20.114 1.00 0.00 C ATOM 2246 CG HIS A 142 -3.127 -11.369 19.492 1.00 0.00 C ATOM 2247 ND1 HIS A 142 -2.648 -10.827 18.312 1.00 0.00 N ATOM 2248 CD2 HIS A 142 -4.151 -10.563 19.898 1.00 0.00 C ATOM 2249 CE1 HIS A 142 -3.358 -9.745 18.030 1.00 0.00 C ATOM 2250 NE2 HIS A 142 -4.288 -9.582 19.014 1.00 0.00 N ATOM 0 H HIS A 142 -3.711 -13.584 17.521 1.00 0.00 H new ATOM 0 HA HIS A 142 -2.434 -14.715 19.901 1.00 0.00 H new ATOM 0 HB2 HIS A 142 -2.790 -12.627 21.177 1.00 0.00 H new ATOM 0 HB3 HIS A 142 -1.462 -12.579 20.035 1.00 0.00 H new ATOM 0 HD2 HIS A 142 -4.748 -10.700 20.787 1.00 0.00 H new ATOM 0 HE1 HIS A 142 -3.224 -9.104 17.171 1.00 0.00 H new ATOM 0 HE2 HIS A 142 -4.976 -8.830 19.063 1.00 0.00 H new ATOM 2258 N HIS A 143 -4.743 -14.441 21.110 1.00 0.00 N ATOM 2259 CA HIS A 143 -6.083 -14.744 21.583 1.00 0.00 C ATOM 2260 C HIS A 143 -7.083 -13.781 20.940 1.00 0.00 C ATOM 2261 O HIS A 143 -7.477 -12.789 21.552 1.00 0.00 O ATOM 2262 CB HIS A 143 -6.138 -14.723 23.111 1.00 0.00 C ATOM 2263 CG HIS A 143 -7.404 -15.309 23.689 1.00 0.00 C ATOM 2264 ND1 HIS A 143 -8.648 -15.125 23.110 1.00 0.00 N ATOM 2265 CD2 HIS A 143 -7.606 -16.079 24.797 1.00 0.00 C ATOM 2266 CE1 HIS A 143 -9.550 -15.759 23.845 1.00 0.00 C ATOM 2267 NE2 HIS A 143 -8.902 -16.348 24.891 1.00 0.00 N ATOM 0 H HIS A 143 -4.030 -14.414 21.839 1.00 0.00 H new ATOM 0 HA HIS A 143 -6.359 -15.755 21.282 1.00 0.00 H new ATOM 0 HB2 HIS A 143 -5.283 -15.274 23.503 1.00 0.00 H new ATOM 0 HB3 HIS A 143 -6.037 -13.693 23.454 1.00 0.00 H new ATOM 0 HD2 HIS A 143 -6.841 -16.413 25.482 1.00 0.00 H new ATOM 0 HE1 HIS A 143 -10.611 -15.802 23.650 1.00 0.00 H new ATOM 0 HE2 HIS A 143 -9.341 -16.904 25.625 1.00 0.00 H new TER 2275 HIS A 143