USER MOD reduce.3.24.130724 H: found=0, std=0, add=1590, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1589 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: B 36 HIS : no HD1:sc= -10! C(o=-10!,f=-20!) USER MOD Set 1.2: B 37 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 55 LYS NZ :NH3+ 167:sc= 0.0107 (180deg=0) USER MOD Set 2.2: A 60 GLN : amide:sc= 0.00993 X(o=0.021,f=-0.082) USER MOD Single : A 1 MET CE :methyl -173:sc= -0.0573 (180deg=-0.176) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= -0.0168 USER MOD Single : A 12 GLN : amide:sc= -0.209 K(o=-0.21,f=-1.4) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0.075) USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=-0.049) USER MOD Single : A 18 MET CE :methyl 139:sc= -8.85! (180deg=-9.81!) USER MOD Single : A 19 GLN :FLIP amide:sc= -1.57! C(o=-3.1!,f=-1.6!) USER MOD Single : A 20 LYS NZ :NH3+ -126:sc= -0.395 (180deg=-1.95!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot -5:sc= 0.65! USER MOD Single : A 37 THR OG1 : rot 170:sc= -0.464 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS : no HD1:sc= -11.5! C(o=-11!,f=-13!) USER MOD Single : A 45 LYS NZ :NH3+ -106:sc= -0.852 (180deg=-4.29!) USER MOD Single : A 48 MET CE :methyl 149:sc= -10.3! (180deg=-15.9!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc=-0.00721 X(o=-0.0072,f=-0.47) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 LYS NZ :NH3+ 164:sc= -0.189 (180deg=-0.697) USER MOD Single : A 59 SER OG : rot 180:sc= -2.23 USER MOD Single : A 65 LYS NZ :NH3+ -169:sc=-0.000538 (180deg=-0.0892) USER MOD Single : A 66 ASN : amide:sc= -0.611 K(o=-0.61,f=-6.4!) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 170:sc= -1.33 USER MOD Single : A 74 GLN : amide:sc= -0.807 X(o=-0.81,f=-0.98) USER MOD Single : A 76 SER OG : rot 170:sc= 0.373 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 GLN : amide:sc= -0.0129 K(o=-0.013,f=-1.6!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 CYS SG : rot 77:sc= 0.589 USER MOD Single : A 94 GLN : amide:sc= -1.18 K(o=-1.2,f=-4.1!) USER MOD Single : A 97 THR OG1 : rot -52:sc= 0.491 USER MOD Single : A 101 TYR OH : rot 0:sc= -0.82 USER MOD Single : A 103 ASN : amide:sc= -0.31 X(o=-0.31,f=0) USER MOD Single : B 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 46 LYS NZ :NH3+ -159:sc= -2.41 (180deg=-2.6) USER MOD Single : B 51 SER OG : rot 180:sc= 0 USER MOD Single : B 54 THR OG1 : rot -64:sc= 0.616 USER MOD Single : B 55 ASN : amide:sc= -1.77 K(o=-1.8,f=-8.3!) USER MOD Single : B 62 CYS SG : rot 151:sc= 1.18 USER MOD Single : B 68 HIS : no HE2:sc= -2.5 K(o=-2.5,f=-7.5!) USER MOD Single : B 72 SER OG : rot 180:sc= -0.112 USER MOD Single : B 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 76 SER OG : rot 180:sc= 0 USER MOD Single : B 78 CYS SG : rot 61:sc= -2 USER MOD Single : B 81 THR OG1 : rot 180:sc= 0 USER MOD Single : B 87 TYR OH : rot 180:sc= 0 USER MOD Single : B 88 THR OG1 : rot -150:sc= -0.172 USER MOD Single : B 93 GLN : amide:sc= -0.129 X(o=-0.13,f=0) USER MOD Single : B 96 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000663) USER MOD Single : B 98 ASN : amide:sc= -2.06 X(o=-2.1,f=-2.5) USER MOD Single : B 100 GLN : amide:sc= -0.947 X(o=-0.95,f=-0.7) USER MOD Single : B 103 SER OG : rot 180:sc= 0 USER MOD Single : B 104 MET CE :methyl -178:sc= -1.57 (180deg=-1.6) USER MOD Single : B 106 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : B 108 CYS SG : rot -24:sc= -2.62 USER MOD Single : B 109 SER OG : rot 180:sc= 0 USER MOD Single : B 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 113 ASN : amide:sc= 1.26 K(o=1.3,f=-0.078) USER MOD Single : B 116 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 118 ASN : amide:sc= -0.039 K(o=-0.039,f=-1.5!) USER MOD Single : B 121 SER OG : rot 35:sc= 0.0567 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.391 28.076 -5.817 1.00 0.00 N ATOM 2 CA MET A 1 4.140 28.398 -6.553 1.00 0.00 C ATOM 3 C MET A 1 2.907 28.012 -5.742 1.00 0.00 C ATOM 4 O MET A 1 2.101 28.867 -5.375 1.00 0.00 O ATOM 5 CB MET A 1 4.152 27.647 -7.886 1.00 0.00 C ATOM 6 CG MET A 1 3.130 28.165 -8.885 1.00 0.00 C ATOM 7 SD MET A 1 2.837 27.012 -10.239 1.00 0.00 S ATOM 8 CE MET A 1 1.312 26.239 -9.702 1.00 0.00 C ATOM 0 H1 MET A 1 6.213 28.349 -6.393 1.00 0.00 H new ATOM 0 H2 MET A 1 5.409 28.598 -4.918 1.00 0.00 H new ATOM 0 H3 MET A 1 5.428 27.055 -5.625 1.00 0.00 H new ATOM 0 HA MET A 1 4.094 29.473 -6.727 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.147 27.720 -8.326 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.962 26.590 -7.700 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.190 28.360 -8.369 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.474 29.116 -9.291 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.067 25.415 -10.372 1.00 0.00 H new ATOM 0 HE2 MET A 1 1.434 25.859 -8.688 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.506 26.973 -9.720 1.00 0.00 H new ATOM 20 N ASP A 2 2.769 26.719 -5.465 1.00 0.00 N ATOM 21 CA ASP A 2 1.635 26.218 -4.697 1.00 0.00 C ATOM 22 C ASP A 2 0.322 26.484 -5.427 1.00 0.00 C ATOM 23 O ASP A 2 0.189 27.477 -6.142 1.00 0.00 O ATOM 24 CB ASP A 2 1.602 26.867 -3.312 1.00 0.00 C ATOM 25 CG ASP A 2 2.375 26.069 -2.281 1.00 0.00 C ATOM 26 OD1 ASP A 2 3.602 26.275 -2.169 1.00 0.00 O ATOM 27 OD2 ASP A 2 1.755 25.237 -1.585 1.00 0.00 O ATOM 0 H ASP A 2 3.429 25.999 -5.761 1.00 0.00 H new ATOM 0 HA ASP A 2 1.755 25.141 -4.583 1.00 0.00 H new ATOM 0 HB2 ASP A 2 2.018 27.873 -3.375 1.00 0.00 H new ATOM 0 HB3 ASP A 2 0.567 26.970 -2.986 1.00 0.00 H new ATOM 32 N LEU A 3 -0.643 25.590 -5.242 1.00 0.00 N ATOM 33 CA LEU A 3 -1.946 25.729 -5.882 1.00 0.00 C ATOM 34 C LEU A 3 -2.848 26.666 -5.083 1.00 0.00 C ATOM 35 O LEU A 3 -3.926 26.276 -4.634 1.00 0.00 O ATOM 36 CB LEU A 3 -2.612 24.359 -6.031 1.00 0.00 C ATOM 37 CG LEU A 3 -2.189 23.568 -7.271 1.00 0.00 C ATOM 38 CD1 LEU A 3 -0.687 23.334 -7.267 1.00 0.00 C ATOM 39 CD2 LEU A 3 -2.938 22.246 -7.339 1.00 0.00 C ATOM 0 H LEU A 3 -0.548 24.762 -4.654 1.00 0.00 H new ATOM 0 HA LEU A 3 -1.794 26.160 -6.872 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -2.389 23.764 -5.145 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -3.693 24.498 -6.058 1.00 0.00 H new ATOM 0 HG LEU A 3 -2.442 24.151 -8.156 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -0.404 22.770 -8.156 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -0.169 24.293 -7.266 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -0.409 22.771 -6.376 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -2.625 21.696 -8.227 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -2.716 21.656 -6.450 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -4.010 22.437 -7.389 1.00 0.00 H new ATOM 51 N SER A 4 -2.395 27.903 -4.909 1.00 0.00 N ATOM 52 CA SER A 4 -3.155 28.904 -4.165 1.00 0.00 C ATOM 53 C SER A 4 -3.265 28.538 -2.685 1.00 0.00 C ATOM 54 O SER A 4 -4.040 29.148 -1.947 1.00 0.00 O ATOM 55 CB SER A 4 -4.553 29.067 -4.763 1.00 0.00 C ATOM 56 OG SER A 4 -4.523 28.937 -6.174 1.00 0.00 O ATOM 0 H SER A 4 -1.503 28.238 -5.274 1.00 0.00 H new ATOM 0 HA SER A 4 -2.617 29.849 -4.243 1.00 0.00 H new ATOM 0 HB2 SER A 4 -5.222 28.318 -4.340 1.00 0.00 H new ATOM 0 HB3 SER A 4 -4.956 30.043 -4.493 1.00 0.00 H new ATOM 0 HG SER A 4 -5.429 29.044 -6.532 1.00 0.00 H new ATOM 62 N ALA A 5 -2.490 27.546 -2.252 1.00 0.00 N ATOM 63 CA ALA A 5 -2.508 27.115 -0.858 1.00 0.00 C ATOM 64 C ALA A 5 -3.925 26.786 -0.391 1.00 0.00 C ATOM 65 O ALA A 5 -4.217 26.831 0.804 1.00 0.00 O ATOM 66 CB ALA A 5 -1.903 28.192 0.025 1.00 0.00 C ATOM 0 H ALA A 5 -1.843 27.027 -2.846 1.00 0.00 H new ATOM 0 HA ALA A 5 -1.913 26.205 -0.779 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -1.920 27.863 1.064 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -0.873 28.377 -0.280 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -2.481 29.111 -0.074 1.00 0.00 H new ATOM 72 N LEU A 6 -4.800 26.458 -1.335 1.00 0.00 N ATOM 73 CA LEU A 6 -6.183 26.126 -1.009 1.00 0.00 C ATOM 74 C LEU A 6 -6.270 24.773 -0.308 1.00 0.00 C ATOM 75 O LEU A 6 -7.162 24.543 0.509 1.00 0.00 O ATOM 76 CB LEU A 6 -7.047 26.128 -2.274 1.00 0.00 C ATOM 77 CG LEU A 6 -6.850 24.924 -3.203 1.00 0.00 C ATOM 78 CD1 LEU A 6 -8.094 24.048 -3.212 1.00 0.00 C ATOM 79 CD2 LEU A 6 -6.513 25.384 -4.614 1.00 0.00 C ATOM 0 H LEU A 6 -4.578 26.415 -2.330 1.00 0.00 H new ATOM 0 HA LEU A 6 -6.561 26.887 -0.326 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -8.095 26.170 -1.978 1.00 0.00 H new ATOM 0 HB3 LEU A 6 -6.837 27.038 -2.836 1.00 0.00 H new ATOM 0 HG LEU A 6 -6.015 24.334 -2.826 1.00 0.00 H new ATOM 0 HD11 LEU A 6 -7.936 23.199 -3.877 1.00 0.00 H new ATOM 0 HD12 LEU A 6 -8.292 23.687 -2.203 1.00 0.00 H new ATOM 0 HD13 LEU A 6 -8.946 24.630 -3.563 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -6.377 24.515 -5.257 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -7.326 25.998 -5.001 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -5.594 25.969 -4.596 1.00 0.00 H new ATOM 91 N ARG A 7 -5.338 23.881 -0.630 1.00 0.00 N ATOM 92 CA ARG A 7 -5.311 22.553 -0.026 1.00 0.00 C ATOM 93 C ARG A 7 -4.062 21.784 -0.449 1.00 0.00 C ATOM 94 O ARG A 7 -4.103 20.567 -0.632 1.00 0.00 O ATOM 95 CB ARG A 7 -6.567 21.765 -0.410 1.00 0.00 C ATOM 96 CG ARG A 7 -6.617 21.364 -1.876 1.00 0.00 C ATOM 97 CD ARG A 7 -7.905 20.629 -2.211 1.00 0.00 C ATOM 98 NE ARG A 7 -9.084 21.472 -2.023 1.00 0.00 N ATOM 99 CZ ARG A 7 -9.732 21.601 -0.866 1.00 0.00 C ATOM 100 NH1 ARG A 7 -9.324 20.942 0.212 1.00 0.00 N ATOM 101 NH2 ARG A 7 -10.794 22.390 -0.788 1.00 0.00 N ATOM 0 H ARG A 7 -4.593 24.053 -1.305 1.00 0.00 H new ATOM 0 HA ARG A 7 -5.288 22.677 1.057 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -6.623 20.867 0.205 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -7.446 22.365 -0.177 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -6.532 22.253 -2.500 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -5.763 20.728 -2.109 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -7.867 20.285 -3.245 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -7.990 19.742 -1.583 1.00 0.00 H new ATOM 0 HE ARG A 7 -9.432 21.994 -2.827 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -8.509 20.331 0.158 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -9.826 21.046 1.094 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -11.114 22.897 -1.613 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -11.291 22.490 0.097 1.00 0.00 H new ATOM 115 N VAL A 8 -2.954 22.501 -0.602 1.00 0.00 N ATOM 116 CA VAL A 8 -1.695 21.884 -1.003 1.00 0.00 C ATOM 117 C VAL A 8 -1.074 21.103 0.150 1.00 0.00 C ATOM 118 O VAL A 8 -0.724 19.932 0.003 1.00 0.00 O ATOM 119 CB VAL A 8 -0.685 22.936 -1.499 1.00 0.00 C ATOM 120 CG1 VAL A 8 0.549 22.262 -2.079 1.00 0.00 C ATOM 121 CG2 VAL A 8 -1.331 23.854 -2.526 1.00 0.00 C ATOM 0 H VAL A 8 -2.902 23.509 -0.455 1.00 0.00 H new ATOM 0 HA VAL A 8 -1.925 21.200 -1.820 1.00 0.00 H new ATOM 0 HB VAL A 8 -0.373 23.542 -0.648 1.00 0.00 H new ATOM 0 HG11 VAL A 8 1.250 23.022 -2.424 1.00 0.00 H new ATOM 0 HG12 VAL A 8 1.024 21.651 -1.312 1.00 0.00 H new ATOM 0 HG13 VAL A 8 0.258 21.630 -2.918 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -0.602 24.591 -2.865 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -1.674 23.265 -3.376 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -2.180 24.366 -2.073 1.00 0.00 H new ATOM 131 N GLU A 9 -0.941 21.759 1.298 1.00 0.00 N ATOM 132 CA GLU A 9 -0.363 21.126 2.478 1.00 0.00 C ATOM 133 C GLU A 9 -1.182 19.910 2.899 1.00 0.00 C ATOM 134 O GLU A 9 -0.646 18.949 3.451 1.00 0.00 O ATOM 135 CB GLU A 9 -0.282 22.126 3.631 1.00 0.00 C ATOM 136 CG GLU A 9 -1.624 22.733 4.006 1.00 0.00 C ATOM 137 CD GLU A 9 -1.843 24.095 3.378 1.00 0.00 C ATOM 138 OE1 GLU A 9 -1.711 24.206 2.140 1.00 0.00 O ATOM 139 OE2 GLU A 9 -2.146 25.051 4.122 1.00 0.00 O ATOM 0 H GLU A 9 -1.226 22.729 1.436 1.00 0.00 H new ATOM 0 HA GLU A 9 0.644 20.793 2.225 1.00 0.00 H new ATOM 0 HB2 GLU A 9 0.138 21.627 4.504 1.00 0.00 H new ATOM 0 HB3 GLU A 9 0.406 22.926 3.359 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -2.423 22.060 3.694 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -1.688 22.822 5.090 1.00 0.00 H new ATOM 146 N GLU A 10 -2.484 19.960 2.637 1.00 0.00 N ATOM 147 CA GLU A 10 -3.378 18.862 2.990 1.00 0.00 C ATOM 148 C GLU A 10 -3.016 17.596 2.219 1.00 0.00 C ATOM 149 O GLU A 10 -2.681 16.572 2.812 1.00 0.00 O ATOM 150 CB GLU A 10 -4.830 19.249 2.707 1.00 0.00 C ATOM 151 CG GLU A 10 -5.376 20.300 3.659 1.00 0.00 C ATOM 152 CD GLU A 10 -5.721 19.730 5.020 1.00 0.00 C ATOM 153 OE1 GLU A 10 -6.047 18.526 5.095 1.00 0.00 O ATOM 154 OE2 GLU A 10 -5.669 20.486 6.013 1.00 0.00 O ATOM 0 H GLU A 10 -2.944 20.748 2.182 1.00 0.00 H new ATOM 0 HA GLU A 10 -3.264 18.661 4.055 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -4.905 19.622 1.686 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -5.453 18.357 2.768 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -4.640 21.095 3.778 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -6.266 20.753 3.223 1.00 0.00 H new ATOM 161 N VAL A 11 -3.088 17.675 0.894 1.00 0.00 N ATOM 162 CA VAL A 11 -2.770 16.536 0.041 1.00 0.00 C ATOM 163 C VAL A 11 -1.346 16.047 0.283 1.00 0.00 C ATOM 164 O VAL A 11 -1.084 14.844 0.286 1.00 0.00 O ATOM 165 CB VAL A 11 -2.934 16.886 -1.450 1.00 0.00 C ATOM 166 CG1 VAL A 11 -2.794 15.639 -2.310 1.00 0.00 C ATOM 167 CG2 VAL A 11 -4.272 17.567 -1.695 1.00 0.00 C ATOM 0 H VAL A 11 -3.364 18.516 0.388 1.00 0.00 H new ATOM 0 HA VAL A 11 -3.472 15.743 0.300 1.00 0.00 H new ATOM 0 HB VAL A 11 -2.143 17.582 -1.731 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -2.913 15.906 -3.360 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -1.808 15.200 -2.157 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -3.561 14.916 -2.030 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -4.370 17.807 -2.754 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -5.080 16.899 -1.398 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -4.326 18.484 -1.109 1.00 0.00 H new ATOM 177 N GLN A 12 -0.429 16.987 0.486 1.00 0.00 N ATOM 178 CA GLN A 12 0.969 16.652 0.730 1.00 0.00 C ATOM 179 C GLN A 12 1.110 15.778 1.972 1.00 0.00 C ATOM 180 O GLN A 12 1.917 14.848 2.001 1.00 0.00 O ATOM 181 CB GLN A 12 1.800 17.926 0.890 1.00 0.00 C ATOM 182 CG GLN A 12 3.281 17.725 0.614 1.00 0.00 C ATOM 183 CD GLN A 12 4.085 18.998 0.788 1.00 0.00 C ATOM 184 OE1 GLN A 12 3.603 20.094 0.499 1.00 0.00 O ATOM 185 NE2 GLN A 12 5.318 18.860 1.262 1.00 0.00 N ATOM 0 H GLN A 12 -0.629 17.987 0.486 1.00 0.00 H new ATOM 0 HA GLN A 12 1.338 16.092 -0.129 1.00 0.00 H new ATOM 0 HB2 GLN A 12 1.413 18.689 0.215 1.00 0.00 H new ATOM 0 HB3 GLN A 12 1.676 18.306 1.904 1.00 0.00 H new ATOM 0 HG2 GLN A 12 3.671 16.959 1.284 1.00 0.00 H new ATOM 0 HG3 GLN A 12 3.410 17.354 -0.403 1.00 0.00 H new ATOM 0 HE21 GLN A 12 5.677 17.932 1.488 1.00 0.00 H new ATOM 0 HE22 GLN A 12 5.906 19.682 1.400 1.00 0.00 H new ATOM 194 N ASN A 13 0.321 16.083 2.997 1.00 0.00 N ATOM 195 CA ASN A 13 0.359 15.326 4.243 1.00 0.00 C ATOM 196 C ASN A 13 -0.215 13.926 4.046 1.00 0.00 C ATOM 197 O ASN A 13 0.200 12.976 4.709 1.00 0.00 O ATOM 198 CB ASN A 13 -0.422 16.061 5.334 1.00 0.00 C ATOM 199 CG ASN A 13 0.444 17.037 6.106 1.00 0.00 C ATOM 200 OD1 ASN A 13 1.099 17.900 5.523 1.00 0.00 O ATOM 201 ND2 ASN A 13 0.452 16.903 7.427 1.00 0.00 N ATOM 0 H ASN A 13 -0.352 16.849 2.989 1.00 0.00 H new ATOM 0 HA ASN A 13 1.400 15.232 4.551 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -1.255 16.598 4.881 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -0.849 15.333 6.024 1.00 0.00 H new ATOM 0 HD21 ASN A 13 1.017 17.530 8.000 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -0.107 16.173 7.869 1.00 0.00 H new ATOM 208 N VAL A 14 -1.172 13.807 3.131 1.00 0.00 N ATOM 209 CA VAL A 14 -1.802 12.523 2.849 1.00 0.00 C ATOM 210 C VAL A 14 -0.849 11.594 2.106 1.00 0.00 C ATOM 211 O VAL A 14 -0.677 10.435 2.482 1.00 0.00 O ATOM 212 CB VAL A 14 -3.084 12.697 2.013 1.00 0.00 C ATOM 213 CG1 VAL A 14 -3.829 11.375 1.898 1.00 0.00 C ATOM 214 CG2 VAL A 14 -3.976 13.769 2.619 1.00 0.00 C ATOM 0 H VAL A 14 -1.527 14.583 2.573 1.00 0.00 H new ATOM 0 HA VAL A 14 -2.061 12.081 3.811 1.00 0.00 H new ATOM 0 HB VAL A 14 -2.801 13.017 1.010 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -4.732 11.517 1.304 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -3.189 10.637 1.414 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -4.101 11.023 2.893 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -4.877 13.877 2.015 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -4.252 13.482 3.633 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.439 14.717 2.644 1.00 0.00 H new ATOM 224 N ILE A 15 -0.232 12.110 1.047 1.00 0.00 N ATOM 225 CA ILE A 15 0.704 11.325 0.250 1.00 0.00 C ATOM 226 C ILE A 15 1.822 10.758 1.119 1.00 0.00 C ATOM 227 O ILE A 15 2.323 9.661 0.865 1.00 0.00 O ATOM 228 CB ILE A 15 1.317 12.168 -0.886 1.00 0.00 C ATOM 229 CG1 ILE A 15 0.211 12.804 -1.730 1.00 0.00 C ATOM 230 CG2 ILE A 15 2.226 11.311 -1.756 1.00 0.00 C ATOM 231 CD1 ILE A 15 0.504 14.230 -2.138 1.00 0.00 C ATOM 0 H ILE A 15 -0.363 13.068 0.721 1.00 0.00 H new ATOM 0 HA ILE A 15 0.140 10.502 -0.188 1.00 0.00 H new ATOM 0 HB ILE A 15 1.917 12.963 -0.443 1.00 0.00 H new ATOM 0 HG12 ILE A 15 0.058 12.203 -2.626 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -0.722 12.780 -1.168 1.00 0.00 H new ATOM 0 HG21 ILE A 15 2.650 11.923 -2.552 1.00 0.00 H new ATOM 0 HG22 ILE A 15 3.031 10.900 -1.147 1.00 0.00 H new ATOM 0 HG23 ILE A 15 1.649 10.496 -2.193 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -0.324 14.615 -2.734 1.00 0.00 H new ATOM 0 HD12 ILE A 15 0.627 14.845 -1.247 1.00 0.00 H new ATOM 0 HD13 ILE A 15 1.420 14.259 -2.728 1.00 0.00 H new ATOM 243 N ASN A 16 2.206 11.507 2.147 1.00 0.00 N ATOM 244 CA ASN A 16 3.260 11.071 3.055 1.00 0.00 C ATOM 245 C ASN A 16 2.842 9.801 3.788 1.00 0.00 C ATOM 246 O ASN A 16 3.546 8.790 3.755 1.00 0.00 O ATOM 247 CB ASN A 16 3.587 12.174 4.063 1.00 0.00 C ATOM 248 CG ASN A 16 5.057 12.205 4.431 1.00 0.00 C ATOM 249 OD1 ASN A 16 5.615 11.210 4.892 1.00 0.00 O ATOM 250 ND2 ASN A 16 5.692 13.354 4.230 1.00 0.00 N ATOM 0 H ASN A 16 1.804 12.417 2.372 1.00 0.00 H new ATOM 0 HA ASN A 16 4.152 10.858 2.466 1.00 0.00 H new ATOM 0 HB2 ASN A 16 3.299 13.139 3.647 1.00 0.00 H new ATOM 0 HB3 ASN A 16 2.993 12.026 4.965 1.00 0.00 H new ATOM 0 HD21 ASN A 16 6.682 13.436 4.460 1.00 0.00 H new ATOM 0 HD22 ASN A 16 5.189 14.154 3.845 1.00 0.00 H new ATOM 257 N ALA A 17 1.686 9.857 4.443 1.00 0.00 N ATOM 258 CA ALA A 17 1.169 8.709 5.174 1.00 0.00 C ATOM 259 C ALA A 17 0.964 7.523 4.239 1.00 0.00 C ATOM 260 O ALA A 17 1.146 6.370 4.631 1.00 0.00 O ATOM 261 CB ALA A 17 -0.136 9.068 5.870 1.00 0.00 C ATOM 0 H ALA A 17 1.092 10.685 4.481 1.00 0.00 H new ATOM 0 HA ALA A 17 1.901 8.426 5.931 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -0.510 8.200 6.412 1.00 0.00 H new ATOM 0 HB2 ALA A 17 0.038 9.885 6.570 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -0.872 9.376 5.127 1.00 0.00 H new ATOM 267 N MET A 18 0.593 7.819 2.998 1.00 0.00 N ATOM 268 CA MET A 18 0.371 6.782 1.998 1.00 0.00 C ATOM 269 C MET A 18 1.650 5.990 1.755 1.00 0.00 C ATOM 270 O MET A 18 1.612 4.784 1.508 1.00 0.00 O ATOM 271 CB MET A 18 -0.114 7.405 0.688 1.00 0.00 C ATOM 272 CG MET A 18 -0.765 6.409 -0.259 1.00 0.00 C ATOM 273 SD MET A 18 -2.555 6.323 -0.059 1.00 0.00 S ATOM 274 CE MET A 18 -3.006 8.045 -0.257 1.00 0.00 C ATOM 0 H MET A 18 0.440 8.769 2.661 1.00 0.00 H new ATOM 0 HA MET A 18 -0.394 6.102 2.372 1.00 0.00 H new ATOM 0 HB2 MET A 18 -0.828 8.197 0.915 1.00 0.00 H new ATOM 0 HB3 MET A 18 0.731 7.873 0.184 1.00 0.00 H new ATOM 0 HG2 MET A 18 -0.532 6.686 -1.287 1.00 0.00 H new ATOM 0 HG3 MET A 18 -0.337 5.421 -0.090 1.00 0.00 H new ATOM 0 HE1 MET A 18 -3.913 8.117 -0.857 1.00 0.00 H new ATOM 0 HE2 MET A 18 -3.182 8.490 0.722 1.00 0.00 H new ATOM 0 HE3 MET A 18 -2.197 8.578 -0.757 1.00 0.00 H new ATOM 284 N GLN A 19 2.785 6.678 1.833 1.00 0.00 N ATOM 285 CA GLN A 19 4.081 6.042 1.628 1.00 0.00 C ATOM 286 C GLN A 19 4.424 5.128 2.798 1.00 0.00 C ATOM 287 O GLN A 19 5.111 4.120 2.631 1.00 0.00 O ATOM 288 CB GLN A 19 5.171 7.103 1.455 1.00 0.00 C ATOM 289 CG GLN A 19 6.403 6.595 0.722 1.00 0.00 C ATOM 290 CD GLN A 19 7.690 7.173 1.278 1.00 0.00 C ATOM 291 OE1 GLN A 19 8.816 6.583 0.896 1.00 0.00 O flip ATOM 292 NE2 GLN A 19 7.673 8.140 2.041 1.00 0.00 N flip ATOM 0 H GLN A 19 2.833 7.676 2.037 1.00 0.00 H new ATOM 0 HA GLN A 19 4.026 5.439 0.722 1.00 0.00 H new ATOM 0 HB2 GLN A 19 4.758 7.951 0.909 1.00 0.00 H new ATOM 0 HB3 GLN A 19 5.468 7.470 2.437 1.00 0.00 H new ATOM 0 HG2 GLN A 19 6.439 5.508 0.788 1.00 0.00 H new ATOM 0 HG3 GLN A 19 6.322 6.847 -0.335 1.00 0.00 H new ATOM 0 HE21 GLN A 19 6.784 8.563 2.309 1.00 0.00 H new ATOM 0 HE22 GLN A 19 8.548 8.518 2.405 1.00 0.00 H new ATOM 301 N LYS A 20 3.937 5.485 3.984 1.00 0.00 N ATOM 302 CA LYS A 20 4.190 4.695 5.185 1.00 0.00 C ATOM 303 C LYS A 20 3.710 3.259 5.001 1.00 0.00 C ATOM 304 O LYS A 20 4.357 2.316 5.455 1.00 0.00 O ATOM 305 CB LYS A 20 3.493 5.328 6.391 1.00 0.00 C ATOM 306 CG LYS A 20 3.978 6.733 6.706 1.00 0.00 C ATOM 307 CD LYS A 20 3.482 7.203 8.064 1.00 0.00 C ATOM 308 CE LYS A 20 4.345 6.658 9.191 1.00 0.00 C ATOM 309 NZ LYS A 20 3.848 5.344 9.686 1.00 0.00 N ATOM 0 H LYS A 20 3.365 6.316 4.138 1.00 0.00 H new ATOM 0 HA LYS A 20 5.265 4.680 5.362 1.00 0.00 H new ATOM 0 HB2 LYS A 20 2.419 5.356 6.206 1.00 0.00 H new ATOM 0 HB3 LYS A 20 3.649 4.694 7.264 1.00 0.00 H new ATOM 0 HG2 LYS A 20 5.068 6.755 6.688 1.00 0.00 H new ATOM 0 HG3 LYS A 20 3.632 7.420 5.934 1.00 0.00 H new ATOM 0 HD2 LYS A 20 3.485 8.293 8.096 1.00 0.00 H new ATOM 0 HD3 LYS A 20 2.450 6.882 8.207 1.00 0.00 H new ATOM 0 HE2 LYS A 20 5.372 6.550 8.842 1.00 0.00 H new ATOM 0 HE3 LYS A 20 4.362 7.373 10.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 3.705 5.392 10.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 2.946 5.117 9.221 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 4.546 4.604 9.468 1.00 0.00 H new ATOM 323 N ILE A 21 2.575 3.100 4.327 1.00 0.00 N ATOM 324 CA ILE A 21 2.012 1.779 4.080 1.00 0.00 C ATOM 325 C ILE A 21 2.893 0.990 3.115 1.00 0.00 C ATOM 326 O ILE A 21 3.074 -0.218 3.269 1.00 0.00 O ATOM 327 CB ILE A 21 0.579 1.873 3.511 1.00 0.00 C ATOM 328 CG1 ILE A 21 -0.347 2.554 4.521 1.00 0.00 C ATOM 329 CG2 ILE A 21 0.049 0.491 3.151 1.00 0.00 C ATOM 330 CD1 ILE A 21 -0.322 4.064 4.442 1.00 0.00 C ATOM 0 H ILE A 21 2.028 3.870 3.943 1.00 0.00 H new ATOM 0 HA ILE A 21 1.971 1.260 5.038 1.00 0.00 H new ATOM 0 HB ILE A 21 0.608 2.473 2.602 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -1.367 2.207 4.358 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -0.063 2.246 5.527 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -0.961 0.581 2.752 1.00 0.00 H new ATOM 0 HG22 ILE A 21 0.696 0.037 2.400 1.00 0.00 H new ATOM 0 HG23 ILE A 21 0.033 -0.136 4.042 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -1.002 4.479 5.186 1.00 0.00 H new ATOM 0 HD12 ILE A 21 0.689 4.422 4.635 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -0.636 4.382 3.448 1.00 0.00 H new ATOM 342 N LEU A 22 3.443 1.684 2.124 1.00 0.00 N ATOM 343 CA LEU A 22 4.311 1.052 1.139 1.00 0.00 C ATOM 344 C LEU A 22 5.777 1.280 1.488 1.00 0.00 C ATOM 345 O LEU A 22 6.630 1.374 0.605 1.00 0.00 O ATOM 346 CB LEU A 22 4.017 1.600 -0.260 1.00 0.00 C ATOM 347 CG LEU A 22 2.774 1.022 -0.937 1.00 0.00 C ATOM 348 CD1 LEU A 22 2.821 -0.499 -0.935 1.00 0.00 C ATOM 349 CD2 LEU A 22 1.512 1.519 -0.245 1.00 0.00 C ATOM 0 H LEU A 22 3.303 2.684 1.982 1.00 0.00 H new ATOM 0 HA LEU A 22 4.113 -0.020 1.149 1.00 0.00 H new ATOM 0 HB2 LEU A 22 3.905 2.682 -0.193 1.00 0.00 H new ATOM 0 HB3 LEU A 22 4.881 1.408 -0.897 1.00 0.00 H new ATOM 0 HG LEU A 22 2.757 1.362 -1.972 1.00 0.00 H new ATOM 0 HD11 LEU A 22 1.928 -0.891 -1.421 1.00 0.00 H new ATOM 0 HD12 LEU A 22 3.706 -0.836 -1.475 1.00 0.00 H new ATOM 0 HD13 LEU A 22 2.863 -0.860 0.092 1.00 0.00 H new ATOM 0 HD21 LEU A 22 0.636 1.098 -0.739 1.00 0.00 H new ATOM 0 HD22 LEU A 22 1.523 1.208 0.800 1.00 0.00 H new ATOM 0 HD23 LEU A 22 1.472 2.607 -0.299 1.00 0.00 H new ATOM 361 N GLU A 23 6.062 1.373 2.783 1.00 0.00 N ATOM 362 CA GLU A 23 7.425 1.595 3.252 1.00 0.00 C ATOM 363 C GLU A 23 8.101 0.278 3.621 1.00 0.00 C ATOM 364 O GLU A 23 7.603 -0.800 3.297 1.00 0.00 O ATOM 365 CB GLU A 23 7.423 2.539 4.457 1.00 0.00 C ATOM 366 CG GLU A 23 8.561 3.546 4.443 1.00 0.00 C ATOM 367 CD GLU A 23 8.140 4.908 4.957 1.00 0.00 C ATOM 368 OE1 GLU A 23 8.212 5.128 6.184 1.00 0.00 O ATOM 369 OE2 GLU A 23 7.738 5.756 4.132 1.00 0.00 O ATOM 0 H GLU A 23 5.367 1.298 3.526 1.00 0.00 H new ATOM 0 HA GLU A 23 7.990 2.053 2.440 1.00 0.00 H new ATOM 0 HB2 GLU A 23 6.475 3.075 4.486 1.00 0.00 H new ATOM 0 HB3 GLU A 23 7.483 1.948 5.371 1.00 0.00 H new ATOM 0 HG2 GLU A 23 9.382 3.169 5.053 1.00 0.00 H new ATOM 0 HG3 GLU A 23 8.940 3.647 3.426 1.00 0.00 H new ATOM 376 N CYS A 24 9.240 0.378 4.295 1.00 0.00 N ATOM 377 CA CYS A 24 9.996 -0.798 4.707 1.00 0.00 C ATOM 378 C CYS A 24 9.998 -0.938 6.231 1.00 0.00 C ATOM 379 O CYS A 24 10.116 0.055 6.949 1.00 0.00 O ATOM 380 CB CYS A 24 11.424 -0.692 4.186 1.00 0.00 C ATOM 381 SG CYS A 24 12.371 -2.224 4.273 1.00 0.00 S ATOM 0 H CYS A 24 9.662 1.265 4.569 1.00 0.00 H new ATOM 0 HA CYS A 24 9.522 -1.685 4.287 1.00 0.00 H new ATOM 0 HB2 CYS A 24 11.394 -0.357 3.149 1.00 0.00 H new ATOM 0 HB3 CYS A 24 11.948 0.076 4.754 1.00 0.00 H new ATOM 386 N PRO A 25 9.840 -2.170 6.747 1.00 0.00 N ATOM 387 CA PRO A 25 9.795 -2.430 8.181 1.00 0.00 C ATOM 388 C PRO A 25 11.149 -2.797 8.795 1.00 0.00 C ATOM 389 O PRO A 25 11.199 -3.299 9.918 1.00 0.00 O ATOM 390 CB PRO A 25 8.850 -3.623 8.248 1.00 0.00 C ATOM 391 CG PRO A 25 9.139 -4.399 7.003 1.00 0.00 C ATOM 392 CD PRO A 25 9.655 -3.414 5.976 1.00 0.00 C ATOM 0 HA PRO A 25 9.487 -1.548 8.743 1.00 0.00 H new ATOM 0 HB2 PRO A 25 9.030 -4.223 9.140 1.00 0.00 H new ATOM 0 HB3 PRO A 25 7.809 -3.303 8.284 1.00 0.00 H new ATOM 0 HG2 PRO A 25 9.878 -5.177 7.196 1.00 0.00 H new ATOM 0 HG3 PRO A 25 8.239 -4.897 6.642 1.00 0.00 H new ATOM 0 HD2 PRO A 25 10.591 -3.752 5.531 1.00 0.00 H new ATOM 0 HD3 PRO A 25 8.945 -3.278 5.160 1.00 0.00 H new ATOM 400 N ILE A 26 12.243 -2.557 8.074 1.00 0.00 N ATOM 401 CA ILE A 26 13.566 -2.888 8.605 1.00 0.00 C ATOM 402 C ILE A 26 14.622 -1.844 8.242 1.00 0.00 C ATOM 403 O ILE A 26 15.459 -1.492 9.072 1.00 0.00 O ATOM 404 CB ILE A 26 14.037 -4.279 8.135 1.00 0.00 C ATOM 405 CG1 ILE A 26 14.182 -4.319 6.614 1.00 0.00 C ATOM 406 CG2 ILE A 26 13.070 -5.353 8.609 1.00 0.00 C ATOM 407 CD1 ILE A 26 15.606 -4.136 6.138 1.00 0.00 C ATOM 0 H ILE A 26 12.243 -2.144 7.141 1.00 0.00 H new ATOM 0 HA ILE A 26 13.455 -2.896 9.689 1.00 0.00 H new ATOM 0 HB ILE A 26 15.016 -4.475 8.573 1.00 0.00 H new ATOM 0 HG12 ILE A 26 13.804 -5.273 6.246 1.00 0.00 H new ATOM 0 HG13 ILE A 26 13.558 -3.539 6.177 1.00 0.00 H new ATOM 0 HG21 ILE A 26 13.416 -6.329 8.270 1.00 0.00 H new ATOM 0 HG22 ILE A 26 13.021 -5.344 9.698 1.00 0.00 H new ATOM 0 HG23 ILE A 26 12.079 -5.157 8.200 1.00 0.00 H new ATOM 0 HD11 ILE A 26 15.634 -4.175 5.049 1.00 0.00 H new ATOM 0 HD12 ILE A 26 15.981 -3.170 6.476 1.00 0.00 H new ATOM 0 HD13 ILE A 26 16.231 -4.931 6.546 1.00 0.00 H new ATOM 419 N CYS A 27 14.592 -1.352 7.006 1.00 0.00 N ATOM 420 CA CYS A 27 15.565 -0.353 6.568 1.00 0.00 C ATOM 421 C CYS A 27 14.881 0.913 6.051 1.00 0.00 C ATOM 422 O CYS A 27 15.544 1.827 5.560 1.00 0.00 O ATOM 423 CB CYS A 27 16.477 -0.932 5.484 1.00 0.00 C ATOM 424 SG CYS A 27 15.609 -1.477 3.996 1.00 0.00 S ATOM 0 H CYS A 27 13.912 -1.625 6.296 1.00 0.00 H new ATOM 0 HA CYS A 27 16.166 -0.081 7.436 1.00 0.00 H new ATOM 0 HB2 CYS A 27 17.214 -0.179 5.205 1.00 0.00 H new ATOM 0 HB3 CYS A 27 17.026 -1.777 5.900 1.00 0.00 H new ATOM 429 N LEU A 28 13.557 0.967 6.165 1.00 0.00 N ATOM 430 CA LEU A 28 12.795 2.126 5.714 1.00 0.00 C ATOM 431 C LEU A 28 13.098 2.459 4.254 1.00 0.00 C ATOM 432 O LEU A 28 13.022 3.620 3.848 1.00 0.00 O ATOM 433 CB LEU A 28 13.103 3.337 6.598 1.00 0.00 C ATOM 434 CG LEU A 28 12.316 3.400 7.907 1.00 0.00 C ATOM 435 CD1 LEU A 28 10.824 3.506 7.628 1.00 0.00 C ATOM 436 CD2 LEU A 28 12.613 2.179 8.765 1.00 0.00 C ATOM 0 H LEU A 28 12.990 0.220 6.566 1.00 0.00 H new ATOM 0 HA LEU A 28 11.736 1.880 5.793 1.00 0.00 H new ATOM 0 HB2 LEU A 28 14.168 3.336 6.832 1.00 0.00 H new ATOM 0 HB3 LEU A 28 12.903 4.244 6.028 1.00 0.00 H new ATOM 0 HG LEU A 28 12.627 4.290 8.454 1.00 0.00 H new ATOM 0 HD11 LEU A 28 10.280 3.550 8.571 1.00 0.00 H new ATOM 0 HD12 LEU A 28 10.625 4.410 7.052 1.00 0.00 H new ATOM 0 HD13 LEU A 28 10.497 2.635 7.061 1.00 0.00 H new ATOM 0 HD21 LEU A 28 12.045 2.240 9.693 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.329 1.276 8.224 1.00 0.00 H new ATOM 0 HD23 LEU A 28 13.678 2.145 8.993 1.00 0.00 H new ATOM 448 N GLU A 29 13.436 1.442 3.466 1.00 0.00 N ATOM 449 CA GLU A 29 13.742 1.647 2.054 1.00 0.00 C ATOM 450 C GLU A 29 12.555 1.254 1.182 1.00 0.00 C ATOM 451 O GLU A 29 12.127 0.100 1.190 1.00 0.00 O ATOM 452 CB GLU A 29 14.977 0.839 1.650 1.00 0.00 C ATOM 453 CG GLU A 29 16.228 1.211 2.428 1.00 0.00 C ATOM 454 CD GLU A 29 16.692 2.626 2.143 1.00 0.00 C ATOM 455 OE1 GLU A 29 16.765 2.999 0.954 1.00 0.00 O ATOM 456 OE2 GLU A 29 16.983 3.361 3.111 1.00 0.00 O ATOM 0 H GLU A 29 13.505 0.474 3.779 1.00 0.00 H new ATOM 0 HA GLU A 29 13.949 2.706 1.904 1.00 0.00 H new ATOM 0 HB2 GLU A 29 14.771 -0.221 1.795 1.00 0.00 H new ATOM 0 HB3 GLU A 29 15.164 0.984 0.586 1.00 0.00 H new ATOM 0 HG2 GLU A 29 16.033 1.104 3.495 1.00 0.00 H new ATOM 0 HG3 GLU A 29 17.027 0.513 2.179 1.00 0.00 H new ATOM 463 N LEU A 30 12.024 2.221 0.434 1.00 0.00 N ATOM 464 CA LEU A 30 10.879 1.979 -0.446 1.00 0.00 C ATOM 465 C LEU A 30 10.995 0.629 -1.148 1.00 0.00 C ATOM 466 O LEU A 30 11.707 0.492 -2.143 1.00 0.00 O ATOM 467 CB LEU A 30 10.757 3.097 -1.482 1.00 0.00 C ATOM 468 CG LEU A 30 9.379 3.225 -2.135 1.00 0.00 C ATOM 469 CD1 LEU A 30 8.333 3.631 -1.105 1.00 0.00 C ATOM 470 CD2 LEU A 30 9.422 4.228 -3.278 1.00 0.00 C ATOM 0 H LEU A 30 12.369 3.181 0.419 1.00 0.00 H new ATOM 0 HA LEU A 30 9.982 1.965 0.173 1.00 0.00 H new ATOM 0 HB2 LEU A 30 11.005 4.044 -1.003 1.00 0.00 H new ATOM 0 HB3 LEU A 30 11.499 2.931 -2.263 1.00 0.00 H new ATOM 0 HG LEU A 30 9.100 2.253 -2.541 1.00 0.00 H new ATOM 0 HD11 LEU A 30 7.360 3.717 -1.589 1.00 0.00 H new ATOM 0 HD12 LEU A 30 8.283 2.876 -0.320 1.00 0.00 H new ATOM 0 HD13 LEU A 30 8.607 4.591 -0.668 1.00 0.00 H new ATOM 0 HD21 LEU A 30 8.434 4.306 -3.731 1.00 0.00 H new ATOM 0 HD22 LEU A 30 9.724 5.203 -2.895 1.00 0.00 H new ATOM 0 HD23 LEU A 30 10.139 3.894 -4.028 1.00 0.00 H new ATOM 482 N ILE A 31 10.297 -0.366 -0.612 1.00 0.00 N ATOM 483 CA ILE A 31 10.321 -1.712 -1.169 1.00 0.00 C ATOM 484 C ILE A 31 10.007 -1.706 -2.664 1.00 0.00 C ATOM 485 O ILE A 31 9.019 -1.117 -3.102 1.00 0.00 O ATOM 486 CB ILE A 31 9.326 -2.638 -0.433 1.00 0.00 C ATOM 487 CG1 ILE A 31 7.879 -2.257 -0.764 1.00 0.00 C ATOM 488 CG2 ILE A 31 9.563 -2.576 1.071 1.00 0.00 C ATOM 489 CD1 ILE A 31 6.850 -3.129 -0.075 1.00 0.00 C ATOM 0 H ILE A 31 9.705 -0.264 0.212 1.00 0.00 H new ATOM 0 HA ILE A 31 11.332 -2.096 -1.029 1.00 0.00 H new ATOM 0 HB ILE A 31 9.493 -3.660 -0.772 1.00 0.00 H new ATOM 0 HG12 ILE A 31 7.712 -1.218 -0.480 1.00 0.00 H new ATOM 0 HG13 ILE A 31 7.733 -2.320 -1.842 1.00 0.00 H new ATOM 0 HG21 ILE A 31 8.856 -3.232 1.578 1.00 0.00 H new ATOM 0 HG22 ILE A 31 10.580 -2.898 1.293 1.00 0.00 H new ATOM 0 HG23 ILE A 31 9.422 -1.553 1.420 1.00 0.00 H new ATOM 0 HD11 ILE A 31 5.849 -2.801 -0.356 1.00 0.00 H new ATOM 0 HD12 ILE A 31 6.991 -4.167 -0.378 1.00 0.00 H new ATOM 0 HD13 ILE A 31 6.969 -3.047 1.005 1.00 0.00 H new ATOM 501 N LYS A 32 10.860 -2.367 -3.442 1.00 0.00 N ATOM 502 CA LYS A 32 10.678 -2.442 -4.887 1.00 0.00 C ATOM 503 C LYS A 32 10.157 -3.816 -5.292 1.00 0.00 C ATOM 504 O LYS A 32 9.353 -3.940 -6.215 1.00 0.00 O ATOM 505 CB LYS A 32 11.999 -2.152 -5.604 1.00 0.00 C ATOM 506 CG LYS A 32 11.829 -1.376 -6.901 1.00 0.00 C ATOM 507 CD LYS A 32 12.987 -0.420 -7.133 1.00 0.00 C ATOM 508 CE LYS A 32 13.067 0.633 -6.039 1.00 0.00 C ATOM 509 NZ LYS A 32 13.788 1.854 -6.495 1.00 0.00 N ATOM 0 H LYS A 32 11.684 -2.858 -3.095 1.00 0.00 H new ATOM 0 HA LYS A 32 9.944 -1.691 -5.179 1.00 0.00 H new ATOM 0 HB2 LYS A 32 12.650 -1.588 -4.935 1.00 0.00 H new ATOM 0 HB3 LYS A 32 12.502 -3.095 -5.818 1.00 0.00 H new ATOM 0 HG2 LYS A 32 11.758 -2.073 -7.736 1.00 0.00 H new ATOM 0 HG3 LYS A 32 10.894 -0.817 -6.872 1.00 0.00 H new ATOM 0 HD2 LYS A 32 13.921 -0.980 -7.169 1.00 0.00 H new ATOM 0 HD3 LYS A 32 12.870 0.067 -8.101 1.00 0.00 H new ATOM 0 HE2 LYS A 32 12.060 0.903 -5.721 1.00 0.00 H new ATOM 0 HE3 LYS A 32 13.574 0.215 -5.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 13.821 2.547 -5.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 14.757 1.601 -6.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 13.290 2.268 -7.309 1.00 0.00 H new ATOM 523 N GLU A 33 10.617 -4.845 -4.588 1.00 0.00 N ATOM 524 CA GLU A 33 10.196 -6.213 -4.864 1.00 0.00 C ATOM 525 C GLU A 33 9.402 -6.776 -3.688 1.00 0.00 C ATOM 526 O GLU A 33 9.942 -7.505 -2.855 1.00 0.00 O ATOM 527 CB GLU A 33 11.413 -7.098 -5.145 1.00 0.00 C ATOM 528 CG GLU A 33 12.047 -6.846 -6.503 1.00 0.00 C ATOM 529 CD GLU A 33 13.562 -6.884 -6.455 1.00 0.00 C ATOM 530 OE1 GLU A 33 14.165 -5.917 -5.945 1.00 0.00 O ATOM 531 OE2 GLU A 33 14.146 -7.882 -6.928 1.00 0.00 O ATOM 0 H GLU A 33 11.283 -4.757 -3.820 1.00 0.00 H new ATOM 0 HA GLU A 33 9.555 -6.203 -5.746 1.00 0.00 H new ATOM 0 HB2 GLU A 33 12.160 -6.932 -4.368 1.00 0.00 H new ATOM 0 HB3 GLU A 33 11.114 -8.144 -5.081 1.00 0.00 H new ATOM 0 HG2 GLU A 33 11.691 -7.594 -7.211 1.00 0.00 H new ATOM 0 HG3 GLU A 33 11.723 -5.875 -6.876 1.00 0.00 H new ATOM 538 N PRO A 34 8.104 -6.438 -3.603 1.00 0.00 N ATOM 539 CA PRO A 34 7.234 -6.908 -2.520 1.00 0.00 C ATOM 540 C PRO A 34 7.352 -8.407 -2.280 1.00 0.00 C ATOM 541 O PRO A 34 6.990 -9.215 -3.137 1.00 0.00 O ATOM 542 CB PRO A 34 5.833 -6.554 -3.019 1.00 0.00 C ATOM 543 CG PRO A 34 6.037 -5.378 -3.907 1.00 0.00 C ATOM 544 CD PRO A 34 7.383 -5.569 -4.552 1.00 0.00 C ATOM 0 HA PRO A 34 7.493 -6.452 -1.564 1.00 0.00 H new ATOM 0 HB2 PRO A 34 5.383 -7.386 -3.560 1.00 0.00 H new ATOM 0 HB3 PRO A 34 5.166 -6.314 -2.191 1.00 0.00 H new ATOM 0 HG2 PRO A 34 5.250 -5.316 -4.659 1.00 0.00 H new ATOM 0 HG3 PRO A 34 6.007 -4.449 -3.337 1.00 0.00 H new ATOM 0 HD2 PRO A 34 7.294 -6.034 -5.534 1.00 0.00 H new ATOM 0 HD3 PRO A 34 7.897 -4.619 -4.695 1.00 0.00 H new ATOM 552 N VAL A 35 7.855 -8.774 -1.107 1.00 0.00 N ATOM 553 CA VAL A 35 8.015 -10.176 -0.747 1.00 0.00 C ATOM 554 C VAL A 35 7.156 -10.526 0.462 1.00 0.00 C ATOM 555 O VAL A 35 7.290 -9.923 1.526 1.00 0.00 O ATOM 556 CB VAL A 35 9.485 -10.516 -0.437 1.00 0.00 C ATOM 557 CG1 VAL A 35 9.646 -12.003 -0.160 1.00 0.00 C ATOM 558 CG2 VAL A 35 10.384 -10.079 -1.583 1.00 0.00 C ATOM 0 H VAL A 35 8.159 -8.118 -0.388 1.00 0.00 H new ATOM 0 HA VAL A 35 7.692 -10.765 -1.606 1.00 0.00 H new ATOM 0 HB VAL A 35 9.783 -9.972 0.459 1.00 0.00 H new ATOM 0 HG11 VAL A 35 10.692 -12.222 0.057 1.00 0.00 H new ATOM 0 HG12 VAL A 35 9.032 -12.282 0.696 1.00 0.00 H new ATOM 0 HG13 VAL A 35 9.330 -12.572 -1.034 1.00 0.00 H new ATOM 0 HG21 VAL A 35 11.419 -10.326 -1.348 1.00 0.00 H new ATOM 0 HG22 VAL A 35 10.086 -10.594 -2.496 1.00 0.00 H new ATOM 0 HG23 VAL A 35 10.292 -9.003 -1.727 1.00 0.00 H new ATOM 568 N SER A 36 6.271 -11.499 0.288 1.00 0.00 N ATOM 569 CA SER A 36 5.386 -11.924 1.364 1.00 0.00 C ATOM 570 C SER A 36 6.054 -12.975 2.243 1.00 0.00 C ATOM 571 O SER A 36 6.430 -14.048 1.768 1.00 0.00 O ATOM 572 CB SER A 36 4.078 -12.472 0.791 1.00 0.00 C ATOM 573 OG SER A 36 4.223 -13.822 0.387 1.00 0.00 O ATOM 0 H SER A 36 6.147 -12.008 -0.587 1.00 0.00 H new ATOM 0 HA SER A 36 5.166 -11.053 1.982 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.290 -12.396 1.540 1.00 0.00 H new ATOM 0 HB3 SER A 36 3.768 -11.866 -0.060 1.00 0.00 H new ATOM 0 HG SER A 36 5.159 -14.095 0.489 1.00 0.00 H new ATOM 579 N THR A 37 6.200 -12.661 3.527 1.00 0.00 N ATOM 580 CA THR A 37 6.824 -13.580 4.472 1.00 0.00 C ATOM 581 C THR A 37 5.786 -14.520 5.074 1.00 0.00 C ATOM 582 O THR A 37 4.601 -14.189 5.148 1.00 0.00 O ATOM 583 CB THR A 37 7.542 -12.809 5.584 1.00 0.00 C ATOM 584 OG1 THR A 37 6.629 -12.420 6.596 1.00 0.00 O ATOM 585 CG2 THR A 37 8.244 -11.560 5.095 1.00 0.00 C ATOM 0 H THR A 37 5.895 -11.778 3.936 1.00 0.00 H new ATOM 0 HA THR A 37 7.559 -14.174 3.929 1.00 0.00 H new ATOM 0 HB THR A 37 8.292 -13.498 5.971 1.00 0.00 H new ATOM 0 HG1 THR A 37 7.124 -12.074 7.368 1.00 0.00 H new ATOM 0 HG21 THR A 37 8.731 -11.064 5.935 1.00 0.00 H new ATOM 0 HG22 THR A 37 8.992 -11.831 4.350 1.00 0.00 H new ATOM 0 HG23 THR A 37 7.515 -10.884 4.648 1.00 0.00 H new ATOM 593 N LYS A 38 6.241 -15.696 5.502 1.00 0.00 N ATOM 594 CA LYS A 38 5.359 -16.698 6.096 1.00 0.00 C ATOM 595 C LYS A 38 4.530 -16.115 7.238 1.00 0.00 C ATOM 596 O LYS A 38 3.471 -16.644 7.578 1.00 0.00 O ATOM 597 CB LYS A 38 6.177 -17.886 6.604 1.00 0.00 C ATOM 598 CG LYS A 38 6.645 -18.820 5.500 1.00 0.00 C ATOM 599 CD LYS A 38 5.641 -19.935 5.253 1.00 0.00 C ATOM 600 CE LYS A 38 6.306 -21.157 4.641 1.00 0.00 C ATOM 601 NZ LYS A 38 5.370 -22.312 4.549 1.00 0.00 N ATOM 0 H LYS A 38 7.220 -15.979 5.448 1.00 0.00 H new ATOM 0 HA LYS A 38 4.672 -17.033 5.319 1.00 0.00 H new ATOM 0 HB2 LYS A 38 7.046 -17.513 7.145 1.00 0.00 H new ATOM 0 HB3 LYS A 38 5.577 -18.452 7.317 1.00 0.00 H new ATOM 0 HG2 LYS A 38 6.795 -18.253 4.581 1.00 0.00 H new ATOM 0 HG3 LYS A 38 7.609 -19.250 5.770 1.00 0.00 H new ATOM 0 HD2 LYS A 38 5.164 -20.212 6.193 1.00 0.00 H new ATOM 0 HD3 LYS A 38 4.854 -19.577 4.589 1.00 0.00 H new ATOM 0 HE2 LYS A 38 6.675 -20.909 3.646 1.00 0.00 H new ATOM 0 HE3 LYS A 38 7.171 -21.438 5.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 5.862 -23.125 4.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 5.037 -22.566 5.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 4.556 -22.053 3.955 1.00 0.00 H new ATOM 615 N CYS A 39 5.013 -15.027 7.833 1.00 0.00 N ATOM 616 CA CYS A 39 4.307 -14.387 8.938 1.00 0.00 C ATOM 617 C CYS A 39 3.348 -13.308 8.437 1.00 0.00 C ATOM 618 O CYS A 39 2.983 -12.398 9.182 1.00 0.00 O ATOM 619 CB CYS A 39 5.306 -13.779 9.923 1.00 0.00 C ATOM 620 SG CYS A 39 5.827 -14.905 11.237 1.00 0.00 S ATOM 0 H CYS A 39 5.887 -14.572 7.569 1.00 0.00 H new ATOM 0 HA CYS A 39 3.720 -15.153 9.446 1.00 0.00 H new ATOM 0 HB2 CYS A 39 6.187 -13.448 9.373 1.00 0.00 H new ATOM 0 HB3 CYS A 39 4.861 -12.892 10.375 1.00 0.00 H new ATOM 625 N ASP A 40 2.937 -13.415 7.175 1.00 0.00 N ATOM 626 CA ASP A 40 2.016 -12.450 6.585 1.00 0.00 C ATOM 627 C ASP A 40 2.565 -11.028 6.683 1.00 0.00 C ATOM 628 O ASP A 40 1.973 -10.166 7.333 1.00 0.00 O ATOM 629 CB ASP A 40 0.651 -12.534 7.271 1.00 0.00 C ATOM 630 CG ASP A 40 -0.299 -13.474 6.555 1.00 0.00 C ATOM 631 OD1 ASP A 40 -0.658 -13.185 5.395 1.00 0.00 O ATOM 632 OD2 ASP A 40 -0.683 -14.500 7.155 1.00 0.00 O ATOM 0 H ASP A 40 3.228 -14.161 6.543 1.00 0.00 H new ATOM 0 HA ASP A 40 1.902 -12.697 5.529 1.00 0.00 H new ATOM 0 HB2 ASP A 40 0.784 -12.870 8.299 1.00 0.00 H new ATOM 0 HB3 ASP A 40 0.208 -11.539 7.316 1.00 0.00 H new ATOM 637 N HIS A 41 3.699 -10.790 6.031 1.00 0.00 N ATOM 638 CA HIS A 41 4.324 -9.470 6.042 1.00 0.00 C ATOM 639 C HIS A 41 4.891 -9.125 4.669 1.00 0.00 C ATOM 640 O HIS A 41 4.724 -9.878 3.713 1.00 0.00 O ATOM 641 CB HIS A 41 5.434 -9.413 7.090 1.00 0.00 C ATOM 642 CG HIS A 41 4.964 -9.714 8.479 1.00 0.00 C ATOM 643 ND1 HIS A 41 4.060 -8.939 9.169 1.00 0.00 N ATOM 644 CD2 HIS A 41 5.298 -10.730 9.311 1.00 0.00 C ATOM 645 CE1 HIS A 41 3.878 -9.495 10.374 1.00 0.00 C ATOM 646 NE2 HIS A 41 4.607 -10.587 10.511 1.00 0.00 N ATOM 0 H HIS A 41 4.204 -11.492 5.489 1.00 0.00 H new ATOM 0 HA HIS A 41 3.557 -8.738 6.296 1.00 0.00 H new ATOM 0 HB2 HIS A 41 6.215 -10.123 6.818 1.00 0.00 H new ATOM 0 HB3 HIS A 41 5.885 -8.421 7.075 1.00 0.00 H new ATOM 0 HD2 HIS A 41 5.991 -11.525 9.080 1.00 0.00 H new ATOM 0 HE1 HIS A 41 3.220 -9.101 11.135 1.00 0.00 H new ATOM 0 HE2 HIS A 41 4.654 -11.198 11.326 1.00 0.00 H new ATOM 654 N ILE A 42 5.562 -7.981 4.581 1.00 0.00 N ATOM 655 CA ILE A 42 6.154 -7.536 3.326 1.00 0.00 C ATOM 656 C ILE A 42 7.591 -7.065 3.528 1.00 0.00 C ATOM 657 O ILE A 42 7.913 -6.438 4.537 1.00 0.00 O ATOM 658 CB ILE A 42 5.335 -6.395 2.696 1.00 0.00 C ATOM 659 CG1 ILE A 42 3.856 -6.781 2.633 1.00 0.00 C ATOM 660 CG2 ILE A 42 5.864 -6.060 1.309 1.00 0.00 C ATOM 661 CD1 ILE A 42 3.567 -7.920 1.678 1.00 0.00 C ATOM 0 H ILE A 42 5.709 -7.345 5.365 1.00 0.00 H new ATOM 0 HA ILE A 42 6.150 -8.393 2.653 1.00 0.00 H new ATOM 0 HB ILE A 42 5.435 -5.507 3.320 1.00 0.00 H new ATOM 0 HG12 ILE A 42 3.519 -7.061 3.631 1.00 0.00 H new ATOM 0 HG13 ILE A 42 3.274 -5.910 2.333 1.00 0.00 H new ATOM 0 HG21 ILE A 42 5.273 -5.251 0.880 1.00 0.00 H new ATOM 0 HG22 ILE A 42 6.906 -5.748 1.382 1.00 0.00 H new ATOM 0 HG23 ILE A 42 5.793 -6.940 0.670 1.00 0.00 H new ATOM 0 HD11 ILE A 42 2.499 -8.139 1.685 1.00 0.00 H new ATOM 0 HD12 ILE A 42 3.872 -7.637 0.671 1.00 0.00 H new ATOM 0 HD13 ILE A 42 4.121 -8.805 1.989 1.00 0.00 H new ATOM 673 N PHE A 43 8.451 -7.374 2.562 1.00 0.00 N ATOM 674 CA PHE A 43 9.855 -6.984 2.632 1.00 0.00 C ATOM 675 C PHE A 43 10.394 -6.644 1.246 1.00 0.00 C ATOM 676 O PHE A 43 9.659 -6.678 0.259 1.00 0.00 O ATOM 677 CB PHE A 43 10.687 -8.108 3.253 1.00 0.00 C ATOM 678 CG PHE A 43 10.579 -8.180 4.750 1.00 0.00 C ATOM 679 CD1 PHE A 43 9.431 -8.669 5.353 1.00 0.00 C ATOM 680 CD2 PHE A 43 11.627 -7.760 5.554 1.00 0.00 C ATOM 681 CE1 PHE A 43 9.330 -8.738 6.729 1.00 0.00 C ATOM 682 CE2 PHE A 43 11.531 -7.826 6.931 1.00 0.00 C ATOM 683 CZ PHE A 43 10.381 -8.316 7.519 1.00 0.00 C ATOM 0 H PHE A 43 8.200 -7.894 1.721 1.00 0.00 H new ATOM 0 HA PHE A 43 9.929 -6.096 3.260 1.00 0.00 H new ATOM 0 HB2 PHE A 43 10.370 -9.060 2.828 1.00 0.00 H new ATOM 0 HB3 PHE A 43 11.733 -7.969 2.979 1.00 0.00 H new ATOM 0 HD1 PHE A 43 8.606 -9.000 4.740 1.00 0.00 H new ATOM 0 HD2 PHE A 43 12.529 -7.377 5.099 1.00 0.00 H new ATOM 0 HE1 PHE A 43 8.430 -9.122 7.186 1.00 0.00 H new ATOM 0 HE2 PHE A 43 12.354 -7.495 7.547 1.00 0.00 H new ATOM 0 HZ PHE A 43 10.304 -8.369 8.595 1.00 0.00 H new ATOM 693 N CYS A 44 11.682 -6.316 1.178 1.00 0.00 N ATOM 694 CA CYS A 44 12.316 -5.970 -0.089 1.00 0.00 C ATOM 695 C CYS A 44 13.094 -7.156 -0.653 1.00 0.00 C ATOM 696 O CYS A 44 14.048 -6.978 -1.410 1.00 0.00 O ATOM 697 CB CYS A 44 13.255 -4.774 0.089 1.00 0.00 C ATOM 698 SG CYS A 44 12.605 -3.470 1.160 1.00 0.00 S ATOM 0 H CYS A 44 12.305 -6.283 1.985 1.00 0.00 H new ATOM 0 HA CYS A 44 11.528 -5.703 -0.794 1.00 0.00 H new ATOM 0 HB2 CYS A 44 14.201 -5.128 0.500 1.00 0.00 H new ATOM 0 HB3 CYS A 44 13.472 -4.349 -0.891 1.00 0.00 H new ATOM 703 N LYS A 45 12.682 -8.365 -0.279 1.00 0.00 N ATOM 704 CA LYS A 45 13.342 -9.581 -0.748 1.00 0.00 C ATOM 705 C LYS A 45 14.739 -9.709 -0.149 1.00 0.00 C ATOM 706 O LYS A 45 15.004 -10.611 0.645 1.00 0.00 O ATOM 707 CB LYS A 45 13.426 -9.591 -2.277 1.00 0.00 C ATOM 708 CG LYS A 45 13.761 -10.956 -2.858 1.00 0.00 C ATOM 709 CD LYS A 45 12.674 -11.446 -3.802 1.00 0.00 C ATOM 710 CE LYS A 45 12.436 -12.939 -3.649 1.00 0.00 C ATOM 711 NZ LYS A 45 12.151 -13.594 -4.955 1.00 0.00 N ATOM 0 H LYS A 45 11.894 -8.529 0.348 1.00 0.00 H new ATOM 0 HA LYS A 45 12.746 -10.433 -0.421 1.00 0.00 H new ATOM 0 HB2 LYS A 45 12.474 -9.254 -2.687 1.00 0.00 H new ATOM 0 HB3 LYS A 45 14.182 -8.874 -2.596 1.00 0.00 H new ATOM 0 HG2 LYS A 45 14.710 -10.902 -3.392 1.00 0.00 H new ATOM 0 HG3 LYS A 45 13.891 -11.674 -2.049 1.00 0.00 H new ATOM 0 HD2 LYS A 45 11.748 -10.907 -3.604 1.00 0.00 H new ATOM 0 HD3 LYS A 45 12.957 -11.225 -4.831 1.00 0.00 H new ATOM 0 HE2 LYS A 45 13.312 -13.401 -3.195 1.00 0.00 H new ATOM 0 HE3 LYS A 45 11.600 -13.105 -2.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 11.139 -13.826 -5.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 12.404 -12.948 -5.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 12.711 -14.467 -5.035 1.00 0.00 H new ATOM 725 N PHE A 46 15.629 -8.801 -0.536 1.00 0.00 N ATOM 726 CA PHE A 46 17.000 -8.811 -0.037 1.00 0.00 C ATOM 727 C PHE A 46 17.031 -8.706 1.485 1.00 0.00 C ATOM 728 O PHE A 46 17.947 -9.210 2.133 1.00 0.00 O ATOM 729 CB PHE A 46 17.798 -7.661 -0.655 1.00 0.00 C ATOM 730 CG PHE A 46 19.244 -7.992 -0.890 1.00 0.00 C ATOM 731 CD1 PHE A 46 19.602 -9.049 -1.710 1.00 0.00 C ATOM 732 CD2 PHE A 46 20.246 -7.244 -0.291 1.00 0.00 C ATOM 733 CE1 PHE A 46 20.932 -9.356 -1.929 1.00 0.00 C ATOM 734 CE2 PHE A 46 21.577 -7.547 -0.506 1.00 0.00 C ATOM 735 CZ PHE A 46 21.921 -8.604 -1.326 1.00 0.00 C ATOM 0 H PHE A 46 15.426 -8.049 -1.194 1.00 0.00 H new ATOM 0 HA PHE A 46 17.456 -9.758 -0.325 1.00 0.00 H new ATOM 0 HB2 PHE A 46 17.339 -7.380 -1.603 1.00 0.00 H new ATOM 0 HB3 PHE A 46 17.734 -6.792 0.000 1.00 0.00 H new ATOM 0 HD1 PHE A 46 18.833 -9.641 -2.184 1.00 0.00 H new ATOM 0 HD2 PHE A 46 19.983 -6.416 0.350 1.00 0.00 H new ATOM 0 HE1 PHE A 46 21.197 -10.183 -2.571 1.00 0.00 H new ATOM 0 HE2 PHE A 46 22.348 -6.957 -0.033 1.00 0.00 H new ATOM 0 HZ PHE A 46 22.961 -8.842 -1.495 1.00 0.00 H new ATOM 745 N CYS A 47 16.022 -8.048 2.049 1.00 0.00 N ATOM 746 CA CYS A 47 15.934 -7.878 3.495 1.00 0.00 C ATOM 747 C CYS A 47 15.923 -9.229 4.203 1.00 0.00 C ATOM 748 O CYS A 47 16.598 -9.417 5.216 1.00 0.00 O ATOM 749 CB CYS A 47 14.676 -7.088 3.861 1.00 0.00 C ATOM 750 SG CYS A 47 14.606 -5.434 3.135 1.00 0.00 S ATOM 0 H CYS A 47 15.255 -7.624 1.527 1.00 0.00 H new ATOM 0 HA CYS A 47 16.813 -7.323 3.824 1.00 0.00 H new ATOM 0 HB2 CYS A 47 13.800 -7.651 3.540 1.00 0.00 H new ATOM 0 HB3 CYS A 47 14.618 -7.000 4.946 1.00 0.00 H new ATOM 755 N MET A 48 15.153 -10.167 3.664 1.00 0.00 N ATOM 756 CA MET A 48 15.054 -11.502 4.243 1.00 0.00 C ATOM 757 C MET A 48 16.398 -12.221 4.184 1.00 0.00 C ATOM 758 O MET A 48 16.731 -13.010 5.067 1.00 0.00 O ATOM 759 CB MET A 48 13.991 -12.321 3.509 1.00 0.00 C ATOM 760 CG MET A 48 12.567 -11.912 3.849 1.00 0.00 C ATOM 761 SD MET A 48 11.876 -12.867 5.214 1.00 0.00 S ATOM 762 CE MET A 48 11.052 -11.579 6.145 1.00 0.00 C ATOM 0 H MET A 48 14.588 -10.028 2.826 1.00 0.00 H new ATOM 0 HA MET A 48 14.764 -11.398 5.288 1.00 0.00 H new ATOM 0 HB2 MET A 48 14.143 -12.219 2.435 1.00 0.00 H new ATOM 0 HB3 MET A 48 14.125 -13.375 3.751 1.00 0.00 H new ATOM 0 HG2 MET A 48 12.549 -10.853 4.106 1.00 0.00 H new ATOM 0 HG3 MET A 48 11.937 -12.037 2.968 1.00 0.00 H new ATOM 0 HE1 MET A 48 10.177 -11.994 6.645 1.00 0.00 H new ATOM 0 HE2 MET A 48 11.737 -11.173 6.890 1.00 0.00 H new ATOM 0 HE3 MET A 48 10.740 -10.784 5.468 1.00 0.00 H new ATOM 772 N LEU A 49 17.168 -11.939 3.137 1.00 0.00 N ATOM 773 CA LEU A 49 18.477 -12.558 2.964 1.00 0.00 C ATOM 774 C LEU A 49 19.428 -12.136 4.079 1.00 0.00 C ATOM 775 O LEU A 49 20.108 -12.969 4.677 1.00 0.00 O ATOM 776 CB LEU A 49 19.067 -12.180 1.603 1.00 0.00 C ATOM 777 CG LEU A 49 18.518 -12.973 0.417 1.00 0.00 C ATOM 778 CD1 LEU A 49 17.036 -12.687 0.224 1.00 0.00 C ATOM 779 CD2 LEU A 49 19.295 -12.644 -0.849 1.00 0.00 C ATOM 0 H LEU A 49 16.908 -11.287 2.397 1.00 0.00 H new ATOM 0 HA LEU A 49 18.350 -13.640 3.009 1.00 0.00 H new ATOM 0 HB2 LEU A 49 18.885 -11.120 1.427 1.00 0.00 H new ATOM 0 HB3 LEU A 49 20.148 -12.316 1.642 1.00 0.00 H new ATOM 0 HG LEU A 49 18.638 -14.036 0.628 1.00 0.00 H new ATOM 0 HD11 LEU A 49 16.662 -13.260 -0.625 1.00 0.00 H new ATOM 0 HD12 LEU A 49 16.490 -12.973 1.123 1.00 0.00 H new ATOM 0 HD13 LEU A 49 16.892 -11.623 0.035 1.00 0.00 H new ATOM 0 HD21 LEU A 49 18.891 -13.217 -1.683 1.00 0.00 H new ATOM 0 HD22 LEU A 49 19.206 -11.579 -1.064 1.00 0.00 H new ATOM 0 HD23 LEU A 49 20.345 -12.900 -0.708 1.00 0.00 H new ATOM 791 N LYS A 50 19.469 -10.836 4.352 1.00 0.00 N ATOM 792 CA LYS A 50 20.337 -10.302 5.397 1.00 0.00 C ATOM 793 C LYS A 50 19.830 -10.701 6.779 1.00 0.00 C ATOM 794 O LYS A 50 20.617 -10.935 7.695 1.00 0.00 O ATOM 795 CB LYS A 50 20.419 -8.778 5.290 1.00 0.00 C ATOM 796 CG LYS A 50 21.270 -8.295 4.128 1.00 0.00 C ATOM 797 CD LYS A 50 20.831 -6.921 3.648 1.00 0.00 C ATOM 798 CE LYS A 50 21.952 -6.202 2.915 1.00 0.00 C ATOM 799 NZ LYS A 50 21.823 -4.722 3.017 1.00 0.00 N ATOM 0 H LYS A 50 18.912 -10.133 3.865 1.00 0.00 H new ATOM 0 HA LYS A 50 21.333 -10.722 5.260 1.00 0.00 H new ATOM 0 HB2 LYS A 50 19.412 -8.375 5.184 1.00 0.00 H new ATOM 0 HB3 LYS A 50 20.826 -8.378 6.219 1.00 0.00 H new ATOM 0 HG2 LYS A 50 22.316 -8.258 4.433 1.00 0.00 H new ATOM 0 HG3 LYS A 50 21.203 -9.007 3.306 1.00 0.00 H new ATOM 0 HD2 LYS A 50 19.970 -7.023 2.987 1.00 0.00 H new ATOM 0 HD3 LYS A 50 20.510 -6.322 4.500 1.00 0.00 H new ATOM 0 HE2 LYS A 50 22.912 -6.512 3.327 1.00 0.00 H new ATOM 0 HE3 LYS A 50 21.946 -6.495 1.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 22.606 -4.269 2.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 20.918 -4.423 2.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 21.854 -4.439 4.017 1.00 0.00 H new ATOM 813 N LEU A 51 18.510 -10.775 6.921 1.00 0.00 N ATOM 814 CA LEU A 51 17.898 -11.146 8.192 1.00 0.00 C ATOM 815 C LEU A 51 18.283 -12.569 8.586 1.00 0.00 C ATOM 816 O LEU A 51 18.389 -12.888 9.771 1.00 0.00 O ATOM 817 CB LEU A 51 16.376 -11.024 8.102 1.00 0.00 C ATOM 818 CG LEU A 51 15.665 -10.783 9.435 1.00 0.00 C ATOM 819 CD1 LEU A 51 15.896 -9.357 9.911 1.00 0.00 C ATOM 820 CD2 LEU A 51 14.177 -11.068 9.303 1.00 0.00 C ATOM 0 H LEU A 51 17.844 -10.583 6.172 1.00 0.00 H new ATOM 0 HA LEU A 51 18.266 -10.464 8.958 1.00 0.00 H new ATOM 0 HB2 LEU A 51 16.132 -10.206 7.425 1.00 0.00 H new ATOM 0 HB3 LEU A 51 15.980 -11.936 7.656 1.00 0.00 H new ATOM 0 HG LEU A 51 16.081 -11.465 10.177 1.00 0.00 H new ATOM 0 HD11 LEU A 51 15.383 -9.203 10.860 1.00 0.00 H new ATOM 0 HD12 LEU A 51 16.964 -9.186 10.044 1.00 0.00 H new ATOM 0 HD13 LEU A 51 15.506 -8.659 9.171 1.00 0.00 H new ATOM 0 HD21 LEU A 51 13.686 -10.892 10.260 1.00 0.00 H new ATOM 0 HD22 LEU A 51 13.746 -10.411 8.548 1.00 0.00 H new ATOM 0 HD23 LEU A 51 14.030 -12.106 9.006 1.00 0.00 H new ATOM 832 N LEU A 52 18.493 -13.418 7.586 1.00 0.00 N ATOM 833 CA LEU A 52 18.868 -14.807 7.827 1.00 0.00 C ATOM 834 C LEU A 52 20.351 -14.919 8.163 1.00 0.00 C ATOM 835 O LEU A 52 20.763 -15.806 8.911 1.00 0.00 O ATOM 836 CB LEU A 52 18.544 -15.663 6.601 1.00 0.00 C ATOM 837 CG LEU A 52 17.055 -15.779 6.267 1.00 0.00 C ATOM 838 CD1 LEU A 52 16.839 -15.737 4.762 1.00 0.00 C ATOM 839 CD2 LEU A 52 16.475 -17.056 6.855 1.00 0.00 C ATOM 0 H LEU A 52 18.410 -13.169 6.600 1.00 0.00 H new ATOM 0 HA LEU A 52 18.293 -15.171 8.678 1.00 0.00 H new ATOM 0 HB2 LEU A 52 19.063 -15.246 5.738 1.00 0.00 H new ATOM 0 HB3 LEU A 52 18.944 -16.664 6.760 1.00 0.00 H new ATOM 0 HG LEU A 52 16.536 -14.929 6.711 1.00 0.00 H new ATOM 0 HD11 LEU A 52 15.774 -15.821 4.545 1.00 0.00 H new ATOM 0 HD12 LEU A 52 17.217 -14.794 4.366 1.00 0.00 H new ATOM 0 HD13 LEU A 52 17.371 -16.566 4.295 1.00 0.00 H new ATOM 0 HD21 LEU A 52 15.415 -17.122 6.608 1.00 0.00 H new ATOM 0 HD22 LEU A 52 16.999 -17.918 6.441 1.00 0.00 H new ATOM 0 HD23 LEU A 52 16.595 -17.045 7.938 1.00 0.00 H new ATOM 851 N ASN A 53 21.151 -14.016 7.604 1.00 0.00 N ATOM 852 CA ASN A 53 22.589 -14.015 7.844 1.00 0.00 C ATOM 853 C ASN A 53 22.945 -13.158 9.056 1.00 0.00 C ATOM 854 O ASN A 53 24.008 -13.327 9.655 1.00 0.00 O ATOM 855 CB ASN A 53 23.331 -13.502 6.609 1.00 0.00 C ATOM 856 CG ASN A 53 23.704 -14.619 5.653 1.00 0.00 C ATOM 857 OD1 ASN A 53 23.050 -15.661 5.612 1.00 0.00 O ATOM 858 ND2 ASN A 53 24.761 -14.407 4.878 1.00 0.00 N ATOM 0 H ASN A 53 20.827 -13.276 6.982 1.00 0.00 H new ATOM 0 HA ASN A 53 22.896 -15.041 8.048 1.00 0.00 H new ATOM 0 HB2 ASN A 53 22.706 -12.776 6.089 1.00 0.00 H new ATOM 0 HB3 ASN A 53 24.234 -12.979 6.922 1.00 0.00 H new ATOM 0 HD21 ASN A 53 25.060 -15.123 4.216 1.00 0.00 H new ATOM 0 HD22 ASN A 53 25.274 -13.528 4.945 1.00 0.00 H new ATOM 865 N GLN A 54 22.054 -12.236 9.414 1.00 0.00 N ATOM 866 CA GLN A 54 22.280 -11.354 10.555 1.00 0.00 C ATOM 867 C GLN A 54 22.592 -12.154 11.816 1.00 0.00 C ATOM 868 O GLN A 54 23.712 -12.112 12.328 1.00 0.00 O ATOM 869 CB GLN A 54 21.055 -10.469 10.790 1.00 0.00 C ATOM 870 CG GLN A 54 21.400 -9.060 11.244 1.00 0.00 C ATOM 871 CD GLN A 54 20.456 -8.017 10.679 1.00 0.00 C ATOM 872 OE1 GLN A 54 19.260 -8.026 10.966 1.00 0.00 O ATOM 873 NE2 GLN A 54 20.991 -7.111 9.868 1.00 0.00 N ATOM 0 H GLN A 54 21.169 -12.081 8.930 1.00 0.00 H new ATOM 0 HA GLN A 54 23.140 -10.724 10.328 1.00 0.00 H new ATOM 0 HB2 GLN A 54 20.475 -10.413 9.869 1.00 0.00 H new ATOM 0 HB3 GLN A 54 20.417 -10.937 11.540 1.00 0.00 H new ATOM 0 HG2 GLN A 54 21.374 -9.017 12.333 1.00 0.00 H new ATOM 0 HG3 GLN A 54 22.420 -8.824 10.940 1.00 0.00 H new ATOM 0 HE21 GLN A 54 21.989 -7.141 9.657 1.00 0.00 H new ATOM 0 HE22 GLN A 54 20.404 -6.385 9.456 1.00 0.00 H new ATOM 882 N LYS A 55 21.597 -12.882 12.312 1.00 0.00 N ATOM 883 CA LYS A 55 21.769 -13.691 13.514 1.00 0.00 C ATOM 884 C LYS A 55 22.032 -15.152 13.160 1.00 0.00 C ATOM 885 O LYS A 55 21.765 -16.050 13.958 1.00 0.00 O ATOM 886 CB LYS A 55 20.531 -13.585 14.406 1.00 0.00 C ATOM 887 CG LYS A 55 20.529 -12.358 15.302 1.00 0.00 C ATOM 888 CD LYS A 55 19.465 -12.459 16.382 1.00 0.00 C ATOM 889 CE LYS A 55 18.121 -11.946 15.890 1.00 0.00 C ATOM 890 NZ LYS A 55 17.267 -11.462 17.009 1.00 0.00 N ATOM 0 H LYS A 55 20.665 -12.929 11.901 1.00 0.00 H new ATOM 0 HA LYS A 55 22.634 -13.309 14.056 1.00 0.00 H new ATOM 0 HB2 LYS A 55 19.641 -13.566 13.777 1.00 0.00 H new ATOM 0 HB3 LYS A 55 20.464 -14.478 15.027 1.00 0.00 H new ATOM 0 HG2 LYS A 55 21.509 -12.243 15.765 1.00 0.00 H new ATOM 0 HG3 LYS A 55 20.354 -11.467 14.700 1.00 0.00 H new ATOM 0 HD2 LYS A 55 19.365 -13.497 16.700 1.00 0.00 H new ATOM 0 HD3 LYS A 55 19.776 -11.887 17.256 1.00 0.00 H new ATOM 0 HE2 LYS A 55 18.280 -11.136 15.178 1.00 0.00 H new ATOM 0 HE3 LYS A 55 17.602 -12.742 15.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 16.464 -10.925 16.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 16.912 -12.275 17.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 17.828 -10.848 17.633 1.00 0.00 H new ATOM 904 N LYS A 56 22.557 -15.383 11.960 1.00 0.00 N ATOM 905 CA LYS A 56 22.855 -16.737 11.504 1.00 0.00 C ATOM 906 C LYS A 56 21.591 -17.590 11.467 1.00 0.00 C ATOM 907 O LYS A 56 20.616 -17.305 12.160 1.00 0.00 O ATOM 908 CB LYS A 56 23.896 -17.386 12.417 1.00 0.00 C ATOM 909 CG LYS A 56 25.322 -16.951 12.121 1.00 0.00 C ATOM 910 CD LYS A 56 26.329 -17.992 12.582 1.00 0.00 C ATOM 911 CE LYS A 56 26.235 -19.264 11.754 1.00 0.00 C ATOM 912 NZ LYS A 56 26.220 -18.976 10.294 1.00 0.00 N ATOM 0 H LYS A 56 22.785 -14.651 11.287 1.00 0.00 H new ATOM 0 HA LYS A 56 23.257 -16.673 10.493 1.00 0.00 H new ATOM 0 HB2 LYS A 56 23.659 -17.144 13.453 1.00 0.00 H new ATOM 0 HB3 LYS A 56 23.828 -18.469 12.319 1.00 0.00 H new ATOM 0 HG2 LYS A 56 25.437 -16.781 11.050 1.00 0.00 H new ATOM 0 HG3 LYS A 56 25.525 -16.002 12.618 1.00 0.00 H new ATOM 0 HD2 LYS A 56 27.336 -17.583 12.509 1.00 0.00 H new ATOM 0 HD3 LYS A 56 26.156 -18.227 13.632 1.00 0.00 H new ATOM 0 HE2 LYS A 56 27.080 -19.912 11.987 1.00 0.00 H new ATOM 0 HE3 LYS A 56 25.331 -19.808 12.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 26.427 -19.848 9.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 25.282 -18.620 10.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 26.940 -18.259 10.074 1.00 0.00 H new ATOM 926 N GLY A 57 21.617 -18.640 10.651 1.00 0.00 N ATOM 927 CA GLY A 57 20.469 -19.521 10.538 1.00 0.00 C ATOM 928 C GLY A 57 19.205 -18.783 10.132 1.00 0.00 C ATOM 929 O GLY A 57 19.277 -17.708 9.535 1.00 0.00 O ATOM 0 H GLY A 57 22.413 -18.896 10.066 1.00 0.00 H new ATOM 0 HA2 GLY A 57 20.683 -20.298 9.805 1.00 0.00 H new ATOM 0 HA3 GLY A 57 20.303 -20.020 11.493 1.00 0.00 H new ATOM 933 N PRO A 58 18.024 -19.340 10.447 1.00 0.00 N ATOM 934 CA PRO A 58 16.740 -18.716 10.105 1.00 0.00 C ATOM 935 C PRO A 58 16.661 -17.264 10.566 1.00 0.00 C ATOM 936 O PRO A 58 17.302 -16.876 11.542 1.00 0.00 O ATOM 937 CB PRO A 58 15.718 -19.571 10.857 1.00 0.00 C ATOM 938 CG PRO A 58 16.375 -20.899 11.010 1.00 0.00 C ATOM 939 CD PRO A 58 17.845 -20.618 11.159 1.00 0.00 C ATOM 0 HA PRO A 58 16.577 -18.682 9.028 1.00 0.00 H new ATOM 0 HB2 PRO A 58 15.474 -19.136 11.826 1.00 0.00 H new ATOM 0 HB3 PRO A 58 14.784 -19.653 10.301 1.00 0.00 H new ATOM 0 HG2 PRO A 58 15.988 -21.428 11.881 1.00 0.00 H new ATOM 0 HG3 PRO A 58 16.184 -21.531 10.143 1.00 0.00 H new ATOM 0 HD2 PRO A 58 18.134 -20.538 12.207 1.00 0.00 H new ATOM 0 HD3 PRO A 58 18.452 -21.410 10.721 1.00 0.00 H new ATOM 947 N SER A 59 15.869 -16.466 9.856 1.00 0.00 N ATOM 948 CA SER A 59 15.704 -15.057 10.192 1.00 0.00 C ATOM 949 C SER A 59 14.704 -14.884 11.331 1.00 0.00 C ATOM 950 O SER A 59 14.084 -15.849 11.778 1.00 0.00 O ATOM 951 CB SER A 59 15.242 -14.269 8.964 1.00 0.00 C ATOM 952 OG SER A 59 14.673 -15.127 7.990 1.00 0.00 O ATOM 0 H SER A 59 15.332 -16.772 9.045 1.00 0.00 H new ATOM 0 HA SER A 59 16.669 -14.670 10.519 1.00 0.00 H new ATOM 0 HB2 SER A 59 14.510 -13.519 9.264 1.00 0.00 H new ATOM 0 HB3 SER A 59 16.088 -13.734 8.532 1.00 0.00 H new ATOM 0 HG SER A 59 14.385 -14.598 7.217 1.00 0.00 H new ATOM 958 N GLN A 60 14.552 -13.648 11.796 1.00 0.00 N ATOM 959 CA GLN A 60 13.626 -13.349 12.883 1.00 0.00 C ATOM 960 C GLN A 60 12.702 -12.195 12.508 1.00 0.00 C ATOM 961 O GLN A 60 13.146 -11.059 12.346 1.00 0.00 O ATOM 962 CB GLN A 60 14.399 -13.006 14.158 1.00 0.00 C ATOM 963 CG GLN A 60 13.730 -13.506 15.427 1.00 0.00 C ATOM 964 CD GLN A 60 14.597 -13.316 16.656 1.00 0.00 C ATOM 965 OE1 GLN A 60 15.552 -14.061 16.880 1.00 0.00 O ATOM 966 NE2 GLN A 60 14.266 -12.314 17.463 1.00 0.00 N ATOM 0 H GLN A 60 15.058 -12.838 11.438 1.00 0.00 H new ATOM 0 HA GLN A 60 13.016 -14.235 13.063 1.00 0.00 H new ATOM 0 HB2 GLN A 60 15.400 -13.433 14.092 1.00 0.00 H new ATOM 0 HB3 GLN A 60 14.517 -11.924 14.221 1.00 0.00 H new ATOM 0 HG2 GLN A 60 12.786 -12.979 15.568 1.00 0.00 H new ATOM 0 HG3 GLN A 60 13.491 -14.564 15.315 1.00 0.00 H new ATOM 0 HE21 GLN A 60 13.467 -11.721 17.239 1.00 0.00 H new ATOM 0 HE22 GLN A 60 14.811 -12.137 18.307 1.00 0.00 H new ATOM 975 N CYS A 61 11.413 -12.496 12.376 1.00 0.00 N ATOM 976 CA CYS A 61 10.425 -11.483 12.021 1.00 0.00 C ATOM 977 C CYS A 61 10.404 -10.358 13.057 1.00 0.00 C ATOM 978 O CYS A 61 9.971 -10.559 14.191 1.00 0.00 O ATOM 979 CB CYS A 61 9.037 -12.115 11.912 1.00 0.00 C ATOM 980 SG CYS A 61 7.760 -10.988 11.305 1.00 0.00 S ATOM 0 H CYS A 61 11.029 -13.432 12.509 1.00 0.00 H new ATOM 0 HA CYS A 61 10.703 -11.060 11.056 1.00 0.00 H new ATOM 0 HB2 CYS A 61 9.093 -12.976 11.246 1.00 0.00 H new ATOM 0 HB3 CYS A 61 8.741 -12.488 12.892 1.00 0.00 H new ATOM 985 N PRO A 62 10.876 -9.154 12.683 1.00 0.00 N ATOM 986 CA PRO A 62 10.906 -8.004 13.592 1.00 0.00 C ATOM 987 C PRO A 62 9.518 -7.424 13.857 1.00 0.00 C ATOM 988 O PRO A 62 9.337 -6.629 14.778 1.00 0.00 O ATOM 989 CB PRO A 62 11.772 -6.988 12.844 1.00 0.00 C ATOM 990 CG PRO A 62 11.588 -7.326 11.407 1.00 0.00 C ATOM 991 CD PRO A 62 11.416 -8.819 11.350 1.00 0.00 C ATOM 0 HA PRO A 62 11.288 -8.277 14.576 1.00 0.00 H new ATOM 0 HB2 PRO A 62 11.456 -5.966 13.055 1.00 0.00 H new ATOM 0 HB3 PRO A 62 12.818 -7.065 13.139 1.00 0.00 H new ATOM 0 HG2 PRO A 62 10.717 -6.817 10.995 1.00 0.00 H new ATOM 0 HG3 PRO A 62 12.449 -7.010 10.819 1.00 0.00 H new ATOM 0 HD2 PRO A 62 10.732 -9.114 10.554 1.00 0.00 H new ATOM 0 HD3 PRO A 62 12.363 -9.325 11.161 1.00 0.00 H new ATOM 999 N LEU A 63 8.544 -7.823 13.046 1.00 0.00 N ATOM 1000 CA LEU A 63 7.177 -7.334 13.198 1.00 0.00 C ATOM 1001 C LEU A 63 6.491 -7.981 14.397 1.00 0.00 C ATOM 1002 O LEU A 63 5.659 -7.358 15.057 1.00 0.00 O ATOM 1003 CB LEU A 63 6.372 -7.605 11.926 1.00 0.00 C ATOM 1004 CG LEU A 63 6.708 -6.694 10.744 1.00 0.00 C ATOM 1005 CD1 LEU A 63 7.956 -7.187 10.028 1.00 0.00 C ATOM 1006 CD2 LEU A 63 5.535 -6.617 9.779 1.00 0.00 C ATOM 0 H LEU A 63 8.674 -8.482 12.278 1.00 0.00 H new ATOM 0 HA LEU A 63 7.222 -6.259 13.370 1.00 0.00 H new ATOM 0 HB2 LEU A 63 6.533 -8.640 11.625 1.00 0.00 H new ATOM 0 HB3 LEU A 63 5.312 -7.501 12.156 1.00 0.00 H new ATOM 0 HG LEU A 63 6.904 -5.693 11.127 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.180 -6.527 9.190 1.00 0.00 H new ATOM 0 HD12 LEU A 63 8.796 -7.190 10.722 1.00 0.00 H new ATOM 0 HD13 LEU A 63 7.788 -8.198 9.658 1.00 0.00 H new ATOM 0 HD21 LEU A 63 5.792 -5.965 8.945 1.00 0.00 H new ATOM 0 HD22 LEU A 63 5.307 -7.614 9.403 1.00 0.00 H new ATOM 0 HD23 LEU A 63 4.663 -6.217 10.297 1.00 0.00 H new ATOM 1018 N CYS A 64 6.842 -9.233 14.676 1.00 0.00 N ATOM 1019 CA CYS A 64 6.254 -9.957 15.798 1.00 0.00 C ATOM 1020 C CYS A 64 7.290 -10.842 16.488 1.00 0.00 C ATOM 1021 O CYS A 64 6.942 -11.833 17.131 1.00 0.00 O ATOM 1022 CB CYS A 64 5.073 -10.808 15.324 1.00 0.00 C ATOM 1023 SG CYS A 64 5.361 -11.674 13.763 1.00 0.00 S ATOM 0 H CYS A 64 7.529 -9.766 14.142 1.00 0.00 H new ATOM 0 HA CYS A 64 5.897 -9.222 16.519 1.00 0.00 H new ATOM 0 HB2 CYS A 64 4.836 -11.541 16.095 1.00 0.00 H new ATOM 0 HB3 CYS A 64 4.199 -10.167 15.215 1.00 0.00 H new ATOM 1028 N LYS A 65 8.562 -10.476 16.355 1.00 0.00 N ATOM 1029 CA LYS A 65 9.648 -11.235 16.970 1.00 0.00 C ATOM 1030 C LYS A 65 9.547 -12.721 16.636 1.00 0.00 C ATOM 1031 O LYS A 65 9.947 -13.574 17.429 1.00 0.00 O ATOM 1032 CB LYS A 65 9.635 -11.042 18.487 1.00 0.00 C ATOM 1033 CG LYS A 65 9.479 -9.591 18.915 1.00 0.00 C ATOM 1034 CD LYS A 65 10.805 -8.849 18.859 1.00 0.00 C ATOM 1035 CE LYS A 65 10.624 -7.365 19.135 1.00 0.00 C ATOM 1036 NZ LYS A 65 9.944 -6.670 18.008 1.00 0.00 N ATOM 0 H LYS A 65 8.867 -9.658 15.827 1.00 0.00 H new ATOM 0 HA LYS A 65 10.588 -10.859 16.566 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.820 -11.627 18.912 1.00 0.00 H new ATOM 0 HB3 LYS A 65 10.562 -11.437 18.903 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.756 -9.095 18.268 1.00 0.00 H new ATOM 0 HG3 LYS A 65 9.080 -9.550 19.929 1.00 0.00 H new ATOM 0 HD2 LYS A 65 11.493 -9.275 19.589 1.00 0.00 H new ATOM 0 HD3 LYS A 65 11.258 -8.985 17.877 1.00 0.00 H new ATOM 0 HE2 LYS A 65 10.042 -7.234 20.047 1.00 0.00 H new ATOM 0 HE3 LYS A 65 11.597 -6.907 19.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 10.005 -5.641 18.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 10.407 -6.926 17.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 8.945 -6.957 17.976 1.00 0.00 H new ATOM 1050 N ASN A 66 9.010 -13.025 15.459 1.00 0.00 N ATOM 1051 CA ASN A 66 8.859 -14.410 15.024 1.00 0.00 C ATOM 1052 C ASN A 66 10.179 -14.962 14.497 1.00 0.00 C ATOM 1053 O ASN A 66 11.231 -14.340 14.655 1.00 0.00 O ATOM 1054 CB ASN A 66 7.781 -14.512 13.943 1.00 0.00 C ATOM 1055 CG ASN A 66 6.918 -15.749 14.104 1.00 0.00 C ATOM 1056 OD1 ASN A 66 7.388 -16.874 13.934 1.00 0.00 O ATOM 1057 ND2 ASN A 66 5.648 -15.546 14.433 1.00 0.00 N ATOM 0 H ASN A 66 8.673 -12.333 14.790 1.00 0.00 H new ATOM 0 HA ASN A 66 8.557 -15.005 15.886 1.00 0.00 H new ATOM 0 HB2 ASN A 66 7.149 -13.624 13.978 1.00 0.00 H new ATOM 0 HB3 ASN A 66 8.255 -14.528 12.961 1.00 0.00 H new ATOM 0 HD21 ASN A 66 5.020 -16.340 14.555 1.00 0.00 H new ATOM 0 HD22 ASN A 66 5.301 -14.596 14.564 1.00 0.00 H new ATOM 1064 N ASP A 67 10.119 -16.132 13.871 1.00 0.00 N ATOM 1065 CA ASP A 67 11.310 -16.768 13.321 1.00 0.00 C ATOM 1066 C ASP A 67 11.082 -17.198 11.876 1.00 0.00 C ATOM 1067 O ASP A 67 10.401 -18.189 11.612 1.00 0.00 O ATOM 1068 CB ASP A 67 11.704 -17.979 14.169 1.00 0.00 C ATOM 1069 CG ASP A 67 12.424 -17.583 15.443 1.00 0.00 C ATOM 1070 OD1 ASP A 67 11.966 -16.633 16.113 1.00 0.00 O ATOM 1071 OD2 ASP A 67 13.446 -18.223 15.772 1.00 0.00 O ATOM 0 H ASP A 67 9.257 -16.660 13.732 1.00 0.00 H new ATOM 0 HA ASP A 67 12.121 -16.039 13.339 1.00 0.00 H new ATOM 0 HB2 ASP A 67 10.810 -18.548 14.422 1.00 0.00 H new ATOM 0 HB3 ASP A 67 12.345 -18.637 13.582 1.00 0.00 H new ATOM 1076 N ILE A 68 11.657 -16.446 10.943 1.00 0.00 N ATOM 1077 CA ILE A 68 11.517 -16.749 9.524 1.00 0.00 C ATOM 1078 C ILE A 68 12.611 -17.704 9.058 1.00 0.00 C ATOM 1079 O ILE A 68 13.663 -17.814 9.688 1.00 0.00 O ATOM 1080 CB ILE A 68 11.567 -15.468 8.668 1.00 0.00 C ATOM 1081 CG1 ILE A 68 10.564 -14.438 9.189 1.00 0.00 C ATOM 1082 CG2 ILE A 68 11.290 -15.792 7.207 1.00 0.00 C ATOM 1083 CD1 ILE A 68 11.006 -13.005 8.984 1.00 0.00 C ATOM 0 H ILE A 68 12.224 -15.623 11.144 1.00 0.00 H new ATOM 0 HA ILE A 68 10.544 -17.224 9.395 1.00 0.00 H new ATOM 0 HB ILE A 68 12.568 -15.042 8.742 1.00 0.00 H new ATOM 0 HG12 ILE A 68 9.607 -14.589 8.689 1.00 0.00 H new ATOM 0 HG13 ILE A 68 10.399 -14.610 10.253 1.00 0.00 H new ATOM 0 HG21 ILE A 68 11.329 -14.876 6.617 1.00 0.00 H new ATOM 0 HG22 ILE A 68 12.041 -16.492 6.841 1.00 0.00 H new ATOM 0 HG23 ILE A 68 10.301 -16.241 7.115 1.00 0.00 H new ATOM 0 HD11 ILE A 68 10.246 -12.330 9.377 1.00 0.00 H new ATOM 0 HD12 ILE A 68 11.947 -12.836 9.507 1.00 0.00 H new ATOM 0 HD13 ILE A 68 11.144 -12.815 7.919 1.00 0.00 H new ATOM 1095 N THR A 69 12.356 -18.393 7.950 1.00 0.00 N ATOM 1096 CA THR A 69 13.321 -19.339 7.400 1.00 0.00 C ATOM 1097 C THR A 69 13.475 -19.146 5.895 1.00 0.00 C ATOM 1098 O THR A 69 12.875 -18.246 5.309 1.00 0.00 O ATOM 1099 CB THR A 69 12.888 -20.774 7.701 1.00 0.00 C ATOM 1100 OG1 THR A 69 11.476 -20.870 7.762 1.00 0.00 O ATOM 1101 CG2 THR A 69 13.440 -21.304 9.006 1.00 0.00 C ATOM 0 H THR A 69 11.491 -18.314 7.416 1.00 0.00 H new ATOM 0 HA THR A 69 14.285 -19.152 7.872 1.00 0.00 H new ATOM 0 HB THR A 69 13.290 -21.374 6.884 1.00 0.00 H new ATOM 0 HG1 THR A 69 11.219 -21.796 7.954 1.00 0.00 H new ATOM 0 HG21 THR A 69 13.095 -22.326 9.159 1.00 0.00 H new ATOM 0 HG22 THR A 69 14.529 -21.290 8.973 1.00 0.00 H new ATOM 0 HG23 THR A 69 13.094 -20.678 9.828 1.00 0.00 H new ATOM 1109 N LYS A 70 14.285 -19.999 5.275 1.00 0.00 N ATOM 1110 CA LYS A 70 14.518 -19.923 3.837 1.00 0.00 C ATOM 1111 C LYS A 70 13.528 -20.802 3.077 1.00 0.00 C ATOM 1112 O LYS A 70 12.826 -21.619 3.671 1.00 0.00 O ATOM 1113 CB LYS A 70 15.952 -20.348 3.510 1.00 0.00 C ATOM 1114 CG LYS A 70 16.616 -19.481 2.451 1.00 0.00 C ATOM 1115 CD LYS A 70 17.775 -20.205 1.786 1.00 0.00 C ATOM 1116 CE LYS A 70 19.109 -19.786 2.382 1.00 0.00 C ATOM 1117 NZ LYS A 70 20.129 -20.866 2.278 1.00 0.00 N ATOM 0 H LYS A 70 14.790 -20.750 5.745 1.00 0.00 H new ATOM 0 HA LYS A 70 14.371 -18.889 3.524 1.00 0.00 H new ATOM 0 HB2 LYS A 70 16.549 -20.315 4.421 1.00 0.00 H new ATOM 0 HB3 LYS A 70 15.947 -21.383 3.169 1.00 0.00 H new ATOM 0 HG2 LYS A 70 15.881 -19.199 1.697 1.00 0.00 H new ATOM 0 HG3 LYS A 70 16.975 -18.559 2.907 1.00 0.00 H new ATOM 0 HD2 LYS A 70 17.646 -21.281 1.900 1.00 0.00 H new ATOM 0 HD3 LYS A 70 17.771 -19.995 0.716 1.00 0.00 H new ATOM 0 HE2 LYS A 70 19.471 -18.895 1.870 1.00 0.00 H new ATOM 0 HE3 LYS A 70 18.970 -19.518 3.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 21.024 -20.540 2.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 19.796 -21.709 2.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 20.281 -21.105 1.277 1.00 0.00 H new ATOM 1131 N ARG A 71 13.478 -20.624 1.761 1.00 0.00 N ATOM 1132 CA ARG A 71 12.574 -21.400 0.920 1.00 0.00 C ATOM 1133 C ARG A 71 11.121 -21.177 1.330 1.00 0.00 C ATOM 1134 O ARG A 71 10.281 -22.063 1.178 1.00 0.00 O ATOM 1135 CB ARG A 71 12.917 -22.888 1.003 1.00 0.00 C ATOM 1136 CG ARG A 71 13.989 -23.321 0.015 1.00 0.00 C ATOM 1137 CD ARG A 71 15.371 -22.872 0.459 1.00 0.00 C ATOM 1138 NE ARG A 71 16.267 -22.656 -0.674 1.00 0.00 N ATOM 1139 CZ ARG A 71 16.251 -21.564 -1.436 1.00 0.00 C ATOM 1140 NH1 ARG A 71 15.385 -20.588 -1.189 1.00 0.00 N ATOM 1141 NH2 ARG A 71 17.101 -21.448 -2.446 1.00 0.00 N ATOM 0 H ARG A 71 14.052 -19.950 1.254 1.00 0.00 H new ATOM 0 HA ARG A 71 12.697 -21.063 -0.109 1.00 0.00 H new ATOM 0 HB2 ARG A 71 13.252 -23.119 2.014 1.00 0.00 H new ATOM 0 HB3 ARG A 71 12.014 -23.471 0.825 1.00 0.00 H new ATOM 0 HG2 ARG A 71 13.974 -24.406 -0.088 1.00 0.00 H new ATOM 0 HG3 ARG A 71 13.769 -22.905 -0.968 1.00 0.00 H new ATOM 0 HD2 ARG A 71 15.285 -21.950 1.034 1.00 0.00 H new ATOM 0 HD3 ARG A 71 15.800 -23.623 1.123 1.00 0.00 H new ATOM 0 HE ARG A 71 16.945 -23.385 -0.895 1.00 0.00 H new ATOM 0 HH11 ARG A 71 14.729 -20.673 -0.413 1.00 0.00 H new ATOM 0 HH12 ARG A 71 15.376 -19.753 -1.775 1.00 0.00 H new ATOM 0 HH21 ARG A 71 17.768 -22.195 -2.640 1.00 0.00 H new ATOM 0 HH22 ARG A 71 17.089 -20.612 -3.030 1.00 0.00 H new ATOM 1155 N SER A 72 10.834 -19.989 1.852 1.00 0.00 N ATOM 1156 CA SER A 72 9.483 -19.651 2.285 1.00 0.00 C ATOM 1157 C SER A 72 8.994 -18.377 1.602 1.00 0.00 C ATOM 1158 O SER A 72 7.834 -18.286 1.198 1.00 0.00 O ATOM 1159 CB SER A 72 9.442 -19.476 3.805 1.00 0.00 C ATOM 1160 OG SER A 72 9.133 -20.699 4.451 1.00 0.00 O ATOM 0 H SER A 72 11.518 -19.245 1.985 1.00 0.00 H new ATOM 0 HA SER A 72 8.822 -20.470 2.001 1.00 0.00 H new ATOM 0 HB2 SER A 72 10.405 -19.108 4.158 1.00 0.00 H new ATOM 0 HB3 SER A 72 8.698 -18.724 4.068 1.00 0.00 H new ATOM 0 HG SER A 72 9.270 -20.603 5.417 1.00 0.00 H new ATOM 1166 N LEU A 73 9.882 -17.397 1.478 1.00 0.00 N ATOM 1167 CA LEU A 73 9.540 -16.128 0.845 1.00 0.00 C ATOM 1168 C LEU A 73 9.034 -16.344 -0.578 1.00 0.00 C ATOM 1169 O LEU A 73 9.451 -17.281 -1.259 1.00 0.00 O ATOM 1170 CB LEU A 73 10.755 -15.197 0.829 1.00 0.00 C ATOM 1171 CG LEU A 73 11.100 -14.555 2.173 1.00 0.00 C ATOM 1172 CD1 LEU A 73 9.876 -13.879 2.776 1.00 0.00 C ATOM 1173 CD2 LEU A 73 11.664 -15.595 3.130 1.00 0.00 C ATOM 0 H LEU A 73 10.845 -17.457 1.808 1.00 0.00 H new ATOM 0 HA LEU A 73 8.743 -15.666 1.428 1.00 0.00 H new ATOM 0 HB2 LEU A 73 11.620 -15.761 0.481 1.00 0.00 H new ATOM 0 HB3 LEU A 73 10.577 -14.405 0.101 1.00 0.00 H new ATOM 0 HG LEU A 73 11.861 -13.793 2.005 1.00 0.00 H new ATOM 0 HD11 LEU A 73 10.143 -13.429 3.732 1.00 0.00 H new ATOM 0 HD12 LEU A 73 9.517 -13.105 2.098 1.00 0.00 H new ATOM 0 HD13 LEU A 73 9.091 -14.619 2.930 1.00 0.00 H new ATOM 0 HD21 LEU A 73 11.904 -15.121 4.082 1.00 0.00 H new ATOM 0 HD22 LEU A 73 10.925 -16.380 3.292 1.00 0.00 H new ATOM 0 HD23 LEU A 73 12.568 -16.030 2.703 1.00 0.00 H new ATOM 1185 N GLN A 74 8.136 -15.471 -1.020 1.00 0.00 N ATOM 1186 CA GLN A 74 7.574 -15.566 -2.362 1.00 0.00 C ATOM 1187 C GLN A 74 7.207 -14.186 -2.897 1.00 0.00 C ATOM 1188 O GLN A 74 6.361 -13.494 -2.330 1.00 0.00 O ATOM 1189 CB GLN A 74 6.338 -16.469 -2.358 1.00 0.00 C ATOM 1190 CG GLN A 74 6.662 -17.943 -2.543 1.00 0.00 C ATOM 1191 CD GLN A 74 5.733 -18.625 -3.529 1.00 0.00 C ATOM 1192 OE1 GLN A 74 5.181 -19.688 -3.248 1.00 0.00 O ATOM 1193 NE2 GLN A 74 5.556 -18.014 -4.695 1.00 0.00 N ATOM 0 H GLN A 74 7.782 -14.689 -0.469 1.00 0.00 H new ATOM 0 HA GLN A 74 8.331 -16.000 -3.015 1.00 0.00 H new ATOM 0 HB2 GLN A 74 5.805 -16.338 -1.416 1.00 0.00 H new ATOM 0 HB3 GLN A 74 5.663 -16.151 -3.153 1.00 0.00 H new ATOM 0 HG2 GLN A 74 7.691 -18.044 -2.889 1.00 0.00 H new ATOM 0 HG3 GLN A 74 6.598 -18.449 -1.580 1.00 0.00 H new ATOM 0 HE21 GLN A 74 6.033 -17.133 -4.887 1.00 0.00 H new ATOM 0 HE22 GLN A 74 4.943 -18.425 -5.398 1.00 0.00 H new ATOM 1202 N GLU A 75 7.849 -13.791 -3.992 1.00 0.00 N ATOM 1203 CA GLU A 75 7.590 -12.493 -4.605 1.00 0.00 C ATOM 1204 C GLU A 75 6.123 -12.363 -5.005 1.00 0.00 C ATOM 1205 O GLU A 75 5.491 -13.340 -5.406 1.00 0.00 O ATOM 1206 CB GLU A 75 8.485 -12.296 -5.830 1.00 0.00 C ATOM 1207 CG GLU A 75 9.806 -11.612 -5.515 1.00 0.00 C ATOM 1208 CD GLU A 75 9.776 -10.125 -5.805 1.00 0.00 C ATOM 1209 OE1 GLU A 75 8.952 -9.416 -5.188 1.00 0.00 O ATOM 1210 OE2 GLU A 75 10.575 -9.668 -6.649 1.00 0.00 O ATOM 0 H GLU A 75 8.553 -14.351 -4.473 1.00 0.00 H new ATOM 0 HA GLU A 75 7.817 -11.720 -3.870 1.00 0.00 H new ATOM 0 HB2 GLU A 75 8.687 -13.267 -6.282 1.00 0.00 H new ATOM 0 HB3 GLU A 75 7.947 -11.705 -6.571 1.00 0.00 H new ATOM 0 HG2 GLU A 75 10.051 -11.769 -4.464 1.00 0.00 H new ATOM 0 HG3 GLU A 75 10.600 -12.077 -6.100 1.00 0.00 H new ATOM 1217 N SER A 76 5.589 -11.152 -4.892 1.00 0.00 N ATOM 1218 CA SER A 76 4.196 -10.897 -5.241 1.00 0.00 C ATOM 1219 C SER A 76 4.012 -9.472 -5.750 1.00 0.00 C ATOM 1220 O SER A 76 4.737 -8.560 -5.352 1.00 0.00 O ATOM 1221 CB SER A 76 3.293 -11.138 -4.030 1.00 0.00 C ATOM 1222 OG SER A 76 1.998 -10.604 -4.245 1.00 0.00 O ATOM 0 H SER A 76 6.099 -10.332 -4.562 1.00 0.00 H new ATOM 0 HA SER A 76 3.917 -11.586 -6.038 1.00 0.00 H new ATOM 0 HB2 SER A 76 3.221 -12.208 -3.834 1.00 0.00 H new ATOM 0 HB3 SER A 76 3.736 -10.681 -3.145 1.00 0.00 H new ATOM 0 HG SER A 76 1.397 -10.908 -3.533 1.00 0.00 H new ATOM 1228 N THR A 77 3.036 -9.287 -6.632 1.00 0.00 N ATOM 1229 CA THR A 77 2.750 -7.973 -7.198 1.00 0.00 C ATOM 1230 C THR A 77 1.648 -7.258 -6.412 1.00 0.00 C ATOM 1231 O THR A 77 1.277 -6.130 -6.737 1.00 0.00 O ATOM 1232 CB THR A 77 2.341 -8.111 -8.668 1.00 0.00 C ATOM 1233 OG1 THR A 77 3.425 -8.586 -9.447 1.00 0.00 O ATOM 1234 CG2 THR A 77 1.866 -6.815 -9.289 1.00 0.00 C ATOM 0 H THR A 77 2.428 -10.032 -6.971 1.00 0.00 H new ATOM 0 HA THR A 77 3.657 -7.372 -7.131 1.00 0.00 H new ATOM 0 HB THR A 77 1.511 -8.817 -8.667 1.00 0.00 H new ATOM 0 HG1 THR A 77 3.144 -8.669 -10.382 1.00 0.00 H new ATOM 0 HG21 THR A 77 1.593 -6.989 -10.330 1.00 0.00 H new ATOM 0 HG22 THR A 77 0.997 -6.447 -8.743 1.00 0.00 H new ATOM 0 HG23 THR A 77 2.665 -6.075 -9.242 1.00 0.00 H new ATOM 1242 N ARG A 78 1.126 -7.917 -5.381 1.00 0.00 N ATOM 1243 CA ARG A 78 0.067 -7.337 -4.562 1.00 0.00 C ATOM 1244 C ARG A 78 0.447 -5.941 -4.077 1.00 0.00 C ATOM 1245 O ARG A 78 -0.240 -4.963 -4.374 1.00 0.00 O ATOM 1246 CB ARG A 78 -0.231 -8.242 -3.364 1.00 0.00 C ATOM 1247 CG ARG A 78 -1.656 -8.122 -2.850 1.00 0.00 C ATOM 1248 CD ARG A 78 -1.735 -8.400 -1.357 1.00 0.00 C ATOM 1249 NE ARG A 78 -0.970 -9.585 -0.978 1.00 0.00 N ATOM 1250 CZ ARG A 78 -0.860 -10.028 0.273 1.00 0.00 C ATOM 1251 NH1 ARG A 78 -1.463 -9.387 1.266 1.00 0.00 N ATOM 1252 NH2 ARG A 78 -0.144 -11.114 0.530 1.00 0.00 N ATOM 0 H ARG A 78 1.419 -8.851 -5.094 1.00 0.00 H new ATOM 0 HA ARG A 78 -0.827 -7.252 -5.180 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -0.041 -9.278 -3.646 1.00 0.00 H new ATOM 0 HB3 ARG A 78 0.459 -8.000 -2.556 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -2.035 -7.121 -3.055 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -2.297 -8.822 -3.386 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -1.361 -7.536 -0.807 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -2.777 -8.534 -1.068 1.00 0.00 H new ATOM 0 HE ARG A 78 -0.492 -10.104 -1.715 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -2.014 -8.551 1.073 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -1.376 -9.731 2.222 1.00 0.00 H new ATOM 0 HH21 ARG A 78 0.322 -11.609 -0.230 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -0.059 -11.454 1.488 1.00 0.00 H new ATOM 1266 N PHE A 79 1.542 -5.854 -3.329 1.00 0.00 N ATOM 1267 CA PHE A 79 2.008 -4.575 -2.805 1.00 0.00 C ATOM 1268 C PHE A 79 3.114 -3.998 -3.686 1.00 0.00 C ATOM 1269 O PHE A 79 4.070 -3.401 -3.191 1.00 0.00 O ATOM 1270 CB PHE A 79 2.508 -4.741 -1.366 1.00 0.00 C ATOM 1271 CG PHE A 79 1.715 -3.954 -0.360 1.00 0.00 C ATOM 1272 CD1 PHE A 79 0.334 -3.876 -0.455 1.00 0.00 C ATOM 1273 CD2 PHE A 79 2.350 -3.290 0.678 1.00 0.00 C ATOM 1274 CE1 PHE A 79 -0.398 -3.151 0.466 1.00 0.00 C ATOM 1275 CE2 PHE A 79 1.622 -2.564 1.602 1.00 0.00 C ATOM 1276 CZ PHE A 79 0.246 -2.495 1.496 1.00 0.00 C ATOM 0 H PHE A 79 2.123 -6.652 -3.072 1.00 0.00 H new ATOM 0 HA PHE A 79 1.170 -3.878 -2.808 1.00 0.00 H new ATOM 0 HB2 PHE A 79 2.474 -5.797 -1.098 1.00 0.00 H new ATOM 0 HB3 PHE A 79 3.552 -4.433 -1.315 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -0.176 -4.388 -1.258 1.00 0.00 H new ATOM 0 HD2 PHE A 79 3.425 -3.340 0.766 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.473 -3.098 0.380 1.00 0.00 H new ATOM 0 HE2 PHE A 79 2.128 -2.051 2.406 1.00 0.00 H new ATOM 0 HZ PHE A 79 -0.325 -1.929 2.217 1.00 0.00 H new ATOM 1286 N SER A 80 2.975 -4.181 -4.996 1.00 0.00 N ATOM 1287 CA SER A 80 3.961 -3.681 -5.948 1.00 0.00 C ATOM 1288 C SER A 80 3.482 -2.389 -6.602 1.00 0.00 C ATOM 1289 O SER A 80 4.102 -1.336 -6.445 1.00 0.00 O ATOM 1290 CB SER A 80 4.244 -4.734 -7.020 1.00 0.00 C ATOM 1291 OG SER A 80 4.916 -4.164 -8.131 1.00 0.00 O ATOM 0 H SER A 80 2.189 -4.672 -5.422 1.00 0.00 H new ATOM 0 HA SER A 80 4.881 -3.470 -5.402 1.00 0.00 H new ATOM 0 HB2 SER A 80 4.850 -5.535 -6.596 1.00 0.00 H new ATOM 0 HB3 SER A 80 3.307 -5.183 -7.349 1.00 0.00 H new ATOM 0 HG SER A 80 5.087 -4.858 -8.801 1.00 0.00 H new ATOM 1297 N GLN A 81 2.379 -2.476 -7.339 1.00 0.00 N ATOM 1298 CA GLN A 81 1.819 -1.314 -8.019 1.00 0.00 C ATOM 1299 C GLN A 81 1.529 -0.188 -7.030 1.00 0.00 C ATOM 1300 O GLN A 81 1.619 0.991 -7.373 1.00 0.00 O ATOM 1301 CB GLN A 81 0.538 -1.698 -8.762 1.00 0.00 C ATOM 1302 CG GLN A 81 0.655 -2.996 -9.544 1.00 0.00 C ATOM 1303 CD GLN A 81 -0.454 -3.162 -10.565 1.00 0.00 C ATOM 1304 OE1 GLN A 81 -1.228 -2.238 -10.815 1.00 0.00 O ATOM 1305 NE2 GLN A 81 -0.537 -4.346 -11.162 1.00 0.00 N ATOM 0 H GLN A 81 1.855 -3.340 -7.480 1.00 0.00 H new ATOM 0 HA GLN A 81 2.556 -0.959 -8.739 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -0.276 -1.789 -8.043 1.00 0.00 H new ATOM 0 HB3 GLN A 81 0.270 -0.894 -9.447 1.00 0.00 H new ATOM 0 HG2 GLN A 81 1.619 -3.025 -10.052 1.00 0.00 H new ATOM 0 HG3 GLN A 81 0.635 -3.837 -8.851 1.00 0.00 H new ATOM 0 HE21 GLN A 81 0.126 -5.084 -10.925 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -1.263 -4.517 -11.858 1.00 0.00 H new ATOM 1314 N LEU A 82 1.182 -0.560 -5.802 1.00 0.00 N ATOM 1315 CA LEU A 82 0.882 0.419 -4.765 1.00 0.00 C ATOM 1316 C LEU A 82 2.113 1.259 -4.438 1.00 0.00 C ATOM 1317 O LEU A 82 2.000 2.427 -4.070 1.00 0.00 O ATOM 1318 CB LEU A 82 0.375 -0.283 -3.503 1.00 0.00 C ATOM 1319 CG LEU A 82 -1.040 -0.860 -3.608 1.00 0.00 C ATOM 1320 CD1 LEU A 82 -1.101 -2.246 -2.985 1.00 0.00 C ATOM 1321 CD2 LEU A 82 -2.047 0.069 -2.944 1.00 0.00 C ATOM 0 H LEU A 82 1.102 -1.531 -5.502 1.00 0.00 H new ATOM 0 HA LEU A 82 0.102 1.082 -5.139 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.063 -1.091 -3.253 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.402 0.426 -2.675 1.00 0.00 H new ATOM 0 HG LEU A 82 -1.297 -0.947 -4.664 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -2.114 -2.639 -3.070 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -0.410 -2.909 -3.505 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -0.822 -2.185 -1.933 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -3.046 -0.358 -3.029 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.792 0.189 -1.891 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -2.025 1.041 -3.436 1.00 0.00 H new ATOM 1333 N VAL A 83 3.289 0.653 -4.576 1.00 0.00 N ATOM 1334 CA VAL A 83 4.543 1.344 -4.297 1.00 0.00 C ATOM 1335 C VAL A 83 4.961 2.217 -5.476 1.00 0.00 C ATOM 1336 O VAL A 83 5.388 3.357 -5.296 1.00 0.00 O ATOM 1337 CB VAL A 83 5.675 0.348 -3.984 1.00 0.00 C ATOM 1338 CG1 VAL A 83 6.922 1.086 -3.520 1.00 0.00 C ATOM 1339 CG2 VAL A 83 5.226 -0.663 -2.939 1.00 0.00 C ATOM 0 H VAL A 83 3.399 -0.315 -4.879 1.00 0.00 H new ATOM 0 HA VAL A 83 4.371 1.973 -3.424 1.00 0.00 H new ATOM 0 HB VAL A 83 5.919 -0.194 -4.898 1.00 0.00 H new ATOM 0 HG11 VAL A 83 7.711 0.366 -3.303 1.00 0.00 H new ATOM 0 HG12 VAL A 83 7.256 1.765 -4.304 1.00 0.00 H new ATOM 0 HG13 VAL A 83 6.694 1.656 -2.619 1.00 0.00 H new ATOM 0 HG21 VAL A 83 6.040 -1.358 -2.732 1.00 0.00 H new ATOM 0 HG22 VAL A 83 4.952 -0.141 -2.022 1.00 0.00 H new ATOM 0 HG23 VAL A 83 4.364 -1.215 -3.314 1.00 0.00 H new ATOM 1349 N GLU A 84 4.835 1.672 -6.682 1.00 0.00 N ATOM 1350 CA GLU A 84 5.200 2.400 -7.892 1.00 0.00 C ATOM 1351 C GLU A 84 4.174 3.484 -8.205 1.00 0.00 C ATOM 1352 O GLU A 84 4.532 4.613 -8.541 1.00 0.00 O ATOM 1353 CB GLU A 84 5.322 1.438 -9.074 1.00 0.00 C ATOM 1354 CG GLU A 84 6.688 0.782 -9.188 1.00 0.00 C ATOM 1355 CD GLU A 84 7.142 0.625 -10.626 1.00 0.00 C ATOM 1356 OE1 GLU A 84 6.309 0.238 -11.472 1.00 0.00 O ATOM 1357 OE2 GLU A 84 8.330 0.889 -10.906 1.00 0.00 O ATOM 0 H GLU A 84 4.483 0.729 -6.847 1.00 0.00 H new ATOM 0 HA GLU A 84 6.165 2.878 -7.722 1.00 0.00 H new ATOM 0 HB2 GLU A 84 4.563 0.662 -8.979 1.00 0.00 H new ATOM 0 HB3 GLU A 84 5.111 1.980 -9.996 1.00 0.00 H new ATOM 0 HG2 GLU A 84 7.420 1.378 -8.643 1.00 0.00 H new ATOM 0 HG3 GLU A 84 6.657 -0.198 -8.712 1.00 0.00 H new ATOM 1364 N GLU A 85 2.897 3.132 -8.094 1.00 0.00 N ATOM 1365 CA GLU A 85 1.818 4.075 -8.365 1.00 0.00 C ATOM 1366 C GLU A 85 1.926 5.300 -7.463 1.00 0.00 C ATOM 1367 O GLU A 85 1.783 6.434 -7.919 1.00 0.00 O ATOM 1368 CB GLU A 85 0.459 3.400 -8.168 1.00 0.00 C ATOM 1369 CG GLU A 85 0.126 2.378 -9.244 1.00 0.00 C ATOM 1370 CD GLU A 85 -0.227 3.022 -10.570 1.00 0.00 C ATOM 1371 OE1 GLU A 85 0.150 4.195 -10.779 1.00 0.00 O ATOM 1372 OE2 GLU A 85 -0.878 2.354 -11.400 1.00 0.00 O ATOM 0 H GLU A 85 2.584 2.201 -7.818 1.00 0.00 H new ATOM 0 HA GLU A 85 1.907 4.400 -9.401 1.00 0.00 H new ATOM 0 HB2 GLU A 85 0.444 2.909 -7.195 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -0.318 4.164 -8.151 1.00 0.00 H new ATOM 0 HG2 GLU A 85 0.977 1.712 -9.383 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -0.709 1.763 -8.909 1.00 0.00 H new ATOM 1379 N LEU A 86 2.181 5.062 -6.180 1.00 0.00 N ATOM 1380 CA LEU A 86 2.311 6.146 -5.211 1.00 0.00 C ATOM 1381 C LEU A 86 3.407 7.119 -5.630 1.00 0.00 C ATOM 1382 O LEU A 86 3.206 8.334 -5.631 1.00 0.00 O ATOM 1383 CB LEU A 86 2.618 5.581 -3.822 1.00 0.00 C ATOM 1384 CG LEU A 86 2.596 6.605 -2.684 1.00 0.00 C ATOM 1385 CD1 LEU A 86 1.327 7.441 -2.738 1.00 0.00 C ATOM 1386 CD2 LEU A 86 2.717 5.904 -1.340 1.00 0.00 C ATOM 0 H LEU A 86 2.302 4.129 -5.787 1.00 0.00 H new ATOM 0 HA LEU A 86 1.365 6.685 -5.175 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.895 4.797 -3.598 1.00 0.00 H new ATOM 0 HB3 LEU A 86 3.601 5.111 -3.847 1.00 0.00 H new ATOM 0 HG LEU A 86 3.449 7.273 -2.805 1.00 0.00 H new ATOM 0 HD11 LEU A 86 1.331 8.162 -1.921 1.00 0.00 H new ATOM 0 HD12 LEU A 86 1.281 7.971 -3.689 1.00 0.00 H new ATOM 0 HD13 LEU A 86 0.458 6.790 -2.643 1.00 0.00 H new ATOM 0 HD21 LEU A 86 2.700 6.645 -0.540 1.00 0.00 H new ATOM 0 HD22 LEU A 86 1.883 5.214 -1.213 1.00 0.00 H new ATOM 0 HD23 LEU A 86 3.655 5.350 -1.302 1.00 0.00 H new ATOM 1398 N LEU A 87 4.567 6.577 -5.988 1.00 0.00 N ATOM 1399 CA LEU A 87 5.697 7.396 -6.412 1.00 0.00 C ATOM 1400 C LEU A 87 5.294 8.337 -7.543 1.00 0.00 C ATOM 1401 O LEU A 87 5.838 9.434 -7.675 1.00 0.00 O ATOM 1402 CB LEU A 87 6.858 6.507 -6.862 1.00 0.00 C ATOM 1403 CG LEU A 87 7.633 5.830 -5.730 1.00 0.00 C ATOM 1404 CD1 LEU A 87 8.802 5.032 -6.286 1.00 0.00 C ATOM 1405 CD2 LEU A 87 8.121 6.865 -4.727 1.00 0.00 C ATOM 0 H LEU A 87 4.749 5.573 -5.993 1.00 0.00 H new ATOM 0 HA LEU A 87 6.017 7.997 -5.561 1.00 0.00 H new ATOM 0 HB2 LEU A 87 6.468 5.736 -7.527 1.00 0.00 H new ATOM 0 HB3 LEU A 87 7.552 7.111 -7.447 1.00 0.00 H new ATOM 0 HG LEU A 87 6.962 5.142 -5.216 1.00 0.00 H new ATOM 0 HD11 LEU A 87 9.341 4.558 -5.466 1.00 0.00 H new ATOM 0 HD12 LEU A 87 8.429 4.266 -6.966 1.00 0.00 H new ATOM 0 HD13 LEU A 87 9.475 5.699 -6.825 1.00 0.00 H new ATOM 0 HD21 LEU A 87 8.670 6.367 -3.928 1.00 0.00 H new ATOM 0 HD22 LEU A 87 8.776 7.577 -5.229 1.00 0.00 H new ATOM 0 HD23 LEU A 87 7.266 7.394 -4.305 1.00 0.00 H new ATOM 1417 N LYS A 88 4.335 7.902 -8.353 1.00 0.00 N ATOM 1418 CA LYS A 88 3.855 8.705 -9.471 1.00 0.00 C ATOM 1419 C LYS A 88 2.945 9.826 -8.979 1.00 0.00 C ATOM 1420 O LYS A 88 2.895 10.905 -9.570 1.00 0.00 O ATOM 1421 CB LYS A 88 3.106 7.827 -10.474 1.00 0.00 C ATOM 1422 CG LYS A 88 4.016 7.154 -11.490 1.00 0.00 C ATOM 1423 CD LYS A 88 3.318 6.977 -12.830 1.00 0.00 C ATOM 1424 CE LYS A 88 3.916 5.824 -13.619 1.00 0.00 C ATOM 1425 NZ LYS A 88 3.843 6.059 -15.087 1.00 0.00 N ATOM 0 H LYS A 88 3.875 6.997 -8.256 1.00 0.00 H new ATOM 0 HA LYS A 88 4.719 9.150 -9.965 1.00 0.00 H new ATOM 0 HB2 LYS A 88 2.552 7.061 -9.931 1.00 0.00 H new ATOM 0 HB3 LYS A 88 2.373 8.437 -11.002 1.00 0.00 H new ATOM 0 HG2 LYS A 88 4.918 7.751 -11.624 1.00 0.00 H new ATOM 0 HG3 LYS A 88 4.331 6.182 -11.111 1.00 0.00 H new ATOM 0 HD2 LYS A 88 2.255 6.796 -12.667 1.00 0.00 H new ATOM 0 HD3 LYS A 88 3.400 7.897 -13.409 1.00 0.00 H new ATOM 0 HE2 LYS A 88 4.956 5.684 -13.325 1.00 0.00 H new ATOM 0 HE3 LYS A 88 3.388 4.903 -13.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 4.261 5.250 -15.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 2.849 6.167 -15.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 4.368 6.924 -15.327 1.00 0.00 H new ATOM 1439 N ILE A 89 2.225 9.563 -7.891 1.00 0.00 N ATOM 1440 CA ILE A 89 1.318 10.550 -7.319 1.00 0.00 C ATOM 1441 C ILE A 89 2.090 11.745 -6.768 1.00 0.00 C ATOM 1442 O ILE A 89 1.640 12.887 -6.867 1.00 0.00 O ATOM 1443 CB ILE A 89 0.461 9.939 -6.191 1.00 0.00 C ATOM 1444 CG1 ILE A 89 -0.263 8.687 -6.691 1.00 0.00 C ATOM 1445 CG2 ILE A 89 -0.539 10.959 -5.668 1.00 0.00 C ATOM 1446 CD1 ILE A 89 -0.831 7.832 -5.579 1.00 0.00 C ATOM 0 H ILE A 89 2.253 8.675 -7.390 1.00 0.00 H new ATOM 0 HA ILE A 89 0.661 10.883 -8.122 1.00 0.00 H new ATOM 0 HB ILE A 89 1.121 9.654 -5.372 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -1.072 8.987 -7.357 1.00 0.00 H new ATOM 0 HG13 ILE A 89 0.430 8.088 -7.281 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -1.135 10.510 -4.873 1.00 0.00 H new ATOM 0 HG22 ILE A 89 -0.005 11.825 -5.277 1.00 0.00 H new ATOM 0 HG23 ILE A 89 -1.195 11.274 -6.479 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -1.330 6.962 -6.007 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -0.024 7.502 -4.925 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -1.549 8.415 -5.003 1.00 0.00 H new ATOM 1458 N ILE A 90 3.256 11.475 -6.189 1.00 0.00 N ATOM 1459 CA ILE A 90 4.091 12.526 -5.625 1.00 0.00 C ATOM 1460 C ILE A 90 4.738 13.361 -6.724 1.00 0.00 C ATOM 1461 O ILE A 90 4.922 14.570 -6.575 1.00 0.00 O ATOM 1462 CB ILE A 90 5.195 11.945 -4.720 1.00 0.00 C ATOM 1463 CG1 ILE A 90 4.594 10.970 -3.703 1.00 0.00 C ATOM 1464 CG2 ILE A 90 5.944 13.063 -4.009 1.00 0.00 C ATOM 1465 CD1 ILE A 90 5.415 9.712 -3.518 1.00 0.00 C ATOM 0 H ILE A 90 3.643 10.536 -6.099 1.00 0.00 H new ATOM 0 HA ILE A 90 3.438 13.160 -5.025 1.00 0.00 H new ATOM 0 HB ILE A 90 5.903 11.400 -5.344 1.00 0.00 H new ATOM 0 HG12 ILE A 90 4.495 11.475 -2.742 1.00 0.00 H new ATOM 0 HG13 ILE A 90 3.589 10.695 -4.024 1.00 0.00 H new ATOM 0 HG21 ILE A 90 6.720 12.635 -3.374 1.00 0.00 H new ATOM 0 HG22 ILE A 90 6.402 13.721 -4.747 1.00 0.00 H new ATOM 0 HG23 ILE A 90 5.248 13.635 -3.395 1.00 0.00 H new ATOM 0 HD11 ILE A 90 4.932 9.067 -2.784 1.00 0.00 H new ATOM 0 HD12 ILE A 90 5.493 9.185 -4.469 1.00 0.00 H new ATOM 0 HD13 ILE A 90 6.412 9.977 -3.167 1.00 0.00 H new ATOM 1477 N CYS A 91 5.082 12.709 -7.830 1.00 0.00 N ATOM 1478 CA CYS A 91 5.709 13.390 -8.956 1.00 0.00 C ATOM 1479 C CYS A 91 4.791 14.472 -9.517 1.00 0.00 C ATOM 1480 O CYS A 91 5.206 15.614 -9.709 1.00 0.00 O ATOM 1481 CB CYS A 91 6.063 12.386 -10.054 1.00 0.00 C ATOM 1482 SG CYS A 91 7.481 11.333 -9.662 1.00 0.00 S ATOM 0 H CYS A 91 4.937 11.709 -7.970 1.00 0.00 H new ATOM 0 HA CYS A 91 6.623 13.864 -8.598 1.00 0.00 H new ATOM 0 HB2 CYS A 91 5.196 11.753 -10.246 1.00 0.00 H new ATOM 0 HB3 CYS A 91 6.271 12.930 -10.975 1.00 0.00 H new ATOM 0 HG CYS A 91 7.116 10.408 -8.824 1.00 0.00 H new ATOM 1488 N ALA A 92 3.541 14.102 -9.778 1.00 0.00 N ATOM 1489 CA ALA A 92 2.564 15.039 -10.317 1.00 0.00 C ATOM 1490 C ALA A 92 2.362 16.222 -9.374 1.00 0.00 C ATOM 1491 O ALA A 92 2.173 17.355 -9.816 1.00 0.00 O ATOM 1492 CB ALA A 92 1.241 14.334 -10.574 1.00 0.00 C ATOM 0 H ALA A 92 3.182 13.160 -9.625 1.00 0.00 H new ATOM 0 HA ALA A 92 2.947 15.422 -11.263 1.00 0.00 H new ATOM 0 HB1 ALA A 92 0.521 15.047 -10.976 1.00 0.00 H new ATOM 0 HB2 ALA A 92 1.392 13.527 -11.291 1.00 0.00 H new ATOM 0 HB3 ALA A 92 0.860 13.923 -9.639 1.00 0.00 H new ATOM 1498 N PHE A 93 2.405 15.950 -8.074 1.00 0.00 N ATOM 1499 CA PHE A 93 2.227 16.991 -7.068 1.00 0.00 C ATOM 1500 C PHE A 93 3.257 18.102 -7.247 1.00 0.00 C ATOM 1501 O PHE A 93 2.910 19.282 -7.293 1.00 0.00 O ATOM 1502 CB PHE A 93 2.341 16.397 -5.664 1.00 0.00 C ATOM 1503 CG PHE A 93 1.852 17.315 -4.580 1.00 0.00 C ATOM 1504 CD1 PHE A 93 0.495 17.520 -4.388 1.00 0.00 C ATOM 1505 CD2 PHE A 93 2.749 17.973 -3.754 1.00 0.00 C ATOM 1506 CE1 PHE A 93 0.042 18.365 -3.392 1.00 0.00 C ATOM 1507 CE2 PHE A 93 2.302 18.819 -2.758 1.00 0.00 C ATOM 1508 CZ PHE A 93 0.947 19.015 -2.576 1.00 0.00 C ATOM 0 H PHE A 93 2.562 15.017 -7.692 1.00 0.00 H new ATOM 0 HA PHE A 93 1.232 17.418 -7.195 1.00 0.00 H new ATOM 0 HB2 PHE A 93 1.773 15.468 -5.625 1.00 0.00 H new ATOM 0 HB3 PHE A 93 3.383 16.142 -5.470 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -0.217 17.014 -5.024 1.00 0.00 H new ATOM 0 HD2 PHE A 93 3.810 17.823 -3.891 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -1.018 18.517 -3.252 1.00 0.00 H new ATOM 0 HE2 PHE A 93 3.012 19.327 -2.122 1.00 0.00 H new ATOM 0 HZ PHE A 93 0.596 19.675 -1.797 1.00 0.00 H new ATOM 1518 N GLN A 94 4.525 17.717 -7.348 1.00 0.00 N ATOM 1519 CA GLN A 94 5.605 18.680 -7.523 1.00 0.00 C ATOM 1520 C GLN A 94 5.498 19.382 -8.874 1.00 0.00 C ATOM 1521 O GLN A 94 5.936 20.521 -9.030 1.00 0.00 O ATOM 1522 CB GLN A 94 6.962 17.984 -7.404 1.00 0.00 C ATOM 1523 CG GLN A 94 7.093 17.116 -6.163 1.00 0.00 C ATOM 1524 CD GLN A 94 7.861 15.835 -6.427 1.00 0.00 C ATOM 1525 OE1 GLN A 94 7.947 15.373 -7.564 1.00 0.00 O ATOM 1526 NE2 GLN A 94 8.423 15.254 -5.374 1.00 0.00 N ATOM 0 H GLN A 94 4.830 16.744 -7.312 1.00 0.00 H new ATOM 0 HA GLN A 94 5.518 19.430 -6.737 1.00 0.00 H new ATOM 0 HB2 GLN A 94 7.123 17.367 -8.288 1.00 0.00 H new ATOM 0 HB3 GLN A 94 7.749 18.739 -7.394 1.00 0.00 H new ATOM 0 HG2 GLN A 94 7.596 17.682 -5.379 1.00 0.00 H new ATOM 0 HG3 GLN A 94 6.099 16.869 -5.790 1.00 0.00 H new ATOM 0 HE21 GLN A 94 8.326 15.672 -4.449 1.00 0.00 H new ATOM 0 HE22 GLN A 94 8.952 14.389 -5.490 1.00 0.00 H new ATOM 1535 N LEU A 95 4.910 18.693 -9.849 1.00 0.00 N ATOM 1536 CA LEU A 95 4.746 19.251 -11.187 1.00 0.00 C ATOM 1537 C LEU A 95 3.950 20.552 -11.144 1.00 0.00 C ATOM 1538 O LEU A 95 4.260 21.503 -11.860 1.00 0.00 O ATOM 1539 CB LEU A 95 4.046 18.241 -12.099 1.00 0.00 C ATOM 1540 CG LEU A 95 4.454 18.307 -13.571 1.00 0.00 C ATOM 1541 CD1 LEU A 95 4.275 19.716 -14.113 1.00 0.00 C ATOM 1542 CD2 LEU A 95 5.894 17.846 -13.744 1.00 0.00 C ATOM 0 H LEU A 95 4.540 17.749 -9.737 1.00 0.00 H new ATOM 0 HA LEU A 95 5.737 19.468 -11.586 1.00 0.00 H new ATOM 0 HB2 LEU A 95 4.248 17.237 -11.726 1.00 0.00 H new ATOM 0 HB3 LEU A 95 2.969 18.396 -12.029 1.00 0.00 H new ATOM 0 HG LEU A 95 3.807 17.638 -14.138 1.00 0.00 H new ATOM 0 HD11 LEU A 95 4.571 19.743 -15.162 1.00 0.00 H new ATOM 0 HD12 LEU A 95 3.229 20.010 -14.023 1.00 0.00 H new ATOM 0 HD13 LEU A 95 4.897 20.407 -13.543 1.00 0.00 H new ATOM 0 HD21 LEU A 95 6.169 17.899 -14.797 1.00 0.00 H new ATOM 0 HD22 LEU A 95 6.555 18.490 -13.164 1.00 0.00 H new ATOM 0 HD23 LEU A 95 5.991 16.818 -13.395 1.00 0.00 H new ATOM 1554 N ASP A 96 2.925 20.585 -10.299 1.00 0.00 N ATOM 1555 CA ASP A 96 2.086 21.770 -10.164 1.00 0.00 C ATOM 1556 C ASP A 96 2.442 22.549 -8.902 1.00 0.00 C ATOM 1557 O ASP A 96 2.826 23.717 -8.969 1.00 0.00 O ATOM 1558 CB ASP A 96 0.609 21.374 -10.132 1.00 0.00 C ATOM 1559 CG ASP A 96 0.135 20.800 -11.454 1.00 0.00 C ATOM 1560 OD1 ASP A 96 0.978 20.262 -12.202 1.00 0.00 O ATOM 1561 OD2 ASP A 96 -1.077 20.889 -11.739 1.00 0.00 O ATOM 0 H ASP A 96 2.656 19.806 -9.698 1.00 0.00 H new ATOM 0 HA ASP A 96 2.265 22.411 -11.027 1.00 0.00 H new ATOM 0 HB2 ASP A 96 0.450 20.640 -9.342 1.00 0.00 H new ATOM 0 HB3 ASP A 96 0.007 22.247 -9.882 1.00 0.00 H new ATOM 1566 N THR A 97 2.309 21.897 -7.752 1.00 0.00 N ATOM 1567 CA THR A 97 2.617 22.529 -6.474 1.00 0.00 C ATOM 1568 C THR A 97 4.070 22.993 -6.430 1.00 0.00 C ATOM 1569 O THR A 97 4.357 24.133 -6.068 1.00 0.00 O ATOM 1570 CB THR A 97 2.344 21.561 -5.322 1.00 0.00 C ATOM 1571 OG1 THR A 97 3.374 20.593 -5.226 1.00 0.00 O ATOM 1572 CG2 THR A 97 1.031 20.822 -5.457 1.00 0.00 C ATOM 0 H THR A 97 1.990 20.931 -7.678 1.00 0.00 H new ATOM 0 HA THR A 97 1.973 23.402 -6.366 1.00 0.00 H new ATOM 0 HB THR A 97 2.301 22.183 -4.428 1.00 0.00 H new ATOM 0 HG1 THR A 97 3.511 20.173 -6.101 1.00 0.00 H new ATOM 0 HG21 THR A 97 0.901 20.153 -4.607 1.00 0.00 H new ATOM 0 HG22 THR A 97 0.211 21.539 -5.483 1.00 0.00 H new ATOM 0 HG23 THR A 97 1.034 20.241 -6.379 1.00 0.00 H new ATOM 1580 N GLY A 98 4.982 22.101 -6.803 1.00 0.00 N ATOM 1581 CA GLY A 98 6.393 22.437 -6.799 1.00 0.00 C ATOM 1582 C GLY A 98 6.994 22.405 -5.408 1.00 0.00 C ATOM 1583 O GLY A 98 7.957 23.118 -5.124 1.00 0.00 O ATOM 0 H GLY A 98 4.769 21.151 -7.108 1.00 0.00 H new ATOM 0 HA2 GLY A 98 6.931 21.739 -7.440 1.00 0.00 H new ATOM 0 HA3 GLY A 98 6.528 23.431 -7.227 1.00 0.00 H new ATOM 1587 N LEU A 99 6.426 21.576 -4.539 1.00 0.00 N ATOM 1588 CA LEU A 99 6.912 21.453 -3.169 1.00 0.00 C ATOM 1589 C LEU A 99 7.687 20.154 -2.982 1.00 0.00 C ATOM 1590 O LEU A 99 7.490 19.189 -3.719 1.00 0.00 O ATOM 1591 CB LEU A 99 5.743 21.511 -2.183 1.00 0.00 C ATOM 1592 CG LEU A 99 4.654 22.526 -2.528 1.00 0.00 C ATOM 1593 CD1 LEU A 99 3.585 22.550 -1.446 1.00 0.00 C ATOM 1594 CD2 LEU A 99 5.256 23.911 -2.715 1.00 0.00 C ATOM 0 H LEU A 99 5.629 20.979 -4.759 1.00 0.00 H new ATOM 0 HA LEU A 99 7.585 22.288 -2.972 1.00 0.00 H new ATOM 0 HB2 LEU A 99 5.290 20.522 -2.122 1.00 0.00 H new ATOM 0 HB3 LEU A 99 6.134 21.744 -1.193 1.00 0.00 H new ATOM 0 HG LEU A 99 4.187 22.225 -3.466 1.00 0.00 H new ATOM 0 HD11 LEU A 99 2.818 23.278 -1.709 1.00 0.00 H new ATOM 0 HD12 LEU A 99 3.133 21.562 -1.359 1.00 0.00 H new ATOM 0 HD13 LEU A 99 4.037 22.827 -0.494 1.00 0.00 H new ATOM 0 HD21 LEU A 99 4.466 24.621 -2.960 1.00 0.00 H new ATOM 0 HD22 LEU A 99 5.749 24.221 -1.794 1.00 0.00 H new ATOM 0 HD23 LEU A 99 5.985 23.885 -3.525 1.00 0.00 H new ATOM 1606 N GLU A 100 8.571 20.137 -1.989 1.00 0.00 N ATOM 1607 CA GLU A 100 9.377 18.955 -1.704 1.00 0.00 C ATOM 1608 C GLU A 100 8.495 17.781 -1.292 1.00 0.00 C ATOM 1609 O GLU A 100 7.268 17.868 -1.337 1.00 0.00 O ATOM 1610 CB GLU A 100 10.391 19.258 -0.600 1.00 0.00 C ATOM 1611 CG GLU A 100 11.252 20.478 -0.882 1.00 0.00 C ATOM 1612 CD GLU A 100 11.758 21.141 0.384 1.00 0.00 C ATOM 1613 OE1 GLU A 100 12.591 20.529 1.083 1.00 0.00 O ATOM 1614 OE2 GLU A 100 11.321 22.274 0.675 1.00 0.00 O ATOM 0 H GLU A 100 8.747 20.927 -1.369 1.00 0.00 H new ATOM 0 HA GLU A 100 9.911 18.682 -2.614 1.00 0.00 H new ATOM 0 HB2 GLU A 100 9.859 19.409 0.339 1.00 0.00 H new ATOM 0 HB3 GLU A 100 11.038 18.391 -0.464 1.00 0.00 H new ATOM 0 HG2 GLU A 100 12.102 20.184 -1.498 1.00 0.00 H new ATOM 0 HG3 GLU A 100 10.675 21.200 -1.460 1.00 0.00 H new ATOM 1621 N TYR A 101 9.129 16.685 -0.890 1.00 0.00 N ATOM 1622 CA TYR A 101 8.402 15.492 -0.469 1.00 0.00 C ATOM 1623 C TYR A 101 8.940 14.967 0.857 1.00 0.00 C ATOM 1624 O TYR A 101 8.254 15.012 1.879 1.00 0.00 O ATOM 1625 CB TYR A 101 8.501 14.404 -1.541 1.00 0.00 C ATOM 1626 CG TYR A 101 7.738 13.145 -1.198 1.00 0.00 C ATOM 1627 CD1 TYR A 101 6.463 13.210 -0.652 1.00 0.00 C ATOM 1628 CD2 TYR A 101 8.293 11.891 -1.422 1.00 0.00 C ATOM 1629 CE1 TYR A 101 5.761 12.061 -0.338 1.00 0.00 C ATOM 1630 CE2 TYR A 101 7.599 10.738 -1.110 1.00 0.00 C ATOM 1631 CZ TYR A 101 6.334 10.827 -0.569 1.00 0.00 C ATOM 1632 OH TYR A 101 5.639 9.681 -0.257 1.00 0.00 O ATOM 0 H TYR A 101 10.144 16.597 -0.847 1.00 0.00 H new ATOM 0 HA TYR A 101 7.355 15.764 -0.333 1.00 0.00 H new ATOM 0 HB2 TYR A 101 8.126 14.800 -2.485 1.00 0.00 H new ATOM 0 HB3 TYR A 101 9.550 14.152 -1.695 1.00 0.00 H new ATOM 0 HD1 TYR A 101 6.012 14.174 -0.470 1.00 0.00 H new ATOM 0 HD2 TYR A 101 9.283 11.817 -1.847 1.00 0.00 H new ATOM 0 HE1 TYR A 101 4.770 12.129 0.086 1.00 0.00 H new ATOM 0 HE2 TYR A 101 8.045 9.771 -1.289 1.00 0.00 H new ATOM 0 HH TYR A 101 4.765 9.920 0.116 1.00 0.00 H new ATOM 1642 N ALA A 102 10.172 14.468 0.835 1.00 0.00 N ATOM 1643 CA ALA A 102 10.802 13.933 2.035 1.00 0.00 C ATOM 1644 C ALA A 102 12.244 14.414 2.159 1.00 0.00 C ATOM 1645 O ALA A 102 13.103 13.703 2.680 1.00 0.00 O ATOM 1646 CB ALA A 102 10.750 12.413 2.026 1.00 0.00 C ATOM 0 H ALA A 102 10.753 14.423 -0.002 1.00 0.00 H new ATOM 0 HA ALA A 102 10.249 14.299 2.900 1.00 0.00 H new ATOM 0 HB1 ALA A 102 11.224 12.027 2.928 1.00 0.00 H new ATOM 0 HB2 ALA A 102 9.711 12.085 1.993 1.00 0.00 H new ATOM 0 HB3 ALA A 102 11.277 12.036 1.150 1.00 0.00 H new ATOM 1652 N ASN A 103 12.502 15.624 1.675 1.00 0.00 N ATOM 1653 CA ASN A 103 13.841 16.200 1.731 1.00 0.00 C ATOM 1654 C ASN A 103 14.836 15.338 0.961 1.00 0.00 C ATOM 1655 O ASN A 103 14.428 14.271 0.456 1.00 0.00 O ATOM 1656 CB ASN A 103 14.294 16.348 3.185 1.00 0.00 C ATOM 1657 CG ASN A 103 13.841 17.657 3.801 1.00 0.00 C ATOM 1658 OD1 ASN A 103 14.646 18.412 4.347 1.00 0.00 O ATOM 1659 ND2 ASN A 103 12.545 17.933 3.716 1.00 0.00 N ATOM 0 H ASN A 103 11.802 16.225 1.240 1.00 0.00 H new ATOM 0 HA ASN A 103 13.806 17.185 1.266 1.00 0.00 H new ATOM 0 HB2 ASN A 103 13.900 15.518 3.772 1.00 0.00 H new ATOM 0 HB3 ASN A 103 15.381 16.284 3.232 1.00 0.00 H new ATOM 0 HD21 ASN A 103 12.181 18.800 4.112 1.00 0.00 H new ATOM 0 HD22 ASN A 103 11.913 17.278 3.254 1.00 0.00 H new TER 1666 ASN A 103 ATOM 1667 N MET B 26 -21.667 23.123 -20.333 1.00 0.00 N ATOM 1668 CA MET B 26 -22.019 24.566 -20.390 1.00 0.00 C ATOM 1669 C MET B 26 -21.785 25.245 -19.045 1.00 0.00 C ATOM 1670 O MET B 26 -22.568 26.096 -18.623 1.00 0.00 O ATOM 1671 CB MET B 26 -23.489 24.693 -20.796 1.00 0.00 C ATOM 1672 CG MET B 26 -23.717 24.587 -22.296 1.00 0.00 C ATOM 1673 SD MET B 26 -23.811 26.199 -23.098 1.00 0.00 S ATOM 1674 CE MET B 26 -25.580 26.366 -23.317 1.00 0.00 C ATOM 0 HA MET B 26 -21.381 25.061 -21.123 1.00 0.00 H new ATOM 0 HB2 MET B 26 -24.065 23.916 -20.293 1.00 0.00 H new ATOM 0 HB3 MET B 26 -23.873 25.651 -20.445 1.00 0.00 H new ATOM 0 HG2 MET B 26 -22.908 24.009 -22.743 1.00 0.00 H new ATOM 0 HG3 MET B 26 -24.640 24.038 -22.482 1.00 0.00 H new ATOM 0 HE1 MET B 26 -25.798 27.317 -23.803 1.00 0.00 H new ATOM 0 HE2 MET B 26 -25.949 25.549 -23.937 1.00 0.00 H new ATOM 0 HE3 MET B 26 -26.072 26.334 -22.345 1.00 0.00 H new ATOM 1686 N GLU B 27 -20.702 24.863 -18.375 1.00 0.00 N ATOM 1687 CA GLU B 27 -20.364 25.434 -17.077 1.00 0.00 C ATOM 1688 C GLU B 27 -18.855 25.419 -16.852 1.00 0.00 C ATOM 1689 O GLU B 27 -18.319 24.492 -16.243 1.00 0.00 O ATOM 1690 CB GLU B 27 -21.067 24.664 -15.959 1.00 0.00 C ATOM 1691 CG GLU B 27 -20.942 25.322 -14.594 1.00 0.00 C ATOM 1692 CD GLU B 27 -22.085 24.961 -13.666 1.00 0.00 C ATOM 1693 OE1 GLU B 27 -23.253 25.181 -14.049 1.00 0.00 O ATOM 1694 OE2 GLU B 27 -21.812 24.458 -12.556 1.00 0.00 O ATOM 0 H GLU B 27 -20.043 24.160 -18.710 1.00 0.00 H new ATOM 0 HA GLU B 27 -20.704 26.470 -17.064 1.00 0.00 H new ATOM 0 HB2 GLU B 27 -22.123 24.562 -16.208 1.00 0.00 H new ATOM 0 HB3 GLU B 27 -20.653 23.657 -15.907 1.00 0.00 H new ATOM 0 HG2 GLU B 27 -19.999 25.024 -14.136 1.00 0.00 H new ATOM 0 HG3 GLU B 27 -20.908 26.404 -14.718 1.00 0.00 H new ATOM 1701 N PRO B 28 -18.145 26.450 -17.341 1.00 0.00 N ATOM 1702 CA PRO B 28 -16.690 26.550 -17.189 1.00 0.00 C ATOM 1703 C PRO B 28 -16.246 26.390 -15.739 1.00 0.00 C ATOM 1704 O PRO B 28 -17.068 26.170 -14.849 1.00 0.00 O ATOM 1705 CB PRO B 28 -16.375 27.961 -17.692 1.00 0.00 C ATOM 1706 CG PRO B 28 -17.486 28.286 -18.628 1.00 0.00 C ATOM 1707 CD PRO B 28 -18.705 27.598 -18.080 1.00 0.00 C ATOM 0 HA PRO B 28 -16.169 25.763 -17.734 1.00 0.00 H new ATOM 0 HB2 PRO B 28 -16.330 28.674 -16.869 1.00 0.00 H new ATOM 0 HB3 PRO B 28 -15.409 27.995 -18.197 1.00 0.00 H new ATOM 0 HG2 PRO B 28 -17.641 29.363 -18.690 1.00 0.00 H new ATOM 0 HG3 PRO B 28 -17.261 27.937 -19.636 1.00 0.00 H new ATOM 0 HD2 PRO B 28 -19.278 28.256 -17.427 1.00 0.00 H new ATOM 0 HD3 PRO B 28 -19.376 27.275 -18.876 1.00 0.00 H new ATOM 1715 N ASP B 29 -14.942 26.503 -15.509 1.00 0.00 N ATOM 1716 CA ASP B 29 -14.390 26.371 -14.166 1.00 0.00 C ATOM 1717 C ASP B 29 -13.345 27.450 -13.898 1.00 0.00 C ATOM 1718 O ASP B 29 -12.822 28.064 -14.827 1.00 0.00 O ATOM 1719 CB ASP B 29 -13.768 24.986 -13.982 1.00 0.00 C ATOM 1720 CG ASP B 29 -12.805 24.631 -15.098 1.00 0.00 C ATOM 1721 OD1 ASP B 29 -13.257 24.509 -16.255 1.00 0.00 O ATOM 1722 OD2 ASP B 29 -11.599 24.475 -14.814 1.00 0.00 O ATOM 0 H ASP B 29 -14.249 26.685 -16.234 1.00 0.00 H new ATOM 0 HA ASP B 29 -15.204 26.494 -13.452 1.00 0.00 H new ATOM 0 HB2 ASP B 29 -13.243 24.951 -13.028 1.00 0.00 H new ATOM 0 HB3 ASP B 29 -14.560 24.238 -13.938 1.00 0.00 H new ATOM 1727 N GLY B 30 -13.047 27.674 -12.622 1.00 0.00 N ATOM 1728 CA GLY B 30 -12.066 28.679 -12.256 1.00 0.00 C ATOM 1729 C GLY B 30 -10.642 28.203 -12.468 1.00 0.00 C ATOM 1730 O GLY B 30 -9.932 28.714 -13.335 1.00 0.00 O ATOM 0 H GLY B 30 -13.467 27.178 -11.836 1.00 0.00 H new ATOM 0 HA2 GLY B 30 -12.236 29.580 -12.845 1.00 0.00 H new ATOM 0 HA3 GLY B 30 -12.203 28.952 -11.210 1.00 0.00 H new ATOM 1734 N ARG B 31 -10.224 27.224 -11.674 1.00 0.00 N ATOM 1735 CA ARG B 31 -8.874 26.680 -11.777 1.00 0.00 C ATOM 1736 C ARG B 31 -8.901 25.155 -11.769 1.00 0.00 C ATOM 1737 O ARG B 31 -9.369 24.538 -10.811 1.00 0.00 O ATOM 1738 CB ARG B 31 -8.005 27.194 -10.628 1.00 0.00 C ATOM 1739 CG ARG B 31 -7.323 28.518 -10.927 1.00 0.00 C ATOM 1740 CD ARG B 31 -8.288 29.684 -10.793 1.00 0.00 C ATOM 1741 NE ARG B 31 -7.605 30.922 -10.424 1.00 0.00 N ATOM 1742 CZ ARG B 31 -7.175 31.194 -9.194 1.00 0.00 C ATOM 1743 NH1 ARG B 31 -7.358 30.320 -8.212 1.00 0.00 N ATOM 1744 NH2 ARG B 31 -6.563 32.343 -8.944 1.00 0.00 N ATOM 0 H ARG B 31 -10.800 26.791 -10.952 1.00 0.00 H new ATOM 0 HA ARG B 31 -8.446 27.013 -12.722 1.00 0.00 H new ATOM 0 HB2 ARG B 31 -8.624 27.306 -9.738 1.00 0.00 H new ATOM 0 HB3 ARG B 31 -7.245 26.448 -10.396 1.00 0.00 H new ATOM 0 HG2 ARG B 31 -6.484 28.658 -10.245 1.00 0.00 H new ATOM 0 HG3 ARG B 31 -6.913 28.498 -11.937 1.00 0.00 H new ATOM 0 HD2 ARG B 31 -8.815 29.828 -11.736 1.00 0.00 H new ATOM 0 HD3 ARG B 31 -9.040 29.447 -10.041 1.00 0.00 H new ATOM 0 HE ARG B 31 -7.448 31.619 -11.152 1.00 0.00 H new ATOM 0 HH11 ARG B 31 -7.830 29.435 -8.398 1.00 0.00 H new ATOM 0 HH12 ARG B 31 -7.027 30.533 -7.271 1.00 0.00 H new ATOM 0 HH21 ARG B 31 -6.421 33.019 -9.694 1.00 0.00 H new ATOM 0 HH22 ARG B 31 -6.234 32.551 -8.001 1.00 0.00 H new ATOM 1758 N GLY B 32 -8.397 24.553 -12.840 1.00 0.00 N ATOM 1759 CA GLY B 32 -8.372 23.106 -12.935 1.00 0.00 C ATOM 1760 C GLY B 32 -7.137 22.502 -12.294 1.00 0.00 C ATOM 1761 O GLY B 32 -6.245 22.013 -12.988 1.00 0.00 O ATOM 0 H GLY B 32 -8.005 25.042 -13.645 1.00 0.00 H new ATOM 0 HA2 GLY B 32 -9.262 22.698 -12.456 1.00 0.00 H new ATOM 0 HA3 GLY B 32 -8.413 22.813 -13.984 1.00 0.00 H new ATOM 1765 N ALA B 33 -7.085 22.537 -10.967 1.00 0.00 N ATOM 1766 CA ALA B 33 -5.951 21.992 -10.232 1.00 0.00 C ATOM 1767 C ALA B 33 -6.270 20.606 -9.681 1.00 0.00 C ATOM 1768 O ALA B 33 -7.424 20.176 -9.685 1.00 0.00 O ATOM 1769 CB ALA B 33 -5.549 22.932 -9.105 1.00 0.00 C ATOM 0 H ALA B 33 -7.816 22.937 -10.379 1.00 0.00 H new ATOM 0 HA ALA B 33 -5.114 21.896 -10.924 1.00 0.00 H new ATOM 0 HB1 ALA B 33 -4.701 22.511 -8.565 1.00 0.00 H new ATOM 0 HB2 ALA B 33 -5.270 23.900 -9.521 1.00 0.00 H new ATOM 0 HB3 ALA B 33 -6.388 23.059 -8.420 1.00 0.00 H new ATOM 1775 N TRP B 34 -5.241 19.912 -9.206 1.00 0.00 N ATOM 1776 CA TRP B 34 -5.412 18.574 -8.650 1.00 0.00 C ATOM 1777 C TRP B 34 -5.972 17.617 -9.697 1.00 0.00 C ATOM 1778 O TRP B 34 -6.789 16.749 -9.387 1.00 0.00 O ATOM 1779 CB TRP B 34 -6.340 18.620 -7.435 1.00 0.00 C ATOM 1780 CG TRP B 34 -5.944 19.651 -6.423 1.00 0.00 C ATOM 1781 CD1 TRP B 34 -6.743 20.616 -5.881 1.00 0.00 C ATOM 1782 CD2 TRP B 34 -4.651 19.823 -5.833 1.00 0.00 C ATOM 1783 NE1 TRP B 34 -6.026 21.378 -4.990 1.00 0.00 N ATOM 1784 CE2 TRP B 34 -4.738 20.910 -4.943 1.00 0.00 C ATOM 1785 CE3 TRP B 34 -3.426 19.162 -5.970 1.00 0.00 C ATOM 1786 CZ2 TRP B 34 -3.650 21.350 -4.194 1.00 0.00 C ATOM 1787 CZ3 TRP B 34 -2.346 19.600 -5.227 1.00 0.00 C ATOM 1788 CH2 TRP B 34 -2.464 20.685 -4.348 1.00 0.00 C ATOM 0 H TRP B 34 -4.280 20.254 -9.195 1.00 0.00 H new ATOM 0 HA TRP B 34 -4.434 18.209 -8.338 1.00 0.00 H new ATOM 0 HB2 TRP B 34 -7.357 18.823 -7.771 1.00 0.00 H new ATOM 0 HB3 TRP B 34 -6.352 17.640 -6.959 1.00 0.00 H new ATOM 0 HD1 TRP B 34 -7.787 20.760 -6.118 1.00 0.00 H new ATOM 0 HE1 TRP B 34 -6.392 22.163 -4.452 1.00 0.00 H new ATOM 0 HE3 TRP B 34 -3.326 18.324 -6.644 1.00 0.00 H new ATOM 0 HZ2 TRP B 34 -3.739 22.186 -3.516 1.00 0.00 H new ATOM 0 HZ3 TRP B 34 -1.395 19.098 -5.326 1.00 0.00 H new ATOM 0 HH2 TRP B 34 -1.602 21.003 -3.781 1.00 0.00 H new ATOM 1799 N ALA B 35 -5.528 17.780 -10.939 1.00 0.00 N ATOM 1800 CA ALA B 35 -5.985 16.931 -12.032 1.00 0.00 C ATOM 1801 C ALA B 35 -5.081 15.713 -12.195 1.00 0.00 C ATOM 1802 O ALA B 35 -5.553 14.577 -12.229 1.00 0.00 O ATOM 1803 CB ALA B 35 -6.043 17.724 -13.329 1.00 0.00 C ATOM 0 H ALA B 35 -4.852 18.493 -11.213 1.00 0.00 H new ATOM 0 HA ALA B 35 -6.988 16.578 -11.790 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -6.386 17.077 -14.136 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -6.735 18.559 -13.215 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -5.050 18.106 -13.567 1.00 0.00 H new ATOM 1809 N HIS B 36 -3.779 15.959 -12.296 1.00 0.00 N ATOM 1810 CA HIS B 36 -2.807 14.883 -12.455 1.00 0.00 C ATOM 1811 C HIS B 36 -2.865 13.919 -11.275 1.00 0.00 C ATOM 1812 O HIS B 36 -2.609 12.723 -11.424 1.00 0.00 O ATOM 1813 CB HIS B 36 -1.396 15.458 -12.592 1.00 0.00 C ATOM 1814 CG HIS B 36 -1.084 16.527 -11.592 1.00 0.00 C ATOM 1815 ND1 HIS B 36 -1.915 16.776 -10.527 1.00 0.00 N ATOM 1816 CD2 HIS B 36 -0.031 17.379 -11.541 1.00 0.00 C ATOM 1817 CE1 HIS B 36 -1.354 17.765 -9.854 1.00 0.00 C ATOM 1818 NE2 HIS B 36 -0.210 18.164 -10.431 1.00 0.00 N ATOM 0 H HIS B 36 -3.372 16.894 -12.271 1.00 0.00 H new ATOM 0 HA HIS B 36 -3.056 14.333 -13.362 1.00 0.00 H new ATOM 0 HB2 HIS B 36 -0.672 14.650 -12.486 1.00 0.00 H new ATOM 0 HB3 HIS B 36 -1.275 15.865 -13.596 1.00 0.00 H new ATOM 0 HD2 HIS B 36 0.791 17.430 -12.240 1.00 0.00 H new ATOM 0 HE1 HIS B 36 -1.764 18.198 -8.953 1.00 0.00 H new ATOM 0 HE2 HIS B 36 0.408 18.908 -10.106 1.00 0.00 H new ATOM 1826 N SER B 37 -3.201 14.446 -10.103 1.00 0.00 N ATOM 1827 CA SER B 37 -3.292 13.631 -8.897 1.00 0.00 C ATOM 1828 C SER B 37 -4.561 12.785 -8.906 1.00 0.00 C ATOM 1829 O SER B 37 -4.587 11.680 -8.364 1.00 0.00 O ATOM 1830 CB SER B 37 -3.268 14.519 -7.653 1.00 0.00 C ATOM 1831 OG SER B 37 -1.993 15.115 -7.475 1.00 0.00 O ATOM 0 H SER B 37 -3.415 15.433 -9.962 1.00 0.00 H new ATOM 0 HA SER B 37 -2.431 12.963 -8.875 1.00 0.00 H new ATOM 0 HB2 SER B 37 -4.027 15.296 -7.743 1.00 0.00 H new ATOM 0 HB3 SER B 37 -3.521 13.926 -6.774 1.00 0.00 H new ATOM 0 HG SER B 37 -2.005 15.679 -6.674 1.00 0.00 H new ATOM 1837 N ARG B 38 -5.612 13.311 -9.526 1.00 0.00 N ATOM 1838 CA ARG B 38 -6.886 12.604 -9.607 1.00 0.00 C ATOM 1839 C ARG B 38 -6.724 11.273 -10.333 1.00 0.00 C ATOM 1840 O ARG B 38 -7.199 10.238 -9.866 1.00 0.00 O ATOM 1841 CB ARG B 38 -7.927 13.466 -10.324 1.00 0.00 C ATOM 1842 CG ARG B 38 -9.358 13.009 -10.093 1.00 0.00 C ATOM 1843 CD ARG B 38 -10.292 13.538 -11.168 1.00 0.00 C ATOM 1844 NE ARG B 38 -10.444 12.597 -12.275 1.00 0.00 N ATOM 1845 CZ ARG B 38 -11.015 11.401 -12.157 1.00 0.00 C ATOM 1846 NH1 ARG B 38 -11.490 10.996 -10.985 1.00 0.00 N ATOM 1847 NH2 ARG B 38 -11.113 10.606 -13.215 1.00 0.00 N ATOM 0 H ARG B 38 -5.607 14.224 -9.980 1.00 0.00 H new ATOM 0 HA ARG B 38 -7.227 12.404 -8.591 1.00 0.00 H new ATOM 0 HB2 ARG B 38 -7.825 14.498 -9.989 1.00 0.00 H new ATOM 0 HB3 ARG B 38 -7.720 13.457 -11.394 1.00 0.00 H new ATOM 0 HG2 ARG B 38 -9.396 11.920 -10.081 1.00 0.00 H new ATOM 0 HG3 ARG B 38 -9.697 13.351 -9.115 1.00 0.00 H new ATOM 0 HD2 ARG B 38 -11.269 13.743 -10.730 1.00 0.00 H new ATOM 0 HD3 ARG B 38 -9.908 14.485 -11.548 1.00 0.00 H new ATOM 0 HE ARG B 38 -10.092 12.873 -13.192 1.00 0.00 H new ATOM 0 HH11 ARG B 38 -11.418 11.603 -10.168 1.00 0.00 H new ATOM 0 HH12 ARG B 38 -11.927 10.078 -10.901 1.00 0.00 H new ATOM 0 HH21 ARG B 38 -10.751 10.912 -14.118 1.00 0.00 H new ATOM 0 HH22 ARG B 38 -11.551 9.689 -13.125 1.00 0.00 H new ATOM 1861 N ALA B 39 -6.048 11.307 -11.477 1.00 0.00 N ATOM 1862 CA ALA B 39 -5.822 10.103 -12.266 1.00 0.00 C ATOM 1863 C ALA B 39 -4.927 9.118 -11.522 1.00 0.00 C ATOM 1864 O ALA B 39 -5.134 7.907 -11.583 1.00 0.00 O ATOM 1865 CB ALA B 39 -5.211 10.462 -13.612 1.00 0.00 C ATOM 0 H ALA B 39 -5.648 12.155 -11.878 1.00 0.00 H new ATOM 0 HA ALA B 39 -6.786 9.622 -12.433 1.00 0.00 H new ATOM 0 HB1 ALA B 39 -5.047 9.553 -14.191 1.00 0.00 H new ATOM 0 HB2 ALA B 39 -5.888 11.121 -14.155 1.00 0.00 H new ATOM 0 HB3 ALA B 39 -4.259 10.969 -13.456 1.00 0.00 H new ATOM 1871 N ALA B 40 -3.931 9.648 -10.819 1.00 0.00 N ATOM 1872 CA ALA B 40 -3.003 8.816 -10.063 1.00 0.00 C ATOM 1873 C ALA B 40 -3.685 8.201 -8.846 1.00 0.00 C ATOM 1874 O ALA B 40 -3.415 7.057 -8.482 1.00 0.00 O ATOM 1875 CB ALA B 40 -1.791 9.632 -9.636 1.00 0.00 C ATOM 0 H ALA B 40 -3.746 10.649 -10.757 1.00 0.00 H new ATOM 0 HA ALA B 40 -2.671 8.004 -10.710 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -1.106 8.999 -9.072 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -1.283 10.019 -10.520 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -2.114 10.464 -9.010 1.00 0.00 H new ATOM 1881 N LEU B 41 -4.572 8.969 -8.219 1.00 0.00 N ATOM 1882 CA LEU B 41 -5.294 8.499 -7.043 1.00 0.00 C ATOM 1883 C LEU B 41 -6.101 7.246 -7.364 1.00 0.00 C ATOM 1884 O LEU B 41 -6.082 6.272 -6.611 1.00 0.00 O ATOM 1885 CB LEU B 41 -6.221 9.597 -6.515 1.00 0.00 C ATOM 1886 CG LEU B 41 -7.014 9.226 -5.260 1.00 0.00 C ATOM 1887 CD1 LEU B 41 -6.073 8.802 -4.142 1.00 0.00 C ATOM 1888 CD2 LEU B 41 -7.881 10.394 -4.815 1.00 0.00 C ATOM 0 H LEU B 41 -4.807 9.919 -8.506 1.00 0.00 H new ATOM 0 HA LEU B 41 -4.563 8.250 -6.274 1.00 0.00 H new ATOM 0 HB2 LEU B 41 -5.624 10.483 -6.300 1.00 0.00 H new ATOM 0 HB3 LEU B 41 -6.923 9.869 -7.303 1.00 0.00 H new ATOM 0 HG LEU B 41 -7.665 8.385 -5.498 1.00 0.00 H new ATOM 0 HD11 LEU B 41 -6.654 8.542 -3.257 1.00 0.00 H new ATOM 0 HD12 LEU B 41 -5.493 7.937 -4.463 1.00 0.00 H new ATOM 0 HD13 LEU B 41 -5.397 9.624 -3.904 1.00 0.00 H new ATOM 0 HD21 LEU B 41 -8.438 10.114 -3.921 1.00 0.00 H new ATOM 0 HD22 LEU B 41 -7.248 11.253 -4.593 1.00 0.00 H new ATOM 0 HD23 LEU B 41 -8.579 10.653 -5.611 1.00 0.00 H new ATOM 1900 N ASP B 42 -6.811 7.277 -8.488 1.00 0.00 N ATOM 1901 CA ASP B 42 -7.624 6.143 -8.909 1.00 0.00 C ATOM 1902 C ASP B 42 -6.751 4.925 -9.194 1.00 0.00 C ATOM 1903 O ASP B 42 -7.160 3.788 -8.960 1.00 0.00 O ATOM 1904 CB ASP B 42 -8.436 6.506 -10.154 1.00 0.00 C ATOM 1905 CG ASP B 42 -9.804 5.851 -10.164 1.00 0.00 C ATOM 1906 OD1 ASP B 42 -10.319 5.537 -9.070 1.00 0.00 O ATOM 1907 OD2 ASP B 42 -10.359 5.652 -11.265 1.00 0.00 O ATOM 0 H ASP B 42 -6.839 8.075 -9.123 1.00 0.00 H new ATOM 0 HA ASP B 42 -8.308 5.896 -8.097 1.00 0.00 H new ATOM 0 HB2 ASP B 42 -8.554 7.588 -10.204 1.00 0.00 H new ATOM 0 HB3 ASP B 42 -7.885 6.204 -11.045 1.00 0.00 H new ATOM 1912 N ARG B 43 -5.548 5.172 -9.700 1.00 0.00 N ATOM 1913 CA ARG B 43 -4.616 4.095 -10.017 1.00 0.00 C ATOM 1914 C ARG B 43 -4.265 3.296 -8.766 1.00 0.00 C ATOM 1915 O ARG B 43 -4.025 2.091 -8.835 1.00 0.00 O ATOM 1916 CB ARG B 43 -3.344 4.662 -10.649 1.00 0.00 C ATOM 1917 CG ARG B 43 -3.490 4.980 -12.128 1.00 0.00 C ATOM 1918 CD ARG B 43 -2.153 4.895 -12.849 1.00 0.00 C ATOM 1919 NE ARG B 43 -2.194 5.552 -14.154 1.00 0.00 N ATOM 1920 CZ ARG B 43 -2.728 5.004 -15.244 1.00 0.00 C ATOM 1921 NH1 ARG B 43 -3.269 3.793 -15.189 1.00 0.00 N ATOM 1922 NH2 ARG B 43 -2.723 5.670 -16.390 1.00 0.00 N ATOM 0 H ARG B 43 -5.195 6.108 -9.900 1.00 0.00 H new ATOM 0 HA ARG B 43 -5.099 3.427 -10.730 1.00 0.00 H new ATOM 0 HB2 ARG B 43 -3.057 5.569 -10.117 1.00 0.00 H new ATOM 0 HB3 ARG B 43 -2.533 3.946 -10.518 1.00 0.00 H new ATOM 0 HG2 ARG B 43 -4.195 4.285 -12.583 1.00 0.00 H new ATOM 0 HG3 ARG B 43 -3.906 5.980 -12.247 1.00 0.00 H new ATOM 0 HD2 ARG B 43 -1.380 5.356 -12.235 1.00 0.00 H new ATOM 0 HD3 ARG B 43 -1.876 3.849 -12.978 1.00 0.00 H new ATOM 0 HE ARG B 43 -1.790 6.485 -14.235 1.00 0.00 H new ATOM 0 HH11 ARG B 43 -3.277 3.278 -14.309 1.00 0.00 H new ATOM 0 HH12 ARG B 43 -3.677 3.378 -16.027 1.00 0.00 H new ATOM 0 HH21 ARG B 43 -2.310 6.602 -16.437 1.00 0.00 H new ATOM 0 HH22 ARG B 43 -3.132 5.251 -17.225 1.00 0.00 H new ATOM 1936 N LEU B 44 -4.236 3.976 -7.625 1.00 0.00 N ATOM 1937 CA LEU B 44 -3.914 3.328 -6.358 1.00 0.00 C ATOM 1938 C LEU B 44 -5.084 2.483 -5.867 1.00 0.00 C ATOM 1939 O LEU B 44 -4.890 1.431 -5.256 1.00 0.00 O ATOM 1940 CB LEU B 44 -3.549 4.377 -5.304 1.00 0.00 C ATOM 1941 CG LEU B 44 -2.880 3.824 -4.045 1.00 0.00 C ATOM 1942 CD1 LEU B 44 -1.900 4.836 -3.473 1.00 0.00 C ATOM 1943 CD2 LEU B 44 -3.926 3.448 -3.007 1.00 0.00 C ATOM 0 H LEU B 44 -4.431 4.974 -7.551 1.00 0.00 H new ATOM 0 HA LEU B 44 -3.059 2.672 -6.520 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -2.883 5.110 -5.759 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -4.455 4.907 -5.012 1.00 0.00 H new ATOM 0 HG LEU B 44 -2.326 2.925 -4.316 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -1.434 4.425 -2.578 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -1.131 5.057 -4.214 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -2.431 5.753 -3.217 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -3.432 3.056 -2.118 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -4.507 4.331 -2.740 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -4.590 2.687 -3.418 1.00 0.00 H new ATOM 1955 N GLU B 45 -6.298 2.949 -6.138 1.00 0.00 N ATOM 1956 CA GLU B 45 -7.502 2.236 -5.724 1.00 0.00 C ATOM 1957 C GLU B 45 -7.633 0.904 -6.458 1.00 0.00 C ATOM 1958 O GLU B 45 -8.282 -0.021 -5.970 1.00 0.00 O ATOM 1959 CB GLU B 45 -8.741 3.096 -5.980 1.00 0.00 C ATOM 1960 CG GLU B 45 -8.782 4.367 -5.148 1.00 0.00 C ATOM 1961 CD GLU B 45 -9.963 5.252 -5.493 1.00 0.00 C ATOM 1962 OE1 GLU B 45 -9.837 6.075 -6.423 1.00 0.00 O ATOM 1963 OE2 GLU B 45 -11.016 5.121 -4.832 1.00 0.00 O ATOM 0 H GLU B 45 -6.475 3.818 -6.643 1.00 0.00 H new ATOM 0 HA GLU B 45 -7.421 2.032 -4.656 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -8.776 3.362 -7.036 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -9.633 2.505 -5.770 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -8.827 4.104 -4.091 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -7.858 4.925 -5.299 1.00 0.00 H new ATOM 1970 N LYS B 46 -7.014 0.814 -7.632 1.00 0.00 N ATOM 1971 CA LYS B 46 -7.065 -0.406 -8.433 1.00 0.00 C ATOM 1972 C LYS B 46 -6.605 -1.616 -7.622 1.00 0.00 C ATOM 1973 O LYS B 46 -7.047 -2.740 -7.863 1.00 0.00 O ATOM 1974 CB LYS B 46 -6.194 -0.257 -9.682 1.00 0.00 C ATOM 1975 CG LYS B 46 -6.949 0.272 -10.891 1.00 0.00 C ATOM 1976 CD LYS B 46 -7.568 1.632 -10.609 1.00 0.00 C ATOM 1977 CE LYS B 46 -8.672 1.957 -11.601 1.00 0.00 C ATOM 1978 NZ LYS B 46 -9.339 3.250 -11.286 1.00 0.00 N ATOM 0 H LYS B 46 -6.472 1.570 -8.050 1.00 0.00 H new ATOM 0 HA LYS B 46 -8.100 -0.567 -8.734 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -5.365 0.415 -9.459 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -5.761 -1.226 -9.930 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -6.270 0.349 -11.740 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -7.731 -0.434 -11.171 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -7.971 1.647 -9.596 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -6.797 2.401 -10.656 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -8.255 1.999 -12.607 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -9.412 1.156 -11.596 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -10.278 3.274 -11.732 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -9.442 3.345 -10.256 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -8.763 4.036 -11.650 1.00 0.00 H new ATOM 1992 N LEU B 47 -5.716 -1.378 -6.665 1.00 0.00 N ATOM 1993 CA LEU B 47 -5.196 -2.448 -5.822 1.00 0.00 C ATOM 1994 C LEU B 47 -6.017 -2.588 -4.543 1.00 0.00 C ATOM 1995 O LEU B 47 -6.090 -3.668 -3.956 1.00 0.00 O ATOM 1996 CB LEU B 47 -3.730 -2.185 -5.477 1.00 0.00 C ATOM 1997 CG LEU B 47 -2.754 -2.352 -6.645 1.00 0.00 C ATOM 1998 CD1 LEU B 47 -2.529 -1.020 -7.345 1.00 0.00 C ATOM 1999 CD2 LEU B 47 -1.433 -2.932 -6.159 1.00 0.00 C ATOM 0 H LEU B 47 -5.340 -0.454 -6.453 1.00 0.00 H new ATOM 0 HA LEU B 47 -5.270 -3.382 -6.379 1.00 0.00 H new ATOM 0 HB2 LEU B 47 -3.639 -1.171 -5.089 1.00 0.00 H new ATOM 0 HB3 LEU B 47 -3.433 -2.861 -4.675 1.00 0.00 H new ATOM 0 HG LEU B 47 -3.190 -3.048 -7.362 1.00 0.00 H new ATOM 0 HD11 LEU B 47 -1.833 -1.157 -8.172 1.00 0.00 H new ATOM 0 HD12 LEU B 47 -3.478 -0.645 -7.728 1.00 0.00 H new ATOM 0 HD13 LEU B 47 -2.114 -0.302 -6.637 1.00 0.00 H new ATOM 0 HD21 LEU B 47 -0.752 -3.044 -7.003 1.00 0.00 H new ATOM 0 HD22 LEU B 47 -0.991 -2.262 -5.422 1.00 0.00 H new ATOM 0 HD23 LEU B 47 -1.609 -3.907 -5.704 1.00 0.00 H new ATOM 2011 N LEU B 48 -6.633 -1.490 -4.115 1.00 0.00 N ATOM 2012 CA LEU B 48 -7.447 -1.495 -2.904 1.00 0.00 C ATOM 2013 C LEU B 48 -8.838 -2.053 -3.187 1.00 0.00 C ATOM 2014 O LEU B 48 -9.461 -2.665 -2.320 1.00 0.00 O ATOM 2015 CB LEU B 48 -7.557 -0.080 -2.335 1.00 0.00 C ATOM 2016 CG LEU B 48 -6.351 0.383 -1.515 1.00 0.00 C ATOM 2017 CD1 LEU B 48 -6.261 -0.396 -0.212 1.00 0.00 C ATOM 2018 CD2 LEU B 48 -5.070 0.230 -2.321 1.00 0.00 C ATOM 0 H LEU B 48 -6.584 -0.587 -4.588 1.00 0.00 H new ATOM 0 HA LEU B 48 -6.961 -2.137 -2.170 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -7.705 0.617 -3.160 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -8.447 -0.025 -1.708 1.00 0.00 H new ATOM 0 HG LEU B 48 -6.481 1.438 -1.274 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -5.397 -0.053 0.358 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -7.168 -0.235 0.371 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -6.153 -1.459 -0.430 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -4.222 0.564 -1.723 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -4.933 -0.817 -2.592 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -5.136 0.833 -3.226 1.00 0.00 H new ATOM 2030 N ARG B 49 -9.321 -1.837 -4.406 1.00 0.00 N ATOM 2031 CA ARG B 49 -10.640 -2.318 -4.804 1.00 0.00 C ATOM 2032 C ARG B 49 -10.750 -3.829 -4.620 1.00 0.00 C ATOM 2033 O ARG B 49 -9.911 -4.587 -5.107 1.00 0.00 O ATOM 2034 CB ARG B 49 -10.921 -1.949 -6.263 1.00 0.00 C ATOM 2035 CG ARG B 49 -12.365 -1.552 -6.523 1.00 0.00 C ATOM 2036 CD ARG B 49 -12.509 -0.804 -7.838 1.00 0.00 C ATOM 2037 NE ARG B 49 -13.867 -0.305 -8.039 1.00 0.00 N ATOM 2038 CZ ARG B 49 -14.184 0.653 -8.906 1.00 0.00 C ATOM 2039 NH1 ARG B 49 -13.244 1.218 -9.656 1.00 0.00 N ATOM 2040 NH2 ARG B 49 -15.443 1.049 -9.026 1.00 0.00 N ATOM 0 H ARG B 49 -8.819 -1.332 -5.136 1.00 0.00 H new ATOM 0 HA ARG B 49 -11.381 -1.839 -4.164 1.00 0.00 H new ATOM 0 HB2 ARG B 49 -10.269 -1.125 -6.553 1.00 0.00 H new ATOM 0 HB3 ARG B 49 -10.666 -2.797 -6.899 1.00 0.00 H new ATOM 0 HG2 ARG B 49 -12.991 -2.444 -6.540 1.00 0.00 H new ATOM 0 HG3 ARG B 49 -12.724 -0.926 -5.706 1.00 0.00 H new ATOM 0 HD2 ARG B 49 -11.809 0.032 -7.858 1.00 0.00 H new ATOM 0 HD3 ARG B 49 -12.240 -1.465 -8.662 1.00 0.00 H new ATOM 0 HE ARG B 49 -14.616 -0.715 -7.482 1.00 0.00 H new ATOM 0 HH11 ARG B 49 -12.273 0.918 -9.569 1.00 0.00 H new ATOM 0 HH12 ARG B 49 -13.493 1.952 -10.319 1.00 0.00 H new ATOM 0 HH21 ARG B 49 -16.170 0.619 -8.453 1.00 0.00 H new ATOM 0 HH22 ARG B 49 -15.685 1.784 -9.691 1.00 0.00 H new ATOM 2054 N CYS B 50 -11.791 -4.259 -3.914 1.00 0.00 N ATOM 2055 CA CYS B 50 -12.012 -5.679 -3.664 1.00 0.00 C ATOM 2056 C CYS B 50 -12.173 -6.443 -4.974 1.00 0.00 C ATOM 2057 O CYS B 50 -12.625 -5.889 -5.976 1.00 0.00 O ATOM 2058 CB CYS B 50 -13.252 -5.878 -2.791 1.00 0.00 C ATOM 2059 SG CYS B 50 -13.497 -7.580 -2.232 1.00 0.00 S ATOM 0 H CYS B 50 -12.495 -3.644 -3.505 1.00 0.00 H new ATOM 0 HA CYS B 50 -11.140 -6.070 -3.140 1.00 0.00 H new ATOM 0 HB2 CYS B 50 -13.177 -5.228 -1.919 1.00 0.00 H new ATOM 0 HB3 CYS B 50 -14.132 -5.561 -3.351 1.00 0.00 H new ATOM 2064 N SER B 51 -11.802 -7.719 -4.959 1.00 0.00 N ATOM 2065 CA SER B 51 -11.907 -8.559 -6.146 1.00 0.00 C ATOM 2066 C SER B 51 -13.351 -8.990 -6.381 1.00 0.00 C ATOM 2067 O SER B 51 -13.766 -9.214 -7.518 1.00 0.00 O ATOM 2068 CB SER B 51 -11.008 -9.790 -6.005 1.00 0.00 C ATOM 2069 OG SER B 51 -9.896 -9.712 -6.879 1.00 0.00 O ATOM 0 H SER B 51 -11.426 -8.194 -4.138 1.00 0.00 H new ATOM 0 HA SER B 51 -11.578 -7.975 -7.006 1.00 0.00 H new ATOM 0 HB2 SER B 51 -10.660 -9.874 -4.975 1.00 0.00 H new ATOM 0 HB3 SER B 51 -11.583 -10.691 -6.222 1.00 0.00 H new ATOM 0 HG SER B 51 -9.337 -10.509 -6.769 1.00 0.00 H new ATOM 2075 N ARG B 52 -14.114 -9.103 -5.297 1.00 0.00 N ATOM 2076 CA ARG B 52 -15.513 -9.506 -5.387 1.00 0.00 C ATOM 2077 C ARG B 52 -16.432 -8.289 -5.339 1.00 0.00 C ATOM 2078 O ARG B 52 -17.223 -8.059 -6.254 1.00 0.00 O ATOM 2079 CB ARG B 52 -15.862 -10.469 -4.251 1.00 0.00 C ATOM 2080 CG ARG B 52 -15.657 -11.932 -4.609 1.00 0.00 C ATOM 2081 CD ARG B 52 -14.179 -12.284 -4.685 1.00 0.00 C ATOM 2082 NE ARG B 52 -13.911 -13.308 -5.692 1.00 0.00 N ATOM 2083 CZ ARG B 52 -14.313 -14.573 -5.587 1.00 0.00 C ATOM 2084 NH1 ARG B 52 -14.998 -14.974 -4.523 1.00 0.00 N ATOM 2085 NH2 ARG B 52 -14.027 -15.440 -6.549 1.00 0.00 N ATOM 0 H ARG B 52 -13.787 -8.921 -4.348 1.00 0.00 H new ATOM 0 HA ARG B 52 -15.660 -10.013 -6.341 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -15.252 -10.228 -3.381 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -16.902 -10.316 -3.963 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -16.145 -12.562 -3.865 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -16.133 -12.144 -5.567 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -13.604 -11.387 -4.918 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -13.840 -12.636 -3.711 1.00 0.00 H new ATOM 0 HE ARG B 52 -13.386 -13.038 -6.524 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -15.219 -14.312 -3.780 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -15.303 -15.945 -4.449 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -13.500 -15.137 -7.368 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -14.334 -16.409 -6.470 1.00 0.00 H new ATOM 2099 N CYS B 53 -16.322 -7.512 -4.266 1.00 0.00 N ATOM 2100 CA CYS B 53 -17.141 -6.317 -4.099 1.00 0.00 C ATOM 2101 C CYS B 53 -16.812 -5.266 -5.156 1.00 0.00 C ATOM 2102 O CYS B 53 -17.578 -4.324 -5.362 1.00 0.00 O ATOM 2103 CB CYS B 53 -16.942 -5.730 -2.700 1.00 0.00 C ATOM 2104 SG CYS B 53 -17.074 -6.942 -1.365 1.00 0.00 S ATOM 0 H CYS B 53 -15.673 -7.689 -3.499 1.00 0.00 H new ATOM 0 HA CYS B 53 -18.184 -6.608 -4.222 1.00 0.00 H new ATOM 0 HB2 CYS B 53 -15.961 -5.258 -2.652 1.00 0.00 H new ATOM 0 HB3 CYS B 53 -17.681 -4.945 -2.538 1.00 0.00 H new ATOM 2109 N THR B 54 -15.667 -5.429 -5.822 1.00 0.00 N ATOM 2110 CA THR B 54 -15.232 -4.493 -6.860 1.00 0.00 C ATOM 2111 C THR B 54 -15.422 -3.044 -6.417 1.00 0.00 C ATOM 2112 O THR B 54 -16.027 -2.239 -7.126 1.00 0.00 O ATOM 2113 CB THR B 54 -15.991 -4.752 -8.165 1.00 0.00 C ATOM 2114 OG1 THR B 54 -15.548 -3.871 -9.183 1.00 0.00 O ATOM 2115 CG2 THR B 54 -17.489 -4.584 -8.035 1.00 0.00 C ATOM 0 H THR B 54 -15.023 -6.203 -5.660 1.00 0.00 H new ATOM 0 HA THR B 54 -14.168 -4.656 -7.031 1.00 0.00 H new ATOM 0 HB THR B 54 -15.781 -5.791 -8.418 1.00 0.00 H new ATOM 0 HG1 THR B 54 -15.757 -2.948 -8.930 1.00 0.00 H new ATOM 0 HG21 THR B 54 -17.962 -4.783 -8.997 1.00 0.00 H new ATOM 0 HG22 THR B 54 -17.870 -5.284 -7.291 1.00 0.00 H new ATOM 0 HG23 THR B 54 -17.715 -3.564 -7.723 1.00 0.00 H new ATOM 2123 N ASN B 55 -14.897 -2.718 -5.240 1.00 0.00 N ATOM 2124 CA ASN B 55 -15.004 -1.367 -4.701 1.00 0.00 C ATOM 2125 C ASN B 55 -14.124 -1.206 -3.466 1.00 0.00 C ATOM 2126 O ASN B 55 -13.387 -2.119 -3.093 1.00 0.00 O ATOM 2127 CB ASN B 55 -16.460 -1.051 -4.349 1.00 0.00 C ATOM 2128 CG ASN B 55 -17.195 -0.372 -5.488 1.00 0.00 C ATOM 2129 OD1 ASN B 55 -16.580 0.112 -6.438 1.00 0.00 O ATOM 2130 ND2 ASN B 55 -18.519 -0.333 -5.398 1.00 0.00 N ATOM 0 H ASN B 55 -14.393 -3.372 -4.641 1.00 0.00 H new ATOM 0 HA ASN B 55 -14.662 -0.668 -5.464 1.00 0.00 H new ATOM 0 HB2 ASN B 55 -16.976 -1.974 -4.086 1.00 0.00 H new ATOM 0 HB3 ASN B 55 -16.487 -0.409 -3.469 1.00 0.00 H new ATOM 0 HD21 ASN B 55 -19.067 0.111 -6.135 1.00 0.00 H new ATOM 0 HD22 ASN B 55 -18.988 -0.747 -4.592 1.00 0.00 H new ATOM 2137 N ILE B 56 -14.205 -0.039 -2.833 1.00 0.00 N ATOM 2138 CA ILE B 56 -13.415 0.239 -1.640 1.00 0.00 C ATOM 2139 C ILE B 56 -13.742 -0.752 -0.527 1.00 0.00 C ATOM 2140 O ILE B 56 -14.908 -1.063 -0.283 1.00 0.00 O ATOM 2141 CB ILE B 56 -13.655 1.672 -1.126 1.00 0.00 C ATOM 2142 CG1 ILE B 56 -13.466 2.685 -2.256 1.00 0.00 C ATOM 2143 CG2 ILE B 56 -12.718 1.984 0.033 1.00 0.00 C ATOM 2144 CD1 ILE B 56 -12.109 2.601 -2.924 1.00 0.00 C ATOM 0 H ILE B 56 -14.810 0.728 -3.127 1.00 0.00 H new ATOM 0 HA ILE B 56 -12.367 0.136 -1.921 1.00 0.00 H new ATOM 0 HB ILE B 56 -14.682 1.744 -0.769 1.00 0.00 H new ATOM 0 HG12 ILE B 56 -14.241 2.529 -3.006 1.00 0.00 H new ATOM 0 HG13 ILE B 56 -13.605 3.690 -1.859 1.00 0.00 H new ATOM 0 HG21 ILE B 56 -12.900 3.000 0.385 1.00 0.00 H new ATOM 0 HG22 ILE B 56 -12.898 1.281 0.846 1.00 0.00 H new ATOM 0 HG23 ILE B 56 -11.684 1.895 -0.301 1.00 0.00 H new ATOM 0 HD11 ILE B 56 -12.046 3.348 -3.715 1.00 0.00 H new ATOM 0 HD12 ILE B 56 -11.328 2.787 -2.186 1.00 0.00 H new ATOM 0 HD13 ILE B 56 -11.975 1.607 -3.352 1.00 0.00 H new ATOM 2156 N LEU B 57 -12.706 -1.248 0.142 1.00 0.00 N ATOM 2157 CA LEU B 57 -12.886 -2.207 1.228 1.00 0.00 C ATOM 2158 C LEU B 57 -12.418 -1.621 2.557 1.00 0.00 C ATOM 2159 O LEU B 57 -11.660 -0.652 2.589 1.00 0.00 O ATOM 2160 CB LEU B 57 -12.129 -3.511 0.934 1.00 0.00 C ATOM 2161 CG LEU B 57 -11.032 -3.418 -0.132 1.00 0.00 C ATOM 2162 CD1 LEU B 57 -9.741 -2.882 0.470 1.00 0.00 C ATOM 2163 CD2 LEU B 57 -10.797 -4.780 -0.771 1.00 0.00 C ATOM 0 H LEU B 57 -11.734 -1.003 -0.048 1.00 0.00 H new ATOM 0 HA LEU B 57 -13.951 -2.429 1.302 1.00 0.00 H new ATOM 0 HB2 LEU B 57 -11.679 -3.865 1.862 1.00 0.00 H new ATOM 0 HB3 LEU B 57 -12.851 -4.266 0.621 1.00 0.00 H new ATOM 0 HG LEU B 57 -11.362 -2.724 -0.905 1.00 0.00 H new ATOM 0 HD11 LEU B 57 -8.975 -2.824 -0.304 1.00 0.00 H new ATOM 0 HD12 LEU B 57 -9.917 -1.888 0.882 1.00 0.00 H new ATOM 0 HD13 LEU B 57 -9.405 -3.549 1.264 1.00 0.00 H new ATOM 0 HD21 LEU B 57 -10.015 -4.698 -1.526 1.00 0.00 H new ATOM 0 HD22 LEU B 57 -10.489 -5.493 -0.006 1.00 0.00 H new ATOM 0 HD23 LEU B 57 -11.718 -5.126 -1.239 1.00 0.00 H new ATOM 2175 N ARG B 58 -12.876 -2.219 3.652 1.00 0.00 N ATOM 2176 CA ARG B 58 -12.506 -1.762 4.986 1.00 0.00 C ATOM 2177 C ARG B 58 -12.072 -2.937 5.857 1.00 0.00 C ATOM 2178 O ARG B 58 -12.874 -3.815 6.174 1.00 0.00 O ATOM 2179 CB ARG B 58 -13.680 -1.031 5.643 1.00 0.00 C ATOM 2180 CG ARG B 58 -14.994 -1.789 5.556 1.00 0.00 C ATOM 2181 CD ARG B 58 -15.866 -1.533 6.774 1.00 0.00 C ATOM 2182 NE ARG B 58 -16.750 -2.660 7.061 1.00 0.00 N ATOM 2183 CZ ARG B 58 -17.885 -2.897 6.407 1.00 0.00 C ATOM 2184 NH1 ARG B 58 -18.276 -2.090 5.428 1.00 0.00 N ATOM 2185 NH2 ARG B 58 -18.630 -3.945 6.731 1.00 0.00 N ATOM 0 H ARG B 58 -13.505 -3.022 3.641 1.00 0.00 H new ATOM 0 HA ARG B 58 -11.668 -1.072 4.889 1.00 0.00 H new ATOM 0 HB2 ARG B 58 -13.443 -0.850 6.691 1.00 0.00 H new ATOM 0 HB3 ARG B 58 -13.801 -0.056 5.170 1.00 0.00 H new ATOM 0 HG2 ARG B 58 -15.529 -1.490 4.655 1.00 0.00 H new ATOM 0 HG3 ARG B 58 -14.794 -2.857 5.468 1.00 0.00 H new ATOM 0 HD2 ARG B 58 -15.232 -1.340 7.639 1.00 0.00 H new ATOM 0 HD3 ARG B 58 -16.463 -0.636 6.610 1.00 0.00 H new ATOM 0 HE ARG B 58 -16.482 -3.303 7.806 1.00 0.00 H new ATOM 0 HH11 ARG B 58 -17.706 -1.283 5.173 1.00 0.00 H new ATOM 0 HH12 ARG B 58 -19.147 -2.277 4.930 1.00 0.00 H new ATOM 0 HH21 ARG B 58 -18.333 -4.569 7.481 1.00 0.00 H new ATOM 0 HH22 ARG B 58 -19.500 -4.127 6.230 1.00 0.00 H new ATOM 2199 N GLU B 59 -10.797 -2.950 6.233 1.00 0.00 N ATOM 2200 CA GLU B 59 -10.258 -4.022 7.061 1.00 0.00 C ATOM 2201 C GLU B 59 -10.397 -5.369 6.354 1.00 0.00 C ATOM 2202 O GLU B 59 -10.956 -6.318 6.906 1.00 0.00 O ATOM 2203 CB GLU B 59 -10.973 -4.061 8.413 1.00 0.00 C ATOM 2204 CG GLU B 59 -10.052 -4.377 9.579 1.00 0.00 C ATOM 2205 CD GLU B 59 -10.381 -3.567 10.819 1.00 0.00 C ATOM 2206 OE1 GLU B 59 -10.300 -2.322 10.753 1.00 0.00 O ATOM 2207 OE2 GLU B 59 -10.721 -4.177 11.854 1.00 0.00 O ATOM 0 H GLU B 59 -10.119 -2.232 5.978 1.00 0.00 H new ATOM 0 HA GLU B 59 -9.199 -3.826 7.229 1.00 0.00 H new ATOM 0 HB2 GLU B 59 -11.451 -3.098 8.589 1.00 0.00 H new ATOM 0 HB3 GLU B 59 -11.766 -4.808 8.374 1.00 0.00 H new ATOM 0 HG2 GLU B 59 -10.121 -5.439 9.814 1.00 0.00 H new ATOM 0 HG3 GLU B 59 -9.020 -4.182 9.285 1.00 0.00 H new ATOM 2214 N PRO B 60 -9.890 -5.469 5.112 1.00 0.00 N ATOM 2215 CA PRO B 60 -9.961 -6.705 4.326 1.00 0.00 C ATOM 2216 C PRO B 60 -9.071 -7.806 4.889 1.00 0.00 C ATOM 2217 O PRO B 60 -8.559 -7.697 6.004 1.00 0.00 O ATOM 2218 CB PRO B 60 -9.467 -6.275 2.942 1.00 0.00 C ATOM 2219 CG PRO B 60 -8.602 -5.092 3.200 1.00 0.00 C ATOM 2220 CD PRO B 60 -9.209 -4.385 4.379 1.00 0.00 C ATOM 0 HA PRO B 60 -10.966 -7.127 4.324 1.00 0.00 H new ATOM 0 HB2 PRO B 60 -8.909 -7.075 2.455 1.00 0.00 H new ATOM 0 HB3 PRO B 60 -10.299 -6.021 2.286 1.00 0.00 H new ATOM 0 HG2 PRO B 60 -7.577 -5.397 3.413 1.00 0.00 H new ATOM 0 HG3 PRO B 60 -8.566 -4.438 2.329 1.00 0.00 H new ATOM 0 HD2 PRO B 60 -8.449 -3.901 4.992 1.00 0.00 H new ATOM 0 HD3 PRO B 60 -9.908 -3.610 4.066 1.00 0.00 H new ATOM 2228 N VAL B 61 -8.889 -8.866 4.109 1.00 0.00 N ATOM 2229 CA VAL B 61 -8.060 -9.989 4.527 1.00 0.00 C ATOM 2230 C VAL B 61 -7.134 -10.434 3.399 1.00 0.00 C ATOM 2231 O VAL B 61 -7.522 -10.440 2.230 1.00 0.00 O ATOM 2232 CB VAL B 61 -8.918 -11.189 4.971 1.00 0.00 C ATOM 2233 CG1 VAL B 61 -8.054 -12.246 5.641 1.00 0.00 C ATOM 2234 CG2 VAL B 61 -10.034 -10.733 5.901 1.00 0.00 C ATOM 0 H VAL B 61 -9.305 -8.970 3.184 1.00 0.00 H new ATOM 0 HA VAL B 61 -7.465 -9.645 5.373 1.00 0.00 H new ATOM 0 HB VAL B 61 -9.373 -11.634 4.086 1.00 0.00 H new ATOM 0 HG11 VAL B 61 -8.678 -13.085 5.947 1.00 0.00 H new ATOM 0 HG12 VAL B 61 -7.296 -12.595 4.940 1.00 0.00 H new ATOM 0 HG13 VAL B 61 -7.568 -11.817 6.517 1.00 0.00 H new ATOM 0 HG21 VAL B 61 -10.630 -11.594 6.204 1.00 0.00 H new ATOM 0 HG22 VAL B 61 -9.602 -10.261 6.784 1.00 0.00 H new ATOM 0 HG23 VAL B 61 -10.670 -10.016 5.382 1.00 0.00 H new ATOM 2244 N CYS B 62 -5.908 -10.803 3.757 1.00 0.00 N ATOM 2245 CA CYS B 62 -4.927 -11.247 2.774 1.00 0.00 C ATOM 2246 C CYS B 62 -5.105 -12.730 2.460 1.00 0.00 C ATOM 2247 O CYS B 62 -5.042 -13.575 3.352 1.00 0.00 O ATOM 2248 CB CYS B 62 -3.509 -10.989 3.285 1.00 0.00 C ATOM 2249 SG CYS B 62 -3.156 -11.742 4.891 1.00 0.00 S ATOM 0 H CYS B 62 -5.571 -10.803 4.720 1.00 0.00 H new ATOM 0 HA CYS B 62 -5.084 -10.678 1.858 1.00 0.00 H new ATOM 0 HB2 CYS B 62 -2.796 -11.368 2.553 1.00 0.00 H new ATOM 0 HB3 CYS B 62 -3.350 -9.913 3.357 1.00 0.00 H new ATOM 0 HG CYS B 62 -1.888 -12.017 4.972 1.00 0.00 H new ATOM 2255 N LEU B 63 -5.325 -13.039 1.186 1.00 0.00 N ATOM 2256 CA LEU B 63 -5.511 -14.420 0.756 1.00 0.00 C ATOM 2257 C LEU B 63 -4.282 -15.260 1.085 1.00 0.00 C ATOM 2258 O LEU B 63 -4.345 -16.177 1.904 1.00 0.00 O ATOM 2259 CB LEU B 63 -5.792 -14.476 -0.748 1.00 0.00 C ATOM 2260 CG LEU B 63 -6.594 -15.694 -1.213 1.00 0.00 C ATOM 2261 CD1 LEU B 63 -5.965 -16.978 -0.697 1.00 0.00 C ATOM 2262 CD2 LEU B 63 -8.038 -15.587 -0.754 1.00 0.00 C ATOM 0 H LEU B 63 -5.379 -12.352 0.434 1.00 0.00 H new ATOM 0 HA LEU B 63 -6.366 -14.830 1.294 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -6.332 -13.574 -1.035 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -4.841 -14.461 -1.281 1.00 0.00 H new ATOM 0 HG LEU B 63 -6.579 -15.719 -2.303 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -6.550 -17.832 -1.038 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -4.946 -17.061 -1.075 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -5.948 -16.962 0.393 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -8.593 -16.461 -1.093 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -8.071 -15.536 0.334 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -8.487 -14.687 -1.173 1.00 0.00 H new ATOM 2274 N GLY B 64 -3.163 -14.941 0.442 1.00 0.00 N ATOM 2275 CA GLY B 64 -1.935 -15.675 0.679 1.00 0.00 C ATOM 2276 C GLY B 64 -0.725 -14.994 0.071 1.00 0.00 C ATOM 2277 O GLY B 64 0.263 -14.738 0.760 1.00 0.00 O ATOM 0 H GLY B 64 -3.086 -14.186 -0.240 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -1.784 -15.787 1.753 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -2.030 -16.679 0.264 1.00 0.00 H new ATOM 2281 N GLY B 65 -0.801 -14.700 -1.223 1.00 0.00 N ATOM 2282 CA GLY B 65 0.303 -14.046 -1.900 1.00 0.00 C ATOM 2283 C GLY B 65 0.222 -14.182 -3.407 1.00 0.00 C ATOM 2284 O GLY B 65 1.230 -14.437 -4.068 1.00 0.00 O ATOM 0 H GLY B 65 -1.607 -14.903 -1.814 1.00 0.00 H new ATOM 0 HA2 GLY B 65 0.313 -12.989 -1.634 1.00 0.00 H new ATOM 0 HA3 GLY B 65 1.243 -14.472 -1.550 1.00 0.00 H new ATOM 2288 N CYS B 66 -0.978 -14.011 -3.953 1.00 0.00 N ATOM 2289 CA CYS B 66 -1.183 -14.116 -5.393 1.00 0.00 C ATOM 2290 C CYS B 66 -1.821 -12.846 -5.948 1.00 0.00 C ATOM 2291 O CYS B 66 -2.536 -12.884 -6.949 1.00 0.00 O ATOM 2292 CB CYS B 66 -2.061 -15.325 -5.720 1.00 0.00 C ATOM 2293 SG CYS B 66 -3.518 -15.491 -4.661 1.00 0.00 S ATOM 0 H CYS B 66 -1.822 -13.799 -3.421 1.00 0.00 H new ATOM 0 HA CYS B 66 -0.208 -14.246 -5.862 1.00 0.00 H new ATOM 0 HB2 CYS B 66 -2.386 -15.254 -6.758 1.00 0.00 H new ATOM 0 HB3 CYS B 66 -1.460 -16.230 -5.636 1.00 0.00 H new ATOM 2298 N GLU B 67 -1.554 -11.720 -5.293 1.00 0.00 N ATOM 2299 CA GLU B 67 -2.096 -10.434 -5.720 1.00 0.00 C ATOM 2300 C GLU B 67 -3.618 -10.395 -5.588 1.00 0.00 C ATOM 2301 O GLU B 67 -4.271 -9.508 -6.138 1.00 0.00 O ATOM 2302 CB GLU B 67 -1.694 -10.142 -7.169 1.00 0.00 C ATOM 2303 CG GLU B 67 -0.215 -10.358 -7.445 1.00 0.00 C ATOM 2304 CD GLU B 67 0.050 -10.830 -8.860 1.00 0.00 C ATOM 2305 OE1 GLU B 67 -0.515 -10.233 -9.802 1.00 0.00 O ATOM 2306 OE2 GLU B 67 0.822 -11.797 -9.029 1.00 0.00 O ATOM 0 H GLU B 67 -0.964 -11.672 -4.462 1.00 0.00 H new ATOM 0 HA GLU B 67 -1.679 -9.668 -5.067 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -2.276 -10.780 -7.834 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -1.953 -9.111 -7.408 1.00 0.00 H new ATOM 0 HG2 GLU B 67 0.323 -9.427 -7.270 1.00 0.00 H new ATOM 0 HG3 GLU B 67 0.179 -11.091 -6.741 1.00 0.00 H new ATOM 2313 N HIS B 68 -4.181 -11.355 -4.858 1.00 0.00 N ATOM 2314 CA HIS B 68 -5.626 -11.411 -4.663 1.00 0.00 C ATOM 2315 C HIS B 68 -6.007 -10.920 -3.270 1.00 0.00 C ATOM 2316 O HIS B 68 -5.595 -11.496 -2.263 1.00 0.00 O ATOM 2317 CB HIS B 68 -6.136 -12.839 -4.873 1.00 0.00 C ATOM 2318 CG HIS B 68 -6.760 -13.059 -6.216 1.00 0.00 C ATOM 2319 ND1 HIS B 68 -7.470 -14.200 -6.497 1.00 0.00 N ATOM 2320 CD2 HIS B 68 -6.750 -12.261 -7.311 1.00 0.00 C ATOM 2321 CE1 HIS B 68 -7.876 -14.074 -7.747 1.00 0.00 C ATOM 2322 NE2 HIS B 68 -7.463 -12.915 -8.283 1.00 0.00 N ATOM 0 H HIS B 68 -3.661 -12.100 -4.394 1.00 0.00 H new ATOM 0 HA HIS B 68 -6.092 -10.755 -5.398 1.00 0.00 H new ATOM 0 HB2 HIS B 68 -5.306 -13.535 -4.748 1.00 0.00 H new ATOM 0 HB3 HIS B 68 -6.867 -13.073 -4.099 1.00 0.00 H new ATOM 0 HD1 HIS B 68 -7.647 -14.984 -5.869 1.00 0.00 H new ATOM 0 HD2 HIS B 68 -6.273 -11.296 -7.401 1.00 0.00 H new ATOM 0 HE1 HIS B 68 -8.466 -14.811 -8.272 1.00 0.00 H new ATOM 2330 N ILE B 69 -6.798 -9.854 -3.221 1.00 0.00 N ATOM 2331 CA ILE B 69 -7.237 -9.284 -1.952 1.00 0.00 C ATOM 2332 C ILE B 69 -8.749 -9.101 -1.927 1.00 0.00 C ATOM 2333 O ILE B 69 -9.363 -8.783 -2.946 1.00 0.00 O ATOM 2334 CB ILE B 69 -6.564 -7.926 -1.679 1.00 0.00 C ATOM 2335 CG1 ILE B 69 -5.057 -8.011 -1.939 1.00 0.00 C ATOM 2336 CG2 ILE B 69 -6.838 -7.478 -0.250 1.00 0.00 C ATOM 2337 CD1 ILE B 69 -4.608 -7.218 -3.147 1.00 0.00 C ATOM 0 H ILE B 69 -7.149 -9.367 -4.046 1.00 0.00 H new ATOM 0 HA ILE B 69 -6.944 -9.988 -1.173 1.00 0.00 H new ATOM 0 HB ILE B 69 -6.986 -7.186 -2.359 1.00 0.00 H new ATOM 0 HG12 ILE B 69 -4.524 -7.651 -1.059 1.00 0.00 H new ATOM 0 HG13 ILE B 69 -4.778 -9.056 -2.076 1.00 0.00 H new ATOM 0 HG21 ILE B 69 -6.356 -6.517 -0.071 1.00 0.00 H new ATOM 0 HG22 ILE B 69 -7.913 -7.379 -0.100 1.00 0.00 H new ATOM 0 HG23 ILE B 69 -6.441 -8.218 0.446 1.00 0.00 H new ATOM 0 HD11 ILE B 69 -3.530 -7.323 -3.271 1.00 0.00 H new ATOM 0 HD12 ILE B 69 -5.114 -7.592 -4.037 1.00 0.00 H new ATOM 0 HD13 ILE B 69 -4.856 -6.166 -3.004 1.00 0.00 H new ATOM 2349 N PHE B 70 -9.346 -9.301 -0.757 1.00 0.00 N ATOM 2350 CA PHE B 70 -10.790 -9.156 -0.601 1.00 0.00 C ATOM 2351 C PHE B 70 -11.137 -8.696 0.811 1.00 0.00 C ATOM 2352 O PHE B 70 -10.278 -8.664 1.692 1.00 0.00 O ATOM 2353 CB PHE B 70 -11.506 -10.476 -0.907 1.00 0.00 C ATOM 2354 CG PHE B 70 -10.824 -11.312 -1.957 1.00 0.00 C ATOM 2355 CD1 PHE B 70 -9.629 -11.957 -1.681 1.00 0.00 C ATOM 2356 CD2 PHE B 70 -11.382 -11.450 -3.217 1.00 0.00 C ATOM 2357 CE1 PHE B 70 -9.002 -12.725 -2.644 1.00 0.00 C ATOM 2358 CE2 PHE B 70 -10.759 -12.217 -4.185 1.00 0.00 C ATOM 2359 CZ PHE B 70 -9.568 -12.856 -3.897 1.00 0.00 C ATOM 0 H PHE B 70 -8.854 -9.564 0.097 1.00 0.00 H new ATOM 0 HA PHE B 70 -11.128 -8.401 -1.311 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -11.584 -11.057 0.012 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -12.523 -10.259 -1.234 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -9.183 -11.858 -0.703 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -12.313 -10.954 -3.446 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -8.070 -13.222 -2.417 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -11.203 -12.316 -5.165 1.00 0.00 H new ATOM 0 HZ PHE B 70 -9.081 -13.457 -4.651 1.00 0.00 H new ATOM 2369 N CYS B 71 -12.400 -8.341 1.020 1.00 0.00 N ATOM 2370 CA CYS B 71 -12.860 -7.884 2.326 1.00 0.00 C ATOM 2371 C CYS B 71 -12.778 -9.008 3.353 1.00 0.00 C ATOM 2372 O CYS B 71 -12.292 -10.100 3.056 1.00 0.00 O ATOM 2373 CB CYS B 71 -14.297 -7.367 2.232 1.00 0.00 C ATOM 2374 SG CYS B 71 -14.604 -6.285 0.818 1.00 0.00 S ATOM 0 H CYS B 71 -13.124 -8.361 0.301 1.00 0.00 H new ATOM 0 HA CYS B 71 -12.210 -7.071 2.649 1.00 0.00 H new ATOM 0 HB2 CYS B 71 -14.975 -8.219 2.177 1.00 0.00 H new ATOM 0 HB3 CYS B 71 -14.537 -6.827 3.148 1.00 0.00 H new ATOM 2379 N SER B 72 -13.258 -8.735 4.562 1.00 0.00 N ATOM 2380 CA SER B 72 -13.239 -9.726 5.633 1.00 0.00 C ATOM 2381 C SER B 72 -14.578 -10.453 5.729 1.00 0.00 C ATOM 2382 O SER B 72 -14.929 -10.988 6.780 1.00 0.00 O ATOM 2383 CB SER B 72 -12.915 -9.056 6.970 1.00 0.00 C ATOM 2384 OG SER B 72 -12.198 -9.935 7.820 1.00 0.00 O ATOM 0 H SER B 72 -13.664 -7.837 4.825 1.00 0.00 H new ATOM 0 HA SER B 72 -12.465 -10.457 5.402 1.00 0.00 H new ATOM 0 HB2 SER B 72 -12.328 -8.154 6.796 1.00 0.00 H new ATOM 0 HB3 SER B 72 -13.839 -8.746 7.458 1.00 0.00 H new ATOM 0 HG SER B 72 -12.002 -9.483 8.667 1.00 0.00 H new ATOM 2390 N ASN B 73 -15.321 -10.471 4.626 1.00 0.00 N ATOM 2391 CA ASN B 73 -16.618 -11.135 4.587 1.00 0.00 C ATOM 2392 C ASN B 73 -16.915 -11.684 3.194 1.00 0.00 C ATOM 2393 O ASN B 73 -18.070 -11.929 2.847 1.00 0.00 O ATOM 2394 CB ASN B 73 -17.720 -10.162 5.004 1.00 0.00 C ATOM 2395 CG ASN B 73 -18.045 -10.253 6.482 1.00 0.00 C ATOM 2396 OD1 ASN B 73 -18.680 -11.207 6.932 1.00 0.00 O ATOM 2397 ND2 ASN B 73 -17.611 -9.258 7.247 1.00 0.00 N ATOM 0 H ASN B 73 -15.046 -10.033 3.747 1.00 0.00 H new ATOM 0 HA ASN B 73 -16.588 -11.971 5.286 1.00 0.00 H new ATOM 0 HB2 ASN B 73 -17.411 -9.144 4.765 1.00 0.00 H new ATOM 0 HB3 ASN B 73 -18.620 -10.367 4.424 1.00 0.00 H new ATOM 0 HD21 ASN B 73 -17.801 -9.265 8.249 1.00 0.00 H new ATOM 0 HD22 ASN B 73 -17.088 -8.487 6.832 1.00 0.00 H new ATOM 2404 N CYS B 74 -15.867 -11.875 2.401 1.00 0.00 N ATOM 2405 CA CYS B 74 -16.018 -12.394 1.045 1.00 0.00 C ATOM 2406 C CYS B 74 -14.997 -13.494 0.773 1.00 0.00 C ATOM 2407 O CYS B 74 -15.334 -14.550 0.236 1.00 0.00 O ATOM 2408 CB CYS B 74 -15.852 -11.269 0.020 1.00 0.00 C ATOM 2409 SG CYS B 74 -16.667 -9.720 0.476 1.00 0.00 S ATOM 0 H CYS B 74 -14.904 -11.679 2.673 1.00 0.00 H new ATOM 0 HA CYS B 74 -17.020 -12.814 0.953 1.00 0.00 H new ATOM 0 HB2 CYS B 74 -14.788 -11.078 -0.123 1.00 0.00 H new ATOM 0 HB3 CYS B 74 -16.247 -11.605 -0.938 1.00 0.00 H new ATOM 2414 N VAL B 75 -13.749 -13.237 1.148 1.00 0.00 N ATOM 2415 CA VAL B 75 -12.674 -14.200 0.946 1.00 0.00 C ATOM 2416 C VAL B 75 -12.983 -15.528 1.634 1.00 0.00 C ATOM 2417 O VAL B 75 -12.525 -16.584 1.199 1.00 0.00 O ATOM 2418 CB VAL B 75 -11.331 -13.655 1.473 1.00 0.00 C ATOM 2419 CG1 VAL B 75 -11.360 -13.510 2.988 1.00 0.00 C ATOM 2420 CG2 VAL B 75 -10.180 -14.548 1.036 1.00 0.00 C ATOM 0 H VAL B 75 -13.457 -12.368 1.594 1.00 0.00 H new ATOM 0 HA VAL B 75 -12.594 -14.367 -0.128 1.00 0.00 H new ATOM 0 HB VAL B 75 -11.175 -12.665 1.044 1.00 0.00 H new ATOM 0 HG11 VAL B 75 -10.401 -13.124 3.335 1.00 0.00 H new ATOM 0 HG12 VAL B 75 -12.154 -12.819 3.272 1.00 0.00 H new ATOM 0 HG13 VAL B 75 -11.546 -14.483 3.443 1.00 0.00 H new ATOM 0 HG21 VAL B 75 -9.242 -14.146 1.418 1.00 0.00 H new ATOM 0 HG22 VAL B 75 -10.330 -15.554 1.429 1.00 0.00 H new ATOM 0 HG23 VAL B 75 -10.142 -14.586 -0.053 1.00 0.00 H new ATOM 2430 N SER B 76 -13.761 -15.465 2.710 1.00 0.00 N ATOM 2431 CA SER B 76 -14.131 -16.660 3.460 1.00 0.00 C ATOM 2432 C SER B 76 -14.962 -17.607 2.600 1.00 0.00 C ATOM 2433 O SER B 76 -16.189 -17.635 2.698 1.00 0.00 O ATOM 2434 CB SER B 76 -14.911 -16.277 4.718 1.00 0.00 C ATOM 2435 OG SER B 76 -15.386 -17.428 5.395 1.00 0.00 O ATOM 0 H SER B 76 -14.148 -14.598 3.082 1.00 0.00 H new ATOM 0 HA SER B 76 -13.215 -17.173 3.752 1.00 0.00 H new ATOM 0 HB2 SER B 76 -14.271 -15.698 5.384 1.00 0.00 H new ATOM 0 HB3 SER B 76 -15.751 -15.638 4.448 1.00 0.00 H new ATOM 0 HG SER B 76 -15.880 -17.156 6.196 1.00 0.00 H new ATOM 2441 N ASP B 77 -14.285 -18.383 1.762 1.00 0.00 N ATOM 2442 CA ASP B 77 -14.958 -19.334 0.885 1.00 0.00 C ATOM 2443 C ASP B 77 -14.060 -20.529 0.585 1.00 0.00 C ATOM 2444 O ASP B 77 -14.490 -21.679 0.666 1.00 0.00 O ATOM 2445 CB ASP B 77 -15.372 -18.652 -0.421 1.00 0.00 C ATOM 2446 CG ASP B 77 -16.381 -19.467 -1.205 1.00 0.00 C ATOM 2447 OD1 ASP B 77 -15.970 -20.442 -1.868 1.00 0.00 O ATOM 2448 OD2 ASP B 77 -17.584 -19.131 -1.155 1.00 0.00 O ATOM 0 H ASP B 77 -13.269 -18.372 1.671 1.00 0.00 H new ATOM 0 HA ASP B 77 -15.850 -19.693 1.398 1.00 0.00 H new ATOM 0 HB2 ASP B 77 -15.795 -17.673 -0.198 1.00 0.00 H new ATOM 0 HB3 ASP B 77 -14.488 -18.485 -1.036 1.00 0.00 H new ATOM 2453 N CYS B 78 -12.807 -20.248 0.239 1.00 0.00 N ATOM 2454 CA CYS B 78 -11.845 -21.299 -0.072 1.00 0.00 C ATOM 2455 C CYS B 78 -10.547 -21.093 0.700 1.00 0.00 C ATOM 2456 O CYS B 78 -9.458 -21.347 0.184 1.00 0.00 O ATOM 2457 CB CYS B 78 -11.560 -21.329 -1.575 1.00 0.00 C ATOM 2458 SG CYS B 78 -11.248 -19.702 -2.299 1.00 0.00 S ATOM 0 H CYS B 78 -12.435 -19.301 0.167 1.00 0.00 H new ATOM 0 HA CYS B 78 -12.277 -22.254 0.228 1.00 0.00 H new ATOM 0 HB2 CYS B 78 -10.696 -21.968 -1.758 1.00 0.00 H new ATOM 0 HB3 CYS B 78 -12.408 -21.786 -2.086 1.00 0.00 H new ATOM 0 HG CYS B 78 -10.199 -19.173 -1.743 1.00 0.00 H new ATOM 2464 N ILE B 79 -10.669 -20.631 1.941 1.00 0.00 N ATOM 2465 CA ILE B 79 -9.505 -20.391 2.784 1.00 0.00 C ATOM 2466 C ILE B 79 -8.963 -21.695 3.358 1.00 0.00 C ATOM 2467 O ILE B 79 -9.726 -22.589 3.724 1.00 0.00 O ATOM 2468 CB ILE B 79 -9.840 -19.433 3.944 1.00 0.00 C ATOM 2469 CG1 ILE B 79 -10.575 -18.200 3.418 1.00 0.00 C ATOM 2470 CG2 ILE B 79 -8.571 -19.026 4.678 1.00 0.00 C ATOM 2471 CD1 ILE B 79 -9.741 -17.354 2.481 1.00 0.00 C ATOM 0 H ILE B 79 -11.562 -20.416 2.384 1.00 0.00 H new ATOM 0 HA ILE B 79 -8.745 -19.933 2.151 1.00 0.00 H new ATOM 0 HB ILE B 79 -10.493 -19.951 4.647 1.00 0.00 H new ATOM 0 HG12 ILE B 79 -11.479 -18.519 2.899 1.00 0.00 H new ATOM 0 HG13 ILE B 79 -10.892 -17.588 4.262 1.00 0.00 H new ATOM 0 HG21 ILE B 79 -8.824 -18.349 5.494 1.00 0.00 H new ATOM 0 HG22 ILE B 79 -8.083 -19.914 5.080 1.00 0.00 H new ATOM 0 HG23 ILE B 79 -7.896 -18.523 3.986 1.00 0.00 H new ATOM 0 HD11 ILE B 79 -10.326 -16.497 2.147 1.00 0.00 H new ATOM 0 HD12 ILE B 79 -8.850 -17.004 3.002 1.00 0.00 H new ATOM 0 HD13 ILE B 79 -9.446 -17.950 1.618 1.00 0.00 H new ATOM 2483 N GLY B 80 -7.640 -21.798 3.430 1.00 0.00 N ATOM 2484 CA GLY B 80 -7.017 -22.997 3.958 1.00 0.00 C ATOM 2485 C GLY B 80 -6.604 -23.964 2.865 1.00 0.00 C ATOM 2486 O GLY B 80 -5.668 -24.743 3.039 1.00 0.00 O ATOM 0 H GLY B 80 -6.988 -21.072 3.132 1.00 0.00 H new ATOM 0 HA2 GLY B 80 -6.141 -22.720 4.544 1.00 0.00 H new ATOM 0 HA3 GLY B 80 -7.710 -23.494 4.637 1.00 0.00 H new ATOM 2490 N THR B 81 -7.304 -23.912 1.737 1.00 0.00 N ATOM 2491 CA THR B 81 -7.006 -24.789 0.611 1.00 0.00 C ATOM 2492 C THR B 81 -6.216 -24.048 -0.462 1.00 0.00 C ATOM 2493 O THR B 81 -5.402 -24.641 -1.170 1.00 0.00 O ATOM 2494 CB THR B 81 -8.301 -25.346 0.015 1.00 0.00 C ATOM 2495 OG1 THR B 81 -8.019 -26.287 -1.006 1.00 0.00 O ATOM 2496 CG2 THR B 81 -9.195 -24.279 -0.578 1.00 0.00 C ATOM 0 H THR B 81 -8.082 -23.272 1.578 1.00 0.00 H new ATOM 0 HA THR B 81 -6.398 -25.616 0.978 1.00 0.00 H new ATOM 0 HB THR B 81 -8.825 -25.813 0.849 1.00 0.00 H new ATOM 0 HG1 THR B 81 -8.859 -26.633 -1.373 1.00 0.00 H new ATOM 0 HG21 THR B 81 -10.095 -24.742 -0.983 1.00 0.00 H new ATOM 0 HG22 THR B 81 -9.472 -23.564 0.197 1.00 0.00 H new ATOM 0 HG23 THR B 81 -8.663 -23.761 -1.376 1.00 0.00 H new ATOM 2504 N GLY B 82 -6.462 -22.746 -0.577 1.00 0.00 N ATOM 2505 CA GLY B 82 -5.766 -21.944 -1.566 1.00 0.00 C ATOM 2506 C GLY B 82 -6.700 -21.392 -2.625 1.00 0.00 C ATOM 2507 O GLY B 82 -7.616 -22.081 -3.074 1.00 0.00 O ATOM 0 H GLY B 82 -7.131 -22.233 -0.003 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -5.258 -21.118 -1.068 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -4.996 -22.550 -2.044 1.00 0.00 H new ATOM 2511 N CYS B 83 -6.468 -20.146 -3.024 1.00 0.00 N ATOM 2512 CA CYS B 83 -7.296 -19.499 -4.037 1.00 0.00 C ATOM 2513 C CYS B 83 -7.344 -20.332 -5.319 1.00 0.00 C ATOM 2514 O CYS B 83 -6.324 -20.522 -5.980 1.00 0.00 O ATOM 2515 CB CYS B 83 -6.757 -18.101 -4.347 1.00 0.00 C ATOM 2516 SG CYS B 83 -7.695 -17.209 -5.610 1.00 0.00 S ATOM 0 H CYS B 83 -5.713 -19.563 -2.662 1.00 0.00 H new ATOM 0 HA CYS B 83 -8.308 -19.414 -3.642 1.00 0.00 H new ATOM 0 HB2 CYS B 83 -6.754 -17.513 -3.429 1.00 0.00 H new ATOM 0 HB3 CYS B 83 -5.721 -18.187 -4.673 1.00 0.00 H new ATOM 2521 N PRO B 84 -8.533 -20.839 -5.691 1.00 0.00 N ATOM 2522 CA PRO B 84 -8.698 -21.650 -6.902 1.00 0.00 C ATOM 2523 C PRO B 84 -8.617 -20.818 -8.180 1.00 0.00 C ATOM 2524 O PRO B 84 -8.611 -21.364 -9.284 1.00 0.00 O ATOM 2525 CB PRO B 84 -10.098 -22.243 -6.740 1.00 0.00 C ATOM 2526 CG PRO B 84 -10.830 -21.254 -5.902 1.00 0.00 C ATOM 2527 CD PRO B 84 -9.808 -20.665 -4.967 1.00 0.00 C ATOM 0 HA PRO B 84 -7.910 -22.396 -7.002 1.00 0.00 H new ATOM 0 HB2 PRO B 84 -10.584 -22.381 -7.706 1.00 0.00 H new ATOM 0 HB3 PRO B 84 -10.061 -23.220 -6.259 1.00 0.00 H new ATOM 0 HG2 PRO B 84 -11.285 -20.480 -6.520 1.00 0.00 H new ATOM 0 HG3 PRO B 84 -11.636 -21.734 -5.347 1.00 0.00 H new ATOM 0 HD2 PRO B 84 -10.012 -19.614 -4.761 1.00 0.00 H new ATOM 0 HD3 PRO B 84 -9.798 -21.182 -4.007 1.00 0.00 H new ATOM 2535 N VAL B 85 -8.553 -19.498 -8.028 1.00 0.00 N ATOM 2536 CA VAL B 85 -8.473 -18.602 -9.176 1.00 0.00 C ATOM 2537 C VAL B 85 -7.033 -18.168 -9.435 1.00 0.00 C ATOM 2538 O VAL B 85 -6.671 -17.821 -10.559 1.00 0.00 O ATOM 2539 CB VAL B 85 -9.347 -17.349 -8.975 1.00 0.00 C ATOM 2540 CG1 VAL B 85 -9.394 -16.515 -10.247 1.00 0.00 C ATOM 2541 CG2 VAL B 85 -10.750 -17.740 -8.532 1.00 0.00 C ATOM 0 H VAL B 85 -8.555 -19.027 -7.123 1.00 0.00 H new ATOM 0 HA VAL B 85 -8.843 -19.158 -10.037 1.00 0.00 H new ATOM 0 HB VAL B 85 -8.899 -16.741 -8.189 1.00 0.00 H new ATOM 0 HG11 VAL B 85 -10.016 -15.635 -10.083 1.00 0.00 H new ATOM 0 HG12 VAL B 85 -8.385 -16.201 -10.514 1.00 0.00 H new ATOM 0 HG13 VAL B 85 -9.814 -17.111 -11.057 1.00 0.00 H new ATOM 0 HG21 VAL B 85 -11.352 -16.842 -8.395 1.00 0.00 H new ATOM 0 HG22 VAL B 85 -11.209 -18.372 -9.292 1.00 0.00 H new ATOM 0 HG23 VAL B 85 -10.695 -18.287 -7.591 1.00 0.00 H new ATOM 2551 N CYS B 86 -6.216 -18.190 -8.388 1.00 0.00 N ATOM 2552 CA CYS B 86 -4.816 -17.800 -8.502 1.00 0.00 C ATOM 2553 C CYS B 86 -3.900 -19.020 -8.438 1.00 0.00 C ATOM 2554 O CYS B 86 -2.777 -18.990 -8.941 1.00 0.00 O ATOM 2555 CB CYS B 86 -4.450 -16.814 -7.391 1.00 0.00 C ATOM 2556 SG CYS B 86 -4.868 -15.095 -7.761 1.00 0.00 S ATOM 0 H CYS B 86 -6.499 -18.474 -7.450 1.00 0.00 H new ATOM 0 HA CYS B 86 -4.677 -17.318 -9.470 1.00 0.00 H new ATOM 0 HB2 CYS B 86 -4.959 -17.111 -6.474 1.00 0.00 H new ATOM 0 HB3 CYS B 86 -3.380 -16.883 -7.197 1.00 0.00 H new ATOM 2561 N TYR B 87 -4.385 -20.090 -7.816 1.00 0.00 N ATOM 2562 CA TYR B 87 -3.609 -21.320 -7.688 1.00 0.00 C ATOM 2563 C TYR B 87 -2.384 -21.100 -6.805 1.00 0.00 C ATOM 2564 O TYR B 87 -1.289 -21.571 -7.115 1.00 0.00 O ATOM 2565 CB TYR B 87 -3.178 -21.826 -9.066 1.00 0.00 C ATOM 2566 CG TYR B 87 -4.290 -21.815 -10.091 1.00 0.00 C ATOM 2567 CD1 TYR B 87 -5.134 -22.908 -10.238 1.00 0.00 C ATOM 2568 CD2 TYR B 87 -4.494 -20.712 -10.911 1.00 0.00 C ATOM 2569 CE1 TYR B 87 -6.151 -22.902 -11.174 1.00 0.00 C ATOM 2570 CE2 TYR B 87 -5.509 -20.699 -11.849 1.00 0.00 C ATOM 2571 CZ TYR B 87 -6.334 -21.796 -11.976 1.00 0.00 C ATOM 2572 OH TYR B 87 -7.346 -21.786 -12.909 1.00 0.00 O ATOM 0 H TYR B 87 -5.312 -20.131 -7.392 1.00 0.00 H new ATOM 0 HA TYR B 87 -4.243 -22.072 -7.218 1.00 0.00 H new ATOM 0 HB2 TYR B 87 -2.355 -21.210 -9.429 1.00 0.00 H new ATOM 0 HB3 TYR B 87 -2.796 -22.842 -8.967 1.00 0.00 H new ATOM 0 HD1 TYR B 87 -4.994 -23.776 -9.611 1.00 0.00 H new ATOM 0 HD2 TYR B 87 -3.849 -19.851 -10.814 1.00 0.00 H new ATOM 0 HE1 TYR B 87 -6.799 -23.760 -11.276 1.00 0.00 H new ATOM 0 HE2 TYR B 87 -5.655 -19.834 -12.479 1.00 0.00 H new ATOM 0 HH TYR B 87 -7.339 -20.932 -13.390 1.00 0.00 H new ATOM 2582 N THR B 88 -2.577 -20.383 -5.703 1.00 0.00 N ATOM 2583 CA THR B 88 -1.488 -20.102 -4.773 1.00 0.00 C ATOM 2584 C THR B 88 -1.923 -20.360 -3.332 1.00 0.00 C ATOM 2585 O THR B 88 -3.062 -20.074 -2.960 1.00 0.00 O ATOM 2586 CB THR B 88 -1.021 -18.654 -4.927 1.00 0.00 C ATOM 2587 OG1 THR B 88 -0.622 -18.394 -6.261 1.00 0.00 O ATOM 2588 CG2 THR B 88 0.139 -18.299 -4.022 1.00 0.00 C ATOM 0 H THR B 88 -3.476 -19.986 -5.432 1.00 0.00 H new ATOM 0 HA THR B 88 -0.660 -20.770 -5.008 1.00 0.00 H new ATOM 0 HB THR B 88 -1.879 -18.043 -4.646 1.00 0.00 H new ATOM 0 HG1 THR B 88 0.076 -17.706 -6.265 1.00 0.00 H new ATOM 0 HG21 THR B 88 0.420 -17.258 -4.182 1.00 0.00 H new ATOM 0 HG22 THR B 88 -0.155 -18.440 -2.982 1.00 0.00 H new ATOM 0 HG23 THR B 88 0.988 -18.943 -4.249 1.00 0.00 H new ATOM 2596 N PRO B 89 -1.021 -20.904 -2.496 1.00 0.00 N ATOM 2597 CA PRO B 89 -1.324 -21.196 -1.091 1.00 0.00 C ATOM 2598 C PRO B 89 -1.877 -19.982 -0.355 1.00 0.00 C ATOM 2599 O PRO B 89 -1.491 -18.846 -0.633 1.00 0.00 O ATOM 2600 CB PRO B 89 0.034 -21.600 -0.509 1.00 0.00 C ATOM 2601 CG PRO B 89 0.816 -22.093 -1.676 1.00 0.00 C ATOM 2602 CD PRO B 89 0.361 -21.278 -2.853 1.00 0.00 C ATOM 0 HA PRO B 89 -2.091 -21.965 -0.991 1.00 0.00 H new ATOM 0 HB2 PRO B 89 0.527 -20.754 -0.031 1.00 0.00 H new ATOM 0 HB3 PRO B 89 -0.075 -22.375 0.250 1.00 0.00 H new ATOM 0 HG2 PRO B 89 1.886 -21.972 -1.508 1.00 0.00 H new ATOM 0 HG3 PRO B 89 0.638 -23.155 -1.845 1.00 0.00 H new ATOM 0 HD2 PRO B 89 0.990 -20.400 -3.001 1.00 0.00 H new ATOM 0 HD3 PRO B 89 0.395 -21.854 -3.778 1.00 0.00 H new ATOM 2610 N ALA B 90 -2.784 -20.227 0.584 1.00 0.00 N ATOM 2611 CA ALA B 90 -3.391 -19.153 1.360 1.00 0.00 C ATOM 2612 C ALA B 90 -2.459 -18.683 2.471 1.00 0.00 C ATOM 2613 O ALA B 90 -2.518 -17.531 2.900 1.00 0.00 O ATOM 2614 CB ALA B 90 -4.723 -19.605 1.940 1.00 0.00 C ATOM 0 H ALA B 90 -3.115 -21.161 0.826 1.00 0.00 H new ATOM 0 HA ALA B 90 -3.568 -18.311 0.690 1.00 0.00 H new ATOM 0 HB1 ALA B 90 -5.163 -18.792 2.517 1.00 0.00 H new ATOM 0 HB2 ALA B 90 -5.397 -19.882 1.130 1.00 0.00 H new ATOM 0 HB3 ALA B 90 -4.564 -20.466 2.590 1.00 0.00 H new ATOM 2620 N TRP B 91 -1.597 -19.581 2.929 1.00 0.00 N ATOM 2621 CA TRP B 91 -0.647 -19.261 3.991 1.00 0.00 C ATOM 2622 C TRP B 91 -1.365 -18.803 5.258 1.00 0.00 C ATOM 2623 O TRP B 91 -0.768 -18.156 6.118 1.00 0.00 O ATOM 2624 CB TRP B 91 0.317 -18.173 3.521 1.00 0.00 C ATOM 2625 CG TRP B 91 1.569 -18.714 2.901 1.00 0.00 C ATOM 2626 CD1 TRP B 91 2.513 -19.493 3.506 1.00 0.00 C ATOM 2627 CD2 TRP B 91 2.014 -18.514 1.554 1.00 0.00 C ATOM 2628 NE1 TRP B 91 3.517 -19.791 2.617 1.00 0.00 N ATOM 2629 CE2 TRP B 91 3.234 -19.203 1.412 1.00 0.00 C ATOM 2630 CE3 TRP B 91 1.498 -17.823 0.454 1.00 0.00 C ATOM 2631 CZ2 TRP B 91 3.946 -19.217 0.216 1.00 0.00 C ATOM 2632 CZ3 TRP B 91 2.206 -17.839 -0.733 1.00 0.00 C ATOM 2633 CH2 TRP B 91 3.418 -18.531 -0.845 1.00 0.00 C ATOM 0 H TRP B 91 -1.535 -20.538 2.583 1.00 0.00 H new ATOM 0 HA TRP B 91 -0.088 -20.167 4.225 1.00 0.00 H new ATOM 0 HB2 TRP B 91 -0.191 -17.535 2.798 1.00 0.00 H new ATOM 0 HB3 TRP B 91 0.584 -17.543 4.370 1.00 0.00 H new ATOM 0 HD1 TRP B 91 2.476 -19.826 4.533 1.00 0.00 H new ATOM 0 HE1 TRP B 91 4.340 -20.358 2.821 1.00 0.00 H new ATOM 0 HE3 TRP B 91 0.564 -17.287 0.530 1.00 0.00 H new ATOM 0 HZ2 TRP B 91 4.881 -19.750 0.128 1.00 0.00 H new ATOM 0 HZ3 TRP B 91 1.817 -17.308 -1.589 1.00 0.00 H new ATOM 0 HH2 TRP B 91 3.947 -18.524 -1.787 1.00 0.00 H new ATOM 2644 N ILE B 92 -2.645 -19.141 5.369 1.00 0.00 N ATOM 2645 CA ILE B 92 -3.437 -18.761 6.533 1.00 0.00 C ATOM 2646 C ILE B 92 -4.658 -19.661 6.684 1.00 0.00 C ATOM 2647 O ILE B 92 -5.436 -19.833 5.745 1.00 0.00 O ATOM 2648 CB ILE B 92 -3.903 -17.296 6.443 1.00 0.00 C ATOM 2649 CG1 ILE B 92 -4.514 -17.013 5.069 1.00 0.00 C ATOM 2650 CG2 ILE B 92 -2.741 -16.352 6.716 1.00 0.00 C ATOM 2651 CD1 ILE B 92 -5.745 -16.136 5.124 1.00 0.00 C ATOM 0 H ILE B 92 -3.156 -19.677 4.668 1.00 0.00 H new ATOM 0 HA ILE B 92 -2.792 -18.876 7.404 1.00 0.00 H new ATOM 0 HB ILE B 92 -4.668 -17.128 7.201 1.00 0.00 H new ATOM 0 HG12 ILE B 92 -3.765 -16.534 4.439 1.00 0.00 H new ATOM 0 HG13 ILE B 92 -4.773 -17.959 4.594 1.00 0.00 H new ATOM 0 HG21 ILE B 92 -3.087 -15.320 6.649 1.00 0.00 H new ATOM 0 HG22 ILE B 92 -2.348 -16.538 7.715 1.00 0.00 H new ATOM 0 HG23 ILE B 92 -1.955 -16.520 5.980 1.00 0.00 H new ATOM 0 HD11 ILE B 92 -6.124 -15.977 4.114 1.00 0.00 H new ATOM 0 HD12 ILE B 92 -6.512 -16.622 5.727 1.00 0.00 H new ATOM 0 HD13 ILE B 92 -5.488 -15.175 5.570 1.00 0.00 H new ATOM 2663 N GLN B 93 -4.823 -20.234 7.872 1.00 0.00 N ATOM 2664 CA GLN B 93 -5.951 -21.116 8.146 1.00 0.00 C ATOM 2665 C GLN B 93 -7.131 -20.331 8.709 1.00 0.00 C ATOM 2666 O GLN B 93 -8.288 -20.666 8.458 1.00 0.00 O ATOM 2667 CB GLN B 93 -5.538 -22.216 9.128 1.00 0.00 C ATOM 2668 CG GLN B 93 -5.031 -23.477 8.450 1.00 0.00 C ATOM 2669 CD GLN B 93 -6.140 -24.470 8.161 1.00 0.00 C ATOM 2670 OE1 GLN B 93 -6.645 -25.135 9.066 1.00 0.00 O ATOM 2671 NE2 GLN B 93 -6.524 -24.577 6.894 1.00 0.00 N ATOM 0 H GLN B 93 -4.189 -20.103 8.660 1.00 0.00 H new ATOM 0 HA GLN B 93 -6.259 -21.575 7.206 1.00 0.00 H new ATOM 0 HB2 GLN B 93 -4.760 -21.830 9.787 1.00 0.00 H new ATOM 0 HB3 GLN B 93 -6.392 -22.470 9.757 1.00 0.00 H new ATOM 0 HG2 GLN B 93 -4.536 -23.209 7.517 1.00 0.00 H new ATOM 0 HG3 GLN B 93 -4.281 -23.950 9.084 1.00 0.00 H new ATOM 0 HE21 GLN B 93 -6.078 -24.006 6.176 1.00 0.00 H new ATOM 0 HE22 GLN B 93 -7.265 -25.230 6.639 1.00 0.00 H new ATOM 2680 N ASP B 94 -6.830 -19.285 9.471 1.00 0.00 N ATOM 2681 CA ASP B 94 -7.866 -18.453 10.070 1.00 0.00 C ATOM 2682 C ASP B 94 -8.112 -17.202 9.232 1.00 0.00 C ATOM 2683 O ASP B 94 -7.389 -16.934 8.272 1.00 0.00 O ATOM 2684 CB ASP B 94 -7.472 -18.056 11.494 1.00 0.00 C ATOM 2685 CG ASP B 94 -7.513 -19.230 12.453 1.00 0.00 C ATOM 2686 OD1 ASP B 94 -6.759 -20.202 12.234 1.00 0.00 O ATOM 2687 OD2 ASP B 94 -8.298 -19.178 13.423 1.00 0.00 O ATOM 0 H ASP B 94 -5.877 -18.994 9.688 1.00 0.00 H new ATOM 0 HA ASP B 94 -8.788 -19.034 10.104 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -6.468 -17.632 11.486 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -8.145 -17.276 11.850 1.00 0.00 H new ATOM 2692 N LEU B 95 -9.135 -16.439 9.601 1.00 0.00 N ATOM 2693 CA LEU B 95 -9.477 -15.217 8.882 1.00 0.00 C ATOM 2694 C LEU B 95 -8.596 -14.058 9.334 1.00 0.00 C ATOM 2695 O LEU B 95 -8.987 -13.266 10.192 1.00 0.00 O ATOM 2696 CB LEU B 95 -10.950 -14.868 9.098 1.00 0.00 C ATOM 2697 CG LEU B 95 -11.923 -15.535 8.124 1.00 0.00 C ATOM 2698 CD1 LEU B 95 -11.731 -14.985 6.719 1.00 0.00 C ATOM 2699 CD2 LEU B 95 -11.738 -17.045 8.138 1.00 0.00 C ATOM 0 H LEU B 95 -9.742 -16.645 10.394 1.00 0.00 H new ATOM 0 HA LEU B 95 -9.305 -15.389 7.820 1.00 0.00 H new ATOM 0 HB2 LEU B 95 -11.229 -15.147 10.114 1.00 0.00 H new ATOM 0 HB3 LEU B 95 -11.067 -13.787 9.021 1.00 0.00 H new ATOM 0 HG LEU B 95 -12.941 -15.311 8.444 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -12.431 -15.471 6.039 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -11.913 -13.910 6.721 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -10.711 -15.179 6.388 1.00 0.00 H new ATOM 0 HD21 LEU B 95 -12.438 -17.504 7.440 1.00 0.00 H new ATOM 0 HD22 LEU B 95 -10.718 -17.289 7.842 1.00 0.00 H new ATOM 0 HD23 LEU B 95 -11.926 -17.425 9.142 1.00 0.00 H new ATOM 2711 N LYS B 96 -7.405 -13.963 8.752 1.00 0.00 N ATOM 2712 CA LYS B 96 -6.468 -12.899 9.094 1.00 0.00 C ATOM 2713 C LYS B 96 -7.045 -11.531 8.740 1.00 0.00 C ATOM 2714 O LYS B 96 -8.173 -11.429 8.258 1.00 0.00 O ATOM 2715 CB LYS B 96 -5.138 -13.108 8.369 1.00 0.00 C ATOM 2716 CG LYS B 96 -4.300 -14.236 8.949 1.00 0.00 C ATOM 2717 CD LYS B 96 -2.816 -13.910 8.900 1.00 0.00 C ATOM 2718 CE LYS B 96 -2.338 -13.293 10.204 1.00 0.00 C ATOM 2719 NZ LYS B 96 -2.254 -11.809 10.120 1.00 0.00 N ATOM 0 H LYS B 96 -7.066 -14.611 8.041 1.00 0.00 H new ATOM 0 HA LYS B 96 -6.296 -12.933 10.170 1.00 0.00 H new ATOM 0 HB2 LYS B 96 -5.336 -13.317 7.318 1.00 0.00 H new ATOM 0 HB3 LYS B 96 -4.563 -12.183 8.408 1.00 0.00 H new ATOM 0 HG2 LYS B 96 -4.599 -14.419 9.981 1.00 0.00 H new ATOM 0 HG3 LYS B 96 -4.490 -15.155 8.394 1.00 0.00 H new ATOM 0 HD2 LYS B 96 -2.249 -14.819 8.697 1.00 0.00 H new ATOM 0 HD3 LYS B 96 -2.620 -13.222 8.078 1.00 0.00 H new ATOM 0 HE2 LYS B 96 -3.018 -13.573 11.008 1.00 0.00 H new ATOM 0 HE3 LYS B 96 -1.359 -13.698 10.459 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 -1.908 -11.429 11.024 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 -1.599 -11.541 9.358 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 -3.197 -11.419 9.919 1.00 0.00 H new ATOM 2733 N ILE B 97 -6.264 -10.485 8.983 1.00 0.00 N ATOM 2734 CA ILE B 97 -6.697 -9.124 8.691 1.00 0.00 C ATOM 2735 C ILE B 97 -5.653 -8.378 7.867 1.00 0.00 C ATOM 2736 O ILE B 97 -4.473 -8.727 7.880 1.00 0.00 O ATOM 2737 CB ILE B 97 -6.975 -8.333 9.985 1.00 0.00 C ATOM 2738 CG1 ILE B 97 -7.906 -9.127 10.903 1.00 0.00 C ATOM 2739 CG2 ILE B 97 -7.574 -6.972 9.660 1.00 0.00 C ATOM 2740 CD1 ILE B 97 -9.295 -9.319 10.336 1.00 0.00 C ATOM 0 H ILE B 97 -5.328 -10.553 9.382 1.00 0.00 H new ATOM 0 HA ILE B 97 -7.620 -9.203 8.116 1.00 0.00 H new ATOM 0 HB ILE B 97 -6.030 -8.174 10.505 1.00 0.00 H new ATOM 0 HG12 ILE B 97 -7.464 -10.104 11.098 1.00 0.00 H new ATOM 0 HG13 ILE B 97 -7.982 -8.614 11.862 1.00 0.00 H new ATOM 0 HG21 ILE B 97 -7.764 -6.428 10.585 1.00 0.00 H new ATOM 0 HG22 ILE B 97 -6.877 -6.406 9.042 1.00 0.00 H new ATOM 0 HG23 ILE B 97 -8.511 -7.107 9.120 1.00 0.00 H new ATOM 0 HD11 ILE B 97 -9.900 -9.890 11.040 1.00 0.00 H new ATOM 0 HD12 ILE B 97 -9.757 -8.346 10.167 1.00 0.00 H new ATOM 0 HD13 ILE B 97 -9.231 -9.859 9.391 1.00 0.00 H new ATOM 2752 N ASN B 98 -6.097 -7.349 7.153 1.00 0.00 N ATOM 2753 CA ASN B 98 -5.203 -6.551 6.323 1.00 0.00 C ATOM 2754 C ASN B 98 -4.962 -5.180 6.949 1.00 0.00 C ATOM 2755 O ASN B 98 -5.740 -4.249 6.745 1.00 0.00 O ATOM 2756 CB ASN B 98 -5.786 -6.391 4.917 1.00 0.00 C ATOM 2757 CG ASN B 98 -4.996 -7.157 3.874 1.00 0.00 C ATOM 2758 OD1 ASN B 98 -5.561 -7.903 3.073 1.00 0.00 O ATOM 2759 ND2 ASN B 98 -3.680 -6.976 3.877 1.00 0.00 N ATOM 0 H ASN B 98 -7.071 -7.048 7.133 1.00 0.00 H new ATOM 0 HA ASN B 98 -4.248 -7.071 6.253 1.00 0.00 H new ATOM 0 HB2 ASN B 98 -6.819 -6.738 4.913 1.00 0.00 H new ATOM 0 HB3 ASN B 98 -5.804 -5.334 4.652 1.00 0.00 H new ATOM 0 HD21 ASN B 98 -3.096 -7.464 3.198 1.00 0.00 H new ATOM 0 HD22 ASN B 98 -3.253 -6.349 4.558 1.00 0.00 H new ATOM 2766 N ARG B 99 -3.882 -5.067 7.715 1.00 0.00 N ATOM 2767 CA ARG B 99 -3.541 -3.811 8.374 1.00 0.00 C ATOM 2768 C ARG B 99 -3.099 -2.762 7.358 1.00 0.00 C ATOM 2769 O ARG B 99 -3.696 -1.690 7.259 1.00 0.00 O ATOM 2770 CB ARG B 99 -2.434 -4.037 9.405 1.00 0.00 C ATOM 2771 CG ARG B 99 -2.939 -4.604 10.723 1.00 0.00 C ATOM 2772 CD ARG B 99 -3.044 -3.527 11.790 1.00 0.00 C ATOM 2773 NE ARG B 99 -4.176 -3.751 12.686 1.00 0.00 N ATOM 2774 CZ ARG B 99 -4.567 -2.884 13.618 1.00 0.00 C ATOM 2775 NH1 ARG B 99 -3.921 -1.737 13.779 1.00 0.00 N ATOM 2776 NH2 ARG B 99 -5.608 -3.166 14.390 1.00 0.00 N ATOM 0 H ARG B 99 -3.228 -5.829 7.895 1.00 0.00 H new ATOM 0 HA ARG B 99 -4.433 -3.444 8.881 1.00 0.00 H new ATOM 0 HB2 ARG B 99 -1.692 -4.717 8.987 1.00 0.00 H new ATOM 0 HB3 ARG B 99 -1.927 -3.091 9.596 1.00 0.00 H new ATOM 0 HG2 ARG B 99 -3.916 -5.064 10.572 1.00 0.00 H new ATOM 0 HG3 ARG B 99 -2.266 -5.390 11.064 1.00 0.00 H new ATOM 0 HD2 ARG B 99 -2.122 -3.501 12.371 1.00 0.00 H new ATOM 0 HD3 ARG B 99 -3.147 -2.553 11.312 1.00 0.00 H new ATOM 0 HE ARG B 99 -4.697 -4.623 12.592 1.00 0.00 H new ATOM 0 HH11 ARG B 99 -3.120 -1.515 13.187 1.00 0.00 H new ATOM 0 HH12 ARG B 99 -4.225 -1.077 14.494 1.00 0.00 H new ATOM 0 HH21 ARG B 99 -6.109 -4.047 14.270 1.00 0.00 H new ATOM 0 HH22 ARG B 99 -5.908 -2.502 15.104 1.00 0.00 H new ATOM 2790 N GLN B 100 -2.048 -3.077 6.607 1.00 0.00 N ATOM 2791 CA GLN B 100 -1.528 -2.158 5.600 1.00 0.00 C ATOM 2792 C GLN B 100 -2.593 -1.830 4.559 1.00 0.00 C ATOM 2793 O GLN B 100 -2.787 -0.669 4.200 1.00 0.00 O ATOM 2794 CB GLN B 100 -0.295 -2.757 4.919 1.00 0.00 C ATOM 2795 CG GLN B 100 0.874 -2.981 5.865 1.00 0.00 C ATOM 2796 CD GLN B 100 1.817 -1.795 5.916 1.00 0.00 C ATOM 2797 OE1 GLN B 100 2.933 -1.853 5.400 1.00 0.00 O ATOM 2798 NE2 GLN B 100 1.374 -0.711 6.543 1.00 0.00 N ATOM 0 H GLN B 100 -1.541 -3.959 6.676 1.00 0.00 H new ATOM 0 HA GLN B 100 -1.242 -1.233 6.102 1.00 0.00 H new ATOM 0 HB2 GLN B 100 -0.569 -3.708 4.462 1.00 0.00 H new ATOM 0 HB3 GLN B 100 0.022 -2.095 4.113 1.00 0.00 H new ATOM 0 HG2 GLN B 100 0.493 -3.181 6.866 1.00 0.00 H new ATOM 0 HG3 GLN B 100 1.426 -3.867 5.551 1.00 0.00 H new ATOM 0 HE21 GLN B 100 0.442 -0.706 6.957 1.00 0.00 H new ATOM 0 HE22 GLN B 100 1.966 0.117 6.611 1.00 0.00 H new ATOM 2807 N LEU B 101 -3.283 -2.859 4.077 1.00 0.00 N ATOM 2808 CA LEU B 101 -4.329 -2.677 3.077 1.00 0.00 C ATOM 2809 C LEU B 101 -5.407 -1.724 3.587 1.00 0.00 C ATOM 2810 O LEU B 101 -5.796 -0.782 2.895 1.00 0.00 O ATOM 2811 CB LEU B 101 -4.949 -4.026 2.706 1.00 0.00 C ATOM 2812 CG LEU B 101 -4.864 -4.390 1.222 1.00 0.00 C ATOM 2813 CD1 LEU B 101 -5.453 -3.279 0.366 1.00 0.00 C ATOM 2814 CD2 LEU B 101 -3.423 -4.667 0.823 1.00 0.00 C ATOM 0 H LEU B 101 -3.137 -3.827 4.363 1.00 0.00 H new ATOM 0 HA LEU B 101 -3.878 -2.239 2.187 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -4.456 -4.807 3.285 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -5.997 -4.021 3.004 1.00 0.00 H new ATOM 0 HG LEU B 101 -5.446 -5.296 1.055 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -5.384 -3.555 -0.686 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -6.499 -3.129 0.634 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -4.899 -2.356 0.536 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -3.382 -4.924 -0.235 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -2.818 -3.779 1.005 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -3.035 -5.497 1.414 1.00 0.00 H new ATOM 2826 N ASP B 102 -5.886 -1.974 4.802 1.00 0.00 N ATOM 2827 CA ASP B 102 -6.917 -1.137 5.404 1.00 0.00 C ATOM 2828 C ASP B 102 -6.416 0.291 5.594 1.00 0.00 C ATOM 2829 O ASP B 102 -7.132 1.254 5.317 1.00 0.00 O ATOM 2830 CB ASP B 102 -7.354 -1.719 6.750 1.00 0.00 C ATOM 2831 CG ASP B 102 -8.541 -0.983 7.341 1.00 0.00 C ATOM 2832 OD1 ASP B 102 -9.295 -0.356 6.568 1.00 0.00 O ATOM 2833 OD2 ASP B 102 -8.716 -1.033 8.577 1.00 0.00 O ATOM 0 H ASP B 102 -5.576 -2.749 5.388 1.00 0.00 H new ATOM 0 HA ASP B 102 -7.773 -1.116 4.729 1.00 0.00 H new ATOM 0 HB2 ASP B 102 -7.609 -2.771 6.622 1.00 0.00 H new ATOM 0 HB3 ASP B 102 -6.519 -1.677 7.449 1.00 0.00 H new ATOM 2838 N SER B 103 -5.178 0.420 6.063 1.00 0.00 N ATOM 2839 CA SER B 103 -4.577 1.730 6.286 1.00 0.00 C ATOM 2840 C SER B 103 -4.601 2.559 5.006 1.00 0.00 C ATOM 2841 O SER B 103 -4.720 3.784 5.049 1.00 0.00 O ATOM 2842 CB SER B 103 -3.137 1.577 6.782 1.00 0.00 C ATOM 2843 OG SER B 103 -3.098 1.409 8.188 1.00 0.00 O ATOM 0 H SER B 103 -4.572 -0.367 6.296 1.00 0.00 H new ATOM 0 HA SER B 103 -5.161 2.248 7.047 1.00 0.00 H new ATOM 0 HB2 SER B 103 -2.671 0.719 6.297 1.00 0.00 H new ATOM 0 HB3 SER B 103 -2.557 2.456 6.501 1.00 0.00 H new ATOM 0 HG SER B 103 -2.168 1.312 8.480 1.00 0.00 H new ATOM 2849 N MET B 104 -4.493 1.881 3.869 1.00 0.00 N ATOM 2850 CA MET B 104 -4.509 2.551 2.574 1.00 0.00 C ATOM 2851 C MET B 104 -5.920 3.010 2.222 1.00 0.00 C ATOM 2852 O MET B 104 -6.103 3.997 1.509 1.00 0.00 O ATOM 2853 CB MET B 104 -3.975 1.618 1.486 1.00 0.00 C ATOM 2854 CG MET B 104 -2.523 1.216 1.688 1.00 0.00 C ATOM 2855 SD MET B 104 -1.614 1.095 0.136 1.00 0.00 S ATOM 2856 CE MET B 104 -1.358 2.828 -0.242 1.00 0.00 C ATOM 0 H MET B 104 -4.393 0.867 3.818 1.00 0.00 H new ATOM 0 HA MET B 104 -3.864 3.428 2.636 1.00 0.00 H new ATOM 0 HB2 MET B 104 -4.591 0.719 1.455 1.00 0.00 H new ATOM 0 HB3 MET B 104 -4.076 2.107 0.517 1.00 0.00 H new ATOM 0 HG2 MET B 104 -2.035 1.945 2.335 1.00 0.00 H new ATOM 0 HG3 MET B 104 -2.484 0.256 2.203 1.00 0.00 H new ATOM 0 HE1 MET B 104 -0.838 2.919 -1.196 1.00 0.00 H new ATOM 0 HE2 MET B 104 -2.322 3.333 -0.304 1.00 0.00 H new ATOM 0 HE3 MET B 104 -0.758 3.287 0.544 1.00 0.00 H new ATOM 2866 N ILE B 105 -6.916 2.287 2.728 1.00 0.00 N ATOM 2867 CA ILE B 105 -8.312 2.624 2.469 1.00 0.00 C ATOM 2868 C ILE B 105 -8.628 4.031 2.958 1.00 0.00 C ATOM 2869 O ILE B 105 -9.019 4.898 2.176 1.00 0.00 O ATOM 2870 CB ILE B 105 -9.273 1.628 3.151 1.00 0.00 C ATOM 2871 CG1 ILE B 105 -8.899 0.187 2.795 1.00 0.00 C ATOM 2872 CG2 ILE B 105 -10.711 1.919 2.748 1.00 0.00 C ATOM 2873 CD1 ILE B 105 -9.020 -0.124 1.319 1.00 0.00 C ATOM 0 H ILE B 105 -6.782 1.466 3.318 1.00 0.00 H new ATOM 0 HA ILE B 105 -8.457 2.569 1.390 1.00 0.00 H new ATOM 0 HB ILE B 105 -9.183 1.748 4.231 1.00 0.00 H new ATOM 0 HG12 ILE B 105 -7.874 -0.003 3.115 1.00 0.00 H new ATOM 0 HG13 ILE B 105 -9.539 -0.495 3.355 1.00 0.00 H new ATOM 0 HG21 ILE B 105 -11.377 1.208 3.237 1.00 0.00 H new ATOM 0 HG22 ILE B 105 -10.976 2.932 3.051 1.00 0.00 H new ATOM 0 HG23 ILE B 105 -10.812 1.826 1.667 1.00 0.00 H new ATOM 0 HD11 ILE B 105 -8.739 -1.162 1.142 1.00 0.00 H new ATOM 0 HD12 ILE B 105 -10.049 0.033 0.997 1.00 0.00 H new ATOM 0 HD13 ILE B 105 -8.359 0.532 0.753 1.00 0.00 H new ATOM 2885 N GLN B 106 -8.454 4.253 4.256 1.00 0.00 N ATOM 2886 CA GLN B 106 -8.718 5.558 4.849 1.00 0.00 C ATOM 2887 C GLN B 106 -7.814 6.620 4.234 1.00 0.00 C ATOM 2888 O GLN B 106 -8.228 7.760 4.025 1.00 0.00 O ATOM 2889 CB GLN B 106 -8.511 5.506 6.364 1.00 0.00 C ATOM 2890 CG GLN B 106 -9.645 4.825 7.110 1.00 0.00 C ATOM 2891 CD GLN B 106 -9.936 5.473 8.449 1.00 0.00 C ATOM 2892 OE1 GLN B 106 -9.023 5.905 9.154 1.00 0.00 O ATOM 2893 NE2 GLN B 106 -11.212 5.547 8.807 1.00 0.00 N ATOM 0 H GLN B 106 -8.131 3.546 4.917 1.00 0.00 H new ATOM 0 HA GLN B 106 -9.755 5.823 4.644 1.00 0.00 H new ATOM 0 HB2 GLN B 106 -7.580 4.981 6.577 1.00 0.00 H new ATOM 0 HB3 GLN B 106 -8.397 6.522 6.742 1.00 0.00 H new ATOM 0 HG2 GLN B 106 -10.545 4.850 6.496 1.00 0.00 H new ATOM 0 HG3 GLN B 106 -9.394 3.776 7.266 1.00 0.00 H new ATOM 0 HE21 GLN B 106 -11.937 5.176 8.192 1.00 0.00 H new ATOM 0 HE22 GLN B 106 -11.468 5.975 9.697 1.00 0.00 H new ATOM 2902 N LEU B 107 -6.575 6.235 3.946 1.00 0.00 N ATOM 2903 CA LEU B 107 -5.605 7.148 3.353 1.00 0.00 C ATOM 2904 C LEU B 107 -6.112 7.691 2.019 1.00 0.00 C ATOM 2905 O LEU B 107 -6.217 8.903 1.829 1.00 0.00 O ATOM 2906 CB LEU B 107 -4.264 6.435 3.153 1.00 0.00 C ATOM 2907 CG LEU B 107 -3.049 7.167 3.727 1.00 0.00 C ATOM 2908 CD1 LEU B 107 -2.931 8.559 3.126 1.00 0.00 C ATOM 2909 CD2 LEU B 107 -3.143 7.243 5.243 1.00 0.00 C ATOM 0 H LEU B 107 -6.218 5.294 4.114 1.00 0.00 H new ATOM 0 HA LEU B 107 -5.466 7.987 4.034 1.00 0.00 H new ATOM 0 HB2 LEU B 107 -4.323 5.447 3.610 1.00 0.00 H new ATOM 0 HB3 LEU B 107 -4.106 6.283 2.085 1.00 0.00 H new ATOM 0 HG LEU B 107 -2.152 6.606 3.466 1.00 0.00 H new ATOM 0 HD11 LEU B 107 -2.061 9.064 3.546 1.00 0.00 H new ATOM 0 HD12 LEU B 107 -2.818 8.480 2.045 1.00 0.00 H new ATOM 0 HD13 LEU B 107 -3.829 9.132 3.356 1.00 0.00 H new ATOM 0 HD21 LEU B 107 -2.271 7.766 5.636 1.00 0.00 H new ATOM 0 HD22 LEU B 107 -4.048 7.782 5.525 1.00 0.00 H new ATOM 0 HD23 LEU B 107 -3.178 6.235 5.656 1.00 0.00 H new ATOM 2921 N CYS B 108 -6.427 6.784 1.099 1.00 0.00 N ATOM 2922 CA CYS B 108 -6.925 7.171 -0.217 1.00 0.00 C ATOM 2923 C CYS B 108 -8.177 8.033 -0.091 1.00 0.00 C ATOM 2924 O CYS B 108 -8.433 8.899 -0.928 1.00 0.00 O ATOM 2925 CB CYS B 108 -7.228 5.929 -1.056 1.00 0.00 C ATOM 2926 SG CYS B 108 -7.796 6.291 -2.733 1.00 0.00 S ATOM 0 H CYS B 108 -6.346 5.777 1.240 1.00 0.00 H new ATOM 0 HA CYS B 108 -6.151 7.756 -0.714 1.00 0.00 H new ATOM 0 HB2 CYS B 108 -6.330 5.314 -1.113 1.00 0.00 H new ATOM 0 HB3 CYS B 108 -7.988 5.336 -0.547 1.00 0.00 H new ATOM 0 HG CYS B 108 -8.325 7.478 -2.765 1.00 0.00 H new ATOM 2932 N SER B 109 -8.953 7.790 0.961 1.00 0.00 N ATOM 2933 CA SER B 109 -10.177 8.547 1.197 1.00 0.00 C ATOM 2934 C SER B 109 -9.871 10.034 1.337 1.00 0.00 C ATOM 2935 O SER B 109 -10.625 10.882 0.858 1.00 0.00 O ATOM 2936 CB SER B 109 -10.881 8.038 2.456 1.00 0.00 C ATOM 2937 OG SER B 109 -12.284 8.225 2.367 1.00 0.00 O ATOM 0 H SER B 109 -8.756 7.076 1.662 1.00 0.00 H new ATOM 0 HA SER B 109 -10.836 8.407 0.340 1.00 0.00 H new ATOM 0 HB2 SER B 109 -10.660 6.980 2.597 1.00 0.00 H new ATOM 0 HB3 SER B 109 -10.496 8.564 3.330 1.00 0.00 H new ATOM 0 HG SER B 109 -12.711 7.890 3.183 1.00 0.00 H new ATOM 2943 N LYS B 110 -8.758 10.345 1.994 1.00 0.00 N ATOM 2944 CA LYS B 110 -8.348 11.729 2.194 1.00 0.00 C ATOM 2945 C LYS B 110 -8.010 12.390 0.862 1.00 0.00 C ATOM 2946 O LYS B 110 -8.469 13.493 0.570 1.00 0.00 O ATOM 2947 CB LYS B 110 -7.140 11.797 3.129 1.00 0.00 C ATOM 2948 CG LYS B 110 -7.462 11.424 4.569 1.00 0.00 C ATOM 2949 CD LYS B 110 -6.598 10.272 5.056 1.00 0.00 C ATOM 2950 CE LYS B 110 -5.116 10.610 4.981 1.00 0.00 C ATOM 2951 NZ LYS B 110 -4.542 10.890 6.326 1.00 0.00 N ATOM 0 H LYS B 110 -8.124 9.656 2.397 1.00 0.00 H new ATOM 0 HA LYS B 110 -9.180 12.267 2.649 1.00 0.00 H new ATOM 0 HB2 LYS B 110 -6.363 11.130 2.755 1.00 0.00 H new ATOM 0 HB3 LYS B 110 -6.730 12.807 3.107 1.00 0.00 H new ATOM 0 HG2 LYS B 110 -7.310 12.291 5.212 1.00 0.00 H new ATOM 0 HG3 LYS B 110 -8.514 11.149 4.648 1.00 0.00 H new ATOM 0 HD2 LYS B 110 -6.864 10.027 6.084 1.00 0.00 H new ATOM 0 HD3 LYS B 110 -6.800 9.386 4.455 1.00 0.00 H new ATOM 0 HE2 LYS B 110 -4.577 9.781 4.522 1.00 0.00 H new ATOM 0 HE3 LYS B 110 -4.974 11.478 4.338 1.00 0.00 H new ATOM 0 HZ1 LYS B 110 -3.531 11.116 6.232 1.00 0.00 H new ATOM 0 HZ2 LYS B 110 -5.039 11.697 6.754 1.00 0.00 H new ATOM 0 HZ3 LYS B 110 -4.655 10.053 6.933 1.00 0.00 H new ATOM 2965 N LEU B 111 -7.202 11.706 0.057 1.00 0.00 N ATOM 2966 CA LEU B 111 -6.802 12.226 -1.246 1.00 0.00 C ATOM 2967 C LEU B 111 -8.019 12.468 -2.132 1.00 0.00 C ATOM 2968 O LEU B 111 -8.081 13.457 -2.863 1.00 0.00 O ATOM 2969 CB LEU B 111 -5.841 11.254 -1.934 1.00 0.00 C ATOM 2970 CG LEU B 111 -4.363 11.456 -1.597 1.00 0.00 C ATOM 2971 CD1 LEU B 111 -3.497 10.489 -2.390 1.00 0.00 C ATOM 2972 CD2 LEU B 111 -3.945 12.893 -1.867 1.00 0.00 C ATOM 0 H LEU B 111 -6.812 10.791 0.284 1.00 0.00 H new ATOM 0 HA LEU B 111 -6.294 13.178 -1.089 1.00 0.00 H new ATOM 0 HB2 LEU B 111 -6.123 10.236 -1.664 1.00 0.00 H new ATOM 0 HB3 LEU B 111 -5.967 11.345 -3.013 1.00 0.00 H new ATOM 0 HG LEU B 111 -4.222 11.251 -0.536 1.00 0.00 H new ATOM 0 HD11 LEU B 111 -2.449 10.648 -2.137 1.00 0.00 H new ATOM 0 HD12 LEU B 111 -3.778 9.465 -2.146 1.00 0.00 H new ATOM 0 HD13 LEU B 111 -3.643 10.661 -3.456 1.00 0.00 H new ATOM 0 HD21 LEU B 111 -2.890 13.017 -1.621 1.00 0.00 H new ATOM 0 HD22 LEU B 111 -4.102 13.126 -2.920 1.00 0.00 H new ATOM 0 HD23 LEU B 111 -4.542 13.567 -1.253 1.00 0.00 H new ATOM 2984 N ARG B 112 -8.986 11.559 -2.062 1.00 0.00 N ATOM 2985 CA ARG B 112 -10.203 11.674 -2.858 1.00 0.00 C ATOM 2986 C ARG B 112 -10.946 12.966 -2.535 1.00 0.00 C ATOM 2987 O ARG B 112 -11.201 13.784 -3.418 1.00 0.00 O ATOM 2988 CB ARG B 112 -11.115 10.471 -2.611 1.00 0.00 C ATOM 2989 CG ARG B 112 -10.805 9.279 -3.502 1.00 0.00 C ATOM 2990 CD ARG B 112 -12.050 8.449 -3.779 1.00 0.00 C ATOM 2991 NE ARG B 112 -12.010 7.157 -3.098 1.00 0.00 N ATOM 2992 CZ ARG B 112 -12.307 6.987 -1.813 1.00 0.00 C ATOM 2993 NH1 ARG B 112 -12.666 8.022 -1.063 1.00 0.00 N ATOM 2994 NH2 ARG B 112 -12.245 5.777 -1.274 1.00 0.00 N ATOM 0 H ARG B 112 -8.951 10.735 -1.462 1.00 0.00 H new ATOM 0 HA ARG B 112 -9.918 11.695 -3.910 1.00 0.00 H new ATOM 0 HB2 ARG B 112 -11.027 10.167 -1.568 1.00 0.00 H new ATOM 0 HB3 ARG B 112 -12.151 10.772 -2.769 1.00 0.00 H new ATOM 0 HG2 ARG B 112 -10.383 9.628 -4.444 1.00 0.00 H new ATOM 0 HG3 ARG B 112 -10.049 8.655 -3.026 1.00 0.00 H new ATOM 0 HD2 ARG B 112 -12.933 9.001 -3.457 1.00 0.00 H new ATOM 0 HD3 ARG B 112 -12.148 8.290 -4.853 1.00 0.00 H new ATOM 0 HE ARG B 112 -11.738 6.337 -3.640 1.00 0.00 H new ATOM 0 HH11 ARG B 112 -12.715 8.955 -1.472 1.00 0.00 H new ATOM 0 HH12 ARG B 112 -12.892 7.884 -0.078 1.00 0.00 H new ATOM 0 HH21 ARG B 112 -11.970 4.978 -1.845 1.00 0.00 H new ATOM 0 HH22 ARG B 112 -12.473 5.645 -0.288 1.00 0.00 H new ATOM 3008 N ASN B 113 -11.290 13.141 -1.263 1.00 0.00 N ATOM 3009 CA ASN B 113 -12.004 14.334 -0.822 1.00 0.00 C ATOM 3010 C ASN B 113 -11.194 15.593 -1.112 1.00 0.00 C ATOM 3011 O ASN B 113 -11.755 16.659 -1.367 1.00 0.00 O ATOM 3012 CB ASN B 113 -12.312 14.245 0.674 1.00 0.00 C ATOM 3013 CG ASN B 113 -13.421 13.257 0.979 1.00 0.00 C ATOM 3014 OD1 ASN B 113 -14.602 13.598 0.926 1.00 0.00 O ATOM 3015 ND2 ASN B 113 -13.043 12.025 1.299 1.00 0.00 N ATOM 0 H ASN B 113 -11.086 12.472 -0.520 1.00 0.00 H new ATOM 0 HA ASN B 113 -12.941 14.392 -1.377 1.00 0.00 H new ATOM 0 HB2 ASN B 113 -11.410 13.951 1.211 1.00 0.00 H new ATOM 0 HB3 ASN B 113 -12.596 15.231 1.043 1.00 0.00 H new ATOM 0 HD21 ASN B 113 -13.744 11.316 1.514 1.00 0.00 H new ATOM 0 HD22 ASN B 113 -12.051 11.788 1.330 1.00 0.00 H new ATOM 3022 N LEU B 114 -9.872 15.462 -1.072 1.00 0.00 N ATOM 3023 CA LEU B 114 -8.984 16.590 -1.331 1.00 0.00 C ATOM 3024 C LEU B 114 -8.999 16.967 -2.809 1.00 0.00 C ATOM 3025 O LEU B 114 -9.289 18.108 -3.167 1.00 0.00 O ATOM 3026 CB LEU B 114 -7.558 16.254 -0.892 1.00 0.00 C ATOM 3027 CG LEU B 114 -7.295 16.381 0.610 1.00 0.00 C ATOM 3028 CD1 LEU B 114 -6.062 15.585 1.005 1.00 0.00 C ATOM 3029 CD2 LEU B 114 -7.138 17.843 1.001 1.00 0.00 C ATOM 0 H LEU B 114 -9.392 14.587 -0.863 1.00 0.00 H new ATOM 0 HA LEU B 114 -9.343 17.443 -0.754 1.00 0.00 H new ATOM 0 HB2 LEU B 114 -7.330 15.234 -1.200 1.00 0.00 H new ATOM 0 HB3 LEU B 114 -6.867 16.909 -1.423 1.00 0.00 H new ATOM 0 HG LEU B 114 -8.152 15.972 1.146 1.00 0.00 H new ATOM 0 HD11 LEU B 114 -5.891 15.687 2.077 1.00 0.00 H new ATOM 0 HD12 LEU B 114 -6.214 14.534 0.761 1.00 0.00 H new ATOM 0 HD13 LEU B 114 -5.196 15.962 0.462 1.00 0.00 H new ATOM 0 HD21 LEU B 114 -6.952 17.915 2.073 1.00 0.00 H new ATOM 0 HD22 LEU B 114 -6.299 18.277 0.457 1.00 0.00 H new ATOM 0 HD23 LEU B 114 -8.051 18.386 0.754 1.00 0.00 H new ATOM 3041 N LEU B 115 -8.682 16.000 -3.664 1.00 0.00 N ATOM 3042 CA LEU B 115 -8.658 16.230 -5.104 1.00 0.00 C ATOM 3043 C LEU B 115 -10.029 16.667 -5.608 1.00 0.00 C ATOM 3044 O LEU B 115 -10.134 17.448 -6.554 1.00 0.00 O ATOM 3045 CB LEU B 115 -8.213 14.963 -5.837 1.00 0.00 C ATOM 3046 CG LEU B 115 -6.815 14.460 -5.471 1.00 0.00 C ATOM 3047 CD1 LEU B 115 -6.577 13.076 -6.052 1.00 0.00 C ATOM 3048 CD2 LEU B 115 -5.755 15.436 -5.959 1.00 0.00 C ATOM 0 H LEU B 115 -8.438 15.050 -3.385 1.00 0.00 H new ATOM 0 HA LEU B 115 -7.944 17.029 -5.307 1.00 0.00 H new ATOM 0 HB2 LEU B 115 -8.933 14.171 -5.631 1.00 0.00 H new ATOM 0 HB3 LEU B 115 -8.245 15.152 -6.910 1.00 0.00 H new ATOM 0 HG LEU B 115 -6.746 14.391 -4.385 1.00 0.00 H new ATOM 0 HD11 LEU B 115 -5.578 12.735 -5.781 1.00 0.00 H new ATOM 0 HD12 LEU B 115 -7.318 12.382 -5.654 1.00 0.00 H new ATOM 0 HD13 LEU B 115 -6.665 13.117 -7.138 1.00 0.00 H new ATOM 0 HD21 LEU B 115 -4.766 15.064 -5.691 1.00 0.00 H new ATOM 0 HD22 LEU B 115 -5.823 15.536 -7.042 1.00 0.00 H new ATOM 0 HD23 LEU B 115 -5.915 16.409 -5.494 1.00 0.00 H new ATOM 3060 N HIS B 116 -11.079 16.158 -4.970 1.00 0.00 N ATOM 3061 CA HIS B 116 -12.444 16.497 -5.355 1.00 0.00 C ATOM 3062 C HIS B 116 -12.893 17.791 -4.684 1.00 0.00 C ATOM 3063 O HIS B 116 -12.980 18.838 -5.327 1.00 0.00 O ATOM 3064 CB HIS B 116 -13.398 15.359 -4.985 1.00 0.00 C ATOM 3065 CG HIS B 116 -13.519 14.311 -6.046 1.00 0.00 C ATOM 3066 ND1 HIS B 116 -14.447 14.414 -7.053 1.00 0.00 N ATOM 3067 CD2 HIS B 116 -12.812 13.166 -6.211 1.00 0.00 C ATOM 3068 CE1 HIS B 116 -14.286 13.339 -7.804 1.00 0.00 C ATOM 3069 NE2 HIS B 116 -13.306 12.553 -7.334 1.00 0.00 N ATOM 0 H HIS B 116 -11.010 15.510 -4.185 1.00 0.00 H new ATOM 0 HA HIS B 116 -12.465 16.643 -6.435 1.00 0.00 H new ATOM 0 HB2 HIS B 116 -13.053 14.892 -4.062 1.00 0.00 H new ATOM 0 HB3 HIS B 116 -14.385 15.775 -4.782 1.00 0.00 H new ATOM 0 HD2 HIS B 116 -12.013 12.806 -5.579 1.00 0.00 H new ATOM 0 HE1 HIS B 116 -14.870 13.121 -8.686 1.00 0.00 H new ATOM 0 HE2 HIS B 116 -12.989 11.670 -7.734 1.00 0.00 H new ATOM 3077 N ASP B 117 -13.178 17.712 -3.388 1.00 0.00 N ATOM 3078 CA ASP B 117 -13.619 18.877 -2.631 1.00 0.00 C ATOM 3079 C ASP B 117 -13.757 18.542 -1.149 1.00 0.00 C ATOM 3080 O ASP B 117 -14.277 17.487 -0.787 1.00 0.00 O ATOM 3081 CB ASP B 117 -14.952 19.393 -3.175 1.00 0.00 C ATOM 3082 CG ASP B 117 -15.137 20.879 -2.941 1.00 0.00 C ATOM 3083 OD1 ASP B 117 -15.148 21.298 -1.763 1.00 0.00 O ATOM 3084 OD2 ASP B 117 -15.272 21.625 -3.933 1.00 0.00 O ATOM 0 H ASP B 117 -13.111 16.854 -2.841 1.00 0.00 H new ATOM 0 HA ASP B 117 -12.865 19.656 -2.741 1.00 0.00 H new ATOM 0 HB2 ASP B 117 -15.009 19.187 -4.244 1.00 0.00 H new ATOM 0 HB3 ASP B 117 -15.769 18.849 -2.701 1.00 0.00 H new ATOM 3089 N ASN B 118 -13.288 19.447 -0.296 1.00 0.00 N ATOM 3090 CA ASN B 118 -13.360 19.248 1.147 1.00 0.00 C ATOM 3091 C ASN B 118 -13.639 20.564 1.865 1.00 0.00 C ATOM 3092 O ASN B 118 -12.821 21.483 1.837 1.00 0.00 O ATOM 3093 CB ASN B 118 -12.056 18.638 1.664 1.00 0.00 C ATOM 3094 CG ASN B 118 -12.241 17.907 2.979 1.00 0.00 C ATOM 3095 OD1 ASN B 118 -13.343 17.858 3.525 1.00 0.00 O ATOM 3096 ND2 ASN B 118 -11.160 17.334 3.496 1.00 0.00 N ATOM 0 H ASN B 118 -12.854 20.326 -0.579 1.00 0.00 H new ATOM 0 HA ASN B 118 -14.181 18.562 1.353 1.00 0.00 H new ATOM 0 HB2 ASN B 118 -11.661 17.947 0.920 1.00 0.00 H new ATOM 0 HB3 ASN B 118 -11.314 19.427 1.791 1.00 0.00 H new ATOM 0 HD21 ASN B 118 -11.224 16.828 4.380 1.00 0.00 H new ATOM 0 HD22 ASN B 118 -10.266 17.399 3.009 1.00 0.00 H new ATOM 3103 N GLU B 119 -14.799 20.647 2.508 1.00 0.00 N ATOM 3104 CA GLU B 119 -15.186 21.850 3.234 1.00 0.00 C ATOM 3105 C GLU B 119 -15.694 21.504 4.630 1.00 0.00 C ATOM 3106 O GLU B 119 -16.822 21.039 4.794 1.00 0.00 O ATOM 3107 CB GLU B 119 -16.265 22.613 2.462 1.00 0.00 C ATOM 3108 CG GLU B 119 -15.711 23.494 1.354 1.00 0.00 C ATOM 3109 CD GLU B 119 -16.595 24.692 1.065 1.00 0.00 C ATOM 3110 OE1 GLU B 119 -17.796 24.490 0.789 1.00 0.00 O ATOM 3111 OE2 GLU B 119 -16.087 25.831 1.115 1.00 0.00 O ATOM 0 H GLU B 119 -15.487 19.895 2.541 1.00 0.00 H new ATOM 0 HA GLU B 119 -14.304 22.482 3.334 1.00 0.00 H new ATOM 0 HB2 GLU B 119 -16.966 21.898 2.031 1.00 0.00 H new ATOM 0 HB3 GLU B 119 -16.830 23.232 3.159 1.00 0.00 H new ATOM 0 HG2 GLU B 119 -14.716 23.840 1.633 1.00 0.00 H new ATOM 0 HG3 GLU B 119 -15.599 22.902 0.446 1.00 0.00 H new ATOM 3118 N LEU B 120 -14.853 21.733 5.633 1.00 0.00 N ATOM 3119 CA LEU B 120 -15.216 21.446 7.016 1.00 0.00 C ATOM 3120 C LEU B 120 -14.894 22.630 7.922 1.00 0.00 C ATOM 3121 O LEU B 120 -14.498 22.454 9.073 1.00 0.00 O ATOM 3122 CB LEU B 120 -14.482 20.197 7.509 1.00 0.00 C ATOM 3123 CG LEU B 120 -15.269 19.328 8.491 1.00 0.00 C ATOM 3124 CD1 LEU B 120 -16.138 18.329 7.742 1.00 0.00 C ATOM 3125 CD2 LEU B 120 -14.324 18.609 9.441 1.00 0.00 C ATOM 0 H LEU B 120 -13.915 22.117 5.514 1.00 0.00 H new ATOM 0 HA LEU B 120 -16.291 21.267 7.053 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -14.211 19.589 6.646 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -13.552 20.506 7.986 1.00 0.00 H new ATOM 0 HG LEU B 120 -15.920 19.975 9.079 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -16.690 17.719 8.457 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -16.840 18.865 7.103 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -15.507 17.686 7.128 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -14.901 17.995 10.133 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -13.648 17.973 8.870 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -13.745 19.342 10.003 1.00 0.00 H new ATOM 3137 N SER B 121 -15.065 23.836 7.392 1.00 0.00 N ATOM 3138 CA SER B 121 -14.792 25.051 8.152 1.00 0.00 C ATOM 3139 C SER B 121 -15.963 26.024 8.063 1.00 0.00 C ATOM 3140 O SER B 121 -16.425 26.356 6.972 1.00 0.00 O ATOM 3141 CB SER B 121 -13.517 25.722 7.641 1.00 0.00 C ATOM 3142 OG SER B 121 -13.536 25.847 6.229 1.00 0.00 O ATOM 0 H SER B 121 -15.391 23.999 6.439 1.00 0.00 H new ATOM 0 HA SER B 121 -14.654 24.772 9.197 1.00 0.00 H new ATOM 0 HB2 SER B 121 -13.414 26.708 8.095 1.00 0.00 H new ATOM 0 HB3 SER B 121 -12.648 25.139 7.946 1.00 0.00 H new ATOM 0 HG SER B 121 -14.453 26.020 5.928 1.00 0.00 H new ATOM 3148 N ASP B 122 -16.439 26.477 9.219 1.00 0.00 N ATOM 3149 CA ASP B 122 -17.557 27.412 9.270 1.00 0.00 C ATOM 3150 C ASP B 122 -17.246 28.581 10.200 1.00 0.00 C ATOM 3151 O ASP B 122 -16.293 28.463 10.999 1.00 0.00 O ATOM 3152 CB ASP B 122 -18.825 26.697 9.738 1.00 0.00 C ATOM 3153 CG ASP B 122 -20.080 27.502 9.457 1.00 0.00 C ATOM 3154 OD1 ASP B 122 -20.461 28.326 10.315 1.00 0.00 O ATOM 3155 OD2 ASP B 122 -20.681 27.308 8.380 1.00 0.00 O ATOM 0 H ASP B 122 -16.068 26.212 10.132 1.00 0.00 H new ATOM 0 HA ASP B 122 -17.718 27.803 8.265 1.00 0.00 H new ATOM 0 HB2 ASP B 122 -18.898 25.730 9.241 1.00 0.00 H new ATOM 0 HB3 ASP B 122 -18.754 26.501 10.808 1.00 0.00 H new TER 3160 ASP B 122 HETATM 3161 ZN ZN A 123 14.172 -3.082 2.937 1.00 0.00 ZN HETATM 3162 ZN ZN A 124 5.947 -12.530 11.616 1.00 0.00 ZN HETATM 3163 ZN ZN B 143 -15.159 -8.162 -0.582 1.00 0.00 ZN HETATM 3164 ZN ZN B 144 -5.702 -15.846 -5.627 1.00 0.00 ZN