USER MOD reduce.3.24.130724 H: found=0, std=0, add=1458, rem=0, adj=52 USER MOD reduce.3.24.130724 removed 1458 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 134 MET CE :methyl 166:sc= -0.137 (180deg=0) USER MOD Set 1.2: A 188 HIS : no HE2:sc= -1.66 K(o=-1.8,f=-4.2!) USER MOD Set 2.1: A 113 MET CE :methyl -169:sc= -0.415 (180deg=-0.766) USER MOD Set 2.2: A 124 HIS : no HE2:sc= -1.82 K(o=-2.2,f=-3.4) USER MOD Set 3.1: A 109 THR OG1 : rot -12:sc= 0.982 USER MOD Set 3.2: A 176 HIS : no HD1:sc= -3.05! C(o=-2.1!,f=-16!) USER MOD Set 4.1: A 84 LYS NZ :NH3+ 165:sc= 0.0732 (180deg=0) USER MOD Set 4.2: A 105 SER OG : rot -40:sc= 1.01 USER MOD Set 5.1: A 5 SER OG : rot 45:sc= -0.0964 USER MOD Set 5.2: A 75 ASN : amide:sc= -0.0907 K(o=-0.19,f=-1.5) USER MOD Single : A 0 THR OG1 : rot 180:sc= 0.00817 USER MOD Single : A 1 MET CE :methyl -135:sc= -1.38 (180deg=-3.59!) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= -0.249 USER MOD Single : A -5 GLY N :NH3+ -127:sc= 0.0935 (180deg=0) USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=-0.051) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl -178:sc= -2.24! (180deg=-2.27!) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0.0197 USER MOD Single : A 23 THR OG1 : rot -140:sc= -0.849 USER MOD Single : A 24 MET CE :methyl 165:sc= -0.856 (180deg=-1.27) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 CYS SG : rot 75:sc= -0.809 USER MOD Single : A 31 MET CE :methyl -179:sc= -5.52! (180deg=-5.6!) USER MOD Single : A 45 ASN : amide:sc= -0.0403 X(o=-0.04,f=-0.34) USER MOD Single : A 52 SER OG : rot -160:sc= -0.226 USER MOD Single : A 57 LYS NZ :NH3+ 165:sc= -0.0195 (180deg=-0.179) USER MOD Single : A 58 LYS NZ :NH3+ -168:sc= -0.0301 (180deg=-0.233) USER MOD Single : A 66 LYS NZ :NH3+ -146:sc= -0.229 (180deg=-2.82!) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl -155:sc= -0.247 (180deg=-1.18) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl 141:sc= -2.54 (180deg=-6.08!) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ -121:sc= 0 (180deg=-0.18) USER MOD Single : A 85 GLN : amide:sc= 0.181 K(o=0.18,f=-1) USER MOD Single : A 89 LYS NZ :NH3+ -111:sc= -0.121 (180deg=-1.33) USER MOD Single : A 92 MET CE :methyl -175:sc= -2.98! (180deg=-3.32!) USER MOD Single : A 96 THR OG1 : rot 121:sc= 1.35 USER MOD Single : A 98 LYS NZ :NH3+ 143:sc= -2.53! (180deg=-4.94!) USER MOD Single : A 99 THR OG1 : rot 180:sc= -0.34 USER MOD Single : A 101 MET CE :methyl 161:sc= -4.21! (180deg=-4.87!) USER MOD Single : A 106 LYS NZ :NH3+ -179:sc= -0.654 (180deg=-0.656!) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.0211 USER MOD Single : A 111 MET CE :methyl 154:sc= -6.24! (180deg=-9.23!) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 CYS SG : rot -142:sc= -1.41 USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= -1.02 K(o=-1,f=-1.9!) USER MOD Single : A 127 TYR OH : rot 150:sc= 0 USER MOD Single : A 128 SER OG : rot -140:sc= -0.0614 USER MOD Single : A 137 LYS NZ :NH3+ 143:sc= 1.22 (180deg=0.653) USER MOD Single : A 138 LYS NZ :NH3+ 168:sc= 2.41 (180deg=2.3) USER MOD Single : A 172 ASN : amide:sc= -2.62! C(o=-2.6!,f=-6.7!) USER MOD Single : A 179 THR OG1 : rot 180:sc= -0.0371 USER MOD Single : A 183 GLN : amide:sc= -2.59 K(o=-2.6,f=-3.8) USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 196 LYS NZ :NH3+ 169:sc= -0.0229 (180deg=-0.173) USER MOD Single : A 199 TYR OH : rot 180:sc= 0 USER MOD Single : A 200 SER OG : rot -114:sc= 1.07 USER MOD Single : A 202 GLN : amide:sc= -0.0409 X(o=-0.041,f=-0.072) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -5 -27.862 -17.740 2.467 1.00 10.08 N ATOM 2 CA GLY A -5 -29.054 -17.019 1.966 1.00 9.65 C ATOM 3 C GLY A -5 -28.676 -15.689 1.359 1.00 8.52 C ATOM 4 O GLY A -5 -27.492 -15.389 1.212 1.00 8.35 O ATOM 0 H1 GLY A -5 -27.840 -18.698 2.063 1.00 10.08 H new ATOM 0 H2 GLY A -5 -27.002 -17.226 2.187 1.00 10.08 H new ATOM 0 H3 GLY A -5 -27.905 -17.803 3.504 1.00 10.08 H new ATOM 0 HA2 GLY A -5 -29.564 -17.629 1.221 1.00 9.65 H new ATOM 0 HA3 GLY A -5 -29.757 -16.861 2.784 1.00 9.65 H new ATOM 10 N ILE A -4 -29.667 -14.885 1.008 1.00 7.94 N ATOM 11 CA ILE A -4 -29.404 -13.577 0.437 1.00 6.97 C ATOM 12 C ILE A -4 -29.531 -12.513 1.518 1.00 6.09 C ATOM 13 O ILE A -4 -30.635 -12.200 1.973 1.00 5.96 O ATOM 14 CB ILE A -4 -30.350 -13.235 -0.745 1.00 7.12 C ATOM 15 CG1 ILE A -4 -30.154 -14.206 -1.919 1.00 7.77 C ATOM 16 CG2 ILE A -4 -30.117 -11.804 -1.212 1.00 7.21 C ATOM 17 CD1 ILE A -4 -30.784 -15.568 -1.722 1.00 8.21 C ATOM 0 H ILE A -4 -30.656 -15.115 1.108 1.00 7.94 H new ATOM 0 HA ILE A -4 -28.389 -13.598 0.040 1.00 6.97 H new ATOM 0 HB ILE A -4 -31.375 -13.335 -0.389 1.00 7.12 H new ATOM 0 HG12 ILE A -4 -30.570 -13.755 -2.820 1.00 7.77 H new ATOM 0 HG13 ILE A -4 -29.086 -14.336 -2.091 1.00 7.77 H new ATOM 0 HG21 ILE A -4 -30.787 -11.578 -2.041 1.00 7.21 H new ATOM 0 HG22 ILE A -4 -30.313 -11.116 -0.389 1.00 7.21 H new ATOM 0 HG23 ILE A -4 -29.084 -11.692 -1.540 1.00 7.21 H new ATOM 0 HD11 ILE A -4 -30.595 -16.186 -2.600 1.00 8.21 H new ATOM 0 HD12 ILE A -4 -30.352 -16.045 -0.842 1.00 8.21 H new ATOM 0 HD13 ILE A -4 -31.859 -15.455 -1.582 1.00 8.21 H new ATOM 29 N ASP A -3 -28.394 -11.985 1.944 1.00 5.76 N ATOM 30 CA ASP A -3 -28.363 -10.980 2.998 1.00 5.11 C ATOM 31 C ASP A -3 -28.700 -9.607 2.434 1.00 4.13 C ATOM 32 O ASP A -3 -28.080 -9.152 1.469 1.00 4.11 O ATOM 33 CB ASP A -3 -26.992 -10.954 3.680 1.00 5.67 C ATOM 34 CG ASP A -3 -26.721 -12.209 4.489 1.00 6.72 C ATOM 35 OD1 ASP A -3 -26.176 -13.185 3.928 1.00 7.08 O ATOM 36 OD2 ASP A -3 -27.050 -12.231 5.693 1.00 7.33 O ATOM 0 H ASP A -3 -27.477 -12.236 1.575 1.00 5.76 H new ATOM 0 HA ASP A -3 -29.113 -11.243 3.744 1.00 5.11 H new ATOM 0 HB2 ASP A -3 -26.216 -10.839 2.924 1.00 5.67 H new ATOM 0 HB3 ASP A -3 -26.932 -10.084 4.334 1.00 5.67 H new ATOM 41 N PRO A -2 -29.708 -8.944 3.014 1.00 3.75 N ATOM 42 CA PRO A -2 -30.157 -7.631 2.561 1.00 3.21 C ATOM 43 C PRO A -2 -29.333 -6.484 3.141 1.00 2.50 C ATOM 44 O PRO A -2 -28.602 -6.653 4.118 1.00 2.81 O ATOM 45 CB PRO A -2 -31.591 -7.573 3.076 1.00 3.86 C ATOM 46 CG PRO A -2 -31.576 -8.382 4.330 1.00 4.50 C ATOM 47 CD PRO A -2 -30.505 -9.431 4.155 1.00 4.43 C ATOM 0 HA PRO A -2 -30.059 -7.515 1.482 1.00 3.21 H new ATOM 0 HB2 PRO A -2 -31.901 -6.546 3.271 1.00 3.86 H new ATOM 0 HB3 PRO A -2 -32.290 -7.984 2.348 1.00 3.86 H new ATOM 0 HG2 PRO A -2 -31.364 -7.753 5.194 1.00 4.50 H new ATOM 0 HG3 PRO A -2 -32.547 -8.845 4.504 1.00 4.50 H new ATOM 0 HD2 PRO A -2 -29.895 -9.532 5.053 1.00 4.43 H new ATOM 0 HD3 PRO A -2 -30.936 -10.411 3.951 1.00 4.43 H new ATOM 55 N PHE A -1 -29.464 -5.318 2.525 1.00 2.13 N ATOM 56 CA PHE A -1 -28.775 -4.124 2.955 1.00 1.78 C ATOM 57 C PHE A -1 -29.784 -3.006 3.139 1.00 1.73 C ATOM 58 O PHE A -1 -30.104 -2.274 2.199 1.00 2.21 O ATOM 59 CB PHE A -1 -27.726 -3.709 1.927 1.00 2.13 C ATOM 60 CG PHE A -1 -26.660 -4.738 1.697 1.00 2.45 C ATOM 61 CD1 PHE A -1 -25.573 -4.826 2.547 1.00 2.78 C ATOM 62 CD2 PHE A -1 -26.749 -5.613 0.631 1.00 2.89 C ATOM 63 CE1 PHE A -1 -24.588 -5.773 2.337 1.00 3.51 C ATOM 64 CE2 PHE A -1 -25.769 -6.563 0.414 1.00 3.47 C ATOM 65 CZ PHE A -1 -24.687 -6.644 1.268 1.00 3.78 C ATOM 0 H PHE A -1 -30.058 -5.180 1.707 1.00 2.13 H new ATOM 0 HA PHE A -1 -28.270 -4.326 3.899 1.00 1.78 H new ATOM 0 HB2 PHE A -1 -28.223 -3.497 0.980 1.00 2.13 H new ATOM 0 HB3 PHE A -1 -27.257 -2.781 2.255 1.00 2.13 H new ATOM 0 HD1 PHE A -1 -25.493 -4.148 3.384 1.00 2.78 H new ATOM 0 HD2 PHE A -1 -27.593 -5.554 -0.040 1.00 2.89 H new ATOM 0 HE1 PHE A -1 -23.743 -5.832 3.007 1.00 3.51 H new ATOM 0 HE2 PHE A -1 -25.849 -7.241 -0.423 1.00 3.47 H new ATOM 0 HZ PHE A -1 -23.920 -7.386 1.101 1.00 3.78 H new ATOM 75 N THR A 0 -30.325 -2.920 4.334 1.00 1.54 N ATOM 76 CA THR A 0 -31.339 -1.927 4.646 1.00 1.59 C ATOM 77 C THR A 0 -30.710 -0.572 4.996 1.00 1.40 C ATOM 78 O THR A 0 -29.691 -0.188 4.415 1.00 1.49 O ATOM 79 CB THR A 0 -32.237 -2.421 5.793 1.00 1.75 C ATOM 80 OG1 THR A 0 -31.431 -2.860 6.894 1.00 1.70 O ATOM 81 CG2 THR A 0 -33.127 -3.561 5.323 1.00 2.11 C ATOM 0 H THR A 0 -30.080 -3.530 5.114 1.00 1.54 H new ATOM 0 HA THR A 0 -31.953 -1.785 3.757 1.00 1.59 H new ATOM 0 HB THR A 0 -32.869 -1.593 6.116 1.00 1.75 H new ATOM 0 HG1 THR A 0 -32.011 -3.171 7.620 1.00 1.70 H new ATOM 0 HG21 THR A 0 -33.755 -3.897 6.149 1.00 2.11 H new ATOM 0 HG22 THR A 0 -33.758 -3.216 4.504 1.00 2.11 H new ATOM 0 HG23 THR A 0 -32.507 -4.389 4.979 1.00 2.11 H new ATOM 89 N MET A 1 -31.313 0.163 5.935 1.00 1.38 N ATOM 90 CA MET A 1 -30.817 1.494 6.297 1.00 1.36 C ATOM 91 C MET A 1 -29.662 1.398 7.293 1.00 1.21 C ATOM 92 O MET A 1 -29.592 2.119 8.291 1.00 1.42 O ATOM 93 CB MET A 1 -31.952 2.368 6.845 1.00 1.66 C ATOM 94 CG MET A 1 -31.602 3.850 6.983 1.00 1.86 C ATOM 95 SD MET A 1 -31.167 4.637 5.412 1.00 2.09 S ATOM 96 CE MET A 1 -29.417 4.261 5.285 1.00 1.64 C ATOM 0 H MET A 1 -32.138 -0.137 6.454 1.00 1.38 H new ATOM 0 HA MET A 1 -30.435 1.969 5.394 1.00 1.36 H new ATOM 0 HB2 MET A 1 -32.817 2.272 6.189 1.00 1.66 H new ATOM 0 HB3 MET A 1 -32.249 1.985 7.822 1.00 1.66 H new ATOM 0 HG2 MET A 1 -32.450 4.376 7.422 1.00 1.86 H new ATOM 0 HG3 MET A 1 -30.768 3.955 7.677 1.00 1.86 H new ATOM 0 HE1 MET A 1 -28.874 5.155 4.978 1.00 1.64 H new ATOM 0 HE2 MET A 1 -29.046 3.926 6.253 1.00 1.64 H new ATOM 0 HE3 MET A 1 -29.267 3.474 4.546 1.00 1.64 H new ATOM 106 N VAL A 2 -28.758 0.500 6.981 1.00 1.00 N ATOM 107 CA VAL A 2 -27.498 0.363 7.669 1.00 0.98 C ATOM 108 C VAL A 2 -26.432 0.143 6.607 1.00 0.79 C ATOM 109 O VAL A 2 -25.912 -0.955 6.421 1.00 0.92 O ATOM 110 CB VAL A 2 -27.491 -0.795 8.704 1.00 1.21 C ATOM 111 CG1 VAL A 2 -28.385 -0.470 9.889 1.00 1.56 C ATOM 112 CG2 VAL A 2 -27.926 -2.102 8.064 1.00 1.32 C ATOM 0 H VAL A 2 -28.882 -0.171 6.223 1.00 1.00 H new ATOM 0 HA VAL A 2 -27.307 1.267 8.248 1.00 0.98 H new ATOM 0 HB VAL A 2 -26.468 -0.910 9.062 1.00 1.21 H new ATOM 0 HG11 VAL A 2 -28.363 -1.297 10.599 1.00 1.56 H new ATOM 0 HG12 VAL A 2 -28.027 0.437 10.377 1.00 1.56 H new ATOM 0 HG13 VAL A 2 -29.407 -0.317 9.543 1.00 1.56 H new ATOM 0 HG21 VAL A 2 -27.912 -2.895 8.811 1.00 1.32 H new ATOM 0 HG22 VAL A 2 -28.936 -1.995 7.668 1.00 1.32 H new ATOM 0 HG23 VAL A 2 -27.243 -2.355 7.253 1.00 1.32 H new ATOM 122 N ALA A 3 -26.155 1.194 5.864 1.00 0.66 N ATOM 123 CA ALA A 3 -25.259 1.099 4.733 1.00 0.55 C ATOM 124 C ALA A 3 -24.511 2.395 4.534 1.00 0.60 C ATOM 125 O ALA A 3 -25.028 3.479 4.799 1.00 1.10 O ATOM 126 CB ALA A 3 -26.024 0.732 3.469 1.00 0.63 C ATOM 0 H ALA A 3 -26.539 2.125 6.024 1.00 0.66 H new ATOM 0 HA ALA A 3 -24.536 0.310 4.941 1.00 0.55 H new ATOM 0 HB1 ALA A 3 -25.331 0.666 2.630 1.00 0.63 H new ATOM 0 HB2 ALA A 3 -26.517 -0.230 3.609 1.00 0.63 H new ATOM 0 HB3 ALA A 3 -26.772 1.497 3.262 1.00 0.63 H new ATOM 132 N LEU A 4 -23.295 2.263 4.063 1.00 0.45 N ATOM 133 CA LEU A 4 -22.429 3.394 3.813 1.00 0.41 C ATOM 134 C LEU A 4 -22.208 3.530 2.318 1.00 0.39 C ATOM 135 O LEU A 4 -21.910 2.548 1.640 1.00 0.38 O ATOM 136 CB LEU A 4 -21.087 3.214 4.530 1.00 0.41 C ATOM 137 CG LEU A 4 -21.046 3.622 6.009 1.00 0.56 C ATOM 138 CD1 LEU A 4 -22.128 2.936 6.816 1.00 1.16 C ATOM 139 CD2 LEU A 4 -19.689 3.295 6.594 1.00 1.46 C ATOM 0 H LEU A 4 -22.873 1.361 3.840 1.00 0.45 H new ATOM 0 HA LEU A 4 -22.901 4.298 4.198 1.00 0.41 H new ATOM 0 HB2 LEU A 4 -20.798 2.166 4.456 1.00 0.41 H new ATOM 0 HB3 LEU A 4 -20.333 3.791 3.995 1.00 0.41 H new ATOM 0 HG LEU A 4 -21.224 4.696 6.060 1.00 0.56 H new ATOM 0 HD11 LEU A 4 -22.062 3.253 7.857 1.00 1.16 H new ATOM 0 HD12 LEU A 4 -23.106 3.204 6.416 1.00 1.16 H new ATOM 0 HD13 LEU A 4 -21.996 1.856 6.757 1.00 1.16 H new ATOM 0 HD21 LEU A 4 -19.666 3.587 7.644 1.00 1.46 H new ATOM 0 HD22 LEU A 4 -19.505 2.224 6.511 1.00 1.46 H new ATOM 0 HD23 LEU A 4 -18.917 3.839 6.049 1.00 1.46 H new ATOM 151 N SER A 5 -22.353 4.740 1.813 1.00 0.41 N ATOM 152 CA SER A 5 -22.207 4.982 0.393 1.00 0.42 C ATOM 153 C SER A 5 -20.758 5.329 0.093 1.00 0.37 C ATOM 154 O SER A 5 -20.290 6.433 0.388 1.00 0.42 O ATOM 155 CB SER A 5 -23.162 6.089 -0.065 1.00 0.51 C ATOM 156 OG SER A 5 -22.881 7.323 0.571 1.00 1.28 O ATOM 0 H SER A 5 -22.572 5.569 2.365 1.00 0.41 H new ATOM 0 HA SER A 5 -22.470 4.082 -0.163 1.00 0.42 H new ATOM 0 HB2 SER A 5 -23.085 6.211 -1.145 1.00 0.51 H new ATOM 0 HB3 SER A 5 -24.189 5.795 0.150 1.00 0.51 H new ATOM 0 HG SER A 5 -21.914 7.481 0.566 1.00 1.28 H new ATOM 162 N LEU A 6 -20.035 4.373 -0.463 1.00 0.31 N ATOM 163 CA LEU A 6 -18.608 4.528 -0.649 1.00 0.28 C ATOM 164 C LEU A 6 -18.259 4.548 -2.126 1.00 0.28 C ATOM 165 O LEU A 6 -18.661 3.664 -2.888 1.00 0.31 O ATOM 166 CB LEU A 6 -17.854 3.398 0.061 1.00 0.26 C ATOM 167 CG LEU A 6 -18.182 3.231 1.551 1.00 0.33 C ATOM 168 CD1 LEU A 6 -17.370 2.098 2.158 1.00 0.61 C ATOM 169 CD2 LEU A 6 -17.933 4.529 2.306 1.00 0.62 C ATOM 0 H LEU A 6 -20.413 3.485 -0.792 1.00 0.31 H new ATOM 0 HA LEU A 6 -18.306 5.480 -0.212 1.00 0.28 H new ATOM 0 HB2 LEU A 6 -18.071 2.460 -0.450 1.00 0.26 H new ATOM 0 HB3 LEU A 6 -16.784 3.576 -0.042 1.00 0.26 H new ATOM 0 HG LEU A 6 -19.239 2.980 1.639 1.00 0.33 H new ATOM 0 HD11 LEU A 6 -17.619 1.998 3.215 1.00 0.61 H new ATOM 0 HD12 LEU A 6 -17.601 1.167 1.641 1.00 0.61 H new ATOM 0 HD13 LEU A 6 -16.307 2.316 2.055 1.00 0.61 H new ATOM 0 HD21 LEU A 6 -18.172 4.388 3.360 1.00 0.62 H new ATOM 0 HD22 LEU A 6 -16.885 4.813 2.206 1.00 0.62 H new ATOM 0 HD23 LEU A 6 -18.563 5.317 1.893 1.00 0.62 H new ATOM 181 N LYS A 7 -17.535 5.575 -2.531 1.00 0.29 N ATOM 182 CA LYS A 7 -17.030 5.653 -3.888 1.00 0.31 C ATOM 183 C LYS A 7 -15.847 4.724 -4.050 1.00 0.29 C ATOM 184 O LYS A 7 -14.768 4.992 -3.532 1.00 0.31 O ATOM 185 CB LYS A 7 -16.606 7.075 -4.241 1.00 0.39 C ATOM 186 CG LYS A 7 -17.694 7.900 -4.896 1.00 0.52 C ATOM 187 CD LYS A 7 -17.154 9.251 -5.323 1.00 0.63 C ATOM 188 CE LYS A 7 -18.125 9.978 -6.231 1.00 0.94 C ATOM 189 NZ LYS A 7 -17.612 11.320 -6.618 1.00 1.72 N ATOM 0 H LYS A 7 -17.284 6.367 -1.939 1.00 0.29 H new ATOM 0 HA LYS A 7 -17.833 5.355 -4.562 1.00 0.31 H new ATOM 0 HB2 LYS A 7 -16.278 7.581 -3.333 1.00 0.39 H new ATOM 0 HB3 LYS A 7 -15.746 7.031 -4.909 1.00 0.39 H new ATOM 0 HG2 LYS A 7 -18.089 7.369 -5.763 1.00 0.52 H new ATOM 0 HG3 LYS A 7 -18.523 8.036 -4.201 1.00 0.52 H new ATOM 0 HD2 LYS A 7 -16.955 9.859 -4.441 1.00 0.63 H new ATOM 0 HD3 LYS A 7 -16.203 9.117 -5.839 1.00 0.63 H new ATOM 0 HE2 LYS A 7 -18.302 9.383 -7.127 1.00 0.94 H new ATOM 0 HE3 LYS A 7 -19.085 10.086 -5.726 1.00 0.94 H new ATOM 0 HZ1 LYS A 7 -18.302 11.789 -7.239 1.00 1.72 H new ATOM 0 HZ2 LYS A 7 -17.467 11.896 -5.764 1.00 1.72 H new ATOM 0 HZ3 LYS A 7 -16.708 11.214 -7.122 1.00 1.72 H new ATOM 203 N ILE A 8 -16.044 3.640 -4.768 1.00 0.28 N ATOM 204 CA ILE A 8 -14.992 2.670 -4.962 1.00 0.28 C ATOM 205 C ILE A 8 -14.207 3.005 -6.215 1.00 0.31 C ATOM 206 O ILE A 8 -14.642 2.722 -7.329 1.00 0.34 O ATOM 207 CB ILE A 8 -15.544 1.234 -5.082 1.00 0.33 C ATOM 208 CG1 ILE A 8 -16.382 0.870 -3.850 1.00 0.58 C ATOM 209 CG2 ILE A 8 -14.403 0.246 -5.266 1.00 0.32 C ATOM 210 CD1 ILE A 8 -15.627 0.977 -2.542 1.00 0.51 C ATOM 0 H ILE A 8 -16.925 3.409 -5.227 1.00 0.28 H new ATOM 0 HA ILE A 8 -14.345 2.713 -4.086 1.00 0.28 H new ATOM 0 HB ILE A 8 -16.191 1.184 -5.958 1.00 0.33 H new ATOM 0 HG12 ILE A 8 -17.254 1.523 -3.810 1.00 0.58 H new ATOM 0 HG13 ILE A 8 -16.752 -0.149 -3.962 1.00 0.58 H new ATOM 0 HG21 ILE A 8 -14.806 -0.763 -5.349 1.00 0.32 H new ATOM 0 HG22 ILE A 8 -13.851 0.493 -6.173 1.00 0.32 H new ATOM 0 HG23 ILE A 8 -13.733 0.300 -4.408 1.00 0.32 H new ATOM 0 HD11 ILE A 8 -16.286 0.704 -1.718 1.00 0.51 H new ATOM 0 HD12 ILE A 8 -14.770 0.303 -2.560 1.00 0.51 H new ATOM 0 HD13 ILE A 8 -15.280 2.001 -2.405 1.00 0.51 H new ATOM 222 N SER A 9 -13.064 3.628 -6.038 1.00 0.33 N ATOM 223 CA SER A 9 -12.220 3.966 -7.165 1.00 0.39 C ATOM 224 C SER A 9 -11.106 2.936 -7.279 1.00 0.37 C ATOM 225 O SER A 9 -10.503 2.560 -6.281 1.00 0.45 O ATOM 226 CB SER A 9 -11.663 5.385 -7.013 1.00 0.46 C ATOM 227 OG SER A 9 -12.716 6.328 -6.922 1.00 1.48 O ATOM 0 H SER A 9 -12.697 3.911 -5.129 1.00 0.33 H new ATOM 0 HA SER A 9 -12.807 3.948 -8.083 1.00 0.39 H new ATOM 0 HB2 SER A 9 -11.038 5.442 -6.122 1.00 0.46 H new ATOM 0 HB3 SER A 9 -11.026 5.624 -7.865 1.00 0.46 H new ATOM 0 HG SER A 9 -12.341 7.228 -6.824 1.00 1.48 H new ATOM 233 N ILE A 10 -10.880 2.441 -8.482 1.00 0.40 N ATOM 234 CA ILE A 10 -9.884 1.405 -8.705 1.00 0.42 C ATOM 235 C ILE A 10 -8.916 1.837 -9.801 1.00 0.50 C ATOM 236 O ILE A 10 -9.161 1.612 -10.989 1.00 0.53 O ATOM 237 CB ILE A 10 -10.550 0.058 -9.086 1.00 0.40 C ATOM 238 CG1 ILE A 10 -11.586 -0.340 -8.024 1.00 0.38 C ATOM 239 CG2 ILE A 10 -9.496 -1.034 -9.243 1.00 0.45 C ATOM 240 CD1 ILE A 10 -12.384 -1.582 -8.368 1.00 0.43 C ATOM 0 H ILE A 10 -11.374 2.740 -9.323 1.00 0.40 H new ATOM 0 HA ILE A 10 -9.334 1.260 -7.775 1.00 0.42 H new ATOM 0 HB ILE A 10 -11.061 0.179 -10.041 1.00 0.40 H new ATOM 0 HG12 ILE A 10 -11.074 -0.502 -7.076 1.00 0.38 H new ATOM 0 HG13 ILE A 10 -12.275 0.491 -7.876 1.00 0.38 H new ATOM 0 HG21 ILE A 10 -9.982 -1.973 -9.510 1.00 0.45 H new ATOM 0 HG22 ILE A 10 -8.794 -0.752 -10.028 1.00 0.45 H new ATOM 0 HG23 ILE A 10 -8.958 -1.159 -8.303 1.00 0.45 H new ATOM 0 HD11 ILE A 10 -13.092 -1.793 -7.567 1.00 0.43 H new ATOM 0 HD12 ILE A 10 -12.927 -1.419 -9.299 1.00 0.43 H new ATOM 0 HD13 ILE A 10 -11.707 -2.428 -8.486 1.00 0.43 H new ATOM 252 N GLY A 11 -7.834 2.494 -9.395 1.00 0.59 N ATOM 253 CA GLY A 11 -6.856 2.997 -10.343 1.00 0.68 C ATOM 254 C GLY A 11 -7.344 4.225 -11.090 1.00 0.75 C ATOM 255 O GLY A 11 -6.807 5.321 -10.926 1.00 0.96 O ATOM 0 H GLY A 11 -7.616 2.688 -8.418 1.00 0.59 H new ATOM 0 HA2 GLY A 11 -5.935 3.241 -9.814 1.00 0.68 H new ATOM 0 HA3 GLY A 11 -6.614 2.213 -11.060 1.00 0.68 H new ATOM 259 N ASN A 12 -8.372 4.039 -11.903 1.00 0.75 N ATOM 260 CA ASN A 12 -8.935 5.115 -12.705 1.00 0.90 C ATOM 261 C ASN A 12 -10.453 5.136 -12.589 1.00 0.84 C ATOM 262 O ASN A 12 -11.058 6.177 -12.320 1.00 1.09 O ATOM 263 CB ASN A 12 -8.516 4.953 -14.171 1.00 1.09 C ATOM 264 CG ASN A 12 -9.526 5.521 -15.138 1.00 1.77 C ATOM 265 OD1 ASN A 12 -10.392 4.817 -15.657 1.00 2.62 O ATOM 266 ND2 ASN A 12 -9.419 6.795 -15.369 1.00 2.17 N ATOM 0 H ASN A 12 -8.839 3.140 -12.026 1.00 0.75 H new ATOM 0 HA ASN A 12 -8.551 6.063 -12.330 1.00 0.90 H new ATOM 0 HB2 ASN A 12 -7.556 5.446 -14.326 1.00 1.09 H new ATOM 0 HB3 ASN A 12 -8.370 3.895 -14.387 1.00 1.09 H new ATOM 0 HD21 ASN A 12 -10.070 7.254 -16.005 1.00 2.17 H new ATOM 0 HD22 ASN A 12 -8.684 7.336 -14.914 1.00 2.17 H new ATOM 273 N VAL A 13 -11.058 3.980 -12.798 1.00 0.65 N ATOM 274 CA VAL A 13 -12.502 3.839 -12.732 1.00 0.61 C ATOM 275 C VAL A 13 -13.004 4.059 -11.303 1.00 0.53 C ATOM 276 O VAL A 13 -12.271 3.840 -10.337 1.00 0.50 O ATOM 277 CB VAL A 13 -12.918 2.437 -13.235 1.00 0.61 C ATOM 278 CG1 VAL A 13 -12.235 1.368 -12.410 1.00 0.55 C ATOM 279 CG2 VAL A 13 -14.428 2.246 -13.216 1.00 0.65 C ATOM 0 H VAL A 13 -10.564 3.115 -13.018 1.00 0.65 H new ATOM 0 HA VAL A 13 -12.954 4.596 -13.372 1.00 0.61 H new ATOM 0 HB VAL A 13 -12.598 2.349 -14.273 1.00 0.61 H new ATOM 0 HG11 VAL A 13 -12.533 0.384 -12.771 1.00 0.55 H new ATOM 0 HG12 VAL A 13 -11.154 1.475 -12.499 1.00 0.55 H new ATOM 0 HG13 VAL A 13 -12.525 1.474 -11.365 1.00 0.55 H new ATOM 0 HG21 VAL A 13 -14.673 1.247 -13.577 1.00 0.65 H new ATOM 0 HG22 VAL A 13 -14.797 2.364 -12.197 1.00 0.65 H new ATOM 0 HG23 VAL A 13 -14.897 2.990 -13.860 1.00 0.65 H new ATOM 289 N VAL A 14 -14.246 4.490 -11.179 1.00 0.51 N ATOM 290 CA VAL A 14 -14.872 4.657 -9.881 1.00 0.46 C ATOM 291 C VAL A 14 -16.304 4.148 -9.930 1.00 0.41 C ATOM 292 O VAL A 14 -17.097 4.543 -10.785 1.00 0.45 O ATOM 293 CB VAL A 14 -14.814 6.119 -9.363 1.00 0.53 C ATOM 294 CG1 VAL A 14 -15.200 7.105 -10.443 1.00 0.62 C ATOM 295 CG2 VAL A 14 -15.698 6.302 -8.132 1.00 0.50 C ATOM 0 H VAL A 14 -14.845 4.732 -11.968 1.00 0.51 H new ATOM 0 HA VAL A 14 -14.302 4.064 -9.166 1.00 0.46 H new ATOM 0 HB VAL A 14 -13.782 6.321 -9.077 1.00 0.53 H new ATOM 0 HG11 VAL A 14 -15.148 8.119 -10.046 1.00 0.62 H new ATOM 0 HG12 VAL A 14 -14.514 7.010 -11.285 1.00 0.62 H new ATOM 0 HG13 VAL A 14 -16.216 6.898 -10.778 1.00 0.62 H new ATOM 0 HG21 VAL A 14 -15.638 7.336 -7.791 1.00 0.50 H new ATOM 0 HG22 VAL A 14 -16.731 6.064 -8.387 1.00 0.50 H new ATOM 0 HG23 VAL A 14 -15.358 5.638 -7.338 1.00 0.50 H new ATOM 305 N LYS A 15 -16.603 3.244 -9.020 1.00 0.39 N ATOM 306 CA LYS A 15 -17.890 2.585 -8.952 1.00 0.41 C ATOM 307 C LYS A 15 -18.538 2.893 -7.610 1.00 0.35 C ATOM 308 O LYS A 15 -17.847 3.055 -6.609 1.00 0.31 O ATOM 309 CB LYS A 15 -17.717 1.072 -9.125 1.00 0.50 C ATOM 310 CG LYS A 15 -17.233 0.656 -10.506 1.00 0.67 C ATOM 311 CD LYS A 15 -18.228 1.038 -11.589 1.00 0.80 C ATOM 312 CE LYS A 15 -17.800 0.510 -12.949 1.00 1.02 C ATOM 313 NZ LYS A 15 -18.773 0.868 -14.014 1.00 1.28 N ATOM 0 H LYS A 15 -15.950 2.943 -8.297 1.00 0.39 H new ATOM 0 HA LYS A 15 -18.530 2.951 -9.754 1.00 0.41 H new ATOM 0 HB2 LYS A 15 -17.009 0.711 -8.379 1.00 0.50 H new ATOM 0 HB3 LYS A 15 -18.670 0.583 -8.923 1.00 0.50 H new ATOM 0 HG2 LYS A 15 -16.272 1.127 -10.712 1.00 0.67 H new ATOM 0 HG3 LYS A 15 -17.070 -0.422 -10.525 1.00 0.67 H new ATOM 0 HD2 LYS A 15 -19.212 0.642 -11.337 1.00 0.80 H new ATOM 0 HD3 LYS A 15 -18.322 2.123 -11.632 1.00 0.80 H new ATOM 0 HE2 LYS A 15 -16.820 0.913 -13.203 1.00 1.02 H new ATOM 0 HE3 LYS A 15 -17.696 -0.574 -12.901 1.00 1.02 H new ATOM 0 HZ1 LYS A 15 -18.445 0.490 -14.925 1.00 1.28 H new ATOM 0 HZ2 LYS A 15 -19.703 0.462 -13.785 1.00 1.28 H new ATOM 0 HZ3 LYS A 15 -18.853 1.903 -14.077 1.00 1.28 H new ATOM 327 N THR A 16 -19.849 2.993 -7.586 1.00 0.38 N ATOM 328 CA THR A 16 -20.544 3.340 -6.360 1.00 0.37 C ATOM 329 C THR A 16 -21.107 2.089 -5.698 1.00 0.35 C ATOM 330 O THR A 16 -21.934 1.385 -6.280 1.00 0.39 O ATOM 331 CB THR A 16 -21.677 4.350 -6.624 1.00 0.45 C ATOM 332 OG1 THR A 16 -21.144 5.504 -7.285 1.00 0.50 O ATOM 333 CG2 THR A 16 -22.350 4.774 -5.324 1.00 0.45 C ATOM 0 H THR A 16 -20.454 2.841 -8.393 1.00 0.38 H new ATOM 0 HA THR A 16 -19.822 3.807 -5.690 1.00 0.37 H new ATOM 0 HB THR A 16 -22.424 3.870 -7.256 1.00 0.45 H new ATOM 0 HG1 THR A 16 -21.865 6.146 -7.455 1.00 0.50 H new ATOM 0 HG21 THR A 16 -23.145 5.487 -5.542 1.00 0.45 H new ATOM 0 HG22 THR A 16 -22.772 3.899 -4.831 1.00 0.45 H new ATOM 0 HG23 THR A 16 -21.614 5.240 -4.669 1.00 0.45 H new ATOM 341 N MET A 17 -20.647 1.805 -4.490 1.00 0.31 N ATOM 342 CA MET A 17 -21.101 0.639 -3.755 1.00 0.32 C ATOM 343 C MET A 17 -21.468 1.030 -2.341 1.00 0.32 C ATOM 344 O MET A 17 -20.915 1.980 -1.786 1.00 0.31 O ATOM 345 CB MET A 17 -20.046 -0.470 -3.718 1.00 0.34 C ATOM 346 CG MET A 17 -20.127 -1.437 -4.886 1.00 0.44 C ATOM 347 SD MET A 17 -19.271 -2.992 -4.553 1.00 1.04 S ATOM 348 CE MET A 17 -20.169 -3.567 -3.112 1.00 0.40 C ATOM 0 H MET A 17 -19.956 2.370 -3.997 1.00 0.31 H new ATOM 0 HA MET A 17 -21.976 0.250 -4.276 1.00 0.32 H new ATOM 0 HB2 MET A 17 -19.056 -0.015 -3.704 1.00 0.34 H new ATOM 0 HB3 MET A 17 -20.153 -1.029 -2.788 1.00 0.34 H new ATOM 0 HG2 MET A 17 -21.173 -1.643 -5.112 1.00 0.44 H new ATOM 0 HG3 MET A 17 -19.695 -0.970 -5.771 1.00 0.44 H new ATOM 0 HE1 MET A 17 -19.735 -4.504 -2.763 1.00 0.40 H new ATOM 0 HE2 MET A 17 -20.105 -2.820 -2.321 1.00 0.40 H new ATOM 0 HE3 MET A 17 -21.215 -3.728 -3.375 1.00 0.40 H new ATOM 358 N GLN A 18 -22.409 0.315 -1.769 1.00 0.36 N ATOM 359 CA GLN A 18 -22.777 0.519 -0.388 1.00 0.37 C ATOM 360 C GLN A 18 -22.495 -0.731 0.418 1.00 0.35 C ATOM 361 O GLN A 18 -22.775 -1.846 -0.027 1.00 0.38 O ATOM 362 CB GLN A 18 -24.239 0.930 -0.278 1.00 0.44 C ATOM 363 CG GLN A 18 -24.445 2.393 -0.616 1.00 0.49 C ATOM 364 CD GLN A 18 -25.880 2.733 -0.945 1.00 0.59 C ATOM 365 OE1 GLN A 18 -26.667 3.090 -0.067 1.00 0.92 O ATOM 366 NE2 GLN A 18 -26.228 2.633 -2.217 1.00 0.60 N ATOM 0 H GLN A 18 -22.937 -0.418 -2.243 1.00 0.36 H new ATOM 0 HA GLN A 18 -22.174 1.329 0.021 1.00 0.37 H new ATOM 0 HB2 GLN A 18 -24.840 0.315 -0.948 1.00 0.44 H new ATOM 0 HB3 GLN A 18 -24.594 0.738 0.735 1.00 0.44 H new ATOM 0 HG2 GLN A 18 -24.118 3.003 0.226 1.00 0.49 H new ATOM 0 HG3 GLN A 18 -23.813 2.656 -1.464 1.00 0.49 H new ATOM 0 HE21 GLN A 18 -25.543 2.333 -2.911 1.00 0.60 H new ATOM 0 HE22 GLN A 18 -27.181 2.856 -2.504 1.00 0.60 H new ATOM 375 N PHE A 19 -21.943 -0.541 1.602 1.00 0.34 N ATOM 376 CA PHE A 19 -21.560 -1.640 2.467 1.00 0.33 C ATOM 377 C PHE A 19 -22.198 -1.394 3.815 1.00 0.37 C ATOM 378 O PHE A 19 -22.541 -0.257 4.125 1.00 0.40 O ATOM 379 CB PHE A 19 -20.039 -1.702 2.651 1.00 0.29 C ATOM 380 CG PHE A 19 -19.253 -1.829 1.378 1.00 0.27 C ATOM 381 CD1 PHE A 19 -18.832 -0.703 0.695 1.00 0.30 C ATOM 382 CD2 PHE A 19 -18.954 -3.075 0.857 1.00 0.33 C ATOM 383 CE1 PHE A 19 -18.126 -0.816 -0.487 1.00 0.31 C ATOM 384 CE2 PHE A 19 -18.247 -3.198 -0.322 1.00 0.36 C ATOM 385 CZ PHE A 19 -17.765 -2.061 -0.955 1.00 0.31 C ATOM 0 H PHE A 19 -21.748 0.381 1.991 1.00 0.34 H new ATOM 0 HA PHE A 19 -21.887 -2.580 2.023 1.00 0.33 H new ATOM 0 HB2 PHE A 19 -19.714 -0.802 3.173 1.00 0.29 H new ATOM 0 HB3 PHE A 19 -19.800 -2.548 3.295 1.00 0.29 H new ATOM 0 HD1 PHE A 19 -19.058 0.276 1.090 1.00 0.30 H new ATOM 0 HD2 PHE A 19 -19.278 -3.963 1.379 1.00 0.33 H new ATOM 0 HE1 PHE A 19 -17.857 0.070 -1.043 1.00 0.31 H new ATOM 0 HE2 PHE A 19 -18.070 -4.174 -0.750 1.00 0.36 H new ATOM 0 HZ PHE A 19 -17.111 -2.151 -1.810 1.00 0.31 H new ATOM 395 N GLU A 20 -22.355 -2.422 4.615 1.00 0.39 N ATOM 396 CA GLU A 20 -22.883 -2.227 5.947 1.00 0.43 C ATOM 397 C GLU A 20 -21.792 -1.673 6.851 1.00 0.44 C ATOM 398 O GLU A 20 -20.617 -2.014 6.708 1.00 0.47 O ATOM 399 CB GLU A 20 -23.437 -3.521 6.538 1.00 0.50 C ATOM 400 CG GLU A 20 -24.627 -4.086 5.789 1.00 0.61 C ATOM 401 CD GLU A 20 -25.314 -5.179 6.572 1.00 0.90 C ATOM 402 OE1 GLU A 20 -24.802 -6.315 6.586 1.00 1.06 O ATOM 403 OE2 GLU A 20 -26.392 -4.920 7.149 1.00 1.42 O ATOM 0 H GLU A 20 -22.129 -3.387 4.374 1.00 0.39 H new ATOM 0 HA GLU A 20 -23.708 -1.518 5.878 1.00 0.43 H new ATOM 0 HB2 GLU A 20 -22.644 -4.269 6.554 1.00 0.50 H new ATOM 0 HB3 GLU A 20 -23.726 -3.340 7.573 1.00 0.50 H new ATOM 0 HG2 GLU A 20 -25.338 -3.287 5.580 1.00 0.61 H new ATOM 0 HG3 GLU A 20 -24.298 -4.480 4.827 1.00 0.61 H new ATOM 410 N PRO A 21 -22.171 -0.791 7.775 1.00 0.50 N ATOM 411 CA PRO A 21 -21.264 -0.217 8.764 1.00 0.53 C ATOM 412 C PRO A 21 -20.435 -1.292 9.471 1.00 0.53 C ATOM 413 O PRO A 21 -19.248 -1.097 9.751 1.00 0.65 O ATOM 414 CB PRO A 21 -22.209 0.494 9.753 1.00 0.57 C ATOM 415 CG PRO A 21 -23.599 0.122 9.345 1.00 0.61 C ATOM 416 CD PRO A 21 -23.521 -0.258 7.907 1.00 0.62 C ATOM 0 HA PRO A 21 -20.532 0.453 8.314 1.00 0.53 H new ATOM 0 HB2 PRO A 21 -22.007 0.181 10.777 1.00 0.57 H new ATOM 0 HB3 PRO A 21 -22.069 1.574 9.717 1.00 0.57 H new ATOM 0 HG2 PRO A 21 -23.973 -0.706 9.947 1.00 0.61 H new ATOM 0 HG3 PRO A 21 -24.284 0.957 9.491 1.00 0.61 H new ATOM 0 HD2 PRO A 21 -24.274 -1.001 7.646 1.00 0.62 H new ATOM 0 HD3 PRO A 21 -23.680 0.601 7.255 1.00 0.62 H new ATOM 424 N SER A 22 -21.054 -2.440 9.714 1.00 0.50 N ATOM 425 CA SER A 22 -20.399 -3.540 10.402 1.00 0.61 C ATOM 426 C SER A 22 -19.925 -4.632 9.436 1.00 0.84 C ATOM 427 O SER A 22 -19.581 -5.732 9.868 1.00 1.64 O ATOM 428 CB SER A 22 -21.358 -4.123 11.441 1.00 0.68 C ATOM 429 OG SER A 22 -22.676 -4.214 10.920 1.00 1.32 O ATOM 0 H SER A 22 -22.018 -2.632 9.441 1.00 0.50 H new ATOM 0 HA SER A 22 -19.508 -3.150 10.894 1.00 0.61 H new ATOM 0 HB2 SER A 22 -21.014 -5.112 11.745 1.00 0.68 H new ATOM 0 HB3 SER A 22 -21.358 -3.497 12.333 1.00 0.68 H new ATOM 0 HG SER A 22 -23.272 -4.591 11.601 1.00 1.32 H new ATOM 435 N THR A 23 -19.890 -4.328 8.136 1.00 0.41 N ATOM 436 CA THR A 23 -19.430 -5.287 7.134 1.00 0.49 C ATOM 437 C THR A 23 -18.000 -5.748 7.414 1.00 0.63 C ATOM 438 O THR A 23 -17.727 -6.947 7.418 1.00 1.47 O ATOM 439 CB THR A 23 -19.513 -4.691 5.710 1.00 0.51 C ATOM 440 OG1 THR A 23 -20.875 -4.644 5.281 1.00 0.68 O ATOM 441 CG2 THR A 23 -18.699 -5.494 4.714 1.00 0.50 C ATOM 0 H THR A 23 -20.175 -3.426 7.755 1.00 0.41 H new ATOM 0 HA THR A 23 -20.092 -6.151 7.195 1.00 0.49 H new ATOM 0 HB THR A 23 -19.099 -3.684 5.751 1.00 0.51 H new ATOM 0 HG1 THR A 23 -20.929 -4.894 4.335 1.00 0.68 H new ATOM 0 HG21 THR A 23 -18.784 -5.042 3.726 1.00 0.50 H new ATOM 0 HG22 THR A 23 -17.653 -5.501 5.021 1.00 0.50 H new ATOM 0 HG23 THR A 23 -19.074 -6.517 4.678 1.00 0.50 H new ATOM 449 N MET A 24 -17.114 -4.779 7.664 1.00 0.54 N ATOM 450 CA MET A 24 -15.691 -5.038 7.915 1.00 0.48 C ATOM 451 C MET A 24 -14.944 -5.278 6.599 1.00 0.43 C ATOM 452 O MET A 24 -15.485 -5.864 5.664 1.00 0.47 O ATOM 453 CB MET A 24 -15.509 -6.217 8.880 1.00 0.60 C ATOM 454 CG MET A 24 -14.295 -6.108 9.774 1.00 0.57 C ATOM 455 SD MET A 24 -14.323 -7.323 11.100 1.00 0.83 S ATOM 456 CE MET A 24 -13.127 -6.602 12.211 1.00 0.71 C ATOM 0 H MET A 24 -17.363 -3.790 7.698 1.00 0.54 H new ATOM 0 HA MET A 24 -15.262 -4.155 8.388 1.00 0.48 H new ATOM 0 HB2 MET A 24 -16.399 -6.301 9.504 1.00 0.60 H new ATOM 0 HB3 MET A 24 -15.438 -7.138 8.301 1.00 0.60 H new ATOM 0 HG2 MET A 24 -13.393 -6.243 9.178 1.00 0.57 H new ATOM 0 HG3 MET A 24 -14.248 -5.106 10.201 1.00 0.57 H new ATOM 0 HE1 MET A 24 -13.212 -7.071 13.191 1.00 0.71 H new ATOM 0 HE2 MET A 24 -12.123 -6.761 11.818 1.00 0.71 H new ATOM 0 HE3 MET A 24 -13.315 -5.532 12.304 1.00 0.71 H new ATOM 466 N VAL A 25 -13.711 -4.777 6.544 1.00 0.40 N ATOM 467 CA VAL A 25 -12.880 -4.815 5.329 1.00 0.38 C ATOM 468 C VAL A 25 -12.939 -6.152 4.579 1.00 0.39 C ATOM 469 O VAL A 25 -13.290 -6.180 3.402 1.00 0.39 O ATOM 470 CB VAL A 25 -11.412 -4.473 5.658 1.00 0.41 C ATOM 471 CG1 VAL A 25 -10.495 -4.749 4.474 1.00 0.42 C ATOM 472 CG2 VAL A 25 -11.305 -3.019 6.074 1.00 0.40 C ATOM 0 H VAL A 25 -13.254 -4.331 7.339 1.00 0.40 H new ATOM 0 HA VAL A 25 -13.302 -4.061 4.665 1.00 0.38 H new ATOM 0 HB VAL A 25 -11.092 -5.112 6.481 1.00 0.41 H new ATOM 0 HG11 VAL A 25 -9.469 -4.497 4.742 1.00 0.42 H new ATOM 0 HG12 VAL A 25 -10.551 -5.805 4.208 1.00 0.42 H new ATOM 0 HG13 VAL A 25 -10.807 -4.144 3.623 1.00 0.42 H new ATOM 0 HG21 VAL A 25 -10.266 -2.782 6.305 1.00 0.40 H new ATOM 0 HG22 VAL A 25 -11.650 -2.381 5.260 1.00 0.40 H new ATOM 0 HG23 VAL A 25 -11.922 -2.847 6.956 1.00 0.40 H new ATOM 482 N TYR A 26 -12.613 -7.248 5.258 1.00 0.42 N ATOM 483 CA TYR A 26 -12.513 -8.549 4.593 1.00 0.45 C ATOM 484 C TYR A 26 -13.832 -8.955 3.926 1.00 0.43 C ATOM 485 O TYR A 26 -13.833 -9.651 2.909 1.00 0.42 O ATOM 486 CB TYR A 26 -12.036 -9.639 5.561 1.00 0.52 C ATOM 487 CG TYR A 26 -13.023 -10.030 6.642 1.00 0.56 C ATOM 488 CD1 TYR A 26 -13.076 -9.331 7.842 1.00 0.58 C ATOM 489 CD2 TYR A 26 -13.919 -11.074 6.452 1.00 0.70 C ATOM 490 CE1 TYR A 26 -13.987 -9.664 8.822 1.00 0.65 C ATOM 491 CE2 TYR A 26 -14.839 -11.409 7.428 1.00 0.78 C ATOM 492 CZ TYR A 26 -14.799 -10.795 8.639 1.00 0.72 C ATOM 493 OH TYR A 26 -15.789 -11.024 9.581 1.00 0.83 O ATOM 0 H TYR A 26 -12.415 -7.265 6.258 1.00 0.42 H new ATOM 0 HA TYR A 26 -11.766 -8.444 3.807 1.00 0.45 H new ATOM 0 HB2 TYR A 26 -11.785 -10.529 4.983 1.00 0.52 H new ATOM 0 HB3 TYR A 26 -11.117 -9.299 6.038 1.00 0.52 H new ATOM 0 HD1 TYR A 26 -12.392 -8.513 8.010 1.00 0.58 H new ATOM 0 HD2 TYR A 26 -13.897 -11.633 5.528 1.00 0.70 H new ATOM 0 HE1 TYR A 26 -14.075 -9.065 9.716 1.00 0.65 H new ATOM 0 HE2 TYR A 26 -15.590 -12.159 7.228 1.00 0.78 H new ATOM 0 HH TYR A 26 -16.285 -11.836 9.344 1.00 0.83 H new ATOM 503 N ASP A 27 -14.945 -8.513 4.491 1.00 0.43 N ATOM 504 CA ASP A 27 -16.256 -8.815 3.928 1.00 0.44 C ATOM 505 C ASP A 27 -16.509 -7.926 2.713 1.00 0.39 C ATOM 506 O ASP A 27 -17.012 -8.374 1.686 1.00 0.40 O ATOM 507 CB ASP A 27 -17.347 -8.604 4.981 1.00 0.50 C ATOM 508 CG ASP A 27 -18.670 -9.275 4.639 1.00 0.91 C ATOM 509 OD1 ASP A 27 -19.026 -9.307 3.443 1.00 1.48 O ATOM 510 OD2 ASP A 27 -19.369 -9.751 5.553 1.00 1.24 O ATOM 0 H ASP A 27 -14.969 -7.945 5.338 1.00 0.43 H new ATOM 0 HA ASP A 27 -16.279 -9.859 3.615 1.00 0.44 H new ATOM 0 HB2 ASP A 27 -16.993 -8.986 5.939 1.00 0.50 H new ATOM 0 HB3 ASP A 27 -17.515 -7.534 5.107 1.00 0.50 H new ATOM 515 N ALA A 28 -16.126 -6.661 2.824 1.00 0.37 N ATOM 516 CA ALA A 28 -16.291 -5.716 1.730 1.00 0.33 C ATOM 517 C ALA A 28 -15.516 -6.184 0.508 1.00 0.32 C ATOM 518 O ALA A 28 -16.028 -6.179 -0.614 1.00 0.31 O ATOM 519 CB ALA A 28 -15.831 -4.329 2.155 1.00 0.33 C ATOM 0 H ALA A 28 -15.699 -6.266 3.662 1.00 0.37 H new ATOM 0 HA ALA A 28 -17.348 -5.664 1.470 1.00 0.33 H new ATOM 0 HB1 ALA A 28 -15.960 -3.633 1.326 1.00 0.33 H new ATOM 0 HB2 ALA A 28 -16.424 -3.994 3.006 1.00 0.33 H new ATOM 0 HB3 ALA A 28 -14.779 -4.365 2.437 1.00 0.33 H new ATOM 525 N CYS A 29 -14.289 -6.615 0.755 1.00 0.35 N ATOM 526 CA CYS A 29 -13.405 -7.118 -0.284 1.00 0.37 C ATOM 527 C CYS A 29 -14.010 -8.311 -1.034 1.00 0.38 C ATOM 528 O CYS A 29 -13.759 -8.493 -2.227 1.00 0.40 O ATOM 529 CB CYS A 29 -12.069 -7.512 0.338 1.00 0.45 C ATOM 530 SG CYS A 29 -11.127 -6.124 1.010 1.00 1.37 S ATOM 0 H CYS A 29 -13.876 -6.626 1.688 1.00 0.35 H new ATOM 0 HA CYS A 29 -13.259 -6.322 -1.014 1.00 0.37 H new ATOM 0 HB2 CYS A 29 -12.251 -8.233 1.135 1.00 0.45 H new ATOM 0 HB3 CYS A 29 -11.464 -8.016 -0.416 1.00 0.45 H new ATOM 0 HG CYS A 29 -11.659 -5.742 2.133 1.00 1.37 H new ATOM 536 N ARG A 30 -14.806 -9.127 -0.350 1.00 0.40 N ATOM 537 CA ARG A 30 -15.372 -10.311 -0.990 1.00 0.44 C ATOM 538 C ARG A 30 -16.575 -9.938 -1.853 1.00 0.42 C ATOM 539 O ARG A 30 -16.731 -10.444 -2.963 1.00 0.45 O ATOM 540 CB ARG A 30 -15.742 -11.392 0.037 1.00 0.49 C ATOM 541 CG ARG A 30 -16.987 -11.105 0.864 1.00 0.53 C ATOM 542 CD ARG A 30 -17.179 -12.164 1.933 1.00 0.71 C ATOM 543 NE ARG A 30 -18.258 -11.836 2.859 1.00 1.12 N ATOM 544 CZ ARG A 30 -18.885 -12.737 3.612 1.00 1.68 C ATOM 545 NH1 ARG A 30 -18.598 -14.028 3.485 1.00 1.94 N ATOM 546 NH2 ARG A 30 -19.797 -12.349 4.496 1.00 2.41 N ATOM 0 H ARG A 30 -15.070 -8.996 0.626 1.00 0.40 H new ATOM 0 HA ARG A 30 -14.604 -10.732 -1.639 1.00 0.44 H new ATOM 0 HB2 ARG A 30 -15.885 -12.336 -0.489 1.00 0.49 H new ATOM 0 HB3 ARG A 30 -14.899 -11.529 0.715 1.00 0.49 H new ATOM 0 HG2 ARG A 30 -16.902 -10.123 1.330 1.00 0.53 H new ATOM 0 HG3 ARG A 30 -17.862 -11.075 0.214 1.00 0.53 H new ATOM 0 HD2 ARG A 30 -17.392 -13.121 1.457 1.00 0.71 H new ATOM 0 HD3 ARG A 30 -16.250 -12.285 2.491 1.00 0.71 H new ATOM 0 HE ARG A 30 -18.548 -10.861 2.934 1.00 1.12 H new ATOM 0 HH11 ARG A 30 -17.896 -14.330 2.810 1.00 1.94 H new ATOM 0 HH12 ARG A 30 -19.080 -14.717 4.063 1.00 1.94 H new ATOM 0 HH21 ARG A 30 -20.018 -11.359 4.599 1.00 2.41 H new ATOM 0 HH22 ARG A 30 -20.276 -13.041 5.072 1.00 2.41 H new ATOM 560 N MET A 31 -17.407 -9.030 -1.356 1.00 0.39 N ATOM 561 CA MET A 31 -18.603 -8.621 -2.073 1.00 0.40 C ATOM 562 C MET A 31 -18.270 -7.801 -3.308 1.00 0.38 C ATOM 563 O MET A 31 -18.906 -7.962 -4.341 1.00 0.44 O ATOM 564 CB MET A 31 -19.519 -7.817 -1.167 1.00 0.39 C ATOM 565 CG MET A 31 -19.970 -8.582 0.058 1.00 0.43 C ATOM 566 SD MET A 31 -20.943 -7.559 1.167 1.00 0.45 S ATOM 567 CE MET A 31 -19.693 -6.355 1.586 1.00 0.39 C ATOM 0 H MET A 31 -17.273 -8.564 -0.458 1.00 0.39 H new ATOM 0 HA MET A 31 -19.110 -9.531 -2.393 1.00 0.40 H new ATOM 0 HB2 MET A 31 -19.002 -6.911 -0.851 1.00 0.39 H new ATOM 0 HB3 MET A 31 -20.395 -7.503 -1.734 1.00 0.39 H new ATOM 0 HG2 MET A 31 -20.560 -9.445 -0.250 1.00 0.43 H new ATOM 0 HG3 MET A 31 -19.098 -8.964 0.588 1.00 0.43 H new ATOM 0 HE1 MET A 31 -20.105 -5.633 2.291 1.00 0.39 H new ATOM 0 HE2 MET A 31 -18.840 -6.859 2.040 1.00 0.39 H new ATOM 0 HE3 MET A 31 -19.370 -5.837 0.683 1.00 0.39 H new ATOM 577 N ILE A 32 -17.286 -6.917 -3.207 1.00 0.34 N ATOM 578 CA ILE A 32 -16.920 -6.076 -4.339 1.00 0.33 C ATOM 579 C ILE A 32 -16.415 -6.929 -5.506 1.00 0.36 C ATOM 580 O ILE A 32 -16.735 -6.662 -6.665 1.00 0.40 O ATOM 581 CB ILE A 32 -15.872 -5.013 -3.946 1.00 0.30 C ATOM 582 CG1 ILE A 32 -15.565 -4.118 -5.145 1.00 0.40 C ATOM 583 CG2 ILE A 32 -14.600 -5.658 -3.411 1.00 0.30 C ATOM 584 CD1 ILE A 32 -14.522 -3.070 -4.864 1.00 0.48 C ATOM 0 H ILE A 32 -16.733 -6.764 -2.364 1.00 0.34 H new ATOM 0 HA ILE A 32 -17.818 -5.548 -4.658 1.00 0.33 H new ATOM 0 HB ILE A 32 -16.287 -4.401 -3.145 1.00 0.30 H new ATOM 0 HG12 ILE A 32 -15.229 -4.740 -5.975 1.00 0.40 H new ATOM 0 HG13 ILE A 32 -16.484 -3.627 -5.466 1.00 0.40 H new ATOM 0 HG21 ILE A 32 -13.883 -4.882 -3.144 1.00 0.30 H new ATOM 0 HG22 ILE A 32 -14.837 -6.253 -2.529 1.00 0.30 H new ATOM 0 HG23 ILE A 32 -14.169 -6.302 -4.177 1.00 0.30 H new ATOM 0 HD11 ILE A 32 -14.356 -2.472 -5.760 1.00 0.48 H new ATOM 0 HD12 ILE A 32 -14.864 -2.424 -4.055 1.00 0.48 H new ATOM 0 HD13 ILE A 32 -13.590 -3.554 -4.572 1.00 0.48 H new ATOM 596 N ARG A 33 -15.659 -7.975 -5.176 1.00 0.36 N ATOM 597 CA ARG A 33 -15.187 -8.947 -6.162 1.00 0.41 C ATOM 598 C ARG A 33 -16.351 -9.618 -6.889 1.00 0.45 C ATOM 599 O ARG A 33 -16.208 -10.072 -8.026 1.00 0.49 O ATOM 600 CB ARG A 33 -14.306 -10.003 -5.492 1.00 0.45 C ATOM 601 CG ARG A 33 -12.877 -9.544 -5.258 1.00 1.01 C ATOM 602 CD ARG A 33 -12.050 -10.621 -4.576 1.00 0.94 C ATOM 603 NE ARG A 33 -12.275 -10.659 -3.132 1.00 0.64 N ATOM 604 CZ ARG A 33 -11.804 -11.612 -2.325 1.00 0.84 C ATOM 605 NH1 ARG A 33 -11.186 -12.674 -2.829 1.00 1.32 N ATOM 606 NH2 ARG A 33 -11.979 -11.521 -1.012 1.00 1.22 N ATOM 0 H ARG A 33 -15.357 -8.172 -4.222 1.00 0.36 H new ATOM 0 HA ARG A 33 -14.596 -8.407 -6.901 1.00 0.41 H new ATOM 0 HB2 ARG A 33 -14.750 -10.281 -4.536 1.00 0.45 H new ATOM 0 HB3 ARG A 33 -14.294 -10.900 -6.111 1.00 0.45 H new ATOM 0 HG2 ARG A 33 -12.418 -9.280 -6.211 1.00 1.01 H new ATOM 0 HG3 ARG A 33 -12.879 -8.643 -4.645 1.00 1.01 H new ATOM 0 HD2 ARG A 33 -12.296 -11.592 -5.006 1.00 0.94 H new ATOM 0 HD3 ARG A 33 -10.993 -10.444 -4.773 1.00 0.94 H new ATOM 0 HE ARG A 33 -12.827 -9.910 -2.715 1.00 0.64 H new ATOM 0 HH11 ARG A 33 -11.069 -12.765 -3.838 1.00 1.32 H new ATOM 0 HH12 ARG A 33 -10.828 -13.399 -2.207 1.00 1.32 H new ATOM 0 HH21 ARG A 33 -12.474 -10.721 -0.618 1.00 1.22 H new ATOM 0 HH22 ARG A 33 -11.618 -12.251 -0.398 1.00 1.22 H new ATOM 620 N GLU A 34 -17.491 -9.690 -6.218 1.00 0.46 N ATOM 621 CA GLU A 34 -18.670 -10.339 -6.763 1.00 0.51 C ATOM 622 C GLU A 34 -19.242 -9.548 -7.938 1.00 0.50 C ATOM 623 O GLU A 34 -19.335 -10.054 -9.056 1.00 0.54 O ATOM 624 CB GLU A 34 -19.728 -10.468 -5.669 1.00 0.55 C ATOM 625 CG GLU A 34 -19.374 -11.458 -4.571 1.00 0.90 C ATOM 626 CD GLU A 34 -19.424 -12.896 -5.037 1.00 1.51 C ATOM 627 OE1 GLU A 34 -18.412 -13.389 -5.581 1.00 2.40 O ATOM 628 OE2 GLU A 34 -20.475 -13.544 -4.849 1.00 1.50 O ATOM 0 H GLU A 34 -17.623 -9.301 -5.284 1.00 0.46 H new ATOM 0 HA GLU A 34 -18.384 -11.327 -7.125 1.00 0.51 H new ATOM 0 HB2 GLU A 34 -19.891 -9.488 -5.220 1.00 0.55 H new ATOM 0 HB3 GLU A 34 -20.671 -10.771 -6.125 1.00 0.55 H new ATOM 0 HG2 GLU A 34 -18.374 -11.237 -4.198 1.00 0.90 H new ATOM 0 HG3 GLU A 34 -20.062 -11.328 -3.736 1.00 0.90 H new ATOM 635 N ARG A 35 -19.617 -8.302 -7.677 1.00 0.51 N ATOM 636 CA ARG A 35 -20.273 -7.477 -8.686 1.00 0.55 C ATOM 637 C ARG A 35 -19.276 -6.787 -9.617 1.00 0.49 C ATOM 638 O ARG A 35 -19.462 -6.788 -10.832 1.00 0.54 O ATOM 639 CB ARG A 35 -21.221 -6.443 -8.056 1.00 0.72 C ATOM 640 CG ARG A 35 -20.606 -5.601 -6.949 1.00 0.77 C ATOM 641 CD ARG A 35 -20.827 -6.224 -5.582 1.00 0.79 C ATOM 642 NE ARG A 35 -22.233 -6.251 -5.192 1.00 1.02 N ATOM 643 CZ ARG A 35 -22.735 -7.108 -4.305 1.00 1.46 C ATOM 644 NH1 ARG A 35 -21.949 -8.033 -3.763 1.00 1.79 N ATOM 645 NH2 ARG A 35 -24.015 -7.041 -3.966 1.00 1.90 N ATOM 0 H ARG A 35 -19.479 -7.841 -6.778 1.00 0.51 H new ATOM 0 HA ARG A 35 -20.868 -8.162 -9.290 1.00 0.55 H new ATOM 0 HB2 ARG A 35 -21.582 -5.778 -8.840 1.00 0.72 H new ATOM 0 HB3 ARG A 35 -22.090 -6.965 -7.655 1.00 0.72 H new ATOM 0 HG2 ARG A 35 -19.537 -5.488 -7.129 1.00 0.77 H new ATOM 0 HG3 ARG A 35 -21.040 -4.601 -6.968 1.00 0.77 H new ATOM 0 HD2 ARG A 35 -20.436 -7.241 -5.584 1.00 0.79 H new ATOM 0 HD3 ARG A 35 -20.259 -5.666 -4.838 1.00 0.79 H new ATOM 0 HE ARG A 35 -22.866 -5.577 -5.622 1.00 1.02 H new ATOM 0 HH11 ARG A 35 -20.965 -8.084 -4.027 1.00 1.79 H new ATOM 0 HH12 ARG A 35 -22.330 -8.691 -3.083 1.00 1.79 H new ATOM 0 HH21 ARG A 35 -24.617 -6.332 -4.385 1.00 1.90 H new ATOM 0 HH22 ARG A 35 -24.398 -7.698 -3.286 1.00 1.90 H new ATOM 659 N ILE A 36 -18.217 -6.211 -9.059 1.00 0.45 N ATOM 660 CA ILE A 36 -17.308 -5.382 -9.846 1.00 0.43 C ATOM 661 C ILE A 36 -16.078 -6.178 -10.282 1.00 0.45 C ATOM 662 O ILE A 36 -15.197 -6.473 -9.474 1.00 0.44 O ATOM 663 CB ILE A 36 -16.860 -4.129 -9.057 1.00 0.43 C ATOM 664 CG1 ILE A 36 -18.073 -3.419 -8.449 1.00 0.43 C ATOM 665 CG2 ILE A 36 -16.096 -3.173 -9.963 1.00 0.44 C ATOM 666 CD1 ILE A 36 -17.712 -2.207 -7.617 1.00 0.44 C ATOM 0 H ILE A 36 -17.967 -6.301 -8.074 1.00 0.45 H new ATOM 0 HA ILE A 36 -17.855 -5.059 -10.732 1.00 0.43 H new ATOM 0 HB ILE A 36 -16.200 -4.449 -8.251 1.00 0.43 H new ATOM 0 HG12 ILE A 36 -18.743 -3.112 -9.252 1.00 0.43 H new ATOM 0 HG13 ILE A 36 -18.623 -4.125 -7.827 1.00 0.43 H new ATOM 0 HG21 ILE A 36 -15.789 -2.297 -9.391 1.00 0.44 H new ATOM 0 HG22 ILE A 36 -15.214 -3.675 -10.360 1.00 0.44 H new ATOM 0 HG23 ILE A 36 -16.738 -2.861 -10.787 1.00 0.44 H new ATOM 0 HD11 ILE A 36 -18.621 -1.755 -7.219 1.00 0.44 H new ATOM 0 HD12 ILE A 36 -17.066 -2.511 -6.793 1.00 0.44 H new ATOM 0 HD13 ILE A 36 -17.189 -1.481 -8.239 1.00 0.44 H new ATOM 678 N PRO A 37 -16.000 -6.527 -11.575 1.00 0.53 N ATOM 679 CA PRO A 37 -14.898 -7.319 -12.126 1.00 0.60 C ATOM 680 C PRO A 37 -13.627 -6.493 -12.302 1.00 0.61 C ATOM 681 O PRO A 37 -12.566 -7.022 -12.634 1.00 0.71 O ATOM 682 CB PRO A 37 -15.425 -7.788 -13.491 1.00 0.73 C ATOM 683 CG PRO A 37 -16.855 -7.351 -13.553 1.00 0.76 C ATOM 684 CD PRO A 37 -16.978 -6.190 -12.613 1.00 0.60 C ATOM 0 HA PRO A 37 -14.621 -8.139 -11.464 1.00 0.60 H new ATOM 0 HB2 PRO A 37 -14.847 -7.349 -14.304 1.00 0.73 H new ATOM 0 HB3 PRO A 37 -15.343 -8.870 -13.590 1.00 0.73 H new ATOM 0 HG2 PRO A 37 -17.130 -7.062 -14.567 1.00 0.76 H new ATOM 0 HG3 PRO A 37 -17.523 -8.161 -13.260 1.00 0.76 H new ATOM 0 HD2 PRO A 37 -16.744 -5.244 -13.101 1.00 0.60 H new ATOM 0 HD3 PRO A 37 -17.986 -6.099 -12.208 1.00 0.60 H new ATOM 692 N GLU A 38 -13.743 -5.193 -12.075 1.00 0.57 N ATOM 693 CA GLU A 38 -12.602 -4.292 -12.165 1.00 0.61 C ATOM 694 C GLU A 38 -11.759 -4.365 -10.898 1.00 0.54 C ATOM 695 O GLU A 38 -10.623 -3.896 -10.868 1.00 0.62 O ATOM 696 CB GLU A 38 -13.074 -2.858 -12.396 1.00 0.75 C ATOM 697 CG GLU A 38 -13.745 -2.656 -13.741 1.00 0.99 C ATOM 698 CD GLU A 38 -12.823 -2.985 -14.896 1.00 1.67 C ATOM 699 OE1 GLU A 38 -11.915 -2.179 -15.183 1.00 2.46 O ATOM 700 OE2 GLU A 38 -13.005 -4.046 -15.528 1.00 2.04 O ATOM 0 H GLU A 38 -14.620 -4.736 -11.826 1.00 0.57 H new ATOM 0 HA GLU A 38 -11.988 -4.602 -13.010 1.00 0.61 H new ATOM 0 HB2 GLU A 38 -13.771 -2.580 -11.605 1.00 0.75 H new ATOM 0 HB3 GLU A 38 -12.220 -2.185 -12.319 1.00 0.75 H new ATOM 0 HG2 GLU A 38 -14.635 -3.283 -13.799 1.00 0.99 H new ATOM 0 HG3 GLU A 38 -14.078 -1.622 -13.827 1.00 0.99 H new ATOM 707 N ALA A 39 -12.329 -4.962 -9.860 1.00 0.47 N ATOM 708 CA ALA A 39 -11.652 -5.089 -8.578 1.00 0.47 C ATOM 709 C ALA A 39 -10.430 -5.993 -8.689 1.00 0.49 C ATOM 710 O ALA A 39 -9.325 -5.615 -8.305 1.00 0.55 O ATOM 711 CB ALA A 39 -12.619 -5.623 -7.531 1.00 0.47 C ATOM 0 H ALA A 39 -13.264 -5.368 -9.882 1.00 0.47 H new ATOM 0 HA ALA A 39 -11.308 -4.101 -8.272 1.00 0.47 H new ATOM 0 HB1 ALA A 39 -12.105 -5.715 -6.574 1.00 0.47 H new ATOM 0 HB2 ALA A 39 -13.459 -4.936 -7.427 1.00 0.47 H new ATOM 0 HB3 ALA A 39 -12.987 -6.601 -7.841 1.00 0.47 H new ATOM 717 N LEU A 40 -10.625 -7.185 -9.232 1.00 0.50 N ATOM 718 CA LEU A 40 -9.542 -8.150 -9.340 1.00 0.59 C ATOM 719 C LEU A 40 -8.798 -8.015 -10.670 1.00 0.67 C ATOM 720 O LEU A 40 -8.813 -8.914 -11.510 1.00 0.99 O ATOM 721 CB LEU A 40 -10.029 -9.604 -9.104 1.00 0.65 C ATOM 722 CG LEU A 40 -11.426 -10.004 -9.639 1.00 0.62 C ATOM 723 CD1 LEU A 40 -12.543 -9.410 -8.794 1.00 1.29 C ATOM 724 CD2 LEU A 40 -11.594 -9.594 -11.090 1.00 1.19 C ATOM 0 H LEU A 40 -11.519 -7.506 -9.603 1.00 0.50 H new ATOM 0 HA LEU A 40 -8.834 -7.920 -8.544 1.00 0.59 H new ATOM 0 HB2 LEU A 40 -9.297 -10.277 -9.550 1.00 0.65 H new ATOM 0 HB3 LEU A 40 -10.019 -9.788 -8.030 1.00 0.65 H new ATOM 0 HG LEU A 40 -11.494 -11.090 -9.573 1.00 0.62 H new ATOM 0 HD11 LEU A 40 -13.508 -9.713 -9.201 1.00 1.29 H new ATOM 0 HD12 LEU A 40 -12.453 -9.768 -7.768 1.00 1.29 H new ATOM 0 HD13 LEU A 40 -12.470 -8.323 -8.806 1.00 1.29 H new ATOM 0 HD21 LEU A 40 -12.584 -9.888 -11.439 1.00 1.19 H new ATOM 0 HD22 LEU A 40 -11.484 -8.513 -11.178 1.00 1.19 H new ATOM 0 HD23 LEU A 40 -10.835 -10.086 -11.697 1.00 1.19 H new ATOM 736 N ALA A 41 -8.147 -6.871 -10.858 1.00 0.65 N ATOM 737 CA ALA A 41 -7.327 -6.644 -12.046 1.00 0.74 C ATOM 738 C ALA A 41 -6.165 -7.631 -12.078 1.00 0.81 C ATOM 739 O ALA A 41 -5.601 -7.929 -13.131 1.00 1.15 O ATOM 740 CB ALA A 41 -6.817 -5.211 -12.073 1.00 0.92 C ATOM 0 H ALA A 41 -8.170 -6.088 -10.205 1.00 0.65 H new ATOM 0 HA ALA A 41 -7.941 -6.804 -12.933 1.00 0.74 H new ATOM 0 HB1 ALA A 41 -6.208 -5.058 -12.964 1.00 0.92 H new ATOM 0 HB2 ALA A 41 -7.663 -4.524 -12.090 1.00 0.92 H new ATOM 0 HB3 ALA A 41 -6.214 -5.023 -11.185 1.00 0.92 H new ATOM 746 N GLY A 42 -5.821 -8.125 -10.902 1.00 0.75 N ATOM 747 CA GLY A 42 -4.831 -9.167 -10.768 1.00 0.86 C ATOM 748 C GLY A 42 -5.252 -10.145 -9.696 1.00 0.80 C ATOM 749 O GLY A 42 -6.451 -10.340 -9.497 1.00 0.82 O ATOM 0 H GLY A 42 -6.222 -7.813 -10.018 1.00 0.75 H new ATOM 0 HA2 GLY A 42 -4.707 -9.687 -11.718 1.00 0.86 H new ATOM 0 HA3 GLY A 42 -3.864 -8.731 -10.515 1.00 0.86 H new ATOM 753 N PRO A 43 -4.308 -10.767 -8.977 1.00 0.83 N ATOM 754 CA PRO A 43 -4.639 -11.652 -7.859 1.00 0.82 C ATOM 755 C PRO A 43 -5.349 -10.892 -6.739 1.00 0.72 C ATOM 756 O PRO A 43 -4.752 -10.029 -6.091 1.00 0.66 O ATOM 757 CB PRO A 43 -3.279 -12.173 -7.381 1.00 0.94 C ATOM 758 CG PRO A 43 -2.278 -11.211 -7.921 1.00 1.09 C ATOM 759 CD PRO A 43 -2.857 -10.671 -9.197 1.00 0.98 C ATOM 0 HA PRO A 43 -5.319 -12.451 -8.154 1.00 0.82 H new ATOM 0 HB2 PRO A 43 -3.235 -12.217 -6.293 1.00 0.94 H new ATOM 0 HB3 PRO A 43 -3.093 -13.182 -7.749 1.00 0.94 H new ATOM 0 HG2 PRO A 43 -2.088 -10.407 -7.210 1.00 1.09 H new ATOM 0 HG3 PRO A 43 -1.324 -11.705 -8.106 1.00 1.09 H new ATOM 0 HD2 PRO A 43 -2.545 -9.642 -9.377 1.00 0.98 H new ATOM 0 HD3 PRO A 43 -2.542 -11.256 -10.061 1.00 0.98 H new ATOM 767 N PRO A 44 -6.638 -11.201 -6.502 1.00 0.76 N ATOM 768 CA PRO A 44 -7.473 -10.482 -5.526 1.00 0.73 C ATOM 769 C PRO A 44 -6.920 -10.554 -4.109 1.00 0.69 C ATOM 770 O PRO A 44 -7.239 -9.718 -3.263 1.00 0.74 O ATOM 771 CB PRO A 44 -8.826 -11.194 -5.605 1.00 0.93 C ATOM 772 CG PRO A 44 -8.538 -12.512 -6.233 1.00 0.99 C ATOM 773 CD PRO A 44 -7.386 -12.281 -7.166 1.00 0.89 C ATOM 0 HA PRO A 44 -7.523 -9.418 -5.756 1.00 0.73 H new ATOM 0 HB2 PRO A 44 -9.264 -11.317 -4.615 1.00 0.93 H new ATOM 0 HB3 PRO A 44 -9.538 -10.622 -6.200 1.00 0.93 H new ATOM 0 HG2 PRO A 44 -8.286 -13.257 -5.479 1.00 0.99 H new ATOM 0 HG3 PRO A 44 -9.408 -12.886 -6.772 1.00 0.99 H new ATOM 0 HD2 PRO A 44 -6.778 -13.178 -7.288 1.00 0.89 H new ATOM 0 HD3 PRO A 44 -7.723 -11.987 -8.160 1.00 0.89 H new ATOM 781 N ASN A 45 -6.084 -11.553 -3.864 1.00 0.72 N ATOM 782 CA ASN A 45 -5.445 -11.728 -2.563 1.00 0.77 C ATOM 783 C ASN A 45 -4.533 -10.550 -2.262 1.00 0.71 C ATOM 784 O ASN A 45 -4.293 -10.210 -1.105 1.00 0.85 O ATOM 785 CB ASN A 45 -4.626 -13.017 -2.544 1.00 0.87 C ATOM 786 CG ASN A 45 -5.443 -14.235 -2.917 1.00 1.41 C ATOM 787 OD1 ASN A 45 -6.634 -14.320 -2.616 1.00 2.21 O ATOM 788 ND2 ASN A 45 -4.809 -15.176 -3.594 1.00 1.37 N ATOM 0 H ASN A 45 -5.830 -12.261 -4.553 1.00 0.72 H new ATOM 0 HA ASN A 45 -6.225 -11.785 -1.803 1.00 0.77 H new ATOM 0 HB2 ASN A 45 -3.789 -12.921 -3.235 1.00 0.87 H new ATOM 0 HB3 ASN A 45 -4.203 -13.159 -1.549 1.00 0.87 H new ATOM 0 HD21 ASN A 45 -5.307 -16.015 -3.889 1.00 1.37 H new ATOM 0 HD22 ASN A 45 -3.821 -15.063 -3.821 1.00 1.37 H new ATOM 795 N ASP A 46 -4.039 -9.921 -3.316 1.00 0.61 N ATOM 796 CA ASP A 46 -3.127 -8.800 -3.180 1.00 0.68 C ATOM 797 C ASP A 46 -3.854 -7.487 -3.413 1.00 0.57 C ATOM 798 O ASP A 46 -3.258 -6.511 -3.853 1.00 0.61 O ATOM 799 CB ASP A 46 -1.964 -8.933 -4.164 1.00 0.83 C ATOM 800 CG ASP A 46 -1.087 -10.132 -3.865 1.00 1.22 C ATOM 801 OD1 ASP A 46 -0.442 -10.148 -2.796 1.00 1.90 O ATOM 802 OD2 ASP A 46 -1.039 -11.061 -4.696 1.00 1.38 O ATOM 0 H ASP A 46 -4.257 -10.171 -4.281 1.00 0.61 H new ATOM 0 HA ASP A 46 -2.732 -8.806 -2.164 1.00 0.68 H new ATOM 0 HB2 ASP A 46 -2.357 -9.018 -5.177 1.00 0.83 H new ATOM 0 HB3 ASP A 46 -1.359 -8.027 -4.132 1.00 0.83 H new ATOM 807 N PHE A 47 -5.144 -7.466 -3.120 1.00 0.53 N ATOM 808 CA PHE A 47 -5.939 -6.249 -3.221 1.00 0.47 C ATOM 809 C PHE A 47 -6.566 -5.921 -1.874 1.00 0.44 C ATOM 810 O PHE A 47 -7.094 -6.806 -1.199 1.00 0.48 O ATOM 811 CB PHE A 47 -7.028 -6.397 -4.289 1.00 0.49 C ATOM 812 CG PHE A 47 -6.541 -6.203 -5.699 1.00 0.51 C ATOM 813 CD1 PHE A 47 -6.059 -7.276 -6.428 1.00 0.79 C ATOM 814 CD2 PHE A 47 -6.558 -4.952 -6.293 1.00 0.78 C ATOM 815 CE1 PHE A 47 -5.606 -7.109 -7.720 1.00 0.85 C ATOM 816 CE2 PHE A 47 -6.106 -4.779 -7.586 1.00 0.80 C ATOM 817 CZ PHE A 47 -5.652 -5.828 -8.305 1.00 0.63 C ATOM 0 H PHE A 47 -5.668 -8.284 -2.808 1.00 0.53 H new ATOM 0 HA PHE A 47 -5.280 -5.432 -3.515 1.00 0.47 H new ATOM 0 HB2 PHE A 47 -7.472 -7.389 -4.203 1.00 0.49 H new ATOM 0 HB3 PHE A 47 -7.819 -5.675 -4.087 1.00 0.49 H new ATOM 0 HD1 PHE A 47 -6.037 -8.258 -5.979 1.00 0.79 H new ATOM 0 HD2 PHE A 47 -6.929 -4.103 -5.739 1.00 0.78 H new ATOM 0 HE1 PHE A 47 -5.221 -7.950 -8.277 1.00 0.85 H new ATOM 0 HE2 PHE A 47 -6.116 -3.793 -8.027 1.00 0.80 H new ATOM 0 HZ PHE A 47 -5.325 -5.686 -9.325 1.00 0.63 H new ATOM 827 N GLY A 48 -6.483 -4.660 -1.472 1.00 0.42 N ATOM 828 CA GLY A 48 -7.044 -4.246 -0.202 1.00 0.41 C ATOM 829 C GLY A 48 -7.786 -2.930 -0.306 1.00 0.35 C ATOM 830 O GLY A 48 -7.861 -2.335 -1.382 1.00 0.34 O ATOM 0 H GLY A 48 -6.036 -3.914 -2.005 1.00 0.42 H new ATOM 0 HA2 GLY A 48 -7.724 -5.017 0.161 1.00 0.41 H new ATOM 0 HA3 GLY A 48 -6.245 -4.153 0.533 1.00 0.41 H new ATOM 834 N LEU A 49 -8.315 -2.460 0.816 1.00 0.31 N ATOM 835 CA LEU A 49 -9.132 -1.256 0.827 1.00 0.28 C ATOM 836 C LEU A 49 -8.333 -0.050 1.315 1.00 0.29 C ATOM 837 O LEU A 49 -7.921 0.018 2.470 1.00 0.31 O ATOM 838 CB LEU A 49 -10.367 -1.467 1.709 1.00 0.26 C ATOM 839 CG LEU A 49 -11.254 -2.647 1.300 1.00 0.26 C ATOM 840 CD1 LEU A 49 -12.413 -2.814 2.268 1.00 0.27 C ATOM 841 CD2 LEU A 49 -11.773 -2.461 -0.116 1.00 0.25 C ATOM 0 H LEU A 49 -8.192 -2.895 1.730 1.00 0.31 H new ATOM 0 HA LEU A 49 -9.453 -1.054 -0.195 1.00 0.28 H new ATOM 0 HB2 LEU A 49 -10.040 -1.616 2.738 1.00 0.26 H new ATOM 0 HB3 LEU A 49 -10.967 -0.557 1.694 1.00 0.26 H new ATOM 0 HG LEU A 49 -10.647 -3.552 1.332 1.00 0.26 H new ATOM 0 HD11 LEU A 49 -13.028 -3.658 1.957 1.00 0.27 H new ATOM 0 HD12 LEU A 49 -12.026 -2.997 3.270 1.00 0.27 H new ATOM 0 HD13 LEU A 49 -13.017 -1.907 2.272 1.00 0.27 H new ATOM 0 HD21 LEU A 49 -12.401 -3.310 -0.388 1.00 0.25 H new ATOM 0 HD22 LEU A 49 -12.359 -1.544 -0.171 1.00 0.25 H new ATOM 0 HD23 LEU A 49 -10.932 -2.396 -0.806 1.00 0.25 H new ATOM 853 N PHE A 50 -8.086 0.875 0.408 1.00 0.29 N ATOM 854 CA PHE A 50 -7.421 2.124 0.745 1.00 0.30 C ATOM 855 C PHE A 50 -8.448 3.242 0.879 1.00 0.30 C ATOM 856 O PHE A 50 -9.319 3.400 0.035 1.00 0.31 O ATOM 857 CB PHE A 50 -6.381 2.481 -0.323 1.00 0.34 C ATOM 858 CG PHE A 50 -5.595 3.728 -0.013 1.00 0.34 C ATOM 859 CD1 PHE A 50 -4.498 3.679 0.833 1.00 0.37 C ATOM 860 CD2 PHE A 50 -5.953 4.946 -0.569 1.00 0.36 C ATOM 861 CE1 PHE A 50 -3.775 4.822 1.120 1.00 0.38 C ATOM 862 CE2 PHE A 50 -5.233 6.090 -0.286 1.00 0.38 C ATOM 863 CZ PHE A 50 -4.144 6.029 0.559 1.00 0.37 C ATOM 0 H PHE A 50 -8.337 0.786 -0.577 1.00 0.29 H new ATOM 0 HA PHE A 50 -6.907 2.002 1.699 1.00 0.30 H new ATOM 0 HB2 PHE A 50 -5.690 1.646 -0.437 1.00 0.34 H new ATOM 0 HB3 PHE A 50 -6.886 2.610 -1.280 1.00 0.34 H new ATOM 0 HD1 PHE A 50 -4.205 2.737 1.273 1.00 0.37 H new ATOM 0 HD2 PHE A 50 -6.805 5.001 -1.231 1.00 0.36 H new ATOM 0 HE1 PHE A 50 -2.923 4.771 1.782 1.00 0.38 H new ATOM 0 HE2 PHE A 50 -5.522 7.033 -0.726 1.00 0.38 H new ATOM 0 HZ PHE A 50 -3.581 6.923 0.781 1.00 0.37 H new ATOM 873 N LEU A 51 -8.349 4.008 1.945 1.00 0.30 N ATOM 874 CA LEU A 51 -9.262 5.115 2.161 1.00 0.32 C ATOM 875 C LEU A 51 -8.636 6.388 1.610 1.00 0.36 C ATOM 876 O LEU A 51 -7.576 6.809 2.065 1.00 0.38 O ATOM 877 CB LEU A 51 -9.580 5.254 3.657 1.00 0.33 C ATOM 878 CG LEU A 51 -10.834 6.069 4.009 1.00 0.35 C ATOM 879 CD1 LEU A 51 -10.603 7.561 3.822 1.00 0.46 C ATOM 880 CD2 LEU A 51 -12.017 5.607 3.172 1.00 0.41 C ATOM 0 H LEU A 51 -7.647 3.886 2.675 1.00 0.30 H new ATOM 0 HA LEU A 51 -10.201 4.930 1.639 1.00 0.32 H new ATOM 0 HB2 LEU A 51 -9.691 4.255 4.078 1.00 0.33 H new ATOM 0 HB3 LEU A 51 -8.723 5.714 4.149 1.00 0.33 H new ATOM 0 HG LEU A 51 -11.056 5.898 5.062 1.00 0.35 H new ATOM 0 HD11 LEU A 51 -11.511 8.105 4.080 1.00 0.46 H new ATOM 0 HD12 LEU A 51 -9.788 7.887 4.469 1.00 0.46 H new ATOM 0 HD13 LEU A 51 -10.343 7.762 2.783 1.00 0.46 H new ATOM 0 HD21 LEU A 51 -12.898 6.193 3.432 1.00 0.41 H new ATOM 0 HD22 LEU A 51 -11.790 5.743 2.115 1.00 0.41 H new ATOM 0 HD23 LEU A 51 -12.212 4.553 3.368 1.00 0.41 H new ATOM 892 N SER A 52 -9.287 6.982 0.624 1.00 0.42 N ATOM 893 CA SER A 52 -8.758 8.166 -0.032 1.00 0.53 C ATOM 894 C SER A 52 -9.396 9.434 0.523 1.00 0.61 C ATOM 895 O SER A 52 -10.619 9.586 0.506 1.00 0.93 O ATOM 896 CB SER A 52 -8.997 8.077 -1.540 1.00 0.67 C ATOM 897 OG SER A 52 -8.439 6.888 -2.078 1.00 1.28 O ATOM 0 H SER A 52 -10.185 6.663 0.260 1.00 0.42 H new ATOM 0 HA SER A 52 -7.687 8.213 0.163 1.00 0.53 H new ATOM 0 HB2 SER A 52 -10.067 8.104 -1.744 1.00 0.67 H new ATOM 0 HB3 SER A 52 -8.557 8.944 -2.033 1.00 0.67 H new ATOM 0 HG SER A 52 -8.317 6.992 -3.045 1.00 1.28 H new ATOM 903 N ASP A 53 -8.564 10.334 1.022 1.00 0.74 N ATOM 904 CA ASP A 53 -9.038 11.619 1.515 1.00 0.90 C ATOM 905 C ASP A 53 -8.532 12.736 0.614 1.00 1.04 C ATOM 906 O ASP A 53 -9.320 13.481 0.025 1.00 1.28 O ATOM 907 CB ASP A 53 -8.567 11.857 2.953 1.00 0.89 C ATOM 908 CG ASP A 53 -9.037 13.191 3.502 1.00 1.18 C ATOM 909 OD1 ASP A 53 -10.186 13.272 3.977 1.00 1.42 O ATOM 910 OD2 ASP A 53 -8.259 14.167 3.456 1.00 1.24 O ATOM 0 H ASP A 53 -7.556 10.199 1.097 1.00 0.74 H new ATOM 0 HA ASP A 53 -10.128 11.611 1.506 1.00 0.90 H new ATOM 0 HB2 ASP A 53 -8.936 11.054 3.591 1.00 0.89 H new ATOM 0 HB3 ASP A 53 -7.478 11.816 2.987 1.00 0.89 H new ATOM 915 N ASP A 54 -7.210 12.811 0.489 1.00 0.93 N ATOM 916 CA ASP A 54 -6.544 13.841 -0.304 1.00 1.10 C ATOM 917 C ASP A 54 -5.039 13.691 -0.175 1.00 1.02 C ATOM 918 O ASP A 54 -4.347 13.364 -1.139 1.00 1.22 O ATOM 919 CB ASP A 54 -6.949 15.251 0.145 1.00 1.26 C ATOM 920 CG ASP A 54 -6.292 16.335 -0.691 1.00 1.47 C ATOM 921 OD1 ASP A 54 -6.782 16.619 -1.806 1.00 1.73 O ATOM 922 OD2 ASP A 54 -5.286 16.916 -0.234 1.00 1.45 O ATOM 0 H ASP A 54 -6.568 12.157 0.936 1.00 0.93 H new ATOM 0 HA ASP A 54 -6.850 13.711 -1.342 1.00 1.10 H new ATOM 0 HB2 ASP A 54 -8.032 15.353 0.081 1.00 1.26 H new ATOM 0 HB3 ASP A 54 -6.677 15.388 1.192 1.00 1.26 H new ATOM 927 N ASP A 55 -4.542 13.928 1.028 1.00 0.87 N ATOM 928 CA ASP A 55 -3.115 13.833 1.308 1.00 0.94 C ATOM 929 C ASP A 55 -2.733 12.384 1.589 1.00 0.87 C ATOM 930 O ASP A 55 -3.501 11.650 2.209 1.00 0.71 O ATOM 931 CB ASP A 55 -2.752 14.721 2.504 1.00 0.99 C ATOM 932 CG ASP A 55 -1.284 14.638 2.876 1.00 1.39 C ATOM 933 OD1 ASP A 55 -0.478 15.401 2.307 1.00 1.58 O ATOM 934 OD2 ASP A 55 -0.930 13.804 3.738 1.00 1.79 O ATOM 0 H ASP A 55 -5.110 14.190 1.834 1.00 0.87 H new ATOM 0 HA ASP A 55 -2.560 14.179 0.436 1.00 0.94 H new ATOM 0 HB2 ASP A 55 -3.005 15.756 2.272 1.00 0.99 H new ATOM 0 HB3 ASP A 55 -3.356 14.430 3.363 1.00 0.99 H new ATOM 939 N PRO A 56 -1.556 11.949 1.106 1.00 1.06 N ATOM 940 CA PRO A 56 -1.047 10.587 1.301 1.00 1.08 C ATOM 941 C PRO A 56 -1.167 10.073 2.740 1.00 0.98 C ATOM 942 O PRO A 56 -1.419 8.887 2.949 1.00 0.97 O ATOM 943 CB PRO A 56 0.433 10.680 0.893 1.00 1.35 C ATOM 944 CG PRO A 56 0.695 12.123 0.601 1.00 1.48 C ATOM 945 CD PRO A 56 -0.633 12.740 0.285 1.00 1.33 C ATOM 0 HA PRO A 56 -1.630 9.877 0.714 1.00 1.08 H new ATOM 0 HB2 PRO A 56 1.081 10.321 1.693 1.00 1.35 H new ATOM 0 HB3 PRO A 56 0.635 10.063 0.018 1.00 1.35 H new ATOM 0 HG2 PRO A 56 1.157 12.614 1.457 1.00 1.48 H new ATOM 0 HG3 PRO A 56 1.382 12.231 -0.238 1.00 1.48 H new ATOM 0 HD2 PRO A 56 -0.661 13.798 0.547 1.00 1.33 H new ATOM 0 HD3 PRO A 56 -0.871 12.668 -0.776 1.00 1.33 H new ATOM 953 N LYS A 57 -0.986 10.947 3.730 1.00 0.99 N ATOM 954 CA LYS A 57 -1.045 10.517 5.125 1.00 1.02 C ATOM 955 C LYS A 57 -2.475 10.485 5.650 1.00 0.82 C ATOM 956 O LYS A 57 -2.781 9.742 6.585 1.00 0.87 O ATOM 957 CB LYS A 57 -0.206 11.426 6.014 1.00 1.25 C ATOM 958 CG LYS A 57 1.237 11.525 5.596 1.00 1.51 C ATOM 959 CD LYS A 57 2.056 12.144 6.700 1.00 1.62 C ATOM 960 CE LYS A 57 3.452 12.458 6.231 1.00 2.08 C ATOM 961 NZ LYS A 57 3.477 13.590 5.269 1.00 2.93 N ATOM 0 H LYS A 57 -0.800 11.941 3.595 1.00 0.99 H new ATOM 0 HA LYS A 57 -0.641 9.505 5.156 1.00 1.02 H new ATOM 0 HB2 LYS A 57 -0.644 12.424 6.012 1.00 1.25 H new ATOM 0 HB3 LYS A 57 -0.253 11.059 7.039 1.00 1.25 H new ATOM 0 HG2 LYS A 57 1.623 10.534 5.358 1.00 1.51 H new ATOM 0 HG3 LYS A 57 1.321 12.126 4.690 1.00 1.51 H new ATOM 0 HD2 LYS A 57 1.572 13.057 7.047 1.00 1.62 H new ATOM 0 HD3 LYS A 57 2.099 11.463 7.550 1.00 1.62 H new ATOM 0 HE2 LYS A 57 4.077 12.700 7.091 1.00 2.08 H new ATOM 0 HE3 LYS A 57 3.884 11.574 5.761 1.00 2.08 H new ATOM 0 HZ1 LYS A 57 4.452 13.938 5.167 1.00 2.93 H new ATOM 0 HZ2 LYS A 57 3.126 13.268 4.345 1.00 2.93 H new ATOM 0 HZ3 LYS A 57 2.871 14.358 5.621 1.00 2.93 H new ATOM 975 N LYS A 58 -3.343 11.307 5.075 1.00 0.69 N ATOM 976 CA LYS A 58 -4.745 11.319 5.467 1.00 0.65 C ATOM 977 C LYS A 58 -5.436 10.096 4.899 1.00 0.56 C ATOM 978 O LYS A 58 -6.428 9.609 5.442 1.00 0.63 O ATOM 979 CB LYS A 58 -5.412 12.600 4.984 1.00 0.73 C ATOM 980 CG LYS A 58 -4.741 13.843 5.531 1.00 0.94 C ATOM 981 CD LYS A 58 -5.335 15.103 4.946 1.00 1.24 C ATOM 982 CE LYS A 58 -4.610 16.340 5.449 1.00 1.55 C ATOM 983 NZ LYS A 58 -4.640 16.444 6.934 1.00 2.16 N ATOM 0 H LYS A 58 -3.102 11.971 4.339 1.00 0.69 H new ATOM 0 HA LYS A 58 -4.823 11.290 6.554 1.00 0.65 H new ATOM 0 HB2 LYS A 58 -5.391 12.629 3.895 1.00 0.73 H new ATOM 0 HB3 LYS A 58 -6.460 12.595 5.282 1.00 0.73 H new ATOM 0 HG2 LYS A 58 -4.842 13.863 6.616 1.00 0.94 H new ATOM 0 HG3 LYS A 58 -3.674 13.807 5.311 1.00 0.94 H new ATOM 0 HD2 LYS A 58 -5.279 15.063 3.858 1.00 1.24 H new ATOM 0 HD3 LYS A 58 -6.391 15.166 5.209 1.00 1.24 H new ATOM 0 HE2 LYS A 58 -3.575 16.316 5.109 1.00 1.55 H new ATOM 0 HE3 LYS A 58 -5.067 17.229 5.015 1.00 1.55 H new ATOM 0 HZ1 LYS A 58 -4.319 17.390 7.222 1.00 2.16 H new ATOM 0 HZ2 LYS A 58 -5.611 16.290 7.273 1.00 2.16 H new ATOM 0 HZ3 LYS A 58 -4.011 15.725 7.345 1.00 2.16 H new ATOM 997 N GLY A 59 -4.899 9.614 3.791 1.00 0.54 N ATOM 998 CA GLY A 59 -5.305 8.334 3.270 1.00 0.59 C ATOM 999 C GLY A 59 -4.721 7.219 4.105 1.00 0.54 C ATOM 1000 O GLY A 59 -3.597 7.334 4.594 1.00 0.58 O ATOM 0 H GLY A 59 -4.185 10.092 3.242 1.00 0.54 H new ATOM 0 HA2 GLY A 59 -6.393 8.264 3.267 1.00 0.59 H new ATOM 0 HA3 GLY A 59 -4.976 8.234 2.236 1.00 0.59 H new ATOM 1004 N ILE A 60 -5.465 6.143 4.278 1.00 0.49 N ATOM 1005 CA ILE A 60 -5.041 5.066 5.159 1.00 0.47 C ATOM 1006 C ILE A 60 -5.367 3.710 4.562 1.00 0.42 C ATOM 1007 O ILE A 60 -6.272 3.583 3.735 1.00 0.41 O ATOM 1008 CB ILE A 60 -5.710 5.158 6.550 1.00 0.51 C ATOM 1009 CG1 ILE A 60 -7.229 5.308 6.403 1.00 0.55 C ATOM 1010 CG2 ILE A 60 -5.123 6.309 7.358 1.00 0.60 C ATOM 1011 CD1 ILE A 60 -7.975 5.290 7.719 1.00 0.65 C ATOM 0 H ILE A 60 -6.364 5.989 3.822 1.00 0.49 H new ATOM 0 HA ILE A 60 -3.962 5.174 5.273 1.00 0.47 H new ATOM 0 HB ILE A 60 -5.509 4.234 7.092 1.00 0.51 H new ATOM 0 HG12 ILE A 60 -7.444 6.244 5.887 1.00 0.55 H new ATOM 0 HG13 ILE A 60 -7.605 4.503 5.772 1.00 0.55 H new ATOM 0 HG21 ILE A 60 -5.609 6.354 8.333 1.00 0.60 H new ATOM 0 HG22 ILE A 60 -4.053 6.150 7.493 1.00 0.60 H new ATOM 0 HG23 ILE A 60 -5.287 7.247 6.827 1.00 0.60 H new ATOM 0 HD11 ILE A 60 -9.043 5.401 7.533 1.00 0.65 H new ATOM 0 HD12 ILE A 60 -7.792 4.344 8.228 1.00 0.65 H new ATOM 0 HD13 ILE A 60 -7.628 6.112 8.345 1.00 0.65 H new ATOM 1023 N TRP A 61 -4.626 2.700 4.981 1.00 0.42 N ATOM 1024 CA TRP A 61 -4.916 1.337 4.586 1.00 0.40 C ATOM 1025 C TRP A 61 -5.896 0.715 5.560 1.00 0.40 C ATOM 1026 O TRP A 61 -5.653 0.684 6.770 1.00 0.48 O ATOM 1027 CB TRP A 61 -3.645 0.500 4.523 1.00 0.44 C ATOM 1028 CG TRP A 61 -2.864 0.696 3.263 1.00 0.43 C ATOM 1029 CD1 TRP A 61 -1.719 1.417 3.111 1.00 0.48 C ATOM 1030 CD2 TRP A 61 -3.169 0.146 1.978 1.00 0.41 C ATOM 1031 NE1 TRP A 61 -1.295 1.357 1.807 1.00 0.49 N ATOM 1032 CE2 TRP A 61 -2.168 0.580 1.091 1.00 0.45 C ATOM 1033 CE3 TRP A 61 -4.194 -0.671 1.490 1.00 0.41 C ATOM 1034 CZ2 TRP A 61 -2.160 0.225 -0.253 1.00 0.48 C ATOM 1035 CZ3 TRP A 61 -4.185 -1.025 0.156 1.00 0.45 C ATOM 1036 CH2 TRP A 61 -3.173 -0.578 -0.701 1.00 0.48 C ATOM 0 H TRP A 61 -3.818 2.800 5.596 1.00 0.42 H new ATOM 0 HA TRP A 61 -5.358 1.359 3.590 1.00 0.40 H new ATOM 0 HB2 TRP A 61 -3.013 0.749 5.375 1.00 0.44 H new ATOM 0 HB3 TRP A 61 -3.908 -0.554 4.618 1.00 0.44 H new ATOM 0 HD1 TRP A 61 -1.218 1.957 3.901 1.00 0.48 H new ATOM 0 HE1 TRP A 61 -0.465 1.816 1.432 1.00 0.49 H new ATOM 0 HE3 TRP A 61 -4.979 -1.019 2.146 1.00 0.41 H new ATOM 0 HZ2 TRP A 61 -1.383 0.570 -0.919 1.00 0.48 H new ATOM 0 HZ3 TRP A 61 -4.971 -1.656 -0.232 1.00 0.45 H new ATOM 0 HH2 TRP A 61 -3.192 -0.874 -1.740 1.00 0.48 H new ATOM 1047 N LEU A 62 -7.009 0.241 5.038 1.00 0.36 N ATOM 1048 CA LEU A 62 -8.012 -0.408 5.852 1.00 0.37 C ATOM 1049 C LEU A 62 -7.681 -1.886 5.981 1.00 0.42 C ATOM 1050 O LEU A 62 -7.776 -2.634 5.008 1.00 0.43 O ATOM 1051 CB LEU A 62 -9.398 -0.235 5.226 1.00 0.33 C ATOM 1052 CG LEU A 62 -9.779 1.201 4.866 1.00 0.31 C ATOM 1053 CD1 LEU A 62 -11.130 1.232 4.180 1.00 0.29 C ATOM 1054 CD2 LEU A 62 -9.803 2.079 6.102 1.00 0.35 C ATOM 0 H LEU A 62 -7.241 0.295 4.046 1.00 0.36 H new ATOM 0 HA LEU A 62 -8.019 0.050 6.841 1.00 0.37 H new ATOM 0 HB2 LEU A 62 -9.449 -0.844 4.323 1.00 0.33 H new ATOM 0 HB3 LEU A 62 -10.143 -0.628 5.918 1.00 0.33 H new ATOM 0 HG LEU A 62 -9.025 1.590 4.181 1.00 0.31 H new ATOM 0 HD11 LEU A 62 -11.388 2.261 3.930 1.00 0.29 H new ATOM 0 HD12 LEU A 62 -11.089 0.636 3.268 1.00 0.29 H new ATOM 0 HD13 LEU A 62 -11.887 0.821 4.848 1.00 0.29 H new ATOM 0 HD21 LEU A 62 -10.077 3.096 5.821 1.00 0.35 H new ATOM 0 HD22 LEU A 62 -10.534 1.690 6.811 1.00 0.35 H new ATOM 0 HD23 LEU A 62 -8.816 2.084 6.564 1.00 0.35 H new ATOM 1066 N GLU A 63 -7.266 -2.301 7.168 1.00 0.48 N ATOM 1067 CA GLU A 63 -6.916 -3.693 7.399 1.00 0.55 C ATOM 1068 C GLU A 63 -8.173 -4.529 7.606 1.00 0.52 C ATOM 1069 O GLU A 63 -9.209 -4.014 8.028 1.00 0.48 O ATOM 1070 CB GLU A 63 -5.988 -3.818 8.609 1.00 0.65 C ATOM 1071 CG GLU A 63 -6.626 -3.384 9.919 1.00 0.68 C ATOM 1072 CD GLU A 63 -5.683 -3.525 11.092 1.00 1.07 C ATOM 1073 OE1 GLU A 63 -5.442 -4.668 11.531 1.00 1.42 O ATOM 1074 OE2 GLU A 63 -5.189 -2.490 11.594 1.00 1.30 O ATOM 0 H GLU A 63 -7.164 -1.696 7.983 1.00 0.48 H new ATOM 0 HA GLU A 63 -6.391 -4.067 6.520 1.00 0.55 H new ATOM 0 HB2 GLU A 63 -5.662 -4.854 8.700 1.00 0.65 H new ATOM 0 HB3 GLU A 63 -5.095 -3.218 8.434 1.00 0.65 H new ATOM 0 HG2 GLU A 63 -6.948 -2.346 9.837 1.00 0.68 H new ATOM 0 HG3 GLU A 63 -7.520 -3.981 10.101 1.00 0.68 H new ATOM 1081 N ALA A 64 -8.075 -5.816 7.313 1.00 0.58 N ATOM 1082 CA ALA A 64 -9.209 -6.723 7.435 1.00 0.58 C ATOM 1083 C ALA A 64 -9.695 -6.820 8.878 1.00 0.60 C ATOM 1084 O ALA A 64 -10.870 -7.087 9.130 1.00 0.65 O ATOM 1085 CB ALA A 64 -8.833 -8.099 6.914 1.00 0.64 C ATOM 0 H ALA A 64 -7.216 -6.260 6.987 1.00 0.58 H new ATOM 0 HA ALA A 64 -10.026 -6.322 6.835 1.00 0.58 H new ATOM 0 HB1 ALA A 64 -9.687 -8.770 7.009 1.00 0.64 H new ATOM 0 HB2 ALA A 64 -8.545 -8.025 5.865 1.00 0.64 H new ATOM 0 HB3 ALA A 64 -7.997 -8.491 7.493 1.00 0.64 H new ATOM 1091 N GLY A 65 -8.790 -6.572 9.814 1.00 0.64 N ATOM 1092 CA GLY A 65 -9.098 -6.735 11.221 1.00 0.70 C ATOM 1093 C GLY A 65 -9.807 -5.546 11.850 1.00 0.70 C ATOM 1094 O GLY A 65 -9.727 -5.355 13.062 1.00 0.84 O ATOM 0 H GLY A 65 -7.839 -6.258 9.622 1.00 0.64 H new ATOM 0 HA2 GLY A 65 -9.721 -7.621 11.344 1.00 0.70 H new ATOM 0 HA3 GLY A 65 -8.171 -6.919 11.764 1.00 0.70 H new ATOM 1098 N LYS A 66 -10.509 -4.750 11.051 1.00 0.60 N ATOM 1099 CA LYS A 66 -11.327 -3.678 11.601 1.00 0.61 C ATOM 1100 C LYS A 66 -12.470 -3.343 10.651 1.00 0.54 C ATOM 1101 O LYS A 66 -12.396 -3.606 9.444 1.00 0.47 O ATOM 1102 CB LYS A 66 -10.495 -2.421 11.924 1.00 0.66 C ATOM 1103 CG LYS A 66 -10.625 -1.284 10.920 1.00 0.60 C ATOM 1104 CD LYS A 66 -9.893 -1.561 9.623 1.00 0.56 C ATOM 1105 CE LYS A 66 -10.266 -0.544 8.560 1.00 0.61 C ATOM 1106 NZ LYS A 66 -11.698 -0.635 8.189 1.00 1.29 N ATOM 0 H LYS A 66 -10.528 -4.825 10.034 1.00 0.60 H new ATOM 0 HA LYS A 66 -11.745 -4.034 12.543 1.00 0.61 H new ATOM 0 HB2 LYS A 66 -10.789 -2.052 12.907 1.00 0.66 H new ATOM 0 HB3 LYS A 66 -9.445 -2.707 11.992 1.00 0.66 H new ATOM 0 HG2 LYS A 66 -11.680 -1.112 10.707 1.00 0.60 H new ATOM 0 HG3 LYS A 66 -10.236 -0.367 11.363 1.00 0.60 H new ATOM 0 HD2 LYS A 66 -8.817 -1.534 9.796 1.00 0.56 H new ATOM 0 HD3 LYS A 66 -10.134 -2.564 9.272 1.00 0.56 H new ATOM 0 HE2 LYS A 66 -10.048 0.460 8.925 1.00 0.61 H new ATOM 0 HE3 LYS A 66 -9.650 -0.702 7.674 1.00 0.61 H new ATOM 0 HZ1 LYS A 66 -11.810 -0.413 7.179 1.00 1.29 H new ATOM 0 HZ2 LYS A 66 -12.043 -1.599 8.372 1.00 1.29 H new ATOM 0 HZ3 LYS A 66 -12.247 0.043 8.755 1.00 1.29 H new ATOM 1120 N ALA A 67 -13.513 -2.747 11.191 1.00 0.57 N ATOM 1121 CA ALA A 67 -14.686 -2.423 10.410 1.00 0.52 C ATOM 1122 C ALA A 67 -14.493 -1.090 9.708 1.00 0.47 C ATOM 1123 O ALA A 67 -13.619 -0.304 10.075 1.00 0.47 O ATOM 1124 CB ALA A 67 -15.915 -2.402 11.300 1.00 0.59 C ATOM 0 H ALA A 67 -13.571 -2.477 12.173 1.00 0.57 H new ATOM 0 HA ALA A 67 -14.833 -3.188 9.648 1.00 0.52 H new ATOM 0 HB1 ALA A 67 -16.793 -2.157 10.702 1.00 0.59 H new ATOM 0 HB2 ALA A 67 -16.050 -3.382 11.758 1.00 0.59 H new ATOM 0 HB3 ALA A 67 -15.786 -1.652 12.080 1.00 0.59 H new ATOM 1130 N LEU A 68 -15.281 -0.848 8.677 1.00 0.45 N ATOM 1131 CA LEU A 68 -15.159 0.377 7.903 1.00 0.40 C ATOM 1132 C LEU A 68 -15.617 1.569 8.731 1.00 0.43 C ATOM 1133 O LEU A 68 -14.873 2.527 8.935 1.00 0.44 O ATOM 1134 CB LEU A 68 -15.996 0.278 6.632 1.00 0.37 C ATOM 1135 CG LEU A 68 -15.678 -0.913 5.727 1.00 0.36 C ATOM 1136 CD1 LEU A 68 -16.634 -0.955 4.545 1.00 0.36 C ATOM 1137 CD2 LEU A 68 -14.240 -0.842 5.247 1.00 0.37 C ATOM 0 H LEU A 68 -16.012 -1.482 8.355 1.00 0.45 H new ATOM 0 HA LEU A 68 -14.113 0.516 7.631 1.00 0.40 H new ATOM 0 HB2 LEU A 68 -17.048 0.228 6.913 1.00 0.37 H new ATOM 0 HB3 LEU A 68 -15.863 1.195 6.057 1.00 0.37 H new ATOM 0 HG LEU A 68 -15.805 -1.829 6.303 1.00 0.36 H new ATOM 0 HD11 LEU A 68 -16.393 -1.809 3.912 1.00 0.36 H new ATOM 0 HD12 LEU A 68 -17.657 -1.050 4.908 1.00 0.36 H new ATOM 0 HD13 LEU A 68 -16.538 -0.036 3.967 1.00 0.36 H new ATOM 0 HD21 LEU A 68 -14.028 -1.696 4.604 1.00 0.37 H new ATOM 0 HD22 LEU A 68 -14.089 0.080 4.686 1.00 0.37 H new ATOM 0 HD23 LEU A 68 -13.569 -0.859 6.105 1.00 0.37 H new ATOM 1149 N ASP A 69 -16.830 1.455 9.242 1.00 0.47 N ATOM 1150 CA ASP A 69 -17.480 2.516 10.015 1.00 0.52 C ATOM 1151 C ASP A 69 -16.819 2.687 11.383 1.00 0.58 C ATOM 1152 O ASP A 69 -17.106 3.636 12.109 1.00 0.65 O ATOM 1153 CB ASP A 69 -18.973 2.185 10.167 1.00 0.58 C ATOM 1154 CG ASP A 69 -19.752 3.191 11.000 1.00 0.86 C ATOM 1155 OD1 ASP A 69 -20.047 4.294 10.496 1.00 1.14 O ATOM 1156 OD2 ASP A 69 -20.096 2.870 12.158 1.00 1.16 O ATOM 0 H ASP A 69 -17.403 0.618 9.135 1.00 0.47 H new ATOM 0 HA ASP A 69 -17.371 3.461 9.483 1.00 0.52 H new ATOM 0 HB2 ASP A 69 -19.423 2.124 9.176 1.00 0.58 H new ATOM 0 HB3 ASP A 69 -19.071 1.200 10.622 1.00 0.58 H new ATOM 1161 N TYR A 70 -15.926 1.766 11.732 1.00 0.59 N ATOM 1162 CA TYR A 70 -15.130 1.905 12.938 1.00 0.65 C ATOM 1163 C TYR A 70 -14.238 3.142 12.818 1.00 0.62 C ATOM 1164 O TYR A 70 -13.983 3.841 13.800 1.00 0.67 O ATOM 1165 CB TYR A 70 -14.307 0.628 13.171 1.00 0.69 C ATOM 1166 CG TYR A 70 -13.060 0.833 13.997 1.00 0.81 C ATOM 1167 CD1 TYR A 70 -13.155 1.049 15.362 1.00 1.02 C ATOM 1168 CD2 TYR A 70 -11.798 0.814 13.419 1.00 0.84 C ATOM 1169 CE1 TYR A 70 -12.030 1.238 16.134 1.00 1.21 C ATOM 1170 CE2 TYR A 70 -10.663 1.001 14.186 1.00 1.05 C ATOM 1171 CZ TYR A 70 -10.746 1.208 15.486 1.00 1.22 C ATOM 1172 OH TYR A 70 -9.659 1.401 16.313 1.00 1.45 O ATOM 0 H TYR A 70 -15.739 0.919 11.196 1.00 0.59 H new ATOM 0 HA TYR A 70 -15.780 2.040 13.802 1.00 0.65 H new ATOM 0 HB2 TYR A 70 -14.938 -0.111 13.664 1.00 0.69 H new ATOM 0 HB3 TYR A 70 -14.024 0.211 12.204 1.00 0.69 H new ATOM 0 HD1 TYR A 70 -14.128 1.070 15.829 1.00 1.02 H new ATOM 0 HD2 TYR A 70 -11.701 0.651 12.356 1.00 0.84 H new ATOM 0 HE1 TYR A 70 -12.110 1.404 17.198 1.00 1.21 H new ATOM 0 HE2 TYR A 70 -9.692 0.977 13.713 1.00 1.05 H new ATOM 0 HH TYR A 70 -8.835 1.363 15.784 1.00 1.45 H new ATOM 1182 N TYR A 71 -13.756 3.394 11.606 1.00 0.57 N ATOM 1183 CA TYR A 71 -13.038 4.624 11.303 1.00 0.58 C ATOM 1184 C TYR A 71 -14.010 5.774 11.037 1.00 0.60 C ATOM 1185 O TYR A 71 -15.132 5.789 11.539 1.00 0.69 O ATOM 1186 CB TYR A 71 -12.102 4.424 10.111 1.00 0.56 C ATOM 1187 CG TYR A 71 -10.771 3.821 10.496 1.00 0.56 C ATOM 1188 CD1 TYR A 71 -9.713 4.618 10.905 1.00 0.58 C ATOM 1189 CD2 TYR A 71 -10.573 2.447 10.441 1.00 0.62 C ATOM 1190 CE1 TYR A 71 -8.494 4.062 11.248 1.00 0.63 C ATOM 1191 CE2 TYR A 71 -9.359 1.885 10.784 1.00 0.66 C ATOM 1192 CZ TYR A 71 -8.320 2.727 11.224 1.00 0.65 C ATOM 1193 OH TYR A 71 -7.110 2.139 11.524 1.00 0.72 O ATOM 0 H TYR A 71 -13.851 2.758 10.814 1.00 0.57 H new ATOM 0 HA TYR A 71 -12.435 4.885 12.173 1.00 0.58 H new ATOM 0 HB2 TYR A 71 -12.588 3.779 9.379 1.00 0.56 H new ATOM 0 HB3 TYR A 71 -11.932 5.385 9.625 1.00 0.56 H new ATOM 0 HD1 TYR A 71 -9.843 5.689 10.957 1.00 0.58 H new ATOM 0 HD2 TYR A 71 -11.383 1.807 10.124 1.00 0.62 H new ATOM 0 HE1 TYR A 71 -7.675 4.704 11.537 1.00 0.63 H new ATOM 0 HE2 TYR A 71 -9.209 0.818 10.716 1.00 0.66 H new ATOM 0 HH TYR A 71 -7.192 1.165 11.450 1.00 0.72 H new ATOM 1203 N MET A 72 -13.573 6.730 10.231 1.00 0.60 N ATOM 1204 CA MET A 72 -14.362 7.924 9.948 1.00 0.69 C ATOM 1205 C MET A 72 -15.178 7.770 8.667 1.00 0.63 C ATOM 1206 O MET A 72 -15.617 8.764 8.091 1.00 0.75 O ATOM 1207 CB MET A 72 -13.440 9.135 9.807 1.00 0.83 C ATOM 1208 CG MET A 72 -12.635 9.452 11.056 1.00 1.02 C ATOM 1209 SD MET A 72 -11.389 10.726 10.772 1.00 1.73 S ATOM 1210 CE MET A 72 -10.376 9.931 9.526 1.00 2.38 C ATOM 0 H MET A 72 -12.670 6.703 9.757 1.00 0.60 H new ATOM 0 HA MET A 72 -15.050 8.068 10.781 1.00 0.69 H new ATOM 0 HB2 MET A 72 -12.752 8.960 8.980 1.00 0.83 H new ATOM 0 HB3 MET A 72 -14.040 10.006 9.544 1.00 0.83 H new ATOM 0 HG2 MET A 72 -13.311 9.779 11.846 1.00 1.02 H new ATOM 0 HG3 MET A 72 -12.147 8.544 11.410 1.00 1.02 H new ATOM 0 HE1 MET A 72 -9.368 10.344 9.559 1.00 2.38 H new ATOM 0 HE2 MET A 72 -10.335 8.859 9.720 1.00 2.38 H new ATOM 0 HE3 MET A 72 -10.808 10.105 8.540 1.00 2.38 H new ATOM 1220 N LEU A 73 -15.395 6.539 8.220 1.00 0.56 N ATOM 1221 CA LEU A 73 -16.075 6.328 6.947 1.00 0.54 C ATOM 1222 C LEU A 73 -17.562 6.258 7.147 1.00 0.50 C ATOM 1223 O LEU A 73 -18.050 5.734 8.147 1.00 0.60 O ATOM 1224 CB LEU A 73 -15.630 5.057 6.218 1.00 0.71 C ATOM 1225 CG LEU A 73 -14.279 4.462 6.610 1.00 0.43 C ATOM 1226 CD1 LEU A 73 -13.966 3.278 5.714 1.00 0.88 C ATOM 1227 CD2 LEU A 73 -13.178 5.499 6.523 1.00 0.88 C ATOM 0 H LEU A 73 -15.117 5.687 8.708 1.00 0.56 H new ATOM 0 HA LEU A 73 -15.803 7.183 6.328 1.00 0.54 H new ATOM 0 HB2 LEU A 73 -16.393 4.294 6.374 1.00 0.71 H new ATOM 0 HB3 LEU A 73 -15.607 5.271 5.150 1.00 0.71 H new ATOM 0 HG LEU A 73 -14.335 4.126 7.645 1.00 0.43 H new ATOM 0 HD11 LEU A 73 -13.002 2.854 5.995 1.00 0.88 H new ATOM 0 HD12 LEU A 73 -14.742 2.521 5.827 1.00 0.88 H new ATOM 0 HD13 LEU A 73 -13.929 3.607 4.676 1.00 0.88 H new ATOM 0 HD21 LEU A 73 -12.228 5.046 6.808 1.00 0.88 H new ATOM 0 HD22 LEU A 73 -13.110 5.873 5.501 1.00 0.88 H new ATOM 0 HD23 LEU A 73 -13.403 6.325 7.197 1.00 0.88 H new ATOM 1239 N ARG A 74 -18.263 6.788 6.175 1.00 0.48 N ATOM 1240 CA ARG A 74 -19.701 6.795 6.158 1.00 0.52 C ATOM 1241 C ARG A 74 -20.184 7.263 4.797 1.00 0.46 C ATOM 1242 O ARG A 74 -19.395 7.362 3.855 1.00 0.45 O ATOM 1243 CB ARG A 74 -20.271 7.651 7.307 1.00 0.65 C ATOM 1244 CG ARG A 74 -19.554 8.975 7.569 1.00 1.17 C ATOM 1245 CD ARG A 74 -19.984 10.073 6.610 1.00 1.64 C ATOM 1246 NE ARG A 74 -18.968 10.360 5.602 1.00 2.05 N ATOM 1247 CZ ARG A 74 -18.970 11.447 4.836 1.00 2.72 C ATOM 1248 NH1 ARG A 74 -19.914 12.369 4.990 1.00 2.96 N ATOM 1249 NH2 ARG A 74 -18.016 11.626 3.934 1.00 3.29 N ATOM 0 H ARG A 74 -17.841 7.234 5.360 1.00 0.48 H new ATOM 0 HA ARG A 74 -20.069 5.782 6.323 1.00 0.52 H new ATOM 0 HB2 ARG A 74 -21.318 7.863 7.092 1.00 0.65 H new ATOM 0 HB3 ARG A 74 -20.247 7.059 8.222 1.00 0.65 H new ATOM 0 HG2 ARG A 74 -19.751 9.294 8.592 1.00 1.17 H new ATOM 0 HG3 ARG A 74 -18.478 8.824 7.484 1.00 1.17 H new ATOM 0 HD2 ARG A 74 -20.910 9.778 6.116 1.00 1.64 H new ATOM 0 HD3 ARG A 74 -20.199 10.981 7.174 1.00 1.64 H new ATOM 0 HE ARG A 74 -18.212 9.687 5.478 1.00 2.05 H new ATOM 0 HH11 ARG A 74 -20.639 12.244 5.697 1.00 2.96 H new ATOM 0 HH12 ARG A 74 -19.914 13.202 4.402 1.00 2.96 H new ATOM 0 HH21 ARG A 74 -17.279 10.929 3.826 1.00 3.29 H new ATOM 0 HH22 ARG A 74 -18.019 12.460 3.347 1.00 3.29 H new ATOM 1263 N ASN A 75 -21.469 7.528 4.700 1.00 0.49 N ATOM 1264 CA ASN A 75 -22.091 7.919 3.437 1.00 0.47 C ATOM 1265 C ASN A 75 -21.453 9.175 2.859 1.00 0.48 C ATOM 1266 O ASN A 75 -21.700 10.286 3.331 1.00 0.56 O ATOM 1267 CB ASN A 75 -23.598 8.124 3.626 1.00 0.52 C ATOM 1268 CG ASN A 75 -24.362 6.817 3.563 1.00 0.52 C ATOM 1269 OD1 ASN A 75 -24.877 6.433 2.516 1.00 0.72 O ATOM 1270 ND2 ASN A 75 -24.426 6.110 4.672 1.00 0.51 N ATOM 0 H ASN A 75 -22.117 7.481 5.487 1.00 0.49 H new ATOM 0 HA ASN A 75 -21.929 7.110 2.725 1.00 0.47 H new ATOM 0 HB2 ASN A 75 -23.781 8.604 4.587 1.00 0.52 H new ATOM 0 HB3 ASN A 75 -23.971 8.799 2.856 1.00 0.52 H new ATOM 0 HD21 ASN A 75 -24.914 5.214 4.678 1.00 0.51 H new ATOM 0 HD22 ASN A 75 -23.987 6.458 5.525 1.00 0.51 H new ATOM 1277 N GLY A 76 -20.620 8.987 1.842 1.00 0.45 N ATOM 1278 CA GLY A 76 -19.976 10.107 1.194 1.00 0.51 C ATOM 1279 C GLY A 76 -18.475 9.932 1.044 1.00 0.47 C ATOM 1280 O GLY A 76 -17.836 10.675 0.300 1.00 0.55 O ATOM 0 H GLY A 76 -20.380 8.074 1.456 1.00 0.45 H new ATOM 0 HA2 GLY A 76 -20.418 10.251 0.208 1.00 0.51 H new ATOM 0 HA3 GLY A 76 -20.174 11.013 1.768 1.00 0.51 H new ATOM 1284 N ASP A 77 -17.899 8.956 1.743 1.00 0.42 N ATOM 1285 CA ASP A 77 -16.455 8.753 1.692 1.00 0.42 C ATOM 1286 C ASP A 77 -16.039 7.950 0.471 1.00 0.38 C ATOM 1287 O ASP A 77 -16.763 7.070 0.003 1.00 0.40 O ATOM 1288 CB ASP A 77 -15.948 8.065 2.961 1.00 0.44 C ATOM 1289 CG ASP A 77 -15.958 8.990 4.156 1.00 0.74 C ATOM 1290 OD1 ASP A 77 -15.055 9.851 4.257 1.00 1.05 O ATOM 1291 OD2 ASP A 77 -16.876 8.880 4.989 1.00 1.00 O ATOM 0 H ASP A 77 -18.402 8.302 2.343 1.00 0.42 H new ATOM 0 HA ASP A 77 -16.002 9.742 1.620 1.00 0.42 H new ATOM 0 HB2 ASP A 77 -16.569 7.194 3.173 1.00 0.44 H new ATOM 0 HB3 ASP A 77 -14.934 7.701 2.794 1.00 0.44 H new ATOM 1296 N THR A 78 -14.870 8.279 -0.051 1.00 0.36 N ATOM 1297 CA THR A 78 -14.299 7.561 -1.173 1.00 0.35 C ATOM 1298 C THR A 78 -13.359 6.478 -0.666 1.00 0.31 C ATOM 1299 O THR A 78 -12.491 6.739 0.169 1.00 0.34 O ATOM 1300 CB THR A 78 -13.527 8.518 -2.105 1.00 0.42 C ATOM 1301 OG1 THR A 78 -14.388 9.584 -2.533 1.00 0.50 O ATOM 1302 CG2 THR A 78 -12.982 7.781 -3.322 1.00 0.42 C ATOM 0 H THR A 78 -14.294 9.048 0.290 1.00 0.36 H new ATOM 0 HA THR A 78 -15.113 7.107 -1.739 1.00 0.35 H new ATOM 0 HB THR A 78 -12.685 8.928 -1.546 1.00 0.42 H new ATOM 0 HG1 THR A 78 -13.891 10.189 -3.123 1.00 0.50 H new ATOM 0 HG21 THR A 78 -12.443 8.481 -3.960 1.00 0.42 H new ATOM 0 HG22 THR A 78 -12.305 6.992 -2.996 1.00 0.42 H new ATOM 0 HG23 THR A 78 -13.808 7.342 -3.882 1.00 0.42 H new ATOM 1310 N MET A 79 -13.520 5.268 -1.171 1.00 0.27 N ATOM 1311 CA MET A 79 -12.688 4.163 -0.750 1.00 0.27 C ATOM 1312 C MET A 79 -12.098 3.489 -1.975 1.00 0.28 C ATOM 1313 O MET A 79 -12.810 2.894 -2.783 1.00 0.27 O ATOM 1314 CB MET A 79 -13.487 3.155 0.076 1.00 0.23 C ATOM 1315 CG MET A 79 -12.607 2.212 0.883 1.00 0.27 C ATOM 1316 SD MET A 79 -13.554 1.035 1.867 1.00 0.65 S ATOM 1317 CE MET A 79 -14.206 -0.026 0.584 1.00 0.24 C ATOM 0 H MET A 79 -14.220 5.029 -1.873 1.00 0.27 H new ATOM 0 HA MET A 79 -11.886 4.547 -0.119 1.00 0.27 H new ATOM 0 HB2 MET A 79 -14.149 3.694 0.754 1.00 0.23 H new ATOM 0 HB3 MET A 79 -14.121 2.570 -0.590 1.00 0.23 H new ATOM 0 HG2 MET A 79 -11.951 1.666 0.205 1.00 0.27 H new ATOM 0 HG3 MET A 79 -11.967 2.797 1.543 1.00 0.27 H new ATOM 0 HE1 MET A 79 -14.189 -1.061 0.924 1.00 0.24 H new ATOM 0 HE2 MET A 79 -15.232 0.265 0.358 1.00 0.24 H new ATOM 0 HE3 MET A 79 -13.595 0.071 -0.314 1.00 0.24 H new ATOM 1327 N GLU A 80 -10.800 3.610 -2.113 1.00 0.32 N ATOM 1328 CA GLU A 80 -10.106 3.059 -3.253 1.00 0.35 C ATOM 1329 C GLU A 80 -9.886 1.571 -3.039 1.00 0.33 C ATOM 1330 O GLU A 80 -9.325 1.162 -2.022 1.00 0.33 O ATOM 1331 CB GLU A 80 -8.760 3.766 -3.426 1.00 0.40 C ATOM 1332 CG GLU A 80 -8.128 3.560 -4.792 1.00 0.53 C ATOM 1333 CD GLU A 80 -6.817 4.298 -4.945 1.00 0.69 C ATOM 1334 OE1 GLU A 80 -6.838 5.544 -5.030 1.00 1.04 O ATOM 1335 OE2 GLU A 80 -5.758 3.640 -4.982 1.00 1.04 O ATOM 0 H GLU A 80 -10.198 4.090 -1.444 1.00 0.32 H new ATOM 0 HA GLU A 80 -10.704 3.208 -4.152 1.00 0.35 H new ATOM 0 HB2 GLU A 80 -8.897 4.834 -3.257 1.00 0.40 H new ATOM 0 HB3 GLU A 80 -8.072 3.408 -2.660 1.00 0.40 H new ATOM 0 HG2 GLU A 80 -7.962 2.495 -4.954 1.00 0.53 H new ATOM 0 HG3 GLU A 80 -8.821 3.896 -5.563 1.00 0.53 H new ATOM 1342 N TYR A 81 -10.316 0.753 -3.982 1.00 0.33 N ATOM 1343 CA TYR A 81 -10.000 -0.655 -3.932 1.00 0.33 C ATOM 1344 C TYR A 81 -8.790 -0.868 -4.805 1.00 0.36 C ATOM 1345 O TYR A 81 -8.880 -0.840 -6.030 1.00 0.39 O ATOM 1346 CB TYR A 81 -11.174 -1.510 -4.421 1.00 0.33 C ATOM 1347 CG TYR A 81 -10.947 -3.004 -4.283 1.00 0.33 C ATOM 1348 CD1 TYR A 81 -10.338 -3.727 -5.299 1.00 0.37 C ATOM 1349 CD2 TYR A 81 -11.337 -3.687 -3.138 1.00 0.34 C ATOM 1350 CE1 TYR A 81 -10.122 -5.086 -5.180 1.00 0.39 C ATOM 1351 CE2 TYR A 81 -11.126 -5.046 -3.014 1.00 0.36 C ATOM 1352 CZ TYR A 81 -10.543 -5.744 -4.023 1.00 0.38 C ATOM 1353 OH TYR A 81 -10.303 -7.096 -3.913 1.00 0.42 O ATOM 0 H TYR A 81 -10.879 1.039 -4.783 1.00 0.33 H new ATOM 0 HA TYR A 81 -9.799 -0.959 -2.905 1.00 0.33 H new ATOM 0 HB2 TYR A 81 -12.068 -1.235 -3.862 1.00 0.33 H new ATOM 0 HB3 TYR A 81 -11.369 -1.277 -5.468 1.00 0.33 H new ATOM 0 HD1 TYR A 81 -10.027 -3.218 -6.199 1.00 0.37 H new ATOM 0 HD2 TYR A 81 -11.812 -3.147 -2.333 1.00 0.34 H new ATOM 0 HE1 TYR A 81 -9.633 -5.633 -5.973 1.00 0.39 H new ATOM 0 HE2 TYR A 81 -11.426 -5.556 -2.111 1.00 0.36 H new ATOM 0 HH TYR A 81 -10.649 -7.421 -3.056 1.00 0.42 H new ATOM 1363 N ARG A 82 -7.657 -1.046 -4.177 1.00 0.37 N ATOM 1364 CA ARG A 82 -6.414 -1.066 -4.914 1.00 0.39 C ATOM 1365 C ARG A 82 -5.555 -2.232 -4.496 1.00 0.40 C ATOM 1366 O ARG A 82 -5.804 -2.874 -3.472 1.00 0.42 O ATOM 1367 CB ARG A 82 -5.639 0.241 -4.734 1.00 0.42 C ATOM 1368 CG ARG A 82 -5.278 0.560 -3.295 1.00 0.44 C ATOM 1369 CD ARG A 82 -4.118 1.541 -3.230 1.00 0.56 C ATOM 1370 NE ARG A 82 -2.884 0.945 -3.750 1.00 0.65 N ATOM 1371 CZ ARG A 82 -1.844 1.643 -4.202 1.00 0.88 C ATOM 1372 NH1 ARG A 82 -1.868 2.972 -4.194 1.00 1.08 N ATOM 1373 NH2 ARG A 82 -0.775 1.009 -4.668 1.00 1.03 N ATOM 0 H ARG A 82 -7.565 -1.178 -3.170 1.00 0.37 H new ATOM 0 HA ARG A 82 -6.666 -1.176 -5.969 1.00 0.39 H new ATOM 0 HB2 ARG A 82 -4.723 0.191 -5.323 1.00 0.42 H new ATOM 0 HB3 ARG A 82 -6.233 1.061 -5.137 1.00 0.42 H new ATOM 0 HG2 ARG A 82 -6.144 0.980 -2.784 1.00 0.44 H new ATOM 0 HG3 ARG A 82 -5.013 -0.358 -2.771 1.00 0.44 H new ATOM 0 HD2 ARG A 82 -4.362 2.435 -3.804 1.00 0.56 H new ATOM 0 HD3 ARG A 82 -3.964 1.857 -2.198 1.00 0.56 H new ATOM 0 HE ARG A 82 -2.817 -0.073 -3.767 1.00 0.65 H new ATOM 0 HH11 ARG A 82 -2.688 3.465 -3.840 1.00 1.08 H new ATOM 0 HH12 ARG A 82 -1.067 3.499 -4.542 1.00 1.08 H new ATOM 0 HH21 ARG A 82 -0.751 -0.011 -4.679 1.00 1.03 H new ATOM 0 HH22 ARG A 82 0.023 1.541 -5.015 1.00 1.03 H new ATOM 1387 N LYS A 83 -4.547 -2.503 -5.296 1.00 0.43 N ATOM 1388 CA LYS A 83 -3.599 -3.545 -4.991 1.00 0.45 C ATOM 1389 C LYS A 83 -2.877 -3.195 -3.694 1.00 0.42 C ATOM 1390 O LYS A 83 -2.395 -2.070 -3.531 1.00 0.42 O ATOM 1391 CB LYS A 83 -2.616 -3.700 -6.159 1.00 0.53 C ATOM 1392 CG LYS A 83 -1.745 -4.945 -6.090 1.00 0.60 C ATOM 1393 CD LYS A 83 -0.982 -5.154 -7.389 1.00 0.70 C ATOM 1394 CE LYS A 83 -0.140 -6.422 -7.356 1.00 1.25 C ATOM 1395 NZ LYS A 83 -0.975 -7.651 -7.327 1.00 1.74 N ATOM 0 H LYS A 83 -4.364 -2.009 -6.170 1.00 0.43 H new ATOM 0 HA LYS A 83 -4.110 -4.498 -4.854 1.00 0.45 H new ATOM 0 HB2 LYS A 83 -3.180 -3.718 -7.092 1.00 0.53 H new ATOM 0 HB3 LYS A 83 -1.971 -2.822 -6.193 1.00 0.53 H new ATOM 0 HG2 LYS A 83 -1.042 -4.855 -5.262 1.00 0.60 H new ATOM 0 HG3 LYS A 83 -2.367 -5.817 -5.886 1.00 0.60 H new ATOM 0 HD2 LYS A 83 -1.686 -5.208 -8.219 1.00 0.70 H new ATOM 0 HD3 LYS A 83 -0.337 -4.295 -7.573 1.00 0.70 H new ATOM 0 HE2 LYS A 83 0.510 -6.447 -8.231 1.00 1.25 H new ATOM 0 HE3 LYS A 83 0.507 -6.404 -6.479 1.00 1.25 H new ATOM 0 HZ1 LYS A 83 -0.754 -8.201 -6.472 1.00 1.74 H new ATOM 0 HZ2 LYS A 83 -1.981 -7.387 -7.318 1.00 1.74 H new ATOM 0 HZ3 LYS A 83 -0.775 -8.226 -8.170 1.00 1.74 H new ATOM 1409 N LYS A 84 -2.854 -4.147 -2.763 1.00 0.44 N ATOM 1410 CA LYS A 84 -2.173 -3.975 -1.482 1.00 0.46 C ATOM 1411 C LYS A 84 -0.738 -3.549 -1.713 1.00 0.46 C ATOM 1412 O LYS A 84 -0.166 -2.793 -0.933 1.00 0.52 O ATOM 1413 CB LYS A 84 -2.191 -5.281 -0.685 1.00 0.54 C ATOM 1414 CG LYS A 84 -3.363 -5.430 0.273 1.00 0.55 C ATOM 1415 CD LYS A 84 -3.156 -4.629 1.551 1.00 0.66 C ATOM 1416 CE LYS A 84 -4.224 -4.954 2.586 1.00 0.67 C ATOM 1417 NZ LYS A 84 -3.898 -4.399 3.929 1.00 1.32 N ATOM 0 H LYS A 84 -3.305 -5.055 -2.875 1.00 0.44 H new ATOM 0 HA LYS A 84 -2.697 -3.205 -0.915 1.00 0.46 H new ATOM 0 HB2 LYS A 84 -2.204 -6.117 -1.385 1.00 0.54 H new ATOM 0 HB3 LYS A 84 -1.264 -5.356 -0.117 1.00 0.54 H new ATOM 0 HG2 LYS A 84 -4.278 -5.100 -0.218 1.00 0.55 H new ATOM 0 HG3 LYS A 84 -3.497 -6.483 0.522 1.00 0.55 H new ATOM 0 HD2 LYS A 84 -2.170 -4.845 1.962 1.00 0.66 H new ATOM 0 HD3 LYS A 84 -3.180 -3.563 1.323 1.00 0.66 H new ATOM 0 HE2 LYS A 84 -5.182 -4.555 2.253 1.00 0.67 H new ATOM 0 HE3 LYS A 84 -4.338 -6.036 2.660 1.00 0.67 H new ATOM 0 HZ1 LYS A 84 -4.748 -4.419 4.528 1.00 1.32 H new ATOM 0 HZ2 LYS A 84 -3.150 -4.972 4.369 1.00 1.32 H new ATOM 0 HZ3 LYS A 84 -3.568 -3.418 3.828 1.00 1.32 H new ATOM 1431 N GLN A 85 -0.172 -4.031 -2.807 1.00 0.44 N ATOM 1432 CA GLN A 85 1.188 -3.716 -3.174 1.00 0.47 C ATOM 1433 C GLN A 85 1.225 -2.622 -4.215 1.00 0.52 C ATOM 1434 O GLN A 85 0.305 -2.469 -5.017 1.00 0.83 O ATOM 1435 CB GLN A 85 1.901 -4.967 -3.684 1.00 0.53 C ATOM 1436 CG GLN A 85 0.967 -6.091 -4.064 1.00 0.50 C ATOM 1437 CD GLN A 85 1.673 -7.424 -4.149 1.00 0.64 C ATOM 1438 OE1 GLN A 85 2.153 -7.821 -5.210 1.00 1.10 O ATOM 1439 NE2 GLN A 85 1.756 -8.111 -3.023 1.00 0.72 N ATOM 0 H GLN A 85 -0.647 -4.651 -3.462 1.00 0.44 H new ATOM 0 HA GLN A 85 1.708 -3.355 -2.287 1.00 0.47 H new ATOM 0 HB2 GLN A 85 2.505 -4.701 -4.551 1.00 0.53 H new ATOM 0 HB3 GLN A 85 2.587 -5.322 -2.914 1.00 0.53 H new ATOM 0 HG2 GLN A 85 0.163 -6.155 -3.331 1.00 0.50 H new ATOM 0 HG3 GLN A 85 0.505 -5.866 -5.025 1.00 0.50 H new ATOM 0 HE21 GLN A 85 1.342 -7.740 -2.168 1.00 0.72 H new ATOM 0 HE22 GLN A 85 2.234 -9.012 -3.009 1.00 0.72 H new ATOM 1448 N ARG A 86 2.291 -1.856 -4.179 1.00 0.50 N ATOM 1449 CA ARG A 86 2.465 -0.732 -5.075 1.00 0.52 C ATOM 1450 C ARG A 86 3.693 -0.922 -5.950 1.00 0.50 C ATOM 1451 O ARG A 86 4.579 -1.710 -5.610 1.00 0.53 O ATOM 1452 CB ARG A 86 2.570 0.557 -4.257 1.00 0.67 C ATOM 1453 CG ARG A 86 3.184 0.372 -2.874 1.00 0.85 C ATOM 1454 CD ARG A 86 4.694 0.191 -2.913 1.00 0.98 C ATOM 1455 NE ARG A 86 5.367 1.323 -3.544 1.00 1.13 N ATOM 1456 CZ ARG A 86 5.407 2.556 -3.034 1.00 1.24 C ATOM 1457 NH1 ARG A 86 4.809 2.825 -1.878 1.00 1.62 N ATOM 1458 NH2 ARG A 86 6.050 3.521 -3.683 1.00 1.85 N ATOM 0 H ARG A 86 3.064 -1.993 -3.528 1.00 0.50 H new ATOM 0 HA ARG A 86 1.600 -0.665 -5.735 1.00 0.52 H new ATOM 0 HB2 ARG A 86 3.167 1.279 -4.813 1.00 0.67 H new ATOM 0 HB3 ARG A 86 1.574 0.985 -4.146 1.00 0.67 H new ATOM 0 HG2 ARG A 86 2.943 1.238 -2.257 1.00 0.85 H new ATOM 0 HG3 ARG A 86 2.732 -0.496 -2.395 1.00 0.85 H new ATOM 0 HD2 ARG A 86 5.070 0.066 -1.898 1.00 0.98 H new ATOM 0 HD3 ARG A 86 4.935 -0.722 -3.457 1.00 0.98 H new ATOM 0 HE ARG A 86 5.838 1.161 -4.434 1.00 1.13 H new ATOM 0 HH11 ARG A 86 4.316 2.087 -1.375 1.00 1.62 H new ATOM 0 HH12 ARG A 86 4.843 3.769 -1.494 1.00 1.62 H new ATOM 0 HH21 ARG A 86 6.512 3.319 -4.570 1.00 1.85 H new ATOM 0 HH22 ARG A 86 6.081 4.464 -3.295 1.00 1.85 H new ATOM 1472 N PRO A 87 3.754 -0.222 -7.096 1.00 0.52 N ATOM 1473 CA PRO A 87 4.918 -0.264 -7.975 1.00 0.52 C ATOM 1474 C PRO A 87 6.134 0.315 -7.274 1.00 0.53 C ATOM 1475 O PRO A 87 6.300 1.531 -7.166 1.00 0.62 O ATOM 1476 CB PRO A 87 4.515 0.599 -9.176 1.00 0.57 C ATOM 1477 CG PRO A 87 3.397 1.454 -8.685 1.00 0.86 C ATOM 1478 CD PRO A 87 2.689 0.646 -7.634 1.00 0.60 C ATOM 0 HA PRO A 87 5.189 -1.279 -8.267 1.00 0.52 H new ATOM 0 HB2 PRO A 87 5.351 1.206 -9.523 1.00 0.57 H new ATOM 0 HB3 PRO A 87 4.199 -0.019 -10.016 1.00 0.57 H new ATOM 0 HG2 PRO A 87 3.774 2.389 -8.270 1.00 0.86 H new ATOM 0 HG3 PRO A 87 2.720 1.716 -9.498 1.00 0.86 H new ATOM 0 HD2 PRO A 87 2.259 1.282 -6.860 1.00 0.60 H new ATOM 0 HD3 PRO A 87 1.871 0.063 -8.058 1.00 0.60 H new ATOM 1486 N LEU A 88 6.950 -0.568 -6.741 1.00 0.50 N ATOM 1487 CA LEU A 88 8.089 -0.164 -5.952 1.00 0.53 C ATOM 1488 C LEU A 88 9.344 -0.208 -6.808 1.00 0.44 C ATOM 1489 O LEU A 88 9.768 -1.278 -7.251 1.00 0.42 O ATOM 1490 CB LEU A 88 8.205 -1.100 -4.750 1.00 0.63 C ATOM 1491 CG LEU A 88 9.068 -0.617 -3.589 1.00 0.88 C ATOM 1492 CD1 LEU A 88 8.549 0.700 -3.034 1.00 1.19 C ATOM 1493 CD2 LEU A 88 9.077 -1.674 -2.507 1.00 1.51 C ATOM 0 H LEU A 88 6.843 -1.577 -6.842 1.00 0.50 H new ATOM 0 HA LEU A 88 7.964 0.858 -5.594 1.00 0.53 H new ATOM 0 HB2 LEU A 88 7.202 -1.294 -4.371 1.00 0.63 H new ATOM 0 HB3 LEU A 88 8.604 -2.053 -5.098 1.00 0.63 H new ATOM 0 HG LEU A 88 10.083 -0.449 -3.948 1.00 0.88 H new ATOM 0 HD11 LEU A 88 9.183 1.021 -2.207 1.00 1.19 H new ATOM 0 HD12 LEU A 88 8.564 1.457 -3.818 1.00 1.19 H new ATOM 0 HD13 LEU A 88 7.527 0.567 -2.678 1.00 1.19 H new ATOM 0 HD21 LEU A 88 9.692 -1.336 -1.673 1.00 1.51 H new ATOM 0 HD22 LEU A 88 8.059 -1.848 -2.160 1.00 1.51 H new ATOM 0 HD23 LEU A 88 9.487 -2.601 -2.908 1.00 1.51 H new ATOM 1505 N LYS A 89 9.922 0.958 -7.051 1.00 0.44 N ATOM 1506 CA LYS A 89 11.130 1.054 -7.848 1.00 0.42 C ATOM 1507 C LYS A 89 12.343 1.000 -6.944 1.00 0.39 C ATOM 1508 O LYS A 89 12.593 1.920 -6.171 1.00 0.42 O ATOM 1509 CB LYS A 89 11.145 2.334 -8.693 1.00 0.51 C ATOM 1510 CG LYS A 89 10.366 2.220 -9.997 1.00 0.69 C ATOM 1511 CD LYS A 89 8.865 2.103 -9.769 1.00 0.93 C ATOM 1512 CE LYS A 89 8.247 3.434 -9.377 1.00 1.49 C ATOM 1513 NZ LYS A 89 8.396 4.448 -10.454 1.00 2.11 N ATOM 0 H LYS A 89 9.571 1.852 -6.706 1.00 0.44 H new ATOM 0 HA LYS A 89 11.155 0.209 -8.536 1.00 0.42 H new ATOM 0 HB2 LYS A 89 10.731 3.152 -8.104 1.00 0.51 H new ATOM 0 HB3 LYS A 89 12.178 2.596 -8.920 1.00 0.51 H new ATOM 0 HG2 LYS A 89 10.570 3.094 -10.616 1.00 0.69 H new ATOM 0 HG3 LYS A 89 10.716 1.349 -10.551 1.00 0.69 H new ATOM 0 HD2 LYS A 89 8.387 1.734 -10.677 1.00 0.93 H new ATOM 0 HD3 LYS A 89 8.673 1.369 -8.987 1.00 0.93 H new ATOM 0 HE2 LYS A 89 7.189 3.293 -9.154 1.00 1.49 H new ATOM 0 HE3 LYS A 89 8.719 3.800 -8.465 1.00 1.49 H new ATOM 0 HZ1 LYS A 89 9.062 5.186 -10.147 1.00 2.11 H new ATOM 0 HZ2 LYS A 89 8.759 3.990 -11.314 1.00 2.11 H new ATOM 0 HZ3 LYS A 89 7.471 4.879 -10.656 1.00 2.11 H new ATOM 1527 N ILE A 90 13.097 -0.072 -7.063 1.00 0.36 N ATOM 1528 CA ILE A 90 14.198 -0.335 -6.159 1.00 0.33 C ATOM 1529 C ILE A 90 15.484 -0.485 -6.949 1.00 0.35 C ATOM 1530 O ILE A 90 15.531 -1.238 -7.919 1.00 0.36 O ATOM 1531 CB ILE A 90 13.960 -1.622 -5.332 1.00 0.32 C ATOM 1532 CG1 ILE A 90 12.673 -1.510 -4.509 1.00 0.35 C ATOM 1533 CG2 ILE A 90 15.149 -1.909 -4.426 1.00 0.33 C ATOM 1534 CD1 ILE A 90 12.706 -0.412 -3.467 1.00 0.36 C ATOM 0 H ILE A 90 12.966 -0.782 -7.784 1.00 0.36 H new ATOM 0 HA ILE A 90 14.272 0.508 -5.472 1.00 0.33 H new ATOM 0 HB ILE A 90 13.850 -2.454 -6.027 1.00 0.32 H new ATOM 0 HG12 ILE A 90 11.836 -1.332 -5.184 1.00 0.35 H new ATOM 0 HG13 ILE A 90 12.486 -2.463 -4.013 1.00 0.35 H new ATOM 0 HG21 ILE A 90 14.960 -2.818 -3.854 1.00 0.33 H new ATOM 0 HG22 ILE A 90 16.045 -2.042 -5.033 1.00 0.33 H new ATOM 0 HG23 ILE A 90 15.295 -1.073 -3.741 1.00 0.33 H new ATOM 0 HD11 ILE A 90 11.760 -0.396 -2.926 1.00 0.36 H new ATOM 0 HD12 ILE A 90 13.521 -0.598 -2.768 1.00 0.36 H new ATOM 0 HD13 ILE A 90 12.861 0.550 -3.956 1.00 0.36 H new ATOM 1546 N ARG A 91 16.523 0.226 -6.551 1.00 0.38 N ATOM 1547 CA ARG A 91 17.812 0.081 -7.190 1.00 0.43 C ATOM 1548 C ARG A 91 18.739 -0.674 -6.254 1.00 0.42 C ATOM 1549 O ARG A 91 18.929 -0.279 -5.102 1.00 0.44 O ATOM 1550 CB ARG A 91 18.403 1.443 -7.548 1.00 0.52 C ATOM 1551 CG ARG A 91 19.588 1.355 -8.493 1.00 0.57 C ATOM 1552 CD ARG A 91 20.044 2.733 -8.940 1.00 0.74 C ATOM 1553 NE ARG A 91 18.996 3.449 -9.668 1.00 0.72 N ATOM 1554 CZ ARG A 91 19.227 4.240 -10.714 1.00 1.09 C ATOM 1555 NH1 ARG A 91 20.465 4.400 -11.169 1.00 1.82 N ATOM 1556 NH2 ARG A 91 18.221 4.866 -11.312 1.00 1.12 N ATOM 0 H ARG A 91 16.497 0.906 -5.791 1.00 0.38 H new ATOM 0 HA ARG A 91 17.692 -0.477 -8.119 1.00 0.43 H new ATOM 0 HB2 ARG A 91 17.628 2.059 -8.005 1.00 0.52 H new ATOM 0 HB3 ARG A 91 18.714 1.948 -6.633 1.00 0.52 H new ATOM 0 HG2 ARG A 91 20.412 0.840 -7.999 1.00 0.57 H new ATOM 0 HG3 ARG A 91 19.317 0.759 -9.365 1.00 0.57 H new ATOM 0 HD2 ARG A 91 20.343 3.316 -8.069 1.00 0.74 H new ATOM 0 HD3 ARG A 91 20.924 2.635 -9.575 1.00 0.74 H new ATOM 0 HE ARG A 91 18.032 3.336 -9.356 1.00 0.72 H new ATOM 0 HH11 ARG A 91 21.241 3.916 -10.717 1.00 1.82 H new ATOM 0 HH12 ARG A 91 20.639 5.006 -11.970 1.00 1.82 H new ATOM 0 HH21 ARG A 91 17.268 4.742 -10.971 1.00 1.12 H new ATOM 0 HH22 ARG A 91 18.401 5.471 -12.113 1.00 1.12 H new ATOM 1570 N MET A 92 19.292 -1.762 -6.750 1.00 0.42 N ATOM 1571 CA MET A 92 20.116 -2.646 -5.958 1.00 0.44 C ATOM 1572 C MET A 92 21.539 -2.141 -5.855 1.00 0.48 C ATOM 1573 O MET A 92 21.945 -1.220 -6.568 1.00 0.51 O ATOM 1574 CB MET A 92 20.105 -4.043 -6.577 1.00 0.46 C ATOM 1575 CG MET A 92 19.198 -5.032 -5.864 1.00 0.57 C ATOM 1576 SD MET A 92 17.597 -4.343 -5.411 1.00 1.04 S ATOM 1577 CE MET A 92 16.916 -4.014 -7.028 1.00 0.34 C ATOM 0 H MET A 92 19.180 -2.058 -7.720 1.00 0.42 H new ATOM 0 HA MET A 92 19.703 -2.682 -4.950 1.00 0.44 H new ATOM 0 HB2 MET A 92 19.792 -3.965 -7.618 1.00 0.46 H new ATOM 0 HB3 MET A 92 21.122 -4.436 -6.579 1.00 0.46 H new ATOM 0 HG2 MET A 92 19.043 -5.899 -6.507 1.00 0.57 H new ATOM 0 HG3 MET A 92 19.699 -5.388 -4.964 1.00 0.57 H new ATOM 0 HE1 MET A 92 15.960 -3.501 -6.923 1.00 0.34 H new ATOM 0 HE2 MET A 92 17.605 -3.385 -7.592 1.00 0.34 H new ATOM 0 HE3 MET A 92 16.767 -4.955 -7.558 1.00 0.34 H new ATOM 1587 N LEU A 93 22.287 -2.813 -5.001 1.00 0.49 N ATOM 1588 CA LEU A 93 23.615 -2.405 -4.575 1.00 0.55 C ATOM 1589 C LEU A 93 24.576 -2.283 -5.750 1.00 0.61 C ATOM 1590 O LEU A 93 25.407 -1.374 -5.801 1.00 0.69 O ATOM 1591 CB LEU A 93 24.113 -3.451 -3.593 1.00 0.57 C ATOM 1592 CG LEU A 93 23.084 -3.818 -2.530 1.00 0.57 C ATOM 1593 CD1 LEU A 93 22.982 -5.324 -2.369 1.00 0.68 C ATOM 1594 CD2 LEU A 93 23.421 -3.137 -1.227 1.00 0.79 C ATOM 0 H LEU A 93 21.979 -3.685 -4.570 1.00 0.49 H new ATOM 0 HA LEU A 93 23.565 -1.420 -4.112 1.00 0.55 H new ATOM 0 HB2 LEU A 93 24.395 -4.350 -4.142 1.00 0.57 H new ATOM 0 HB3 LEU A 93 25.014 -3.081 -3.104 1.00 0.57 H new ATOM 0 HG LEU A 93 22.104 -3.465 -2.851 1.00 0.57 H new ATOM 0 HD11 LEU A 93 22.241 -5.559 -1.605 1.00 0.68 H new ATOM 0 HD12 LEU A 93 22.681 -5.772 -3.316 1.00 0.68 H new ATOM 0 HD13 LEU A 93 23.951 -5.724 -2.070 1.00 0.68 H new ATOM 0 HD21 LEU A 93 22.680 -3.405 -0.474 1.00 0.79 H new ATOM 0 HD22 LEU A 93 24.409 -3.456 -0.894 1.00 0.79 H new ATOM 0 HD23 LEU A 93 23.418 -2.056 -1.370 1.00 0.79 H new ATOM 1606 N ASP A 94 24.446 -3.198 -6.699 1.00 0.61 N ATOM 1607 CA ASP A 94 25.308 -3.215 -7.876 1.00 0.69 C ATOM 1608 C ASP A 94 24.913 -2.109 -8.851 1.00 0.66 C ATOM 1609 O ASP A 94 25.616 -1.841 -9.825 1.00 0.70 O ATOM 1610 CB ASP A 94 25.246 -4.580 -8.570 1.00 0.76 C ATOM 1611 CG ASP A 94 23.908 -4.845 -9.231 1.00 1.47 C ATOM 1612 OD1 ASP A 94 22.889 -4.944 -8.513 1.00 2.26 O ATOM 1613 OD2 ASP A 94 23.870 -4.951 -10.473 1.00 1.93 O ATOM 0 H ASP A 94 23.749 -3.943 -6.678 1.00 0.61 H new ATOM 0 HA ASP A 94 26.332 -3.037 -7.548 1.00 0.69 H new ATOM 0 HB2 ASP A 94 26.034 -4.636 -9.321 1.00 0.76 H new ATOM 0 HB3 ASP A 94 25.446 -5.363 -7.839 1.00 0.76 H new ATOM 1618 N GLY A 95 23.791 -1.456 -8.573 1.00 0.61 N ATOM 1619 CA GLY A 95 23.349 -0.350 -9.396 1.00 0.61 C ATOM 1620 C GLY A 95 22.225 -0.735 -10.332 1.00 0.58 C ATOM 1621 O GLY A 95 21.862 0.030 -11.229 1.00 0.64 O ATOM 0 H GLY A 95 23.178 -1.675 -7.788 1.00 0.61 H new ATOM 0 HA2 GLY A 95 23.019 0.467 -8.754 1.00 0.61 H new ATOM 0 HA3 GLY A 95 24.191 0.023 -9.979 1.00 0.61 H new ATOM 1625 N THR A 96 21.662 -1.912 -10.126 1.00 0.54 N ATOM 1626 CA THR A 96 20.613 -2.409 -11.002 1.00 0.54 C ATOM 1627 C THR A 96 19.245 -2.129 -10.408 1.00 0.47 C ATOM 1628 O THR A 96 19.003 -2.405 -9.241 1.00 0.47 O ATOM 1629 CB THR A 96 20.779 -3.917 -11.263 1.00 0.62 C ATOM 1630 OG1 THR A 96 22.000 -4.142 -11.975 1.00 0.81 O ATOM 1631 CG2 THR A 96 19.612 -4.482 -12.059 1.00 0.61 C ATOM 0 H THR A 96 21.912 -2.541 -9.363 1.00 0.54 H new ATOM 0 HA THR A 96 20.697 -1.885 -11.954 1.00 0.54 H new ATOM 0 HB THR A 96 20.804 -4.427 -10.300 1.00 0.62 H new ATOM 0 HG1 THR A 96 22.579 -4.735 -11.452 1.00 0.81 H new ATOM 0 HG21 THR A 96 19.766 -5.549 -12.223 1.00 0.61 H new ATOM 0 HG22 THR A 96 18.686 -4.330 -11.505 1.00 0.61 H new ATOM 0 HG23 THR A 96 19.547 -3.973 -13.021 1.00 0.61 H new ATOM 1639 N VAL A 97 18.350 -1.592 -11.212 1.00 0.45 N ATOM 1640 CA VAL A 97 17.049 -1.203 -10.716 1.00 0.41 C ATOM 1641 C VAL A 97 15.988 -2.204 -11.164 1.00 0.38 C ATOM 1642 O VAL A 97 16.020 -2.708 -12.288 1.00 0.41 O ATOM 1643 CB VAL A 97 16.676 0.234 -11.164 1.00 0.50 C ATOM 1644 CG1 VAL A 97 16.634 0.347 -12.677 1.00 1.07 C ATOM 1645 CG2 VAL A 97 15.352 0.676 -10.559 1.00 1.11 C ATOM 0 H VAL A 97 18.500 -1.416 -12.206 1.00 0.45 H new ATOM 0 HA VAL A 97 17.091 -1.205 -9.627 1.00 0.41 H new ATOM 0 HB VAL A 97 17.456 0.900 -10.796 1.00 0.50 H new ATOM 0 HG11 VAL A 97 16.370 1.366 -12.959 1.00 1.07 H new ATOM 0 HG12 VAL A 97 17.613 0.099 -13.088 1.00 1.07 H new ATOM 0 HG13 VAL A 97 15.889 -0.343 -13.073 1.00 1.07 H new ATOM 0 HG21 VAL A 97 15.119 1.687 -10.892 1.00 1.11 H new ATOM 0 HG22 VAL A 97 14.561 -0.003 -10.879 1.00 1.11 H new ATOM 0 HG23 VAL A 97 15.426 0.660 -9.472 1.00 1.11 H new ATOM 1655 N LYS A 98 15.078 -2.508 -10.261 1.00 0.35 N ATOM 1656 CA LYS A 98 13.958 -3.378 -10.570 1.00 0.35 C ATOM 1657 C LYS A 98 12.689 -2.799 -9.972 1.00 0.36 C ATOM 1658 O LYS A 98 12.742 -2.053 -8.995 1.00 0.37 O ATOM 1659 CB LYS A 98 14.180 -4.809 -10.058 1.00 0.38 C ATOM 1660 CG LYS A 98 13.900 -5.008 -8.573 1.00 0.41 C ATOM 1661 CD LYS A 98 13.715 -6.483 -8.225 1.00 0.43 C ATOM 1662 CE LYS A 98 12.391 -7.034 -8.750 1.00 0.43 C ATOM 1663 NZ LYS A 98 12.414 -7.294 -10.215 1.00 0.94 N ATOM 0 H LYS A 98 15.091 -2.164 -9.301 1.00 0.35 H new ATOM 0 HA LYS A 98 13.866 -3.435 -11.655 1.00 0.35 H new ATOM 0 HB2 LYS A 98 13.543 -5.486 -10.627 1.00 0.38 H new ATOM 0 HB3 LYS A 98 15.212 -5.096 -10.260 1.00 0.38 H new ATOM 0 HG2 LYS A 98 14.724 -4.597 -7.989 1.00 0.41 H new ATOM 0 HG3 LYS A 98 13.004 -4.453 -8.294 1.00 0.41 H new ATOM 0 HD2 LYS A 98 14.539 -7.060 -8.644 1.00 0.43 H new ATOM 0 HD3 LYS A 98 13.756 -6.608 -7.143 1.00 0.43 H new ATOM 0 HE2 LYS A 98 12.154 -7.960 -8.225 1.00 0.43 H new ATOM 0 HE3 LYS A 98 11.593 -6.327 -8.524 1.00 0.43 H new ATOM 0 HZ1 LYS A 98 11.867 -8.153 -10.424 1.00 0.94 H new ATOM 0 HZ2 LYS A 98 11.995 -6.486 -10.718 1.00 0.94 H new ATOM 0 HZ3 LYS A 98 13.397 -7.425 -10.529 1.00 0.94 H new ATOM 1677 N THR A 99 11.557 -3.124 -10.562 1.00 0.40 N ATOM 1678 CA THR A 99 10.285 -2.687 -10.035 1.00 0.44 C ATOM 1679 C THR A 99 9.487 -3.898 -9.589 1.00 0.47 C ATOM 1680 O THR A 99 9.056 -4.709 -10.414 1.00 0.58 O ATOM 1681 CB THR A 99 9.481 -1.898 -11.082 1.00 0.48 C ATOM 1682 OG1 THR A 99 10.238 -0.764 -11.529 1.00 0.50 O ATOM 1683 CG2 THR A 99 8.155 -1.439 -10.498 1.00 0.57 C ATOM 0 H THR A 99 11.494 -3.690 -11.408 1.00 0.40 H new ATOM 0 HA THR A 99 10.474 -2.026 -9.189 1.00 0.44 H new ATOM 0 HB THR A 99 9.280 -2.551 -11.931 1.00 0.48 H new ATOM 0 HG1 THR A 99 9.720 -0.268 -12.197 1.00 0.50 H new ATOM 0 HG21 THR A 99 7.599 -0.882 -11.252 1.00 0.57 H new ATOM 0 HG22 THR A 99 7.575 -2.307 -10.186 1.00 0.57 H new ATOM 0 HG23 THR A 99 8.340 -0.798 -9.636 1.00 0.57 H new ATOM 1691 N ILE A 100 9.309 -4.036 -8.291 1.00 0.42 N ATOM 1692 CA ILE A 100 8.609 -5.177 -7.740 1.00 0.44 C ATOM 1693 C ILE A 100 7.431 -4.679 -6.917 1.00 0.45 C ATOM 1694 O ILE A 100 7.493 -3.602 -6.326 1.00 0.45 O ATOM 1695 CB ILE A 100 9.565 -6.064 -6.893 1.00 0.48 C ATOM 1696 CG1 ILE A 100 8.910 -7.411 -6.533 1.00 0.61 C ATOM 1697 CG2 ILE A 100 10.033 -5.331 -5.640 1.00 0.48 C ATOM 1698 CD1 ILE A 100 8.153 -7.429 -5.220 1.00 0.50 C ATOM 0 H ILE A 100 9.642 -3.368 -7.595 1.00 0.42 H new ATOM 0 HA ILE A 100 8.237 -5.804 -8.550 1.00 0.44 H new ATOM 0 HB ILE A 100 10.443 -6.275 -7.504 1.00 0.48 H new ATOM 0 HG12 ILE A 100 8.224 -7.689 -7.333 1.00 0.61 H new ATOM 0 HG13 ILE A 100 9.685 -8.176 -6.498 1.00 0.61 H new ATOM 0 HG21 ILE A 100 10.700 -5.977 -5.068 1.00 0.48 H new ATOM 0 HG22 ILE A 100 10.564 -4.423 -5.926 1.00 0.48 H new ATOM 0 HG23 ILE A 100 9.170 -5.068 -5.028 1.00 0.48 H new ATOM 0 HD11 ILE A 100 7.730 -8.420 -5.058 1.00 0.50 H new ATOM 0 HD12 ILE A 100 8.834 -7.187 -4.404 1.00 0.50 H new ATOM 0 HD13 ILE A 100 7.350 -6.693 -5.253 1.00 0.50 H new ATOM 1710 N MET A 101 6.349 -5.429 -6.907 1.00 0.47 N ATOM 1711 CA MET A 101 5.168 -4.999 -6.188 1.00 0.50 C ATOM 1712 C MET A 101 5.173 -5.547 -4.775 1.00 0.50 C ATOM 1713 O MET A 101 5.046 -6.750 -4.547 1.00 0.52 O ATOM 1714 CB MET A 101 3.916 -5.447 -6.934 1.00 0.56 C ATOM 1715 CG MET A 101 3.874 -4.949 -8.370 1.00 0.64 C ATOM 1716 SD MET A 101 2.224 -4.446 -8.882 1.00 0.98 S ATOM 1717 CE MET A 101 1.893 -3.184 -7.656 1.00 0.59 C ATOM 0 H MET A 101 6.262 -6.328 -7.382 1.00 0.47 H new ATOM 0 HA MET A 101 5.171 -3.911 -6.127 1.00 0.50 H new ATOM 0 HB2 MET A 101 3.867 -6.536 -6.931 1.00 0.56 H new ATOM 0 HB3 MET A 101 3.035 -5.087 -6.404 1.00 0.56 H new ATOM 0 HG2 MET A 101 4.556 -4.106 -8.478 1.00 0.64 H new ATOM 0 HG3 MET A 101 4.232 -5.736 -9.034 1.00 0.64 H new ATOM 0 HE1 MET A 101 1.086 -2.540 -8.005 1.00 0.59 H new ATOM 0 HE2 MET A 101 1.601 -3.656 -6.718 1.00 0.59 H new ATOM 0 HE3 MET A 101 2.791 -2.587 -7.497 1.00 0.59 H new ATOM 1727 N VAL A 102 5.335 -4.628 -3.835 1.00 0.50 N ATOM 1728 CA VAL A 102 5.346 -4.961 -2.423 1.00 0.53 C ATOM 1729 C VAL A 102 4.252 -4.199 -1.705 1.00 0.49 C ATOM 1730 O VAL A 102 3.977 -3.041 -2.032 1.00 0.50 O ATOM 1731 CB VAL A 102 6.699 -4.643 -1.762 1.00 0.61 C ATOM 1732 CG1 VAL A 102 6.881 -5.475 -0.505 1.00 0.73 C ATOM 1733 CG2 VAL A 102 7.839 -4.868 -2.735 1.00 0.90 C ATOM 0 H VAL A 102 5.462 -3.635 -4.031 1.00 0.50 H new ATOM 0 HA VAL A 102 5.176 -6.035 -2.343 1.00 0.53 H new ATOM 0 HB VAL A 102 6.707 -3.591 -1.478 1.00 0.61 H new ATOM 0 HG11 VAL A 102 7.842 -5.239 -0.049 1.00 0.73 H new ATOM 0 HG12 VAL A 102 6.080 -5.250 0.199 1.00 0.73 H new ATOM 0 HG13 VAL A 102 6.851 -6.534 -0.762 1.00 0.73 H new ATOM 0 HG21 VAL A 102 8.785 -4.637 -2.246 1.00 0.90 H new ATOM 0 HG22 VAL A 102 7.842 -5.909 -3.058 1.00 0.90 H new ATOM 0 HG23 VAL A 102 7.711 -4.220 -3.602 1.00 0.90 H new ATOM 1743 N ASP A 103 3.621 -4.864 -0.754 1.00 0.48 N ATOM 1744 CA ASP A 103 2.463 -4.323 -0.062 1.00 0.47 C ATOM 1745 C ASP A 103 2.805 -3.025 0.662 1.00 0.46 C ATOM 1746 O ASP A 103 3.757 -2.963 1.436 1.00 0.51 O ATOM 1747 CB ASP A 103 1.906 -5.363 0.906 1.00 0.51 C ATOM 1748 CG ASP A 103 1.643 -6.690 0.219 1.00 1.22 C ATOM 1749 OD1 ASP A 103 0.576 -6.830 -0.415 1.00 1.56 O ATOM 1750 OD2 ASP A 103 2.490 -7.601 0.314 1.00 1.96 O ATOM 0 H ASP A 103 3.896 -5.794 -0.439 1.00 0.48 H new ATOM 0 HA ASP A 103 1.697 -4.086 -0.801 1.00 0.47 H new ATOM 0 HB2 ASP A 103 2.610 -5.511 1.725 1.00 0.51 H new ATOM 0 HB3 ASP A 103 0.980 -4.991 1.345 1.00 0.51 H new ATOM 1755 N ASP A 104 2.021 -1.995 0.386 1.00 0.46 N ATOM 1756 CA ASP A 104 2.240 -0.666 0.950 1.00 0.47 C ATOM 1757 C ASP A 104 1.715 -0.607 2.379 1.00 0.46 C ATOM 1758 O ASP A 104 2.117 0.236 3.177 1.00 0.54 O ATOM 1759 CB ASP A 104 1.514 0.379 0.101 1.00 0.54 C ATOM 1760 CG ASP A 104 1.870 1.804 0.474 1.00 0.66 C ATOM 1761 OD1 ASP A 104 2.965 2.268 0.086 1.00 1.08 O ATOM 1762 OD2 ASP A 104 1.046 2.474 1.134 1.00 0.64 O ATOM 0 H ASP A 104 1.214 -2.053 -0.235 1.00 0.46 H new ATOM 0 HA ASP A 104 3.310 -0.458 0.954 1.00 0.47 H new ATOM 0 HB2 ASP A 104 1.754 0.215 -0.949 1.00 0.54 H new ATOM 0 HB3 ASP A 104 0.438 0.240 0.208 1.00 0.54 H new ATOM 1767 N SER A 105 0.828 -1.540 2.693 1.00 0.43 N ATOM 1768 CA SER A 105 0.098 -1.529 3.954 1.00 0.49 C ATOM 1769 C SER A 105 0.913 -2.141 5.107 1.00 0.57 C ATOM 1770 O SER A 105 0.340 -2.652 6.074 1.00 0.96 O ATOM 1771 CB SER A 105 -1.215 -2.295 3.750 1.00 0.52 C ATOM 1772 OG SER A 105 -2.037 -2.284 4.906 1.00 1.27 O ATOM 0 H SER A 105 0.594 -2.324 2.084 1.00 0.43 H new ATOM 0 HA SER A 105 -0.101 -0.496 4.239 1.00 0.49 H new ATOM 0 HB2 SER A 105 -1.762 -1.856 2.915 1.00 0.52 H new ATOM 0 HB3 SER A 105 -0.991 -3.326 3.477 1.00 0.52 H new ATOM 0 HG SER A 105 -1.480 -2.394 5.705 1.00 1.27 H new ATOM 1778 N LYS A 106 2.238 -2.065 5.033 1.00 0.45 N ATOM 1779 CA LYS A 106 3.081 -2.645 6.072 1.00 0.49 C ATOM 1780 C LYS A 106 4.437 -1.948 6.172 1.00 0.52 C ATOM 1781 O LYS A 106 4.728 -1.017 5.417 1.00 0.65 O ATOM 1782 CB LYS A 106 3.241 -4.155 5.854 1.00 0.58 C ATOM 1783 CG LYS A 106 3.491 -4.565 4.413 1.00 0.69 C ATOM 1784 CD LYS A 106 4.960 -4.576 4.056 1.00 0.58 C ATOM 1785 CE LYS A 106 5.178 -5.302 2.741 1.00 1.00 C ATOM 1786 NZ LYS A 106 4.595 -6.672 2.765 1.00 2.02 N ATOM 0 H LYS A 106 2.747 -1.613 4.273 1.00 0.45 H new ATOM 0 HA LYS A 106 2.580 -2.487 7.027 1.00 0.49 H new ATOM 0 HB2 LYS A 106 4.068 -4.511 6.468 1.00 0.58 H new ATOM 0 HB3 LYS A 106 2.341 -4.657 6.209 1.00 0.58 H new ATOM 0 HG2 LYS A 106 3.073 -5.557 4.244 1.00 0.69 H new ATOM 0 HG3 LYS A 106 2.965 -3.880 3.748 1.00 0.69 H new ATOM 0 HD2 LYS A 106 5.330 -3.554 3.980 1.00 0.58 H new ATOM 0 HD3 LYS A 106 5.530 -5.064 4.847 1.00 0.58 H new ATOM 0 HE2 LYS A 106 4.728 -4.729 1.930 1.00 1.00 H new ATOM 0 HE3 LYS A 106 6.246 -5.365 2.533 1.00 1.00 H new ATOM 0 HZ1 LYS A 106 4.778 -7.143 1.856 1.00 2.02 H new ATOM 0 HZ2 LYS A 106 5.030 -7.221 3.534 1.00 2.02 H new ATOM 0 HZ3 LYS A 106 3.569 -6.610 2.922 1.00 2.02 H new ATOM 1800 N THR A 107 5.254 -2.408 7.113 1.00 0.53 N ATOM 1801 CA THR A 107 6.503 -1.742 7.452 1.00 0.57 C ATOM 1802 C THR A 107 7.647 -2.110 6.508 1.00 0.52 C ATOM 1803 O THR A 107 7.490 -2.912 5.585 1.00 0.54 O ATOM 1804 CB THR A 107 6.916 -2.078 8.895 1.00 0.69 C ATOM 1805 OG1 THR A 107 6.851 -3.494 9.094 1.00 0.76 O ATOM 1806 CG2 THR A 107 6.017 -1.369 9.898 1.00 0.74 C ATOM 0 H THR A 107 5.069 -3.249 7.659 1.00 0.53 H new ATOM 0 HA THR A 107 6.318 -0.673 7.350 1.00 0.57 H new ATOM 0 HB THR A 107 7.938 -1.733 9.053 1.00 0.69 H new ATOM 0 HG1 THR A 107 7.116 -3.708 10.013 1.00 0.76 H new ATOM 0 HG21 THR A 107 6.330 -1.623 10.911 1.00 0.74 H new ATOM 0 HG22 THR A 107 6.092 -0.291 9.755 1.00 0.74 H new ATOM 0 HG23 THR A 107 4.984 -1.684 9.748 1.00 0.74 H new ATOM 1814 N VAL A 108 8.811 -1.527 6.778 1.00 0.49 N ATOM 1815 CA VAL A 108 9.978 -1.665 5.917 1.00 0.47 C ATOM 1816 C VAL A 108 10.522 -3.088 5.917 1.00 0.42 C ATOM 1817 O VAL A 108 10.688 -3.693 4.866 1.00 0.44 O ATOM 1818 CB VAL A 108 11.102 -0.720 6.371 1.00 0.55 C ATOM 1819 CG1 VAL A 108 12.224 -0.675 5.346 1.00 0.61 C ATOM 1820 CG2 VAL A 108 10.553 0.669 6.646 1.00 0.60 C ATOM 0 H VAL A 108 8.971 -0.946 7.601 1.00 0.49 H new ATOM 0 HA VAL A 108 9.651 -1.410 4.909 1.00 0.47 H new ATOM 0 HB VAL A 108 11.520 -1.108 7.300 1.00 0.55 H new ATOM 0 HG11 VAL A 108 13.006 0.001 5.692 1.00 0.61 H new ATOM 0 HG12 VAL A 108 12.639 -1.675 5.217 1.00 0.61 H new ATOM 0 HG13 VAL A 108 11.832 -0.319 4.393 1.00 0.61 H new ATOM 0 HG21 VAL A 108 11.363 1.324 6.966 1.00 0.60 H new ATOM 0 HG22 VAL A 108 10.101 1.068 5.738 1.00 0.60 H new ATOM 0 HG23 VAL A 108 9.800 0.613 7.432 1.00 0.60 H new ATOM 1830 N THR A 109 10.828 -3.588 7.105 1.00 0.43 N ATOM 1831 CA THR A 109 11.403 -4.922 7.281 1.00 0.43 C ATOM 1832 C THR A 109 10.633 -6.001 6.517 1.00 0.44 C ATOM 1833 O THR A 109 11.238 -6.858 5.865 1.00 0.45 O ATOM 1834 CB THR A 109 11.450 -5.280 8.773 1.00 0.51 C ATOM 1835 OG1 THR A 109 11.976 -4.160 9.495 1.00 0.56 O ATOM 1836 CG2 THR A 109 12.320 -6.504 9.018 1.00 0.56 C ATOM 0 H THR A 109 10.686 -3.082 7.979 1.00 0.43 H new ATOM 0 HA THR A 109 12.412 -4.891 6.870 1.00 0.43 H new ATOM 0 HB THR A 109 10.441 -5.514 9.114 1.00 0.51 H new ATOM 0 HG1 THR A 109 12.360 -3.516 8.865 1.00 0.56 H new ATOM 0 HG21 THR A 109 12.334 -6.733 10.084 1.00 0.56 H new ATOM 0 HG22 THR A 109 11.915 -7.354 8.469 1.00 0.56 H new ATOM 0 HG23 THR A 109 13.335 -6.303 8.677 1.00 0.56 H new ATOM 1844 N ASP A 110 9.310 -5.939 6.573 1.00 0.47 N ATOM 1845 CA ASP A 110 8.464 -6.919 5.896 1.00 0.51 C ATOM 1846 C ASP A 110 8.606 -6.772 4.383 1.00 0.49 C ATOM 1847 O ASP A 110 8.783 -7.749 3.655 1.00 0.54 O ATOM 1848 CB ASP A 110 7.005 -6.710 6.312 1.00 0.57 C ATOM 1849 CG ASP A 110 6.086 -7.830 5.865 1.00 0.65 C ATOM 1850 OD1 ASP A 110 5.861 -7.954 4.644 1.00 0.70 O ATOM 1851 OD2 ASP A 110 5.602 -8.596 6.720 1.00 0.76 O ATOM 0 H ASP A 110 8.796 -5.219 7.081 1.00 0.47 H new ATOM 0 HA ASP A 110 8.776 -7.924 6.181 1.00 0.51 H new ATOM 0 HB2 ASP A 110 6.954 -6.619 7.397 1.00 0.57 H new ATOM 0 HB3 ASP A 110 6.647 -5.768 5.896 1.00 0.57 H new ATOM 1856 N MET A 111 8.553 -5.529 3.932 1.00 0.46 N ATOM 1857 CA MET A 111 8.695 -5.197 2.521 1.00 0.46 C ATOM 1858 C MET A 111 10.083 -5.562 1.995 1.00 0.40 C ATOM 1859 O MET A 111 10.218 -6.109 0.902 1.00 0.43 O ATOM 1860 CB MET A 111 8.413 -3.703 2.338 1.00 0.51 C ATOM 1861 CG MET A 111 9.046 -3.069 1.110 1.00 0.50 C ATOM 1862 SD MET A 111 8.675 -1.310 1.000 1.00 0.75 S ATOM 1863 CE MET A 111 8.891 -0.844 2.714 1.00 0.67 C ATOM 0 H MET A 111 8.410 -4.719 4.535 1.00 0.46 H new ATOM 0 HA MET A 111 7.978 -5.780 1.943 1.00 0.46 H new ATOM 0 HB2 MET A 111 7.334 -3.557 2.287 1.00 0.51 H new ATOM 0 HB3 MET A 111 8.765 -3.172 3.223 1.00 0.51 H new ATOM 0 HG2 MET A 111 10.126 -3.211 1.143 1.00 0.50 H new ATOM 0 HG3 MET A 111 8.685 -3.573 0.214 1.00 0.50 H new ATOM 0 HE1 MET A 111 9.157 0.211 2.773 1.00 0.67 H new ATOM 0 HE2 MET A 111 7.962 -1.015 3.257 1.00 0.67 H new ATOM 0 HE3 MET A 111 9.686 -1.444 3.157 1.00 0.67 H new ATOM 1873 N LEU A 112 11.107 -5.276 2.788 1.00 0.36 N ATOM 1874 CA LEU A 112 12.484 -5.546 2.394 1.00 0.34 C ATOM 1875 C LEU A 112 12.710 -7.047 2.244 1.00 0.37 C ATOM 1876 O LEU A 112 13.488 -7.489 1.397 1.00 0.42 O ATOM 1877 CB LEU A 112 13.453 -4.981 3.429 1.00 0.35 C ATOM 1878 CG LEU A 112 14.864 -4.711 2.910 1.00 0.38 C ATOM 1879 CD1 LEU A 112 14.863 -3.502 1.988 1.00 0.39 C ATOM 1880 CD2 LEU A 112 15.820 -4.497 4.064 1.00 0.46 C ATOM 0 H LEU A 112 11.010 -4.855 3.712 1.00 0.36 H new ATOM 0 HA LEU A 112 12.667 -5.062 1.434 1.00 0.34 H new ATOM 0 HB2 LEU A 112 13.042 -4.051 3.821 1.00 0.35 H new ATOM 0 HB3 LEU A 112 13.516 -5.678 4.265 1.00 0.35 H new ATOM 0 HG LEU A 112 15.199 -5.580 2.343 1.00 0.38 H new ATOM 0 HD11 LEU A 112 15.875 -3.320 1.625 1.00 0.39 H new ATOM 0 HD12 LEU A 112 14.202 -3.690 1.142 1.00 0.39 H new ATOM 0 HD13 LEU A 112 14.511 -2.627 2.535 1.00 0.39 H new ATOM 0 HD21 LEU A 112 16.821 -4.306 3.677 1.00 0.46 H new ATOM 0 HD22 LEU A 112 15.491 -3.643 4.656 1.00 0.46 H new ATOM 0 HD23 LEU A 112 15.838 -5.388 4.692 1.00 0.46 H new ATOM 1892 N MET A 113 12.013 -7.818 3.074 1.00 0.39 N ATOM 1893 CA MET A 113 12.051 -9.276 3.004 1.00 0.46 C ATOM 1894 C MET A 113 11.649 -9.739 1.616 1.00 0.49 C ATOM 1895 O MET A 113 12.243 -10.653 1.048 1.00 0.56 O ATOM 1896 CB MET A 113 11.093 -9.871 4.039 1.00 0.55 C ATOM 1897 CG MET A 113 11.093 -11.391 4.083 1.00 0.61 C ATOM 1898 SD MET A 113 9.972 -12.048 5.334 1.00 0.98 S ATOM 1899 CE MET A 113 10.669 -11.335 6.822 1.00 1.34 C ATOM 0 H MET A 113 11.409 -7.453 3.810 1.00 0.39 H new ATOM 0 HA MET A 113 13.066 -9.613 3.215 1.00 0.46 H new ATOM 0 HB2 MET A 113 11.358 -9.490 5.025 1.00 0.55 H new ATOM 0 HB3 MET A 113 10.082 -9.524 3.824 1.00 0.55 H new ATOM 0 HG2 MET A 113 10.808 -11.779 3.105 1.00 0.61 H new ATOM 0 HG3 MET A 113 12.104 -11.745 4.284 1.00 0.61 H new ATOM 0 HE1 MET A 113 10.212 -11.799 7.696 1.00 1.34 H new ATOM 0 HE2 MET A 113 11.745 -11.509 6.839 1.00 1.34 H new ATOM 0 HE3 MET A 113 10.475 -10.263 6.837 1.00 1.34 H new ATOM 1909 N THR A 114 10.651 -9.063 1.084 1.00 0.47 N ATOM 1910 CA THR A 114 10.111 -9.379 -0.218 1.00 0.50 C ATOM 1911 C THR A 114 11.042 -8.912 -1.339 1.00 0.46 C ATOM 1912 O THR A 114 11.217 -9.612 -2.333 1.00 0.49 O ATOM 1913 CB THR A 114 8.719 -8.741 -0.379 1.00 0.54 C ATOM 1914 OG1 THR A 114 7.824 -9.293 0.598 1.00 0.62 O ATOM 1915 CG2 THR A 114 8.156 -8.965 -1.777 1.00 0.60 C ATOM 0 H THR A 114 10.192 -8.278 1.545 1.00 0.47 H new ATOM 0 HA THR A 114 10.021 -10.463 -0.292 1.00 0.50 H new ATOM 0 HB THR A 114 8.820 -7.666 -0.229 1.00 0.54 H new ATOM 0 HG1 THR A 114 6.938 -8.886 0.497 1.00 0.62 H new ATOM 0 HG21 THR A 114 7.173 -8.500 -1.852 1.00 0.60 H new ATOM 0 HG22 THR A 114 8.825 -8.520 -2.514 1.00 0.60 H new ATOM 0 HG23 THR A 114 8.067 -10.035 -1.966 1.00 0.60 H new ATOM 1923 N ILE A 115 11.682 -7.756 -1.165 1.00 0.43 N ATOM 1924 CA ILE A 115 12.503 -7.175 -2.223 1.00 0.41 C ATOM 1925 C ILE A 115 13.789 -7.970 -2.424 1.00 0.42 C ATOM 1926 O ILE A 115 14.113 -8.375 -3.541 1.00 0.43 O ATOM 1927 CB ILE A 115 12.876 -5.710 -1.920 1.00 0.40 C ATOM 1928 CG1 ILE A 115 11.622 -4.874 -1.659 1.00 0.42 C ATOM 1929 CG2 ILE A 115 13.674 -5.124 -3.077 1.00 0.42 C ATOM 1930 CD1 ILE A 115 11.923 -3.462 -1.201 1.00 0.44 C ATOM 0 H ILE A 115 11.647 -7.207 -0.306 1.00 0.43 H new ATOM 0 HA ILE A 115 11.902 -7.211 -3.131 1.00 0.41 H new ATOM 0 HB ILE A 115 13.492 -5.688 -1.021 1.00 0.40 H new ATOM 0 HG12 ILE A 115 11.026 -4.833 -2.571 1.00 0.42 H new ATOM 0 HG13 ILE A 115 11.014 -5.371 -0.903 1.00 0.42 H new ATOM 0 HG21 ILE A 115 13.933 -4.089 -2.853 1.00 0.42 H new ATOM 0 HG22 ILE A 115 14.586 -5.703 -3.220 1.00 0.42 H new ATOM 0 HG23 ILE A 115 13.075 -5.160 -3.987 1.00 0.42 H new ATOM 0 HD11 ILE A 115 10.988 -2.926 -1.035 1.00 0.44 H new ATOM 0 HD12 ILE A 115 12.493 -3.494 -0.272 1.00 0.44 H new ATOM 0 HD13 ILE A 115 12.505 -2.948 -1.966 1.00 0.44 H new ATOM 1942 N CYS A 116 14.515 -8.200 -1.336 1.00 0.43 N ATOM 1943 CA CYS A 116 15.781 -8.919 -1.407 1.00 0.47 C ATOM 1944 C CYS A 116 15.548 -10.358 -1.856 1.00 0.50 C ATOM 1945 O CYS A 116 16.423 -10.984 -2.459 1.00 0.53 O ATOM 1946 CB CYS A 116 16.495 -8.887 -0.056 1.00 0.51 C ATOM 1947 SG CYS A 116 16.754 -7.220 0.593 1.00 1.56 S ATOM 0 H CYS A 116 14.250 -7.900 -0.398 1.00 0.43 H new ATOM 0 HA CYS A 116 16.418 -8.425 -2.141 1.00 0.47 H new ATOM 0 HB2 CYS A 116 15.914 -9.461 0.665 1.00 0.51 H new ATOM 0 HB3 CYS A 116 17.461 -9.383 -0.154 1.00 0.51 H new ATOM 0 HG CYS A 116 17.911 -7.159 1.182 1.00 1.56 H new ATOM 1953 N ALA A 117 14.357 -10.869 -1.568 1.00 0.50 N ATOM 1954 CA ALA A 117 13.973 -12.210 -1.985 1.00 0.54 C ATOM 1955 C ALA A 117 13.837 -12.287 -3.500 1.00 0.54 C ATOM 1956 O ALA A 117 14.094 -13.329 -4.101 1.00 0.58 O ATOM 1957 CB ALA A 117 12.670 -12.619 -1.319 1.00 0.57 C ATOM 0 H ALA A 117 13.637 -10.371 -1.044 1.00 0.50 H new ATOM 0 HA ALA A 117 14.757 -12.900 -1.675 1.00 0.54 H new ATOM 0 HB1 ALA A 117 12.397 -13.624 -1.641 1.00 0.57 H new ATOM 0 HB2 ALA A 117 12.795 -12.606 -0.236 1.00 0.57 H new ATOM 0 HB3 ALA A 117 11.882 -11.921 -1.601 1.00 0.57 H new ATOM 1963 N ARG A 118 13.448 -11.170 -4.118 1.00 0.50 N ATOM 1964 CA ARG A 118 13.286 -11.119 -5.567 1.00 0.51 C ATOM 1965 C ARG A 118 14.623 -11.329 -6.252 1.00 0.52 C ATOM 1966 O ARG A 118 14.714 -12.037 -7.252 1.00 0.55 O ATOM 1967 CB ARG A 118 12.677 -9.786 -6.020 1.00 0.49 C ATOM 1968 CG ARG A 118 11.374 -9.450 -5.322 1.00 0.49 C ATOM 1969 CD ARG A 118 10.351 -10.565 -5.464 1.00 0.58 C ATOM 1970 NE ARG A 118 9.912 -10.753 -6.848 1.00 0.84 N ATOM 1971 CZ ARG A 118 8.708 -11.218 -7.189 1.00 1.16 C ATOM 1972 NH1 ARG A 118 7.859 -11.631 -6.252 1.00 1.23 N ATOM 1973 NH2 ARG A 118 8.367 -11.298 -8.470 1.00 1.75 N ATOM 0 H ARG A 118 13.241 -10.294 -3.638 1.00 0.50 H new ATOM 0 HA ARG A 118 12.602 -11.919 -5.850 1.00 0.51 H new ATOM 0 HB2 ARG A 118 13.395 -8.987 -5.837 1.00 0.49 H new ATOM 0 HB3 ARG A 118 12.506 -9.821 -7.096 1.00 0.49 H new ATOM 0 HG2 ARG A 118 11.566 -9.266 -4.265 1.00 0.49 H new ATOM 0 HG3 ARG A 118 10.967 -8.528 -5.738 1.00 0.49 H new ATOM 0 HD2 ARG A 118 10.780 -11.496 -5.093 1.00 0.58 H new ATOM 0 HD3 ARG A 118 9.486 -10.341 -4.840 1.00 0.58 H new ATOM 0 HE ARG A 118 10.564 -10.515 -7.595 1.00 0.84 H new ATOM 0 HH11 ARG A 118 8.127 -11.593 -5.269 1.00 1.23 H new ATOM 0 HH12 ARG A 118 6.940 -11.986 -6.517 1.00 1.23 H new ATOM 0 HH21 ARG A 118 9.025 -11.004 -9.192 1.00 1.75 H new ATOM 0 HH22 ARG A 118 7.447 -11.653 -8.732 1.00 1.75 H new ATOM 1987 N ILE A 119 15.665 -10.727 -5.692 1.00 0.52 N ATOM 1988 CA ILE A 119 17.003 -10.853 -6.247 1.00 0.54 C ATOM 1989 C ILE A 119 17.581 -12.212 -5.884 1.00 0.58 C ATOM 1990 O ILE A 119 18.382 -12.784 -6.625 1.00 0.66 O ATOM 1991 CB ILE A 119 17.955 -9.765 -5.705 1.00 0.51 C ATOM 1992 CG1 ILE A 119 17.193 -8.471 -5.409 1.00 0.49 C ATOM 1993 CG2 ILE A 119 19.078 -9.503 -6.700 1.00 0.56 C ATOM 1994 CD1 ILE A 119 16.647 -7.780 -6.639 1.00 0.69 C ATOM 0 H ILE A 119 15.607 -10.148 -4.855 1.00 0.52 H new ATOM 0 HA ILE A 119 16.918 -10.739 -7.328 1.00 0.54 H new ATOM 0 HB ILE A 119 18.389 -10.125 -4.772 1.00 0.51 H new ATOM 0 HG12 ILE A 119 16.367 -8.695 -4.734 1.00 0.49 H new ATOM 0 HG13 ILE A 119 17.856 -7.784 -4.884 1.00 0.49 H new ATOM 0 HG21 ILE A 119 19.742 -8.734 -6.305 1.00 0.56 H new ATOM 0 HG22 ILE A 119 19.642 -10.421 -6.862 1.00 0.56 H new ATOM 0 HG23 ILE A 119 18.655 -9.166 -7.646 1.00 0.56 H new ATOM 0 HD11 ILE A 119 16.121 -6.872 -6.343 1.00 0.69 H new ATOM 0 HD12 ILE A 119 17.469 -7.522 -7.306 1.00 0.69 H new ATOM 0 HD13 ILE A 119 15.957 -8.447 -7.155 1.00 0.69 H new ATOM 2006 N GLY A 120 17.166 -12.720 -4.732 1.00 0.57 N ATOM 2007 CA GLY A 120 17.687 -13.976 -4.245 1.00 0.62 C ATOM 2008 C GLY A 120 18.756 -13.773 -3.194 1.00 0.64 C ATOM 2009 O GLY A 120 19.616 -14.627 -2.997 1.00 0.70 O ATOM 0 H GLY A 120 16.474 -12.280 -4.125 1.00 0.57 H new ATOM 0 HA2 GLY A 120 16.874 -14.569 -3.826 1.00 0.62 H new ATOM 0 HA3 GLY A 120 18.100 -14.545 -5.078 1.00 0.62 H new ATOM 2013 N ILE A 121 18.696 -12.632 -2.516 1.00 0.66 N ATOM 2014 CA ILE A 121 19.692 -12.278 -1.514 1.00 0.71 C ATOM 2015 C ILE A 121 19.501 -13.091 -0.236 1.00 0.82 C ATOM 2016 O ILE A 121 20.470 -13.439 0.433 1.00 1.54 O ATOM 2017 CB ILE A 121 19.633 -10.771 -1.179 1.00 0.63 C ATOM 2018 CG1 ILE A 121 19.927 -9.937 -2.428 1.00 0.59 C ATOM 2019 CG2 ILE A 121 20.617 -10.430 -0.070 1.00 0.67 C ATOM 2020 CD1 ILE A 121 19.818 -8.443 -2.208 1.00 0.56 C ATOM 0 H ILE A 121 17.964 -11.934 -2.644 1.00 0.66 H new ATOM 0 HA ILE A 121 20.670 -12.509 -1.937 1.00 0.71 H new ATOM 0 HB ILE A 121 18.628 -10.534 -0.831 1.00 0.63 H new ATOM 0 HG12 ILE A 121 20.932 -10.170 -2.780 1.00 0.59 H new ATOM 0 HG13 ILE A 121 19.236 -10.229 -3.219 1.00 0.59 H new ATOM 0 HG21 ILE A 121 20.560 -9.364 0.152 1.00 0.67 H new ATOM 0 HG22 ILE A 121 20.368 -11.000 0.825 1.00 0.67 H new ATOM 0 HG23 ILE A 121 21.628 -10.681 -0.391 1.00 0.67 H new ATOM 0 HD11 ILE A 121 20.041 -7.921 -3.139 1.00 0.56 H new ATOM 0 HD12 ILE A 121 18.806 -8.195 -1.886 1.00 0.56 H new ATOM 0 HD13 ILE A 121 20.528 -8.135 -1.441 1.00 0.56 H new ATOM 2032 N THR A 122 18.244 -13.388 0.082 1.00 0.96 N ATOM 2033 CA THR A 122 17.887 -14.141 1.285 1.00 1.00 C ATOM 2034 C THR A 122 18.062 -13.302 2.558 1.00 0.90 C ATOM 2035 O THR A 122 17.073 -12.935 3.198 1.00 1.04 O ATOM 2036 CB THR A 122 18.692 -15.456 1.401 1.00 1.18 C ATOM 2037 OG1 THR A 122 18.524 -16.232 0.205 1.00 1.55 O ATOM 2038 CG2 THR A 122 18.236 -16.274 2.602 1.00 1.65 C ATOM 0 H THR A 122 17.442 -13.114 -0.486 1.00 0.96 H new ATOM 0 HA THR A 122 16.831 -14.394 1.186 1.00 1.00 H new ATOM 0 HB THR A 122 19.743 -15.201 1.535 1.00 1.18 H new ATOM 0 HG1 THR A 122 19.036 -17.064 0.280 1.00 1.55 H new ATOM 0 HG21 THR A 122 18.819 -17.193 2.659 1.00 1.65 H new ATOM 0 HG22 THR A 122 18.382 -15.695 3.514 1.00 1.65 H new ATOM 0 HG23 THR A 122 17.180 -16.521 2.494 1.00 1.65 H new ATOM 2046 N ASN A 123 19.304 -12.983 2.920 1.00 0.91 N ATOM 2047 CA ASN A 123 19.558 -12.222 4.142 1.00 0.87 C ATOM 2048 C ASN A 123 19.317 -10.741 3.889 1.00 0.77 C ATOM 2049 O ASN A 123 20.192 -10.025 3.403 1.00 1.05 O ATOM 2050 CB ASN A 123 20.985 -12.444 4.657 1.00 1.10 C ATOM 2051 CG ASN A 123 21.141 -12.053 6.116 1.00 1.31 C ATOM 2052 OD1 ASN A 123 20.190 -12.113 6.895 1.00 2.13 O ATOM 2053 ND2 ASN A 123 22.340 -11.659 6.501 1.00 1.50 N ATOM 0 H ASN A 123 20.140 -13.236 2.393 1.00 0.91 H new ATOM 0 HA ASN A 123 18.869 -12.576 4.909 1.00 0.87 H new ATOM 0 HB2 ASN A 123 21.254 -13.493 4.534 1.00 1.10 H new ATOM 0 HB3 ASN A 123 21.681 -11.864 4.052 1.00 1.10 H new ATOM 0 HD21 ASN A 123 22.502 -11.392 7.472 1.00 1.50 H new ATOM 0 HD22 ASN A 123 23.105 -11.622 5.828 1.00 1.50 H new ATOM 2060 N HIS A 124 18.118 -10.295 4.218 1.00 0.61 N ATOM 2061 CA HIS A 124 17.692 -8.937 3.917 1.00 0.59 C ATOM 2062 C HIS A 124 17.855 -8.027 5.124 1.00 0.57 C ATOM 2063 O HIS A 124 17.713 -6.813 5.014 1.00 0.66 O ATOM 2064 CB HIS A 124 16.226 -8.922 3.462 1.00 0.63 C ATOM 2065 CG HIS A 124 15.261 -9.403 4.503 1.00 0.58 C ATOM 2066 ND1 HIS A 124 14.601 -8.560 5.371 1.00 0.55 N ATOM 2067 CD2 HIS A 124 14.852 -10.653 4.815 1.00 0.66 C ATOM 2068 CE1 HIS A 124 13.829 -9.273 6.170 1.00 0.57 C ATOM 2069 NE2 HIS A 124 13.965 -10.548 5.855 1.00 0.66 N ATOM 0 H HIS A 124 17.416 -10.858 4.698 1.00 0.61 H new ATOM 0 HA HIS A 124 18.326 -8.565 3.112 1.00 0.59 H new ATOM 0 HB2 HIS A 124 15.956 -7.906 3.173 1.00 0.63 H new ATOM 0 HB3 HIS A 124 16.126 -9.544 2.573 1.00 0.63 H new ATOM 0 HD1 HIS A 124 14.694 -7.545 5.393 1.00 0.55 H new ATOM 0 HD2 HIS A 124 15.166 -11.567 4.333 1.00 0.66 H new ATOM 0 HE1 HIS A 124 13.193 -8.880 6.950 1.00 0.57 H new ATOM 2078 N ASP A 125 18.144 -8.615 6.275 1.00 0.62 N ATOM 2079 CA ASP A 125 18.236 -7.853 7.508 1.00 0.72 C ATOM 2080 C ASP A 125 19.454 -6.941 7.494 1.00 0.64 C ATOM 2081 O ASP A 125 19.466 -5.907 8.152 1.00 0.66 O ATOM 2082 CB ASP A 125 18.282 -8.793 8.713 1.00 0.97 C ATOM 2083 CG ASP A 125 18.303 -8.049 10.034 1.00 1.54 C ATOM 2084 OD1 ASP A 125 17.346 -7.297 10.308 1.00 2.14 O ATOM 2085 OD2 ASP A 125 19.290 -8.196 10.791 1.00 2.11 O ATOM 0 H ASP A 125 18.318 -9.615 6.380 1.00 0.62 H new ATOM 0 HA ASP A 125 17.347 -7.227 7.589 1.00 0.72 H new ATOM 0 HB2 ASP A 125 17.416 -9.454 8.687 1.00 0.97 H new ATOM 0 HB3 ASP A 125 19.167 -9.425 8.642 1.00 0.97 H new ATOM 2090 N GLU A 126 20.456 -7.303 6.691 1.00 0.62 N ATOM 2091 CA GLU A 126 21.685 -6.518 6.601 1.00 0.62 C ATOM 2092 C GLU A 126 21.445 -5.193 5.884 1.00 0.52 C ATOM 2093 O GLU A 126 22.347 -4.365 5.781 1.00 0.61 O ATOM 2094 CB GLU A 126 22.784 -7.290 5.862 1.00 0.76 C ATOM 2095 CG GLU A 126 23.109 -8.645 6.464 1.00 1.19 C ATOM 2096 CD GLU A 126 24.397 -9.228 5.915 1.00 1.84 C ATOM 2097 OE1 GLU A 126 25.487 -8.773 6.329 1.00 2.27 O ATOM 2098 OE2 GLU A 126 24.325 -10.152 5.076 1.00 2.30 O ATOM 0 H GLU A 126 20.440 -8.132 6.096 1.00 0.62 H new ATOM 0 HA GLU A 126 22.008 -6.320 7.623 1.00 0.62 H new ATOM 0 HB2 GLU A 126 22.479 -7.430 4.825 1.00 0.76 H new ATOM 0 HB3 GLU A 126 23.690 -6.685 5.848 1.00 0.76 H new ATOM 0 HG2 GLU A 126 23.190 -8.549 7.547 1.00 1.19 H new ATOM 0 HG3 GLU A 126 22.288 -9.334 6.266 1.00 1.19 H new ATOM 2105 N TYR A 127 20.232 -4.986 5.397 1.00 0.43 N ATOM 2106 CA TYR A 127 19.935 -3.821 4.584 1.00 0.38 C ATOM 2107 C TYR A 127 18.942 -2.894 5.259 1.00 0.39 C ATOM 2108 O TYR A 127 18.122 -3.320 6.073 1.00 0.42 O ATOM 2109 CB TYR A 127 19.361 -4.251 3.237 1.00 0.36 C ATOM 2110 CG TYR A 127 20.241 -5.205 2.483 1.00 0.36 C ATOM 2111 CD1 TYR A 127 21.428 -4.776 1.913 1.00 0.38 C ATOM 2112 CD2 TYR A 127 19.889 -6.535 2.346 1.00 0.40 C ATOM 2113 CE1 TYR A 127 22.241 -5.647 1.226 1.00 0.41 C ATOM 2114 CE2 TYR A 127 20.695 -7.417 1.662 1.00 0.43 C ATOM 2115 CZ TYR A 127 21.859 -6.965 1.080 1.00 0.43 C ATOM 2116 OH TYR A 127 22.680 -7.847 0.417 1.00 0.49 O ATOM 0 H TYR A 127 19.439 -5.609 5.551 1.00 0.43 H new ATOM 0 HA TYR A 127 20.873 -3.284 4.445 1.00 0.38 H new ATOM 0 HB2 TYR A 127 18.389 -4.717 3.398 1.00 0.36 H new ATOM 0 HB3 TYR A 127 19.192 -3.365 2.625 1.00 0.36 H new ATOM 0 HD1 TYR A 127 21.720 -3.741 2.010 1.00 0.38 H new ATOM 0 HD2 TYR A 127 18.966 -6.888 2.783 1.00 0.40 H new ATOM 0 HE1 TYR A 127 23.173 -5.302 0.803 1.00 0.41 H new ATOM 0 HE2 TYR A 127 20.416 -8.457 1.582 1.00 0.43 H new ATOM 0 HH TYR A 127 22.555 -8.748 0.782 1.00 0.49 H new ATOM 2126 N SER A 128 19.030 -1.625 4.911 1.00 0.40 N ATOM 2127 CA SER A 128 18.014 -0.654 5.262 1.00 0.42 C ATOM 2128 C SER A 128 17.459 -0.057 3.981 1.00 0.41 C ATOM 2129 O SER A 128 17.986 -0.315 2.895 1.00 0.54 O ATOM 2130 CB SER A 128 18.586 0.445 6.158 1.00 0.47 C ATOM 2131 OG SER A 128 18.962 -0.071 7.421 1.00 1.13 O ATOM 0 H SER A 128 19.808 -1.239 4.377 1.00 0.40 H new ATOM 0 HA SER A 128 17.220 -1.148 5.821 1.00 0.42 H new ATOM 0 HB2 SER A 128 19.451 0.899 5.675 1.00 0.47 H new ATOM 0 HB3 SER A 128 17.845 1.233 6.290 1.00 0.47 H new ATOM 0 HG SER A 128 18.717 0.569 8.122 1.00 1.13 H new ATOM 2137 N LEU A 129 16.408 0.730 4.088 1.00 0.42 N ATOM 2138 CA LEU A 129 15.801 1.297 2.900 1.00 0.42 C ATOM 2139 C LEU A 129 16.057 2.793 2.870 1.00 0.43 C ATOM 2140 O LEU A 129 16.082 3.436 3.907 1.00 0.48 O ATOM 2141 CB LEU A 129 14.298 0.989 2.877 1.00 0.43 C ATOM 2142 CG LEU A 129 13.697 0.703 1.493 1.00 0.45 C ATOM 2143 CD1 LEU A 129 12.311 0.098 1.630 1.00 1.33 C ATOM 2144 CD2 LEU A 129 13.629 1.964 0.647 1.00 1.13 C ATOM 0 H LEU A 129 15.962 0.989 4.968 1.00 0.42 H new ATOM 0 HA LEU A 129 16.246 0.851 2.010 1.00 0.42 H new ATOM 0 HB2 LEU A 129 14.113 0.127 3.518 1.00 0.43 H new ATOM 0 HB3 LEU A 129 13.766 1.833 3.316 1.00 0.43 H new ATOM 0 HG LEU A 129 14.351 -0.010 0.991 1.00 0.45 H new ATOM 0 HD11 LEU A 129 11.900 -0.098 0.640 1.00 1.33 H new ATOM 0 HD12 LEU A 129 12.375 -0.836 2.188 1.00 1.33 H new ATOM 0 HD13 LEU A 129 11.661 0.794 2.161 1.00 1.33 H new ATOM 0 HD21 LEU A 129 13.199 1.727 -0.326 1.00 1.13 H new ATOM 0 HD22 LEU A 129 13.006 2.705 1.148 1.00 1.13 H new ATOM 0 HD23 LEU A 129 14.633 2.366 0.512 1.00 1.13 H new ATOM 2156 N VAL A 130 16.283 3.334 1.693 1.00 0.42 N ATOM 2157 CA VAL A 130 16.472 4.764 1.536 1.00 0.46 C ATOM 2158 C VAL A 130 15.696 5.250 0.319 1.00 0.46 C ATOM 2159 O VAL A 130 15.959 4.840 -0.813 1.00 0.45 O ATOM 2160 CB VAL A 130 17.978 5.126 1.440 1.00 0.48 C ATOM 2161 CG1 VAL A 130 18.728 4.083 0.651 1.00 0.49 C ATOM 2162 CG2 VAL A 130 18.199 6.495 0.821 1.00 0.60 C ATOM 0 H VAL A 130 16.341 2.803 0.824 1.00 0.42 H new ATOM 0 HA VAL A 130 16.084 5.272 2.419 1.00 0.46 H new ATOM 0 HB VAL A 130 18.362 5.154 2.460 1.00 0.48 H new ATOM 0 HG11 VAL A 130 19.782 4.356 0.596 1.00 0.49 H new ATOM 0 HG12 VAL A 130 18.629 3.115 1.142 1.00 0.49 H new ATOM 0 HG13 VAL A 130 18.316 4.023 -0.356 1.00 0.49 H new ATOM 0 HG21 VAL A 130 19.268 6.705 0.774 1.00 0.60 H new ATOM 0 HG22 VAL A 130 17.782 6.511 -0.186 1.00 0.60 H new ATOM 0 HG23 VAL A 130 17.706 7.253 1.430 1.00 0.60 H new ATOM 2172 N ARG A 131 14.709 6.093 0.566 1.00 0.48 N ATOM 2173 CA ARG A 131 13.835 6.560 -0.489 1.00 0.50 C ATOM 2174 C ARG A 131 14.233 7.957 -0.940 1.00 0.57 C ATOM 2175 O ARG A 131 13.915 8.950 -0.278 1.00 0.64 O ATOM 2176 CB ARG A 131 12.393 6.598 0.016 1.00 0.54 C ATOM 2177 CG ARG A 131 11.960 5.339 0.743 1.00 0.51 C ATOM 2178 CD ARG A 131 10.503 5.423 1.155 1.00 0.62 C ATOM 2179 NE ARG A 131 9.605 5.382 -0.002 1.00 0.96 N ATOM 2180 CZ ARG A 131 8.748 4.389 -0.248 1.00 1.65 C ATOM 2181 NH1 ARG A 131 8.701 3.335 0.558 1.00 2.18 N ATOM 2182 NH2 ARG A 131 7.943 4.449 -1.303 1.00 2.01 N ATOM 0 H ARG A 131 14.495 6.467 1.490 1.00 0.48 H new ATOM 0 HA ARG A 131 13.921 5.874 -1.332 1.00 0.50 H new ATOM 0 HB2 ARG A 131 12.276 7.450 0.685 1.00 0.54 H new ATOM 0 HB3 ARG A 131 11.727 6.764 -0.831 1.00 0.54 H new ATOM 0 HG2 ARG A 131 12.110 4.473 0.098 1.00 0.51 H new ATOM 0 HG3 ARG A 131 12.583 5.192 1.625 1.00 0.51 H new ATOM 0 HD2 ARG A 131 10.268 4.598 1.827 1.00 0.62 H new ATOM 0 HD3 ARG A 131 10.336 6.345 1.712 1.00 0.62 H new ATOM 0 HE ARG A 131 9.637 6.161 -0.660 1.00 0.96 H new ATOM 0 HH11 ARG A 131 9.320 3.283 1.367 1.00 2.18 H new ATOM 0 HH12 ARG A 131 8.045 2.577 0.369 1.00 2.18 H new ATOM 0 HH21 ARG A 131 7.979 5.255 -1.927 1.00 2.01 H new ATOM 0 HH22 ARG A 131 7.289 3.689 -1.489 1.00 2.01 H new ATOM 2196 N GLU A 132 14.907 8.038 -2.069 1.00 0.58 N ATOM 2197 CA GLU A 132 15.220 9.325 -2.649 1.00 0.66 C ATOM 2198 C GLU A 132 14.021 9.838 -3.417 1.00 0.73 C ATOM 2199 O GLU A 132 13.626 9.263 -4.442 1.00 0.74 O ATOM 2200 CB GLU A 132 16.443 9.245 -3.562 1.00 0.68 C ATOM 2201 CG GLU A 132 17.718 8.854 -2.839 1.00 0.64 C ATOM 2202 CD GLU A 132 18.959 9.180 -3.641 1.00 0.72 C ATOM 2203 OE1 GLU A 132 19.105 8.643 -4.757 1.00 0.90 O ATOM 2204 OE2 GLU A 132 19.794 9.977 -3.171 1.00 1.05 O ATOM 0 H GLU A 132 15.246 7.235 -2.598 1.00 0.58 H new ATOM 0 HA GLU A 132 15.459 10.017 -1.842 1.00 0.66 H new ATOM 0 HB2 GLU A 132 16.248 8.521 -4.354 1.00 0.68 H new ATOM 0 HB3 GLU A 132 16.590 10.212 -4.043 1.00 0.68 H new ATOM 0 HG2 GLU A 132 17.762 9.371 -1.880 1.00 0.64 H new ATOM 0 HG3 GLU A 132 17.698 7.786 -2.624 1.00 0.64 H new ATOM 2211 N LEU A 133 13.422 10.908 -2.918 1.00 0.80 N ATOM 2212 CA LEU A 133 12.210 11.415 -3.521 1.00 0.87 C ATOM 2213 C LEU A 133 12.465 12.711 -4.259 1.00 0.97 C ATOM 2214 O LEU A 133 13.572 13.250 -4.264 1.00 1.02 O ATOM 2215 CB LEU A 133 11.117 11.673 -2.484 1.00 0.92 C ATOM 2216 CG LEU A 133 10.963 10.637 -1.374 1.00 0.87 C ATOM 2217 CD1 LEU A 133 9.754 10.980 -0.530 1.00 0.97 C ATOM 2218 CD2 LEU A 133 10.831 9.232 -1.936 1.00 0.80 C ATOM 0 H LEU A 133 13.753 11.433 -2.108 1.00 0.80 H new ATOM 0 HA LEU A 133 11.876 10.644 -4.216 1.00 0.87 H new ATOM 0 HB2 LEU A 133 11.310 12.641 -2.021 1.00 0.92 H new ATOM 0 HB3 LEU A 133 10.164 11.754 -3.008 1.00 0.92 H new ATOM 0 HG LEU A 133 11.861 10.659 -0.756 1.00 0.87 H new ATOM 0 HD11 LEU A 133 9.643 10.241 0.263 1.00 0.97 H new ATOM 0 HD12 LEU A 133 9.886 11.968 -0.089 1.00 0.97 H new ATOM 0 HD13 LEU A 133 8.861 10.978 -1.155 1.00 0.97 H new ATOM 0 HD21 LEU A 133 10.723 8.521 -1.117 1.00 0.80 H new ATOM 0 HD22 LEU A 133 9.954 9.179 -2.580 1.00 0.80 H new ATOM 0 HD23 LEU A 133 11.721 8.986 -2.515 1.00 0.80 H new ATOM 2230 N MET A 134 11.402 13.204 -4.851 1.00 1.04 N ATOM 2231 CA MET A 134 11.406 14.467 -5.562 1.00 1.15 C ATOM 2232 C MET A 134 10.728 15.531 -4.711 1.00 1.22 C ATOM 2233 O MET A 134 10.732 16.714 -5.056 1.00 1.29 O ATOM 2234 CB MET A 134 10.641 14.294 -6.871 1.00 1.27 C ATOM 2235 CG MET A 134 9.209 13.836 -6.644 1.00 1.36 C ATOM 2236 SD MET A 134 8.063 15.208 -6.382 1.00 1.80 S ATOM 2237 CE MET A 134 6.604 14.331 -5.827 1.00 2.03 C ATOM 0 H MET A 134 10.496 12.735 -4.854 1.00 1.04 H new ATOM 0 HA MET A 134 12.431 14.775 -5.769 1.00 1.15 H new ATOM 0 HB2 MET A 134 10.636 15.239 -7.415 1.00 1.27 H new ATOM 0 HB3 MET A 134 11.158 13.568 -7.498 1.00 1.27 H new ATOM 0 HG2 MET A 134 8.879 13.253 -7.504 1.00 1.36 H new ATOM 0 HG3 MET A 134 9.178 13.173 -5.779 1.00 1.36 H new ATOM 0 HE1 MET A 134 5.898 15.038 -5.391 1.00 2.03 H new ATOM 0 HE2 MET A 134 6.138 13.828 -6.674 1.00 2.03 H new ATOM 0 HE3 MET A 134 6.887 13.592 -5.077 1.00 2.03 H new ATOM 2247 N GLU A 135 10.146 15.080 -3.599 1.00 1.27 N ATOM 2248 CA GLU A 135 9.306 15.912 -2.754 1.00 1.39 C ATOM 2249 C GLU A 135 9.981 17.217 -2.375 1.00 1.41 C ATOM 2250 O GLU A 135 11.097 17.220 -1.869 1.00 1.45 O ATOM 2251 CB GLU A 135 8.929 15.155 -1.489 1.00 1.48 C ATOM 2252 CG GLU A 135 7.843 14.119 -1.705 1.00 1.58 C ATOM 2253 CD GLU A 135 7.053 13.843 -0.441 1.00 1.83 C ATOM 2254 OE1 GLU A 135 6.265 14.718 -0.032 1.00 2.04 O ATOM 2255 OE2 GLU A 135 7.231 12.768 0.163 1.00 2.29 O ATOM 0 H GLU A 135 10.248 14.122 -3.263 1.00 1.27 H new ATOM 0 HA GLU A 135 8.413 16.154 -3.330 1.00 1.39 H new ATOM 0 HB2 GLU A 135 9.816 14.662 -1.092 1.00 1.48 H new ATOM 0 HB3 GLU A 135 8.596 15.867 -0.734 1.00 1.48 H new ATOM 0 HG2 GLU A 135 7.166 14.463 -2.487 1.00 1.58 H new ATOM 0 HG3 GLU A 135 8.293 13.192 -2.059 1.00 1.58 H new ATOM 2262 N GLU A 136 9.287 18.322 -2.619 1.00 1.46 N ATOM 2263 CA GLU A 136 9.759 19.634 -2.201 1.00 1.52 C ATOM 2264 C GLU A 136 9.839 19.693 -0.678 1.00 1.52 C ATOM 2265 O GLU A 136 10.578 20.498 -0.111 1.00 1.59 O ATOM 2266 CB GLU A 136 8.821 20.729 -2.722 1.00 1.67 C ATOM 2267 CG GLU A 136 7.422 20.660 -2.131 1.00 1.73 C ATOM 2268 CD GLU A 136 6.476 21.678 -2.725 1.00 1.93 C ATOM 2269 OE1 GLU A 136 6.769 22.890 -2.642 1.00 2.12 O ATOM 2270 OE2 GLU A 136 5.441 21.275 -3.292 1.00 1.99 O ATOM 0 H GLU A 136 8.391 18.334 -3.107 1.00 1.46 H new ATOM 0 HA GLU A 136 10.752 19.801 -2.618 1.00 1.52 H new ATOM 0 HB2 GLU A 136 9.254 21.704 -2.498 1.00 1.67 H new ATOM 0 HB3 GLU A 136 8.753 20.652 -3.807 1.00 1.67 H new ATOM 0 HG2 GLU A 136 7.016 19.661 -2.289 1.00 1.73 H new ATOM 0 HG3 GLU A 136 7.481 20.813 -1.053 1.00 1.73 H new ATOM 2277 N LYS A 137 9.064 18.825 -0.035 1.00 1.53 N ATOM 2278 CA LYS A 137 9.039 18.730 1.415 1.00 1.61 C ATOM 2279 C LYS A 137 10.318 18.069 1.912 1.00 1.55 C ATOM 2280 O LYS A 137 11.198 18.726 2.467 1.00 1.63 O ATOM 2281 CB LYS A 137 7.830 17.908 1.872 1.00 1.72 C ATOM 2282 CG LYS A 137 6.563 18.169 1.071 1.00 1.83 C ATOM 2283 CD LYS A 137 5.406 17.336 1.592 1.00 2.14 C ATOM 2284 CE LYS A 137 4.224 17.343 0.635 1.00 2.31 C ATOM 2285 NZ LYS A 137 4.541 16.658 -0.645 1.00 2.98 N ATOM 0 H LYS A 137 8.439 18.171 -0.506 1.00 1.53 H new ATOM 0 HA LYS A 137 8.964 19.735 1.829 1.00 1.61 H new ATOM 0 HB2 LYS A 137 8.078 16.849 1.805 1.00 1.72 H new ATOM 0 HB3 LYS A 137 7.634 18.123 2.922 1.00 1.72 H new ATOM 0 HG2 LYS A 137 6.307 19.227 1.125 1.00 1.83 H new ATOM 0 HG3 LYS A 137 6.739 17.936 0.021 1.00 1.83 H new ATOM 0 HD2 LYS A 137 5.739 16.310 1.749 1.00 2.14 H new ATOM 0 HD3 LYS A 137 5.090 17.721 2.562 1.00 2.14 H new ATOM 0 HE2 LYS A 137 3.372 16.853 1.107 1.00 2.31 H new ATOM 0 HE3 LYS A 137 3.928 18.372 0.432 1.00 2.31 H new ATOM 0 HZ1 LYS A 137 3.704 16.136 -0.976 1.00 2.98 H new ATOM 0 HZ2 LYS A 137 4.813 17.364 -1.358 1.00 2.98 H new ATOM 0 HZ3 LYS A 137 5.328 15.994 -0.498 1.00 2.98 H new ATOM 2299 N LYS A 138 10.411 16.757 1.706 1.00 1.47 N ATOM 2300 CA LYS A 138 11.606 16.005 2.067 1.00 1.45 C ATOM 2301 C LYS A 138 12.817 16.460 1.274 1.00 1.34 C ATOM 2302 O LYS A 138 13.698 17.141 1.796 1.00 1.43 O ATOM 2303 CB LYS A 138 11.424 14.516 1.807 1.00 1.48 C ATOM 2304 CG LYS A 138 10.558 13.801 2.813 1.00 1.52 C ATOM 2305 CD LYS A 138 9.097 13.829 2.419 1.00 1.58 C ATOM 2306 CE LYS A 138 8.275 12.900 3.291 1.00 1.42 C ATOM 2307 NZ LYS A 138 6.879 12.779 2.805 1.00 1.76 N ATOM 0 H LYS A 138 9.670 16.193 1.290 1.00 1.47 H new ATOM 0 HA LYS A 138 11.766 16.188 3.130 1.00 1.45 H new ATOM 0 HB2 LYS A 138 10.990 14.385 0.816 1.00 1.48 H new ATOM 0 HB3 LYS A 138 12.405 14.042 1.790 1.00 1.48 H new ATOM 0 HG2 LYS A 138 10.889 12.767 2.907 1.00 1.52 H new ATOM 0 HG3 LYS A 138 10.679 14.265 3.792 1.00 1.52 H new ATOM 0 HD2 LYS A 138 8.714 14.846 2.505 1.00 1.58 H new ATOM 0 HD3 LYS A 138 8.994 13.537 1.374 1.00 1.58 H new ATOM 0 HE2 LYS A 138 8.740 11.914 3.311 1.00 1.42 H new ATOM 0 HE3 LYS A 138 8.272 13.271 4.316 1.00 1.42 H new ATOM 0 HZ1 LYS A 138 6.408 11.991 3.294 1.00 1.76 H new ATOM 0 HZ2 LYS A 138 6.366 13.663 2.999 1.00 1.76 H new ATOM 0 HZ3 LYS A 138 6.882 12.598 1.781 1.00 1.76 H new ATOM 2321 N ASP A 169 12.835 16.060 0.002 1.00 1.23 N ATOM 2322 CA ASP A 169 14.012 16.185 -0.860 1.00 1.18 C ATOM 2323 C ASP A 169 15.231 15.584 -0.171 1.00 1.11 C ATOM 2324 O ASP A 169 16.370 16.002 -0.373 1.00 1.30 O ATOM 2325 CB ASP A 169 14.256 17.646 -1.255 1.00 1.35 C ATOM 2326 CG ASP A 169 15.319 17.789 -2.328 1.00 1.44 C ATOM 2327 OD1 ASP A 169 15.242 17.070 -3.347 1.00 1.48 O ATOM 2328 OD2 ASP A 169 16.227 18.635 -2.166 1.00 1.59 O ATOM 0 H ASP A 169 12.030 15.638 -0.462 1.00 1.23 H new ATOM 0 HA ASP A 169 13.830 15.629 -1.780 1.00 1.18 H new ATOM 0 HB2 ASP A 169 13.323 18.083 -1.612 1.00 1.35 H new ATOM 0 HB3 ASP A 169 14.556 18.212 -0.373 1.00 1.35 H new ATOM 2333 N GLU A 170 14.967 14.569 0.627 1.00 0.96 N ATOM 2334 CA GLU A 170 15.998 13.889 1.367 1.00 0.90 C ATOM 2335 C GLU A 170 16.108 12.446 0.904 1.00 0.78 C ATOM 2336 O GLU A 170 15.441 12.031 -0.059 1.00 0.77 O ATOM 2337 CB GLU A 170 15.697 13.952 2.865 1.00 0.98 C ATOM 2338 CG GLU A 170 14.371 13.318 3.250 1.00 1.24 C ATOM 2339 CD GLU A 170 14.132 13.337 4.743 1.00 1.90 C ATOM 2340 OE1 GLU A 170 14.554 12.383 5.428 1.00 2.27 O ATOM 2341 OE2 GLU A 170 13.523 14.307 5.244 1.00 2.57 O ATOM 0 H GLU A 170 14.030 14.196 0.777 1.00 0.96 H new ATOM 0 HA GLU A 170 16.952 14.384 1.184 1.00 0.90 H new ATOM 0 HB2 GLU A 170 16.499 13.453 3.409 1.00 0.98 H new ATOM 0 HB3 GLU A 170 15.697 14.995 3.183 1.00 0.98 H new ATOM 0 HG2 GLU A 170 13.560 13.847 2.749 1.00 1.24 H new ATOM 0 HG3 GLU A 170 14.348 12.288 2.895 1.00 1.24 H new ATOM 2348 N LEU A 171 16.934 11.689 1.602 1.00 0.73 N ATOM 2349 CA LEU A 171 17.201 10.313 1.245 1.00 0.67 C ATOM 2350 C LEU A 171 16.146 9.398 1.825 1.00 0.62 C ATOM 2351 O LEU A 171 15.971 8.292 1.354 1.00 0.57 O ATOM 2352 CB LEU A 171 18.575 9.900 1.765 1.00 0.71 C ATOM 2353 CG LEU A 171 19.697 10.876 1.436 1.00 0.77 C ATOM 2354 CD1 LEU A 171 21.023 10.372 1.980 1.00 0.86 C ATOM 2355 CD2 LEU A 171 19.776 11.100 -0.064 1.00 0.74 C ATOM 0 H LEU A 171 17.436 12.012 2.429 1.00 0.73 H new ATOM 0 HA LEU A 171 17.181 10.228 0.158 1.00 0.67 H new ATOM 0 HB2 LEU A 171 18.519 9.782 2.847 1.00 0.71 H new ATOM 0 HB3 LEU A 171 18.827 8.924 1.351 1.00 0.71 H new ATOM 0 HG LEU A 171 19.479 11.831 1.915 1.00 0.77 H new ATOM 0 HD11 LEU A 171 21.811 11.084 1.734 1.00 0.86 H new ATOM 0 HD12 LEU A 171 20.955 10.265 3.063 1.00 0.86 H new ATOM 0 HD13 LEU A 171 21.255 9.405 1.534 1.00 0.86 H new ATOM 0 HD21 LEU A 171 20.582 11.800 -0.285 1.00 0.74 H new ATOM 0 HD22 LEU A 171 19.971 10.151 -0.564 1.00 0.74 H new ATOM 0 HD23 LEU A 171 18.831 11.510 -0.421 1.00 0.74 H new ATOM 2367 N ASN A 172 15.462 9.868 2.859 1.00 0.65 N ATOM 2368 CA ASN A 172 14.444 9.080 3.551 1.00 0.63 C ATOM 2369 C ASN A 172 14.965 7.692 3.879 1.00 0.57 C ATOM 2370 O ASN A 172 14.604 6.712 3.221 1.00 0.53 O ATOM 2371 CB ASN A 172 13.153 8.950 2.735 1.00 0.65 C ATOM 2372 CG ASN A 172 12.423 10.259 2.548 1.00 0.75 C ATOM 2373 OD1 ASN A 172 11.784 10.767 3.466 1.00 0.90 O ATOM 2374 ND2 ASN A 172 12.459 10.780 1.337 1.00 0.80 N ATOM 0 H ASN A 172 15.594 10.804 3.243 1.00 0.65 H new ATOM 0 HA ASN A 172 14.214 9.616 4.472 1.00 0.63 H new ATOM 0 HB2 ASN A 172 13.392 8.533 1.756 1.00 0.65 H new ATOM 0 HB3 ASN A 172 12.490 8.241 3.230 1.00 0.65 H new ATOM 0 HD21 ASN A 172 11.944 11.637 1.135 1.00 0.80 H new ATOM 0 HD22 ASN A 172 13.002 10.326 0.603 1.00 0.80 H new ATOM 2381 N TRP A 173 15.794 7.590 4.902 1.00 0.58 N ATOM 2382 CA TRP A 173 16.352 6.312 5.280 1.00 0.55 C ATOM 2383 C TRP A 173 15.376 5.612 6.210 1.00 0.54 C ATOM 2384 O TRP A 173 15.230 5.998 7.370 1.00 0.61 O ATOM 2385 CB TRP A 173 17.701 6.496 5.979 1.00 0.60 C ATOM 2386 CG TRP A 173 18.873 6.579 5.051 1.00 0.63 C ATOM 2387 CD1 TRP A 173 19.272 7.660 4.320 1.00 0.72 C ATOM 2388 CD2 TRP A 173 19.815 5.537 4.774 1.00 0.64 C ATOM 2389 NE1 TRP A 173 20.398 7.354 3.601 1.00 0.78 N ATOM 2390 CE2 TRP A 173 20.752 6.055 3.862 1.00 0.73 C ATOM 2391 CE3 TRP A 173 19.954 4.216 5.206 1.00 0.65 C ATOM 2392 CZ2 TRP A 173 21.815 5.298 3.376 1.00 0.80 C ATOM 2393 CZ3 TRP A 173 21.009 3.466 4.724 1.00 0.73 C ATOM 2394 CH2 TRP A 173 21.928 4.009 3.818 1.00 0.79 C ATOM 0 H TRP A 173 16.092 8.375 5.481 1.00 0.58 H new ATOM 0 HA TRP A 173 16.515 5.710 4.386 1.00 0.55 H new ATOM 0 HB2 TRP A 173 17.664 7.405 6.580 1.00 0.60 H new ATOM 0 HB3 TRP A 173 17.856 5.665 6.667 1.00 0.60 H new ATOM 0 HD1 TRP A 173 18.773 8.618 4.310 1.00 0.72 H new ATOM 0 HE1 TRP A 173 20.892 7.989 2.974 1.00 0.78 H new ATOM 0 HE3 TRP A 173 19.249 3.789 5.904 1.00 0.65 H new ATOM 0 HZ2 TRP A 173 22.524 5.714 2.676 1.00 0.80 H new ATOM 0 HZ3 TRP A 173 21.127 2.444 5.051 1.00 0.73 H new ATOM 0 HH2 TRP A 173 22.743 3.397 3.461 1.00 0.79 H new ATOM 2405 N LEU A 174 14.685 4.615 5.693 1.00 0.49 N ATOM 2406 CA LEU A 174 13.701 3.889 6.469 1.00 0.49 C ATOM 2407 C LEU A 174 14.382 3.067 7.545 1.00 0.53 C ATOM 2408 O LEU A 174 15.166 2.155 7.246 1.00 0.56 O ATOM 2409 CB LEU A 174 12.857 2.975 5.589 1.00 0.48 C ATOM 2410 CG LEU A 174 12.089 3.652 4.456 1.00 0.50 C ATOM 2411 CD1 LEU A 174 11.014 2.707 3.947 1.00 0.52 C ATOM 2412 CD2 LEU A 174 11.482 4.971 4.912 1.00 0.54 C ATOM 0 H LEU A 174 14.789 4.288 4.732 1.00 0.49 H new ATOM 0 HA LEU A 174 13.042 4.624 6.931 1.00 0.49 H new ATOM 0 HB2 LEU A 174 13.510 2.218 5.156 1.00 0.48 H new ATOM 0 HB3 LEU A 174 12.141 2.453 6.224 1.00 0.48 H new ATOM 0 HG LEU A 174 12.781 3.880 3.646 1.00 0.50 H new ATOM 0 HD11 LEU A 174 10.462 3.185 3.138 1.00 0.52 H new ATOM 0 HD12 LEU A 174 11.478 1.792 3.578 1.00 0.52 H new ATOM 0 HD13 LEU A 174 10.329 2.464 4.759 1.00 0.52 H new ATOM 0 HD21 LEU A 174 10.942 5.429 4.083 1.00 0.54 H new ATOM 0 HD22 LEU A 174 10.794 4.789 5.737 1.00 0.54 H new ATOM 0 HD23 LEU A 174 12.275 5.642 5.243 1.00 0.54 H new ATOM 2424 N ASP A 175 14.035 3.371 8.788 1.00 0.61 N ATOM 2425 CA ASP A 175 14.706 2.806 9.959 1.00 0.72 C ATOM 2426 C ASP A 175 14.119 1.454 10.336 1.00 0.68 C ATOM 2427 O ASP A 175 14.326 0.968 11.446 1.00 0.75 O ATOM 2428 CB ASP A 175 14.578 3.755 11.156 1.00 0.93 C ATOM 2429 CG ASP A 175 14.947 5.184 10.823 1.00 1.83 C ATOM 2430 OD1 ASP A 175 16.151 5.515 10.843 1.00 2.37 O ATOM 2431 OD2 ASP A 175 14.029 5.981 10.535 1.00 2.56 O ATOM 0 H ASP A 175 13.280 4.017 9.017 1.00 0.61 H new ATOM 0 HA ASP A 175 15.757 2.674 9.700 1.00 0.72 H new ATOM 0 HB2 ASP A 175 13.553 3.728 11.526 1.00 0.93 H new ATOM 0 HB3 ASP A 175 15.218 3.400 11.964 1.00 0.93 H new ATOM 2436 N HIS A 176 13.376 0.859 9.406 1.00 0.66 N ATOM 2437 CA HIS A 176 12.713 -0.427 9.635 1.00 0.71 C ATOM 2438 C HIS A 176 11.645 -0.322 10.716 1.00 0.83 C ATOM 2439 O HIS A 176 11.170 -1.328 11.232 1.00 1.10 O ATOM 2440 CB HIS A 176 13.730 -1.519 9.984 1.00 0.71 C ATOM 2441 CG HIS A 176 14.459 -2.031 8.788 1.00 0.69 C ATOM 2442 ND1 HIS A 176 13.921 -2.964 7.940 1.00 0.77 N ATOM 2443 CD2 HIS A 176 15.663 -1.704 8.270 1.00 0.67 C ATOM 2444 CE1 HIS A 176 14.753 -3.183 6.943 1.00 0.76 C ATOM 2445 NE2 HIS A 176 15.827 -2.435 7.119 1.00 0.69 N ATOM 0 H HIS A 176 13.216 1.250 8.478 1.00 0.66 H new ATOM 0 HA HIS A 176 12.219 -0.706 8.705 1.00 0.71 H new ATOM 0 HB2 HIS A 176 14.449 -1.124 10.701 1.00 0.71 H new ATOM 0 HB3 HIS A 176 13.215 -2.346 10.472 1.00 0.71 H new ATOM 0 HD2 HIS A 176 16.367 -0.998 8.685 1.00 0.67 H new ATOM 0 HE1 HIS A 176 14.585 -3.861 6.119 1.00 0.76 H new ATOM 0 HE2 HIS A 176 16.640 -2.405 6.504 1.00 0.69 H new ATOM 2454 N GLY A 177 11.239 0.901 11.012 1.00 0.82 N ATOM 2455 CA GLY A 177 10.230 1.126 12.029 1.00 0.96 C ATOM 2456 C GLY A 177 9.272 2.211 11.608 1.00 1.00 C ATOM 2457 O GLY A 177 8.601 2.827 12.433 1.00 1.34 O ATOM 0 H GLY A 177 11.591 1.748 10.565 1.00 0.82 H new ATOM 0 HA2 GLY A 177 9.681 0.202 12.213 1.00 0.96 H new ATOM 0 HA3 GLY A 177 10.710 1.404 12.967 1.00 0.96 H new ATOM 2461 N ARG A 178 9.217 2.439 10.307 1.00 0.90 N ATOM 2462 CA ARG A 178 8.401 3.495 9.740 1.00 0.99 C ATOM 2463 C ARG A 178 7.533 2.937 8.621 1.00 0.87 C ATOM 2464 O ARG A 178 8.054 2.366 7.661 1.00 0.86 O ATOM 2465 CB ARG A 178 9.318 4.594 9.194 1.00 1.22 C ATOM 2466 CG ARG A 178 8.597 5.863 8.783 1.00 1.27 C ATOM 2467 CD ARG A 178 7.984 6.561 9.983 1.00 1.18 C ATOM 2468 NE ARG A 178 8.958 6.764 11.050 1.00 1.23 N ATOM 2469 CZ ARG A 178 8.640 6.936 12.333 1.00 1.74 C ATOM 2470 NH1 ARG A 178 7.369 6.940 12.716 1.00 2.16 N ATOM 2471 NH2 ARG A 178 9.601 7.089 13.236 1.00 2.18 N ATOM 0 H ARG A 178 9.736 1.897 9.616 1.00 0.90 H new ATOM 0 HA ARG A 178 7.751 3.910 10.510 1.00 0.99 H new ATOM 0 HB2 ARG A 178 10.060 4.842 9.953 1.00 1.22 H new ATOM 0 HB3 ARG A 178 9.861 4.203 8.333 1.00 1.22 H new ATOM 0 HG2 ARG A 178 9.295 6.536 8.286 1.00 1.27 H new ATOM 0 HG3 ARG A 178 7.816 5.623 8.061 1.00 1.27 H new ATOM 0 HD2 ARG A 178 7.578 7.524 9.674 1.00 1.18 H new ATOM 0 HD3 ARG A 178 7.150 5.969 10.360 1.00 1.18 H new ATOM 0 HE ARG A 178 9.946 6.775 10.798 1.00 1.23 H new ATOM 0 HH11 ARG A 178 6.628 6.811 12.027 1.00 2.16 H new ATOM 0 HH12 ARG A 178 7.133 7.072 13.700 1.00 2.16 H new ATOM 0 HH21 ARG A 178 10.579 7.075 12.947 1.00 2.18 H new ATOM 0 HH22 ARG A 178 9.361 7.221 14.219 1.00 2.18 H new ATOM 2485 N THR A 179 6.222 3.082 8.739 1.00 0.91 N ATOM 2486 CA THR A 179 5.330 2.634 7.681 1.00 0.89 C ATOM 2487 C THR A 179 5.269 3.675 6.574 1.00 0.86 C ATOM 2488 O THR A 179 5.480 4.864 6.807 1.00 0.91 O ATOM 2489 CB THR A 179 3.904 2.303 8.188 1.00 1.05 C ATOM 2490 OG1 THR A 179 2.995 2.201 7.085 1.00 1.20 O ATOM 2491 CG2 THR A 179 3.400 3.347 9.168 1.00 1.11 C ATOM 0 H THR A 179 5.757 3.500 9.545 1.00 0.91 H new ATOM 0 HA THR A 179 5.745 1.704 7.291 1.00 0.89 H new ATOM 0 HB THR A 179 3.957 1.347 8.708 1.00 1.05 H new ATOM 0 HG1 THR A 179 2.098 1.990 7.419 1.00 1.20 H new ATOM 0 HG21 THR A 179 2.397 3.080 9.501 1.00 1.11 H new ATOM 0 HG22 THR A 179 4.068 3.391 10.028 1.00 1.11 H new ATOM 0 HG23 THR A 179 3.373 4.321 8.680 1.00 1.11 H new ATOM 2499 N LEU A 180 4.984 3.215 5.374 1.00 0.84 N ATOM 2500 CA LEU A 180 5.031 4.052 4.187 1.00 0.84 C ATOM 2501 C LEU A 180 3.872 5.036 4.183 1.00 0.93 C ATOM 2502 O LEU A 180 3.961 6.132 3.622 1.00 0.97 O ATOM 2503 CB LEU A 180 4.982 3.151 2.955 1.00 0.85 C ATOM 2504 CG LEU A 180 5.844 1.892 3.080 1.00 0.83 C ATOM 2505 CD1 LEU A 180 5.719 1.019 1.845 1.00 1.08 C ATOM 2506 CD2 LEU A 180 7.294 2.266 3.333 1.00 0.90 C ATOM 0 H LEU A 180 4.712 2.249 5.191 1.00 0.84 H new ATOM 0 HA LEU A 180 5.954 4.631 4.179 1.00 0.84 H new ATOM 0 HB2 LEU A 180 3.949 2.857 2.772 1.00 0.85 H new ATOM 0 HB3 LEU A 180 5.310 3.721 2.086 1.00 0.85 H new ATOM 0 HG LEU A 180 5.483 1.316 3.932 1.00 0.83 H new ATOM 0 HD11 LEU A 180 6.342 0.132 1.962 1.00 1.08 H new ATOM 0 HD12 LEU A 180 4.679 0.718 1.716 1.00 1.08 H new ATOM 0 HD13 LEU A 180 6.046 1.579 0.969 1.00 1.08 H new ATOM 0 HD21 LEU A 180 7.894 1.360 3.419 1.00 0.90 H new ATOM 0 HD22 LEU A 180 7.664 2.869 2.504 1.00 0.90 H new ATOM 0 HD23 LEU A 180 7.366 2.838 4.258 1.00 0.90 H new ATOM 2518 N ARG A 181 2.805 4.650 4.861 1.00 1.02 N ATOM 2519 CA ARG A 181 1.581 5.428 4.879 1.00 1.13 C ATOM 2520 C ARG A 181 1.703 6.630 5.814 1.00 1.18 C ATOM 2521 O ARG A 181 0.967 7.609 5.684 1.00 1.36 O ATOM 2522 CB ARG A 181 0.415 4.522 5.290 1.00 1.22 C ATOM 2523 CG ARG A 181 -0.962 5.128 5.077 1.00 1.15 C ATOM 2524 CD ARG A 181 -1.057 5.861 3.749 1.00 0.69 C ATOM 2525 NE ARG A 181 -0.459 5.109 2.642 1.00 1.10 N ATOM 2526 CZ ARG A 181 -0.174 5.650 1.462 1.00 2.02 C ATOM 2527 NH1 ARG A 181 -0.515 6.907 1.217 1.00 2.54 N ATOM 2528 NH2 ARG A 181 0.446 4.939 0.532 1.00 2.64 N ATOM 0 H ARG A 181 2.764 3.792 5.412 1.00 1.02 H new ATOM 0 HA ARG A 181 1.393 5.820 3.880 1.00 1.13 H new ATOM 0 HB2 ARG A 181 0.479 3.591 4.726 1.00 1.22 H new ATOM 0 HB3 ARG A 181 0.526 4.265 6.343 1.00 1.22 H new ATOM 0 HG2 ARG A 181 -1.715 4.341 5.112 1.00 1.15 H new ATOM 0 HG3 ARG A 181 -1.185 5.819 5.890 1.00 1.15 H new ATOM 0 HD2 ARG A 181 -2.105 6.060 3.523 1.00 0.69 H new ATOM 0 HD3 ARG A 181 -0.560 6.827 3.836 1.00 0.69 H new ATOM 0 HE ARG A 181 -0.251 4.121 2.784 1.00 1.10 H new ATOM 0 HH11 ARG A 181 -0.994 7.454 1.932 1.00 2.54 H new ATOM 0 HH12 ARG A 181 -0.299 7.327 0.313 1.00 2.54 H new ATOM 0 HH21 ARG A 181 0.707 3.971 0.720 1.00 2.64 H new ATOM 0 HH22 ARG A 181 0.662 5.359 -0.372 1.00 2.64 H new ATOM 2542 N GLU A 182 2.647 6.564 6.744 1.00 1.11 N ATOM 2543 CA GLU A 182 2.867 7.665 7.670 1.00 1.18 C ATOM 2544 C GLU A 182 3.992 8.559 7.155 1.00 1.16 C ATOM 2545 O GLU A 182 4.200 9.669 7.647 1.00 1.25 O ATOM 2546 CB GLU A 182 3.190 7.138 9.072 1.00 1.25 C ATOM 2547 CG GLU A 182 4.598 6.589 9.216 1.00 1.34 C ATOM 2548 CD GLU A 182 4.896 6.089 10.615 1.00 1.89 C ATOM 2549 OE1 GLU A 182 4.663 6.842 11.585 1.00 2.31 O ATOM 2550 OE2 GLU A 182 5.397 4.955 10.752 1.00 2.30 O ATOM 0 H GLU A 182 3.268 5.766 6.876 1.00 1.11 H new ATOM 0 HA GLU A 182 1.953 8.255 7.737 1.00 1.18 H new ATOM 0 HB2 GLU A 182 3.050 7.943 9.793 1.00 1.25 H new ATOM 0 HB3 GLU A 182 2.477 6.354 9.327 1.00 1.25 H new ATOM 0 HG2 GLU A 182 4.739 5.774 8.507 1.00 1.34 H new ATOM 0 HG3 GLU A 182 5.315 7.367 8.953 1.00 1.34 H new ATOM 2557 N GLN A 183 4.714 8.063 6.155 1.00 1.07 N ATOM 2558 CA GLN A 183 5.776 8.830 5.519 1.00 1.06 C ATOM 2559 C GLN A 183 5.182 9.839 4.554 1.00 1.13 C ATOM 2560 O GLN A 183 5.646 10.974 4.450 1.00 1.22 O ATOM 2561 CB GLN A 183 6.720 7.913 4.750 1.00 1.00 C ATOM 2562 CG GLN A 183 7.436 6.905 5.619 1.00 1.00 C ATOM 2563 CD GLN A 183 8.223 5.906 4.803 1.00 1.04 C ATOM 2564 OE1 GLN A 183 8.697 6.210 3.711 1.00 1.65 O ATOM 2565 NE2 GLN A 183 8.362 4.700 5.319 1.00 0.81 N ATOM 0 H GLN A 183 4.581 7.129 5.767 1.00 1.07 H new ATOM 0 HA GLN A 183 6.333 9.345 6.301 1.00 1.06 H new ATOM 0 HB2 GLN A 183 6.153 7.382 3.986 1.00 1.00 H new ATOM 0 HB3 GLN A 183 7.460 8.522 4.231 1.00 1.00 H new ATOM 0 HG2 GLN A 183 8.109 7.427 6.299 1.00 1.00 H new ATOM 0 HG3 GLN A 183 6.708 6.376 6.234 1.00 1.00 H new ATOM 0 HE21 GLN A 183 7.954 4.484 6.229 1.00 0.81 H new ATOM 0 HE22 GLN A 183 8.877 3.983 4.808 1.00 0.81 H new ATOM 2574 N GLY A 184 4.149 9.411 3.843 1.00 1.16 N ATOM 2575 CA GLY A 184 3.531 10.261 2.851 1.00 1.28 C ATOM 2576 C GLY A 184 4.294 10.241 1.545 1.00 1.23 C ATOM 2577 O GLY A 184 4.149 11.141 0.720 1.00 1.38 O ATOM 0 H GLY A 184 3.728 8.487 3.937 1.00 1.16 H new ATOM 0 HA2 GLY A 184 2.506 9.934 2.679 1.00 1.28 H new ATOM 0 HA3 GLY A 184 3.480 11.283 3.228 1.00 1.28 H new ATOM 2581 N VAL A 185 5.123 9.219 1.371 1.00 1.10 N ATOM 2582 CA VAL A 185 5.890 9.059 0.146 1.00 1.08 C ATOM 2583 C VAL A 185 4.994 8.620 -1.009 1.00 1.02 C ATOM 2584 O VAL A 185 3.919 8.060 -0.792 1.00 1.15 O ATOM 2585 CB VAL A 185 7.029 8.038 0.333 1.00 1.13 C ATOM 2586 CG1 VAL A 185 8.091 8.585 1.271 1.00 1.31 C ATOM 2587 CG2 VAL A 185 6.482 6.725 0.864 1.00 1.14 C ATOM 0 H VAL A 185 5.280 8.488 2.065 1.00 1.10 H new ATOM 0 HA VAL A 185 6.324 10.030 -0.093 1.00 1.08 H new ATOM 0 HB VAL A 185 7.489 7.857 -0.639 1.00 1.13 H new ATOM 0 HG11 VAL A 185 8.886 7.849 1.389 1.00 1.31 H new ATOM 0 HG12 VAL A 185 8.506 9.503 0.855 1.00 1.31 H new ATOM 0 HG13 VAL A 185 7.644 8.796 2.243 1.00 1.31 H new ATOM 0 HG21 VAL A 185 7.299 6.015 0.990 1.00 1.14 H new ATOM 0 HG22 VAL A 185 5.997 6.895 1.825 1.00 1.14 H new ATOM 0 HG23 VAL A 185 5.756 6.321 0.158 1.00 1.14 H new ATOM 2597 N GLU A 186 5.438 8.878 -2.231 1.00 0.93 N ATOM 2598 CA GLU A 186 4.678 8.516 -3.413 1.00 0.92 C ATOM 2599 C GLU A 186 5.098 7.147 -3.928 1.00 0.83 C ATOM 2600 O GLU A 186 6.006 6.503 -3.384 1.00 0.82 O ATOM 2601 CB GLU A 186 4.862 9.563 -4.518 1.00 1.02 C ATOM 2602 CG GLU A 186 4.160 10.881 -4.250 1.00 1.46 C ATOM 2603 CD GLU A 186 2.653 10.753 -4.313 1.00 2.45 C ATOM 2604 OE1 GLU A 186 2.096 10.741 -5.429 1.00 2.97 O ATOM 2605 OE2 GLU A 186 2.016 10.683 -3.240 1.00 3.02 O ATOM 0 H GLU A 186 6.326 9.339 -2.427 1.00 0.93 H new ATOM 0 HA GLU A 186 3.625 8.479 -3.133 1.00 0.92 H new ATOM 0 HB2 GLU A 186 5.927 9.752 -4.650 1.00 1.02 H new ATOM 0 HB3 GLU A 186 4.492 9.152 -5.457 1.00 1.02 H new ATOM 0 HG2 GLU A 186 4.450 11.251 -3.267 1.00 1.46 H new ATOM 0 HG3 GLU A 186 4.490 11.621 -4.979 1.00 1.46 H new ATOM 2612 N GLU A 187 4.441 6.711 -4.985 1.00 0.89 N ATOM 2613 CA GLU A 187 4.721 5.422 -5.583 1.00 0.91 C ATOM 2614 C GLU A 187 5.697 5.556 -6.747 1.00 0.91 C ATOM 2615 O GLU A 187 6.409 4.612 -7.077 1.00 1.14 O ATOM 2616 CB GLU A 187 3.413 4.777 -6.029 1.00 1.05 C ATOM 2617 CG GLU A 187 2.630 4.156 -4.880 1.00 1.11 C ATOM 2618 CD GLU A 187 1.217 3.768 -5.265 1.00 1.36 C ATOM 2619 OE1 GLU A 187 1.025 2.670 -5.821 1.00 1.72 O ATOM 2620 OE2 GLU A 187 0.283 4.551 -4.997 1.00 1.86 O ATOM 0 H GLU A 187 3.702 7.238 -5.451 1.00 0.89 H new ATOM 0 HA GLU A 187 5.196 4.781 -4.840 1.00 0.91 H new ATOM 0 HB2 GLU A 187 2.793 5.528 -6.519 1.00 1.05 H new ATOM 0 HB3 GLU A 187 3.629 4.008 -6.771 1.00 1.05 H new ATOM 0 HG2 GLU A 187 3.159 3.272 -4.524 1.00 1.11 H new ATOM 0 HG3 GLU A 187 2.593 4.862 -4.050 1.00 1.11 H new ATOM 2627 N HIS A 188 5.756 6.747 -7.331 1.00 0.92 N ATOM 2628 CA HIS A 188 6.628 7.003 -8.483 1.00 0.95 C ATOM 2629 C HIS A 188 8.054 7.358 -8.053 1.00 0.92 C ATOM 2630 O HIS A 188 8.903 7.648 -8.892 1.00 1.01 O ATOM 2631 CB HIS A 188 6.052 8.133 -9.353 1.00 1.04 C ATOM 2632 CG HIS A 188 5.865 9.426 -8.615 1.00 1.03 C ATOM 2633 ND1 HIS A 188 4.632 9.935 -8.289 1.00 1.09 N ATOM 2634 CD2 HIS A 188 6.770 10.290 -8.107 1.00 1.08 C ATOM 2635 CE1 HIS A 188 4.789 11.049 -7.603 1.00 1.14 C ATOM 2636 NE2 HIS A 188 6.079 11.291 -7.477 1.00 1.15 N ATOM 0 H HIS A 188 5.212 7.555 -7.029 1.00 0.92 H new ATOM 0 HA HIS A 188 6.672 6.082 -9.065 1.00 0.95 H new ATOM 0 HB2 HIS A 188 6.716 8.301 -10.201 1.00 1.04 H new ATOM 0 HB3 HIS A 188 5.092 7.814 -9.759 1.00 1.04 H new ATOM 0 HD1 HIS A 188 3.736 9.517 -8.539 1.00 1.09 H new ATOM 0 HD2 HIS A 188 7.844 10.207 -8.184 1.00 1.08 H new ATOM 0 HE1 HIS A 188 3.992 11.663 -7.209 1.00 1.14 H new ATOM 2645 N GLU A 189 8.311 7.339 -6.752 1.00 0.89 N ATOM 2646 CA GLU A 189 9.614 7.734 -6.223 1.00 0.92 C ATOM 2647 C GLU A 189 10.609 6.578 -6.320 1.00 0.78 C ATOM 2648 O GLU A 189 10.240 5.427 -6.088 1.00 0.74 O ATOM 2649 CB GLU A 189 9.474 8.157 -4.762 1.00 1.10 C ATOM 2650 CG GLU A 189 8.404 9.208 -4.508 1.00 1.37 C ATOM 2651 CD GLU A 189 8.697 10.537 -5.178 1.00 1.82 C ATOM 2652 OE1 GLU A 189 9.877 10.806 -5.466 1.00 2.38 O ATOM 2653 OE2 GLU A 189 7.751 11.317 -5.414 1.00 2.34 O ATOM 0 H GLU A 189 7.636 7.055 -6.042 1.00 0.89 H new ATOM 0 HA GLU A 189 9.985 8.570 -6.815 1.00 0.92 H new ATOM 0 HB2 GLU A 189 9.249 7.275 -4.162 1.00 1.10 H new ATOM 0 HB3 GLU A 189 10.433 8.542 -4.415 1.00 1.10 H new ATOM 0 HG2 GLU A 189 7.445 8.833 -4.864 1.00 1.37 H new ATOM 0 HG3 GLU A 189 8.306 9.364 -3.434 1.00 1.37 H new ATOM 2660 N THR A 190 11.857 6.877 -6.682 1.00 0.74 N ATOM 2661 CA THR A 190 12.897 5.853 -6.725 1.00 0.66 C ATOM 2662 C THR A 190 13.434 5.558 -5.327 1.00 0.57 C ATOM 2663 O THR A 190 13.853 6.462 -4.605 1.00 0.61 O ATOM 2664 CB THR A 190 14.067 6.265 -7.645 1.00 0.70 C ATOM 2665 OG1 THR A 190 13.593 6.493 -8.982 1.00 0.81 O ATOM 2666 CG2 THR A 190 15.148 5.190 -7.672 1.00 0.66 C ATOM 0 H THR A 190 12.169 7.811 -6.947 1.00 0.74 H new ATOM 0 HA THR A 190 12.436 4.953 -7.131 1.00 0.66 H new ATOM 0 HB THR A 190 14.495 7.185 -7.246 1.00 0.70 H new ATOM 0 HG1 THR A 190 14.344 6.755 -9.555 1.00 0.81 H new ATOM 0 HG21 THR A 190 15.959 5.506 -8.327 1.00 0.66 H new ATOM 0 HG22 THR A 190 15.534 5.037 -6.664 1.00 0.66 H new ATOM 0 HG23 THR A 190 14.724 4.257 -8.044 1.00 0.66 H new ATOM 2674 N LEU A 191 13.420 4.288 -4.953 1.00 0.48 N ATOM 2675 CA LEU A 191 13.910 3.874 -3.649 1.00 0.42 C ATOM 2676 C LEU A 191 15.161 3.031 -3.848 1.00 0.39 C ATOM 2677 O LEU A 191 15.237 2.247 -4.795 1.00 0.38 O ATOM 2678 CB LEU A 191 12.855 3.060 -2.875 1.00 0.41 C ATOM 2679 CG LEU A 191 11.410 3.597 -2.871 1.00 0.51 C ATOM 2680 CD1 LEU A 191 11.372 5.111 -2.752 1.00 1.01 C ATOM 2681 CD2 LEU A 191 10.654 3.136 -4.105 1.00 0.82 C ATOM 0 H LEU A 191 13.074 3.526 -5.536 1.00 0.48 H new ATOM 0 HA LEU A 191 14.133 4.765 -3.062 1.00 0.42 H new ATOM 0 HB2 LEU A 191 12.839 2.051 -3.287 1.00 0.41 H new ATOM 0 HB3 LEU A 191 13.186 2.976 -1.840 1.00 0.41 H new ATOM 0 HG LEU A 191 10.915 3.185 -1.991 1.00 0.51 H new ATOM 0 HD11 LEU A 191 10.336 5.450 -2.753 1.00 1.01 H new ATOM 0 HD12 LEU A 191 11.853 5.415 -1.822 1.00 1.01 H new ATOM 0 HD13 LEU A 191 11.900 5.556 -3.596 1.00 1.01 H new ATOM 0 HD21 LEU A 191 9.638 3.529 -4.077 1.00 0.82 H new ATOM 0 HD22 LEU A 191 11.160 3.501 -4.999 1.00 0.82 H new ATOM 0 HD23 LEU A 191 10.621 2.047 -4.126 1.00 0.82 H new ATOM 2693 N LEU A 192 16.152 3.189 -2.988 1.00 0.39 N ATOM 2694 CA LEU A 192 17.405 2.474 -3.154 1.00 0.41 C ATOM 2695 C LEU A 192 17.591 1.463 -2.034 1.00 0.40 C ATOM 2696 O LEU A 192 17.278 1.744 -0.874 1.00 0.44 O ATOM 2697 CB LEU A 192 18.578 3.456 -3.141 1.00 0.44 C ATOM 2698 CG LEU A 192 18.323 4.790 -3.839 1.00 0.49 C ATOM 2699 CD1 LEU A 192 19.491 5.730 -3.605 1.00 0.56 C ATOM 2700 CD2 LEU A 192 18.091 4.591 -5.327 1.00 0.50 C ATOM 0 H LEU A 192 16.114 3.801 -2.173 1.00 0.39 H new ATOM 0 HA LEU A 192 17.376 1.952 -4.110 1.00 0.41 H new ATOM 0 HB2 LEU A 192 18.853 3.654 -2.105 1.00 0.44 H new ATOM 0 HB3 LEU A 192 19.436 2.977 -3.612 1.00 0.44 H new ATOM 0 HG LEU A 192 17.422 5.233 -3.416 1.00 0.49 H new ATOM 0 HD11 LEU A 192 19.300 6.679 -4.106 1.00 0.56 H new ATOM 0 HD12 LEU A 192 19.611 5.902 -2.535 1.00 0.56 H new ATOM 0 HD13 LEU A 192 20.402 5.285 -4.005 1.00 0.56 H new ATOM 0 HD21 LEU A 192 17.912 5.557 -5.800 1.00 0.50 H new ATOM 0 HD22 LEU A 192 18.970 4.126 -5.773 1.00 0.50 H new ATOM 0 HD23 LEU A 192 17.224 3.947 -5.477 1.00 0.50 H new ATOM 2712 N LEU A 193 18.063 0.278 -2.382 1.00 0.43 N ATOM 2713 CA LEU A 193 18.443 -0.704 -1.386 1.00 0.50 C ATOM 2714 C LEU A 193 19.890 -0.465 -0.959 1.00 0.47 C ATOM 2715 O LEU A 193 20.797 -0.451 -1.792 1.00 0.49 O ATOM 2716 CB LEU A 193 18.254 -2.118 -1.957 1.00 0.68 C ATOM 2717 CG LEU A 193 18.487 -3.279 -0.985 1.00 0.44 C ATOM 2718 CD1 LEU A 193 17.749 -4.516 -1.457 1.00 1.09 C ATOM 2719 CD2 LEU A 193 19.965 -3.600 -0.865 1.00 1.03 C ATOM 0 H LEU A 193 18.192 -0.026 -3.347 1.00 0.43 H new ATOM 0 HA LEU A 193 17.808 -0.607 -0.506 1.00 0.50 H new ATOM 0 HB2 LEU A 193 17.239 -2.197 -2.347 1.00 0.68 H new ATOM 0 HB3 LEU A 193 18.931 -2.239 -2.803 1.00 0.68 H new ATOM 0 HG LEU A 193 18.109 -2.975 -0.009 1.00 0.44 H new ATOM 0 HD11 LEU A 193 17.923 -5.333 -0.757 1.00 1.09 H new ATOM 0 HD12 LEU A 193 16.681 -4.305 -1.509 1.00 1.09 H new ATOM 0 HD13 LEU A 193 18.111 -4.801 -2.445 1.00 1.09 H new ATOM 0 HD21 LEU A 193 20.102 -4.428 -0.169 1.00 1.03 H new ATOM 0 HD22 LEU A 193 20.357 -3.879 -1.843 1.00 1.03 H new ATOM 0 HD23 LEU A 193 20.499 -2.724 -0.497 1.00 1.03 H new ATOM 2731 N ARG A 194 20.098 -0.267 0.336 1.00 0.46 N ATOM 2732 CA ARG A 194 21.429 -0.015 0.869 1.00 0.46 C ATOM 2733 C ARG A 194 21.757 -1.007 1.965 1.00 0.44 C ATOM 2734 O ARG A 194 20.876 -1.437 2.708 1.00 0.49 O ATOM 2735 CB ARG A 194 21.549 1.404 1.430 1.00 0.53 C ATOM 2736 CG ARG A 194 21.584 2.497 0.378 1.00 0.60 C ATOM 2737 CD ARG A 194 22.706 2.289 -0.621 1.00 0.65 C ATOM 2738 NE ARG A 194 24.001 2.063 0.026 1.00 0.69 N ATOM 2739 CZ ARG A 194 25.078 1.616 -0.621 1.00 0.95 C ATOM 2740 NH1 ARG A 194 24.997 1.296 -1.907 1.00 1.25 N ATOM 2741 NH2 ARG A 194 26.231 1.473 0.024 1.00 1.06 N ATOM 0 H ARG A 194 19.359 -0.276 1.039 1.00 0.46 H new ATOM 0 HA ARG A 194 22.134 -0.127 0.045 1.00 0.46 H new ATOM 0 HB2 ARG A 194 20.709 1.589 2.099 1.00 0.53 H new ATOM 0 HB3 ARG A 194 22.456 1.468 2.032 1.00 0.53 H new ATOM 0 HG2 ARG A 194 20.630 2.524 -0.149 1.00 0.60 H new ATOM 0 HG3 ARG A 194 21.707 3.465 0.865 1.00 0.60 H new ATOM 0 HD2 ARG A 194 22.468 1.436 -1.257 1.00 0.65 H new ATOM 0 HD3 ARG A 194 22.776 3.162 -1.271 1.00 0.65 H new ATOM 0 HE ARG A 194 24.083 2.258 1.024 1.00 0.69 H new ATOM 0 HH11 ARG A 194 24.110 1.392 -2.402 1.00 1.25 H new ATOM 0 HH12 ARG A 194 25.822 0.954 -2.400 1.00 1.25 H new ATOM 0 HH21 ARG A 194 26.293 1.705 1.015 1.00 1.06 H new ATOM 0 HH22 ARG A 194 27.054 1.131 -0.472 1.00 1.06 H new ATOM 2755 N ARG A 195 23.021 -1.363 2.070 1.00 0.45 N ATOM 2756 CA ARG A 195 23.458 -2.281 3.100 1.00 0.50 C ATOM 2757 C ARG A 195 23.877 -1.507 4.342 1.00 0.55 C ATOM 2758 O ARG A 195 24.707 -0.600 4.267 1.00 0.64 O ATOM 2759 CB ARG A 195 24.612 -3.147 2.590 1.00 0.59 C ATOM 2760 CG ARG A 195 24.908 -4.330 3.491 1.00 1.02 C ATOM 2761 CD ARG A 195 26.019 -5.204 2.941 1.00 1.07 C ATOM 2762 NE ARG A 195 26.233 -6.383 3.777 1.00 1.49 N ATOM 2763 CZ ARG A 195 27.252 -7.227 3.642 1.00 2.13 C ATOM 2764 NH1 ARG A 195 28.199 -6.998 2.740 1.00 2.34 N ATOM 2765 NH2 ARG A 195 27.330 -8.290 4.430 1.00 2.68 N ATOM 0 H ARG A 195 23.763 -1.030 1.454 1.00 0.45 H new ATOM 0 HA ARG A 195 22.629 -2.939 3.361 1.00 0.50 H new ATOM 0 HB2 ARG A 195 24.373 -3.510 1.590 1.00 0.59 H new ATOM 0 HB3 ARG A 195 25.508 -2.533 2.500 1.00 0.59 H new ATOM 0 HG2 ARG A 195 25.188 -3.970 4.481 1.00 1.02 H new ATOM 0 HG3 ARG A 195 24.004 -4.927 3.613 1.00 1.02 H new ATOM 0 HD2 ARG A 195 25.770 -5.516 1.927 1.00 1.07 H new ATOM 0 HD3 ARG A 195 26.942 -4.627 2.880 1.00 1.07 H new ATOM 0 HE ARG A 195 25.554 -6.572 4.515 1.00 1.49 H new ATOM 0 HH11 ARG A 195 28.148 -6.171 2.145 1.00 2.34 H new ATOM 0 HH12 ARG A 195 28.978 -7.649 2.642 1.00 2.34 H new ATOM 0 HH21 ARG A 195 26.611 -8.457 5.134 1.00 2.68 H new ATOM 0 HH22 ARG A 195 28.109 -8.941 4.332 1.00 2.68 H new ATOM 2779 N LYS A 196 23.281 -1.850 5.474 1.00 0.60 N ATOM 2780 CA LYS A 196 23.591 -1.192 6.734 1.00 0.69 C ATOM 2781 C LYS A 196 24.532 -2.061 7.563 1.00 0.76 C ATOM 2782 O LYS A 196 25.525 -1.578 8.104 1.00 0.88 O ATOM 2783 CB LYS A 196 22.311 -0.903 7.525 1.00 0.75 C ATOM 2784 CG LYS A 196 22.567 -0.299 8.898 1.00 0.88 C ATOM 2785 CD LYS A 196 21.271 -0.037 9.647 1.00 1.28 C ATOM 2786 CE LYS A 196 21.527 0.512 11.042 1.00 1.65 C ATOM 2787 NZ LYS A 196 22.294 1.788 11.013 1.00 2.15 N ATOM 0 H LYS A 196 22.576 -2.584 5.546 1.00 0.60 H new ATOM 0 HA LYS A 196 24.082 -0.244 6.514 1.00 0.69 H new ATOM 0 HB2 LYS A 196 21.684 -0.223 6.949 1.00 0.75 H new ATOM 0 HB3 LYS A 196 21.750 -1.830 7.644 1.00 0.75 H new ATOM 0 HG2 LYS A 196 23.194 -0.973 9.481 1.00 0.88 H new ATOM 0 HG3 LYS A 196 23.119 0.635 8.788 1.00 0.88 H new ATOM 0 HD2 LYS A 196 20.662 0.670 9.084 1.00 1.28 H new ATOM 0 HD3 LYS A 196 20.699 -0.962 9.720 1.00 1.28 H new ATOM 0 HE2 LYS A 196 20.575 0.674 11.547 1.00 1.65 H new ATOM 0 HE3 LYS A 196 22.076 -0.227 11.626 1.00 1.65 H new ATOM 0 HZ1 LYS A 196 22.285 2.220 11.959 1.00 2.15 H new ATOM 0 HZ2 LYS A 196 23.276 1.596 10.729 1.00 2.15 H new ATOM 0 HZ3 LYS A 196 21.857 2.440 10.331 1.00 2.15 H new ATOM 2801 N PHE A 197 24.211 -3.343 7.662 1.00 0.77 N ATOM 2802 CA PHE A 197 25.066 -4.283 8.371 1.00 0.89 C ATOM 2803 C PHE A 197 26.016 -4.932 7.383 1.00 0.96 C ATOM 2804 O PHE A 197 25.638 -5.211 6.252 1.00 0.92 O ATOM 2805 CB PHE A 197 24.254 -5.374 9.067 1.00 0.95 C ATOM 2806 CG PHE A 197 23.153 -4.873 9.960 1.00 0.94 C ATOM 2807 CD1 PHE A 197 23.391 -3.820 10.824 1.00 1.14 C ATOM 2808 CD2 PHE A 197 21.888 -5.440 9.931 1.00 0.92 C ATOM 2809 CE1 PHE A 197 22.398 -3.338 11.648 1.00 1.19 C ATOM 2810 CE2 PHE A 197 20.884 -4.963 10.755 1.00 0.95 C ATOM 2811 CZ PHE A 197 21.097 -3.987 11.605 1.00 1.03 C ATOM 0 H PHE A 197 23.368 -3.755 7.262 1.00 0.77 H new ATOM 0 HA PHE A 197 25.615 -3.730 9.133 1.00 0.89 H new ATOM 0 HB2 PHE A 197 23.818 -6.023 8.307 1.00 0.95 H new ATOM 0 HB3 PHE A 197 24.932 -5.988 9.660 1.00 0.95 H new ATOM 0 HD1 PHE A 197 24.371 -3.368 10.853 1.00 1.14 H new ATOM 0 HD2 PHE A 197 21.685 -6.261 9.259 1.00 0.92 H new ATOM 0 HE1 PHE A 197 22.580 -2.502 12.307 1.00 1.19 H new ATOM 0 HE2 PHE A 197 19.900 -5.405 10.697 1.00 0.95 H new ATOM 0 HZ PHE A 197 20.309 -3.666 12.271 1.00 1.03 H new ATOM 2821 N PHE A 198 27.233 -5.187 7.814 1.00 1.16 N ATOM 2822 CA PHE A 198 28.253 -5.718 6.922 1.00 1.33 C ATOM 2823 C PHE A 198 28.857 -6.991 7.492 1.00 1.58 C ATOM 2824 O PHE A 198 29.968 -7.376 7.127 1.00 2.05 O ATOM 2825 CB PHE A 198 29.356 -4.680 6.697 1.00 1.51 C ATOM 2826 CG PHE A 198 28.872 -3.398 6.079 1.00 1.40 C ATOM 2827 CD1 PHE A 198 28.612 -3.323 4.720 1.00 1.61 C ATOM 2828 CD2 PHE A 198 28.676 -2.270 6.857 1.00 1.53 C ATOM 2829 CE1 PHE A 198 28.165 -2.147 4.149 1.00 1.95 C ATOM 2830 CE2 PHE A 198 28.229 -1.091 6.293 1.00 1.78 C ATOM 2831 CZ PHE A 198 27.983 -1.027 4.933 1.00 2.00 C ATOM 0 H PHE A 198 27.544 -5.037 8.774 1.00 1.16 H new ATOM 0 HA PHE A 198 27.780 -5.951 5.968 1.00 1.33 H new ATOM 0 HB2 PHE A 198 29.829 -4.455 7.653 1.00 1.51 H new ATOM 0 HB3 PHE A 198 30.123 -5.114 6.056 1.00 1.51 H new ATOM 0 HD1 PHE A 198 28.761 -4.194 4.100 1.00 1.61 H new ATOM 0 HD2 PHE A 198 28.875 -2.312 7.918 1.00 1.53 H new ATOM 0 HE1 PHE A 198 27.958 -2.105 3.090 1.00 1.95 H new ATOM 0 HE2 PHE A 198 28.072 -0.221 6.913 1.00 1.78 H new ATOM 0 HZ PHE A 198 27.649 -0.102 4.486 1.00 2.00 H new ATOM 2841 N TYR A 199 28.120 -7.660 8.370 1.00 1.48 N ATOM 2842 CA TYR A 199 28.662 -8.824 9.050 1.00 1.79 C ATOM 2843 C TYR A 199 28.706 -10.055 8.144 1.00 2.06 C ATOM 2844 O TYR A 199 29.530 -10.943 8.357 1.00 2.27 O ATOM 2845 CB TYR A 199 27.918 -9.121 10.367 1.00 2.08 C ATOM 2846 CG TYR A 199 26.403 -9.172 10.288 1.00 2.04 C ATOM 2847 CD1 TYR A 199 25.760 -10.205 9.613 1.00 2.35 C ATOM 2848 CD2 TYR A 199 25.619 -8.179 10.853 1.00 2.05 C ATOM 2849 CE1 TYR A 199 24.382 -10.239 9.505 1.00 2.78 C ATOM 2850 CE2 TYR A 199 24.241 -8.211 10.758 1.00 2.47 C ATOM 2851 CZ TYR A 199 23.623 -9.292 10.204 1.00 2.89 C ATOM 2852 OH TYR A 199 22.254 -9.263 9.973 1.00 3.53 O ATOM 0 H TYR A 199 27.162 -7.420 8.623 1.00 1.48 H new ATOM 0 HA TYR A 199 29.693 -8.579 9.307 1.00 1.79 H new ATOM 0 HB2 TYR A 199 28.273 -10.077 10.752 1.00 2.08 H new ATOM 0 HB3 TYR A 199 28.197 -8.360 11.096 1.00 2.08 H new ATOM 0 HD1 TYR A 199 26.347 -10.993 9.166 1.00 2.35 H new ATOM 0 HD2 TYR A 199 26.095 -7.364 11.378 1.00 2.05 H new ATOM 0 HE1 TYR A 199 23.898 -10.984 8.891 1.00 2.78 H new ATOM 0 HE2 TYR A 199 23.654 -7.381 11.122 1.00 2.47 H new ATOM 0 HH TYR A 199 21.845 -8.561 10.521 1.00 3.53 H new ATOM 2862 N SER A 200 27.835 -10.101 7.134 1.00 2.43 N ATOM 2863 CA SER A 200 27.821 -11.208 6.170 1.00 3.08 C ATOM 2864 C SER A 200 27.569 -12.541 6.876 1.00 3.06 C ATOM 2865 O SER A 200 28.110 -13.579 6.487 1.00 3.33 O ATOM 2866 CB SER A 200 29.145 -11.255 5.397 1.00 3.56 C ATOM 2867 OG SER A 200 29.403 -10.021 4.741 1.00 4.12 O ATOM 0 H SER A 200 27.129 -9.385 6.961 1.00 2.43 H new ATOM 0 HA SER A 200 27.008 -11.038 5.464 1.00 3.08 H new ATOM 0 HB2 SER A 200 29.961 -11.483 6.083 1.00 3.56 H new ATOM 0 HB3 SER A 200 29.112 -12.060 4.663 1.00 3.56 H new ATOM 0 HG SER A 200 29.377 -10.155 3.771 1.00 4.12 H new ATOM 2873 N ASP A 201 26.735 -12.485 7.914 1.00 2.98 N ATOM 2874 CA ASP A 201 26.390 -13.641 8.748 1.00 3.19 C ATOM 2875 C ASP A 201 27.600 -14.118 9.563 1.00 3.05 C ATOM 2876 O ASP A 201 27.569 -15.166 10.205 1.00 3.25 O ATOM 2877 CB ASP A 201 25.808 -14.769 7.887 1.00 3.87 C ATOM 2878 CG ASP A 201 25.285 -15.935 8.706 1.00 4.29 C ATOM 2879 OD1 ASP A 201 24.403 -15.721 9.567 1.00 4.89 O ATOM 2880 OD2 ASP A 201 25.750 -17.076 8.491 1.00 4.31 O ATOM 0 H ASP A 201 26.272 -11.624 8.205 1.00 2.98 H new ATOM 0 HA ASP A 201 25.624 -13.334 9.460 1.00 3.19 H new ATOM 0 HB2 ASP A 201 24.998 -14.370 7.276 1.00 3.87 H new ATOM 0 HB3 ASP A 201 26.576 -15.129 7.203 1.00 3.87 H new ATOM 2885 N GLN A 202 28.658 -13.319 9.559 1.00 3.02 N ATOM 2886 CA GLN A 202 29.849 -13.620 10.333 1.00 3.45 C ATOM 2887 C GLN A 202 29.930 -12.680 11.532 1.00 3.85 C ATOM 2888 O GLN A 202 29.354 -13.018 12.586 1.00 4.18 O ATOM 2889 CB GLN A 202 31.098 -13.482 9.451 1.00 3.65 C ATOM 2890 CG GLN A 202 32.397 -13.886 10.134 1.00 4.42 C ATOM 2891 CD GLN A 202 32.431 -15.354 10.507 1.00 5.07 C ATOM 2892 OE1 GLN A 202 32.051 -15.737 11.613 1.00 5.73 O ATOM 2893 NE2 GLN A 202 32.883 -16.187 9.585 1.00 5.30 N ATOM 2894 OXT GLN A 202 30.543 -11.597 11.413 1.00 4.27 O ATOM 0 H GLN A 202 28.713 -12.452 9.024 1.00 3.02 H new ATOM 0 HA GLN A 202 29.797 -14.647 10.695 1.00 3.45 H new ATOM 0 HB2 GLN A 202 30.966 -14.092 8.557 1.00 3.65 H new ATOM 0 HB3 GLN A 202 31.182 -12.447 9.120 1.00 3.65 H new ATOM 0 HG2 GLN A 202 33.234 -13.664 9.472 1.00 4.42 H new ATOM 0 HG3 GLN A 202 32.532 -13.284 11.033 1.00 4.42 H new ATOM 0 HE21 GLN A 202 33.189 -15.829 8.680 1.00 5.30 H new ATOM 0 HE22 GLN A 202 32.926 -17.188 9.779 1.00 5.30 H new TER 2903 GLN A 202