USER MOD reduce.3.24.130724 H: found=0, std=0, add=1306, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1309 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 56 THR OG1 : rot 82:sc= -1.2! USER MOD Set 1.2: A 159 SER OG : rot 180:sc= 0.0168 USER MOD Set 2.1: A 77 ASN : amide:sc= -0.889 K(o=-0.67,f=-4.7) USER MOD Set 2.2: A 82 GLN : amide:sc= 0.279 K(o=-0.67,f=-7.6!) USER MOD Set 2.3: A 109 ASN : amide:sc= -0.0567 K(o=-0.67,f=-6.7) USER MOD Set 3.1: A 28 TYR OH : rot -110:sc= 0.385 USER MOD Set 3.2: A 33 HIS : no HE2:sc= -6.65! C(o=-6.5!,f=-12!) USER MOD Set 3.3: A 61 TYR OH : rot 180:sc= 0 USER MOD Set 3.4: A 70 THR OG1 : rot 69:sc= -0.215! USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 61:sc= 0.259 USER MOD Single : A 14 SER OG : rot -28:sc= 0.538 USER MOD Single : A 25 HIS : no HD1:sc= -2.02 K(o=-2,f=-6.1!) USER MOD Single : A 26 LYS NZ :NH3+ -154:sc= 1.06 (180deg=0.558) USER MOD Single : A 29 ASN : amide:sc= -2.87! C(o=-2.9!,f=-3.2!) USER MOD Single : A 32 GLN : amide:sc= -0.582 X(o=-0.58,f=-0.37) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 SER OG : rot 133:sc= 1.15 USER MOD Single : A 41 TYR OH : rot -15:sc= -0.706 USER MOD Single : A 42 ASN : amide:sc= -9.44! C(o=-9.4!,f=-12!) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ -169:sc= -0.0382 (180deg=-0.256) USER MOD Single : A 47 CYS SG : rot 80:sc= -2.53! USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 45:sc= 0.637 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= -0.0638 USER MOD Single : A 58 THR OG1 : rot 96:sc= -0.158! USER MOD Single : A 59 THR OG1 : rot 91:sc= 1.1 USER MOD Single : A 62 ASN :FLIP amide:sc=-0.00227 F(o=-1.6,f=-0.0023) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot -147:sc= 1.02 USER MOD Single : A 65 LYS NZ :NH3+ 159:sc= -0.104 (180deg=-0.489) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN :FLIP amide:sc= -0.32 F(o=-2.6!,f=-0.32) USER MOD Single : A 76 SER OG : rot 134:sc= 0.132 USER MOD Single : A 78 GLN : amide:sc= -0.618 K(o=-0.62,f=-5.2!) USER MOD Single : A 86 ASN : amide:sc= -0.485 X(o=-0.49,f=-0.019) USER MOD Single : A 91 LYS NZ :NH3+ -174:sc= 1.18 (180deg=1.15) USER MOD Single : A 95 CYS SG : rot 140:sc= -4.06! USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 LYS NZ :NH3+ -161:sc= -0.0592 (180deg=-0.429) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 MET CE :methyl -158:sc= -4.15 (180deg=-5.37!) USER MOD Single : A 107 LYS NZ :NH3+ 151:sc= 1.27 (180deg=1.13) USER MOD Single : A 111 ASN : amide:sc= -5.23! C(o=-5.2!,f=-6.7!) USER MOD Single : A 114 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 116 HIS : no HD1:sc= -5.84! C(o=-5.8!,f=-13!) USER MOD Single : A 119 TYR OH : rot 110:sc= -1.85! USER MOD Single : A 121 TYR OH : rot 180:sc= -0.573 USER MOD Single : A 122 MET CE :methyl -113:sc= -7.47! (180deg=-12!) USER MOD Single : A 123 LYS NZ :NH3+ -156:sc= 1.22 (180deg=1.02) USER MOD Single : A 124 LYS NZ :NH3+ 170:sc=-0.00341 (180deg=-0.102) USER MOD Single : A 125 THR OG1 : rot 89:sc= 1.26 USER MOD Single : A 126 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0147) USER MOD Single : A 132 THR OG1 : rot 140:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 165:sc=-0.00942 (180deg=-0.214) USER MOD Single : A 136 LYS NZ :NH3+ 150:sc= 0.0652 (180deg=-0.105) USER MOD Single : A 138 ASN : amide:sc= -0.703 X(o=-0.7,f=-0.94) USER MOD Single : A 140 THR OG1 : rot 69:sc= -4.42! USER MOD Single : A 141 SER OG : rot 93:sc= -2.91! USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 1.23 (180deg=1.23) USER MOD Single : A 166 LYS NZ :NH3+ -170:sc= 0.369 (180deg=0.114) USER MOD Single : A 173 SER OG : rot 180:sc= -0.149 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 10 -6.724 22.641 0.956 1.00 5.22 N ATOM 2 CA GLY A 10 -6.921 21.193 0.713 1.00 4.42 C ATOM 3 C GLY A 10 -7.983 20.929 -0.331 1.00 3.29 C ATOM 4 O GLY A 10 -8.596 21.861 -0.856 1.00 3.60 O ATOM 0 HA2 GLY A 10 -5.979 20.749 0.391 1.00 4.42 H new ATOM 0 HA3 GLY A 10 -7.202 20.704 1.646 1.00 4.42 H new ATOM 10 N MET A 11 -8.209 19.655 -0.616 1.00 2.49 N ATOM 11 CA MET A 11 -9.152 19.235 -1.648 1.00 1.84 C ATOM 12 C MET A 11 -9.296 17.720 -1.625 1.00 1.40 C ATOM 13 O MET A 11 -10.368 17.178 -1.913 1.00 2.20 O ATOM 14 CB MET A 11 -8.688 19.693 -3.038 1.00 2.43 C ATOM 15 CG MET A 11 -9.605 19.247 -4.169 1.00 3.11 C ATOM 16 SD MET A 11 -9.033 19.802 -5.786 1.00 4.02 S ATOM 17 CE MET A 11 -10.267 19.055 -6.851 1.00 4.85 C ATOM 0 H MET A 11 -7.745 18.882 -0.140 1.00 2.49 H new ATOM 0 HA MET A 11 -10.117 19.698 -1.441 1.00 1.84 H new ATOM 0 HB2 MET A 11 -8.617 20.781 -3.047 1.00 2.43 H new ATOM 0 HB3 MET A 11 -7.685 19.307 -3.222 1.00 2.43 H new ATOM 0 HG2 MET A 11 -9.676 18.159 -4.167 1.00 3.11 H new ATOM 0 HG3 MET A 11 -10.609 19.632 -3.991 1.00 3.11 H new ATOM 0 HE1 MET A 11 -10.052 19.306 -7.889 1.00 4.85 H new ATOM 0 HE2 MET A 11 -10.246 17.972 -6.728 1.00 4.85 H new ATOM 0 HE3 MET A 11 -11.254 19.432 -6.584 1.00 4.85 H new ATOM 27 N GLY A 12 -8.202 17.048 -1.271 1.00 0.92 N ATOM 28 CA GLY A 12 -8.196 15.601 -1.207 1.00 0.85 C ATOM 29 C GLY A 12 -9.248 15.059 -0.262 1.00 0.79 C ATOM 30 O GLY A 12 -9.225 15.342 0.935 1.00 1.55 O ATOM 0 H GLY A 12 -7.315 17.487 -1.026 1.00 0.92 H new ATOM 0 HA2 GLY A 12 -8.365 15.196 -2.205 1.00 0.85 H new ATOM 0 HA3 GLY A 12 -7.212 15.259 -0.886 1.00 0.85 H new ATOM 34 N SER A 13 -10.176 14.293 -0.803 1.00 0.52 N ATOM 35 CA SER A 13 -11.244 13.712 -0.002 1.00 0.53 C ATOM 36 C SER A 13 -11.251 12.196 -0.158 1.00 0.41 C ATOM 37 O SER A 13 -11.998 11.484 0.519 1.00 0.53 O ATOM 38 CB SER A 13 -12.586 14.302 -0.428 1.00 0.79 C ATOM 39 OG SER A 13 -12.522 15.720 -0.459 1.00 1.58 O ATOM 0 H SER A 13 -10.215 14.057 -1.794 1.00 0.52 H new ATOM 0 HA SER A 13 -11.075 13.948 1.049 1.00 0.53 H new ATOM 0 HB2 SER A 13 -12.859 13.923 -1.413 1.00 0.79 H new ATOM 0 HB3 SER A 13 -13.366 13.983 0.264 1.00 0.79 H new ATOM 0 HG SER A 13 -11.846 16.003 -1.109 1.00 1.58 H new ATOM 45 N SER A 14 -10.396 11.722 -1.055 1.00 0.32 N ATOM 46 CA SER A 14 -10.230 10.330 -1.361 1.00 0.22 C ATOM 47 C SER A 14 -8.934 10.263 -2.115 1.00 0.21 C ATOM 48 O SER A 14 -8.520 11.230 -2.748 1.00 0.35 O ATOM 49 CB SER A 14 -11.381 9.773 -2.217 1.00 0.25 C ATOM 50 OG SER A 14 -12.652 10.169 -1.723 1.00 1.17 O ATOM 0 H SER A 14 -9.784 12.327 -1.602 1.00 0.32 H new ATOM 0 HA SER A 14 -10.230 9.725 -0.454 1.00 0.22 H new ATOM 0 HB2 SER A 14 -11.268 10.118 -3.245 1.00 0.25 H new ATOM 0 HB3 SER A 14 -11.323 8.685 -2.238 1.00 0.25 H new ATOM 0 HG SER A 14 -12.597 10.312 -0.755 1.00 1.17 H new ATOM 56 N ILE A 15 -8.289 9.143 -2.021 1.00 0.18 N ATOM 57 CA ILE A 15 -6.959 8.972 -2.541 1.00 0.18 C ATOM 58 C ILE A 15 -6.899 9.166 -4.063 1.00 0.17 C ATOM 59 O ILE A 15 -5.826 9.322 -4.632 1.00 0.19 O ATOM 60 CB ILE A 15 -6.464 7.578 -2.152 1.00 0.17 C ATOM 61 CG1 ILE A 15 -7.463 6.520 -2.624 1.00 0.18 C ATOM 62 CG2 ILE A 15 -6.281 7.506 -0.654 1.00 0.23 C ATOM 63 CD1 ILE A 15 -6.837 5.198 -2.996 1.00 0.38 C ATOM 0 H ILE A 15 -8.671 8.308 -1.576 1.00 0.18 H new ATOM 0 HA ILE A 15 -6.313 9.737 -2.110 1.00 0.18 H new ATOM 0 HB ILE A 15 -5.505 7.385 -2.633 1.00 0.17 H new ATOM 0 HG12 ILE A 15 -8.197 6.352 -1.836 1.00 0.18 H new ATOM 0 HG13 ILE A 15 -8.005 6.908 -3.487 1.00 0.18 H new ATOM 0 HG21 ILE A 15 -5.928 6.512 -0.378 1.00 0.23 H new ATOM 0 HG22 ILE A 15 -5.549 8.251 -0.341 1.00 0.23 H new ATOM 0 HG23 ILE A 15 -7.233 7.703 -0.161 1.00 0.23 H new ATOM 0 HD11 ILE A 15 -7.614 4.506 -3.319 1.00 0.38 H new ATOM 0 HD12 ILE A 15 -6.125 5.348 -3.807 1.00 0.38 H new ATOM 0 HD13 ILE A 15 -6.319 4.784 -2.131 1.00 0.38 H new ATOM 75 N PHE A 16 -8.064 9.214 -4.705 1.00 0.18 N ATOM 76 CA PHE A 16 -8.152 9.324 -6.161 1.00 0.19 C ATOM 77 C PHE A 16 -7.834 10.723 -6.671 1.00 0.21 C ATOM 78 O PHE A 16 -7.904 10.980 -7.873 1.00 0.30 O ATOM 79 CB PHE A 16 -9.536 8.934 -6.629 1.00 0.20 C ATOM 80 CG PHE A 16 -9.874 7.527 -6.298 1.00 0.19 C ATOM 81 CD1 PHE A 16 -9.128 6.480 -6.793 1.00 0.22 C ATOM 82 CD2 PHE A 16 -10.936 7.256 -5.471 1.00 0.18 C ATOM 83 CE1 PHE A 16 -9.437 5.185 -6.446 1.00 0.22 C ATOM 84 CE2 PHE A 16 -11.253 5.965 -5.133 1.00 0.19 C ATOM 85 CZ PHE A 16 -10.500 4.900 -5.753 1.00 0.19 C ATOM 0 H PHE A 16 -8.969 9.178 -4.235 1.00 0.18 H new ATOM 0 HA PHE A 16 -7.403 8.645 -6.568 1.00 0.19 H new ATOM 0 HB2 PHE A 16 -10.270 9.597 -6.172 1.00 0.20 H new ATOM 0 HB3 PHE A 16 -9.605 9.076 -7.707 1.00 0.20 H new ATOM 0 HD1 PHE A 16 -8.298 6.676 -7.456 1.00 0.22 H new ATOM 0 HD2 PHE A 16 -11.529 8.070 -5.082 1.00 0.18 H new ATOM 0 HE1 PHE A 16 -8.781 4.386 -6.757 1.00 0.22 H new ATOM 0 HE2 PHE A 16 -12.041 5.752 -4.426 1.00 0.19 H new ATOM 0 HZ PHE A 16 -10.818 3.874 -5.642 1.00 0.19 H new ATOM 95 N ASP A 17 -7.513 11.631 -5.767 1.00 0.21 N ATOM 96 CA ASP A 17 -7.106 12.968 -6.160 1.00 0.26 C ATOM 97 C ASP A 17 -5.641 12.932 -6.528 1.00 0.25 C ATOM 98 O ASP A 17 -5.127 13.814 -7.217 1.00 0.32 O ATOM 99 CB ASP A 17 -7.327 13.975 -5.031 1.00 0.32 C ATOM 100 CG ASP A 17 -8.789 14.100 -4.624 1.00 1.13 C ATOM 101 OD1 ASP A 17 -9.631 14.469 -5.473 1.00 1.30 O ATOM 102 OD2 ASP A 17 -9.105 13.837 -3.443 1.00 2.11 O ATOM 0 H ASP A 17 -7.526 11.468 -4.760 1.00 0.21 H new ATOM 0 HA ASP A 17 -7.710 13.286 -7.010 1.00 0.26 H new ATOM 0 HB2 ASP A 17 -6.738 13.675 -4.164 1.00 0.32 H new ATOM 0 HB3 ASP A 17 -6.958 14.951 -5.345 1.00 0.32 H new ATOM 107 N PHE A 18 -4.974 11.890 -6.056 1.00 0.22 N ATOM 108 CA PHE A 18 -3.565 11.721 -6.294 1.00 0.23 C ATOM 109 C PHE A 18 -3.295 10.639 -7.304 1.00 0.26 C ATOM 110 O PHE A 18 -3.589 9.463 -7.091 1.00 0.29 O ATOM 111 CB PHE A 18 -2.853 11.431 -4.998 1.00 0.21 C ATOM 112 CG PHE A 18 -3.017 12.554 -4.036 1.00 0.22 C ATOM 113 CD1 PHE A 18 -2.566 13.822 -4.356 1.00 0.27 C ATOM 114 CD2 PHE A 18 -3.645 12.354 -2.832 1.00 0.23 C ATOM 115 CE1 PHE A 18 -2.731 14.870 -3.478 1.00 0.31 C ATOM 116 CE2 PHE A 18 -3.820 13.395 -1.957 1.00 0.29 C ATOM 117 CZ PHE A 18 -3.361 14.657 -2.274 1.00 0.31 C ATOM 0 H PHE A 18 -5.399 11.147 -5.502 1.00 0.22 H new ATOM 0 HA PHE A 18 -3.181 12.653 -6.710 1.00 0.23 H new ATOM 0 HB2 PHE A 18 -3.246 10.513 -4.561 1.00 0.21 H new ATOM 0 HB3 PHE A 18 -1.793 11.264 -5.191 1.00 0.21 H new ATOM 0 HD1 PHE A 18 -2.079 13.992 -5.305 1.00 0.27 H new ATOM 0 HD2 PHE A 18 -4.004 11.369 -2.572 1.00 0.23 H new ATOM 0 HE1 PHE A 18 -2.367 15.854 -3.734 1.00 0.31 H new ATOM 0 HE2 PHE A 18 -4.320 13.226 -1.015 1.00 0.29 H new ATOM 0 HZ PHE A 18 -3.496 15.474 -1.580 1.00 0.31 H new ATOM 127 N GLU A 19 -2.769 11.087 -8.420 1.00 0.35 N ATOM 128 CA GLU A 19 -2.312 10.213 -9.490 1.00 0.43 C ATOM 129 C GLU A 19 -1.425 9.093 -8.943 1.00 0.34 C ATOM 130 O GLU A 19 -0.545 9.326 -8.106 1.00 0.37 O ATOM 131 CB GLU A 19 -1.526 11.027 -10.522 1.00 0.63 C ATOM 132 CG GLU A 19 -1.253 10.277 -11.816 1.00 1.08 C ATOM 133 CD GLU A 19 -2.490 10.139 -12.678 1.00 2.04 C ATOM 134 OE1 GLU A 19 -3.325 9.256 -12.384 1.00 2.86 O ATOM 135 OE2 GLU A 19 -2.634 10.902 -13.656 1.00 2.30 O ATOM 0 H GLU A 19 -2.642 12.079 -8.619 1.00 0.35 H new ATOM 0 HA GLU A 19 -3.187 9.764 -9.960 1.00 0.43 H new ATOM 0 HB2 GLU A 19 -2.080 11.938 -10.751 1.00 0.63 H new ATOM 0 HB3 GLU A 19 -0.576 11.333 -10.083 1.00 0.63 H new ATOM 0 HG2 GLU A 19 -0.479 10.799 -12.378 1.00 1.08 H new ATOM 0 HG3 GLU A 19 -0.864 9.286 -11.583 1.00 1.08 H new ATOM 142 N VAL A 20 -1.656 7.888 -9.435 1.00 0.29 N ATOM 143 CA VAL A 20 -0.882 6.726 -9.035 1.00 0.26 C ATOM 144 C VAL A 20 -0.053 6.259 -10.213 1.00 0.25 C ATOM 145 O VAL A 20 -0.291 6.682 -11.336 1.00 0.28 O ATOM 146 CB VAL A 20 -1.812 5.590 -8.532 1.00 0.31 C ATOM 147 CG1 VAL A 20 -1.046 4.328 -8.176 1.00 0.67 C ATOM 148 CG2 VAL A 20 -2.581 6.079 -7.337 1.00 0.49 C ATOM 0 H VAL A 20 -2.384 7.688 -10.121 1.00 0.29 H new ATOM 0 HA VAL A 20 -0.222 6.997 -8.211 1.00 0.26 H new ATOM 0 HB VAL A 20 -2.492 5.330 -9.343 1.00 0.31 H new ATOM 0 HG11 VAL A 20 -1.743 3.565 -7.830 1.00 0.67 H new ATOM 0 HG12 VAL A 20 -0.516 3.963 -9.056 1.00 0.67 H new ATOM 0 HG13 VAL A 20 -0.328 4.549 -7.386 1.00 0.67 H new ATOM 0 HG21 VAL A 20 -3.237 5.286 -6.977 1.00 0.49 H new ATOM 0 HG22 VAL A 20 -1.885 6.361 -6.547 1.00 0.49 H new ATOM 0 HG23 VAL A 20 -3.179 6.945 -7.619 1.00 0.49 H new ATOM 158 N LEU A 21 0.943 5.433 -9.955 1.00 0.28 N ATOM 159 CA LEU A 21 1.810 4.949 -11.003 1.00 0.35 C ATOM 160 C LEU A 21 1.948 3.448 -10.911 1.00 0.38 C ATOM 161 O LEU A 21 1.852 2.885 -9.828 1.00 0.58 O ATOM 162 CB LEU A 21 3.188 5.596 -10.875 1.00 0.45 C ATOM 163 CG LEU A 21 3.171 7.118 -10.808 1.00 0.46 C ATOM 164 CD1 LEU A 21 4.549 7.664 -10.517 1.00 0.69 C ATOM 165 CD2 LEU A 21 2.653 7.681 -12.103 1.00 0.68 C ATOM 0 H LEU A 21 1.169 5.084 -9.024 1.00 0.28 H new ATOM 0 HA LEU A 21 1.375 5.210 -11.968 1.00 0.35 H new ATOM 0 HB2 LEU A 21 3.673 5.211 -9.978 1.00 0.45 H new ATOM 0 HB3 LEU A 21 3.799 5.290 -11.724 1.00 0.45 H new ATOM 0 HG LEU A 21 2.510 7.418 -9.995 1.00 0.46 H new ATOM 0 HD11 LEU A 21 4.508 8.752 -10.475 1.00 0.69 H new ATOM 0 HD12 LEU A 21 4.899 7.277 -9.560 1.00 0.69 H new ATOM 0 HD13 LEU A 21 5.236 7.357 -11.306 1.00 0.69 H new ATOM 0 HD21 LEU A 21 2.643 8.770 -12.048 1.00 0.68 H new ATOM 0 HD22 LEU A 21 3.299 7.364 -12.922 1.00 0.68 H new ATOM 0 HD23 LEU A 21 1.640 7.318 -12.279 1.00 0.68 H new ATOM 177 N ASP A 22 2.135 2.798 -12.050 1.00 0.33 N ATOM 178 CA ASP A 22 2.574 1.416 -12.048 1.00 0.37 C ATOM 179 C ASP A 22 4.058 1.415 -11.733 1.00 0.35 C ATOM 180 O ASP A 22 4.658 2.489 -11.623 1.00 0.40 O ATOM 181 CB ASP A 22 2.323 0.725 -13.395 1.00 0.50 C ATOM 182 CG ASP A 22 0.870 0.733 -13.820 1.00 1.16 C ATOM 183 OD1 ASP A 22 0.116 -0.169 -13.399 1.00 1.48 O ATOM 184 OD2 ASP A 22 0.489 1.621 -14.607 1.00 1.87 O ATOM 0 H ASP A 22 1.991 3.202 -12.976 1.00 0.33 H new ATOM 0 HA ASP A 22 2.006 0.859 -11.303 1.00 0.37 H new ATOM 0 HB2 ASP A 22 2.920 1.217 -14.163 1.00 0.50 H new ATOM 0 HB3 ASP A 22 2.669 -0.307 -13.334 1.00 0.50 H new ATOM 189 N ALA A 23 4.669 0.247 -11.618 1.00 0.39 N ATOM 190 CA ALA A 23 6.084 0.161 -11.246 1.00 0.42 C ATOM 191 C ALA A 23 6.996 0.780 -12.299 1.00 0.47 C ATOM 192 O ALA A 23 8.205 0.890 -12.103 1.00 0.59 O ATOM 193 CB ALA A 23 6.479 -1.284 -10.983 1.00 0.52 C ATOM 0 H ALA A 23 4.216 -0.653 -11.774 1.00 0.39 H new ATOM 0 HA ALA A 23 6.212 0.737 -10.330 1.00 0.42 H new ATOM 0 HB1 ALA A 23 7.533 -1.329 -10.708 1.00 0.52 H new ATOM 0 HB2 ALA A 23 5.874 -1.684 -10.169 1.00 0.52 H new ATOM 0 HB3 ALA A 23 6.313 -1.876 -11.883 1.00 0.52 H new ATOM 199 N ASP A 24 6.414 1.203 -13.405 1.00 0.46 N ATOM 200 CA ASP A 24 7.177 1.834 -14.465 1.00 0.54 C ATOM 201 C ASP A 24 6.950 3.341 -14.488 1.00 0.51 C ATOM 202 O ASP A 24 7.438 4.018 -15.391 1.00 0.62 O ATOM 203 CB ASP A 24 6.789 1.247 -15.820 1.00 0.69 C ATOM 204 CG ASP A 24 7.090 -0.231 -15.935 1.00 1.43 C ATOM 205 OD1 ASP A 24 8.278 -0.605 -15.857 1.00 1.51 O ATOM 206 OD2 ASP A 24 6.145 -1.024 -16.087 1.00 2.34 O ATOM 0 H ASP A 24 5.415 1.121 -13.593 1.00 0.46 H new ATOM 0 HA ASP A 24 8.232 1.642 -14.270 1.00 0.54 H new ATOM 0 HB2 ASP A 24 5.724 1.409 -15.988 1.00 0.69 H new ATOM 0 HB3 ASP A 24 7.321 1.782 -16.607 1.00 0.69 H new ATOM 211 N HIS A 25 6.162 3.855 -13.525 1.00 0.43 N ATOM 212 CA HIS A 25 5.855 5.289 -13.431 1.00 0.44 C ATOM 213 C HIS A 25 4.840 5.673 -14.496 1.00 0.47 C ATOM 214 O HIS A 25 4.493 6.841 -14.645 1.00 0.54 O ATOM 215 CB HIS A 25 7.104 6.178 -13.531 1.00 0.54 C ATOM 216 CG HIS A 25 7.928 6.248 -12.279 1.00 0.64 C ATOM 217 ND1 HIS A 25 7.565 6.953 -11.146 1.00 0.73 N ATOM 218 CD2 HIS A 25 9.111 5.679 -11.991 1.00 1.47 C ATOM 219 CE1 HIS A 25 8.493 6.799 -10.212 1.00 0.59 C ATOM 220 NE2 HIS A 25 9.449 6.034 -10.705 1.00 1.26 N ATOM 0 H HIS A 25 5.725 3.290 -12.797 1.00 0.43 H new ATOM 0 HA HIS A 25 5.432 5.462 -12.441 1.00 0.44 H new ATOM 0 HB2 HIS A 25 7.732 5.809 -14.342 1.00 0.54 H new ATOM 0 HB3 HIS A 25 6.794 7.187 -13.802 1.00 0.54 H new ATOM 0 HD2 HIS A 25 9.693 5.054 -12.652 1.00 1.47 H new ATOM 0 HE1 HIS A 25 8.471 7.225 -9.220 1.00 0.59 H new ATOM 0 HE2 HIS A 25 10.298 5.753 -10.214 1.00 1.26 H new ATOM 229 N LYS A 26 4.391 4.671 -15.246 1.00 0.48 N ATOM 230 CA LYS A 26 3.223 4.815 -16.099 1.00 0.53 C ATOM 231 C LYS A 26 2.049 5.094 -15.188 1.00 0.41 C ATOM 232 O LYS A 26 1.762 4.277 -14.313 1.00 0.38 O ATOM 233 CB LYS A 26 2.949 3.517 -16.869 1.00 0.67 C ATOM 234 CG LYS A 26 4.177 2.892 -17.510 1.00 1.00 C ATOM 235 CD LYS A 26 3.928 1.434 -17.874 1.00 2.12 C ATOM 236 CE LYS A 26 3.447 0.640 -16.665 1.00 3.15 C ATOM 237 NZ LYS A 26 3.475 -0.828 -16.898 1.00 4.25 N ATOM 0 H LYS A 26 4.823 3.748 -15.278 1.00 0.48 H new ATOM 0 HA LYS A 26 3.382 5.615 -16.822 1.00 0.53 H new ATOM 0 HB2 LYS A 26 2.502 2.793 -16.188 1.00 0.67 H new ATOM 0 HB3 LYS A 26 2.212 3.720 -17.647 1.00 0.67 H new ATOM 0 HG2 LYS A 26 4.448 3.452 -18.405 1.00 1.00 H new ATOM 0 HG3 LYS A 26 5.022 2.959 -16.825 1.00 1.00 H new ATOM 0 HD2 LYS A 26 3.185 1.377 -18.669 1.00 2.12 H new ATOM 0 HD3 LYS A 26 4.845 0.991 -18.262 1.00 2.12 H new ATOM 0 HE2 LYS A 26 4.072 0.880 -15.805 1.00 3.15 H new ATOM 0 HE3 LYS A 26 2.431 0.945 -16.415 1.00 3.15 H new ATOM 0 HZ1 LYS A 26 2.771 -1.290 -16.288 1.00 4.25 H new ATOM 0 HZ2 LYS A 26 3.252 -1.026 -17.894 1.00 4.25 H new ATOM 0 HZ3 LYS A 26 4.421 -1.197 -16.675 1.00 4.25 H new ATOM 251 N PRO A 27 1.395 6.253 -15.312 1.00 0.41 N ATOM 252 CA PRO A 27 0.287 6.601 -14.429 1.00 0.37 C ATOM 253 C PRO A 27 -0.759 5.497 -14.355 1.00 0.32 C ATOM 254 O PRO A 27 -1.427 5.159 -15.339 1.00 0.36 O ATOM 255 CB PRO A 27 -0.266 7.874 -15.067 1.00 0.46 C ATOM 256 CG PRO A 27 0.937 8.487 -15.692 1.00 0.54 C ATOM 257 CD PRO A 27 1.693 7.327 -16.276 1.00 0.50 C ATOM 0 HA PRO A 27 0.595 6.740 -13.393 1.00 0.37 H new ATOM 0 HB2 PRO A 27 -1.036 7.653 -15.806 1.00 0.46 H new ATOM 0 HB3 PRO A 27 -0.716 8.534 -14.325 1.00 0.46 H new ATOM 0 HG2 PRO A 27 0.660 9.208 -16.462 1.00 0.54 H new ATOM 0 HG3 PRO A 27 1.538 9.021 -14.956 1.00 0.54 H new ATOM 0 HD2 PRO A 27 1.350 7.080 -17.281 1.00 0.50 H new ATOM 0 HD3 PRO A 27 2.762 7.529 -16.345 1.00 0.50 H new ATOM 265 N TYR A 28 -0.861 4.939 -13.166 1.00 0.28 N ATOM 266 CA TYR A 28 -1.819 3.897 -12.842 1.00 0.26 C ATOM 267 C TYR A 28 -3.200 4.487 -12.606 1.00 0.25 C ATOM 268 O TYR A 28 -3.345 5.543 -11.990 1.00 0.37 O ATOM 269 CB TYR A 28 -1.323 3.161 -11.596 1.00 0.30 C ATOM 270 CG TYR A 28 -2.088 1.921 -11.213 1.00 0.37 C ATOM 271 CD1 TYR A 28 -2.755 1.194 -12.181 1.00 0.50 C ATOM 272 CD2 TYR A 28 -2.153 1.480 -9.901 1.00 0.82 C ATOM 273 CE1 TYR A 28 -3.459 0.058 -11.863 1.00 0.64 C ATOM 274 CE2 TYR A 28 -2.859 0.344 -9.568 1.00 1.10 C ATOM 275 CZ TYR A 28 -3.486 -0.356 -10.463 1.00 0.92 C ATOM 276 OH TYR A 28 -4.196 -1.523 -10.228 1.00 1.20 O ATOM 0 H TYR A 28 -0.268 5.202 -12.379 1.00 0.28 H new ATOM 0 HA TYR A 28 -1.903 3.200 -13.676 1.00 0.26 H new ATOM 0 HB2 TYR A 28 -0.280 2.887 -11.752 1.00 0.30 H new ATOM 0 HB3 TYR A 28 -1.348 3.854 -10.755 1.00 0.30 H new ATOM 0 HD1 TYR A 28 -2.722 1.526 -13.208 1.00 0.50 H new ATOM 0 HD2 TYR A 28 -1.643 2.035 -9.128 1.00 0.82 H new ATOM 0 HE1 TYR A 28 -3.975 -0.510 -12.623 1.00 0.64 H new ATOM 0 HE2 TYR A 28 -2.891 0.028 -8.536 1.00 1.10 H new ATOM 0 HH TYR A 28 -5.016 -1.313 -9.734 1.00 1.20 H new ATOM 286 N ASN A 29 -4.208 3.800 -13.112 1.00 0.34 N ATOM 287 CA ASN A 29 -5.583 4.214 -12.957 1.00 0.42 C ATOM 288 C ASN A 29 -6.083 3.790 -11.588 1.00 0.34 C ATOM 289 O ASN A 29 -6.703 2.739 -11.434 1.00 0.44 O ATOM 290 CB ASN A 29 -6.446 3.605 -14.066 1.00 0.67 C ATOM 291 CG ASN A 29 -7.913 3.986 -13.963 1.00 0.73 C ATOM 292 OD1 ASN A 29 -8.792 3.225 -14.364 1.00 1.18 O ATOM 293 ND2 ASN A 29 -8.187 5.161 -13.428 1.00 1.51 N ATOM 0 H ASN A 29 -4.091 2.937 -13.643 1.00 0.34 H new ATOM 0 HA ASN A 29 -5.650 5.299 -13.036 1.00 0.42 H new ATOM 0 HB2 ASN A 29 -6.061 3.926 -15.034 1.00 0.67 H new ATOM 0 HB3 ASN A 29 -6.356 2.519 -14.032 1.00 0.67 H new ATOM 0 HD21 ASN A 29 -9.156 5.466 -13.336 1.00 1.51 H new ATOM 0 HD22 ASN A 29 -7.430 5.764 -13.107 1.00 1.51 H new ATOM 300 N LEU A 30 -5.776 4.601 -10.590 1.00 0.25 N ATOM 301 CA LEU A 30 -6.182 4.329 -9.225 1.00 0.20 C ATOM 302 C LEU A 30 -7.695 4.218 -9.133 1.00 0.19 C ATOM 303 O LEU A 30 -8.231 3.302 -8.505 1.00 0.19 O ATOM 304 CB LEU A 30 -5.719 5.456 -8.300 1.00 0.22 C ATOM 305 CG LEU A 30 -6.026 5.262 -6.836 1.00 0.22 C ATOM 306 CD1 LEU A 30 -5.265 4.075 -6.278 1.00 0.23 C ATOM 307 CD2 LEU A 30 -5.710 6.522 -6.056 1.00 0.28 C ATOM 0 H LEU A 30 -5.241 5.462 -10.704 1.00 0.25 H new ATOM 0 HA LEU A 30 -5.725 3.388 -8.919 1.00 0.20 H new ATOM 0 HB2 LEU A 30 -4.642 5.577 -8.414 1.00 0.22 H new ATOM 0 HB3 LEU A 30 -6.181 6.386 -8.630 1.00 0.22 H new ATOM 0 HG LEU A 30 -7.091 5.055 -6.734 1.00 0.22 H new ATOM 0 HD11 LEU A 30 -5.502 3.955 -5.221 1.00 0.23 H new ATOM 0 HD12 LEU A 30 -5.551 3.173 -6.819 1.00 0.23 H new ATOM 0 HD13 LEU A 30 -4.194 4.243 -6.393 1.00 0.23 H new ATOM 0 HD21 LEU A 30 -5.938 6.364 -5.002 1.00 0.28 H new ATOM 0 HD22 LEU A 30 -4.653 6.763 -6.167 1.00 0.28 H new ATOM 0 HD23 LEU A 30 -6.312 7.347 -6.437 1.00 0.28 H new ATOM 319 N VAL A 31 -8.366 5.141 -9.812 1.00 0.20 N ATOM 320 CA VAL A 31 -9.803 5.364 -9.654 1.00 0.19 C ATOM 321 C VAL A 31 -10.634 4.208 -10.202 1.00 0.20 C ATOM 322 O VAL A 31 -11.862 4.233 -10.147 1.00 0.23 O ATOM 323 CB VAL A 31 -10.226 6.662 -10.351 1.00 0.22 C ATOM 324 CG1 VAL A 31 -11.481 7.257 -9.741 1.00 1.02 C ATOM 325 CG2 VAL A 31 -9.099 7.672 -10.345 1.00 0.87 C ATOM 0 H VAL A 31 -7.928 5.761 -10.493 1.00 0.20 H new ATOM 0 HA VAL A 31 -9.991 5.438 -8.583 1.00 0.19 H new ATOM 0 HB VAL A 31 -10.458 6.406 -11.385 1.00 0.22 H new ATOM 0 HG11 VAL A 31 -11.742 8.175 -10.268 1.00 1.02 H new ATOM 0 HG12 VAL A 31 -12.301 6.544 -9.827 1.00 1.02 H new ATOM 0 HG13 VAL A 31 -11.304 7.480 -8.689 1.00 1.02 H new ATOM 0 HG21 VAL A 31 -9.425 8.584 -10.845 1.00 0.87 H new ATOM 0 HG22 VAL A 31 -8.822 7.902 -9.316 1.00 0.87 H new ATOM 0 HG23 VAL A 31 -8.237 7.259 -10.869 1.00 0.87 H new ATOM 335 N GLN A 32 -9.980 3.194 -10.734 1.00 0.21 N ATOM 336 CA GLN A 32 -10.688 2.005 -11.167 1.00 0.23 C ATOM 337 C GLN A 32 -11.047 1.160 -9.946 1.00 0.22 C ATOM 338 O GLN A 32 -11.792 0.188 -10.038 1.00 0.28 O ATOM 339 CB GLN A 32 -9.845 1.196 -12.158 1.00 0.26 C ATOM 340 CG GLN A 32 -8.688 0.447 -11.511 1.00 0.29 C ATOM 341 CD GLN A 32 -7.803 -0.256 -12.522 1.00 0.35 C ATOM 342 OE1 GLN A 32 -8.031 -1.412 -12.870 1.00 1.02 O ATOM 343 NE2 GLN A 32 -6.780 0.433 -12.991 1.00 0.75 N ATOM 0 H GLN A 32 -8.970 3.168 -10.876 1.00 0.21 H new ATOM 0 HA GLN A 32 -11.602 2.302 -11.680 1.00 0.23 H new ATOM 0 HB2 GLN A 32 -10.489 0.480 -12.669 1.00 0.26 H new ATOM 0 HB3 GLN A 32 -9.450 1.869 -12.919 1.00 0.26 H new ATOM 0 HG2 GLN A 32 -8.086 1.148 -10.933 1.00 0.29 H new ATOM 0 HG3 GLN A 32 -9.084 -0.287 -10.809 1.00 0.29 H new ATOM 0 HE21 GLN A 32 -6.624 1.391 -12.678 1.00 0.75 H new ATOM 0 HE22 GLN A 32 -6.146 0.008 -13.667 1.00 0.75 H new ATOM 352 N HIS A 33 -10.503 1.555 -8.797 1.00 0.17 N ATOM 353 CA HIS A 33 -10.817 0.916 -7.522 1.00 0.16 C ATOM 354 C HIS A 33 -11.848 1.746 -6.797 1.00 0.16 C ATOM 355 O HIS A 33 -11.896 1.800 -5.573 1.00 0.17 O ATOM 356 CB HIS A 33 -9.539 0.732 -6.692 1.00 0.16 C ATOM 357 CG HIS A 33 -8.543 -0.098 -7.429 1.00 0.16 C ATOM 358 ND1 HIS A 33 -8.821 -1.392 -7.787 1.00 0.21 N ATOM 359 CD2 HIS A 33 -7.310 0.187 -7.950 1.00 0.22 C ATOM 360 CE1 HIS A 33 -7.829 -1.879 -8.492 1.00 0.27 C ATOM 361 NE2 HIS A 33 -6.899 -0.944 -8.619 1.00 0.28 N ATOM 0 H HIS A 33 -9.836 2.323 -8.724 1.00 0.17 H new ATOM 0 HA HIS A 33 -11.234 -0.077 -7.691 1.00 0.16 H new ATOM 0 HB2 HIS A 33 -9.107 1.706 -6.460 1.00 0.16 H new ATOM 0 HB3 HIS A 33 -9.783 0.257 -5.742 1.00 0.16 H new ATOM 0 HD1 HIS A 33 -9.671 -1.899 -7.542 1.00 0.21 H new ATOM 0 HD2 HIS A 33 -6.767 1.116 -7.855 1.00 0.22 H new ATOM 0 HE1 HIS A 33 -7.778 -2.877 -8.901 1.00 0.27 H new ATOM 370 N LYS A 34 -12.662 2.415 -7.592 1.00 0.19 N ATOM 371 CA LYS A 34 -13.773 3.173 -7.083 1.00 0.19 C ATOM 372 C LYS A 34 -15.016 2.311 -7.067 1.00 0.21 C ATOM 373 O LYS A 34 -15.583 1.996 -8.114 1.00 0.33 O ATOM 374 CB LYS A 34 -14.012 4.396 -7.951 1.00 0.22 C ATOM 375 CG LYS A 34 -13.160 5.571 -7.567 1.00 0.28 C ATOM 376 CD LYS A 34 -14.008 6.772 -7.207 1.00 0.69 C ATOM 377 CE LYS A 34 -14.905 7.162 -8.361 1.00 1.01 C ATOM 378 NZ LYS A 34 -15.631 8.431 -8.092 1.00 1.56 N ATOM 0 H LYS A 34 -12.566 2.444 -8.607 1.00 0.19 H new ATOM 0 HA LYS A 34 -13.544 3.497 -6.068 1.00 0.19 H new ATOM 0 HB2 LYS A 34 -13.816 4.138 -8.992 1.00 0.22 H new ATOM 0 HB3 LYS A 34 -15.062 4.680 -7.885 1.00 0.22 H new ATOM 0 HG2 LYS A 34 -12.528 5.303 -6.721 1.00 0.28 H new ATOM 0 HG3 LYS A 34 -12.496 5.827 -8.393 1.00 0.28 H new ATOM 0 HD2 LYS A 34 -14.614 6.545 -6.330 1.00 0.69 H new ATOM 0 HD3 LYS A 34 -13.364 7.611 -6.941 1.00 0.69 H new ATOM 0 HE2 LYS A 34 -14.307 7.270 -9.266 1.00 1.01 H new ATOM 0 HE3 LYS A 34 -15.624 6.364 -8.548 1.00 1.01 H new ATOM 0 HZ1 LYS A 34 -16.235 8.665 -8.906 1.00 1.56 H new ATOM 0 HZ2 LYS A 34 -16.221 8.320 -7.243 1.00 1.56 H new ATOM 0 HZ3 LYS A 34 -14.945 9.198 -7.939 1.00 1.56 H new ATOM 392 N GLY A 35 -15.447 1.948 -5.886 1.00 0.18 N ATOM 393 CA GLY A 35 -16.585 1.083 -5.748 1.00 0.20 C ATOM 394 C GLY A 35 -16.286 -0.073 -4.830 1.00 0.17 C ATOM 395 O GLY A 35 -17.141 -0.478 -4.042 1.00 0.20 O ATOM 0 H GLY A 35 -15.024 2.240 -5.005 1.00 0.18 H new ATOM 0 HA2 GLY A 35 -17.430 1.650 -5.358 1.00 0.20 H new ATOM 0 HA3 GLY A 35 -16.879 0.706 -6.728 1.00 0.20 H new ATOM 399 N SER A 36 -15.073 -0.604 -4.919 1.00 0.16 N ATOM 400 CA SER A 36 -14.623 -1.590 -3.981 1.00 0.16 C ATOM 401 C SER A 36 -13.299 -1.135 -3.418 1.00 0.14 C ATOM 402 O SER A 36 -12.417 -0.713 -4.164 1.00 0.16 O ATOM 403 CB SER A 36 -14.470 -2.946 -4.658 1.00 0.20 C ATOM 404 OG SER A 36 -15.678 -3.337 -5.289 1.00 0.29 O ATOM 0 H SER A 36 -14.392 -0.359 -5.638 1.00 0.16 H new ATOM 0 HA SER A 36 -15.355 -1.699 -3.181 1.00 0.16 H new ATOM 0 HB2 SER A 36 -13.668 -2.900 -5.395 1.00 0.20 H new ATOM 0 HB3 SER A 36 -14.182 -3.695 -3.920 1.00 0.20 H new ATOM 0 HG SER A 36 -15.486 -3.654 -6.196 1.00 0.29 H new ATOM 410 N PRO A 37 -13.178 -1.166 -2.091 1.00 0.12 N ATOM 411 CA PRO A 37 -11.957 -0.833 -1.375 1.00 0.12 C ATOM 412 C PRO A 37 -10.717 -1.428 -2.010 1.00 0.12 C ATOM 413 O PRO A 37 -10.780 -2.409 -2.740 1.00 0.15 O ATOM 414 CB PRO A 37 -12.181 -1.441 0.019 1.00 0.15 C ATOM 415 CG PRO A 37 -13.456 -2.192 -0.080 1.00 0.18 C ATOM 416 CD PRO A 37 -14.233 -1.517 -1.158 1.00 0.15 C ATOM 0 HA PRO A 37 -11.781 0.243 -1.370 1.00 0.12 H new ATOM 0 HB2 PRO A 37 -11.358 -2.099 0.298 1.00 0.15 H new ATOM 0 HB3 PRO A 37 -12.240 -0.664 0.782 1.00 0.15 H new ATOM 0 HG2 PRO A 37 -13.277 -3.239 -0.323 1.00 0.18 H new ATOM 0 HG3 PRO A 37 -13.998 -2.172 0.866 1.00 0.18 H new ATOM 0 HD2 PRO A 37 -14.975 -2.178 -1.606 1.00 0.15 H new ATOM 0 HD3 PRO A 37 -14.767 -0.640 -0.792 1.00 0.15 H new ATOM 424 N LEU A 38 -9.603 -0.817 -1.706 1.00 0.14 N ATOM 425 CA LEU A 38 -8.313 -1.214 -2.221 1.00 0.13 C ATOM 426 C LEU A 38 -7.301 -1.008 -1.096 1.00 0.13 C ATOM 427 O LEU A 38 -7.452 -0.111 -0.291 1.00 0.20 O ATOM 428 CB LEU A 38 -7.936 -0.392 -3.467 1.00 0.16 C ATOM 429 CG LEU A 38 -8.040 1.129 -3.359 1.00 0.20 C ATOM 430 CD1 LEU A 38 -7.357 1.782 -4.541 1.00 0.31 C ATOM 431 CD2 LEU A 38 -9.490 1.591 -3.304 1.00 0.26 C ATOM 0 H LEU A 38 -9.563 -0.012 -1.081 1.00 0.14 H new ATOM 0 HA LEU A 38 -8.329 -2.258 -2.535 1.00 0.13 H new ATOM 0 HB2 LEU A 38 -6.910 -0.642 -3.739 1.00 0.16 H new ATOM 0 HB3 LEU A 38 -8.572 -0.716 -4.291 1.00 0.16 H new ATOM 0 HG LEU A 38 -7.548 1.425 -2.432 1.00 0.20 H new ATOM 0 HD11 LEU A 38 -7.437 2.866 -4.454 1.00 0.31 H new ATOM 0 HD12 LEU A 38 -6.305 1.496 -4.557 1.00 0.31 H new ATOM 0 HD13 LEU A 38 -7.836 1.456 -5.464 1.00 0.31 H new ATOM 0 HD21 LEU A 38 -9.523 2.678 -3.227 1.00 0.26 H new ATOM 0 HD22 LEU A 38 -10.007 1.275 -4.210 1.00 0.26 H new ATOM 0 HD23 LEU A 38 -9.979 1.151 -2.435 1.00 0.26 H new ATOM 443 N LEU A 39 -6.324 -1.865 -0.989 1.00 0.18 N ATOM 444 CA LEU A 39 -5.291 -1.720 0.010 1.00 0.19 C ATOM 445 C LEU A 39 -4.009 -1.304 -0.664 1.00 0.18 C ATOM 446 O LEU A 39 -3.443 -2.055 -1.457 1.00 0.21 O ATOM 447 CB LEU A 39 -5.040 -3.030 0.744 1.00 0.23 C ATOM 448 CG LEU A 39 -5.836 -3.301 2.038 1.00 0.35 C ATOM 449 CD1 LEU A 39 -5.283 -2.531 3.211 1.00 1.10 C ATOM 450 CD2 LEU A 39 -7.295 -2.966 1.877 1.00 1.19 C ATOM 0 H LEU A 39 -6.217 -2.683 -1.588 1.00 0.18 H new ATOM 0 HA LEU A 39 -5.620 -0.970 0.729 1.00 0.19 H new ATOM 0 HB2 LEU A 39 -5.244 -3.846 0.050 1.00 0.23 H new ATOM 0 HB3 LEU A 39 -3.979 -3.077 0.989 1.00 0.23 H new ATOM 0 HG LEU A 39 -5.734 -4.368 2.235 1.00 0.35 H new ATOM 0 HD11 LEU A 39 -5.873 -2.751 4.101 1.00 1.10 H new ATOM 0 HD12 LEU A 39 -4.246 -2.822 3.381 1.00 1.10 H new ATOM 0 HD13 LEU A 39 -5.330 -1.463 3.000 1.00 1.10 H new ATOM 0 HD21 LEU A 39 -7.820 -3.171 2.810 1.00 1.19 H new ATOM 0 HD22 LEU A 39 -7.400 -1.911 1.625 1.00 1.19 H new ATOM 0 HD23 LEU A 39 -7.722 -3.574 1.079 1.00 1.19 H new ATOM 462 N ILE A 40 -3.570 -0.108 -0.384 1.00 0.19 N ATOM 463 CA ILE A 40 -2.318 0.361 -0.933 1.00 0.20 C ATOM 464 C ILE A 40 -1.206 0.162 0.085 1.00 0.18 C ATOM 465 O ILE A 40 -1.313 0.611 1.223 1.00 0.20 O ATOM 466 CB ILE A 40 -2.420 1.831 -1.337 1.00 0.23 C ATOM 467 CG1 ILE A 40 -3.870 2.180 -1.657 1.00 0.30 C ATOM 468 CG2 ILE A 40 -1.535 2.116 -2.544 1.00 0.37 C ATOM 469 CD1 ILE A 40 -4.003 3.565 -2.215 1.00 0.35 C ATOM 0 H ILE A 40 -4.053 0.560 0.217 1.00 0.19 H new ATOM 0 HA ILE A 40 -2.088 -0.217 -1.828 1.00 0.20 H new ATOM 0 HB ILE A 40 -2.078 2.447 -0.505 1.00 0.23 H new ATOM 0 HG12 ILE A 40 -4.267 1.461 -2.373 1.00 0.30 H new ATOM 0 HG13 ILE A 40 -4.472 2.094 -0.752 1.00 0.30 H new ATOM 0 HG21 ILE A 40 -1.620 3.168 -2.818 1.00 0.37 H new ATOM 0 HG22 ILE A 40 -0.498 1.888 -2.297 1.00 0.37 H new ATOM 0 HG23 ILE A 40 -1.853 1.496 -3.382 1.00 0.37 H new ATOM 0 HD11 ILE A 40 -5.052 3.772 -2.429 1.00 0.35 H new ATOM 0 HD12 ILE A 40 -3.631 4.287 -1.488 1.00 0.35 H new ATOM 0 HD13 ILE A 40 -3.423 3.644 -3.134 1.00 0.35 H new ATOM 481 N TYR A 41 -0.152 -0.527 -0.321 1.00 0.18 N ATOM 482 CA TYR A 41 0.894 -0.937 0.598 1.00 0.19 C ATOM 483 C TYR A 41 2.178 -0.138 0.379 1.00 0.20 C ATOM 484 O TYR A 41 2.411 0.388 -0.692 1.00 0.27 O ATOM 485 CB TYR A 41 1.224 -2.433 0.413 1.00 0.20 C ATOM 486 CG TYR A 41 0.132 -3.421 0.783 1.00 0.20 C ATOM 487 CD1 TYR A 41 -1.118 -3.361 0.198 1.00 0.27 C ATOM 488 CD2 TYR A 41 0.373 -4.447 1.698 1.00 0.29 C ATOM 489 CE1 TYR A 41 -2.094 -4.288 0.507 1.00 0.32 C ATOM 490 CE2 TYR A 41 -0.607 -5.375 2.014 1.00 0.35 C ATOM 491 CZ TYR A 41 -1.836 -5.285 1.412 1.00 0.33 C ATOM 492 OH TYR A 41 -2.810 -6.209 1.696 1.00 0.42 O ATOM 0 H TYR A 41 0.001 -0.815 -1.287 1.00 0.18 H new ATOM 0 HA TYR A 41 0.519 -0.753 1.605 1.00 0.19 H new ATOM 0 HB2 TYR A 41 1.492 -2.596 -0.631 1.00 0.20 H new ATOM 0 HB3 TYR A 41 2.108 -2.663 1.008 1.00 0.20 H new ATOM 0 HD1 TYR A 41 -1.335 -2.577 -0.512 1.00 0.27 H new ATOM 0 HD2 TYR A 41 1.342 -4.519 2.169 1.00 0.29 H new ATOM 0 HE1 TYR A 41 -3.063 -4.227 0.034 1.00 0.32 H new ATOM 0 HE2 TYR A 41 -0.405 -6.161 2.727 1.00 0.35 H new ATOM 0 HH TYR A 41 -3.675 -5.884 1.369 1.00 0.42 H new ATOM 502 N ASN A 42 2.992 -0.053 1.414 1.00 0.28 N ATOM 503 CA ASN A 42 4.385 0.393 1.305 1.00 0.34 C ATOM 504 C ASN A 42 5.264 -0.836 1.438 1.00 0.37 C ATOM 505 O ASN A 42 5.282 -1.466 2.478 1.00 0.54 O ATOM 506 CB ASN A 42 4.722 1.368 2.434 1.00 0.46 C ATOM 507 CG ASN A 42 6.217 1.518 2.654 1.00 1.50 C ATOM 508 OD1 ASN A 42 7.019 1.355 1.740 1.00 2.27 O ATOM 509 ND2 ASN A 42 6.601 1.837 3.871 1.00 2.35 N ATOM 0 H ASN A 42 2.712 -0.291 2.365 1.00 0.28 H new ATOM 0 HA ASN A 42 4.544 0.898 0.352 1.00 0.34 H new ATOM 0 HB2 ASN A 42 4.293 2.344 2.206 1.00 0.46 H new ATOM 0 HB3 ASN A 42 4.256 1.023 3.357 1.00 0.46 H new ATOM 0 HD21 ASN A 42 7.593 1.956 4.078 1.00 2.35 H new ATOM 0 HD22 ASN A 42 5.907 1.965 4.608 1.00 2.35 H new ATOM 516 N VAL A 43 5.984 -1.184 0.401 1.00 0.36 N ATOM 517 CA VAL A 43 6.699 -2.448 0.387 1.00 0.38 C ATOM 518 C VAL A 43 8.164 -2.269 0.070 1.00 0.42 C ATOM 519 O VAL A 43 8.580 -1.241 -0.436 1.00 0.50 O ATOM 520 CB VAL A 43 6.091 -3.424 -0.632 1.00 0.39 C ATOM 521 CG1 VAL A 43 4.666 -3.757 -0.254 1.00 1.03 C ATOM 522 CG2 VAL A 43 6.146 -2.845 -2.031 1.00 0.98 C ATOM 0 H VAL A 43 6.094 -0.619 -0.441 1.00 0.36 H new ATOM 0 HA VAL A 43 6.603 -2.860 1.392 1.00 0.38 H new ATOM 0 HB VAL A 43 6.679 -4.342 -0.620 1.00 0.39 H new ATOM 0 HG11 VAL A 43 4.248 -4.449 -0.985 1.00 1.03 H new ATOM 0 HG12 VAL A 43 4.650 -4.218 0.733 1.00 1.03 H new ATOM 0 HG13 VAL A 43 4.071 -2.844 -0.238 1.00 1.03 H new ATOM 0 HG21 VAL A 43 5.710 -3.553 -2.735 1.00 0.98 H new ATOM 0 HG22 VAL A 43 5.584 -1.911 -2.061 1.00 0.98 H new ATOM 0 HG23 VAL A 43 7.183 -2.653 -2.305 1.00 0.98 H new ATOM 532 N ALA A 44 8.956 -3.250 0.437 1.00 0.50 N ATOM 533 CA ALA A 44 10.306 -3.333 -0.064 1.00 0.59 C ATOM 534 C ALA A 44 10.275 -4.095 -1.382 1.00 0.58 C ATOM 535 O ALA A 44 9.360 -4.886 -1.618 1.00 0.88 O ATOM 536 CB ALA A 44 11.216 -4.019 0.943 1.00 0.83 C ATOM 0 H ALA A 44 8.690 -3.998 1.078 1.00 0.50 H new ATOM 0 HA ALA A 44 10.707 -2.332 -0.225 1.00 0.59 H new ATOM 0 HB1 ALA A 44 12.229 -4.070 0.543 1.00 0.83 H new ATOM 0 HB2 ALA A 44 11.222 -3.452 1.874 1.00 0.83 H new ATOM 0 HB3 ALA A 44 10.851 -5.028 1.135 1.00 0.83 H new ATOM 542 N SER A 45 11.247 -3.846 -2.241 1.00 0.57 N ATOM 543 CA SER A 45 11.325 -4.526 -3.528 1.00 0.63 C ATOM 544 C SER A 45 11.822 -5.964 -3.336 1.00 1.01 C ATOM 545 O SER A 45 11.725 -6.502 -2.234 1.00 1.78 O ATOM 546 CB SER A 45 12.232 -3.737 -4.470 1.00 0.73 C ATOM 547 OG SER A 45 11.716 -2.435 -4.690 1.00 1.62 O ATOM 0 H SER A 45 11.997 -3.176 -2.073 1.00 0.57 H new ATOM 0 HA SER A 45 10.333 -4.578 -3.977 1.00 0.63 H new ATOM 0 HB2 SER A 45 13.234 -3.669 -4.046 1.00 0.73 H new ATOM 0 HB3 SER A 45 12.323 -4.263 -5.420 1.00 0.73 H new ATOM 0 HG SER A 45 12.312 -1.945 -5.294 1.00 1.62 H new ATOM 553 N LYS A 46 12.349 -6.597 -4.388 1.00 1.32 N ATOM 554 CA LYS A 46 12.827 -7.978 -4.265 1.00 1.69 C ATOM 555 C LYS A 46 13.963 -8.055 -3.241 1.00 1.14 C ATOM 556 O LYS A 46 14.295 -9.125 -2.726 1.00 1.47 O ATOM 557 CB LYS A 46 13.289 -8.535 -5.616 1.00 2.68 C ATOM 558 CG LYS A 46 13.365 -10.054 -5.637 1.00 3.45 C ATOM 559 CD LYS A 46 13.852 -10.586 -6.973 1.00 4.39 C ATOM 560 CE LYS A 46 13.806 -12.106 -7.012 1.00 5.19 C ATOM 561 NZ LYS A 46 14.567 -12.718 -5.889 1.00 5.84 N ATOM 0 H LYS A 46 12.455 -6.187 -5.316 1.00 1.32 H new ATOM 0 HA LYS A 46 11.994 -8.591 -3.921 1.00 1.69 H new ATOM 0 HB2 LYS A 46 12.604 -8.200 -6.395 1.00 2.68 H new ATOM 0 HB3 LYS A 46 14.270 -8.124 -5.856 1.00 2.68 H new ATOM 0 HG2 LYS A 46 14.035 -10.393 -4.847 1.00 3.45 H new ATOM 0 HG3 LYS A 46 12.380 -10.468 -5.420 1.00 3.45 H new ATOM 0 HD2 LYS A 46 13.235 -10.181 -7.775 1.00 4.39 H new ATOM 0 HD3 LYS A 46 14.872 -10.246 -7.152 1.00 4.39 H new ATOM 0 HE2 LYS A 46 12.769 -12.438 -6.970 1.00 5.19 H new ATOM 0 HE3 LYS A 46 14.215 -12.456 -7.960 1.00 5.19 H new ATOM 0 HZ1 LYS A 46 14.668 -13.740 -6.054 1.00 5.84 H new ATOM 0 HZ2 LYS A 46 15.509 -12.282 -5.830 1.00 5.84 H new ATOM 0 HZ3 LYS A 46 14.056 -12.560 -4.997 1.00 5.84 H new ATOM 575 N CYS A 47 14.532 -6.899 -2.940 1.00 1.21 N ATOM 576 CA CYS A 47 15.475 -6.763 -1.854 1.00 1.53 C ATOM 577 C CYS A 47 14.798 -5.969 -0.747 1.00 1.99 C ATOM 578 O CYS A 47 14.199 -4.924 -1.006 1.00 2.46 O ATOM 579 CB CYS A 47 16.745 -6.056 -2.328 1.00 2.04 C ATOM 580 SG CYS A 47 17.988 -5.812 -1.040 1.00 3.55 S ATOM 0 H CYS A 47 14.350 -6.032 -3.445 1.00 1.21 H new ATOM 0 HA CYS A 47 15.770 -7.745 -1.485 1.00 1.53 H new ATOM 0 HB2 CYS A 47 17.188 -6.635 -3.138 1.00 2.04 H new ATOM 0 HB3 CYS A 47 16.473 -5.085 -2.742 1.00 2.04 H new ATOM 0 HG CYS A 47 18.650 -6.916 -0.861 1.00 3.55 H new ATOM 586 N GLY A 48 14.860 -6.482 0.465 1.00 2.39 N ATOM 587 CA GLY A 48 14.149 -5.880 1.570 1.00 2.91 C ATOM 588 C GLY A 48 13.699 -6.930 2.554 1.00 2.40 C ATOM 589 O GLY A 48 14.527 -7.680 3.074 1.00 2.46 O ATOM 0 H GLY A 48 15.396 -7.315 0.708 1.00 2.39 H new ATOM 0 HA2 GLY A 48 14.793 -5.157 2.072 1.00 2.91 H new ATOM 0 HA3 GLY A 48 13.284 -5.331 1.196 1.00 2.91 H new ATOM 593 N TYR A 49 12.395 -7.011 2.796 1.00 2.15 N ATOM 594 CA TYR A 49 11.864 -8.021 3.695 1.00 1.79 C ATOM 595 C TYR A 49 10.347 -8.159 3.561 1.00 1.42 C ATOM 596 O TYR A 49 9.596 -7.199 3.752 1.00 1.67 O ATOM 597 CB TYR A 49 12.237 -7.694 5.141 1.00 2.10 C ATOM 598 CG TYR A 49 12.020 -8.858 6.080 1.00 2.40 C ATOM 599 CD1 TYR A 49 13.013 -9.806 6.292 1.00 2.66 C ATOM 600 CD2 TYR A 49 10.826 -8.994 6.772 1.00 3.01 C ATOM 601 CE1 TYR A 49 12.819 -10.859 7.164 1.00 3.26 C ATOM 602 CE2 TYR A 49 10.623 -10.041 7.649 1.00 3.74 C ATOM 603 CZ TYR A 49 11.621 -11.027 7.772 1.00 3.76 C ATOM 604 OH TYR A 49 11.426 -12.012 8.718 1.00 4.63 O ATOM 0 H TYR A 49 11.694 -6.394 2.385 1.00 2.15 H new ATOM 0 HA TYR A 49 12.310 -8.976 3.416 1.00 1.79 H new ATOM 0 HB2 TYR A 49 13.283 -7.391 5.182 1.00 2.10 H new ATOM 0 HB3 TYR A 49 11.645 -6.844 5.481 1.00 2.10 H new ATOM 0 HD1 TYR A 49 13.952 -9.718 5.766 1.00 2.66 H new ATOM 0 HD2 TYR A 49 10.041 -8.268 6.622 1.00 3.01 H new ATOM 0 HE1 TYR A 49 13.625 -11.550 7.362 1.00 3.26 H new ATOM 0 HE2 TYR A 49 9.715 -10.103 8.230 1.00 3.74 H new ATOM 0 HH TYR A 49 10.502 -11.976 9.042 1.00 4.63 H new ATOM 614 N THR A 50 9.913 -9.364 3.221 1.00 1.05 N ATOM 615 CA THR A 50 8.498 -9.698 3.151 1.00 0.81 C ATOM 616 C THR A 50 8.028 -10.285 4.494 1.00 0.77 C ATOM 617 O THR A 50 8.204 -11.471 4.758 1.00 1.44 O ATOM 618 CB THR A 50 8.249 -10.701 2.007 1.00 1.09 C ATOM 619 OG1 THR A 50 9.051 -11.878 2.183 1.00 1.93 O ATOM 620 CG2 THR A 50 8.583 -10.060 0.669 1.00 1.87 C ATOM 0 H THR A 50 10.533 -10.139 2.986 1.00 1.05 H new ATOM 0 HA THR A 50 7.927 -8.792 2.949 1.00 0.81 H new ATOM 0 HB THR A 50 7.196 -10.983 2.024 1.00 1.09 H new ATOM 0 HG1 THR A 50 9.001 -12.172 3.117 1.00 1.93 H new ATOM 0 HG21 THR A 50 8.404 -10.777 -0.133 1.00 1.87 H new ATOM 0 HG22 THR A 50 7.954 -9.183 0.519 1.00 1.87 H new ATOM 0 HG23 THR A 50 9.631 -9.761 0.660 1.00 1.87 H new ATOM 628 N LYS A 51 7.443 -9.443 5.352 1.00 0.61 N ATOM 629 CA LYS A 51 7.028 -9.866 6.697 1.00 0.56 C ATOM 630 C LYS A 51 5.908 -10.910 6.647 1.00 0.76 C ATOM 631 O LYS A 51 5.619 -11.578 7.638 1.00 1.55 O ATOM 632 CB LYS A 51 6.563 -8.648 7.492 1.00 0.59 C ATOM 633 CG LYS A 51 6.246 -8.939 8.952 1.00 1.22 C ATOM 634 CD LYS A 51 7.502 -9.113 9.790 1.00 1.39 C ATOM 635 CE LYS A 51 8.357 -7.857 9.768 1.00 1.46 C ATOM 636 NZ LYS A 51 9.441 -7.895 10.786 1.00 2.01 N ATOM 0 H LYS A 51 7.245 -8.465 5.141 1.00 0.61 H new ATOM 0 HA LYS A 51 7.887 -10.327 7.184 1.00 0.56 H new ATOM 0 HB2 LYS A 51 7.336 -7.881 7.446 1.00 0.59 H new ATOM 0 HB3 LYS A 51 5.675 -8.234 7.015 1.00 0.59 H new ATOM 0 HG2 LYS A 51 5.648 -8.124 9.361 1.00 1.22 H new ATOM 0 HG3 LYS A 51 5.640 -9.843 9.017 1.00 1.22 H new ATOM 0 HD2 LYS A 51 7.227 -9.350 10.818 1.00 1.39 H new ATOM 0 HD3 LYS A 51 8.080 -9.956 9.412 1.00 1.39 H new ATOM 0 HE2 LYS A 51 8.796 -7.736 8.778 1.00 1.46 H new ATOM 0 HE3 LYS A 51 7.725 -6.987 9.945 1.00 1.46 H new ATOM 0 HZ1 LYS A 51 9.997 -7.018 10.733 1.00 2.01 H new ATOM 0 HZ2 LYS A 51 9.024 -7.984 11.734 1.00 2.01 H new ATOM 0 HZ3 LYS A 51 10.061 -8.710 10.603 1.00 2.01 H new ATOM 650 N GLY A 52 5.306 -11.062 5.481 1.00 0.45 N ATOM 651 CA GLY A 52 4.134 -11.906 5.344 1.00 0.51 C ATOM 652 C GLY A 52 3.054 -11.178 4.586 1.00 0.41 C ATOM 653 O GLY A 52 2.104 -11.776 4.076 1.00 0.41 O ATOM 0 H GLY A 52 5.609 -10.613 4.617 1.00 0.45 H new ATOM 0 HA2 GLY A 52 4.398 -12.826 4.822 1.00 0.51 H new ATOM 0 HA3 GLY A 52 3.767 -12.193 6.329 1.00 0.51 H new ATOM 657 N GLY A 53 3.225 -9.864 4.500 1.00 0.44 N ATOM 658 CA GLY A 53 2.323 -9.035 3.733 1.00 0.50 C ATOM 659 C GLY A 53 2.314 -9.397 2.265 1.00 0.36 C ATOM 660 O GLY A 53 1.423 -8.994 1.542 1.00 0.32 O ATOM 0 H GLY A 53 3.983 -9.356 4.955 1.00 0.44 H new ATOM 0 HA2 GLY A 53 1.314 -9.132 4.135 1.00 0.50 H new ATOM 0 HA3 GLY A 53 2.611 -7.990 3.845 1.00 0.50 H new ATOM 664 N TYR A 54 3.309 -10.152 1.817 1.00 0.37 N ATOM 665 CA TYR A 54 3.369 -10.590 0.430 1.00 0.36 C ATOM 666 C TYR A 54 2.252 -11.586 0.154 1.00 0.26 C ATOM 667 O TYR A 54 1.400 -11.357 -0.702 1.00 0.25 O ATOM 668 CB TYR A 54 4.718 -11.238 0.154 1.00 0.45 C ATOM 669 CG TYR A 54 5.166 -11.175 -1.287 1.00 0.41 C ATOM 670 CD1 TYR A 54 4.262 -11.092 -2.346 1.00 0.45 C ATOM 671 CD2 TYR A 54 6.511 -11.196 -1.577 1.00 0.53 C ATOM 672 CE1 TYR A 54 4.706 -11.036 -3.656 1.00 0.46 C ATOM 673 CE2 TYR A 54 6.966 -11.146 -2.865 1.00 0.65 C ATOM 674 CZ TYR A 54 6.065 -11.067 -3.908 1.00 0.56 C ATOM 675 OH TYR A 54 6.522 -11.029 -5.201 1.00 0.70 O ATOM 0 H TYR A 54 4.085 -10.474 2.395 1.00 0.37 H new ATOM 0 HA TYR A 54 3.246 -9.727 -0.224 1.00 0.36 H new ATOM 0 HB2 TYR A 54 5.472 -10.755 0.776 1.00 0.45 H new ATOM 0 HB3 TYR A 54 4.673 -12.283 0.461 1.00 0.45 H new ATOM 0 HD1 TYR A 54 3.202 -11.071 -2.141 1.00 0.45 H new ATOM 0 HD2 TYR A 54 7.224 -11.253 -0.768 1.00 0.53 H new ATOM 0 HE1 TYR A 54 4.000 -10.969 -4.471 1.00 0.46 H new ATOM 0 HE2 TYR A 54 8.027 -11.168 -3.066 1.00 0.65 H new ATOM 0 HH TYR A 54 7.502 -11.057 -5.203 1.00 0.70 H new ATOM 685 N GLU A 55 2.276 -12.691 0.893 1.00 0.25 N ATOM 686 CA GLU A 55 1.216 -13.696 0.852 1.00 0.27 C ATOM 687 C GLU A 55 -0.133 -13.049 1.058 1.00 0.22 C ATOM 688 O GLU A 55 -1.148 -13.470 0.501 1.00 0.25 O ATOM 689 CB GLU A 55 1.433 -14.728 1.958 1.00 0.36 C ATOM 690 CG GLU A 55 2.466 -15.782 1.625 1.00 1.14 C ATOM 691 CD GLU A 55 3.836 -15.211 1.300 1.00 1.92 C ATOM 692 OE1 GLU A 55 4.264 -14.240 1.964 1.00 2.61 O ATOM 693 OE2 GLU A 55 4.494 -15.739 0.380 1.00 2.39 O ATOM 0 H GLU A 55 3.032 -12.916 1.539 1.00 0.25 H new ATOM 0 HA GLU A 55 1.244 -14.180 -0.124 1.00 0.27 H new ATOM 0 HB2 GLU A 55 1.737 -14.211 2.868 1.00 0.36 H new ATOM 0 HB3 GLU A 55 0.484 -15.220 2.173 1.00 0.36 H new ATOM 0 HG2 GLU A 55 2.558 -16.467 2.468 1.00 1.14 H new ATOM 0 HG3 GLU A 55 2.115 -16.367 0.775 1.00 1.14 H new ATOM 700 N THR A 56 -0.117 -12.003 1.849 1.00 0.25 N ATOM 701 CA THR A 56 -1.313 -11.310 2.229 1.00 0.24 C ATOM 702 C THR A 56 -1.855 -10.509 1.067 1.00 0.21 C ATOM 703 O THR A 56 -2.966 -10.737 0.596 1.00 0.22 O ATOM 704 CB THR A 56 -1.011 -10.389 3.423 1.00 0.26 C ATOM 705 OG1 THR A 56 -0.692 -11.188 4.568 1.00 0.33 O ATOM 706 CG2 THR A 56 -2.173 -9.465 3.732 1.00 0.25 C ATOM 0 H THR A 56 0.736 -11.610 2.247 1.00 0.25 H new ATOM 0 HA THR A 56 -2.071 -12.038 2.519 1.00 0.24 H new ATOM 0 HB THR A 56 -0.160 -9.760 3.162 1.00 0.26 H new ATOM 0 HG1 THR A 56 0.248 -11.462 4.524 1.00 0.33 H new ATOM 0 HG21 THR A 56 -1.918 -8.832 4.582 1.00 0.25 H new ATOM 0 HG22 THR A 56 -2.382 -8.840 2.864 1.00 0.25 H new ATOM 0 HG23 THR A 56 -3.055 -10.058 3.973 1.00 0.25 H new ATOM 714 N ALA A 57 -1.033 -9.607 0.594 1.00 0.19 N ATOM 715 CA ALA A 57 -1.375 -8.729 -0.492 1.00 0.20 C ATOM 716 C ALA A 57 -1.743 -9.520 -1.743 1.00 0.19 C ATOM 717 O ALA A 57 -2.712 -9.197 -2.431 1.00 0.22 O ATOM 718 CB ALA A 57 -0.193 -7.826 -0.756 1.00 0.22 C ATOM 0 H ALA A 57 -0.092 -9.461 0.960 1.00 0.19 H new ATOM 0 HA ALA A 57 -2.248 -8.134 -0.224 1.00 0.20 H new ATOM 0 HB1 ALA A 57 -0.428 -7.149 -1.577 1.00 0.22 H new ATOM 0 HB2 ALA A 57 0.029 -7.246 0.140 1.00 0.22 H new ATOM 0 HB3 ALA A 57 0.675 -8.430 -1.021 1.00 0.22 H new ATOM 724 N THR A 58 -0.970 -10.570 -2.016 1.00 0.17 N ATOM 725 CA THR A 58 -1.183 -11.397 -3.195 1.00 0.17 C ATOM 726 C THR A 58 -2.582 -12.012 -3.170 1.00 0.17 C ATOM 727 O THR A 58 -3.380 -11.842 -4.098 1.00 0.19 O ATOM 728 CB THR A 58 -0.146 -12.535 -3.267 1.00 0.20 C ATOM 729 OG1 THR A 58 1.179 -11.994 -3.273 1.00 0.24 O ATOM 730 CG2 THR A 58 -0.350 -13.394 -4.506 1.00 0.26 C ATOM 0 H THR A 58 -0.188 -10.866 -1.432 1.00 0.17 H new ATOM 0 HA THR A 58 -1.075 -10.755 -4.069 1.00 0.17 H new ATOM 0 HB THR A 58 -0.282 -13.164 -2.387 1.00 0.20 H new ATOM 0 HG1 THR A 58 1.539 -12.000 -2.361 1.00 0.24 H new ATOM 0 HG21 THR A 58 0.398 -14.187 -4.526 1.00 0.26 H new ATOM 0 HG22 THR A 58 -1.346 -13.835 -4.483 1.00 0.26 H new ATOM 0 HG23 THR A 58 -0.248 -12.776 -5.398 1.00 0.26 H new ATOM 738 N THR A 59 -2.862 -12.705 -2.075 1.00 0.16 N ATOM 739 CA THR A 59 -4.114 -13.417 -1.888 1.00 0.17 C ATOM 740 C THR A 59 -5.291 -12.454 -1.780 1.00 0.16 C ATOM 741 O THR A 59 -6.368 -12.723 -2.300 1.00 0.19 O ATOM 742 CB THR A 59 -4.042 -14.294 -0.621 1.00 0.20 C ATOM 743 OG1 THR A 59 -2.922 -15.186 -0.716 1.00 0.48 O ATOM 744 CG2 THR A 59 -5.319 -15.096 -0.422 1.00 0.46 C ATOM 0 H THR A 59 -2.220 -12.788 -1.287 1.00 0.16 H new ATOM 0 HA THR A 59 -4.270 -14.050 -2.761 1.00 0.17 H new ATOM 0 HB THR A 59 -3.922 -13.635 0.239 1.00 0.20 H new ATOM 0 HG1 THR A 59 -2.131 -14.761 -0.324 1.00 0.48 H new ATOM 0 HG21 THR A 59 -5.231 -15.702 0.480 1.00 0.46 H new ATOM 0 HG22 THR A 59 -6.164 -14.415 -0.321 1.00 0.46 H new ATOM 0 HG23 THR A 59 -5.478 -15.747 -1.282 1.00 0.46 H new ATOM 752 N LEU A 60 -5.067 -11.317 -1.137 1.00 0.13 N ATOM 753 CA LEU A 60 -6.112 -10.343 -0.914 1.00 0.13 C ATOM 754 C LEU A 60 -6.578 -9.767 -2.223 1.00 0.13 C ATOM 755 O LEU A 60 -7.774 -9.701 -2.504 1.00 0.15 O ATOM 756 CB LEU A 60 -5.591 -9.246 -0.014 1.00 0.13 C ATOM 757 CG LEU A 60 -5.721 -9.553 1.463 1.00 0.14 C ATOM 758 CD1 LEU A 60 -5.137 -8.427 2.287 1.00 0.43 C ATOM 759 CD2 LEU A 60 -7.184 -9.772 1.806 1.00 0.35 C ATOM 0 H LEU A 60 -4.158 -11.050 -0.759 1.00 0.13 H new ATOM 0 HA LEU A 60 -6.960 -10.830 -0.433 1.00 0.13 H new ATOM 0 HB2 LEU A 60 -4.542 -9.066 -0.247 1.00 0.13 H new ATOM 0 HB3 LEU A 60 -6.129 -8.324 -0.232 1.00 0.13 H new ATOM 0 HG LEU A 60 -5.165 -10.461 1.695 1.00 0.14 H new ATOM 0 HD11 LEU A 60 -5.238 -8.662 3.347 1.00 0.43 H new ATOM 0 HD12 LEU A 60 -4.082 -8.305 2.041 1.00 0.43 H new ATOM 0 HD13 LEU A 60 -5.670 -7.502 2.068 1.00 0.43 H new ATOM 0 HD21 LEU A 60 -7.279 -9.993 2.869 1.00 0.35 H new ATOM 0 HD22 LEU A 60 -7.752 -8.872 1.570 1.00 0.35 H new ATOM 0 HD23 LEU A 60 -7.573 -10.608 1.225 1.00 0.35 H new ATOM 771 N TYR A 61 -5.614 -9.375 -3.031 1.00 0.14 N ATOM 772 CA TYR A 61 -5.901 -8.827 -4.332 1.00 0.15 C ATOM 773 C TYR A 61 -6.670 -9.832 -5.175 1.00 0.17 C ATOM 774 O TYR A 61 -7.660 -9.505 -5.784 1.00 0.22 O ATOM 775 CB TYR A 61 -4.616 -8.459 -5.052 1.00 0.17 C ATOM 776 CG TYR A 61 -4.897 -7.734 -6.335 1.00 0.18 C ATOM 777 CD1 TYR A 61 -5.992 -6.907 -6.425 1.00 0.16 C ATOM 778 CD2 TYR A 61 -4.070 -7.851 -7.432 1.00 0.28 C ATOM 779 CE1 TYR A 61 -6.262 -6.207 -7.578 1.00 0.18 C ATOM 780 CE2 TYR A 61 -4.332 -7.157 -8.599 1.00 0.31 C ATOM 781 CZ TYR A 61 -5.431 -6.333 -8.664 1.00 0.23 C ATOM 782 OH TYR A 61 -5.697 -5.627 -9.812 1.00 0.28 O ATOM 0 H TYR A 61 -4.621 -9.428 -2.804 1.00 0.14 H new ATOM 0 HA TYR A 61 -6.506 -7.931 -4.191 1.00 0.15 H new ATOM 0 HB2 TYR A 61 -4.001 -7.833 -4.405 1.00 0.17 H new ATOM 0 HB3 TYR A 61 -4.042 -9.362 -5.260 1.00 0.17 H new ATOM 0 HD1 TYR A 61 -6.651 -6.805 -5.576 1.00 0.16 H new ATOM 0 HD2 TYR A 61 -3.204 -8.495 -7.379 1.00 0.28 H new ATOM 0 HE1 TYR A 61 -7.125 -5.560 -7.629 1.00 0.18 H new ATOM 0 HE2 TYR A 61 -3.679 -7.261 -9.453 1.00 0.31 H new ATOM 0 HH TYR A 61 -5.013 -5.827 -10.485 1.00 0.28 H new ATOM 792 N ASN A 62 -6.213 -11.063 -5.178 1.00 0.18 N ATOM 793 CA ASN A 62 -6.776 -12.096 -6.032 1.00 0.22 C ATOM 794 C ASN A 62 -8.123 -12.547 -5.519 1.00 0.20 C ATOM 795 O ASN A 62 -8.956 -13.028 -6.284 1.00 0.24 O ATOM 796 CB ASN A 62 -5.822 -13.282 -6.170 1.00 0.27 C ATOM 797 CG ASN A 62 -4.739 -13.023 -7.197 1.00 0.75 C ATOM 798 OD1 ASN A 62 -4.298 -11.778 -7.291 1.00 1.21 O flip ATOM 799 ND2 ASN A 62 -4.288 -13.937 -7.886 1.00 1.12 N flip ATOM 0 H ASN A 62 -5.442 -11.381 -4.591 1.00 0.18 H new ATOM 0 HA ASN A 62 -6.918 -11.665 -7.023 1.00 0.22 H new ATOM 0 HB2 ASN A 62 -5.363 -13.492 -5.204 1.00 0.27 H new ATOM 0 HB3 ASN A 62 -6.386 -14.170 -6.454 1.00 0.27 H new ATOM 0 HD21 ASN A 62 -4.656 -14.883 -7.783 1.00 1.12 H new ATOM 0 HD22 ASN A 62 -3.546 -13.749 -8.561 1.00 1.12 H new ATOM 806 N LYS A 63 -8.347 -12.383 -4.225 1.00 0.18 N ATOM 807 CA LYS A 63 -9.586 -12.806 -3.644 1.00 0.20 C ATOM 808 C LYS A 63 -10.626 -11.756 -3.931 1.00 0.18 C ATOM 809 O LYS A 63 -11.803 -12.063 -4.123 1.00 0.22 O ATOM 810 CB LYS A 63 -9.442 -12.981 -2.131 1.00 0.26 C ATOM 811 CG LYS A 63 -10.585 -13.751 -1.490 1.00 0.29 C ATOM 812 CD LYS A 63 -10.269 -15.236 -1.420 1.00 0.64 C ATOM 813 CE LYS A 63 -9.121 -15.506 -0.457 1.00 0.91 C ATOM 814 NZ LYS A 63 -8.656 -16.918 -0.513 1.00 1.54 N ATOM 0 H LYS A 63 -7.686 -11.963 -3.572 1.00 0.18 H new ATOM 0 HA LYS A 63 -9.879 -13.765 -4.073 1.00 0.20 H new ATOM 0 HB2 LYS A 63 -8.506 -13.499 -1.922 1.00 0.26 H new ATOM 0 HB3 LYS A 63 -9.373 -11.998 -1.666 1.00 0.26 H new ATOM 0 HG2 LYS A 63 -10.769 -13.367 -0.487 1.00 0.29 H new ATOM 0 HG3 LYS A 63 -11.499 -13.597 -2.063 1.00 0.29 H new ATOM 0 HD2 LYS A 63 -11.154 -15.785 -1.099 1.00 0.64 H new ATOM 0 HD3 LYS A 63 -10.009 -15.603 -2.413 1.00 0.64 H new ATOM 0 HE2 LYS A 63 -8.289 -14.842 -0.692 1.00 0.91 H new ATOM 0 HE3 LYS A 63 -9.439 -15.271 0.559 1.00 0.91 H new ATOM 0 HZ1 LYS A 63 -7.874 -17.053 0.160 1.00 1.54 H new ATOM 0 HZ2 LYS A 63 -9.441 -17.552 -0.263 1.00 1.54 H new ATOM 0 HZ3 LYS A 63 -8.327 -17.137 -1.475 1.00 1.54 H new ATOM 828 N TYR A 64 -10.188 -10.499 -3.986 1.00 0.16 N ATOM 829 CA TYR A 64 -11.140 -9.423 -3.941 1.00 0.16 C ATOM 830 C TYR A 64 -11.060 -8.423 -5.078 1.00 0.17 C ATOM 831 O TYR A 64 -11.897 -7.523 -5.153 1.00 0.17 O ATOM 832 CB TYR A 64 -11.072 -8.763 -2.580 1.00 0.15 C ATOM 833 CG TYR A 64 -11.535 -9.705 -1.505 1.00 0.17 C ATOM 834 CD1 TYR A 64 -12.802 -10.268 -1.519 1.00 0.19 C ATOM 835 CD2 TYR A 64 -10.689 -10.011 -0.451 1.00 0.19 C ATOM 836 CE1 TYR A 64 -13.208 -11.114 -0.506 1.00 0.23 C ATOM 837 CE2 TYR A 64 -11.082 -10.852 0.557 1.00 0.23 C ATOM 838 CZ TYR A 64 -12.434 -11.480 0.424 1.00 0.24 C ATOM 839 OH TYR A 64 -12.739 -12.245 1.541 1.00 0.31 O ATOM 0 H TYR A 64 -9.210 -10.219 -4.059 1.00 0.16 H new ATOM 0 HA TYR A 64 -12.122 -9.871 -4.093 1.00 0.16 H new ATOM 0 HB2 TYR A 64 -10.049 -8.446 -2.376 1.00 0.15 H new ATOM 0 HB3 TYR A 64 -11.691 -7.866 -2.575 1.00 0.15 H new ATOM 0 HD1 TYR A 64 -13.478 -10.043 -2.330 1.00 0.19 H new ATOM 0 HD2 TYR A 64 -9.700 -9.578 -0.423 1.00 0.19 H new ATOM 0 HE1 TYR A 64 -14.225 -11.477 -0.508 1.00 0.23 H new ATOM 0 HE2 TYR A 64 -10.446 -11.052 1.407 1.00 0.23 H new ATOM 0 HH TYR A 64 -12.184 -11.957 2.296 1.00 0.31 H new ATOM 849 N LYS A 65 -10.116 -8.580 -5.990 1.00 0.20 N ATOM 850 CA LYS A 65 -10.152 -7.786 -7.208 1.00 0.23 C ATOM 851 C LYS A 65 -11.350 -8.218 -8.005 1.00 0.20 C ATOM 852 O LYS A 65 -11.899 -7.456 -8.795 1.00 0.22 O ATOM 853 CB LYS A 65 -8.864 -7.890 -8.033 1.00 0.34 C ATOM 854 CG LYS A 65 -8.527 -9.266 -8.588 1.00 0.29 C ATOM 855 CD LYS A 65 -7.168 -9.229 -9.263 1.00 0.38 C ATOM 856 CE LYS A 65 -6.971 -10.382 -10.236 1.00 0.80 C ATOM 857 NZ LYS A 65 -7.942 -10.340 -11.361 1.00 1.35 N ATOM 0 H LYS A 65 -9.334 -9.231 -5.916 1.00 0.20 H new ATOM 0 HA LYS A 65 -10.231 -6.733 -6.938 1.00 0.23 H new ATOM 0 HB2 LYS A 65 -8.935 -7.193 -8.868 1.00 0.34 H new ATOM 0 HB3 LYS A 65 -8.032 -7.559 -7.411 1.00 0.34 H new ATOM 0 HG2 LYS A 65 -8.524 -10.002 -7.784 1.00 0.29 H new ATOM 0 HG3 LYS A 65 -9.290 -9.577 -9.302 1.00 0.29 H new ATOM 0 HD2 LYS A 65 -7.056 -8.285 -9.796 1.00 0.38 H new ATOM 0 HD3 LYS A 65 -6.387 -9.261 -8.503 1.00 0.38 H new ATOM 0 HE2 LYS A 65 -5.956 -10.351 -10.633 1.00 0.80 H new ATOM 0 HE3 LYS A 65 -7.076 -11.327 -9.703 1.00 0.80 H new ATOM 0 HZ1 LYS A 65 -7.572 -10.894 -12.160 1.00 1.35 H new ATOM 0 HZ2 LYS A 65 -8.850 -10.742 -11.051 1.00 1.35 H new ATOM 0 HZ3 LYS A 65 -8.084 -9.354 -11.660 1.00 1.35 H new ATOM 871 N SER A 66 -11.773 -9.445 -7.728 1.00 0.23 N ATOM 872 CA SER A 66 -13.042 -9.956 -8.228 1.00 0.26 C ATOM 873 C SER A 66 -14.172 -8.944 -7.969 1.00 0.25 C ATOM 874 O SER A 66 -15.069 -8.777 -8.795 1.00 0.31 O ATOM 875 CB SER A 66 -13.357 -11.300 -7.558 1.00 0.32 C ATOM 876 OG SER A 66 -14.643 -11.777 -7.914 1.00 1.28 O ATOM 0 H SER A 66 -11.251 -10.109 -7.156 1.00 0.23 H new ATOM 0 HA SER A 66 -12.964 -10.107 -9.305 1.00 0.26 H new ATOM 0 HB2 SER A 66 -12.605 -12.034 -7.845 1.00 0.32 H new ATOM 0 HB3 SER A 66 -13.297 -11.189 -6.475 1.00 0.32 H new ATOM 0 HG SER A 66 -14.808 -12.635 -7.470 1.00 1.28 H new ATOM 882 N GLN A 67 -14.117 -8.261 -6.822 1.00 0.21 N ATOM 883 CA GLN A 67 -15.083 -7.210 -6.515 1.00 0.20 C ATOM 884 C GLN A 67 -14.605 -5.832 -7.003 1.00 0.20 C ATOM 885 O GLN A 67 -15.414 -4.990 -7.390 1.00 0.27 O ATOM 886 CB GLN A 67 -15.361 -7.169 -5.011 1.00 0.21 C ATOM 887 CG GLN A 67 -16.014 -8.440 -4.491 1.00 0.38 C ATOM 888 CD GLN A 67 -16.377 -8.360 -3.022 1.00 0.52 C ATOM 889 OE1 GLN A 67 -15.477 -8.804 -2.164 1.00 1.11 O flip ATOM 890 NE2 GLN A 67 -17.467 -7.927 -2.662 1.00 0.46 N flip ATOM 0 H GLN A 67 -13.417 -8.418 -6.097 1.00 0.21 H new ATOM 0 HA GLN A 67 -16.005 -7.447 -7.046 1.00 0.20 H new ATOM 0 HB2 GLN A 67 -14.424 -7.005 -4.479 1.00 0.21 H new ATOM 0 HB3 GLN A 67 -16.007 -6.319 -4.790 1.00 0.21 H new ATOM 0 HG2 GLN A 67 -16.914 -8.643 -5.072 1.00 0.38 H new ATOM 0 HG3 GLN A 67 -15.337 -9.280 -4.647 1.00 0.38 H new ATOM 0 HE21 GLN A 67 -18.137 -7.592 -3.355 1.00 0.46 H new ATOM 0 HE22 GLN A 67 -17.703 -7.902 -1.670 1.00 0.46 H new ATOM 899 N GLY A 68 -13.292 -5.616 -6.986 1.00 0.17 N ATOM 900 CA GLY A 68 -12.718 -4.332 -7.354 1.00 0.18 C ATOM 901 C GLY A 68 -11.530 -3.992 -6.474 1.00 0.15 C ATOM 902 O GLY A 68 -10.811 -3.018 -6.718 1.00 0.17 O ATOM 0 H GLY A 68 -12.605 -6.321 -6.719 1.00 0.17 H new ATOM 0 HA2 GLY A 68 -12.406 -4.356 -8.398 1.00 0.18 H new ATOM 0 HA3 GLY A 68 -13.475 -3.553 -7.265 1.00 0.18 H new ATOM 906 N PHE A 69 -11.319 -4.829 -5.461 1.00 0.14 N ATOM 907 CA PHE A 69 -10.254 -4.640 -4.481 1.00 0.13 C ATOM 908 C PHE A 69 -8.887 -4.803 -5.119 1.00 0.14 C ATOM 909 O PHE A 69 -8.692 -5.689 -5.935 1.00 0.18 O ATOM 910 CB PHE A 69 -10.410 -5.653 -3.340 1.00 0.14 C ATOM 911 CG PHE A 69 -9.331 -5.557 -2.318 1.00 0.12 C ATOM 912 CD1 PHE A 69 -8.989 -4.331 -1.845 1.00 0.14 C ATOM 913 CD2 PHE A 69 -8.655 -6.672 -1.846 1.00 0.14 C ATOM 914 CE1 PHE A 69 -8.003 -4.178 -0.934 1.00 0.16 C ATOM 915 CE2 PHE A 69 -7.647 -6.533 -0.912 1.00 0.16 C ATOM 916 CZ PHE A 69 -7.316 -5.279 -0.457 1.00 0.14 C ATOM 0 H PHE A 69 -11.885 -5.661 -5.297 1.00 0.14 H new ATOM 0 HA PHE A 69 -10.333 -3.626 -4.088 1.00 0.13 H new ATOM 0 HB2 PHE A 69 -11.375 -5.500 -2.856 1.00 0.14 H new ATOM 0 HB3 PHE A 69 -10.419 -6.660 -3.756 1.00 0.14 H new ATOM 0 HD1 PHE A 69 -9.516 -3.460 -2.205 1.00 0.14 H new ATOM 0 HD2 PHE A 69 -8.918 -7.654 -2.211 1.00 0.14 H new ATOM 0 HE1 PHE A 69 -7.750 -3.191 -0.577 1.00 0.16 H new ATOM 0 HE2 PHE A 69 -7.123 -7.402 -0.542 1.00 0.16 H new ATOM 0 HZ PHE A 69 -6.525 -5.155 0.268 1.00 0.14 H new ATOM 926 N THR A 70 -7.939 -3.952 -4.762 1.00 0.13 N ATOM 927 CA THR A 70 -6.605 -4.094 -5.250 1.00 0.12 C ATOM 928 C THR A 70 -5.647 -3.951 -4.119 1.00 0.12 C ATOM 929 O THR A 70 -5.888 -3.213 -3.186 1.00 0.19 O ATOM 930 CB THR A 70 -6.293 -3.046 -6.310 1.00 0.15 C ATOM 931 OG1 THR A 70 -5.223 -3.476 -7.147 1.00 0.20 O ATOM 932 CG2 THR A 70 -5.932 -1.719 -5.681 1.00 0.19 C ATOM 0 H THR A 70 -8.083 -3.160 -4.135 1.00 0.13 H new ATOM 0 HA THR A 70 -6.509 -5.081 -5.703 1.00 0.12 H new ATOM 0 HB THR A 70 -7.193 -2.917 -6.911 1.00 0.15 H new ATOM 0 HG1 THR A 70 -5.523 -4.225 -7.703 1.00 0.20 H new ATOM 0 HG21 THR A 70 -5.715 -0.992 -6.464 1.00 0.19 H new ATOM 0 HG22 THR A 70 -6.767 -1.363 -5.077 1.00 0.19 H new ATOM 0 HG23 THR A 70 -5.054 -1.843 -5.048 1.00 0.19 H new ATOM 940 N VAL A 71 -4.604 -4.694 -4.177 1.00 0.13 N ATOM 941 CA VAL A 71 -3.474 -4.403 -3.386 1.00 0.13 C ATOM 942 C VAL A 71 -2.425 -3.770 -4.261 1.00 0.13 C ATOM 943 O VAL A 71 -1.740 -4.447 -5.010 1.00 0.15 O ATOM 944 CB VAL A 71 -2.932 -5.662 -2.731 1.00 0.15 C ATOM 945 CG1 VAL A 71 -1.514 -5.436 -2.248 1.00 0.16 C ATOM 946 CG2 VAL A 71 -3.834 -6.075 -1.584 1.00 0.17 C ATOM 0 H VAL A 71 -4.512 -5.517 -4.772 1.00 0.13 H new ATOM 0 HA VAL A 71 -3.756 -3.714 -2.590 1.00 0.13 H new ATOM 0 HB VAL A 71 -2.914 -6.467 -3.466 1.00 0.15 H new ATOM 0 HG11 VAL A 71 -1.139 -6.347 -1.781 1.00 0.16 H new ATOM 0 HG12 VAL A 71 -0.879 -5.174 -3.094 1.00 0.16 H new ATOM 0 HG13 VAL A 71 -1.502 -4.624 -1.521 1.00 0.16 H new ATOM 0 HG21 VAL A 71 -3.440 -6.978 -1.118 1.00 0.17 H new ATOM 0 HG22 VAL A 71 -3.874 -5.274 -0.846 1.00 0.17 H new ATOM 0 HG23 VAL A 71 -4.838 -6.270 -1.962 1.00 0.17 H new ATOM 956 N LEU A 72 -2.321 -2.469 -4.194 1.00 0.17 N ATOM 957 CA LEU A 72 -1.258 -1.807 -4.918 1.00 0.22 C ATOM 958 C LEU A 72 -0.134 -1.523 -3.958 1.00 0.19 C ATOM 959 O LEU A 72 -0.316 -0.812 -2.980 1.00 0.28 O ATOM 960 CB LEU A 72 -1.674 -0.493 -5.618 1.00 0.43 C ATOM 961 CG LEU A 72 -3.144 -0.098 -5.617 1.00 0.34 C ATOM 962 CD1 LEU A 72 -3.673 0.141 -4.215 1.00 1.04 C ATOM 963 CD2 LEU A 72 -3.337 1.140 -6.457 1.00 1.00 C ATOM 0 H LEU A 72 -2.939 -1.856 -3.662 1.00 0.17 H new ATOM 0 HA LEU A 72 -0.958 -2.485 -5.717 1.00 0.22 H new ATOM 0 HB2 LEU A 72 -1.113 0.319 -5.156 1.00 0.43 H new ATOM 0 HB3 LEU A 72 -1.349 -0.555 -6.657 1.00 0.43 H new ATOM 0 HG LEU A 72 -3.709 -0.928 -6.040 1.00 0.34 H new ATOM 0 HD11 LEU A 72 -4.725 0.420 -4.266 1.00 1.04 H new ATOM 0 HD12 LEU A 72 -3.567 -0.770 -3.626 1.00 1.04 H new ATOM 0 HD13 LEU A 72 -3.107 0.945 -3.745 1.00 1.04 H new ATOM 0 HD21 LEU A 72 -4.390 1.421 -6.455 1.00 1.00 H new ATOM 0 HD22 LEU A 72 -2.743 1.956 -6.045 1.00 1.00 H new ATOM 0 HD23 LEU A 72 -3.017 0.939 -7.480 1.00 1.00 H new ATOM 975 N ALA A 73 1.026 -2.065 -4.234 1.00 0.22 N ATOM 976 CA ALA A 73 2.149 -1.894 -3.343 1.00 0.30 C ATOM 977 C ALA A 73 3.157 -0.912 -3.909 1.00 0.23 C ATOM 978 O ALA A 73 3.541 -0.983 -5.069 1.00 0.32 O ATOM 979 CB ALA A 73 2.798 -3.227 -3.043 1.00 0.51 C ATOM 0 H ALA A 73 1.218 -2.626 -5.064 1.00 0.22 H new ATOM 0 HA ALA A 73 1.776 -1.478 -2.407 1.00 0.30 H new ATOM 0 HB1 ALA A 73 3.642 -3.077 -2.370 1.00 0.51 H new ATOM 0 HB2 ALA A 73 2.071 -3.888 -2.571 1.00 0.51 H new ATOM 0 HB3 ALA A 73 3.149 -3.678 -3.971 1.00 0.51 H new ATOM 985 N PHE A 74 3.550 0.020 -3.076 1.00 0.29 N ATOM 986 CA PHE A 74 4.506 1.044 -3.426 1.00 0.33 C ATOM 987 C PHE A 74 5.827 0.752 -2.715 1.00 0.35 C ATOM 988 O PHE A 74 5.921 0.882 -1.499 1.00 0.37 O ATOM 989 CB PHE A 74 3.943 2.414 -3.014 1.00 0.44 C ATOM 990 CG PHE A 74 2.816 2.922 -3.892 1.00 0.36 C ATOM 991 CD1 PHE A 74 1.966 2.021 -4.514 1.00 0.43 C ATOM 992 CD2 PHE A 74 2.584 4.284 -4.075 1.00 0.41 C ATOM 993 CE1 PHE A 74 0.913 2.464 -5.307 1.00 0.41 C ATOM 994 CE2 PHE A 74 1.533 4.726 -4.849 1.00 0.43 C ATOM 995 CZ PHE A 74 0.789 3.885 -5.542 1.00 0.35 C ATOM 0 H PHE A 74 3.208 0.090 -2.117 1.00 0.29 H new ATOM 0 HA PHE A 74 4.687 1.054 -4.501 1.00 0.33 H new ATOM 0 HB2 PHE A 74 3.586 2.351 -1.986 1.00 0.44 H new ATOM 0 HB3 PHE A 74 4.753 3.144 -3.026 1.00 0.44 H new ATOM 0 HD1 PHE A 74 2.124 0.961 -4.381 1.00 0.43 H new ATOM 0 HD2 PHE A 74 3.237 5.003 -3.603 1.00 0.41 H new ATOM 0 HE1 PHE A 74 0.208 1.767 -5.735 1.00 0.41 H new ATOM 0 HE2 PHE A 74 1.314 5.783 -4.889 1.00 0.43 H new ATOM 0 HZ PHE A 74 0.092 4.256 -6.279 1.00 0.35 H new ATOM 1005 N PRO A 75 6.861 0.332 -3.461 1.00 0.37 N ATOM 1006 CA PRO A 75 8.100 -0.155 -2.877 1.00 0.46 C ATOM 1007 C PRO A 75 9.052 0.956 -2.475 1.00 0.61 C ATOM 1008 O PRO A 75 9.950 1.310 -3.226 1.00 1.30 O ATOM 1009 CB PRO A 75 8.715 -1.025 -3.972 1.00 0.54 C ATOM 1010 CG PRO A 75 8.046 -0.633 -5.251 1.00 0.44 C ATOM 1011 CD PRO A 75 6.912 0.320 -4.922 1.00 0.38 C ATOM 0 HA PRO A 75 7.907 -0.695 -1.950 1.00 0.46 H new ATOM 0 HB2 PRO A 75 9.792 -0.868 -4.033 1.00 0.54 H new ATOM 0 HB3 PRO A 75 8.559 -2.083 -3.761 1.00 0.54 H new ATOM 0 HG2 PRO A 75 8.760 -0.156 -5.923 1.00 0.44 H new ATOM 0 HG3 PRO A 75 7.664 -1.515 -5.766 1.00 0.44 H new ATOM 0 HD2 PRO A 75 7.101 1.316 -5.321 1.00 0.38 H new ATOM 0 HD3 PRO A 75 5.969 -0.021 -5.350 1.00 0.38 H new ATOM 1019 N SER A 76 8.871 1.439 -1.253 1.00 0.41 N ATOM 1020 CA SER A 76 9.582 2.595 -0.722 1.00 0.37 C ATOM 1021 C SER A 76 11.037 2.620 -1.109 1.00 0.50 C ATOM 1022 O SER A 76 11.748 1.610 -1.038 1.00 0.74 O ATOM 1023 CB SER A 76 9.468 2.604 0.808 1.00 0.53 C ATOM 1024 OG SER A 76 9.569 3.919 1.333 1.00 1.44 O ATOM 0 H SER A 76 8.213 1.030 -0.590 1.00 0.41 H new ATOM 0 HA SER A 76 9.117 3.481 -1.154 1.00 0.37 H new ATOM 0 HB2 SER A 76 8.515 2.166 1.105 1.00 0.53 H new ATOM 0 HB3 SER A 76 10.253 1.980 1.235 1.00 0.53 H new ATOM 0 HG SER A 76 8.864 4.061 1.999 1.00 1.44 H new ATOM 1030 N ASN A 77 11.477 3.800 -1.511 1.00 0.52 N ATOM 1031 CA ASN A 77 12.846 3.981 -1.889 1.00 0.72 C ATOM 1032 C ASN A 77 13.703 4.067 -0.645 1.00 0.70 C ATOM 1033 O ASN A 77 13.939 5.134 -0.077 1.00 0.75 O ATOM 1034 CB ASN A 77 13.049 5.192 -2.824 1.00 0.93 C ATOM 1035 CG ASN A 77 12.528 6.504 -2.275 1.00 0.96 C ATOM 1036 OD1 ASN A 77 11.347 6.803 -2.394 1.00 1.81 O ATOM 1037 ND2 ASN A 77 13.412 7.316 -1.717 1.00 1.46 N ATOM 0 H ASN A 77 10.899 4.638 -1.580 1.00 0.52 H new ATOM 0 HA ASN A 77 13.159 3.114 -2.471 1.00 0.72 H new ATOM 0 HB2 ASN A 77 14.113 5.298 -3.035 1.00 0.93 H new ATOM 0 HB3 ASN A 77 12.555 4.988 -3.774 1.00 0.93 H new ATOM 0 HD21 ASN A 77 13.117 8.228 -1.368 1.00 1.46 H new ATOM 0 HD22 ASN A 77 14.388 7.030 -1.636 1.00 1.46 H new ATOM 1044 N GLN A 78 14.147 2.893 -0.223 1.00 0.85 N ATOM 1045 CA GLN A 78 15.189 2.743 0.782 1.00 0.98 C ATOM 1046 C GLN A 78 16.426 3.521 0.366 1.00 0.98 C ATOM 1047 O GLN A 78 17.386 3.651 1.114 1.00 1.12 O ATOM 1048 CB GLN A 78 15.500 1.267 1.009 1.00 1.35 C ATOM 1049 CG GLN A 78 14.358 0.523 1.683 1.00 2.07 C ATOM 1050 CD GLN A 78 14.018 -0.781 0.995 1.00 2.74 C ATOM 1051 OE1 GLN A 78 14.586 -1.825 1.300 1.00 3.34 O ATOM 1052 NE2 GLN A 78 13.070 -0.735 0.071 1.00 3.30 N ATOM 0 H GLN A 78 13.789 2.005 -0.574 1.00 0.85 H new ATOM 0 HA GLN A 78 14.838 3.152 1.729 1.00 0.98 H new ATOM 0 HB2 GLN A 78 15.721 0.795 0.052 1.00 1.35 H new ATOM 0 HB3 GLN A 78 16.397 1.179 1.622 1.00 1.35 H new ATOM 0 HG2 GLN A 78 14.624 0.322 2.721 1.00 2.07 H new ATOM 0 HG3 GLN A 78 13.474 1.161 1.699 1.00 2.07 H new ATOM 0 HE21 GLN A 78 12.621 0.152 -0.155 1.00 3.30 H new ATOM 0 HE22 GLN A 78 12.789 -1.587 -0.414 1.00 3.30 H new ATOM 1061 N PHE A 79 16.376 4.022 -0.860 1.00 0.98 N ATOM 1062 CA PHE A 79 17.471 4.766 -1.457 1.00 1.19 C ATOM 1063 C PHE A 79 17.757 6.063 -0.705 1.00 1.20 C ATOM 1064 O PHE A 79 18.786 6.703 -0.923 1.00 1.54 O ATOM 1065 CB PHE A 79 17.126 5.103 -2.902 1.00 1.32 C ATOM 1066 CG PHE A 79 17.092 3.921 -3.829 1.00 1.57 C ATOM 1067 CD1 PHE A 79 18.245 3.206 -4.103 1.00 1.82 C ATOM 1068 CD2 PHE A 79 15.909 3.540 -4.441 1.00 2.02 C ATOM 1069 CE1 PHE A 79 18.220 2.130 -4.969 1.00 2.25 C ATOM 1070 CE2 PHE A 79 15.876 2.464 -5.307 1.00 2.64 C ATOM 1071 CZ PHE A 79 17.033 1.758 -5.572 1.00 2.68 C ATOM 0 H PHE A 79 15.566 3.921 -1.472 1.00 0.98 H new ATOM 0 HA PHE A 79 18.361 4.139 -1.407 1.00 1.19 H new ATOM 0 HB2 PHE A 79 16.153 5.594 -2.924 1.00 1.32 H new ATOM 0 HB3 PHE A 79 17.854 5.822 -3.278 1.00 1.32 H new ATOM 0 HD1 PHE A 79 19.175 3.493 -3.634 1.00 1.82 H new ATOM 0 HD2 PHE A 79 15.002 4.090 -4.239 1.00 2.02 H new ATOM 0 HE1 PHE A 79 19.127 1.580 -5.175 1.00 2.25 H new ATOM 0 HE2 PHE A 79 14.947 2.175 -5.776 1.00 2.64 H new ATOM 0 HZ PHE A 79 17.010 0.917 -6.249 1.00 2.68 H new ATOM 1081 N GLY A 80 16.849 6.446 0.171 1.00 1.10 N ATOM 1082 CA GLY A 80 17.057 7.630 0.972 1.00 1.22 C ATOM 1083 C GLY A 80 17.674 7.301 2.315 1.00 1.24 C ATOM 1084 O GLY A 80 18.732 6.671 2.386 1.00 1.98 O ATOM 0 H GLY A 80 15.970 5.959 0.343 1.00 1.10 H new ATOM 0 HA2 GLY A 80 17.705 8.323 0.435 1.00 1.22 H new ATOM 0 HA3 GLY A 80 16.104 8.137 1.124 1.00 1.22 H new ATOM 1088 N GLY A 81 17.018 7.740 3.370 1.00 1.18 N ATOM 1089 CA GLY A 81 17.431 7.406 4.713 1.00 1.21 C ATOM 1090 C GLY A 81 16.395 7.828 5.718 1.00 1.14 C ATOM 1091 O GLY A 81 16.593 8.773 6.484 1.00 1.49 O ATOM 0 H GLY A 81 16.190 8.334 3.319 1.00 1.18 H new ATOM 0 HA2 GLY A 81 17.599 6.332 4.789 1.00 1.21 H new ATOM 0 HA3 GLY A 81 18.380 7.894 4.937 1.00 1.21 H new ATOM 1095 N GLN A 82 15.288 7.112 5.710 1.00 0.86 N ATOM 1096 CA GLN A 82 14.124 7.469 6.507 1.00 0.82 C ATOM 1097 C GLN A 82 13.126 6.338 6.499 1.00 0.77 C ATOM 1098 O GLN A 82 12.379 6.146 7.461 1.00 0.91 O ATOM 1099 CB GLN A 82 13.416 8.717 5.951 1.00 0.80 C ATOM 1100 CG GLN A 82 12.811 8.525 4.561 1.00 0.75 C ATOM 1101 CD GLN A 82 13.826 8.551 3.437 1.00 1.09 C ATOM 1102 OE1 GLN A 82 14.834 9.244 3.511 1.00 1.74 O ATOM 1103 NE2 GLN A 82 13.563 7.792 2.386 1.00 1.14 N ATOM 0 H GLN A 82 15.167 6.267 5.152 1.00 0.86 H new ATOM 0 HA GLN A 82 14.480 7.672 7.517 1.00 0.82 H new ATOM 0 HB2 GLN A 82 12.626 9.011 6.642 1.00 0.80 H new ATOM 0 HB3 GLN A 82 14.130 9.540 5.914 1.00 0.80 H new ATOM 0 HG2 GLN A 82 12.281 7.573 4.535 1.00 0.75 H new ATOM 0 HG3 GLN A 82 12.072 9.307 4.387 1.00 0.75 H new ATOM 0 HE21 GLN A 82 12.712 7.229 2.363 1.00 1.14 H new ATOM 0 HE22 GLN A 82 14.211 7.769 1.598 1.00 1.14 H new ATOM 1112 N GLU A 83 13.162 5.575 5.418 1.00 0.75 N ATOM 1113 CA GLU A 83 12.107 4.642 5.074 1.00 0.74 C ATOM 1114 C GLU A 83 11.917 3.571 6.155 1.00 0.72 C ATOM 1115 O GLU A 83 12.743 3.443 7.061 1.00 0.88 O ATOM 1116 CB GLU A 83 12.386 4.018 3.683 1.00 0.87 C ATOM 1117 CG GLU A 83 13.841 4.024 3.231 1.00 1.16 C ATOM 1118 CD GLU A 83 14.784 3.521 4.297 1.00 2.33 C ATOM 1119 OE1 GLU A 83 14.701 2.322 4.640 1.00 3.07 O ATOM 1120 OE2 GLU A 83 15.594 4.331 4.798 1.00 2.83 O ATOM 0 H GLU A 83 13.933 5.588 4.750 1.00 0.75 H new ATOM 0 HA GLU A 83 11.167 5.191 5.020 1.00 0.74 H new ATOM 0 HB2 GLU A 83 12.032 2.987 3.691 1.00 0.87 H new ATOM 0 HB3 GLU A 83 11.793 4.552 2.941 1.00 0.87 H new ATOM 0 HG2 GLU A 83 13.943 3.405 2.340 1.00 1.16 H new ATOM 0 HG3 GLU A 83 14.125 5.038 2.949 1.00 1.16 H new ATOM 1127 N PRO A 84 10.791 2.826 6.063 1.00 0.63 N ATOM 1128 CA PRO A 84 10.320 1.818 7.010 1.00 0.75 C ATOM 1129 C PRO A 84 11.356 1.317 8.019 1.00 1.00 C ATOM 1130 O PRO A 84 11.155 1.435 9.229 1.00 1.75 O ATOM 1131 CB PRO A 84 9.886 0.710 6.041 1.00 1.02 C ATOM 1132 CG PRO A 84 9.675 1.381 4.717 1.00 0.72 C ATOM 1133 CD PRO A 84 9.846 2.851 4.961 1.00 0.61 C ATOM 0 HA PRO A 84 9.550 2.205 7.677 1.00 0.75 H new ATOM 0 HB2 PRO A 84 10.648 -0.066 5.969 1.00 1.02 H new ATOM 0 HB3 PRO A 84 8.971 0.227 6.384 1.00 1.02 H new ATOM 0 HG2 PRO A 84 10.394 1.023 3.980 1.00 0.72 H new ATOM 0 HG3 PRO A 84 8.681 1.164 4.325 1.00 0.72 H new ATOM 0 HD2 PRO A 84 10.239 3.373 4.089 1.00 0.61 H new ATOM 0 HD3 PRO A 84 8.909 3.339 5.229 1.00 0.61 H new ATOM 1141 N GLY A 85 12.452 0.763 7.538 1.00 1.45 N ATOM 1142 CA GLY A 85 13.490 0.321 8.441 1.00 1.82 C ATOM 1143 C GLY A 85 14.541 -0.508 7.755 1.00 1.61 C ATOM 1144 O GLY A 85 15.047 -1.473 8.328 1.00 2.20 O ATOM 0 H GLY A 85 12.643 0.611 6.548 1.00 1.45 H new ATOM 0 HA2 GLY A 85 13.961 1.190 8.900 1.00 1.82 H new ATOM 0 HA3 GLY A 85 13.042 -0.261 9.246 1.00 1.82 H new ATOM 1148 N ASN A 86 14.882 -0.141 6.533 1.00 1.49 N ATOM 1149 CA ASN A 86 15.875 -0.889 5.784 1.00 2.04 C ATOM 1150 C ASN A 86 17.133 -0.057 5.579 1.00 1.94 C ATOM 1151 O ASN A 86 18.246 -0.562 5.726 1.00 2.70 O ATOM 1152 CB ASN A 86 15.301 -1.352 4.450 1.00 2.78 C ATOM 1153 CG ASN A 86 14.228 -2.412 4.623 1.00 3.58 C ATOM 1154 OD1 ASN A 86 13.040 -2.103 4.730 1.00 4.07 O ATOM 1155 ND2 ASN A 86 14.641 -3.670 4.663 1.00 4.20 N ATOM 0 H ASN A 86 14.490 0.663 6.042 1.00 1.49 H new ATOM 0 HA ASN A 86 16.148 -1.773 6.360 1.00 2.04 H new ATOM 0 HB2 ASN A 86 14.882 -0.496 3.921 1.00 2.78 H new ATOM 0 HB3 ASN A 86 16.104 -1.749 3.829 1.00 2.78 H new ATOM 0 HD21 ASN A 86 13.966 -4.425 4.786 1.00 4.20 H new ATOM 0 HD22 ASN A 86 15.634 -3.884 4.571 1.00 4.20 H new ATOM 1162 N GLU A 87 16.931 1.213 5.233 1.00 1.52 N ATOM 1163 CA GLU A 87 17.988 2.223 5.178 1.00 1.46 C ATOM 1164 C GLU A 87 18.995 1.976 4.054 1.00 1.60 C ATOM 1165 O GLU A 87 19.105 2.777 3.136 1.00 2.15 O ATOM 1166 CB GLU A 87 18.692 2.321 6.532 1.00 1.61 C ATOM 1167 CG GLU A 87 19.864 3.283 6.552 1.00 2.19 C ATOM 1168 CD GLU A 87 20.740 3.077 7.765 1.00 2.58 C ATOM 1169 OE1 GLU A 87 20.390 3.597 8.846 1.00 2.84 O ATOM 1170 OE2 GLU A 87 21.789 2.411 7.646 1.00 3.02 O ATOM 0 H GLU A 87 16.012 1.576 4.978 1.00 1.52 H new ATOM 0 HA GLU A 87 17.509 3.175 4.951 1.00 1.46 H new ATOM 0 HB2 GLU A 87 17.967 2.632 7.285 1.00 1.61 H new ATOM 0 HB3 GLU A 87 19.044 1.330 6.819 1.00 1.61 H new ATOM 0 HG2 GLU A 87 20.458 3.150 5.648 1.00 2.19 H new ATOM 0 HG3 GLU A 87 19.493 4.308 6.542 1.00 2.19 H new ATOM 1177 N GLU A 88 19.729 0.877 4.124 1.00 1.57 N ATOM 1178 CA GLU A 88 20.785 0.606 3.156 1.00 1.77 C ATOM 1179 C GLU A 88 20.455 -0.643 2.341 1.00 1.62 C ATOM 1180 O GLU A 88 21.191 -1.011 1.427 1.00 1.62 O ATOM 1181 CB GLU A 88 22.116 0.419 3.893 1.00 2.18 C ATOM 1182 CG GLU A 88 23.348 0.503 3.003 1.00 2.68 C ATOM 1183 CD GLU A 88 23.547 1.881 2.410 1.00 3.33 C ATOM 1184 OE1 GLU A 88 23.453 2.871 3.165 1.00 3.66 O ATOM 1185 OE2 GLU A 88 23.811 1.981 1.192 1.00 3.92 O ATOM 0 H GLU A 88 19.615 0.158 4.839 1.00 1.57 H new ATOM 0 HA GLU A 88 20.866 1.450 2.471 1.00 1.77 H new ATOM 0 HB2 GLU A 88 22.194 1.177 4.673 1.00 2.18 H new ATOM 0 HB3 GLU A 88 22.108 -0.551 4.390 1.00 2.18 H new ATOM 0 HG2 GLU A 88 24.230 0.231 3.583 1.00 2.68 H new ATOM 0 HG3 GLU A 88 23.259 -0.226 2.197 1.00 2.68 H new ATOM 1192 N GLU A 89 19.312 -1.248 2.654 1.00 1.62 N ATOM 1193 CA GLU A 89 18.924 -2.558 2.117 1.00 1.59 C ATOM 1194 C GLU A 89 19.071 -2.631 0.594 1.00 1.49 C ATOM 1195 O GLU A 89 19.871 -3.408 0.081 1.00 1.59 O ATOM 1196 CB GLU A 89 17.473 -2.842 2.517 1.00 1.70 C ATOM 1197 CG GLU A 89 17.027 -4.289 2.361 1.00 1.75 C ATOM 1198 CD GLU A 89 17.843 -5.245 3.199 1.00 2.11 C ATOM 1199 OE1 GLU A 89 17.710 -5.218 4.437 1.00 2.65 O ATOM 1200 OE2 GLU A 89 18.639 -6.016 2.621 1.00 2.45 O ATOM 0 H GLU A 89 18.623 -0.845 3.289 1.00 1.62 H new ATOM 0 HA GLU A 89 19.593 -3.310 2.536 1.00 1.59 H new ATOM 0 HB2 GLU A 89 17.336 -2.547 3.557 1.00 1.70 H new ATOM 0 HB3 GLU A 89 16.818 -2.210 1.917 1.00 1.70 H new ATOM 0 HG2 GLU A 89 15.977 -4.373 2.640 1.00 1.75 H new ATOM 0 HG3 GLU A 89 17.102 -4.577 1.312 1.00 1.75 H new ATOM 1207 N ILE A 90 18.338 -1.789 -0.125 1.00 1.43 N ATOM 1208 CA ILE A 90 18.347 -1.844 -1.584 1.00 1.39 C ATOM 1209 C ILE A 90 19.380 -0.894 -2.172 1.00 1.49 C ATOM 1210 O ILE A 90 19.421 -0.683 -3.385 1.00 1.57 O ATOM 1211 CB ILE A 90 16.969 -1.504 -2.179 1.00 1.45 C ATOM 1212 CG1 ILE A 90 16.613 -0.045 -1.895 1.00 1.74 C ATOM 1213 CG2 ILE A 90 15.906 -2.438 -1.624 1.00 1.76 C ATOM 1214 CD1 ILE A 90 15.261 0.372 -2.439 1.00 2.15 C ATOM 0 H ILE A 90 17.736 -1.067 0.272 1.00 1.43 H new ATOM 0 HA ILE A 90 18.606 -2.870 -1.847 1.00 1.39 H new ATOM 0 HB ILE A 90 17.012 -1.641 -3.259 1.00 1.45 H new ATOM 0 HG12 ILE A 90 16.627 0.120 -0.818 1.00 1.74 H new ATOM 0 HG13 ILE A 90 17.381 0.597 -2.326 1.00 1.74 H new ATOM 0 HG21 ILE A 90 14.938 -2.184 -2.055 1.00 1.76 H new ATOM 0 HG22 ILE A 90 16.158 -3.468 -1.878 1.00 1.76 H new ATOM 0 HG23 ILE A 90 15.860 -2.333 -0.540 1.00 1.76 H new ATOM 0 HD11 ILE A 90 15.079 1.419 -2.198 1.00 2.15 H new ATOM 0 HD12 ILE A 90 15.248 0.241 -3.521 1.00 2.15 H new ATOM 0 HD13 ILE A 90 14.482 -0.244 -1.990 1.00 2.15 H new ATOM 1226 N LYS A 91 20.204 -0.312 -1.317 1.00 1.71 N ATOM 1227 CA LYS A 91 21.233 0.600 -1.780 1.00 1.89 C ATOM 1228 C LYS A 91 22.558 -0.125 -1.913 1.00 1.98 C ATOM 1229 O LYS A 91 23.333 0.140 -2.832 1.00 2.17 O ATOM 1230 CB LYS A 91 21.378 1.795 -0.841 1.00 2.00 C ATOM 1231 CG LYS A 91 20.137 2.661 -0.767 1.00 2.10 C ATOM 1232 CD LYS A 91 20.443 4.035 -0.193 1.00 2.33 C ATOM 1233 CE LYS A 91 21.031 3.956 1.202 1.00 2.39 C ATOM 1234 NZ LYS A 91 21.138 5.298 1.829 1.00 2.79 N ATOM 0 H LYS A 91 20.181 -0.454 -0.307 1.00 1.71 H new ATOM 0 HA LYS A 91 20.933 0.975 -2.759 1.00 1.89 H new ATOM 0 HB2 LYS A 91 21.619 1.434 0.159 1.00 2.00 H new ATOM 0 HB3 LYS A 91 22.218 2.406 -1.171 1.00 2.00 H new ATOM 0 HG2 LYS A 91 19.710 2.770 -1.764 1.00 2.10 H new ATOM 0 HG3 LYS A 91 19.386 2.168 -0.150 1.00 2.10 H new ATOM 0 HD2 LYS A 91 21.140 4.554 -0.850 1.00 2.33 H new ATOM 0 HD3 LYS A 91 19.529 4.628 -0.167 1.00 2.33 H new ATOM 0 HE2 LYS A 91 20.408 3.312 1.824 1.00 2.39 H new ATOM 0 HE3 LYS A 91 22.018 3.496 1.155 1.00 2.39 H new ATOM 0 HZ1 LYS A 91 21.636 5.218 2.738 1.00 2.79 H new ATOM 0 HZ2 LYS A 91 21.667 5.934 1.199 1.00 2.79 H new ATOM 0 HZ3 LYS A 91 20.185 5.683 1.989 1.00 2.79 H new ATOM 1248 N GLU A 92 22.817 -1.036 -0.987 1.00 2.07 N ATOM 1249 CA GLU A 92 24.011 -1.854 -1.053 1.00 2.27 C ATOM 1250 C GLU A 92 23.753 -3.082 -1.912 1.00 2.10 C ATOM 1251 O GLU A 92 24.664 -3.618 -2.539 1.00 2.26 O ATOM 1252 CB GLU A 92 24.463 -2.275 0.347 1.00 2.54 C ATOM 1253 CG GLU A 92 23.453 -3.139 1.085 1.00 2.47 C ATOM 1254 CD GLU A 92 24.047 -3.817 2.297 1.00 2.96 C ATOM 1255 OE1 GLU A 92 24.891 -4.723 2.134 1.00 3.29 O ATOM 1256 OE2 GLU A 92 23.679 -3.437 3.429 1.00 3.20 O ATOM 0 H GLU A 92 22.216 -1.225 -0.185 1.00 2.07 H new ATOM 0 HA GLU A 92 24.808 -1.263 -1.504 1.00 2.27 H new ATOM 0 HB2 GLU A 92 25.403 -2.821 0.266 1.00 2.54 H new ATOM 0 HB3 GLU A 92 24.663 -1.381 0.938 1.00 2.54 H new ATOM 0 HG2 GLU A 92 22.610 -2.522 1.395 1.00 2.47 H new ATOM 0 HG3 GLU A 92 23.061 -3.896 0.405 1.00 2.47 H new ATOM 1263 N PHE A 93 22.500 -3.511 -1.962 1.00 1.86 N ATOM 1264 CA PHE A 93 22.150 -4.722 -2.682 1.00 1.75 C ATOM 1265 C PHE A 93 21.283 -4.385 -3.885 1.00 1.59 C ATOM 1266 O PHE A 93 20.588 -3.368 -3.901 1.00 1.69 O ATOM 1267 CB PHE A 93 21.422 -5.689 -1.750 1.00 1.73 C ATOM 1268 CG PHE A 93 21.450 -7.117 -2.220 1.00 2.09 C ATOM 1269 CD1 PHE A 93 22.620 -7.855 -2.146 1.00 2.34 C ATOM 1270 CD2 PHE A 93 20.314 -7.719 -2.735 1.00 2.65 C ATOM 1271 CE1 PHE A 93 22.656 -9.167 -2.576 1.00 2.87 C ATOM 1272 CE2 PHE A 93 20.343 -9.031 -3.166 1.00 3.40 C ATOM 1273 CZ PHE A 93 21.515 -9.756 -3.086 1.00 3.42 C ATOM 0 H PHE A 93 21.714 -3.040 -1.514 1.00 1.86 H new ATOM 0 HA PHE A 93 23.062 -5.201 -3.039 1.00 1.75 H new ATOM 0 HB2 PHE A 93 21.872 -5.633 -0.759 1.00 1.73 H new ATOM 0 HB3 PHE A 93 20.385 -5.370 -1.647 1.00 1.73 H new ATOM 0 HD1 PHE A 93 23.514 -7.399 -1.747 1.00 2.34 H new ATOM 0 HD2 PHE A 93 19.395 -7.156 -2.800 1.00 2.65 H new ATOM 0 HE1 PHE A 93 23.575 -9.732 -2.514 1.00 2.87 H new ATOM 0 HE2 PHE A 93 19.450 -9.489 -3.565 1.00 3.40 H new ATOM 0 HZ PHE A 93 21.540 -10.782 -3.422 1.00 3.42 H new ATOM 1283 N VAL A 94 21.346 -5.232 -4.900 1.00 1.62 N ATOM 1284 CA VAL A 94 20.568 -5.037 -6.111 1.00 1.68 C ATOM 1285 C VAL A 94 19.087 -5.287 -5.846 1.00 1.54 C ATOM 1286 O VAL A 94 18.696 -6.350 -5.363 1.00 1.74 O ATOM 1287 CB VAL A 94 21.064 -5.959 -7.251 1.00 2.11 C ATOM 1288 CG1 VAL A 94 20.998 -7.426 -6.844 1.00 2.63 C ATOM 1289 CG2 VAL A 94 20.270 -5.719 -8.526 1.00 2.56 C ATOM 0 H VAL A 94 21.932 -6.066 -4.908 1.00 1.62 H new ATOM 0 HA VAL A 94 20.701 -4.002 -6.425 1.00 1.68 H new ATOM 0 HB VAL A 94 22.108 -5.712 -7.446 1.00 2.11 H new ATOM 0 HG11 VAL A 94 21.353 -8.048 -7.666 1.00 2.63 H new ATOM 0 HG12 VAL A 94 21.626 -7.589 -5.968 1.00 2.63 H new ATOM 0 HG13 VAL A 94 19.968 -7.692 -6.607 1.00 2.63 H new ATOM 0 HG21 VAL A 94 20.637 -6.378 -9.313 1.00 2.56 H new ATOM 0 HG22 VAL A 94 19.216 -5.925 -8.342 1.00 2.56 H new ATOM 0 HG23 VAL A 94 20.388 -4.681 -8.838 1.00 2.56 H new ATOM 1299 N CYS A 95 18.262 -4.300 -6.135 1.00 1.47 N ATOM 1300 CA CYS A 95 16.835 -4.463 -5.961 1.00 1.46 C ATOM 1301 C CYS A 95 16.129 -4.556 -7.296 1.00 1.37 C ATOM 1302 O CYS A 95 16.187 -3.640 -8.117 1.00 1.52 O ATOM 1303 CB CYS A 95 16.246 -3.305 -5.157 1.00 1.77 C ATOM 1304 SG CYS A 95 16.987 -1.699 -5.530 1.00 2.83 S ATOM 0 H CYS A 95 18.552 -3.388 -6.487 1.00 1.47 H new ATOM 0 HA CYS A 95 16.681 -5.393 -5.414 1.00 1.46 H new ATOM 0 HB2 CYS A 95 15.174 -3.252 -5.348 1.00 1.77 H new ATOM 0 HB3 CYS A 95 16.371 -3.513 -4.094 1.00 1.77 H new ATOM 0 HG CYS A 95 16.059 -0.789 -5.558 1.00 2.83 H new ATOM 1310 N THR A 96 15.462 -5.669 -7.506 1.00 1.52 N ATOM 1311 CA THR A 96 14.505 -5.782 -8.579 1.00 1.59 C ATOM 1312 C THR A 96 13.185 -5.258 -8.061 1.00 1.08 C ATOM 1313 O THR A 96 12.852 -5.480 -6.893 1.00 1.31 O ATOM 1314 CB THR A 96 14.315 -7.243 -9.006 1.00 2.27 C ATOM 1315 OG1 THR A 96 15.584 -7.907 -9.068 1.00 2.76 O ATOM 1316 CG2 THR A 96 13.627 -7.331 -10.358 1.00 2.98 C ATOM 0 H THR A 96 15.567 -6.513 -6.943 1.00 1.52 H new ATOM 0 HA THR A 96 14.861 -5.219 -9.442 1.00 1.59 H new ATOM 0 HB THR A 96 13.684 -7.732 -8.264 1.00 2.27 H new ATOM 0 HG1 THR A 96 15.452 -8.839 -9.340 1.00 2.76 H new ATOM 0 HG21 THR A 96 13.505 -8.378 -10.637 1.00 2.98 H new ATOM 0 HG22 THR A 96 12.648 -6.854 -10.300 1.00 2.98 H new ATOM 0 HG23 THR A 96 14.234 -6.824 -11.109 1.00 2.98 H new ATOM 1324 N LYS A 97 12.442 -4.550 -8.886 1.00 1.14 N ATOM 1325 CA LYS A 97 11.150 -4.073 -8.459 1.00 1.11 C ATOM 1326 C LYS A 97 10.240 -5.264 -8.276 1.00 1.04 C ATOM 1327 O LYS A 97 9.968 -6.004 -9.224 1.00 1.76 O ATOM 1328 CB LYS A 97 10.579 -3.054 -9.440 1.00 1.47 C ATOM 1329 CG LYS A 97 10.464 -3.543 -10.874 1.00 1.47 C ATOM 1330 CD LYS A 97 9.911 -2.456 -11.782 1.00 1.89 C ATOM 1331 CE LYS A 97 9.974 -2.862 -13.246 1.00 2.34 C ATOM 1332 NZ LYS A 97 11.372 -3.090 -13.690 1.00 2.72 N ATOM 0 H LYS A 97 12.706 -4.297 -9.838 1.00 1.14 H new ATOM 0 HA LYS A 97 11.244 -3.548 -7.508 1.00 1.11 H new ATOM 0 HB2 LYS A 97 9.590 -2.752 -9.094 1.00 1.47 H new ATOM 0 HB3 LYS A 97 11.208 -2.164 -9.424 1.00 1.47 H new ATOM 0 HG2 LYS A 97 11.444 -3.858 -11.234 1.00 1.47 H new ATOM 0 HG3 LYS A 97 9.815 -4.418 -10.912 1.00 1.47 H new ATOM 0 HD2 LYS A 97 8.878 -2.243 -11.507 1.00 1.89 H new ATOM 0 HD3 LYS A 97 10.476 -1.536 -11.635 1.00 1.89 H new ATOM 0 HE2 LYS A 97 9.391 -3.770 -13.398 1.00 2.34 H new ATOM 0 HE3 LYS A 97 9.519 -2.085 -13.860 1.00 2.34 H new ATOM 0 HZ1 LYS A 97 11.418 -3.046 -14.728 1.00 2.72 H new ATOM 0 HZ2 LYS A 97 11.989 -2.357 -13.285 1.00 2.72 H new ATOM 0 HZ3 LYS A 97 11.690 -4.027 -13.369 1.00 2.72 H new ATOM 1346 N PHE A 98 9.838 -5.477 -7.035 1.00 0.89 N ATOM 1347 CA PHE A 98 9.098 -6.662 -6.671 1.00 0.92 C ATOM 1348 C PHE A 98 7.806 -6.738 -7.473 1.00 1.11 C ATOM 1349 O PHE A 98 6.951 -5.861 -7.392 1.00 2.12 O ATOM 1350 CB PHE A 98 8.878 -6.692 -5.142 1.00 1.15 C ATOM 1351 CG PHE A 98 7.451 -6.768 -4.680 1.00 0.75 C ATOM 1352 CD1 PHE A 98 6.736 -7.943 -4.793 1.00 1.02 C ATOM 1353 CD2 PHE A 98 6.830 -5.663 -4.123 1.00 0.96 C ATOM 1354 CE1 PHE A 98 5.428 -8.015 -4.364 1.00 0.94 C ATOM 1355 CE2 PHE A 98 5.519 -5.735 -3.692 1.00 0.87 C ATOM 1356 CZ PHE A 98 4.820 -6.917 -3.815 1.00 0.45 C ATOM 0 H PHE A 98 10.016 -4.837 -6.261 1.00 0.89 H new ATOM 0 HA PHE A 98 9.668 -7.557 -6.922 1.00 0.92 H new ATOM 0 HB2 PHE A 98 9.416 -7.548 -4.735 1.00 1.15 H new ATOM 0 HB3 PHE A 98 9.330 -5.798 -4.713 1.00 1.15 H new ATOM 0 HD1 PHE A 98 7.206 -8.815 -5.222 1.00 1.02 H new ATOM 0 HD2 PHE A 98 7.375 -4.736 -4.024 1.00 0.96 H new ATOM 0 HE1 PHE A 98 4.880 -8.941 -4.461 1.00 0.94 H new ATOM 0 HE2 PHE A 98 5.043 -4.867 -3.260 1.00 0.87 H new ATOM 0 HZ PHE A 98 3.795 -6.977 -3.479 1.00 0.45 H new ATOM 1366 N LYS A 99 7.714 -7.764 -8.298 1.00 0.80 N ATOM 1367 CA LYS A 99 6.558 -7.959 -9.149 1.00 0.78 C ATOM 1368 C LYS A 99 5.697 -9.087 -8.623 1.00 0.79 C ATOM 1369 O LYS A 99 6.094 -10.253 -8.635 1.00 1.43 O ATOM 1370 CB LYS A 99 7.002 -8.235 -10.588 1.00 1.02 C ATOM 1371 CG LYS A 99 7.585 -7.014 -11.284 1.00 1.34 C ATOM 1372 CD LYS A 99 8.274 -7.382 -12.587 1.00 1.63 C ATOM 1373 CE LYS A 99 9.614 -8.056 -12.336 1.00 2.05 C ATOM 1374 NZ LYS A 99 10.304 -8.404 -13.605 1.00 2.69 N ATOM 0 H LYS A 99 8.433 -8.480 -8.396 1.00 0.80 H new ATOM 0 HA LYS A 99 5.960 -7.048 -9.143 1.00 0.78 H new ATOM 0 HB2 LYS A 99 7.746 -9.032 -10.585 1.00 1.02 H new ATOM 0 HB3 LYS A 99 6.148 -8.598 -11.161 1.00 1.02 H new ATOM 0 HG2 LYS A 99 6.790 -6.295 -11.484 1.00 1.34 H new ATOM 0 HG3 LYS A 99 8.298 -6.524 -10.621 1.00 1.34 H new ATOM 0 HD2 LYS A 99 7.632 -8.048 -13.164 1.00 1.63 H new ATOM 0 HD3 LYS A 99 8.423 -6.485 -13.187 1.00 1.63 H new ATOM 0 HE2 LYS A 99 10.249 -7.394 -11.747 1.00 2.05 H new ATOM 0 HE3 LYS A 99 9.461 -8.960 -11.746 1.00 2.05 H new ATOM 0 HZ1 LYS A 99 11.213 -8.861 -13.392 1.00 2.69 H new ATOM 0 HZ2 LYS A 99 9.710 -9.056 -14.156 1.00 2.69 H new ATOM 0 HZ3 LYS A 99 10.473 -7.539 -14.157 1.00 2.69 H new ATOM 1388 N ALA A 100 4.522 -8.720 -8.153 1.00 0.51 N ATOM 1389 CA ALA A 100 3.603 -9.667 -7.561 1.00 0.43 C ATOM 1390 C ALA A 100 2.431 -9.940 -8.478 1.00 0.40 C ATOM 1391 O ALA A 100 2.490 -9.680 -9.683 1.00 0.55 O ATOM 1392 CB ALA A 100 3.088 -9.126 -6.247 1.00 0.43 C ATOM 0 H ALA A 100 4.179 -7.759 -8.171 1.00 0.51 H new ATOM 0 HA ALA A 100 4.141 -10.601 -7.397 1.00 0.43 H new ATOM 0 HB1 ALA A 100 2.396 -9.843 -5.805 1.00 0.43 H new ATOM 0 HB2 ALA A 100 3.925 -8.963 -5.568 1.00 0.43 H new ATOM 0 HB3 ALA A 100 2.571 -8.182 -6.420 1.00 0.43 H new ATOM 1398 N GLU A 101 1.362 -10.457 -7.893 1.00 0.34 N ATOM 1399 CA GLU A 101 0.125 -10.654 -8.613 1.00 0.40 C ATOM 1400 C GLU A 101 -0.725 -9.389 -8.551 1.00 0.43 C ATOM 1401 O GLU A 101 -1.775 -9.294 -9.188 1.00 0.67 O ATOM 1402 CB GLU A 101 -0.655 -11.836 -8.035 1.00 0.50 C ATOM 1403 CG GLU A 101 0.067 -13.165 -8.169 1.00 0.67 C ATOM 1404 CD GLU A 101 0.346 -13.520 -9.610 1.00 1.24 C ATOM 1405 OE1 GLU A 101 -0.597 -13.929 -10.318 1.00 1.57 O ATOM 1406 OE2 GLU A 101 1.506 -13.381 -10.050 1.00 1.99 O ATOM 0 H GLU A 101 1.332 -10.748 -6.916 1.00 0.34 H new ATOM 0 HA GLU A 101 0.364 -10.873 -9.654 1.00 0.40 H new ATOM 0 HB2 GLU A 101 -0.857 -11.647 -6.981 1.00 0.50 H new ATOM 0 HB3 GLU A 101 -1.620 -11.904 -8.537 1.00 0.50 H new ATOM 0 HG2 GLU A 101 1.007 -13.123 -7.618 1.00 0.67 H new ATOM 0 HG3 GLU A 101 -0.535 -13.951 -7.713 1.00 0.67 H new ATOM 1413 N PHE A 102 -0.251 -8.416 -7.784 1.00 0.38 N ATOM 1414 CA PHE A 102 -0.981 -7.196 -7.553 1.00 0.40 C ATOM 1415 C PHE A 102 -0.162 -5.990 -8.015 1.00 0.45 C ATOM 1416 O PHE A 102 1.057 -6.083 -8.183 1.00 0.80 O ATOM 1417 CB PHE A 102 -1.371 -7.095 -6.075 1.00 0.84 C ATOM 1418 CG PHE A 102 -0.278 -7.412 -5.120 1.00 0.45 C ATOM 1419 CD1 PHE A 102 -0.075 -8.706 -4.710 1.00 0.52 C ATOM 1420 CD2 PHE A 102 0.529 -6.418 -4.629 1.00 0.62 C ATOM 1421 CE1 PHE A 102 0.928 -9.011 -3.819 1.00 0.59 C ATOM 1422 CE2 PHE A 102 1.539 -6.708 -3.736 1.00 0.58 C ATOM 1423 CZ PHE A 102 1.737 -8.014 -3.331 1.00 0.44 C ATOM 0 H PHE A 102 0.651 -8.459 -7.309 1.00 0.38 H new ATOM 0 HA PHE A 102 -1.900 -7.205 -8.139 1.00 0.40 H new ATOM 0 HB2 PHE A 102 -1.727 -6.084 -5.876 1.00 0.84 H new ATOM 0 HB3 PHE A 102 -2.206 -7.770 -5.887 1.00 0.84 H new ATOM 0 HD1 PHE A 102 -0.709 -9.493 -5.091 1.00 0.52 H new ATOM 0 HD2 PHE A 102 0.372 -5.397 -4.945 1.00 0.62 H new ATOM 0 HE1 PHE A 102 1.079 -10.033 -3.504 1.00 0.59 H new ATOM 0 HE2 PHE A 102 2.171 -5.919 -3.356 1.00 0.58 H new ATOM 0 HZ PHE A 102 2.526 -8.250 -2.632 1.00 0.44 H new ATOM 1433 N PRO A 103 -0.843 -4.860 -8.244 1.00 0.33 N ATOM 1434 CA PRO A 103 -0.257 -3.622 -8.801 1.00 0.39 C ATOM 1435 C PRO A 103 0.837 -3.008 -7.944 1.00 0.41 C ATOM 1436 O PRO A 103 0.563 -2.260 -7.016 1.00 0.62 O ATOM 1437 CB PRO A 103 -1.457 -2.675 -8.863 1.00 0.42 C ATOM 1438 CG PRO A 103 -2.375 -3.210 -7.832 1.00 0.58 C ATOM 1439 CD PRO A 103 -2.275 -4.681 -7.971 1.00 0.27 C ATOM 0 HA PRO A 103 0.231 -3.819 -9.755 1.00 0.39 H new ATOM 0 HB2 PRO A 103 -1.168 -1.646 -8.648 1.00 0.42 H new ATOM 0 HB3 PRO A 103 -1.918 -2.676 -9.851 1.00 0.42 H new ATOM 0 HG2 PRO A 103 -2.082 -2.885 -6.833 1.00 0.58 H new ATOM 0 HG3 PRO A 103 -3.396 -2.865 -7.993 1.00 0.58 H new ATOM 0 HD2 PRO A 103 -2.586 -5.200 -7.064 1.00 0.27 H new ATOM 0 HD3 PRO A 103 -2.896 -5.058 -8.783 1.00 0.27 H new ATOM 1447 N ILE A 104 2.079 -3.311 -8.257 1.00 0.35 N ATOM 1448 CA ILE A 104 3.174 -2.626 -7.604 1.00 0.35 C ATOM 1449 C ILE A 104 3.476 -1.357 -8.372 1.00 0.33 C ATOM 1450 O ILE A 104 3.594 -1.378 -9.597 1.00 0.44 O ATOM 1451 CB ILE A 104 4.460 -3.476 -7.498 1.00 0.41 C ATOM 1452 CG1 ILE A 104 4.164 -4.854 -6.896 1.00 0.52 C ATOM 1453 CG2 ILE A 104 5.510 -2.738 -6.660 1.00 0.45 C ATOM 1454 CD1 ILE A 104 3.113 -4.833 -5.823 1.00 1.34 C ATOM 0 H ILE A 104 2.353 -4.012 -8.945 1.00 0.35 H new ATOM 0 HA ILE A 104 2.858 -2.414 -6.583 1.00 0.35 H new ATOM 0 HB ILE A 104 4.853 -3.629 -8.503 1.00 0.41 H new ATOM 0 HG12 ILE A 104 3.844 -5.527 -7.692 1.00 0.52 H new ATOM 0 HG13 ILE A 104 5.085 -5.265 -6.482 1.00 0.52 H new ATOM 0 HG21 ILE A 104 6.413 -3.345 -6.591 1.00 0.45 H new ATOM 0 HG22 ILE A 104 5.749 -1.785 -7.133 1.00 0.45 H new ATOM 0 HG23 ILE A 104 5.116 -2.558 -5.660 1.00 0.45 H new ATOM 0 HD11 ILE A 104 2.958 -5.844 -5.445 1.00 1.34 H new ATOM 0 HD12 ILE A 104 3.438 -4.187 -5.008 1.00 1.34 H new ATOM 0 HD13 ILE A 104 2.179 -4.453 -6.236 1.00 1.34 H new ATOM 1466 N MET A 105 3.553 -0.250 -7.661 1.00 0.29 N ATOM 1467 CA MET A 105 3.897 1.012 -8.277 1.00 0.30 C ATOM 1468 C MET A 105 5.402 1.098 -8.399 1.00 0.27 C ATOM 1469 O MET A 105 6.115 0.223 -7.913 1.00 0.35 O ATOM 1470 CB MET A 105 3.333 2.188 -7.473 1.00 0.43 C ATOM 1471 CG MET A 105 4.350 2.967 -6.653 1.00 1.50 C ATOM 1472 SD MET A 105 4.954 4.456 -7.486 1.00 2.49 S ATOM 1473 CE MET A 105 3.472 5.457 -7.522 1.00 3.03 C ATOM 0 H MET A 105 3.382 -0.200 -6.657 1.00 0.29 H new ATOM 0 HA MET A 105 3.453 1.067 -9.271 1.00 0.30 H new ATOM 0 HB2 MET A 105 2.844 2.876 -8.163 1.00 0.43 H new ATOM 0 HB3 MET A 105 2.563 1.810 -6.801 1.00 0.43 H new ATOM 0 HG2 MET A 105 3.899 3.249 -5.701 1.00 1.50 H new ATOM 0 HG3 MET A 105 5.196 2.318 -6.425 1.00 1.50 H new ATOM 0 HE1 MET A 105 3.555 6.202 -8.313 1.00 3.03 H new ATOM 0 HE2 MET A 105 2.608 4.821 -7.712 1.00 3.03 H new ATOM 0 HE3 MET A 105 3.349 5.959 -6.562 1.00 3.03 H new ATOM 1483 N ALA A 106 5.877 2.138 -9.053 1.00 0.33 N ATOM 1484 CA ALA A 106 7.303 2.287 -9.310 1.00 0.52 C ATOM 1485 C ALA A 106 8.076 2.240 -8.006 1.00 0.66 C ATOM 1486 O ALA A 106 8.969 1.409 -7.823 1.00 1.46 O ATOM 1487 CB ALA A 106 7.562 3.587 -10.031 1.00 0.70 C ATOM 0 H ALA A 106 5.300 2.895 -9.418 1.00 0.33 H new ATOM 0 HA ALA A 106 7.639 1.464 -9.941 1.00 0.52 H new ATOM 0 HB1 ALA A 106 8.630 3.692 -10.220 1.00 0.70 H new ATOM 0 HB2 ALA A 106 7.024 3.591 -10.979 1.00 0.70 H new ATOM 0 HB3 ALA A 106 7.219 4.419 -9.416 1.00 0.70 H new ATOM 1493 N LYS A 107 7.675 3.154 -7.129 1.00 0.40 N ATOM 1494 CA LYS A 107 8.170 3.320 -5.767 1.00 0.36 C ATOM 1495 C LYS A 107 8.180 4.781 -5.484 1.00 0.38 C ATOM 1496 O LYS A 107 8.535 5.606 -6.329 1.00 0.59 O ATOM 1497 CB LYS A 107 9.579 2.776 -5.517 1.00 0.49 C ATOM 1498 CG LYS A 107 10.690 3.574 -6.166 1.00 0.84 C ATOM 1499 CD LYS A 107 12.063 2.975 -5.889 1.00 0.83 C ATOM 1500 CE LYS A 107 12.131 1.504 -6.265 1.00 0.95 C ATOM 1501 NZ LYS A 107 11.718 1.256 -7.672 1.00 1.76 N ATOM 0 H LYS A 107 6.955 3.838 -7.363 1.00 0.40 H new ATOM 0 HA LYS A 107 7.511 2.745 -5.116 1.00 0.36 H new ATOM 0 HB2 LYS A 107 9.755 2.742 -4.442 1.00 0.49 H new ATOM 0 HB3 LYS A 107 9.627 1.750 -5.881 1.00 0.49 H new ATOM 0 HG2 LYS A 107 10.524 3.617 -7.242 1.00 0.84 H new ATOM 0 HG3 LYS A 107 10.662 4.600 -5.798 1.00 0.84 H new ATOM 0 HD2 LYS A 107 12.818 3.527 -6.448 1.00 0.83 H new ATOM 0 HD3 LYS A 107 12.302 3.090 -4.832 1.00 0.83 H new ATOM 0 HE2 LYS A 107 13.149 1.142 -6.119 1.00 0.95 H new ATOM 0 HE3 LYS A 107 11.490 0.931 -5.595 1.00 0.95 H new ATOM 0 HZ1 LYS A 107 12.212 0.416 -8.036 1.00 1.76 H new ATOM 0 HZ2 LYS A 107 10.691 1.097 -7.709 1.00 1.76 H new ATOM 0 HZ3 LYS A 107 11.962 2.081 -8.256 1.00 1.76 H new ATOM 1515 N ILE A 108 7.738 5.089 -4.319 1.00 0.31 N ATOM 1516 CA ILE A 108 7.724 6.427 -3.845 1.00 0.35 C ATOM 1517 C ILE A 108 8.219 6.408 -2.409 1.00 0.36 C ATOM 1518 O ILE A 108 8.304 5.344 -1.800 1.00 0.42 O ATOM 1519 CB ILE A 108 6.304 7.029 -4.013 1.00 0.48 C ATOM 1520 CG1 ILE A 108 5.239 6.134 -3.378 1.00 0.82 C ATOM 1521 CG2 ILE A 108 5.991 7.198 -5.502 1.00 0.68 C ATOM 1522 CD1 ILE A 108 5.038 6.347 -1.902 1.00 0.64 C ATOM 0 H ILE A 108 7.369 4.407 -3.656 1.00 0.31 H new ATOM 0 HA ILE A 108 8.386 7.075 -4.420 1.00 0.35 H new ATOM 0 HB ILE A 108 6.288 7.996 -3.510 1.00 0.48 H new ATOM 0 HG12 ILE A 108 4.291 6.303 -3.888 1.00 0.82 H new ATOM 0 HG13 ILE A 108 5.511 5.092 -3.547 1.00 0.82 H new ATOM 0 HG21 ILE A 108 4.993 7.621 -5.618 1.00 0.68 H new ATOM 0 HG22 ILE A 108 6.724 7.867 -5.954 1.00 0.68 H new ATOM 0 HG23 ILE A 108 6.033 6.227 -5.995 1.00 0.68 H new ATOM 0 HD11 ILE A 108 4.265 5.670 -1.539 1.00 0.64 H new ATOM 0 HD12 ILE A 108 5.971 6.148 -1.375 1.00 0.64 H new ATOM 0 HD13 ILE A 108 4.732 7.377 -1.721 1.00 0.64 H new ATOM 1534 N ASN A 109 8.598 7.560 -1.909 1.00 0.38 N ATOM 1535 CA ASN A 109 9.223 7.690 -0.585 1.00 0.44 C ATOM 1536 C ASN A 109 8.234 7.448 0.531 1.00 0.47 C ATOM 1537 O ASN A 109 8.066 8.313 1.385 1.00 0.76 O ATOM 1538 CB ASN A 109 9.819 9.085 -0.445 1.00 0.53 C ATOM 1539 CG ASN A 109 10.963 9.136 0.551 1.00 0.98 C ATOM 1540 OD1 ASN A 109 12.131 9.173 0.168 1.00 1.73 O ATOM 1541 ND2 ASN A 109 10.645 9.090 1.834 1.00 1.16 N ATOM 0 H ASN A 109 8.487 8.447 -2.400 1.00 0.38 H new ATOM 0 HA ASN A 109 10.004 6.934 -0.505 1.00 0.44 H new ATOM 0 HB2 ASN A 109 10.175 9.423 -1.418 1.00 0.53 H new ATOM 0 HB3 ASN A 109 9.039 9.779 -0.132 1.00 0.53 H new ATOM 0 HD21 ASN A 109 11.380 9.084 2.542 1.00 1.16 H new ATOM 0 HD22 ASN A 109 9.665 9.060 2.116 1.00 1.16 H new ATOM 1548 N VAL A 110 7.599 6.273 0.546 1.00 0.41 N ATOM 1549 CA VAL A 110 6.605 5.985 1.564 1.00 0.42 C ATOM 1550 C VAL A 110 7.266 6.038 2.924 1.00 0.44 C ATOM 1551 O VAL A 110 7.846 5.059 3.393 1.00 0.48 O ATOM 1552 CB VAL A 110 5.961 4.594 1.368 1.00 0.43 C ATOM 1553 CG1 VAL A 110 4.462 4.735 1.225 1.00 0.60 C ATOM 1554 CG2 VAL A 110 6.521 3.877 0.153 1.00 0.77 C ATOM 0 H VAL A 110 7.757 5.522 -0.126 1.00 0.41 H new ATOM 0 HA VAL A 110 5.815 6.732 1.485 1.00 0.42 H new ATOM 0 HB VAL A 110 6.197 3.997 2.249 1.00 0.43 H new ATOM 0 HG11 VAL A 110 4.015 3.750 1.087 1.00 0.60 H new ATOM 0 HG12 VAL A 110 4.053 5.197 2.124 1.00 0.60 H new ATOM 0 HG13 VAL A 110 4.236 5.360 0.361 1.00 0.60 H new ATOM 0 HG21 VAL A 110 6.041 2.903 0.052 1.00 0.77 H new ATOM 0 HG22 VAL A 110 6.329 4.471 -0.741 1.00 0.77 H new ATOM 0 HG23 VAL A 110 7.596 3.741 0.274 1.00 0.77 H new ATOM 1564 N ASN A 111 7.157 7.204 3.535 1.00 0.48 N ATOM 1565 CA ASN A 111 7.762 7.489 4.811 1.00 0.56 C ATOM 1566 C ASN A 111 7.506 8.943 5.157 1.00 0.62 C ATOM 1567 O ASN A 111 6.839 9.647 4.400 1.00 0.67 O ATOM 1568 CB ASN A 111 9.265 7.187 4.839 1.00 0.65 C ATOM 1569 CG ASN A 111 9.713 6.811 6.239 1.00 1.20 C ATOM 1570 OD1 ASN A 111 9.571 5.667 6.657 1.00 1.90 O ATOM 1571 ND2 ASN A 111 10.259 7.768 6.975 1.00 1.72 N ATOM 0 H ASN A 111 6.635 7.989 3.146 1.00 0.48 H new ATOM 0 HA ASN A 111 7.307 6.834 5.554 1.00 0.56 H new ATOM 0 HB2 ASN A 111 9.490 6.373 4.150 1.00 0.65 H new ATOM 0 HB3 ASN A 111 9.822 8.059 4.496 1.00 0.65 H new ATOM 0 HD21 ASN A 111 10.577 7.564 7.922 1.00 1.72 H new ATOM 0 HD22 ASN A 111 10.361 8.709 6.594 1.00 1.72 H new ATOM 1578 N GLY A 112 8.038 9.383 6.270 1.00 0.73 N ATOM 1579 CA GLY A 112 7.823 10.730 6.737 1.00 0.85 C ATOM 1580 C GLY A 112 8.195 11.856 5.772 1.00 0.93 C ATOM 1581 O GLY A 112 7.501 12.874 5.740 1.00 1.47 O ATOM 0 H GLY A 112 8.632 8.818 6.877 1.00 0.73 H new ATOM 0 HA2 GLY A 112 6.770 10.837 6.996 1.00 0.85 H new ATOM 0 HA3 GLY A 112 8.392 10.867 7.656 1.00 0.85 H new ATOM 1585 N GLU A 113 9.243 11.707 4.957 1.00 0.88 N ATOM 1586 CA GLU A 113 9.898 12.912 4.446 1.00 1.23 C ATOM 1587 C GLU A 113 9.275 13.445 3.155 1.00 1.10 C ATOM 1588 O GLU A 113 9.085 14.655 3.009 1.00 1.39 O ATOM 1589 CB GLU A 113 11.408 12.703 4.273 1.00 1.61 C ATOM 1590 CG GLU A 113 11.793 11.672 3.233 1.00 1.83 C ATOM 1591 CD GLU A 113 12.883 12.175 2.315 1.00 2.29 C ATOM 1592 OE1 GLU A 113 12.576 12.962 1.400 1.00 2.65 O ATOM 1593 OE2 GLU A 113 14.052 11.790 2.502 1.00 2.81 O ATOM 0 H GLU A 113 9.638 10.818 4.651 1.00 0.88 H new ATOM 0 HA GLU A 113 9.736 13.676 5.206 1.00 1.23 H new ATOM 0 HB2 GLU A 113 11.864 13.656 4.005 1.00 1.61 H new ATOM 0 HB3 GLU A 113 11.831 12.406 5.232 1.00 1.61 H new ATOM 0 HG2 GLU A 113 12.129 10.763 3.731 1.00 1.83 H new ATOM 0 HG3 GLU A 113 10.916 11.407 2.643 1.00 1.83 H new ATOM 1600 N ASN A 114 8.952 12.564 2.225 1.00 0.79 N ATOM 1601 CA ASN A 114 8.418 13.005 0.945 1.00 0.79 C ATOM 1602 C ASN A 114 7.154 12.245 0.614 1.00 0.79 C ATOM 1603 O ASN A 114 6.213 12.799 0.042 1.00 1.22 O ATOM 1604 CB ASN A 114 9.460 12.803 -0.164 1.00 0.87 C ATOM 1605 CG ASN A 114 8.983 13.290 -1.522 1.00 1.45 C ATOM 1606 OD1 ASN A 114 8.186 14.220 -1.620 1.00 2.06 O ATOM 1607 ND2 ASN A 114 9.480 12.671 -2.584 1.00 2.16 N ATOM 0 H ASN A 114 9.047 11.554 2.327 1.00 0.79 H new ATOM 0 HA ASN A 114 8.181 14.067 1.015 1.00 0.79 H new ATOM 0 HB2 ASN A 114 10.375 13.331 0.104 1.00 0.87 H new ATOM 0 HB3 ASN A 114 9.711 11.744 -0.231 1.00 0.87 H new ATOM 0 HD21 ASN A 114 9.203 12.963 -3.521 1.00 2.16 H new ATOM 0 HD22 ASN A 114 10.140 11.902 -2.464 1.00 2.16 H new ATOM 1614 N ALA A 115 7.136 10.981 1.040 1.00 0.59 N ATOM 1615 CA ALA A 115 6.077 10.048 0.693 1.00 0.61 C ATOM 1616 C ALA A 115 5.658 10.240 -0.753 1.00 0.68 C ATOM 1617 O ALA A 115 6.495 10.297 -1.658 1.00 1.26 O ATOM 1618 CB ALA A 115 4.899 10.201 1.643 1.00 0.86 C ATOM 0 H ALA A 115 7.860 10.580 1.637 1.00 0.59 H new ATOM 0 HA ALA A 115 6.454 9.031 0.798 1.00 0.61 H new ATOM 0 HB1 ALA A 115 4.116 9.495 1.368 1.00 0.86 H new ATOM 0 HB2 ALA A 115 5.226 10.001 2.663 1.00 0.86 H new ATOM 0 HB3 ALA A 115 4.510 11.217 1.579 1.00 0.86 H new ATOM 1624 N HIS A 116 4.370 10.317 -0.958 1.00 0.42 N ATOM 1625 CA HIS A 116 3.805 10.690 -2.209 1.00 0.35 C ATOM 1626 C HIS A 116 2.470 11.299 -1.885 1.00 0.29 C ATOM 1627 O HIS A 116 1.806 10.784 -1.011 1.00 0.29 O ATOM 1628 CB HIS A 116 3.684 9.444 -3.105 1.00 0.35 C ATOM 1629 CG HIS A 116 2.780 9.622 -4.270 1.00 0.31 C ATOM 1630 ND1 HIS A 116 1.456 9.793 -4.077 1.00 0.33 N ATOM 1631 CD2 HIS A 116 2.986 9.738 -5.606 1.00 0.31 C ATOM 1632 CE1 HIS A 116 0.865 10.031 -5.205 1.00 0.32 C ATOM 1633 NE2 HIS A 116 1.762 10.002 -6.170 1.00 0.32 N ATOM 0 H HIS A 116 3.676 10.116 -0.238 1.00 0.42 H new ATOM 0 HA HIS A 116 4.416 11.405 -2.760 1.00 0.35 H new ATOM 0 HB2 HIS A 116 4.676 9.171 -3.466 1.00 0.35 H new ATOM 0 HB3 HIS A 116 3.324 8.610 -2.503 1.00 0.35 H new ATOM 0 HD2 HIS A 116 3.928 9.642 -6.125 1.00 0.31 H new ATOM 0 HE1 HIS A 116 -0.190 10.222 -5.333 1.00 0.32 H new ATOM 0 HE2 HIS A 116 1.579 10.150 -7.163 1.00 0.32 H new ATOM 1642 N PRO A 117 2.093 12.417 -2.529 1.00 0.31 N ATOM 1643 CA PRO A 117 0.818 13.100 -2.310 1.00 0.31 C ATOM 1644 C PRO A 117 -0.317 12.159 -1.879 1.00 0.26 C ATOM 1645 O PRO A 117 -1.053 12.460 -0.957 1.00 0.27 O ATOM 1646 CB PRO A 117 0.536 13.708 -3.686 1.00 0.37 C ATOM 1647 CG PRO A 117 1.863 13.817 -4.382 1.00 0.40 C ATOM 1648 CD PRO A 117 2.897 13.150 -3.509 1.00 0.38 C ATOM 0 HA PRO A 117 0.873 13.823 -1.496 1.00 0.31 H new ATOM 0 HB2 PRO A 117 -0.150 13.080 -4.255 1.00 0.37 H new ATOM 0 HB3 PRO A 117 0.067 14.687 -3.589 1.00 0.37 H new ATOM 0 HG2 PRO A 117 1.822 13.338 -5.360 1.00 0.40 H new ATOM 0 HG3 PRO A 117 2.122 14.862 -4.550 1.00 0.40 H new ATOM 0 HD2 PRO A 117 3.537 12.481 -4.084 1.00 0.38 H new ATOM 0 HD3 PRO A 117 3.548 13.880 -3.029 1.00 0.38 H new ATOM 1656 N LEU A 118 -0.422 11.012 -2.545 1.00 0.24 N ATOM 1657 CA LEU A 118 -1.390 9.970 -2.209 1.00 0.23 C ATOM 1658 C LEU A 118 -1.202 9.447 -0.775 1.00 0.27 C ATOM 1659 O LEU A 118 -2.143 9.416 0.011 1.00 0.28 O ATOM 1660 CB LEU A 118 -1.244 8.845 -3.219 1.00 0.24 C ATOM 1661 CG LEU A 118 -2.117 7.624 -3.004 1.00 0.25 C ATOM 1662 CD1 LEU A 118 -3.559 7.964 -3.303 1.00 0.39 C ATOM 1663 CD2 LEU A 118 -1.645 6.472 -3.873 1.00 0.27 C ATOM 0 H LEU A 118 0.169 10.777 -3.342 1.00 0.24 H new ATOM 0 HA LEU A 118 -2.395 10.390 -2.252 1.00 0.23 H new ATOM 0 HB2 LEU A 118 -1.457 9.246 -4.210 1.00 0.24 H new ATOM 0 HB3 LEU A 118 -0.203 8.523 -3.223 1.00 0.24 H new ATOM 0 HG LEU A 118 -2.040 7.314 -1.962 1.00 0.25 H new ATOM 0 HD11 LEU A 118 -4.181 7.082 -3.147 1.00 0.39 H new ATOM 0 HD12 LEU A 118 -3.889 8.763 -2.640 1.00 0.39 H new ATOM 0 HD13 LEU A 118 -3.648 8.292 -4.339 1.00 0.39 H new ATOM 0 HD21 LEU A 118 -2.283 5.604 -3.705 1.00 0.27 H new ATOM 0 HD22 LEU A 118 -1.696 6.763 -4.922 1.00 0.27 H new ATOM 0 HD23 LEU A 118 -0.616 6.220 -3.616 1.00 0.27 H new ATOM 1675 N TYR A 119 0.020 9.049 -0.440 1.00 0.32 N ATOM 1676 CA TYR A 119 0.328 8.538 0.893 1.00 0.42 C ATOM 1677 C TYR A 119 0.453 9.643 1.900 1.00 0.40 C ATOM 1678 O TYR A 119 0.082 9.471 3.054 1.00 0.41 O ATOM 1679 CB TYR A 119 1.603 7.729 0.898 1.00 0.57 C ATOM 1680 CG TYR A 119 1.393 6.346 0.393 1.00 0.54 C ATOM 1681 CD1 TYR A 119 1.373 6.098 -0.960 1.00 0.92 C ATOM 1682 CD2 TYR A 119 1.208 5.291 1.270 1.00 1.09 C ATOM 1683 CE1 TYR A 119 1.184 4.834 -1.437 1.00 1.74 C ATOM 1684 CE2 TYR A 119 1.016 4.013 0.803 1.00 1.88 C ATOM 1685 CZ TYR A 119 1.007 3.790 -0.553 1.00 2.20 C ATOM 1686 OH TYR A 119 0.838 2.523 -1.025 1.00 3.04 O ATOM 0 H TYR A 119 0.818 9.070 -1.075 1.00 0.32 H new ATOM 0 HA TYR A 119 -0.508 7.896 1.171 1.00 0.42 H new ATOM 0 HB2 TYR A 119 2.351 8.229 0.283 1.00 0.57 H new ATOM 0 HB3 TYR A 119 2.001 7.687 1.912 1.00 0.57 H new ATOM 0 HD1 TYR A 119 1.509 6.915 -1.654 1.00 0.92 H new ATOM 0 HD2 TYR A 119 1.215 5.475 2.334 1.00 1.09 H new ATOM 0 HE1 TYR A 119 1.173 4.652 -2.501 1.00 1.74 H new ATOM 0 HE2 TYR A 119 0.874 3.194 1.493 1.00 1.88 H new ATOM 0 HH TYR A 119 1.632 1.988 -0.817 1.00 3.04 H new ATOM 1696 N GLU A 120 1.000 10.767 1.479 1.00 0.40 N ATOM 1697 CA GLU A 120 1.019 11.926 2.331 1.00 0.42 C ATOM 1698 C GLU A 120 -0.396 12.273 2.663 1.00 0.37 C ATOM 1699 O GLU A 120 -0.686 12.703 3.767 1.00 0.43 O ATOM 1700 CB GLU A 120 1.723 13.097 1.668 1.00 0.50 C ATOM 1701 CG GLU A 120 3.216 13.083 1.891 1.00 0.76 C ATOM 1702 CD GLU A 120 3.586 13.293 3.346 1.00 1.58 C ATOM 1703 OE1 GLU A 120 3.609 12.309 4.111 1.00 2.44 O ATOM 1704 OE2 GLU A 120 3.871 14.446 3.732 1.00 1.93 O ATOM 0 H GLU A 120 1.430 10.896 0.563 1.00 0.40 H new ATOM 0 HA GLU A 120 1.578 11.703 3.240 1.00 0.42 H new ATOM 0 HB2 GLU A 120 1.520 13.078 0.597 1.00 0.50 H new ATOM 0 HB3 GLU A 120 1.311 14.029 2.055 1.00 0.50 H new ATOM 0 HG2 GLU A 120 3.623 12.131 1.550 1.00 0.76 H new ATOM 0 HG3 GLU A 120 3.678 13.863 1.285 1.00 0.76 H new ATOM 1711 N TYR A 121 -1.291 12.016 1.718 1.00 0.29 N ATOM 1712 CA TYR A 121 -2.709 12.160 2.009 1.00 0.28 C ATOM 1713 C TYR A 121 -3.179 11.058 2.951 1.00 0.27 C ATOM 1714 O TYR A 121 -4.036 11.275 3.807 1.00 0.29 O ATOM 1715 CB TYR A 121 -3.547 12.122 0.737 1.00 0.28 C ATOM 1716 CG TYR A 121 -5.021 11.968 1.007 1.00 0.30 C ATOM 1717 CD1 TYR A 121 -5.796 13.067 1.349 1.00 0.39 C ATOM 1718 CD2 TYR A 121 -5.642 10.736 0.890 1.00 0.33 C ATOM 1719 CE1 TYR A 121 -7.147 12.941 1.569 1.00 0.46 C ATOM 1720 CE2 TYR A 121 -6.996 10.602 1.103 1.00 0.41 C ATOM 1721 CZ TYR A 121 -7.718 11.661 1.568 1.00 0.46 C ATOM 1722 OH TYR A 121 -9.099 11.579 1.642 1.00 0.56 O ATOM 0 H TYR A 121 -1.069 11.715 0.769 1.00 0.29 H new ATOM 0 HA TYR A 121 -2.842 13.131 2.487 1.00 0.28 H new ATOM 0 HB2 TYR A 121 -3.381 13.039 0.172 1.00 0.28 H new ATOM 0 HB3 TYR A 121 -3.210 11.296 0.111 1.00 0.28 H new ATOM 0 HD1 TYR A 121 -5.330 14.037 1.444 1.00 0.39 H new ATOM 0 HD2 TYR A 121 -5.056 9.867 0.628 1.00 0.33 H new ATOM 0 HE1 TYR A 121 -7.759 13.814 1.740 1.00 0.46 H new ATOM 0 HE2 TYR A 121 -7.485 9.660 0.902 1.00 0.41 H new ATOM 0 HH TYR A 121 -9.372 10.638 1.632 1.00 0.56 H new ATOM 1732 N MET A 122 -2.590 9.891 2.809 1.00 0.27 N ATOM 1733 CA MET A 122 -3.095 8.702 3.466 1.00 0.29 C ATOM 1734 C MET A 122 -2.787 8.756 4.951 1.00 0.33 C ATOM 1735 O MET A 122 -3.685 8.664 5.786 1.00 0.35 O ATOM 1736 CB MET A 122 -2.510 7.440 2.840 1.00 0.33 C ATOM 1737 CG MET A 122 -3.571 6.422 2.498 1.00 0.71 C ATOM 1738 SD MET A 122 -3.047 5.272 1.224 1.00 0.56 S ATOM 1739 CE MET A 122 -3.129 6.354 -0.188 1.00 0.55 C ATOM 0 H MET A 122 -1.756 9.738 2.242 1.00 0.27 H new ATOM 0 HA MET A 122 -4.176 8.669 3.333 1.00 0.29 H new ATOM 0 HB2 MET A 122 -1.962 7.707 1.937 1.00 0.33 H new ATOM 0 HB3 MET A 122 -1.792 6.995 3.529 1.00 0.33 H new ATOM 0 HG2 MET A 122 -3.837 5.865 3.397 1.00 0.71 H new ATOM 0 HG3 MET A 122 -4.471 6.940 2.166 1.00 0.71 H new ATOM 0 HE1 MET A 122 -3.924 6.022 -0.855 1.00 0.55 H new ATOM 0 HE2 MET A 122 -3.336 7.371 0.145 1.00 0.55 H new ATOM 0 HE3 MET A 122 -2.177 6.332 -0.719 1.00 0.55 H new ATOM 1749 N LYS A 123 -1.507 8.929 5.278 1.00 0.37 N ATOM 1750 CA LYS A 123 -1.097 9.075 6.664 1.00 0.45 C ATOM 1751 C LYS A 123 -1.526 10.418 7.237 1.00 0.47 C ATOM 1752 O LYS A 123 -1.648 10.557 8.448 1.00 0.54 O ATOM 1753 CB LYS A 123 0.406 8.852 6.881 1.00 0.53 C ATOM 1754 CG LYS A 123 1.276 9.162 5.687 1.00 0.48 C ATOM 1755 CD LYS A 123 2.633 9.700 6.107 1.00 1.00 C ATOM 1756 CE LYS A 123 2.515 10.968 6.943 1.00 1.05 C ATOM 1757 NZ LYS A 123 1.991 12.112 6.155 1.00 1.46 N ATOM 0 H LYS A 123 -0.744 8.971 4.603 1.00 0.37 H new ATOM 0 HA LYS A 123 -1.613 8.283 7.207 1.00 0.45 H new ATOM 0 HB2 LYS A 123 0.732 9.468 7.719 1.00 0.53 H new ATOM 0 HB3 LYS A 123 0.566 7.813 7.168 1.00 0.53 H new ATOM 0 HG2 LYS A 123 1.411 8.260 5.090 1.00 0.48 H new ATOM 0 HG3 LYS A 123 0.775 9.892 5.051 1.00 0.48 H new ATOM 0 HD2 LYS A 123 3.163 8.938 6.678 1.00 1.00 H new ATOM 0 HD3 LYS A 123 3.231 9.906 5.219 1.00 1.00 H new ATOM 0 HE2 LYS A 123 1.857 10.782 7.792 1.00 1.05 H new ATOM 0 HE3 LYS A 123 3.493 11.226 7.349 1.00 1.05 H new ATOM 0 HZ1 LYS A 123 2.295 13.004 6.594 1.00 1.46 H new ATOM 0 HZ2 LYS A 123 2.359 12.062 5.183 1.00 1.46 H new ATOM 0 HZ3 LYS A 123 0.952 12.072 6.134 1.00 1.46 H new ATOM 1771 N LYS A 124 -1.734 11.429 6.390 1.00 0.43 N ATOM 1772 CA LYS A 124 -2.244 12.691 6.906 1.00 0.50 C ATOM 1773 C LYS A 124 -3.684 12.491 7.364 1.00 0.49 C ATOM 1774 O LYS A 124 -4.169 13.174 8.264 1.00 0.57 O ATOM 1775 CB LYS A 124 -2.139 13.844 5.899 1.00 0.56 C ATOM 1776 CG LYS A 124 -3.389 14.088 5.071 1.00 0.59 C ATOM 1777 CD LYS A 124 -3.187 15.234 4.094 1.00 0.97 C ATOM 1778 CE LYS A 124 -4.480 15.587 3.382 1.00 1.41 C ATOM 1779 NZ LYS A 124 -5.459 16.245 4.288 1.00 1.99 N ATOM 0 H LYS A 124 -1.564 11.400 5.385 1.00 0.43 H new ATOM 0 HA LYS A 124 -1.619 12.984 7.750 1.00 0.50 H new ATOM 0 HB2 LYS A 124 -1.896 14.758 6.440 1.00 0.56 H new ATOM 0 HB3 LYS A 124 -1.308 13.642 5.224 1.00 0.56 H new ATOM 0 HG2 LYS A 124 -3.648 13.182 4.524 1.00 0.59 H new ATOM 0 HG3 LYS A 124 -4.227 14.313 5.731 1.00 0.59 H new ATOM 0 HD2 LYS A 124 -2.813 16.108 4.628 1.00 0.97 H new ATOM 0 HD3 LYS A 124 -2.429 14.960 3.361 1.00 0.97 H new ATOM 0 HE2 LYS A 124 -4.262 16.248 2.543 1.00 1.41 H new ATOM 0 HE3 LYS A 124 -4.923 14.682 2.967 1.00 1.41 H new ATOM 0 HZ1 LYS A 124 -6.252 16.619 3.729 1.00 1.99 H new ATOM 0 HZ2 LYS A 124 -5.816 15.551 4.975 1.00 1.99 H new ATOM 0 HZ3 LYS A 124 -4.994 17.025 4.794 1.00 1.99 H new ATOM 1793 N THR A 125 -4.353 11.529 6.740 1.00 0.42 N ATOM 1794 CA THR A 125 -5.682 11.123 7.166 1.00 0.44 C ATOM 1795 C THR A 125 -5.574 10.252 8.420 1.00 0.44 C ATOM 1796 O THR A 125 -6.246 10.501 9.422 1.00 0.56 O ATOM 1797 CB THR A 125 -6.420 10.356 6.047 1.00 0.49 C ATOM 1798 OG1 THR A 125 -6.461 11.155 4.854 1.00 0.57 O ATOM 1799 CG2 THR A 125 -7.838 10.000 6.469 1.00 0.59 C ATOM 0 H THR A 125 -3.994 11.016 5.935 1.00 0.42 H new ATOM 0 HA THR A 125 -6.260 12.019 7.392 1.00 0.44 H new ATOM 0 HB THR A 125 -5.875 9.432 5.854 1.00 0.49 H new ATOM 0 HG1 THR A 125 -5.663 10.977 4.314 1.00 0.57 H new ATOM 0 HG21 THR A 125 -8.333 9.461 5.662 1.00 0.59 H new ATOM 0 HG22 THR A 125 -7.806 9.371 7.359 1.00 0.59 H new ATOM 0 HG23 THR A 125 -8.392 10.913 6.689 1.00 0.59 H new ATOM 1807 N LYS A 126 -4.708 9.245 8.355 1.00 0.44 N ATOM 1808 CA LYS A 126 -4.435 8.378 9.497 1.00 0.54 C ATOM 1809 C LYS A 126 -2.944 8.081 9.616 1.00 0.57 C ATOM 1810 O LYS A 126 -2.389 7.323 8.820 1.00 0.68 O ATOM 1811 CB LYS A 126 -5.194 7.060 9.384 1.00 0.78 C ATOM 1812 CG LYS A 126 -6.619 7.115 9.891 1.00 1.26 C ATOM 1813 CD LYS A 126 -7.043 5.755 10.404 1.00 0.92 C ATOM 1814 CE LYS A 126 -8.519 5.721 10.767 1.00 1.27 C ATOM 1815 NZ LYS A 126 -8.858 6.667 11.861 1.00 1.85 N ATOM 0 H LYS A 126 -4.179 9.008 7.516 1.00 0.44 H new ATOM 0 HA LYS A 126 -4.770 8.910 10.387 1.00 0.54 H new ATOM 0 HB2 LYS A 126 -5.204 6.749 8.339 1.00 0.78 H new ATOM 0 HB3 LYS A 126 -4.653 6.294 9.939 1.00 0.78 H new ATOM 0 HG2 LYS A 126 -6.701 7.854 10.688 1.00 1.26 H new ATOM 0 HG3 LYS A 126 -7.286 7.434 9.090 1.00 1.26 H new ATOM 0 HD2 LYS A 126 -6.838 5.001 9.644 1.00 0.92 H new ATOM 0 HD3 LYS A 126 -6.448 5.495 11.279 1.00 0.92 H new ATOM 0 HE2 LYS A 126 -9.112 5.963 9.885 1.00 1.27 H new ATOM 0 HE3 LYS A 126 -8.793 4.710 11.068 1.00 1.27 H new ATOM 0 HZ1 LYS A 126 -9.864 6.569 12.105 1.00 1.85 H new ATOM 0 HZ2 LYS A 126 -8.276 6.454 12.697 1.00 1.85 H new ATOM 0 HZ3 LYS A 126 -8.671 7.641 11.548 1.00 1.85 H new ATOM 1829 N PRO A 127 -2.290 8.636 10.643 1.00 0.77 N ATOM 1830 CA PRO A 127 -0.849 8.486 10.847 1.00 1.04 C ATOM 1831 C PRO A 127 -0.499 7.081 11.312 1.00 1.27 C ATOM 1832 O PRO A 127 0.413 6.445 10.786 1.00 1.69 O ATOM 1833 CB PRO A 127 -0.518 9.520 11.940 1.00 1.28 C ATOM 1834 CG PRO A 127 -1.765 10.330 12.124 1.00 1.22 C ATOM 1835 CD PRO A 127 -2.901 9.444 11.702 1.00 0.95 C ATOM 0 HA PRO A 127 -0.283 8.643 9.929 1.00 1.04 H new ATOM 0 HB2 PRO A 127 -0.230 9.029 12.869 1.00 1.28 H new ATOM 0 HB3 PRO A 127 0.318 10.152 11.641 1.00 1.28 H new ATOM 0 HG2 PRO A 127 -1.878 10.641 13.162 1.00 1.22 H new ATOM 0 HG3 PRO A 127 -1.733 11.237 11.521 1.00 1.22 H new ATOM 0 HD2 PRO A 127 -3.264 8.828 12.525 1.00 0.95 H new ATOM 0 HD3 PRO A 127 -3.751 10.019 11.335 1.00 0.95 H new ATOM 1843 N GLY A 128 -1.247 6.594 12.287 1.00 1.55 N ATOM 1844 CA GLY A 128 -1.040 5.254 12.777 1.00 1.96 C ATOM 1845 C GLY A 128 -2.031 4.889 13.853 1.00 2.13 C ATOM 1846 O GLY A 128 -2.418 5.739 14.653 1.00 2.59 O ATOM 0 H GLY A 128 -1.998 7.108 12.749 1.00 1.55 H new ATOM 0 HA2 GLY A 128 -1.125 4.548 11.951 1.00 1.96 H new ATOM 0 HA3 GLY A 128 -0.027 5.164 13.170 1.00 1.96 H new ATOM 1850 N ILE A 129 -2.475 3.633 13.852 1.00 2.17 N ATOM 1851 CA ILE A 129 -3.263 3.111 14.962 1.00 2.46 C ATOM 1852 C ILE A 129 -2.374 3.059 16.194 1.00 2.36 C ATOM 1853 O ILE A 129 -2.833 3.157 17.331 1.00 2.70 O ATOM 1854 CB ILE A 129 -3.849 1.711 14.658 1.00 2.91 C ATOM 1855 CG1 ILE A 129 -2.752 0.747 14.191 1.00 3.06 C ATOM 1856 CG2 ILE A 129 -4.956 1.820 13.615 1.00 3.44 C ATOM 1857 CD1 ILE A 129 -3.247 -0.660 13.928 1.00 3.58 C ATOM 0 H ILE A 129 -2.303 2.965 13.101 1.00 2.17 H new ATOM 0 HA ILE A 129 -4.113 3.772 15.130 1.00 2.46 H new ATOM 0 HB ILE A 129 -4.276 1.308 15.577 1.00 2.91 H new ATOM 0 HG12 ILE A 129 -2.300 1.139 13.280 1.00 3.06 H new ATOM 0 HG13 ILE A 129 -1.967 0.711 14.946 1.00 3.06 H new ATOM 0 HG21 ILE A 129 -5.361 0.829 13.409 1.00 3.44 H new ATOM 0 HG22 ILE A 129 -5.750 2.465 13.993 1.00 3.44 H new ATOM 0 HG23 ILE A 129 -4.550 2.244 12.697 1.00 3.44 H new ATOM 0 HD11 ILE A 129 -2.415 -1.283 13.601 1.00 3.58 H new ATOM 0 HD12 ILE A 129 -3.673 -1.073 14.843 1.00 3.58 H new ATOM 0 HD13 ILE A 129 -4.011 -0.638 13.150 1.00 3.58 H new ATOM 1869 N LEU A 130 -1.086 2.905 15.928 1.00 2.12 N ATOM 1870 CA LEU A 130 -0.054 3.138 16.913 1.00 2.29 C ATOM 1871 C LEU A 130 0.415 4.574 16.744 1.00 2.20 C ATOM 1872 O LEU A 130 0.489 5.062 15.616 1.00 2.44 O ATOM 1873 CB LEU A 130 1.115 2.173 16.687 1.00 2.58 C ATOM 1874 CG LEU A 130 2.211 2.202 17.751 1.00 2.89 C ATOM 1875 CD1 LEU A 130 1.670 1.725 19.089 1.00 3.36 C ATOM 1876 CD2 LEU A 130 3.391 1.347 17.316 1.00 3.47 C ATOM 0 H LEU A 130 -0.731 2.613 15.017 1.00 2.12 H new ATOM 0 HA LEU A 130 -0.437 2.973 17.920 1.00 2.29 H new ATOM 0 HB2 LEU A 130 0.719 1.159 16.627 1.00 2.58 H new ATOM 0 HB3 LEU A 130 1.566 2.397 15.720 1.00 2.58 H new ATOM 0 HG LEU A 130 2.553 3.230 17.868 1.00 2.89 H new ATOM 0 HD11 LEU A 130 2.465 1.753 19.834 1.00 3.36 H new ATOM 0 HD12 LEU A 130 0.854 2.376 19.405 1.00 3.36 H new ATOM 0 HD13 LEU A 130 1.302 0.704 18.989 1.00 3.36 H new ATOM 0 HD21 LEU A 130 4.164 1.377 18.083 1.00 3.47 H new ATOM 0 HD22 LEU A 130 3.061 0.318 17.173 1.00 3.47 H new ATOM 0 HD23 LEU A 130 3.794 1.733 16.380 1.00 3.47 H new ATOM 1888 N ALA A 131 0.702 5.254 17.842 1.00 2.45 N ATOM 1889 CA ALA A 131 1.104 6.653 17.778 1.00 2.67 C ATOM 1890 C ALA A 131 2.489 6.795 17.159 1.00 2.55 C ATOM 1891 O ALA A 131 3.487 6.941 17.862 1.00 3.21 O ATOM 1892 CB ALA A 131 1.065 7.284 19.161 1.00 3.28 C ATOM 0 H ALA A 131 0.665 4.865 18.784 1.00 2.45 H new ATOM 0 HA ALA A 131 0.395 7.180 17.140 1.00 2.67 H new ATOM 0 HB1 ALA A 131 1.368 8.329 19.093 1.00 3.28 H new ATOM 0 HB2 ALA A 131 0.052 7.225 19.559 1.00 3.28 H new ATOM 0 HB3 ALA A 131 1.747 6.751 19.824 1.00 3.28 H new ATOM 1898 N THR A 132 2.547 6.726 15.839 1.00 2.02 N ATOM 1899 CA THR A 132 3.806 6.825 15.132 1.00 2.10 C ATOM 1900 C THR A 132 3.833 8.038 14.203 1.00 1.56 C ATOM 1901 O THR A 132 4.148 9.146 14.642 1.00 2.12 O ATOM 1902 CB THR A 132 4.092 5.542 14.332 1.00 2.73 C ATOM 1903 OG1 THR A 132 3.829 4.397 15.152 1.00 3.34 O ATOM 1904 CG2 THR A 132 5.537 5.504 13.863 1.00 3.56 C ATOM 0 H THR A 132 1.733 6.601 15.237 1.00 2.02 H new ATOM 0 HA THR A 132 4.587 6.952 15.881 1.00 2.10 H new ATOM 0 HB THR A 132 3.443 5.531 13.457 1.00 2.73 H new ATOM 0 HG1 THR A 132 3.391 3.704 14.615 1.00 3.34 H new ATOM 0 HG21 THR A 132 5.713 4.587 13.300 1.00 3.56 H new ATOM 0 HG22 THR A 132 5.735 6.365 13.225 1.00 3.56 H new ATOM 0 HG23 THR A 132 6.201 5.532 14.727 1.00 3.56 H new ATOM 1912 N LYS A 133 3.467 7.838 12.937 1.00 1.29 N ATOM 1913 CA LYS A 133 3.541 8.908 11.946 1.00 1.47 C ATOM 1914 C LYS A 133 3.081 8.424 10.578 1.00 1.14 C ATOM 1915 O LYS A 133 2.257 9.067 9.927 1.00 1.58 O ATOM 1916 CB LYS A 133 4.979 9.434 11.835 1.00 2.24 C ATOM 1917 CG LYS A 133 5.138 10.608 10.883 1.00 3.04 C ATOM 1918 CD LYS A 133 6.591 11.048 10.785 1.00 3.81 C ATOM 1919 CE LYS A 133 6.756 12.263 9.886 1.00 4.63 C ATOM 1920 NZ LYS A 133 6.026 13.445 10.412 1.00 5.17 N ATOM 0 H LYS A 133 3.118 6.950 12.576 1.00 1.29 H new ATOM 0 HA LYS A 133 2.880 9.709 12.277 1.00 1.47 H new ATOM 0 HB2 LYS A 133 5.322 9.734 12.825 1.00 2.24 H new ATOM 0 HB3 LYS A 133 5.627 8.622 11.505 1.00 2.24 H new ATOM 0 HG2 LYS A 133 4.773 10.329 9.895 1.00 3.04 H new ATOM 0 HG3 LYS A 133 4.526 11.442 11.226 1.00 3.04 H new ATOM 0 HD2 LYS A 133 6.968 11.280 11.781 1.00 3.81 H new ATOM 0 HD3 LYS A 133 7.194 10.226 10.399 1.00 3.81 H new ATOM 0 HE2 LYS A 133 7.815 12.503 9.791 1.00 4.63 H new ATOM 0 HE3 LYS A 133 6.392 12.027 8.886 1.00 4.63 H new ATOM 0 HZ1 LYS A 133 6.359 14.303 9.928 1.00 5.17 H new ATOM 0 HZ2 LYS A 133 5.007 13.326 10.244 1.00 5.17 H new ATOM 0 HZ3 LYS A 133 6.200 13.534 11.433 1.00 5.17 H new ATOM 1934 N ALA A 134 3.612 7.285 10.142 1.00 0.92 N ATOM 1935 CA ALA A 134 3.373 6.819 8.785 1.00 0.77 C ATOM 1936 C ALA A 134 3.494 5.306 8.661 1.00 0.81 C ATOM 1937 O ALA A 134 3.667 4.595 9.651 1.00 1.59 O ATOM 1938 CB ALA A 134 4.362 7.486 7.840 1.00 1.02 C ATOM 0 H ALA A 134 4.205 6.675 10.705 1.00 0.92 H new ATOM 0 HA ALA A 134 2.350 7.088 8.521 1.00 0.77 H new ATOM 0 HB1 ALA A 134 4.184 7.138 6.822 1.00 1.02 H new ATOM 0 HB2 ALA A 134 4.232 8.567 7.881 1.00 1.02 H new ATOM 0 HB3 ALA A 134 5.379 7.231 8.138 1.00 1.02 H new ATOM 1944 N ILE A 135 3.405 4.841 7.417 1.00 0.69 N ATOM 1945 CA ILE A 135 3.634 3.445 7.047 1.00 0.74 C ATOM 1946 C ILE A 135 5.123 3.067 7.197 1.00 1.09 C ATOM 1947 O ILE A 135 5.691 2.466 6.292 1.00 2.00 O ATOM 1948 CB ILE A 135 3.240 3.176 5.571 1.00 0.86 C ATOM 1949 CG1 ILE A 135 3.837 4.229 4.613 1.00 0.88 C ATOM 1950 CG2 ILE A 135 1.734 3.101 5.426 1.00 1.54 C ATOM 1951 CD1 ILE A 135 3.091 5.556 4.568 1.00 0.89 C ATOM 0 H ILE A 135 3.167 5.435 6.622 1.00 0.69 H new ATOM 0 HA ILE A 135 3.016 2.847 7.717 1.00 0.74 H new ATOM 0 HB ILE A 135 3.663 2.212 5.290 1.00 0.86 H new ATOM 0 HG12 ILE A 135 4.870 4.420 4.905 1.00 0.88 H new ATOM 0 HG13 ILE A 135 3.863 3.810 3.607 1.00 0.88 H new ATOM 0 HG21 ILE A 135 1.478 2.912 4.384 1.00 1.54 H new ATOM 0 HG22 ILE A 135 1.349 2.292 6.047 1.00 1.54 H new ATOM 0 HG23 ILE A 135 1.290 4.045 5.743 1.00 1.54 H new ATOM 0 HD11 ILE A 135 3.586 6.228 3.868 1.00 0.89 H new ATOM 0 HD12 ILE A 135 2.065 5.386 4.243 1.00 0.89 H new ATOM 0 HD13 ILE A 135 3.087 6.005 5.561 1.00 0.89 H new ATOM 1963 N LYS A 136 5.757 3.419 8.321 1.00 0.85 N ATOM 1964 CA LYS A 136 7.213 3.239 8.478 1.00 1.14 C ATOM 1965 C LYS A 136 7.585 1.774 8.741 1.00 0.75 C ATOM 1966 O LYS A 136 8.328 1.456 9.669 1.00 0.78 O ATOM 1967 CB LYS A 136 7.766 4.096 9.622 1.00 1.71 C ATOM 1968 CG LYS A 136 9.289 4.144 9.631 1.00 2.72 C ATOM 1969 CD LYS A 136 9.848 4.387 11.019 1.00 3.21 C ATOM 1970 CE LYS A 136 11.326 4.010 11.095 1.00 4.09 C ATOM 1971 NZ LYS A 136 12.136 4.602 9.989 1.00 4.81 N ATOM 0 H LYS A 136 5.293 3.828 9.132 1.00 0.85 H new ATOM 0 HA LYS A 136 7.659 3.557 7.535 1.00 1.14 H new ATOM 0 HB2 LYS A 136 7.374 5.109 9.535 1.00 1.71 H new ATOM 0 HB3 LYS A 136 7.413 3.698 10.573 1.00 1.71 H new ATOM 0 HG2 LYS A 136 9.682 3.205 9.243 1.00 2.72 H new ATOM 0 HG3 LYS A 136 9.630 4.934 8.961 1.00 2.72 H new ATOM 0 HD2 LYS A 136 9.724 5.437 11.285 1.00 3.21 H new ATOM 0 HD3 LYS A 136 9.284 3.805 11.748 1.00 3.21 H new ATOM 0 HE2 LYS A 136 11.731 4.340 12.052 1.00 4.09 H new ATOM 0 HE3 LYS A 136 11.420 2.924 11.067 1.00 4.09 H new ATOM 0 HZ1 LYS A 136 13.108 4.765 10.320 1.00 4.81 H new ATOM 0 HZ2 LYS A 136 12.151 3.948 9.181 1.00 4.81 H new ATOM 0 HZ3 LYS A 136 11.714 5.506 9.695 1.00 4.81 H new ATOM 1985 N TRP A 137 7.055 0.891 7.935 1.00 0.69 N ATOM 1986 CA TRP A 137 7.332 -0.526 8.042 1.00 0.45 C ATOM 1987 C TRP A 137 7.362 -1.108 6.644 1.00 0.43 C ATOM 1988 O TRP A 137 7.132 -0.388 5.677 1.00 0.55 O ATOM 1989 CB TRP A 137 6.272 -1.264 8.887 1.00 0.42 C ATOM 1990 CG TRP A 137 6.350 -1.029 10.362 1.00 0.62 C ATOM 1991 CD1 TRP A 137 6.818 -1.890 11.317 1.00 0.93 C ATOM 1992 CD2 TRP A 137 5.913 0.139 11.057 1.00 1.00 C ATOM 1993 NE1 TRP A 137 6.743 -1.291 12.553 1.00 1.11 N ATOM 1994 CE2 TRP A 137 6.184 -0.053 12.416 1.00 1.16 C ATOM 1995 CE3 TRP A 137 5.332 1.339 10.651 1.00 1.47 C ATOM 1996 CZ2 TRP A 137 5.896 0.910 13.373 1.00 1.59 C ATOM 1997 CZ3 TRP A 137 5.048 2.295 11.594 1.00 1.97 C ATOM 1998 CH2 TRP A 137 5.330 2.079 12.947 1.00 1.97 C ATOM 0 H TRP A 137 6.414 1.132 7.179 1.00 0.69 H new ATOM 0 HA TRP A 137 8.291 -0.656 8.544 1.00 0.45 H new ATOM 0 HB2 TRP A 137 5.283 -0.965 8.540 1.00 0.42 H new ATOM 0 HB3 TRP A 137 6.365 -2.334 8.701 1.00 0.42 H new ATOM 0 HD1 TRP A 137 7.189 -2.887 11.129 1.00 0.93 H new ATOM 0 HE1 TRP A 137 7.055 -1.705 13.431 1.00 1.11 H new ATOM 0 HE3 TRP A 137 5.108 1.514 9.609 1.00 1.47 H new ATOM 0 HZ2 TRP A 137 6.112 0.742 14.418 1.00 1.59 H new ATOM 0 HZ3 TRP A 137 4.600 3.228 11.287 1.00 1.97 H new ATOM 0 HH2 TRP A 137 5.097 2.849 13.667 1.00 1.97 H new ATOM 2009 N ASN A 138 7.744 -2.369 6.551 1.00 0.37 N ATOM 2010 CA ASN A 138 7.513 -3.212 5.366 1.00 0.38 C ATOM 2011 C ASN A 138 6.073 -3.060 4.840 1.00 0.31 C ATOM 2012 O ASN A 138 5.441 -2.050 5.049 1.00 0.30 O ATOM 2013 CB ASN A 138 7.792 -4.681 5.688 1.00 0.41 C ATOM 2014 CG ASN A 138 9.186 -4.934 6.242 1.00 1.06 C ATOM 2015 OD1 ASN A 138 9.384 -5.837 7.055 1.00 2.04 O ATOM 2016 ND2 ASN A 138 10.162 -4.149 5.807 1.00 1.40 N ATOM 0 H ASN A 138 8.233 -2.855 7.303 1.00 0.37 H new ATOM 0 HA ASN A 138 8.200 -2.878 4.588 1.00 0.38 H new ATOM 0 HB2 ASN A 138 7.055 -5.031 6.411 1.00 0.41 H new ATOM 0 HB3 ASN A 138 7.658 -5.274 4.783 1.00 0.41 H new ATOM 0 HD21 ASN A 138 11.114 -4.284 6.147 1.00 1.40 H new ATOM 0 HD22 ASN A 138 9.960 -3.411 5.133 1.00 1.40 H new ATOM 2023 N PHE A 139 5.591 -4.087 4.141 1.00 0.34 N ATOM 2024 CA PHE A 139 4.347 -4.065 3.334 1.00 0.36 C ATOM 2025 C PHE A 139 3.200 -3.124 3.813 1.00 0.32 C ATOM 2026 O PHE A 139 2.426 -2.723 2.971 1.00 0.57 O ATOM 2027 CB PHE A 139 3.829 -5.495 3.270 1.00 0.55 C ATOM 2028 CG PHE A 139 4.057 -6.173 1.953 1.00 0.55 C ATOM 2029 CD1 PHE A 139 5.320 -6.604 1.566 1.00 0.61 C ATOM 2030 CD2 PHE A 139 2.993 -6.380 1.099 1.00 1.23 C ATOM 2031 CE1 PHE A 139 5.503 -7.231 0.347 1.00 1.22 C ATOM 2032 CE2 PHE A 139 3.166 -7.005 -0.114 1.00 1.93 C ATOM 2033 CZ PHE A 139 4.423 -7.432 -0.494 1.00 1.89 C ATOM 0 H PHE A 139 6.062 -4.991 4.112 1.00 0.34 H new ATOM 0 HA PHE A 139 4.630 -3.647 2.368 1.00 0.36 H new ATOM 0 HB2 PHE A 139 4.310 -6.079 4.055 1.00 0.55 H new ATOM 0 HB3 PHE A 139 2.760 -5.492 3.484 1.00 0.55 H new ATOM 0 HD1 PHE A 139 6.164 -6.448 2.221 1.00 0.61 H new ATOM 0 HD2 PHE A 139 2.008 -6.046 1.388 1.00 1.23 H new ATOM 0 HE1 PHE A 139 6.487 -7.563 0.052 1.00 1.22 H new ATOM 0 HE2 PHE A 139 2.321 -7.161 -0.768 1.00 1.93 H new ATOM 0 HZ PHE A 139 4.563 -7.922 -1.446 1.00 1.89 H new ATOM 2043 N THR A 140 3.081 -2.810 5.124 1.00 0.25 N ATOM 2044 CA THR A 140 2.180 -1.766 5.665 1.00 0.25 C ATOM 2045 C THR A 140 1.193 -1.172 4.657 1.00 0.22 C ATOM 2046 O THR A 140 1.554 -0.374 3.789 1.00 0.29 O ATOM 2047 CB THR A 140 2.982 -0.610 6.282 1.00 0.37 C ATOM 2048 OG1 THR A 140 4.094 -1.131 6.998 1.00 0.48 O ATOM 2049 CG2 THR A 140 2.121 0.209 7.232 1.00 0.60 C ATOM 0 H THR A 140 3.619 -3.284 5.849 1.00 0.25 H new ATOM 0 HA THR A 140 1.593 -2.293 6.417 1.00 0.25 H new ATOM 0 HB THR A 140 3.322 0.036 5.473 1.00 0.37 H new ATOM 0 HG1 THR A 140 4.742 -1.507 6.367 1.00 0.48 H new ATOM 0 HG21 THR A 140 2.715 1.020 7.654 1.00 0.60 H new ATOM 0 HG22 THR A 140 1.273 0.625 6.688 1.00 0.60 H new ATOM 0 HG23 THR A 140 1.757 -0.430 8.036 1.00 0.60 H new ATOM 2057 N SER A 141 -0.056 -1.524 4.835 1.00 0.19 N ATOM 2058 CA SER A 141 -1.115 -1.180 3.892 1.00 0.20 C ATOM 2059 C SER A 141 -1.993 -0.078 4.446 1.00 0.22 C ATOM 2060 O SER A 141 -1.927 0.184 5.622 1.00 0.39 O ATOM 2061 CB SER A 141 -1.958 -2.394 3.667 1.00 0.26 C ATOM 2062 OG SER A 141 -2.618 -2.286 2.433 1.00 0.62 O ATOM 0 H SER A 141 -0.378 -2.061 5.640 1.00 0.19 H new ATOM 0 HA SER A 141 -0.664 -0.835 2.962 1.00 0.20 H new ATOM 0 HB2 SER A 141 -1.336 -3.289 3.681 1.00 0.26 H new ATOM 0 HB3 SER A 141 -2.685 -2.499 4.472 1.00 0.26 H new ATOM 0 HG SER A 141 -2.082 -2.719 1.736 1.00 0.62 H new ATOM 2068 N PHE A 142 -2.815 0.550 3.606 1.00 0.19 N ATOM 2069 CA PHE A 142 -3.879 1.424 4.065 1.00 0.18 C ATOM 2070 C PHE A 142 -5.150 0.861 3.528 1.00 0.18 C ATOM 2071 O PHE A 142 -5.275 0.651 2.335 1.00 0.21 O ATOM 2072 CB PHE A 142 -3.734 2.850 3.543 1.00 0.22 C ATOM 2073 CG PHE A 142 -2.899 3.772 4.379 1.00 0.26 C ATOM 2074 CD1 PHE A 142 -3.471 4.477 5.429 1.00 0.35 C ATOM 2075 CD2 PHE A 142 -1.561 3.969 4.097 1.00 0.42 C ATOM 2076 CE1 PHE A 142 -2.720 5.360 6.177 1.00 0.50 C ATOM 2077 CE2 PHE A 142 -0.806 4.848 4.845 1.00 0.55 C ATOM 2078 CZ PHE A 142 -1.385 5.542 5.886 1.00 0.57 C ATOM 0 H PHE A 142 -2.757 0.464 2.591 1.00 0.19 H new ATOM 0 HA PHE A 142 -3.853 1.472 5.154 1.00 0.18 H new ATOM 0 HB2 PHE A 142 -3.303 2.808 2.543 1.00 0.22 H new ATOM 0 HB3 PHE A 142 -4.729 3.283 3.443 1.00 0.22 H new ATOM 0 HD1 PHE A 142 -4.515 4.333 5.663 1.00 0.35 H new ATOM 0 HD2 PHE A 142 -1.101 3.429 3.282 1.00 0.42 H new ATOM 0 HE1 PHE A 142 -3.177 5.907 6.988 1.00 0.50 H new ATOM 0 HE2 PHE A 142 0.239 4.993 4.615 1.00 0.55 H new ATOM 0 HZ PHE A 142 -0.793 6.228 6.473 1.00 0.57 H new ATOM 2088 N LEU A 143 -6.095 0.602 4.370 1.00 0.17 N ATOM 2089 CA LEU A 143 -7.319 0.089 3.868 1.00 0.16 C ATOM 2090 C LEU A 143 -8.129 1.232 3.333 1.00 0.15 C ATOM 2091 O LEU A 143 -8.690 2.040 4.066 1.00 0.18 O ATOM 2092 CB LEU A 143 -8.058 -0.701 4.922 1.00 0.21 C ATOM 2093 CG LEU A 143 -9.557 -0.830 4.691 1.00 0.23 C ATOM 2094 CD1 LEU A 143 -9.860 -1.668 3.457 1.00 0.41 C ATOM 2095 CD2 LEU A 143 -10.238 -1.415 5.909 1.00 0.43 C ATOM 0 H LEU A 143 -6.045 0.733 5.380 1.00 0.17 H new ATOM 0 HA LEU A 143 -7.124 -0.612 3.057 1.00 0.16 H new ATOM 0 HB2 LEU A 143 -7.626 -1.700 4.976 1.00 0.21 H new ATOM 0 HB3 LEU A 143 -7.893 -0.230 5.891 1.00 0.21 H new ATOM 0 HG LEU A 143 -9.951 0.172 4.519 1.00 0.23 H new ATOM 0 HD11 LEU A 143 -10.939 -1.740 3.322 1.00 0.41 H new ATOM 0 HD12 LEU A 143 -9.415 -1.198 2.580 1.00 0.41 H new ATOM 0 HD13 LEU A 143 -9.443 -2.667 3.584 1.00 0.41 H new ATOM 0 HD21 LEU A 143 -11.309 -1.498 5.722 1.00 0.43 H new ATOM 0 HD22 LEU A 143 -9.828 -2.403 6.116 1.00 0.43 H new ATOM 0 HD23 LEU A 143 -10.069 -0.765 6.768 1.00 0.43 H new ATOM 2107 N ILE A 144 -8.129 1.291 2.032 1.00 0.14 N ATOM 2108 CA ILE A 144 -8.783 2.318 1.290 1.00 0.14 C ATOM 2109 C ILE A 144 -10.202 1.866 1.032 1.00 0.15 C ATOM 2110 O ILE A 144 -10.426 0.687 0.785 1.00 0.19 O ATOM 2111 CB ILE A 144 -8.044 2.525 -0.038 1.00 0.15 C ATOM 2112 CG1 ILE A 144 -6.556 2.775 0.188 1.00 0.17 C ATOM 2113 CG2 ILE A 144 -8.670 3.652 -0.821 1.00 0.17 C ATOM 2114 CD1 ILE A 144 -6.256 4.005 0.982 1.00 0.19 C ATOM 0 H ILE A 144 -7.658 0.602 1.445 1.00 0.14 H new ATOM 0 HA ILE A 144 -8.785 3.259 1.839 1.00 0.14 H new ATOM 0 HB ILE A 144 -8.137 1.609 -0.622 1.00 0.15 H new ATOM 0 HG12 ILE A 144 -6.127 1.913 0.699 1.00 0.17 H new ATOM 0 HG13 ILE A 144 -6.060 2.851 -0.780 1.00 0.17 H new ATOM 0 HG21 ILE A 144 -8.133 3.785 -1.760 1.00 0.17 H new ATOM 0 HG22 ILE A 144 -9.713 3.414 -1.030 1.00 0.17 H new ATOM 0 HG23 ILE A 144 -8.617 4.572 -0.240 1.00 0.17 H new ATOM 0 HD11 ILE A 144 -5.177 4.110 1.097 1.00 0.19 H new ATOM 0 HD12 ILE A 144 -6.652 4.878 0.464 1.00 0.19 H new ATOM 0 HD13 ILE A 144 -6.720 3.926 1.965 1.00 0.19 H new ATOM 2126 N ASP A 145 -11.154 2.770 1.094 1.00 0.14 N ATOM 2127 CA ASP A 145 -12.557 2.357 1.052 1.00 0.15 C ATOM 2128 C ASP A 145 -13.098 2.392 -0.373 1.00 0.14 C ATOM 2129 O ASP A 145 -12.346 2.647 -1.311 1.00 0.15 O ATOM 2130 CB ASP A 145 -13.412 3.208 2.006 1.00 0.19 C ATOM 2131 CG ASP A 145 -14.258 4.262 1.309 1.00 0.58 C ATOM 2132 OD1 ASP A 145 -13.693 5.163 0.676 1.00 0.98 O ATOM 2133 OD2 ASP A 145 -15.504 4.173 1.382 1.00 0.75 O ATOM 0 H ASP A 145 -10.999 3.775 1.172 1.00 0.14 H new ATOM 0 HA ASP A 145 -12.615 1.324 1.396 1.00 0.15 H new ATOM 0 HB2 ASP A 145 -14.068 2.549 2.575 1.00 0.19 H new ATOM 0 HB3 ASP A 145 -12.756 3.701 2.723 1.00 0.19 H new ATOM 2138 N ARG A 146 -14.390 2.115 -0.530 1.00 0.17 N ATOM 2139 CA ARG A 146 -15.018 2.053 -1.847 1.00 0.17 C ATOM 2140 C ARG A 146 -14.782 3.341 -2.636 1.00 0.18 C ATOM 2141 O ARG A 146 -14.563 3.309 -3.842 1.00 0.22 O ATOM 2142 CB ARG A 146 -16.521 1.804 -1.713 1.00 0.19 C ATOM 2143 CG ARG A 146 -16.874 0.658 -0.776 1.00 0.24 C ATOM 2144 CD ARG A 146 -18.357 0.328 -0.832 1.00 0.29 C ATOM 2145 NE ARG A 146 -19.191 1.515 -0.624 1.00 1.00 N ATOM 2146 CZ ARG A 146 -20.512 1.539 -0.800 1.00 1.46 C ATOM 2147 NH1 ARG A 146 -21.170 0.427 -1.115 1.00 1.63 N ATOM 2148 NH2 ARG A 146 -21.179 2.677 -0.642 1.00 2.22 N ATOM 0 H ARG A 146 -15.026 1.929 0.245 1.00 0.17 H new ATOM 0 HA ARG A 146 -14.561 1.225 -2.390 1.00 0.17 H new ATOM 0 HB2 ARG A 146 -17.000 2.715 -1.354 1.00 0.19 H new ATOM 0 HB3 ARG A 146 -16.934 1.594 -2.700 1.00 0.19 H new ATOM 0 HG2 ARG A 146 -16.294 -0.225 -1.045 1.00 0.24 H new ATOM 0 HG3 ARG A 146 -16.598 0.923 0.245 1.00 0.24 H new ATOM 0 HD2 ARG A 146 -18.593 -0.116 -1.799 1.00 0.29 H new ATOM 0 HD3 ARG A 146 -18.592 -0.418 -0.072 1.00 0.29 H new ATOM 0 HE ARG A 146 -18.732 2.376 -0.326 1.00 1.00 H new ATOM 0 HH11 ARG A 146 -20.664 -0.452 -1.223 1.00 1.63 H new ATOM 0 HH12 ARG A 146 -22.181 0.453 -1.248 1.00 1.63 H new ATOM 0 HH21 ARG A 146 -20.680 3.529 -0.387 1.00 2.22 H new ATOM 0 HH22 ARG A 146 -22.190 2.698 -0.776 1.00 2.22 H new ATOM 2162 N ASP A 147 -14.797 4.473 -1.947 1.00 0.18 N ATOM 2163 CA ASP A 147 -14.622 5.764 -2.604 1.00 0.21 C ATOM 2164 C ASP A 147 -13.172 6.194 -2.565 1.00 0.18 C ATOM 2165 O ASP A 147 -12.855 7.340 -2.866 1.00 0.24 O ATOM 2166 CB ASP A 147 -15.482 6.844 -1.943 1.00 0.28 C ATOM 2167 CG ASP A 147 -16.958 6.684 -2.226 1.00 1.09 C ATOM 2168 OD1 ASP A 147 -17.440 7.238 -3.242 1.00 1.19 O ATOM 2169 OD2 ASP A 147 -17.641 5.981 -1.451 1.00 2.00 O ATOM 0 H ASP A 147 -14.928 4.526 -0.937 1.00 0.18 H new ATOM 0 HA ASP A 147 -14.938 5.644 -3.640 1.00 0.21 H new ATOM 0 HB2 ASP A 147 -15.320 6.819 -0.865 1.00 0.28 H new ATOM 0 HB3 ASP A 147 -15.156 7.824 -2.292 1.00 0.28 H new ATOM 2174 N GLY A 148 -12.290 5.266 -2.234 1.00 0.16 N ATOM 2175 CA GLY A 148 -10.893 5.589 -2.100 1.00 0.16 C ATOM 2176 C GLY A 148 -10.580 6.388 -0.851 1.00 0.15 C ATOM 2177 O GLY A 148 -9.732 7.271 -0.878 1.00 0.17 O ATOM 0 H GLY A 148 -12.522 4.289 -2.055 1.00 0.16 H new ATOM 0 HA2 GLY A 148 -10.313 4.666 -2.087 1.00 0.16 H new ATOM 0 HA3 GLY A 148 -10.572 6.155 -2.975 1.00 0.16 H new ATOM 2181 N VAL A 149 -11.253 6.101 0.244 1.00 0.17 N ATOM 2182 CA VAL A 149 -10.938 6.764 1.498 1.00 0.18 C ATOM 2183 C VAL A 149 -10.239 5.808 2.465 1.00 0.17 C ATOM 2184 O VAL A 149 -10.853 4.889 2.998 1.00 0.24 O ATOM 2185 CB VAL A 149 -12.194 7.352 2.177 1.00 0.28 C ATOM 2186 CG1 VAL A 149 -11.824 8.086 3.458 1.00 0.97 C ATOM 2187 CG2 VAL A 149 -12.936 8.277 1.226 1.00 1.12 C ATOM 0 H VAL A 149 -12.013 5.422 0.295 1.00 0.17 H new ATOM 0 HA VAL A 149 -10.266 7.586 1.253 1.00 0.18 H new ATOM 0 HB VAL A 149 -12.855 6.526 2.437 1.00 0.28 H new ATOM 0 HG11 VAL A 149 -12.725 8.491 3.918 1.00 0.97 H new ATOM 0 HG12 VAL A 149 -11.344 7.393 4.149 1.00 0.97 H new ATOM 0 HG13 VAL A 149 -11.138 8.900 3.226 1.00 0.97 H new ATOM 0 HG21 VAL A 149 -13.817 8.680 1.724 1.00 1.12 H new ATOM 0 HG22 VAL A 149 -12.280 9.096 0.929 1.00 1.12 H new ATOM 0 HG23 VAL A 149 -13.243 7.719 0.341 1.00 1.12 H new ATOM 2197 N PRO A 150 -8.924 5.996 2.650 1.00 0.21 N ATOM 2198 CA PRO A 150 -8.133 5.284 3.660 1.00 0.20 C ATOM 2199 C PRO A 150 -8.776 5.380 5.044 1.00 0.23 C ATOM 2200 O PRO A 150 -8.914 6.472 5.600 1.00 0.34 O ATOM 2201 CB PRO A 150 -6.789 6.026 3.670 1.00 0.26 C ATOM 2202 CG PRO A 150 -6.950 7.200 2.756 1.00 0.29 C ATOM 2203 CD PRO A 150 -8.104 6.905 1.862 1.00 0.41 C ATOM 0 HA PRO A 150 -8.046 4.222 3.430 1.00 0.20 H new ATOM 0 HB2 PRO A 150 -6.532 6.351 4.678 1.00 0.26 H new ATOM 0 HB3 PRO A 150 -5.983 5.376 3.329 1.00 0.26 H new ATOM 0 HG2 PRO A 150 -7.129 8.111 3.327 1.00 0.29 H new ATOM 0 HG3 PRO A 150 -6.043 7.362 2.173 1.00 0.29 H new ATOM 0 HD2 PRO A 150 -8.649 7.811 1.599 1.00 0.41 H new ATOM 0 HD3 PRO A 150 -7.780 6.446 0.928 1.00 0.41 H new ATOM 2211 N VAL A 151 -9.167 4.250 5.597 1.00 0.22 N ATOM 2212 CA VAL A 151 -9.823 4.227 6.889 1.00 0.29 C ATOM 2213 C VAL A 151 -8.986 3.434 7.875 1.00 0.32 C ATOM 2214 O VAL A 151 -9.218 3.473 9.080 1.00 0.61 O ATOM 2215 CB VAL A 151 -11.243 3.622 6.804 1.00 0.42 C ATOM 2216 CG1 VAL A 151 -12.152 4.484 5.942 1.00 1.45 C ATOM 2217 CG2 VAL A 151 -11.196 2.203 6.262 1.00 1.13 C ATOM 0 H VAL A 151 -9.041 3.332 5.170 1.00 0.22 H new ATOM 0 HA VAL A 151 -9.921 5.258 7.229 1.00 0.29 H new ATOM 0 HB VAL A 151 -11.652 3.594 7.814 1.00 0.42 H new ATOM 0 HG11 VAL A 151 -13.145 4.036 5.899 1.00 1.45 H new ATOM 0 HG12 VAL A 151 -12.223 5.482 6.373 1.00 1.45 H new ATOM 0 HG13 VAL A 151 -11.741 4.552 4.935 1.00 1.45 H new ATOM 0 HG21 VAL A 151 -12.207 1.799 6.212 1.00 1.13 H new ATOM 0 HG22 VAL A 151 -10.758 2.209 5.264 1.00 1.13 H new ATOM 0 HG23 VAL A 151 -10.590 1.582 6.921 1.00 1.13 H new ATOM 2227 N GLU A 152 -8.011 2.712 7.346 1.00 0.19 N ATOM 2228 CA GLU A 152 -7.115 1.903 8.163 1.00 0.20 C ATOM 2229 C GLU A 152 -5.735 1.891 7.545 1.00 0.20 C ATOM 2230 O GLU A 152 -5.553 2.318 6.413 1.00 0.19 O ATOM 2231 CB GLU A 152 -7.583 0.445 8.246 1.00 0.21 C ATOM 2232 CG GLU A 152 -9.066 0.266 8.457 1.00 0.57 C ATOM 2233 CD GLU A 152 -9.508 0.497 9.888 1.00 0.63 C ATOM 2234 OE1 GLU A 152 -8.769 0.111 10.814 1.00 1.17 O ATOM 2235 OE2 GLU A 152 -10.582 1.098 10.092 1.00 1.17 O ATOM 0 H GLU A 152 -7.818 2.669 6.345 1.00 0.19 H new ATOM 0 HA GLU A 152 -7.107 2.343 9.160 1.00 0.20 H new ATOM 0 HB2 GLU A 152 -7.297 -0.066 7.327 1.00 0.21 H new ATOM 0 HB3 GLU A 152 -7.053 -0.046 9.062 1.00 0.21 H new ATOM 0 HG2 GLU A 152 -9.603 0.954 7.804 1.00 0.57 H new ATOM 0 HG3 GLU A 152 -9.348 -0.743 8.157 1.00 0.57 H new ATOM 2242 N ARG A 153 -4.771 1.447 8.317 1.00 0.23 N ATOM 2243 CA ARG A 153 -3.514 0.963 7.773 1.00 0.24 C ATOM 2244 C ARG A 153 -2.954 -0.141 8.657 1.00 0.25 C ATOM 2245 O ARG A 153 -3.071 -0.091 9.884 1.00 0.39 O ATOM 2246 CB ARG A 153 -2.502 2.089 7.488 1.00 0.36 C ATOM 2247 CG ARG A 153 -1.059 1.850 7.945 1.00 0.40 C ATOM 2248 CD ARG A 153 -0.895 2.255 9.394 1.00 0.47 C ATOM 2249 NE ARG A 153 -1.466 3.583 9.630 1.00 0.65 N ATOM 2250 CZ ARG A 153 -2.601 3.792 10.299 1.00 1.51 C ATOM 2251 NH1 ARG A 153 -3.242 2.775 10.871 1.00 2.16 N ATOM 2252 NH2 ARG A 153 -3.097 5.016 10.395 1.00 1.85 N ATOM 0 H ARG A 153 -4.830 1.409 9.335 1.00 0.23 H new ATOM 0 HA ARG A 153 -3.717 0.533 6.792 1.00 0.24 H new ATOM 0 HB2 ARG A 153 -2.492 2.274 6.414 1.00 0.36 H new ATOM 0 HB3 ARG A 153 -2.863 3.000 7.965 1.00 0.36 H new ATOM 0 HG2 ARG A 153 -0.801 0.798 7.822 1.00 0.40 H new ATOM 0 HG3 ARG A 153 -0.373 2.422 7.320 1.00 0.40 H new ATOM 0 HD2 ARG A 153 -1.384 1.524 10.038 1.00 0.47 H new ATOM 0 HD3 ARG A 153 0.162 2.256 9.659 1.00 0.47 H new ATOM 0 HE ARG A 153 -0.968 4.393 9.262 1.00 0.65 H new ATOM 0 HH11 ARG A 153 -2.866 1.830 10.799 1.00 2.16 H new ATOM 0 HH12 ARG A 153 -4.109 2.941 11.381 1.00 2.16 H new ATOM 0 HH21 ARG A 153 -2.611 5.799 9.957 1.00 1.85 H new ATOM 0 HH22 ARG A 153 -3.965 5.176 10.906 1.00 1.85 H new ATOM 2266 N PHE A 154 -2.329 -1.115 8.018 1.00 0.24 N ATOM 2267 CA PHE A 154 -1.976 -2.373 8.648 1.00 0.22 C ATOM 2268 C PHE A 154 -0.478 -2.551 8.574 1.00 0.24 C ATOM 2269 O PHE A 154 0.143 -2.096 7.625 1.00 0.32 O ATOM 2270 CB PHE A 154 -2.655 -3.539 7.918 1.00 0.22 C ATOM 2271 CG PHE A 154 -4.160 -3.526 7.951 1.00 0.20 C ATOM 2272 CD1 PHE A 154 -4.878 -2.786 7.024 1.00 0.22 C ATOM 2273 CD2 PHE A 154 -4.858 -4.280 8.883 1.00 0.21 C ATOM 2274 CE1 PHE A 154 -6.258 -2.793 7.031 1.00 0.24 C ATOM 2275 CE2 PHE A 154 -6.241 -4.293 8.890 1.00 0.22 C ATOM 2276 CZ PHE A 154 -6.940 -3.548 7.962 1.00 0.22 C ATOM 0 H PHE A 154 -2.050 -1.053 7.039 1.00 0.24 H new ATOM 0 HA PHE A 154 -2.307 -2.361 9.686 1.00 0.22 H new ATOM 0 HB2 PHE A 154 -2.330 -3.534 6.878 1.00 0.22 H new ATOM 0 HB3 PHE A 154 -2.306 -4.474 8.356 1.00 0.22 H new ATOM 0 HD1 PHE A 154 -4.351 -2.197 6.288 1.00 0.22 H new ATOM 0 HD2 PHE A 154 -4.315 -4.864 9.612 1.00 0.21 H new ATOM 0 HE1 PHE A 154 -6.804 -2.207 6.307 1.00 0.24 H new ATOM 0 HE2 PHE A 154 -6.773 -4.885 9.620 1.00 0.22 H new ATOM 0 HZ PHE A 154 -8.020 -3.556 7.965 1.00 0.22 H new ATOM 2286 N SER A 155 0.096 -3.206 9.560 1.00 0.22 N ATOM 2287 CA SER A 155 1.524 -3.461 9.565 1.00 0.25 C ATOM 2288 C SER A 155 1.853 -4.566 8.559 1.00 0.22 C ATOM 2289 O SER A 155 0.962 -5.295 8.136 1.00 0.26 O ATOM 2290 CB SER A 155 1.966 -3.871 10.971 1.00 0.35 C ATOM 2291 OG SER A 155 1.460 -2.970 11.945 1.00 1.11 O ATOM 0 H SER A 155 -0.403 -3.573 10.370 1.00 0.22 H new ATOM 0 HA SER A 155 2.058 -2.555 9.278 1.00 0.25 H new ATOM 0 HB2 SER A 155 1.615 -4.880 11.187 1.00 0.35 H new ATOM 0 HB3 SER A 155 3.055 -3.894 11.022 1.00 0.35 H new ATOM 0 HG SER A 155 1.754 -3.253 12.836 1.00 1.11 H new ATOM 2297 N PRO A 156 3.120 -4.712 8.152 1.00 0.25 N ATOM 2298 CA PRO A 156 3.533 -5.816 7.282 1.00 0.29 C ATOM 2299 C PRO A 156 3.340 -7.145 7.986 1.00 0.39 C ATOM 2300 O PRO A 156 3.084 -8.175 7.363 1.00 0.78 O ATOM 2301 CB PRO A 156 5.014 -5.555 7.041 1.00 0.34 C ATOM 2302 CG PRO A 156 5.439 -4.669 8.161 1.00 0.36 C ATOM 2303 CD PRO A 156 4.243 -3.834 8.504 1.00 0.33 C ATOM 0 HA PRO A 156 2.955 -5.866 6.359 1.00 0.29 H new ATOM 0 HB2 PRO A 156 5.583 -6.485 7.036 1.00 0.34 H new ATOM 0 HB3 PRO A 156 5.178 -5.076 6.076 1.00 0.34 H new ATOM 0 HG2 PRO A 156 5.765 -5.255 9.020 1.00 0.36 H new ATOM 0 HG3 PRO A 156 6.280 -4.042 7.865 1.00 0.36 H new ATOM 0 HD2 PRO A 156 4.229 -3.563 9.560 1.00 0.33 H new ATOM 0 HD3 PRO A 156 4.223 -2.904 7.936 1.00 0.33 H new ATOM 2311 N GLY A 157 3.531 -7.092 9.294 1.00 0.36 N ATOM 2312 CA GLY A 157 3.209 -8.190 10.172 1.00 0.46 C ATOM 2313 C GLY A 157 1.723 -8.527 10.217 1.00 0.41 C ATOM 2314 O GLY A 157 1.334 -9.507 10.855 1.00 0.50 O ATOM 0 H GLY A 157 3.916 -6.278 9.773 1.00 0.36 H new ATOM 0 HA2 GLY A 157 3.763 -9.073 9.852 1.00 0.46 H new ATOM 0 HA3 GLY A 157 3.548 -7.949 11.179 1.00 0.46 H new ATOM 2318 N ALA A 158 0.883 -7.727 9.554 1.00 0.34 N ATOM 2319 CA ALA A 158 -0.533 -8.050 9.450 1.00 0.31 C ATOM 2320 C ALA A 158 -0.761 -8.942 8.236 1.00 0.34 C ATOM 2321 O ALA A 158 -0.125 -8.762 7.196 1.00 0.50 O ATOM 2322 CB ALA A 158 -1.378 -6.787 9.357 1.00 0.37 C ATOM 0 H ALA A 158 1.159 -6.863 9.088 1.00 0.34 H new ATOM 0 HA ALA A 158 -0.839 -8.583 10.350 1.00 0.31 H new ATOM 0 HB1 ALA A 158 -2.431 -7.058 9.280 1.00 0.37 H new ATOM 0 HB2 ALA A 158 -1.224 -6.180 10.249 1.00 0.37 H new ATOM 0 HB3 ALA A 158 -1.085 -6.217 8.475 1.00 0.37 H new ATOM 2328 N SER A 159 -1.661 -9.902 8.364 1.00 0.26 N ATOM 2329 CA SER A 159 -1.854 -10.896 7.339 1.00 0.30 C ATOM 2330 C SER A 159 -3.191 -10.688 6.643 1.00 0.23 C ATOM 2331 O SER A 159 -3.943 -9.767 6.977 1.00 0.22 O ATOM 2332 CB SER A 159 -1.779 -12.295 7.961 1.00 0.41 C ATOM 2333 OG SER A 159 -1.767 -13.313 6.973 1.00 1.42 O ATOM 0 H SER A 159 -2.270 -10.009 9.175 1.00 0.26 H new ATOM 0 HA SER A 159 -1.066 -10.799 6.592 1.00 0.30 H new ATOM 0 HB2 SER A 159 -0.880 -12.373 8.573 1.00 0.41 H new ATOM 0 HB3 SER A 159 -2.631 -12.443 8.625 1.00 0.41 H new ATOM 0 HG SER A 159 -1.717 -14.190 7.408 1.00 1.42 H new ATOM 2339 N VAL A 160 -3.465 -11.557 5.683 1.00 0.22 N ATOM 2340 CA VAL A 160 -4.689 -11.531 4.892 1.00 0.20 C ATOM 2341 C VAL A 160 -5.912 -11.284 5.766 1.00 0.21 C ATOM 2342 O VAL A 160 -6.682 -10.372 5.517 1.00 0.20 O ATOM 2343 CB VAL A 160 -4.872 -12.885 4.191 1.00 0.24 C ATOM 2344 CG1 VAL A 160 -6.137 -12.910 3.352 1.00 0.28 C ATOM 2345 CG2 VAL A 160 -3.668 -13.227 3.336 1.00 0.26 C ATOM 0 H VAL A 160 -2.833 -12.315 5.426 1.00 0.22 H new ATOM 0 HA VAL A 160 -4.599 -10.722 4.168 1.00 0.20 H new ATOM 0 HB VAL A 160 -4.967 -13.641 4.971 1.00 0.24 H new ATOM 0 HG11 VAL A 160 -6.235 -13.883 2.870 1.00 0.28 H new ATOM 0 HG12 VAL A 160 -7.002 -12.733 3.992 1.00 0.28 H new ATOM 0 HG13 VAL A 160 -6.084 -12.132 2.591 1.00 0.28 H new ATOM 0 HG21 VAL A 160 -3.827 -14.191 2.853 1.00 0.26 H new ATOM 0 HG22 VAL A 160 -3.531 -12.458 2.576 1.00 0.26 H new ATOM 0 HG23 VAL A 160 -2.779 -13.278 3.964 1.00 0.26 H new ATOM 2355 N LYS A 161 -6.048 -12.086 6.815 1.00 0.26 N ATOM 2356 CA LYS A 161 -7.238 -12.067 7.660 1.00 0.31 C ATOM 2357 C LYS A 161 -7.287 -10.816 8.526 1.00 0.26 C ATOM 2358 O LYS A 161 -8.365 -10.350 8.890 1.00 0.27 O ATOM 2359 CB LYS A 161 -7.268 -13.326 8.529 1.00 0.45 C ATOM 2360 CG LYS A 161 -5.996 -13.533 9.332 1.00 1.12 C ATOM 2361 CD LYS A 161 -6.113 -12.994 10.747 1.00 1.80 C ATOM 2362 CE LYS A 161 -4.855 -13.280 11.547 1.00 2.67 C ATOM 2363 NZ LYS A 161 -4.849 -12.573 12.852 1.00 3.46 N ATOM 0 H LYS A 161 -5.342 -12.764 7.103 1.00 0.26 H new ATOM 0 HA LYS A 161 -8.118 -12.051 7.017 1.00 0.31 H new ATOM 0 HB2 LYS A 161 -8.115 -13.267 9.212 1.00 0.45 H new ATOM 0 HB3 LYS A 161 -7.432 -14.195 7.892 1.00 0.45 H new ATOM 0 HG2 LYS A 161 -5.762 -14.597 9.369 1.00 1.12 H new ATOM 0 HG3 LYS A 161 -5.165 -13.041 8.826 1.00 1.12 H new ATOM 0 HD2 LYS A 161 -6.292 -11.919 10.716 1.00 1.80 H new ATOM 0 HD3 LYS A 161 -6.973 -13.446 11.242 1.00 1.80 H new ATOM 0 HE2 LYS A 161 -4.770 -14.353 11.717 1.00 2.67 H new ATOM 0 HE3 LYS A 161 -3.982 -12.979 10.968 1.00 2.67 H new ATOM 0 HZ1 LYS A 161 -3.972 -12.797 13.364 1.00 3.46 H new ATOM 0 HZ2 LYS A 161 -4.903 -11.547 12.691 1.00 3.46 H new ATOM 0 HZ3 LYS A 161 -5.667 -12.879 13.416 1.00 3.46 H new ATOM 2377 N ASP A 162 -6.118 -10.270 8.837 1.00 0.26 N ATOM 2378 CA ASP A 162 -6.029 -9.077 9.666 1.00 0.27 C ATOM 2379 C ASP A 162 -6.526 -7.888 8.878 1.00 0.22 C ATOM 2380 O ASP A 162 -7.184 -6.999 9.411 1.00 0.26 O ATOM 2381 CB ASP A 162 -4.591 -8.824 10.117 1.00 0.33 C ATOM 2382 CG ASP A 162 -4.048 -9.931 10.989 1.00 0.78 C ATOM 2383 OD1 ASP A 162 -4.409 -9.985 12.184 1.00 0.86 O ATOM 2384 OD2 ASP A 162 -3.262 -10.754 10.485 1.00 1.40 O ATOM 0 H ASP A 162 -5.218 -10.636 8.527 1.00 0.26 H new ATOM 0 HA ASP A 162 -6.643 -9.225 10.554 1.00 0.27 H new ATOM 0 HB2 ASP A 162 -3.954 -8.713 9.239 1.00 0.33 H new ATOM 0 HB3 ASP A 162 -4.547 -7.882 10.664 1.00 0.33 H new ATOM 2389 N ILE A 163 -6.200 -7.890 7.599 1.00 0.18 N ATOM 2390 CA ILE A 163 -6.657 -6.867 6.687 1.00 0.15 C ATOM 2391 C ILE A 163 -8.109 -7.107 6.295 1.00 0.14 C ATOM 2392 O ILE A 163 -8.929 -6.195 6.381 1.00 0.15 O ATOM 2393 CB ILE A 163 -5.772 -6.822 5.424 1.00 0.14 C ATOM 2394 CG1 ILE A 163 -4.383 -6.254 5.764 1.00 0.15 C ATOM 2395 CG2 ILE A 163 -6.445 -6.004 4.330 1.00 0.15 C ATOM 2396 CD1 ILE A 163 -3.394 -6.344 4.620 1.00 0.21 C ATOM 0 H ILE A 163 -5.611 -8.602 7.167 1.00 0.18 H new ATOM 0 HA ILE A 163 -6.584 -5.907 7.198 1.00 0.15 H new ATOM 0 HB ILE A 163 -5.641 -7.838 5.052 1.00 0.14 H new ATOM 0 HG12 ILE A 163 -4.489 -5.210 6.060 1.00 0.15 H new ATOM 0 HG13 ILE A 163 -3.981 -6.790 6.624 1.00 0.15 H new ATOM 0 HG21 ILE A 163 -5.807 -5.983 3.447 1.00 0.15 H new ATOM 0 HG22 ILE A 163 -7.403 -6.457 4.075 1.00 0.15 H new ATOM 0 HG23 ILE A 163 -6.607 -4.986 4.685 1.00 0.15 H new ATOM 0 HD11 ILE A 163 -2.437 -5.925 4.932 1.00 0.21 H new ATOM 0 HD12 ILE A 163 -3.258 -7.388 4.338 1.00 0.21 H new ATOM 0 HD13 ILE A 163 -3.774 -5.784 3.766 1.00 0.21 H new ATOM 2408 N GLU A 164 -8.424 -8.340 5.894 1.00 0.13 N ATOM 2409 CA GLU A 164 -9.770 -8.688 5.451 1.00 0.13 C ATOM 2410 C GLU A 164 -10.810 -8.267 6.468 1.00 0.15 C ATOM 2411 O GLU A 164 -11.836 -7.712 6.115 1.00 0.15 O ATOM 2412 CB GLU A 164 -9.945 -10.193 5.236 1.00 0.14 C ATOM 2413 CG GLU A 164 -9.427 -10.732 3.922 1.00 0.20 C ATOM 2414 CD GLU A 164 -9.916 -12.145 3.662 1.00 0.30 C ATOM 2415 OE1 GLU A 164 -11.095 -12.306 3.279 1.00 0.60 O ATOM 2416 OE2 GLU A 164 -9.136 -13.099 3.849 1.00 0.67 O ATOM 0 H GLU A 164 -7.761 -9.115 5.868 1.00 0.13 H new ATOM 0 HA GLU A 164 -9.907 -8.160 4.507 1.00 0.13 H new ATOM 0 HB2 GLU A 164 -9.441 -10.718 6.047 1.00 0.14 H new ATOM 0 HB3 GLU A 164 -11.006 -10.431 5.313 1.00 0.14 H new ATOM 0 HG2 GLU A 164 -9.749 -10.081 3.109 1.00 0.20 H new ATOM 0 HG3 GLU A 164 -8.337 -10.720 3.928 1.00 0.20 H new ATOM 2423 N GLU A 165 -10.550 -8.549 7.734 1.00 0.18 N ATOM 2424 CA GLU A 165 -11.523 -8.267 8.784 1.00 0.21 C ATOM 2425 C GLU A 165 -11.936 -6.796 8.803 1.00 0.21 C ATOM 2426 O GLU A 165 -13.011 -6.457 9.296 1.00 0.27 O ATOM 2427 CB GLU A 165 -10.984 -8.678 10.155 1.00 0.27 C ATOM 2428 CG GLU A 165 -9.746 -7.922 10.588 1.00 0.47 C ATOM 2429 CD GLU A 165 -9.506 -8.011 12.079 1.00 0.66 C ATOM 2430 OE1 GLU A 165 -9.187 -9.118 12.561 1.00 0.83 O ATOM 2431 OE2 GLU A 165 -9.631 -6.982 12.773 1.00 0.87 O ATOM 0 H GLU A 165 -9.681 -8.970 8.061 1.00 0.18 H new ATOM 0 HA GLU A 165 -12.410 -8.860 8.560 1.00 0.21 H new ATOM 0 HB2 GLU A 165 -11.766 -8.529 10.900 1.00 0.27 H new ATOM 0 HB3 GLU A 165 -10.758 -9.744 10.139 1.00 0.27 H new ATOM 0 HG2 GLU A 165 -8.879 -8.318 10.059 1.00 0.47 H new ATOM 0 HG3 GLU A 165 -9.844 -6.875 10.301 1.00 0.47 H new ATOM 2438 N LYS A 166 -11.092 -5.923 8.273 1.00 0.19 N ATOM 2439 CA LYS A 166 -11.453 -4.525 8.152 1.00 0.20 C ATOM 2440 C LYS A 166 -11.857 -4.210 6.710 1.00 0.19 C ATOM 2441 O LYS A 166 -12.619 -3.283 6.448 1.00 0.25 O ATOM 2442 CB LYS A 166 -10.306 -3.621 8.616 1.00 0.25 C ATOM 2443 CG LYS A 166 -9.814 -3.921 10.029 1.00 0.38 C ATOM 2444 CD LYS A 166 -10.946 -3.904 11.050 1.00 0.58 C ATOM 2445 CE LYS A 166 -11.490 -2.503 11.291 1.00 1.09 C ATOM 2446 NZ LYS A 166 -10.502 -1.620 11.971 1.00 1.71 N ATOM 0 H LYS A 166 -10.163 -6.158 7.924 1.00 0.19 H new ATOM 0 HA LYS A 166 -12.307 -4.328 8.800 1.00 0.20 H new ATOM 0 HB2 LYS A 166 -9.472 -3.724 7.922 1.00 0.25 H new ATOM 0 HB3 LYS A 166 -10.633 -2.582 8.569 1.00 0.25 H new ATOM 0 HG2 LYS A 166 -9.329 -4.897 10.043 1.00 0.38 H new ATOM 0 HG3 LYS A 166 -9.060 -3.187 10.313 1.00 0.38 H new ATOM 0 HD2 LYS A 166 -11.753 -4.550 10.704 1.00 0.58 H new ATOM 0 HD3 LYS A 166 -10.588 -4.319 11.992 1.00 0.58 H new ATOM 0 HE2 LYS A 166 -11.775 -2.058 10.338 1.00 1.09 H new ATOM 0 HE3 LYS A 166 -12.394 -2.566 11.897 1.00 1.09 H new ATOM 0 HZ1 LYS A 166 -10.969 -0.738 12.265 1.00 1.71 H new ATOM 0 HZ2 LYS A 166 -10.121 -2.105 12.808 1.00 1.71 H new ATOM 0 HZ3 LYS A 166 -9.725 -1.399 11.316 1.00 1.71 H new ATOM 2460 N LEU A 167 -11.361 -5.025 5.794 1.00 0.15 N ATOM 2461 CA LEU A 167 -11.595 -4.864 4.365 1.00 0.15 C ATOM 2462 C LEU A 167 -12.990 -5.328 3.960 1.00 0.15 C ATOM 2463 O LEU A 167 -13.697 -4.638 3.229 1.00 0.16 O ATOM 2464 CB LEU A 167 -10.564 -5.684 3.593 1.00 0.13 C ATOM 2465 CG LEU A 167 -10.971 -6.029 2.167 1.00 0.14 C ATOM 2466 CD1 LEU A 167 -10.786 -4.832 1.257 1.00 0.16 C ATOM 2467 CD2 LEU A 167 -10.197 -7.225 1.659 1.00 0.16 C ATOM 0 H LEU A 167 -10.776 -5.829 6.023 1.00 0.15 H new ATOM 0 HA LEU A 167 -11.507 -3.803 4.131 1.00 0.15 H new ATOM 0 HB2 LEU A 167 -9.625 -5.131 3.566 1.00 0.13 H new ATOM 0 HB3 LEU A 167 -10.373 -6.609 4.137 1.00 0.13 H new ATOM 0 HG LEU A 167 -12.028 -6.294 2.167 1.00 0.14 H new ATOM 0 HD11 LEU A 167 -11.082 -5.097 0.242 1.00 0.16 H new ATOM 0 HD12 LEU A 167 -11.404 -4.007 1.611 1.00 0.16 H new ATOM 0 HD13 LEU A 167 -9.739 -4.529 1.262 1.00 0.16 H new ATOM 0 HD21 LEU A 167 -10.506 -7.451 0.638 1.00 0.16 H new ATOM 0 HD22 LEU A 167 -9.130 -7.001 1.674 1.00 0.16 H new ATOM 0 HD23 LEU A 167 -10.396 -8.085 2.298 1.00 0.16 H new ATOM 2479 N ILE A 168 -13.356 -6.514 4.423 1.00 0.16 N ATOM 2480 CA ILE A 168 -14.605 -7.158 4.044 1.00 0.19 C ATOM 2481 C ILE A 168 -15.821 -6.251 4.284 1.00 0.22 C ATOM 2482 O ILE A 168 -16.676 -6.138 3.405 1.00 0.25 O ATOM 2483 CB ILE A 168 -14.789 -8.507 4.773 1.00 0.20 C ATOM 2484 CG1 ILE A 168 -13.619 -9.446 4.445 1.00 0.19 C ATOM 2485 CG2 ILE A 168 -16.115 -9.150 4.387 1.00 0.26 C ATOM 2486 CD1 ILE A 168 -13.632 -10.735 5.238 1.00 0.24 C ATOM 0 H ILE A 168 -12.792 -7.059 5.075 1.00 0.16 H new ATOM 0 HA ILE A 168 -14.541 -7.350 2.973 1.00 0.19 H new ATOM 0 HB ILE A 168 -14.801 -8.324 5.847 1.00 0.20 H new ATOM 0 HG12 ILE A 168 -13.643 -9.684 3.382 1.00 0.19 H new ATOM 0 HG13 ILE A 168 -12.681 -8.923 4.634 1.00 0.19 H new ATOM 0 HG21 ILE A 168 -16.225 -10.099 4.911 1.00 0.26 H new ATOM 0 HG22 ILE A 168 -16.935 -8.486 4.662 1.00 0.26 H new ATOM 0 HG23 ILE A 168 -16.135 -9.325 3.311 1.00 0.26 H new ATOM 0 HD11 ILE A 168 -12.776 -11.347 4.952 1.00 0.24 H new ATOM 0 HD12 ILE A 168 -13.576 -10.508 6.303 1.00 0.24 H new ATOM 0 HD13 ILE A 168 -14.553 -11.280 5.031 1.00 0.24 H new ATOM 2498 N PRO A 169 -15.928 -5.589 5.464 1.00 0.24 N ATOM 2499 CA PRO A 169 -16.995 -4.608 5.722 1.00 0.29 C ATOM 2500 C PRO A 169 -17.057 -3.496 4.670 1.00 0.29 C ATOM 2501 O PRO A 169 -18.097 -2.867 4.495 1.00 0.41 O ATOM 2502 CB PRO A 169 -16.624 -4.021 7.086 1.00 0.34 C ATOM 2503 CG PRO A 169 -15.827 -5.084 7.751 1.00 0.40 C ATOM 2504 CD PRO A 169 -15.068 -5.773 6.654 1.00 0.24 C ATOM 0 HA PRO A 169 -17.978 -5.078 5.691 1.00 0.29 H new ATOM 0 HB2 PRO A 169 -16.047 -3.103 6.978 1.00 0.34 H new ATOM 0 HB3 PRO A 169 -17.513 -3.772 7.665 1.00 0.34 H new ATOM 0 HG2 PRO A 169 -15.147 -4.659 8.489 1.00 0.40 H new ATOM 0 HG3 PRO A 169 -16.474 -5.785 8.279 1.00 0.40 H new ATOM 0 HD2 PRO A 169 -14.083 -5.329 6.509 1.00 0.24 H new ATOM 0 HD3 PRO A 169 -14.913 -6.829 6.876 1.00 0.24 H new ATOM 2512 N LEU A 170 -15.944 -3.258 3.978 1.00 0.22 N ATOM 2513 CA LEU A 170 -15.894 -2.245 2.926 1.00 0.22 C ATOM 2514 C LEU A 170 -16.189 -2.842 1.555 1.00 0.20 C ATOM 2515 O LEU A 170 -16.823 -2.200 0.721 1.00 0.23 O ATOM 2516 CB LEU A 170 -14.534 -1.547 2.892 1.00 0.24 C ATOM 2517 CG LEU A 170 -14.302 -0.486 3.959 1.00 0.33 C ATOM 2518 CD1 LEU A 170 -12.900 0.080 3.820 1.00 0.71 C ATOM 2519 CD2 LEU A 170 -15.336 0.622 3.840 1.00 0.69 C ATOM 0 H LEU A 170 -15.065 -3.753 4.127 1.00 0.22 H new ATOM 0 HA LEU A 170 -16.666 -1.512 3.161 1.00 0.22 H new ATOM 0 HB2 LEU A 170 -13.756 -2.305 2.986 1.00 0.24 H new ATOM 0 HB3 LEU A 170 -14.410 -1.083 1.913 1.00 0.24 H new ATOM 0 HG LEU A 170 -14.405 -0.943 4.943 1.00 0.33 H new ATOM 0 HD11 LEU A 170 -12.737 0.839 4.585 1.00 0.71 H new ATOM 0 HD12 LEU A 170 -12.171 -0.721 3.942 1.00 0.71 H new ATOM 0 HD13 LEU A 170 -12.785 0.529 2.833 1.00 0.71 H new ATOM 0 HD21 LEU A 170 -15.156 1.372 4.610 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -15.260 1.086 2.857 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -16.334 0.203 3.968 1.00 0.69 H new ATOM 2531 N LEU A 171 -15.694 -4.051 1.298 1.00 0.18 N ATOM 2532 CA LEU A 171 -16.009 -4.735 0.042 1.00 0.20 C ATOM 2533 C LEU A 171 -17.490 -5.002 -0.022 1.00 0.27 C ATOM 2534 O LEU A 171 -18.176 -4.664 -0.985 1.00 0.34 O ATOM 2535 CB LEU A 171 -15.291 -6.078 -0.063 1.00 0.26 C ATOM 2536 CG LEU A 171 -13.783 -5.994 -0.148 1.00 0.17 C ATOM 2537 CD1 LEU A 171 -13.173 -7.382 -0.155 1.00 0.26 C ATOM 2538 CD2 LEU A 171 -13.367 -5.230 -1.393 1.00 0.31 C ATOM 0 H LEU A 171 -15.084 -4.571 1.929 1.00 0.18 H new ATOM 0 HA LEU A 171 -15.683 -4.090 -0.774 1.00 0.20 H new ATOM 0 HB2 LEU A 171 -15.557 -6.684 0.803 1.00 0.26 H new ATOM 0 HB3 LEU A 171 -15.661 -6.602 -0.944 1.00 0.26 H new ATOM 0 HG LEU A 171 -13.417 -5.460 0.729 1.00 0.17 H new ATOM 0 HD11 LEU A 171 -12.088 -7.302 -0.217 1.00 0.26 H new ATOM 0 HD12 LEU A 171 -13.447 -7.904 0.762 1.00 0.26 H new ATOM 0 HD13 LEU A 171 -13.545 -7.939 -1.015 1.00 0.26 H new ATOM 0 HD21 LEU A 171 -12.279 -5.177 -1.441 1.00 0.31 H new ATOM 0 HD22 LEU A 171 -13.745 -5.742 -2.278 1.00 0.31 H new ATOM 0 HD23 LEU A 171 -13.778 -4.221 -1.355 1.00 0.31 H new ATOM 2550 N GLY A 172 -17.953 -5.613 1.043 1.00 0.29 N ATOM 2551 CA GLY A 172 -19.315 -6.049 1.127 1.00 0.39 C ATOM 2552 C GLY A 172 -20.317 -4.925 1.329 1.00 0.66 C ATOM 2553 O GLY A 172 -21.454 -5.015 0.859 1.00 1.12 O ATOM 0 H GLY A 172 -17.393 -5.819 1.870 1.00 0.29 H new ATOM 0 HA2 GLY A 172 -19.569 -6.588 0.214 1.00 0.39 H new ATOM 0 HA3 GLY A 172 -19.408 -6.756 1.951 1.00 0.39 H new ATOM 2557 N SER A 173 -19.922 -3.866 2.027 1.00 0.85 N ATOM 2558 CA SER A 173 -20.850 -2.786 2.351 1.00 1.33 C ATOM 2559 C SER A 173 -20.121 -1.451 2.506 1.00 1.84 C ATOM 2560 O SER A 173 -18.949 -1.335 2.160 1.00 2.43 O ATOM 2561 CB SER A 173 -21.616 -3.128 3.632 1.00 2.03 C ATOM 2562 OG SER A 173 -22.241 -4.398 3.531 1.00 2.64 O ATOM 0 H SER A 173 -18.974 -3.731 2.377 1.00 0.85 H new ATOM 0 HA SER A 173 -21.555 -2.683 1.526 1.00 1.33 H new ATOM 0 HB2 SER A 173 -20.932 -3.123 4.481 1.00 2.03 H new ATOM 0 HB3 SER A 173 -22.369 -2.363 3.824 1.00 2.03 H new ATOM 0 HG SER A 173 -22.722 -4.593 4.362 1.00 2.64 H new ATOM 2568 N ALA A 174 -20.814 -0.437 3.008 1.00 2.40 N ATOM 2569 CA ALA A 174 -20.206 0.873 3.180 1.00 3.35 C ATOM 2570 C ALA A 174 -19.619 1.048 4.580 1.00 3.69 C ATOM 2571 O ALA A 174 -18.430 1.338 4.730 1.00 4.35 O ATOM 2572 CB ALA A 174 -21.222 1.965 2.887 1.00 4.30 C ATOM 0 H ALA A 174 -21.789 -0.496 3.301 1.00 2.40 H new ATOM 0 HA ALA A 174 -19.382 0.952 2.470 1.00 3.35 H new ATOM 0 HB1 ALA A 174 -20.755 2.941 3.019 1.00 4.30 H new ATOM 0 HB2 ALA A 174 -21.575 1.868 1.860 1.00 4.30 H new ATOM 0 HB3 ALA A 174 -22.065 1.870 3.571 1.00 4.30 H new ATOM 2578 N ARG A 175 -20.446 0.874 5.605 1.00 3.66 N ATOM 2579 CA ARG A 175 -20.002 1.103 6.975 1.00 4.44 C ATOM 2580 C ARG A 175 -20.704 0.172 7.959 1.00 4.81 C ATOM 2581 O ARG A 175 -21.885 0.340 8.258 1.00 5.15 O ATOM 2582 CB ARG A 175 -20.254 2.565 7.366 1.00 5.16 C ATOM 2583 CG ARG A 175 -19.861 2.918 8.799 1.00 5.82 C ATOM 2584 CD ARG A 175 -18.367 2.763 9.048 1.00 6.62 C ATOM 2585 NE ARG A 175 -18.002 1.402 9.447 1.00 7.03 N ATOM 2586 CZ ARG A 175 -16.757 0.922 9.401 1.00 7.84 C ATOM 2587 NH1 ARG A 175 -15.767 1.683 8.954 1.00 8.30 N ATOM 2588 NH2 ARG A 175 -16.506 -0.314 9.813 1.00 8.45 N ATOM 0 H ARG A 175 -21.418 0.578 5.515 1.00 3.66 H new ATOM 0 HA ARG A 175 -18.934 0.890 7.021 1.00 4.44 H new ATOM 0 HB2 ARG A 175 -19.702 3.210 6.683 1.00 5.16 H new ATOM 0 HB3 ARG A 175 -21.312 2.787 7.229 1.00 5.16 H new ATOM 0 HG2 ARG A 175 -20.157 3.945 9.011 1.00 5.82 H new ATOM 0 HG3 ARG A 175 -20.410 2.279 9.491 1.00 5.82 H new ATOM 0 HD2 ARG A 175 -17.822 3.031 8.143 1.00 6.62 H new ATOM 0 HD3 ARG A 175 -18.057 3.461 9.826 1.00 6.62 H new ATOM 0 HE ARG A 175 -18.743 0.784 9.780 1.00 7.03 H new ATOM 0 HH11 ARG A 175 -15.956 2.636 8.645 1.00 8.30 H new ATOM 0 HH12 ARG A 175 -14.816 1.315 8.919 1.00 8.30 H new ATOM 0 HH21 ARG A 175 -17.264 -0.898 10.165 1.00 8.45 H new ATOM 0 HH22 ARG A 175 -15.555 -0.680 9.778 1.00 8.45 H new ATOM 2602 N LEU A 176 -19.966 -0.814 8.447 1.00 5.22 N ATOM 2603 CA LEU A 176 -20.445 -1.682 9.516 1.00 6.05 C ATOM 2604 C LEU A 176 -19.682 -1.375 10.794 1.00 6.72 C ATOM 2605 O LEU A 176 -20.247 -0.706 11.683 1.00 7.14 O ATOM 2606 CB LEU A 176 -20.284 -3.166 9.151 1.00 6.60 C ATOM 2607 CG LEU A 176 -21.434 -3.779 8.345 1.00 7.19 C ATOM 2608 CD1 LEU A 176 -22.747 -3.644 9.101 1.00 7.69 C ATOM 2609 CD2 LEU A 176 -21.541 -3.136 6.974 1.00 7.60 C ATOM 2610 OXT LEU A 176 -18.502 -1.766 10.882 1.00 7.13 O ATOM 0 H LEU A 176 -19.026 -1.035 8.118 1.00 5.22 H new ATOM 0 HA LEU A 176 -21.508 -1.491 9.664 1.00 6.05 H new ATOM 0 HB2 LEU A 176 -19.362 -3.283 8.581 1.00 6.60 H new ATOM 0 HB3 LEU A 176 -20.165 -3.737 10.072 1.00 6.60 H new ATOM 0 HG LEU A 176 -21.221 -4.839 8.206 1.00 7.19 H new ATOM 0 HD11 LEU A 176 -23.552 -4.085 8.513 1.00 7.69 H new ATOM 0 HD12 LEU A 176 -22.671 -4.161 10.058 1.00 7.69 H new ATOM 0 HD13 LEU A 176 -22.960 -2.589 9.275 1.00 7.69 H new ATOM 0 HD21 LEU A 176 -22.365 -3.589 6.423 1.00 7.60 H new ATOM 0 HD22 LEU A 176 -21.724 -2.067 7.087 1.00 7.60 H new ATOM 0 HD23 LEU A 176 -20.611 -3.289 6.427 1.00 7.60 H new TER 2622 LEU A 176