USER MOD reduce.3.24.130724 H: found=0, std=0, add=739, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 742 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 100 ASN :FLIP amide:sc= -5.78! C(o=-9!,f=-8!) USER MOD Set 1.2: A 144 HIS : no HE2:sc= -2.21 K(o=-8,f=-10) USER MOD Set 2.1: A 138 LYS NZ :NH3+ -162:sc= 0.71 (180deg=0) USER MOD Set 2.2: A 140 TYR OH : rot 180:sc= 0.63 USER MOD Set 3.1: A 116 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 120 SER OG : rot 148:sc= 0.136 USER MOD Set 4.1: A 109 SER OG : rot -93:sc= 0.638 USER MOD Set 4.2: A 164 ASN : amide:sc= -0.606 K(o=0.032,f=-1!) USER MOD Single : A 92 SER OG : rot 39:sc= 0.217 USER MOD Single : A 95 LYS NZ :NH3+ 177:sc= 1.04 (180deg=0.971) USER MOD Single : A 96 SER OG : rot 167:sc= 0.53 USER MOD Single : A 104 LYS NZ :NH3+ 172:sc= -0.0103 (180deg=-0.145) USER MOD Single : A 105 ASN : amide:sc= 1.03 K(o=1,f=-1.3) USER MOD Single : A 108 LYS NZ :NH3+ 164:sc= -1.09 (180deg=-1.48) USER MOD Single : A 112 ASN : amide:sc= 0.181 K(o=0.18,f=-7.1!) USER MOD Single : A 113 LYS NZ :NH3+ 156:sc= -0.165 (180deg=-0.68) USER MOD Single : A 118 THR OG1 : rot 76:sc= 0.939 USER MOD Single : A 124 ASN : amide:sc= 0.598 K(o=0.6,f=-0.8) USER MOD Single : A 127 SER OG : rot 8:sc= 0.312 USER MOD Single : A 128 CYS SG : rot 128:sc= -4.19! USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 CYS SG : rot 54:sc= 0.382 USER MOD Single : A 135 ASN : amide:sc= 0.269 X(o=0.27,f=0) USER MOD Single : A 137 SER OG : rot 170:sc= -0.628 USER MOD Single : A 147 THR OG1 : rot 180:sc=-0.00103 USER MOD Single : A 148 GLN : amide:sc= -0.873 K(o=-0.87,f=-2.3!) USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 158 MET CE :methyl -171:sc= -0.684 (180deg=-0.849) USER MOD Single : A 159 ASN : amide:sc= -1.98! C(o=-2!,f=-4.7!) USER MOD Single : A 161 MET CE :methyl -132:sc= -0.17 (180deg=-1.39) USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 174 LYS NZ :NH3+ 164:sc= -0.0287 (180deg=-0.283) USER MOD Single : A 175 SER OG : rot 180:sc= 0.342 USER MOD Single : A 177 LYS NZ :NH3+ 169:sc=-0.00102 (180deg=-0.15) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 88 19.857 -3.235 11.276 1.00 14.85 N ATOM 2 CA GLY A 88 19.720 -4.398 12.186 1.00 14.52 C ATOM 3 C GLY A 88 19.819 -5.706 11.437 1.00 14.06 C ATOM 4 O GLY A 88 20.886 -6.061 10.943 1.00 14.34 O ATOM 0 HA2 GLY A 88 20.496 -4.356 12.950 1.00 14.52 H new ATOM 0 HA3 GLY A 88 18.761 -4.346 12.702 1.00 14.52 H new ATOM 10 N ALA A 89 18.703 -6.421 11.335 1.00 13.50 N ATOM 11 CA ALA A 89 18.647 -7.644 10.541 1.00 13.18 C ATOM 12 C ALA A 89 18.696 -7.297 9.060 1.00 12.18 C ATOM 13 O ALA A 89 18.998 -8.136 8.210 1.00 12.38 O ATOM 14 CB ALA A 89 17.384 -8.429 10.859 1.00 13.38 C ATOM 0 H ALA A 89 17.825 -6.175 11.792 1.00 13.50 H new ATOM 0 HA ALA A 89 19.507 -8.266 10.790 1.00 13.18 H new ATOM 0 HB1 ALA A 89 17.359 -9.338 10.258 1.00 13.38 H new ATOM 0 HB2 ALA A 89 17.376 -8.693 11.916 1.00 13.38 H new ATOM 0 HB3 ALA A 89 16.510 -7.819 10.631 1.00 13.38 H new ATOM 20 N ASP A 90 18.394 -6.043 8.774 1.00 11.25 N ATOM 21 CA ASP A 90 18.432 -5.513 7.424 1.00 10.32 C ATOM 22 C ASP A 90 19.858 -5.121 7.044 1.00 10.04 C ATOM 23 O ASP A 90 20.501 -4.338 7.741 1.00 9.96 O ATOM 24 CB ASP A 90 17.504 -4.300 7.325 1.00 9.53 C ATOM 25 CG ASP A 90 17.844 -3.218 8.339 1.00 9.74 C ATOM 26 OD1 ASP A 90 17.639 -3.438 9.548 1.00 9.91 O ATOM 27 OD2 ASP A 90 18.327 -2.137 7.923 1.00 9.92 O ATOM 0 H ASP A 90 18.114 -5.360 9.477 1.00 11.25 H new ATOM 0 HA ASP A 90 18.093 -6.282 6.730 1.00 10.32 H new ATOM 0 HB2 ASP A 90 17.564 -3.882 6.320 1.00 9.53 H new ATOM 0 HB3 ASP A 90 16.474 -4.622 7.475 1.00 9.53 H new ATOM 32 N PRO A 91 20.381 -5.685 5.946 1.00 10.16 N ATOM 33 CA PRO A 91 21.739 -5.390 5.472 1.00 10.16 C ATOM 34 C PRO A 91 21.898 -3.933 5.041 1.00 9.18 C ATOM 35 O PRO A 91 22.504 -3.127 5.751 1.00 9.15 O ATOM 36 CB PRO A 91 21.922 -6.331 4.273 1.00 10.77 C ATOM 37 CG PRO A 91 20.856 -7.361 4.420 1.00 11.14 C ATOM 38 CD PRO A 91 19.707 -6.668 5.088 1.00 10.63 C ATOM 0 HA PRO A 91 22.482 -5.538 6.256 1.00 10.16 H new ATOM 0 HB2 PRO A 91 21.822 -5.792 3.331 1.00 10.77 H new ATOM 0 HB3 PRO A 91 22.913 -6.786 4.277 1.00 10.77 H new ATOM 0 HG2 PRO A 91 20.561 -7.760 3.449 1.00 11.14 H new ATOM 0 HG3 PRO A 91 21.206 -8.203 5.018 1.00 11.14 H new ATOM 0 HD2 PRO A 91 19.046 -6.190 4.365 1.00 10.63 H new ATOM 0 HD3 PRO A 91 19.097 -7.361 5.667 1.00 10.63 H new ATOM 46 N SER A 92 21.339 -3.596 3.888 1.00 8.61 N ATOM 47 CA SER A 92 21.364 -2.230 3.398 1.00 7.83 C ATOM 48 C SER A 92 20.064 -1.922 2.655 1.00 6.91 C ATOM 49 O SER A 92 19.758 -2.548 1.637 1.00 6.95 O ATOM 50 CB SER A 92 22.577 -2.013 2.486 1.00 8.48 C ATOM 51 OG SER A 92 22.629 -2.979 1.449 1.00 9.30 O ATOM 0 H SER A 92 20.861 -4.255 3.273 1.00 8.61 H new ATOM 0 HA SER A 92 21.451 -1.549 4.245 1.00 7.83 H new ATOM 0 HB2 SER A 92 22.533 -1.014 2.052 1.00 8.48 H new ATOM 0 HB3 SER A 92 23.491 -2.063 3.077 1.00 8.48 H new ATOM 0 HG SER A 92 21.722 -3.158 1.123 1.00 9.30 H new ATOM 57 N LEU A 93 19.284 -0.979 3.161 1.00 6.42 N ATOM 58 CA LEU A 93 17.983 -0.702 2.586 1.00 5.85 C ATOM 59 C LEU A 93 18.036 0.509 1.669 1.00 4.94 C ATOM 60 O LEU A 93 17.997 1.647 2.138 1.00 5.05 O ATOM 61 CB LEU A 93 16.950 -0.454 3.686 1.00 6.31 C ATOM 62 CG LEU A 93 16.789 -1.583 4.701 1.00 7.36 C ATOM 63 CD1 LEU A 93 15.707 -1.224 5.722 1.00 7.82 C ATOM 64 CD2 LEU A 93 16.442 -2.889 3.994 1.00 7.89 C ATOM 0 H LEU A 93 19.529 -0.398 3.963 1.00 6.42 H new ATOM 0 HA LEU A 93 17.691 -1.575 2.003 1.00 5.85 H new ATOM 0 HB2 LEU A 93 17.225 0.455 4.220 1.00 6.31 H new ATOM 0 HB3 LEU A 93 15.983 -0.269 3.218 1.00 6.31 H new ATOM 0 HG LEU A 93 17.734 -1.717 5.227 1.00 7.36 H new ATOM 0 HD11 LEU A 93 15.601 -2.037 6.441 1.00 7.82 H new ATOM 0 HD12 LEU A 93 15.990 -0.311 6.246 1.00 7.82 H new ATOM 0 HD13 LEU A 93 14.759 -1.069 5.208 1.00 7.82 H new ATOM 0 HD21 LEU A 93 16.331 -3.684 4.732 1.00 7.89 H new ATOM 0 HD22 LEU A 93 15.507 -2.769 3.446 1.00 7.89 H new ATOM 0 HD23 LEU A 93 17.240 -3.149 3.298 1.00 7.89 H new ATOM 76 N ARG A 94 18.164 0.281 0.370 1.00 4.45 N ATOM 77 CA ARG A 94 17.948 1.351 -0.585 1.00 3.96 C ATOM 78 C ARG A 94 16.452 1.614 -0.616 1.00 3.05 C ATOM 79 O ARG A 94 15.991 2.751 -0.535 1.00 3.26 O ATOM 80 CB ARG A 94 18.444 0.965 -1.978 1.00 4.35 C ATOM 81 CG ARG A 94 19.817 0.317 -2.000 1.00 5.15 C ATOM 82 CD ARG A 94 20.255 0.005 -3.424 1.00 5.75 C ATOM 83 NE ARG A 94 19.225 -0.716 -4.179 1.00 6.33 N ATOM 84 CZ ARG A 94 19.473 -1.734 -5.006 1.00 7.04 C ATOM 85 NH1 ARG A 94 20.702 -2.219 -5.134 1.00 7.28 N ATOM 86 NH2 ARG A 94 18.484 -2.278 -5.701 1.00 7.78 N ATOM 0 H ARG A 94 18.412 -0.620 -0.039 1.00 4.45 H new ATOM 0 HA ARG A 94 18.504 2.240 -0.288 1.00 3.96 H new ATOM 0 HB2 ARG A 94 17.726 0.280 -2.429 1.00 4.35 H new ATOM 0 HB3 ARG A 94 18.468 1.858 -2.602 1.00 4.35 H new ATOM 0 HG2 ARG A 94 20.543 0.981 -1.530 1.00 5.15 H new ATOM 0 HG3 ARG A 94 19.798 -0.601 -1.413 1.00 5.15 H new ATOM 0 HD2 ARG A 94 20.496 0.935 -3.939 1.00 5.75 H new ATOM 0 HD3 ARG A 94 21.167 -0.591 -3.399 1.00 5.75 H new ATOM 0 HE ARG A 94 18.256 -0.420 -4.065 1.00 6.33 H new ATOM 0 HH11 ARG A 94 21.469 -1.814 -4.597 1.00 7.28 H new ATOM 0 HH12 ARG A 94 20.880 -2.997 -5.769 1.00 7.28 H new ATOM 0 HH21 ARG A 94 17.534 -1.919 -5.604 1.00 7.78 H new ATOM 0 HH22 ARG A 94 18.673 -3.056 -6.333 1.00 7.78 H new ATOM 100 N LYS A 95 15.709 0.520 -0.706 1.00 2.37 N ATOM 101 CA LYS A 95 14.273 0.526 -0.509 1.00 1.60 C ATOM 102 C LYS A 95 13.982 0.357 0.992 1.00 1.26 C ATOM 103 O LYS A 95 13.731 -0.757 1.459 1.00 1.52 O ATOM 104 CB LYS A 95 13.641 -0.614 -1.317 1.00 1.56 C ATOM 105 CG LYS A 95 12.152 -0.804 -1.080 1.00 1.15 C ATOM 106 CD LYS A 95 11.563 -1.816 -2.050 1.00 1.36 C ATOM 107 CE LYS A 95 10.176 -2.264 -1.614 1.00 1.24 C ATOM 108 NZ LYS A 95 9.347 -1.124 -1.157 1.00 1.91 N ATOM 0 H LYS A 95 16.092 -0.401 -0.919 1.00 2.37 H new ATOM 0 HA LYS A 95 13.845 1.468 -0.853 1.00 1.60 H new ATOM 0 HB2 LYS A 95 13.806 -0.425 -2.378 1.00 1.56 H new ATOM 0 HB3 LYS A 95 14.156 -1.543 -1.074 1.00 1.56 H new ATOM 0 HG2 LYS A 95 11.984 -1.138 -0.056 1.00 1.15 H new ATOM 0 HG3 LYS A 95 11.639 0.151 -1.192 1.00 1.15 H new ATOM 0 HD2 LYS A 95 11.508 -1.377 -3.046 1.00 1.36 H new ATOM 0 HD3 LYS A 95 12.221 -2.682 -2.118 1.00 1.36 H new ATOM 0 HE2 LYS A 95 9.678 -2.765 -2.444 1.00 1.24 H new ATOM 0 HE3 LYS A 95 10.266 -2.993 -0.809 1.00 1.24 H new ATOM 0 HZ1 LYS A 95 8.394 -1.463 -0.917 1.00 1.91 H new ATOM 0 HZ2 LYS A 95 9.783 -0.692 -0.317 1.00 1.91 H new ATOM 0 HZ3 LYS A 95 9.282 -0.416 -1.916 1.00 1.91 H new ATOM 122 N SER A 96 14.081 1.442 1.761 1.00 1.02 N ATOM 123 CA SER A 96 13.935 1.366 3.205 1.00 0.93 C ATOM 124 C SER A 96 12.489 1.104 3.625 1.00 0.89 C ATOM 125 O SER A 96 11.601 0.936 2.784 1.00 1.75 O ATOM 126 CB SER A 96 14.460 2.658 3.830 1.00 1.13 C ATOM 127 OG SER A 96 13.951 3.794 3.145 1.00 1.79 O ATOM 0 H SER A 96 14.262 2.380 1.403 1.00 1.02 H new ATOM 0 HA SER A 96 14.520 0.520 3.566 1.00 0.93 H new ATOM 0 HB2 SER A 96 14.172 2.702 4.880 1.00 1.13 H new ATOM 0 HB3 SER A 96 15.549 2.666 3.797 1.00 1.13 H new ATOM 0 HG SER A 96 14.123 4.600 3.676 1.00 1.79 H new ATOM 133 N GLY A 97 12.258 1.064 4.933 1.00 0.44 N ATOM 134 CA GLY A 97 10.957 0.704 5.445 1.00 0.29 C ATOM 135 C GLY A 97 10.814 -0.805 5.573 1.00 0.27 C ATOM 136 O GLY A 97 10.512 -1.310 6.651 1.00 0.36 O ATOM 0 H GLY A 97 12.955 1.276 5.647 1.00 0.44 H new ATOM 0 HA2 GLY A 97 10.805 1.170 6.418 1.00 0.29 H new ATOM 0 HA3 GLY A 97 10.183 1.090 4.782 1.00 0.29 H new ATOM 140 N VAL A 98 11.088 -1.512 4.470 1.00 0.29 N ATOM 141 CA VAL A 98 10.894 -2.967 4.366 1.00 0.33 C ATOM 142 C VAL A 98 9.422 -3.331 4.298 1.00 0.25 C ATOM 143 O VAL A 98 8.627 -2.913 5.133 1.00 0.27 O ATOM 144 CB VAL A 98 11.544 -3.766 5.513 1.00 0.49 C ATOM 145 CG1 VAL A 98 11.044 -5.201 5.504 1.00 0.47 C ATOM 146 CG2 VAL A 98 13.049 -3.755 5.394 1.00 0.71 C ATOM 0 H VAL A 98 11.454 -1.089 3.617 1.00 0.29 H new ATOM 0 HA VAL A 98 11.395 -3.245 3.439 1.00 0.33 H new ATOM 0 HB VAL A 98 11.265 -3.291 6.453 1.00 0.49 H new ATOM 0 HG11 VAL A 98 11.511 -5.754 6.319 1.00 0.47 H new ATOM 0 HG12 VAL A 98 9.962 -5.210 5.633 1.00 0.47 H new ATOM 0 HG13 VAL A 98 11.300 -5.670 4.554 1.00 0.47 H new ATOM 0 HG21 VAL A 98 13.483 -4.326 6.215 1.00 0.71 H new ATOM 0 HG22 VAL A 98 13.342 -4.204 4.445 1.00 0.71 H new ATOM 0 HG23 VAL A 98 13.410 -2.727 5.436 1.00 0.71 H new ATOM 156 N GLY A 99 9.057 -4.106 3.293 1.00 0.21 N ATOM 157 CA GLY A 99 7.684 -4.533 3.178 1.00 0.20 C ATOM 158 C GLY A 99 6.785 -3.394 2.757 1.00 0.15 C ATOM 159 O GLY A 99 5.586 -3.399 3.018 1.00 0.18 O ATOM 0 H GLY A 99 9.681 -4.444 2.561 1.00 0.21 H new ATOM 0 HA2 GLY A 99 7.613 -5.342 2.451 1.00 0.20 H new ATOM 0 HA3 GLY A 99 7.344 -4.932 4.134 1.00 0.20 H new ATOM 163 N ASN A 100 7.378 -2.404 2.116 1.00 0.13 N ATOM 164 CA ASN A 100 6.665 -1.188 1.753 1.00 0.14 C ATOM 165 C ASN A 100 6.012 -1.372 0.395 1.00 0.14 C ATOM 166 O ASN A 100 6.691 -1.710 -0.581 1.00 0.19 O ATOM 167 CB ASN A 100 7.664 -0.035 1.684 1.00 0.21 C ATOM 168 CG ASN A 100 8.182 0.384 3.046 1.00 0.28 C ATOM 169 OD1 ASN A 100 8.038 -0.482 4.047 1.00 0.63 O flip ATOM 170 ND2 ASN A 100 8.683 1.491 3.205 1.00 0.20 N flip ATOM 0 H ASN A 100 8.358 -2.416 1.833 1.00 0.13 H new ATOM 0 HA ASN A 100 5.897 -0.971 2.496 1.00 0.14 H new ATOM 0 HB2 ASN A 100 8.505 -0.328 1.056 1.00 0.21 H new ATOM 0 HB3 ASN A 100 7.190 0.821 1.203 1.00 0.21 H new ATOM 0 HD21 ASN A 100 8.776 2.127 2.413 1.00 0.20 H new ATOM 0 HD22 ASN A 100 9.007 1.776 4.129 1.00 0.20 H new ATOM 177 N ILE A 101 4.713 -1.142 0.329 1.00 0.12 N ATOM 178 CA ILE A 101 3.981 -1.193 -0.929 1.00 0.13 C ATOM 179 C ILE A 101 3.054 0.004 -1.027 1.00 0.12 C ATOM 180 O ILE A 101 2.757 0.642 -0.014 1.00 0.15 O ATOM 181 CB ILE A 101 3.159 -2.490 -1.077 1.00 0.13 C ATOM 182 CG1 ILE A 101 2.159 -2.628 0.075 1.00 0.11 C ATOM 183 CG2 ILE A 101 4.081 -3.697 -1.145 1.00 0.15 C ATOM 184 CD1 ILE A 101 1.350 -3.906 0.036 1.00 0.13 C ATOM 0 H ILE A 101 4.136 -0.916 1.139 1.00 0.12 H new ATOM 0 HA ILE A 101 4.715 -1.174 -1.734 1.00 0.13 H new ATOM 0 HB ILE A 101 2.595 -2.440 -2.008 1.00 0.13 H new ATOM 0 HG12 ILE A 101 2.700 -2.581 1.020 1.00 0.11 H new ATOM 0 HG13 ILE A 101 1.477 -1.778 0.055 1.00 0.11 H new ATOM 0 HG21 ILE A 101 3.486 -4.604 -1.249 1.00 0.15 H new ATOM 0 HG22 ILE A 101 4.746 -3.599 -2.003 1.00 0.15 H new ATOM 0 HG23 ILE A 101 4.673 -3.755 -0.232 1.00 0.15 H new ATOM 0 HD11 ILE A 101 0.665 -3.929 0.884 1.00 0.13 H new ATOM 0 HD12 ILE A 101 0.780 -3.947 -0.892 1.00 0.13 H new ATOM 0 HD13 ILE A 101 2.021 -4.763 0.088 1.00 0.13 H new ATOM 196 N PHE A 102 2.598 0.308 -2.227 1.00 0.11 N ATOM 197 CA PHE A 102 1.661 1.398 -2.412 1.00 0.11 C ATOM 198 C PHE A 102 0.418 0.895 -3.136 1.00 0.09 C ATOM 199 O PHE A 102 0.505 0.054 -4.034 1.00 0.11 O ATOM 200 CB PHE A 102 2.331 2.572 -3.150 1.00 0.16 C ATOM 201 CG PHE A 102 1.872 2.798 -4.565 1.00 0.13 C ATOM 202 CD1 PHE A 102 0.801 3.638 -4.832 1.00 0.14 C ATOM 203 CD2 PHE A 102 2.525 2.193 -5.626 1.00 0.17 C ATOM 204 CE1 PHE A 102 0.386 3.864 -6.126 1.00 0.17 C ATOM 205 CE2 PHE A 102 2.118 2.418 -6.923 1.00 0.21 C ATOM 206 CZ PHE A 102 1.047 3.253 -7.175 1.00 0.20 C ATOM 0 H PHE A 102 2.859 -0.181 -3.083 1.00 0.11 H new ATOM 0 HA PHE A 102 1.348 1.775 -1.438 1.00 0.11 H new ATOM 0 HB2 PHE A 102 2.155 3.484 -2.580 1.00 0.16 H new ATOM 0 HB3 PHE A 102 3.408 2.405 -3.159 1.00 0.16 H new ATOM 0 HD1 PHE A 102 0.286 4.121 -4.015 1.00 0.14 H new ATOM 0 HD2 PHE A 102 3.362 1.538 -5.435 1.00 0.17 H new ATOM 0 HE1 PHE A 102 -0.453 4.516 -6.320 1.00 0.17 H new ATOM 0 HE2 PHE A 102 2.636 1.942 -7.742 1.00 0.21 H new ATOM 0 HZ PHE A 102 0.726 3.428 -8.191 1.00 0.20 H new ATOM 216 N ILE A 103 -0.731 1.390 -2.709 1.00 0.08 N ATOM 217 CA ILE A 103 -2.011 0.979 -3.261 1.00 0.08 C ATOM 218 C ILE A 103 -2.692 2.173 -3.917 1.00 0.08 C ATOM 219 O ILE A 103 -2.616 3.289 -3.408 1.00 0.15 O ATOM 220 CB ILE A 103 -2.931 0.418 -2.159 1.00 0.08 C ATOM 221 CG1 ILE A 103 -2.224 -0.689 -1.381 1.00 0.08 C ATOM 222 CG2 ILE A 103 -4.226 -0.114 -2.759 1.00 0.10 C ATOM 223 CD1 ILE A 103 -2.532 -0.662 0.094 1.00 0.09 C ATOM 0 H ILE A 103 -0.803 2.089 -1.969 1.00 0.08 H new ATOM 0 HA ILE A 103 -1.830 0.198 -3.999 1.00 0.08 H new ATOM 0 HB ILE A 103 -3.171 1.231 -1.473 1.00 0.08 H new ATOM 0 HG12 ILE A 103 -2.516 -1.656 -1.790 1.00 0.08 H new ATOM 0 HG13 ILE A 103 -1.147 -0.595 -1.523 1.00 0.08 H new ATOM 0 HG21 ILE A 103 -4.861 -0.505 -1.964 1.00 0.10 H new ATOM 0 HG22 ILE A 103 -4.746 0.693 -3.275 1.00 0.10 H new ATOM 0 HG23 ILE A 103 -3.999 -0.911 -3.467 1.00 0.10 H new ATOM 0 HD11 ILE A 103 -2.000 -1.473 0.592 1.00 0.09 H new ATOM 0 HD12 ILE A 103 -2.215 0.292 0.515 1.00 0.09 H new ATOM 0 HD13 ILE A 103 -3.605 -0.786 0.244 1.00 0.09 H new ATOM 235 N LYS A 104 -3.353 1.938 -5.037 1.00 0.13 N ATOM 236 CA LYS A 104 -4.013 3.004 -5.771 1.00 0.13 C ATOM 237 C LYS A 104 -5.474 2.656 -6.022 1.00 0.12 C ATOM 238 O LYS A 104 -5.833 1.479 -6.040 1.00 0.14 O ATOM 239 CB LYS A 104 -3.309 3.215 -7.108 1.00 0.19 C ATOM 240 CG LYS A 104 -3.436 4.627 -7.660 1.00 0.28 C ATOM 241 CD LYS A 104 -2.492 4.877 -8.834 1.00 0.39 C ATOM 242 CE LYS A 104 -2.763 3.952 -10.015 1.00 0.66 C ATOM 243 NZ LYS A 104 -4.169 4.046 -10.491 1.00 1.46 N ATOM 0 H LYS A 104 -3.447 1.014 -5.460 1.00 0.13 H new ATOM 0 HA LYS A 104 -3.965 3.917 -5.177 1.00 0.13 H new ATOM 0 HB2 LYS A 104 -2.252 2.975 -6.992 1.00 0.19 H new ATOM 0 HB3 LYS A 104 -3.717 2.514 -7.836 1.00 0.19 H new ATOM 0 HG2 LYS A 104 -4.464 4.799 -7.980 1.00 0.28 H new ATOM 0 HG3 LYS A 104 -3.225 5.345 -6.868 1.00 0.28 H new ATOM 0 HD2 LYS A 104 -2.590 5.913 -9.159 1.00 0.39 H new ATOM 0 HD3 LYS A 104 -1.463 4.743 -8.502 1.00 0.39 H new ATOM 0 HE2 LYS A 104 -2.087 4.202 -10.833 1.00 0.66 H new ATOM 0 HE3 LYS A 104 -2.547 2.923 -9.726 1.00 0.66 H new ATOM 0 HZ1 LYS A 104 -4.273 3.506 -11.374 1.00 1.46 H new ATOM 0 HZ2 LYS A 104 -4.807 3.655 -9.769 1.00 1.46 H new ATOM 0 HZ3 LYS A 104 -4.411 5.043 -10.664 1.00 1.46 H new ATOM 257 N ASN A 105 -6.298 3.689 -6.200 1.00 0.12 N ATOM 258 CA ASN A 105 -7.700 3.542 -6.604 1.00 0.13 C ATOM 259 C ASN A 105 -8.561 3.015 -5.452 1.00 0.15 C ATOM 260 O ASN A 105 -9.545 2.307 -5.666 1.00 0.25 O ATOM 261 CB ASN A 105 -7.823 2.620 -7.827 1.00 0.16 C ATOM 262 CG ASN A 105 -9.101 2.868 -8.612 1.00 0.23 C ATOM 263 OD1 ASN A 105 -9.586 3.994 -8.695 1.00 0.49 O ATOM 264 ND2 ASN A 105 -9.657 1.816 -9.190 1.00 0.34 N ATOM 0 H ASN A 105 -6.011 4.659 -6.067 1.00 0.12 H new ATOM 0 HA ASN A 105 -8.068 4.531 -6.876 1.00 0.13 H new ATOM 0 HB2 ASN A 105 -6.963 2.770 -8.480 1.00 0.16 H new ATOM 0 HB3 ASN A 105 -7.797 1.581 -7.500 1.00 0.16 H new ATOM 0 HD21 ASN A 105 -10.518 1.924 -9.727 1.00 0.34 H new ATOM 0 HD22 ASN A 105 -9.225 0.896 -9.099 1.00 0.34 H new ATOM 271 N LEU A 106 -8.200 3.388 -4.231 1.00 0.14 N ATOM 272 CA LEU A 106 -8.965 2.993 -3.054 1.00 0.17 C ATOM 273 C LEU A 106 -10.234 3.820 -2.922 1.00 0.22 C ATOM 274 O LEU A 106 -10.368 4.882 -3.536 1.00 0.26 O ATOM 275 CB LEU A 106 -8.126 3.139 -1.783 1.00 0.16 C ATOM 276 CG LEU A 106 -7.048 2.073 -1.601 1.00 0.14 C ATOM 277 CD1 LEU A 106 -5.976 2.551 -0.643 1.00 0.15 C ATOM 278 CD2 LEU A 106 -7.669 0.790 -1.077 1.00 0.16 C ATOM 0 H LEU A 106 -7.382 3.963 -4.029 1.00 0.14 H new ATOM 0 HA LEU A 106 -9.239 1.946 -3.181 1.00 0.17 H new ATOM 0 HB2 LEU A 106 -7.650 4.120 -1.789 1.00 0.16 H new ATOM 0 HB3 LEU A 106 -8.792 3.113 -0.920 1.00 0.16 H new ATOM 0 HG LEU A 106 -6.588 1.882 -2.571 1.00 0.14 H new ATOM 0 HD11 LEU A 106 -5.219 1.776 -0.528 1.00 0.15 H new ATOM 0 HD12 LEU A 106 -5.513 3.455 -1.037 1.00 0.15 H new ATOM 0 HD13 LEU A 106 -6.424 2.766 0.327 1.00 0.15 H new ATOM 0 HD21 LEU A 106 -6.893 0.035 -0.950 1.00 0.16 H new ATOM 0 HD22 LEU A 106 -8.148 0.983 -0.117 1.00 0.16 H new ATOM 0 HD23 LEU A 106 -8.413 0.429 -1.787 1.00 0.16 H new ATOM 290 N ASP A 107 -11.158 3.327 -2.118 1.00 0.27 N ATOM 291 CA ASP A 107 -12.413 4.017 -1.882 1.00 0.32 C ATOM 292 C ASP A 107 -12.364 4.709 -0.530 1.00 0.30 C ATOM 293 O ASP A 107 -11.658 4.260 0.371 1.00 0.26 O ATOM 294 CB ASP A 107 -13.578 3.024 -1.918 1.00 0.37 C ATOM 295 CG ASP A 107 -14.930 3.708 -1.996 1.00 0.50 C ATOM 296 OD1 ASP A 107 -15.436 4.162 -0.951 1.00 0.71 O ATOM 297 OD2 ASP A 107 -15.498 3.779 -3.106 1.00 0.62 O ATOM 0 H ASP A 107 -11.062 2.445 -1.614 1.00 0.27 H new ATOM 0 HA ASP A 107 -12.564 4.761 -2.665 1.00 0.32 H new ATOM 0 HB2 ASP A 107 -13.460 2.363 -2.777 1.00 0.37 H new ATOM 0 HB3 ASP A 107 -13.543 2.398 -1.027 1.00 0.37 H new ATOM 302 N LYS A 108 -13.100 5.799 -0.395 1.00 0.38 N ATOM 303 CA LYS A 108 -13.188 6.527 0.871 1.00 0.43 C ATOM 304 C LYS A 108 -13.750 5.650 1.987 1.00 0.36 C ATOM 305 O LYS A 108 -13.565 5.944 3.168 1.00 0.46 O ATOM 306 CB LYS A 108 -14.066 7.767 0.720 1.00 0.55 C ATOM 307 CG LYS A 108 -15.480 7.435 0.291 1.00 0.57 C ATOM 308 CD LYS A 108 -16.488 8.461 0.778 1.00 0.90 C ATOM 309 CE LYS A 108 -16.988 8.164 2.193 1.00 1.21 C ATOM 310 NZ LYS A 108 -15.908 8.208 3.219 1.00 2.20 N ATOM 0 H LYS A 108 -13.652 6.206 -1.150 1.00 0.38 H new ATOM 0 HA LYS A 108 -12.174 6.825 1.139 1.00 0.43 H new ATOM 0 HB2 LYS A 108 -14.095 8.304 1.668 1.00 0.55 H new ATOM 0 HB3 LYS A 108 -13.617 8.438 -0.012 1.00 0.55 H new ATOM 0 HG2 LYS A 108 -15.522 7.376 -0.797 1.00 0.57 H new ATOM 0 HG3 LYS A 108 -15.752 6.452 0.675 1.00 0.57 H new ATOM 0 HD2 LYS A 108 -16.033 9.451 0.757 1.00 0.90 H new ATOM 0 HD3 LYS A 108 -17.336 8.486 0.094 1.00 0.90 H new ATOM 0 HE2 LYS A 108 -17.761 8.886 2.457 1.00 1.21 H new ATOM 0 HE3 LYS A 108 -17.454 7.179 2.207 1.00 1.21 H new ATOM 0 HZ1 LYS A 108 -16.332 8.270 4.167 1.00 2.20 H new ATOM 0 HZ2 LYS A 108 -15.332 7.345 3.154 1.00 2.20 H new ATOM 0 HZ3 LYS A 108 -15.306 9.040 3.054 1.00 2.20 H new ATOM 324 N SER A 109 -14.476 4.606 1.614 1.00 0.31 N ATOM 325 CA SER A 109 -14.969 3.633 2.585 1.00 0.40 C ATOM 326 C SER A 109 -13.824 2.803 3.178 1.00 0.34 C ATOM 327 O SER A 109 -14.017 2.074 4.152 1.00 0.43 O ATOM 328 CB SER A 109 -16.015 2.717 1.942 1.00 0.56 C ATOM 329 OG SER A 109 -15.551 2.194 0.710 1.00 1.41 O ATOM 0 H SER A 109 -14.738 4.409 0.648 1.00 0.31 H new ATOM 0 HA SER A 109 -15.438 4.185 3.400 1.00 0.40 H new ATOM 0 HB2 SER A 109 -16.252 1.898 2.621 1.00 0.56 H new ATOM 0 HB3 SER A 109 -16.938 3.273 1.779 1.00 0.56 H new ATOM 0 HG SER A 109 -15.845 2.774 -0.023 1.00 1.41 H new ATOM 335 N ILE A 110 -12.636 2.909 2.591 1.00 0.23 N ATOM 336 CA ILE A 110 -11.471 2.210 3.105 1.00 0.20 C ATOM 337 C ILE A 110 -10.709 3.104 4.081 1.00 0.20 C ATOM 338 O ILE A 110 -10.320 4.219 3.742 1.00 0.26 O ATOM 339 CB ILE A 110 -10.528 1.757 1.966 1.00 0.20 C ATOM 340 CG1 ILE A 110 -11.262 0.826 0.995 1.00 0.21 C ATOM 341 CG2 ILE A 110 -9.292 1.067 2.529 1.00 0.22 C ATOM 342 CD1 ILE A 110 -11.759 -0.455 1.634 1.00 0.23 C ATOM 0 H ILE A 110 -12.458 3.473 1.760 1.00 0.23 H new ATOM 0 HA ILE A 110 -11.824 1.319 3.625 1.00 0.20 H new ATOM 0 HB ILE A 110 -10.207 2.644 1.420 1.00 0.20 H new ATOM 0 HG12 ILE A 110 -12.110 1.360 0.566 1.00 0.21 H new ATOM 0 HG13 ILE A 110 -10.593 0.575 0.172 1.00 0.21 H new ATOM 0 HG21 ILE A 110 -8.643 0.757 1.710 1.00 0.22 H new ATOM 0 HG22 ILE A 110 -8.753 1.758 3.177 1.00 0.22 H new ATOM 0 HG23 ILE A 110 -9.594 0.191 3.104 1.00 0.22 H new ATOM 0 HD11 ILE A 110 -12.268 -1.062 0.885 1.00 0.23 H new ATOM 0 HD12 ILE A 110 -10.914 -1.011 2.039 1.00 0.23 H new ATOM 0 HD13 ILE A 110 -12.454 -0.214 2.439 1.00 0.23 H new ATOM 354 N ASP A 111 -10.535 2.617 5.298 1.00 0.17 N ATOM 355 CA ASP A 111 -9.772 3.330 6.315 1.00 0.18 C ATOM 356 C ASP A 111 -8.468 2.580 6.556 1.00 0.14 C ATOM 357 O ASP A 111 -8.213 1.562 5.909 1.00 0.13 O ATOM 358 CB ASP A 111 -10.582 3.420 7.614 1.00 0.23 C ATOM 359 CG ASP A 111 -9.982 4.366 8.639 1.00 1.01 C ATOM 360 OD1 ASP A 111 -10.178 5.596 8.500 1.00 1.23 O ATOM 361 OD2 ASP A 111 -9.306 3.893 9.574 1.00 1.59 O ATOM 0 H ASP A 111 -10.915 1.723 5.610 1.00 0.17 H new ATOM 0 HA ASP A 111 -9.557 4.344 5.977 1.00 0.18 H new ATOM 0 HB2 ASP A 111 -11.595 3.747 7.379 1.00 0.23 H new ATOM 0 HB3 ASP A 111 -10.662 2.425 8.053 1.00 0.23 H new ATOM 366 N ASN A 112 -7.663 3.052 7.495 1.00 0.15 N ATOM 367 CA ASN A 112 -6.403 2.389 7.813 1.00 0.13 C ATOM 368 C ASN A 112 -6.692 1.011 8.367 1.00 0.11 C ATOM 369 O ASN A 112 -5.954 0.058 8.121 1.00 0.12 O ATOM 370 CB ASN A 112 -5.588 3.176 8.839 1.00 0.16 C ATOM 371 CG ASN A 112 -5.200 4.562 8.365 1.00 0.19 C ATOM 372 OD1 ASN A 112 -5.095 4.821 7.169 1.00 0.60 O ATOM 373 ND2 ASN A 112 -4.954 5.458 9.306 1.00 0.55 N ATOM 0 H ASN A 112 -7.856 3.887 8.049 1.00 0.15 H new ATOM 0 HA ASN A 112 -5.819 2.323 6.895 1.00 0.13 H new ATOM 0 HB2 ASN A 112 -6.164 3.263 9.760 1.00 0.16 H new ATOM 0 HB3 ASN A 112 -4.684 2.616 9.080 1.00 0.16 H new ATOM 0 HD21 ASN A 112 -4.666 6.402 9.049 1.00 0.55 H new ATOM 0 HD22 ASN A 112 -5.052 5.205 10.289 1.00 0.55 H new ATOM 380 N LYS A 113 -7.794 0.917 9.102 1.00 0.12 N ATOM 381 CA LYS A 113 -8.245 -0.322 9.674 1.00 0.12 C ATOM 382 C LYS A 113 -8.568 -1.316 8.585 1.00 0.11 C ATOM 383 O LYS A 113 -8.123 -2.449 8.601 1.00 0.11 O ATOM 384 CB LYS A 113 -9.520 -0.061 10.445 1.00 0.15 C ATOM 385 CG LYS A 113 -9.541 -0.581 11.869 1.00 0.28 C ATOM 386 CD LYS A 113 -9.229 -2.061 11.955 1.00 0.54 C ATOM 387 CE LYS A 113 -7.739 -2.339 11.824 1.00 1.63 C ATOM 388 NZ LYS A 113 -6.950 -1.666 12.892 1.00 2.58 N ATOM 0 H LYS A 113 -8.397 1.712 9.313 1.00 0.12 H new ATOM 0 HA LYS A 113 -7.460 -0.719 10.318 1.00 0.12 H new ATOM 0 HB2 LYS A 113 -9.697 1.014 10.467 1.00 0.15 H new ATOM 0 HB3 LYS A 113 -10.351 -0.510 9.901 1.00 0.15 H new ATOM 0 HG2 LYS A 113 -8.817 -0.026 12.465 1.00 0.28 H new ATOM 0 HG3 LYS A 113 -10.522 -0.395 12.305 1.00 0.28 H new ATOM 0 HD2 LYS A 113 -9.588 -2.452 12.907 1.00 0.54 H new ATOM 0 HD3 LYS A 113 -9.767 -2.591 11.169 1.00 0.54 H new ATOM 0 HE2 LYS A 113 -7.566 -3.414 11.868 1.00 1.63 H new ATOM 0 HE3 LYS A 113 -7.391 -2.000 10.848 1.00 1.63 H new ATOM 0 HZ1 LYS A 113 -6.051 -2.171 13.030 1.00 2.58 H new ATOM 0 HZ2 LYS A 113 -6.755 -0.683 12.613 1.00 2.58 H new ATOM 0 HZ3 LYS A 113 -7.491 -1.673 13.780 1.00 2.58 H new ATOM 402 N ALA A 114 -9.359 -0.847 7.650 1.00 0.11 N ATOM 403 CA ALA A 114 -9.840 -1.653 6.537 1.00 0.12 C ATOM 404 C ALA A 114 -8.689 -2.137 5.669 1.00 0.11 C ATOM 405 O ALA A 114 -8.658 -3.288 5.225 1.00 0.13 O ATOM 406 CB ALA A 114 -10.815 -0.831 5.714 1.00 0.15 C ATOM 0 H ALA A 114 -9.695 0.116 7.634 1.00 0.11 H new ATOM 0 HA ALA A 114 -10.345 -2.534 6.932 1.00 0.12 H new ATOM 0 HB1 ALA A 114 -11.180 -1.428 4.878 1.00 0.15 H new ATOM 0 HB2 ALA A 114 -11.656 -0.530 6.339 1.00 0.15 H new ATOM 0 HB3 ALA A 114 -10.311 0.057 5.333 1.00 0.15 H new ATOM 412 N LEU A 115 -7.742 -1.246 5.444 1.00 0.09 N ATOM 413 CA LEU A 115 -6.560 -1.565 4.670 1.00 0.09 C ATOM 414 C LEU A 115 -5.726 -2.587 5.438 1.00 0.08 C ATOM 415 O LEU A 115 -5.305 -3.607 4.887 1.00 0.09 O ATOM 416 CB LEU A 115 -5.770 -0.272 4.419 1.00 0.10 C ATOM 417 CG LEU A 115 -4.813 -0.282 3.226 1.00 0.11 C ATOM 418 CD1 LEU A 115 -4.232 1.102 3.003 1.00 0.16 C ATOM 419 CD2 LEU A 115 -3.698 -1.281 3.440 1.00 0.11 C ATOM 0 H LEU A 115 -7.771 -0.287 5.791 1.00 0.09 H new ATOM 0 HA LEU A 115 -6.830 -1.998 3.707 1.00 0.09 H new ATOM 0 HB2 LEU A 115 -6.482 0.542 4.280 1.00 0.10 H new ATOM 0 HB3 LEU A 115 -5.195 -0.043 5.316 1.00 0.10 H new ATOM 0 HG LEU A 115 -5.378 -0.577 2.341 1.00 0.11 H new ATOM 0 HD11 LEU A 115 -3.553 1.079 2.151 1.00 0.16 H new ATOM 0 HD12 LEU A 115 -5.039 1.808 2.805 1.00 0.16 H new ATOM 0 HD13 LEU A 115 -3.686 1.415 3.893 1.00 0.16 H new ATOM 0 HD21 LEU A 115 -3.030 -1.271 2.579 1.00 0.11 H new ATOM 0 HD22 LEU A 115 -3.138 -1.015 4.337 1.00 0.11 H new ATOM 0 HD23 LEU A 115 -4.121 -2.278 3.559 1.00 0.11 H new ATOM 431 N TYR A 116 -5.532 -2.324 6.723 1.00 0.08 N ATOM 432 CA TYR A 116 -4.843 -3.254 7.598 1.00 0.09 C ATOM 433 C TYR A 116 -5.562 -4.592 7.642 1.00 0.10 C ATOM 434 O TYR A 116 -4.938 -5.630 7.488 1.00 0.11 O ATOM 435 CB TYR A 116 -4.726 -2.677 9.012 1.00 0.10 C ATOM 436 CG TYR A 116 -4.228 -3.676 10.029 1.00 0.13 C ATOM 437 CD1 TYR A 116 -2.870 -3.921 10.188 1.00 0.19 C ATOM 438 CD2 TYR A 116 -5.117 -4.362 10.842 1.00 0.18 C ATOM 439 CE1 TYR A 116 -2.416 -4.824 11.127 1.00 0.24 C ATOM 440 CE2 TYR A 116 -4.671 -5.267 11.783 1.00 0.23 C ATOM 441 CZ TYR A 116 -3.307 -5.533 11.877 1.00 0.23 C ATOM 442 OH TYR A 116 -2.868 -6.392 12.860 1.00 0.30 O ATOM 0 H TYR A 116 -5.845 -1.469 7.182 1.00 0.08 H new ATOM 0 HA TYR A 116 -3.842 -3.412 7.197 1.00 0.09 H new ATOM 0 HB2 TYR A 116 -4.050 -1.822 8.993 1.00 0.10 H new ATOM 0 HB3 TYR A 116 -5.701 -2.305 9.326 1.00 0.10 H new ATOM 0 HD1 TYR A 116 -2.159 -3.397 9.567 1.00 0.19 H new ATOM 0 HD2 TYR A 116 -6.177 -4.185 10.737 1.00 0.18 H new ATOM 0 HE1 TYR A 116 -1.355 -4.969 11.268 1.00 0.24 H new ATOM 0 HE2 TYR A 116 -5.371 -5.763 12.439 1.00 0.23 H new ATOM 0 HH TYR A 116 -3.639 -6.813 13.295 1.00 0.30 H new ATOM 452 N ASP A 117 -6.877 -4.554 7.805 1.00 0.10 N ATOM 453 CA ASP A 117 -7.675 -5.767 7.945 1.00 0.12 C ATOM 454 C ASP A 117 -7.462 -6.701 6.763 1.00 0.12 C ATOM 455 O ASP A 117 -7.349 -7.916 6.927 1.00 0.15 O ATOM 456 CB ASP A 117 -9.157 -5.400 8.036 1.00 0.16 C ATOM 457 CG ASP A 117 -10.060 -6.616 8.063 1.00 0.27 C ATOM 458 OD1 ASP A 117 -10.177 -7.253 9.127 1.00 0.36 O ATOM 459 OD2 ASP A 117 -10.665 -6.936 7.013 1.00 0.40 O ATOM 0 H ASP A 117 -7.418 -3.690 7.844 1.00 0.10 H new ATOM 0 HA ASP A 117 -7.360 -6.279 8.854 1.00 0.12 H new ATOM 0 HB2 ASP A 117 -9.326 -4.807 8.935 1.00 0.16 H new ATOM 0 HB3 ASP A 117 -9.425 -4.773 7.186 1.00 0.16 H new ATOM 464 N THR A 118 -7.395 -6.123 5.582 1.00 0.11 N ATOM 465 CA THR A 118 -7.243 -6.901 4.373 1.00 0.11 C ATOM 466 C THR A 118 -5.796 -7.377 4.169 1.00 0.10 C ATOM 467 O THR A 118 -5.546 -8.573 4.006 1.00 0.12 O ATOM 468 CB THR A 118 -7.703 -6.072 3.162 1.00 0.13 C ATOM 469 OG1 THR A 118 -8.982 -5.481 3.445 1.00 0.22 O ATOM 470 CG2 THR A 118 -7.808 -6.941 1.922 1.00 0.17 C ATOM 0 H THR A 118 -7.444 -5.115 5.435 1.00 0.11 H new ATOM 0 HA THR A 118 -7.866 -7.790 4.470 1.00 0.11 H new ATOM 0 HB THR A 118 -6.966 -5.291 2.975 1.00 0.13 H new ATOM 0 HG1 THR A 118 -8.863 -4.717 4.047 1.00 0.22 H new ATOM 0 HG21 THR A 118 -8.135 -6.333 1.078 1.00 0.17 H new ATOM 0 HG22 THR A 118 -6.834 -7.377 1.699 1.00 0.17 H new ATOM 0 HG23 THR A 118 -8.531 -7.738 2.096 1.00 0.17 H new ATOM 478 N PHE A 119 -4.848 -6.444 4.196 1.00 0.08 N ATOM 479 CA PHE A 119 -3.450 -6.761 3.897 1.00 0.08 C ATOM 480 C PHE A 119 -2.779 -7.557 5.025 1.00 0.08 C ATOM 481 O PHE A 119 -1.870 -8.344 4.773 1.00 0.09 O ATOM 482 CB PHE A 119 -2.656 -5.496 3.538 1.00 0.08 C ATOM 483 CG PHE A 119 -3.088 -4.863 2.230 1.00 0.08 C ATOM 484 CD1 PHE A 119 -4.355 -4.297 2.075 1.00 0.10 C ATOM 485 CD2 PHE A 119 -2.227 -4.844 1.147 1.00 0.08 C ATOM 486 CE1 PHE A 119 -4.733 -3.735 0.872 1.00 0.11 C ATOM 487 CE2 PHE A 119 -2.604 -4.282 -0.054 1.00 0.10 C ATOM 488 CZ PHE A 119 -3.906 -3.673 -0.150 1.00 0.09 C ATOM 0 H PHE A 119 -5.019 -5.464 4.421 1.00 0.08 H new ATOM 0 HA PHE A 119 -3.449 -7.409 3.021 1.00 0.08 H new ATOM 0 HB2 PHE A 119 -2.768 -4.766 4.340 1.00 0.08 H new ATOM 0 HB3 PHE A 119 -1.597 -5.746 3.479 1.00 0.08 H new ATOM 0 HD1 PHE A 119 -5.046 -4.299 2.905 1.00 0.10 H new ATOM 0 HD2 PHE A 119 -1.242 -5.277 1.244 1.00 0.08 H new ATOM 0 HE1 PHE A 119 -5.731 -3.337 0.767 1.00 0.11 H new ATOM 0 HE2 PHE A 119 -1.938 -4.298 -0.904 1.00 0.10 H new ATOM 0 HZ PHE A 119 -4.202 -3.167 -1.057 1.00 0.09 H new ATOM 498 N SER A 120 -3.230 -7.359 6.265 1.00 0.09 N ATOM 499 CA SER A 120 -2.649 -8.048 7.424 1.00 0.09 C ATOM 500 C SER A 120 -2.735 -9.564 7.262 1.00 0.08 C ATOM 501 O SER A 120 -1.910 -10.301 7.803 1.00 0.09 O ATOM 502 CB SER A 120 -3.322 -7.606 8.733 1.00 0.13 C ATOM 503 OG SER A 120 -2.787 -8.296 9.850 1.00 0.19 O ATOM 0 H SER A 120 -3.997 -6.727 6.495 1.00 0.09 H new ATOM 0 HA SER A 120 -1.597 -7.769 7.476 1.00 0.09 H new ATOM 0 HB2 SER A 120 -3.188 -6.533 8.868 1.00 0.13 H new ATOM 0 HB3 SER A 120 -4.395 -7.788 8.671 1.00 0.13 H new ATOM 0 HG SER A 120 -2.806 -7.711 10.636 1.00 0.19 H new ATOM 509 N ALA A 121 -3.743 -10.027 6.529 1.00 0.09 N ATOM 510 CA ALA A 121 -3.899 -11.452 6.247 1.00 0.11 C ATOM 511 C ALA A 121 -2.652 -12.024 5.566 1.00 0.11 C ATOM 512 O ALA A 121 -2.397 -13.225 5.629 1.00 0.13 O ATOM 513 CB ALA A 121 -5.122 -11.684 5.373 1.00 0.14 C ATOM 0 H ALA A 121 -4.466 -9.436 6.118 1.00 0.09 H new ATOM 0 HA ALA A 121 -4.033 -11.969 7.197 1.00 0.11 H new ATOM 0 HB1 ALA A 121 -5.227 -12.750 5.170 1.00 0.14 H new ATOM 0 HB2 ALA A 121 -6.012 -11.323 5.889 1.00 0.14 H new ATOM 0 HB3 ALA A 121 -5.005 -11.145 4.433 1.00 0.14 H new ATOM 519 N PHE A 122 -1.874 -11.153 4.930 1.00 0.08 N ATOM 520 CA PHE A 122 -0.668 -11.569 4.222 1.00 0.09 C ATOM 521 C PHE A 122 0.554 -11.495 5.133 1.00 0.10 C ATOM 522 O PHE A 122 1.564 -12.157 4.889 1.00 0.18 O ATOM 523 CB PHE A 122 -0.461 -10.687 2.988 1.00 0.09 C ATOM 524 CG PHE A 122 -1.684 -10.616 2.124 1.00 0.09 C ATOM 525 CD1 PHE A 122 -2.189 -11.758 1.535 1.00 0.13 C ATOM 526 CD2 PHE A 122 -2.338 -9.414 1.924 1.00 0.10 C ATOM 527 CE1 PHE A 122 -3.329 -11.705 0.760 1.00 0.16 C ATOM 528 CE2 PHE A 122 -3.477 -9.351 1.147 1.00 0.12 C ATOM 529 CZ PHE A 122 -3.974 -10.500 0.564 1.00 0.13 C ATOM 0 H PHE A 122 -2.059 -10.151 4.891 1.00 0.08 H new ATOM 0 HA PHE A 122 -0.793 -12.605 3.907 1.00 0.09 H new ATOM 0 HB2 PHE A 122 -0.185 -9.681 3.306 1.00 0.09 H new ATOM 0 HB3 PHE A 122 0.372 -11.076 2.402 1.00 0.09 H new ATOM 0 HD1 PHE A 122 -1.686 -12.702 1.682 1.00 0.13 H new ATOM 0 HD2 PHE A 122 -1.953 -8.514 2.381 1.00 0.10 H new ATOM 0 HE1 PHE A 122 -3.717 -12.605 0.307 1.00 0.16 H new ATOM 0 HE2 PHE A 122 -3.978 -8.406 0.995 1.00 0.12 H new ATOM 0 HZ PHE A 122 -4.865 -10.456 -0.044 1.00 0.13 H new ATOM 539 N GLY A 123 0.453 -10.696 6.186 1.00 0.09 N ATOM 540 CA GLY A 123 1.549 -10.558 7.121 1.00 0.10 C ATOM 541 C GLY A 123 1.332 -9.416 8.092 1.00 0.09 C ATOM 542 O GLY A 123 0.448 -8.583 7.889 1.00 0.11 O ATOM 0 H GLY A 123 -0.372 -10.139 6.409 1.00 0.09 H new ATOM 0 HA2 GLY A 123 1.669 -11.488 7.677 1.00 0.10 H new ATOM 0 HA3 GLY A 123 2.475 -10.394 6.571 1.00 0.10 H new ATOM 546 N ASN A 124 2.128 -9.387 9.153 1.00 0.13 N ATOM 547 CA ASN A 124 2.058 -8.318 10.145 1.00 0.14 C ATOM 548 C ASN A 124 2.399 -6.976 9.510 1.00 0.11 C ATOM 549 O ASN A 124 3.368 -6.857 8.761 1.00 0.14 O ATOM 550 CB ASN A 124 3.016 -8.607 11.307 1.00 0.18 C ATOM 551 CG ASN A 124 2.997 -7.522 12.371 1.00 0.21 C ATOM 552 OD1 ASN A 124 1.979 -6.871 12.601 1.00 0.24 O ATOM 553 ND2 ASN A 124 4.120 -7.327 13.042 1.00 0.25 N ATOM 0 H ASN A 124 2.834 -10.096 9.351 1.00 0.13 H new ATOM 0 HA ASN A 124 1.039 -8.273 10.530 1.00 0.14 H new ATOM 0 HB2 ASN A 124 2.750 -9.561 11.763 1.00 0.18 H new ATOM 0 HB3 ASN A 124 4.029 -8.711 10.919 1.00 0.18 H new ATOM 0 HD21 ASN A 124 4.160 -6.619 13.775 1.00 0.25 H new ATOM 0 HD22 ASN A 124 4.946 -7.884 12.826 1.00 0.25 H new ATOM 560 N ILE A 125 1.591 -5.975 9.808 1.00 0.11 N ATOM 561 CA ILE A 125 1.790 -4.639 9.272 1.00 0.10 C ATOM 562 C ILE A 125 2.262 -3.696 10.372 1.00 0.11 C ATOM 563 O ILE A 125 1.641 -3.617 11.433 1.00 0.14 O ATOM 564 CB ILE A 125 0.484 -4.098 8.654 1.00 0.11 C ATOM 565 CG1 ILE A 125 0.017 -5.004 7.512 1.00 0.10 C ATOM 566 CG2 ILE A 125 0.671 -2.672 8.158 1.00 0.14 C ATOM 567 CD1 ILE A 125 -1.305 -4.582 6.904 1.00 0.11 C ATOM 0 H ILE A 125 0.783 -6.063 10.424 1.00 0.11 H new ATOM 0 HA ILE A 125 2.550 -4.696 8.493 1.00 0.10 H new ATOM 0 HB ILE A 125 -0.283 -4.092 9.429 1.00 0.11 H new ATOM 0 HG12 ILE A 125 0.779 -5.014 6.733 1.00 0.10 H new ATOM 0 HG13 ILE A 125 -0.073 -6.025 7.883 1.00 0.10 H new ATOM 0 HG21 ILE A 125 -0.263 -2.312 7.726 1.00 0.14 H new ATOM 0 HG22 ILE A 125 0.956 -2.031 8.992 1.00 0.14 H new ATOM 0 HG23 ILE A 125 1.454 -2.650 7.400 1.00 0.14 H new ATOM 0 HD11 ILE A 125 -1.572 -5.270 6.102 1.00 0.11 H new ATOM 0 HD12 ILE A 125 -2.080 -4.599 7.670 1.00 0.11 H new ATOM 0 HD13 ILE A 125 -1.215 -3.573 6.502 1.00 0.11 H new ATOM 579 N LEU A 126 3.350 -2.975 10.120 1.00 0.13 N ATOM 580 CA LEU A 126 3.895 -2.064 11.118 1.00 0.15 C ATOM 581 C LEU A 126 3.120 -0.759 11.061 1.00 0.16 C ATOM 582 O LEU A 126 2.825 -0.145 12.085 1.00 0.24 O ATOM 583 CB LEU A 126 5.391 -1.759 10.897 1.00 0.19 C ATOM 584 CG LEU A 126 6.351 -2.950 10.718 1.00 0.21 C ATOM 585 CD1 LEU A 126 5.813 -4.227 11.340 1.00 0.53 C ATOM 586 CD2 LEU A 126 6.684 -3.145 9.251 1.00 0.54 C ATOM 0 H LEU A 126 3.867 -3.004 9.241 1.00 0.13 H new ATOM 0 HA LEU A 126 3.799 -2.548 12.090 1.00 0.15 H new ATOM 0 HB2 LEU A 126 5.476 -1.125 10.014 1.00 0.19 H new ATOM 0 HB3 LEU A 126 5.741 -1.172 11.746 1.00 0.19 H new ATOM 0 HG LEU A 126 7.270 -2.712 11.253 1.00 0.21 H new ATOM 0 HD11 LEU A 126 6.527 -5.036 11.186 1.00 0.53 H new ATOM 0 HD12 LEU A 126 5.661 -4.075 12.409 1.00 0.53 H new ATOM 0 HD13 LEU A 126 4.864 -4.488 10.872 1.00 0.53 H new ATOM 0 HD21 LEU A 126 7.363 -3.990 9.141 1.00 0.54 H new ATOM 0 HD22 LEU A 126 5.768 -3.341 8.693 1.00 0.54 H new ATOM 0 HD23 LEU A 126 7.160 -2.244 8.863 1.00 0.54 H new ATOM 598 N SER A 127 2.790 -0.354 9.843 1.00 0.14 N ATOM 599 CA SER A 127 2.064 0.878 9.599 1.00 0.17 C ATOM 600 C SER A 127 1.273 0.782 8.298 1.00 0.19 C ATOM 601 O SER A 127 1.810 0.386 7.267 1.00 0.37 O ATOM 602 CB SER A 127 3.039 2.055 9.529 1.00 0.19 C ATOM 603 OG SER A 127 3.564 2.371 10.810 1.00 0.76 O ATOM 0 H SER A 127 3.020 -0.874 8.996 1.00 0.14 H new ATOM 0 HA SER A 127 1.367 1.039 10.421 1.00 0.17 H new ATOM 0 HB2 SER A 127 3.856 1.813 8.849 1.00 0.19 H new ATOM 0 HB3 SER A 127 2.530 2.927 9.118 1.00 0.19 H new ATOM 0 HG SER A 127 3.287 1.687 11.455 1.00 0.76 H new ATOM 609 N CYS A 128 -0.001 1.121 8.352 1.00 0.18 N ATOM 610 CA CYS A 128 -0.836 1.153 7.163 1.00 0.17 C ATOM 611 C CYS A 128 -1.510 2.511 7.058 1.00 0.16 C ATOM 612 O CYS A 128 -1.772 3.154 8.075 1.00 0.28 O ATOM 613 CB CYS A 128 -1.879 0.037 7.217 1.00 0.21 C ATOM 614 SG CYS A 128 -2.758 -0.060 8.793 1.00 0.72 S ATOM 0 H CYS A 128 -0.484 1.380 9.212 1.00 0.18 H new ATOM 0 HA CYS A 128 -0.216 0.994 6.281 1.00 0.17 H new ATOM 0 HB2 CYS A 128 -2.603 0.189 6.416 1.00 0.21 H new ATOM 0 HB3 CYS A 128 -1.388 -0.917 7.026 1.00 0.21 H new ATOM 0 HG CYS A 128 -4.040 -0.057 8.576 1.00 0.72 H new ATOM 620 N LYS A 129 -1.777 2.963 5.845 1.00 0.13 N ATOM 621 CA LYS A 129 -2.303 4.302 5.659 1.00 0.14 C ATOM 622 C LYS A 129 -3.181 4.408 4.417 1.00 0.12 C ATOM 623 O LYS A 129 -2.805 3.959 3.340 1.00 0.12 O ATOM 624 CB LYS A 129 -1.136 5.293 5.560 1.00 0.18 C ATOM 625 CG LYS A 129 -1.555 6.742 5.357 1.00 0.23 C ATOM 626 CD LYS A 129 -2.170 7.341 6.611 1.00 0.36 C ATOM 627 CE LYS A 129 -2.502 8.813 6.406 1.00 0.47 C ATOM 628 NZ LYS A 129 -3.038 9.440 7.641 1.00 1.00 N ATOM 0 H LYS A 129 -1.640 2.431 4.986 1.00 0.13 H new ATOM 0 HA LYS A 129 -2.930 4.540 6.519 1.00 0.14 H new ATOM 0 HB2 LYS A 129 -0.539 5.224 6.470 1.00 0.18 H new ATOM 0 HB3 LYS A 129 -0.492 4.995 4.733 1.00 0.18 H new ATOM 0 HG2 LYS A 129 -0.687 7.332 5.062 1.00 0.23 H new ATOM 0 HG3 LYS A 129 -2.273 6.800 4.539 1.00 0.23 H new ATOM 0 HD2 LYS A 129 -3.075 6.793 6.874 1.00 0.36 H new ATOM 0 HD3 LYS A 129 -1.478 7.233 7.447 1.00 0.36 H new ATOM 0 HE2 LYS A 129 -1.606 9.346 6.089 1.00 0.47 H new ATOM 0 HE3 LYS A 129 -3.233 8.911 5.603 1.00 0.47 H new ATOM 0 HZ1 LYS A 129 -3.251 10.441 7.458 1.00 1.00 H new ATOM 0 HZ2 LYS A 129 -3.908 8.949 7.931 1.00 1.00 H new ATOM 0 HZ3 LYS A 129 -2.331 9.370 8.401 1.00 1.00 H new ATOM 642 N VAL A 130 -4.349 5.004 4.601 1.00 0.15 N ATOM 643 CA VAL A 130 -5.209 5.427 3.512 1.00 0.17 C ATOM 644 C VAL A 130 -5.194 6.929 3.520 1.00 0.20 C ATOM 645 O VAL A 130 -5.701 7.557 4.451 1.00 0.24 O ATOM 646 CB VAL A 130 -6.679 4.959 3.647 1.00 0.21 C ATOM 647 CG1 VAL A 130 -7.545 5.584 2.544 1.00 0.28 C ATOM 648 CG2 VAL A 130 -6.775 3.438 3.606 1.00 0.21 C ATOM 0 H VAL A 130 -4.729 5.209 5.525 1.00 0.15 H new ATOM 0 HA VAL A 130 -4.831 4.983 2.591 1.00 0.17 H new ATOM 0 HB VAL A 130 -7.053 5.294 4.614 1.00 0.21 H new ATOM 0 HG11 VAL A 130 -8.575 5.244 2.654 1.00 0.28 H new ATOM 0 HG12 VAL A 130 -7.510 6.670 2.626 1.00 0.28 H new ATOM 0 HG13 VAL A 130 -7.165 5.281 1.568 1.00 0.28 H new ATOM 0 HG21 VAL A 130 -7.818 3.137 3.703 1.00 0.21 H new ATOM 0 HG22 VAL A 130 -6.378 3.074 2.658 1.00 0.21 H new ATOM 0 HG23 VAL A 130 -6.197 3.015 4.428 1.00 0.21 H new ATOM 658 N VAL A 131 -4.582 7.505 2.522 1.00 0.21 N ATOM 659 CA VAL A 131 -4.417 8.931 2.491 1.00 0.27 C ATOM 660 C VAL A 131 -5.701 9.568 1.995 1.00 0.33 C ATOM 661 O VAL A 131 -6.131 9.345 0.861 1.00 0.33 O ATOM 662 CB VAL A 131 -3.215 9.301 1.617 1.00 0.28 C ATOM 663 CG1 VAL A 131 -2.823 10.756 1.821 1.00 0.34 C ATOM 664 CG2 VAL A 131 -2.061 8.368 1.955 1.00 0.25 C ATOM 0 H VAL A 131 -4.190 7.010 1.721 1.00 0.21 H new ATOM 0 HA VAL A 131 -4.215 9.310 3.493 1.00 0.27 H new ATOM 0 HB VAL A 131 -3.477 9.185 0.565 1.00 0.28 H new ATOM 0 HG11 VAL A 131 -1.967 10.994 1.189 1.00 0.34 H new ATOM 0 HG12 VAL A 131 -3.661 11.400 1.554 1.00 0.34 H new ATOM 0 HG13 VAL A 131 -2.559 10.919 2.866 1.00 0.34 H new ATOM 0 HG21 VAL A 131 -1.197 8.620 1.340 1.00 0.25 H new ATOM 0 HG22 VAL A 131 -1.801 8.478 3.008 1.00 0.25 H new ATOM 0 HG23 VAL A 131 -2.357 7.337 1.760 1.00 0.25 H new ATOM 674 N CYS A 132 -6.323 10.335 2.866 1.00 0.43 N ATOM 675 CA CYS A 132 -7.648 10.854 2.612 1.00 0.55 C ATOM 676 C CYS A 132 -7.616 12.333 2.277 1.00 0.58 C ATOM 677 O CYS A 132 -6.771 13.084 2.771 1.00 0.66 O ATOM 678 CB CYS A 132 -8.545 10.608 3.827 1.00 0.75 C ATOM 679 SG CYS A 132 -8.786 8.860 4.220 1.00 1.58 S ATOM 0 H CYS A 132 -5.927 10.614 3.763 1.00 0.43 H new ATOM 0 HA CYS A 132 -8.054 10.328 1.748 1.00 0.55 H new ATOM 0 HB2 CYS A 132 -8.112 11.108 4.693 1.00 0.75 H new ATOM 0 HB3 CYS A 132 -9.517 11.067 3.647 1.00 0.75 H new ATOM 0 HG CYS A 132 -7.629 8.280 4.347 1.00 1.58 H new ATOM 685 N ASP A 133 -8.530 12.741 1.412 1.00 0.59 N ATOM 686 CA ASP A 133 -8.705 14.135 1.097 1.00 0.72 C ATOM 687 C ASP A 133 -9.624 14.743 2.138 1.00 0.93 C ATOM 688 O ASP A 133 -10.355 14.014 2.811 1.00 0.99 O ATOM 689 CB ASP A 133 -9.301 14.310 -0.309 1.00 0.70 C ATOM 690 CG ASP A 133 -9.438 15.765 -0.719 1.00 1.09 C ATOM 691 OD1 ASP A 133 -8.405 16.405 -0.999 1.00 1.20 O ATOM 692 OD2 ASP A 133 -10.577 16.276 -0.754 1.00 2.08 O ATOM 0 H ASP A 133 -9.164 12.114 0.916 1.00 0.59 H new ATOM 0 HA ASP A 133 -7.738 14.637 1.107 1.00 0.72 H new ATOM 0 HB2 ASP A 133 -8.670 13.793 -1.032 1.00 0.70 H new ATOM 0 HB3 ASP A 133 -10.281 13.835 -0.344 1.00 0.70 H new ATOM 697 N GLU A 134 -9.574 16.050 2.297 1.00 1.12 N ATOM 698 CA GLU A 134 -10.506 16.740 3.184 1.00 1.35 C ATOM 699 C GLU A 134 -11.953 16.414 2.795 1.00 1.36 C ATOM 700 O GLU A 134 -12.844 16.386 3.646 1.00 1.52 O ATOM 701 CB GLU A 134 -10.286 18.257 3.154 1.00 1.57 C ATOM 702 CG GLU A 134 -10.692 18.911 1.844 1.00 1.60 C ATOM 703 CD GLU A 134 -10.641 20.421 1.901 1.00 1.96 C ATOM 704 OE1 GLU A 134 -9.528 20.988 1.867 1.00 2.09 O ATOM 705 OE2 GLU A 134 -11.715 21.050 1.990 1.00 2.45 O ATOM 0 H GLU A 134 -8.903 16.659 1.829 1.00 1.12 H new ATOM 0 HA GLU A 134 -10.320 16.389 4.199 1.00 1.35 H new ATOM 0 HB2 GLU A 134 -10.851 18.713 3.967 1.00 1.57 H new ATOM 0 HB3 GLU A 134 -9.233 18.466 3.342 1.00 1.57 H new ATOM 0 HG2 GLU A 134 -10.034 18.560 1.049 1.00 1.60 H new ATOM 0 HG3 GLU A 134 -11.703 18.596 1.584 1.00 1.60 H new ATOM 712 N ASN A 135 -12.176 16.146 1.508 1.00 1.25 N ATOM 713 CA ASN A 135 -13.508 15.810 1.014 1.00 1.31 C ATOM 714 C ASN A 135 -13.742 14.304 1.032 1.00 1.25 C ATOM 715 O ASN A 135 -14.782 13.827 0.576 1.00 1.36 O ATOM 716 CB ASN A 135 -13.727 16.342 -0.408 1.00 1.32 C ATOM 717 CG ASN A 135 -13.763 17.856 -0.475 1.00 1.47 C ATOM 718 OD1 ASN A 135 -14.798 18.473 -0.213 1.00 1.65 O ATOM 719 ND2 ASN A 135 -12.653 18.462 -0.871 1.00 1.46 N ATOM 0 H ASN A 135 -11.451 16.156 0.791 1.00 1.25 H new ATOM 0 HA ASN A 135 -14.223 16.287 1.684 1.00 1.31 H new ATOM 0 HB2 ASN A 135 -12.930 15.974 -1.054 1.00 1.32 H new ATOM 0 HB3 ASN A 135 -14.664 15.944 -0.799 1.00 1.32 H new ATOM 0 HD21 ASN A 135 -12.633 19.477 -0.969 1.00 1.46 H new ATOM 0 HD22 ASN A 135 -11.818 17.913 -1.078 1.00 1.46 H new ATOM 726 N GLY A 136 -12.780 13.552 1.553 1.00 1.12 N ATOM 727 CA GLY A 136 -12.973 12.115 1.674 1.00 1.11 C ATOM 728 C GLY A 136 -11.700 11.286 1.577 1.00 0.89 C ATOM 729 O GLY A 136 -11.241 10.751 2.579 1.00 0.86 O ATOM 0 H GLY A 136 -11.883 13.902 1.890 1.00 1.12 H new ATOM 0 HA2 GLY A 136 -13.452 11.907 2.631 1.00 1.11 H new ATOM 0 HA3 GLY A 136 -13.662 11.789 0.895 1.00 1.11 H new ATOM 733 N SER A 137 -11.131 11.163 0.381 1.00 0.77 N ATOM 734 CA SER A 137 -10.038 10.218 0.142 1.00 0.57 C ATOM 735 C SER A 137 -9.184 10.672 -1.041 1.00 0.47 C ATOM 736 O SER A 137 -9.701 11.281 -1.977 1.00 0.53 O ATOM 737 CB SER A 137 -10.647 8.841 -0.121 1.00 0.67 C ATOM 738 OG SER A 137 -11.652 8.917 -1.119 1.00 1.61 O ATOM 0 H SER A 137 -11.406 11.704 -0.439 1.00 0.77 H new ATOM 0 HA SER A 137 -9.386 10.172 1.014 1.00 0.57 H new ATOM 0 HB2 SER A 137 -9.867 8.148 -0.436 1.00 0.67 H new ATOM 0 HB3 SER A 137 -11.073 8.445 0.801 1.00 0.67 H new ATOM 0 HG SER A 137 -11.915 8.012 -1.388 1.00 1.61 H new ATOM 744 N LYS A 138 -7.881 10.401 -0.996 1.00 0.38 N ATOM 745 CA LYS A 138 -6.993 10.811 -2.081 1.00 0.36 C ATOM 746 C LYS A 138 -6.835 9.706 -3.105 1.00 0.34 C ATOM 747 O LYS A 138 -6.349 9.932 -4.210 1.00 0.47 O ATOM 748 CB LYS A 138 -5.619 11.235 -1.560 1.00 0.36 C ATOM 749 CG LYS A 138 -5.664 12.389 -0.571 1.00 0.44 C ATOM 750 CD LYS A 138 -4.322 13.089 -0.448 1.00 0.67 C ATOM 751 CE LYS A 138 -3.985 13.855 -1.718 1.00 0.89 C ATOM 752 NZ LYS A 138 -2.652 14.500 -1.630 1.00 1.51 N ATOM 0 H LYS A 138 -7.422 9.906 -0.231 1.00 0.38 H new ATOM 0 HA LYS A 138 -7.457 11.673 -2.560 1.00 0.36 H new ATOM 0 HB2 LYS A 138 -5.142 10.379 -1.083 1.00 0.36 H new ATOM 0 HB3 LYS A 138 -4.992 11.518 -2.406 1.00 0.36 H new ATOM 0 HG2 LYS A 138 -6.420 13.108 -0.888 1.00 0.44 H new ATOM 0 HG3 LYS A 138 -5.969 12.016 0.407 1.00 0.44 H new ATOM 0 HD2 LYS A 138 -4.342 13.775 0.399 1.00 0.67 H new ATOM 0 HD3 LYS A 138 -3.543 12.355 -0.245 1.00 0.67 H new ATOM 0 HE2 LYS A 138 -4.005 13.175 -2.570 1.00 0.89 H new ATOM 0 HE3 LYS A 138 -4.746 14.614 -1.898 1.00 0.89 H new ATOM 0 HZ1 LYS A 138 -2.578 15.244 -2.353 1.00 1.51 H new ATOM 0 HZ2 LYS A 138 -2.531 14.920 -0.686 1.00 1.51 H new ATOM 0 HZ3 LYS A 138 -1.911 13.788 -1.789 1.00 1.51 H new ATOM 766 N GLY A 139 -7.237 8.513 -2.729 1.00 0.27 N ATOM 767 CA GLY A 139 -7.242 7.417 -3.675 1.00 0.26 C ATOM 768 C GLY A 139 -6.140 6.402 -3.449 1.00 0.21 C ATOM 769 O GLY A 139 -6.234 5.273 -3.919 1.00 0.31 O ATOM 0 H GLY A 139 -7.560 8.277 -1.791 1.00 0.27 H new ATOM 0 HA2 GLY A 139 -8.205 6.910 -3.622 1.00 0.26 H new ATOM 0 HA3 GLY A 139 -7.149 7.821 -4.683 1.00 0.26 H new ATOM 773 N TYR A 140 -5.098 6.783 -2.736 1.00 0.19 N ATOM 774 CA TYR A 140 -3.940 5.914 -2.597 1.00 0.15 C ATOM 775 C TYR A 140 -3.589 5.665 -1.138 1.00 0.13 C ATOM 776 O TYR A 140 -3.940 6.450 -0.254 1.00 0.16 O ATOM 777 CB TYR A 140 -2.739 6.490 -3.359 1.00 0.19 C ATOM 778 CG TYR A 140 -2.420 7.936 -3.042 1.00 0.23 C ATOM 779 CD1 TYR A 140 -3.083 8.972 -3.688 1.00 0.26 C ATOM 780 CD2 TYR A 140 -1.471 8.262 -2.078 1.00 0.31 C ATOM 781 CE1 TYR A 140 -2.807 10.291 -3.390 1.00 0.34 C ATOM 782 CE2 TYR A 140 -1.193 9.582 -1.772 1.00 0.39 C ATOM 783 CZ TYR A 140 -1.805 10.590 -2.485 1.00 0.41 C ATOM 784 OH TYR A 140 -1.589 11.907 -2.132 1.00 0.49 O ATOM 0 H TYR A 140 -5.026 7.676 -2.249 1.00 0.19 H new ATOM 0 HA TYR A 140 -4.199 4.950 -3.034 1.00 0.15 H new ATOM 0 HB2 TYR A 140 -1.861 5.882 -3.139 1.00 0.19 H new ATOM 0 HB3 TYR A 140 -2.928 6.400 -4.429 1.00 0.19 H new ATOM 0 HD1 TYR A 140 -3.827 8.741 -4.436 1.00 0.26 H new ATOM 0 HD2 TYR A 140 -0.944 7.473 -1.561 1.00 0.31 H new ATOM 0 HE1 TYR A 140 -3.370 11.084 -3.860 1.00 0.34 H new ATOM 0 HE2 TYR A 140 -0.500 9.821 -0.979 1.00 0.39 H new ATOM 0 HH TYR A 140 -0.853 11.956 -1.487 1.00 0.49 H new ATOM 794 N GLY A 141 -2.904 4.558 -0.901 1.00 0.11 N ATOM 795 CA GLY A 141 -2.517 4.178 0.439 1.00 0.11 C ATOM 796 C GLY A 141 -1.211 3.414 0.446 1.00 0.10 C ATOM 797 O GLY A 141 -0.696 3.066 -0.614 1.00 0.12 O ATOM 0 H GLY A 141 -2.605 3.907 -1.627 1.00 0.11 H new ATOM 0 HA2 GLY A 141 -2.420 5.070 1.057 1.00 0.11 H new ATOM 0 HA3 GLY A 141 -3.300 3.565 0.884 1.00 0.11 H new ATOM 801 N PHE A 142 -0.676 3.147 1.629 1.00 0.10 N ATOM 802 CA PHE A 142 0.619 2.484 1.750 1.00 0.10 C ATOM 803 C PHE A 142 0.587 1.431 2.857 1.00 0.10 C ATOM 804 O PHE A 142 -0.034 1.642 3.901 1.00 0.14 O ATOM 805 CB PHE A 142 1.720 3.506 2.062 1.00 0.12 C ATOM 806 CG PHE A 142 1.707 4.721 1.173 1.00 0.14 C ATOM 807 CD1 PHE A 142 2.107 4.632 -0.154 1.00 0.16 C ATOM 808 CD2 PHE A 142 1.292 5.948 1.661 1.00 0.21 C ATOM 809 CE1 PHE A 142 2.091 5.747 -0.971 1.00 0.19 C ATOM 810 CE2 PHE A 142 1.275 7.064 0.848 1.00 0.25 C ATOM 811 CZ PHE A 142 1.695 6.964 -0.469 1.00 0.22 C ATOM 0 H PHE A 142 -1.117 3.378 2.519 1.00 0.10 H new ATOM 0 HA PHE A 142 0.834 1.998 0.798 1.00 0.10 H new ATOM 0 HB2 PHE A 142 1.618 3.827 3.099 1.00 0.12 H new ATOM 0 HB3 PHE A 142 2.690 3.016 1.974 1.00 0.12 H new ATOM 0 HD1 PHE A 142 2.434 3.682 -0.551 1.00 0.16 H new ATOM 0 HD2 PHE A 142 0.978 6.034 2.691 1.00 0.21 H new ATOM 0 HE1 PHE A 142 2.390 5.662 -2.005 1.00 0.19 H new ATOM 0 HE2 PHE A 142 0.935 8.012 1.237 1.00 0.25 H new ATOM 0 HZ PHE A 142 1.711 7.841 -1.100 1.00 0.22 H new ATOM 821 N VAL A 143 1.237 0.293 2.624 1.00 0.08 N ATOM 822 CA VAL A 143 1.407 -0.716 3.669 1.00 0.08 C ATOM 823 C VAL A 143 2.870 -0.854 4.048 1.00 0.08 C ATOM 824 O VAL A 143 3.751 -0.872 3.185 1.00 0.09 O ATOM 825 CB VAL A 143 0.898 -2.113 3.245 1.00 0.08 C ATOM 826 CG1 VAL A 143 1.002 -3.117 4.397 1.00 0.07 C ATOM 827 CG2 VAL A 143 -0.527 -2.033 2.746 1.00 0.10 C ATOM 0 H VAL A 143 1.653 0.046 1.726 1.00 0.08 H new ATOM 0 HA VAL A 143 0.814 -0.368 4.514 1.00 0.08 H new ATOM 0 HB VAL A 143 1.534 -2.464 2.433 1.00 0.08 H new ATOM 0 HG11 VAL A 143 0.636 -4.089 4.066 1.00 0.07 H new ATOM 0 HG12 VAL A 143 2.043 -3.207 4.708 1.00 0.07 H new ATOM 0 HG13 VAL A 143 0.401 -2.770 5.237 1.00 0.07 H new ATOM 0 HG21 VAL A 143 -0.866 -3.027 2.453 1.00 0.10 H new ATOM 0 HG22 VAL A 143 -1.169 -1.650 3.539 1.00 0.10 H new ATOM 0 HG23 VAL A 143 -0.574 -1.365 1.886 1.00 0.10 H new ATOM 837 N HIS A 144 3.122 -0.922 5.337 1.00 0.09 N ATOM 838 CA HIS A 144 4.420 -1.309 5.838 1.00 0.10 C ATOM 839 C HIS A 144 4.339 -2.720 6.388 1.00 0.10 C ATOM 840 O HIS A 144 3.775 -2.936 7.458 1.00 0.11 O ATOM 841 CB HIS A 144 4.869 -0.351 6.938 1.00 0.12 C ATOM 842 CG HIS A 144 5.819 0.690 6.462 1.00 0.14 C ATOM 843 ND1 HIS A 144 6.739 1.300 7.284 1.00 0.18 N ATOM 844 CD2 HIS A 144 6.012 1.206 5.230 1.00 0.17 C ATOM 845 CE1 HIS A 144 7.459 2.146 6.583 1.00 0.21 C ATOM 846 NE2 HIS A 144 7.035 2.118 5.338 1.00 0.21 N ATOM 0 H HIS A 144 2.437 -0.712 6.062 1.00 0.09 H new ATOM 0 HA HIS A 144 5.146 -1.271 5.026 1.00 0.10 H new ATOM 0 HB2 HIS A 144 3.993 0.136 7.366 1.00 0.12 H new ATOM 0 HB3 HIS A 144 5.339 -0.923 7.738 1.00 0.12 H new ATOM 0 HD1 HIS A 144 6.845 1.123 8.283 1.00 0.18 H new ATOM 0 HD2 HIS A 144 5.468 0.952 4.332 1.00 0.17 H new ATOM 0 HE1 HIS A 144 8.262 2.760 6.964 1.00 0.21 H new ATOM 855 N PHE A 145 4.886 -3.676 5.665 1.00 0.10 N ATOM 856 CA PHE A 145 4.865 -5.055 6.114 1.00 0.10 C ATOM 857 C PHE A 145 6.090 -5.382 6.934 1.00 0.13 C ATOM 858 O PHE A 145 7.205 -4.990 6.595 1.00 0.17 O ATOM 859 CB PHE A 145 4.754 -6.027 4.942 1.00 0.10 C ATOM 860 CG PHE A 145 3.344 -6.309 4.522 1.00 0.09 C ATOM 861 CD1 PHE A 145 2.518 -7.089 5.307 1.00 0.10 C ATOM 862 CD2 PHE A 145 2.842 -5.777 3.346 1.00 0.09 C ATOM 863 CE1 PHE A 145 1.215 -7.338 4.929 1.00 0.11 C ATOM 864 CE2 PHE A 145 1.539 -6.022 2.963 1.00 0.10 C ATOM 865 CZ PHE A 145 0.743 -6.861 3.734 1.00 0.10 C ATOM 0 H PHE A 145 5.349 -3.526 4.768 1.00 0.10 H new ATOM 0 HA PHE A 145 3.981 -5.169 6.741 1.00 0.10 H new ATOM 0 HB2 PHE A 145 5.302 -5.621 4.092 1.00 0.10 H new ATOM 0 HB3 PHE A 145 5.237 -6.966 5.214 1.00 0.10 H new ATOM 0 HD1 PHE A 145 2.896 -7.509 6.227 1.00 0.10 H new ATOM 0 HD2 PHE A 145 3.476 -5.164 2.723 1.00 0.09 H new ATOM 0 HE1 PHE A 145 0.566 -7.910 5.576 1.00 0.11 H new ATOM 0 HE2 PHE A 145 1.140 -5.565 2.070 1.00 0.10 H new ATOM 0 HZ PHE A 145 -0.244 -7.136 3.393 1.00 0.10 H new ATOM 875 N GLU A 146 5.846 -6.090 8.025 1.00 0.13 N ATOM 876 CA GLU A 146 6.904 -6.545 8.932 1.00 0.17 C ATOM 877 C GLU A 146 8.027 -7.219 8.155 1.00 0.19 C ATOM 878 O GLU A 146 9.216 -7.013 8.421 1.00 0.22 O ATOM 879 CB GLU A 146 6.332 -7.541 9.942 1.00 0.22 C ATOM 880 CG GLU A 146 7.334 -8.002 10.983 1.00 0.30 C ATOM 881 CD GLU A 146 6.758 -9.053 11.900 1.00 0.37 C ATOM 882 OE1 GLU A 146 6.622 -10.212 11.463 1.00 0.57 O ATOM 883 OE2 GLU A 146 6.427 -8.724 13.057 1.00 0.38 O ATOM 0 H GLU A 146 4.908 -6.369 8.313 1.00 0.13 H new ATOM 0 HA GLU A 146 7.302 -5.674 9.453 1.00 0.17 H new ATOM 0 HB2 GLU A 146 5.482 -7.083 10.448 1.00 0.22 H new ATOM 0 HB3 GLU A 146 5.953 -8.411 9.406 1.00 0.22 H new ATOM 0 HG2 GLU A 146 8.217 -8.402 10.484 1.00 0.30 H new ATOM 0 HG3 GLU A 146 7.662 -7.147 11.574 1.00 0.30 H new ATOM 890 N THR A 147 7.624 -8.034 7.205 1.00 0.22 N ATOM 891 CA THR A 147 8.553 -8.749 6.358 1.00 0.26 C ATOM 892 C THR A 147 8.434 -8.301 4.907 1.00 0.23 C ATOM 893 O THR A 147 7.343 -7.987 4.424 1.00 0.21 O ATOM 894 CB THR A 147 8.328 -10.269 6.447 1.00 0.33 C ATOM 895 OG1 THR A 147 6.923 -10.563 6.411 1.00 0.40 O ATOM 896 CG2 THR A 147 8.935 -10.834 7.717 1.00 0.35 C ATOM 0 H THR A 147 6.643 -8.220 6.998 1.00 0.22 H new ATOM 0 HA THR A 147 9.556 -8.519 6.716 1.00 0.26 H new ATOM 0 HB THR A 147 8.818 -10.734 5.592 1.00 0.33 H new ATOM 0 HG1 THR A 147 6.790 -11.532 6.466 1.00 0.40 H new ATOM 0 HG21 THR A 147 8.762 -11.910 7.756 1.00 0.35 H new ATOM 0 HG22 THR A 147 10.007 -10.638 7.726 1.00 0.35 H new ATOM 0 HG23 THR A 147 8.472 -10.361 8.583 1.00 0.35 H new ATOM 904 N GLN A 148 9.567 -8.278 4.223 1.00 0.24 N ATOM 905 CA GLN A 148 9.631 -7.852 2.835 1.00 0.23 C ATOM 906 C GLN A 148 8.813 -8.785 1.938 1.00 0.21 C ATOM 907 O GLN A 148 8.163 -8.337 0.989 1.00 0.21 O ATOM 908 CB GLN A 148 11.100 -7.815 2.384 1.00 0.28 C ATOM 909 CG GLN A 148 11.326 -7.152 1.036 1.00 0.31 C ATOM 910 CD GLN A 148 10.688 -5.779 0.942 1.00 0.34 C ATOM 911 OE1 GLN A 148 11.292 -4.760 1.268 1.00 0.47 O ATOM 912 NE2 GLN A 148 9.443 -5.756 0.517 1.00 0.38 N ATOM 0 H GLN A 148 10.467 -8.554 4.615 1.00 0.24 H new ATOM 0 HA GLN A 148 9.202 -6.854 2.749 1.00 0.23 H new ATOM 0 HB2 GLN A 148 11.685 -7.288 3.137 1.00 0.28 H new ATOM 0 HB3 GLN A 148 11.480 -8.836 2.342 1.00 0.28 H new ATOM 0 HG2 GLN A 148 12.397 -7.063 0.855 1.00 0.31 H new ATOM 0 HG3 GLN A 148 10.922 -7.790 0.250 1.00 0.31 H new ATOM 0 HE21 GLN A 148 8.977 -6.625 0.256 1.00 0.38 H new ATOM 0 HE22 GLN A 148 8.944 -4.869 0.449 1.00 0.38 H new ATOM 921 N GLU A 149 8.836 -10.077 2.252 1.00 0.22 N ATOM 922 CA GLU A 149 8.137 -11.073 1.445 1.00 0.22 C ATOM 923 C GLU A 149 6.614 -10.937 1.568 1.00 0.18 C ATOM 924 O GLU A 149 5.890 -11.155 0.597 1.00 0.17 O ATOM 925 CB GLU A 149 8.588 -12.488 1.813 1.00 0.28 C ATOM 926 CG GLU A 149 8.007 -13.002 3.107 1.00 0.35 C ATOM 927 CD GLU A 149 8.304 -14.468 3.331 1.00 0.47 C ATOM 928 OE1 GLU A 149 7.731 -15.313 2.610 1.00 0.74 O ATOM 929 OE2 GLU A 149 9.110 -14.785 4.230 1.00 0.62 O ATOM 0 H GLU A 149 9.330 -10.459 3.058 1.00 0.22 H new ATOM 0 HA GLU A 149 8.399 -10.889 0.403 1.00 0.22 H new ATOM 0 HB2 GLU A 149 8.310 -13.167 1.007 1.00 0.28 H new ATOM 0 HB3 GLU A 149 9.676 -12.504 1.883 1.00 0.28 H new ATOM 0 HG2 GLU A 149 8.408 -12.422 3.938 1.00 0.35 H new ATOM 0 HG3 GLU A 149 6.928 -12.849 3.103 1.00 0.35 H new ATOM 936 N ALA A 150 6.131 -10.567 2.755 1.00 0.17 N ATOM 937 CA ALA A 150 4.693 -10.394 2.982 1.00 0.15 C ATOM 938 C ALA A 150 4.138 -9.298 2.083 1.00 0.13 C ATOM 939 O ALA A 150 3.005 -9.379 1.607 1.00 0.13 O ATOM 940 CB ALA A 150 4.420 -10.075 4.442 1.00 0.18 C ATOM 0 H ALA A 150 6.712 -10.381 3.573 1.00 0.17 H new ATOM 0 HA ALA A 150 4.190 -11.329 2.734 1.00 0.15 H new ATOM 0 HB1 ALA A 150 3.348 -9.950 4.593 1.00 0.18 H new ATOM 0 HB2 ALA A 150 4.781 -10.892 5.067 1.00 0.18 H new ATOM 0 HB3 ALA A 150 4.935 -9.154 4.716 1.00 0.18 H new ATOM 946 N ALA A 151 4.956 -8.283 1.846 1.00 0.13 N ATOM 947 CA ALA A 151 4.581 -7.183 0.971 1.00 0.13 C ATOM 948 C ALA A 151 4.392 -7.667 -0.457 1.00 0.12 C ATOM 949 O ALA A 151 3.439 -7.280 -1.131 1.00 0.13 O ATOM 950 CB ALA A 151 5.639 -6.103 1.025 1.00 0.16 C ATOM 0 H ALA A 151 5.889 -8.199 2.250 1.00 0.13 H new ATOM 0 HA ALA A 151 3.632 -6.772 1.316 1.00 0.13 H new ATOM 0 HB1 ALA A 151 5.354 -5.281 0.368 1.00 0.16 H new ATOM 0 HB2 ALA A 151 5.732 -5.735 2.047 1.00 0.16 H new ATOM 0 HB3 ALA A 151 6.595 -6.513 0.699 1.00 0.16 H new ATOM 956 N GLU A 152 5.304 -8.518 -0.910 1.00 0.13 N ATOM 957 CA GLU A 152 5.203 -9.107 -2.235 1.00 0.14 C ATOM 958 C GLU A 152 3.904 -9.897 -2.365 1.00 0.12 C ATOM 959 O GLU A 152 3.238 -9.834 -3.396 1.00 0.15 O ATOM 960 CB GLU A 152 6.404 -10.013 -2.511 1.00 0.18 C ATOM 961 CG GLU A 152 7.726 -9.266 -2.582 1.00 0.26 C ATOM 962 CD GLU A 152 8.893 -10.180 -2.898 1.00 0.75 C ATOM 963 OE1 GLU A 152 8.775 -10.997 -3.835 1.00 0.95 O ATOM 964 OE2 GLU A 152 9.940 -10.073 -2.225 1.00 1.42 O ATOM 0 H GLU A 152 6.122 -8.815 -0.377 1.00 0.13 H new ATOM 0 HA GLU A 152 5.199 -8.303 -2.971 1.00 0.14 H new ATOM 0 HB2 GLU A 152 6.465 -10.769 -1.729 1.00 0.18 H new ATOM 0 HB3 GLU A 152 6.243 -10.540 -3.452 1.00 0.18 H new ATOM 0 HG2 GLU A 152 7.660 -8.489 -3.344 1.00 0.26 H new ATOM 0 HG3 GLU A 152 7.908 -8.765 -1.631 1.00 0.26 H new ATOM 971 N ARG A 153 3.542 -10.614 -1.300 1.00 0.10 N ATOM 972 CA ARG A 153 2.298 -11.376 -1.270 1.00 0.12 C ATOM 973 C ARG A 153 1.093 -10.459 -1.445 1.00 0.11 C ATOM 974 O ARG A 153 0.136 -10.795 -2.142 1.00 0.16 O ATOM 975 CB ARG A 153 2.152 -12.138 0.044 1.00 0.16 C ATOM 976 CG ARG A 153 3.301 -13.080 0.351 1.00 0.21 C ATOM 977 CD ARG A 153 3.057 -13.815 1.655 1.00 0.26 C ATOM 978 NE ARG A 153 4.234 -14.548 2.114 1.00 0.38 N ATOM 979 CZ ARG A 153 4.236 -15.322 3.200 1.00 0.80 C ATOM 980 NH1 ARG A 153 3.109 -15.525 3.869 1.00 1.48 N ATOM 981 NH2 ARG A 153 5.355 -15.904 3.608 1.00 0.84 N ATOM 0 H ARG A 153 4.096 -10.681 -0.446 1.00 0.10 H new ATOM 0 HA ARG A 153 2.336 -12.086 -2.096 1.00 0.12 H new ATOM 0 HB2 ARG A 153 2.059 -11.420 0.859 1.00 0.16 H new ATOM 0 HB3 ARG A 153 1.225 -12.711 0.017 1.00 0.16 H new ATOM 0 HG2 ARG A 153 3.416 -13.798 -0.461 1.00 0.21 H new ATOM 0 HG3 ARG A 153 4.232 -12.517 0.414 1.00 0.21 H new ATOM 0 HD2 ARG A 153 2.757 -13.100 2.421 1.00 0.26 H new ATOM 0 HD3 ARG A 153 2.228 -14.510 1.526 1.00 0.26 H new ATOM 0 HE ARG A 153 5.097 -14.464 1.577 1.00 0.38 H new ATOM 0 HH11 ARG A 153 2.243 -15.089 3.553 1.00 1.48 H new ATOM 0 HH12 ARG A 153 3.109 -16.117 4.700 1.00 1.48 H new ATOM 0 HH21 ARG A 153 6.222 -15.761 3.090 1.00 0.84 H new ATOM 0 HH22 ARG A 153 5.349 -16.495 4.440 1.00 0.84 H new ATOM 995 N ALA A 154 1.140 -9.300 -0.802 1.00 0.09 N ATOM 996 CA ALA A 154 0.058 -8.335 -0.906 1.00 0.09 C ATOM 997 C ALA A 154 -0.031 -7.781 -2.323 1.00 0.09 C ATOM 998 O ALA A 154 -1.119 -7.540 -2.835 1.00 0.10 O ATOM 999 CB ALA A 154 0.242 -7.212 0.101 1.00 0.10 C ATOM 0 H ALA A 154 1.914 -9.007 -0.205 1.00 0.09 H new ATOM 0 HA ALA A 154 -0.879 -8.844 -0.679 1.00 0.09 H new ATOM 0 HB1 ALA A 154 -0.578 -6.501 0.007 1.00 0.10 H new ATOM 0 HB2 ALA A 154 0.250 -7.625 1.110 1.00 0.10 H new ATOM 0 HB3 ALA A 154 1.187 -6.703 -0.090 1.00 0.10 H new ATOM 1005 N ILE A 155 1.122 -7.598 -2.958 1.00 0.09 N ATOM 1006 CA ILE A 155 1.171 -7.104 -4.330 1.00 0.10 C ATOM 1007 C ILE A 155 0.485 -8.076 -5.286 1.00 0.11 C ATOM 1008 O ILE A 155 -0.437 -7.700 -6.006 1.00 0.14 O ATOM 1009 CB ILE A 155 2.626 -6.872 -4.791 1.00 0.11 C ATOM 1010 CG1 ILE A 155 3.278 -5.781 -3.941 1.00 0.12 C ATOM 1011 CG2 ILE A 155 2.676 -6.500 -6.268 1.00 0.14 C ATOM 1012 CD1 ILE A 155 4.734 -5.541 -4.269 1.00 0.15 C ATOM 0 H ILE A 155 2.036 -7.784 -2.544 1.00 0.09 H new ATOM 0 HA ILE A 155 0.641 -6.152 -4.348 1.00 0.10 H new ATOM 0 HB ILE A 155 3.182 -7.800 -4.659 1.00 0.11 H new ATOM 0 HG12 ILE A 155 2.727 -4.850 -4.076 1.00 0.12 H new ATOM 0 HG13 ILE A 155 3.192 -6.053 -2.889 1.00 0.12 H new ATOM 0 HG21 ILE A 155 3.712 -6.342 -6.568 1.00 0.14 H new ATOM 0 HG22 ILE A 155 2.245 -7.307 -6.861 1.00 0.14 H new ATOM 0 HG23 ILE A 155 2.107 -5.585 -6.432 1.00 0.14 H new ATOM 0 HD11 ILE A 155 5.127 -4.754 -3.625 1.00 0.15 H new ATOM 0 HD12 ILE A 155 5.300 -6.459 -4.107 1.00 0.15 H new ATOM 0 HD13 ILE A 155 4.827 -5.237 -5.312 1.00 0.15 H new ATOM 1024 N GLU A 156 0.915 -9.331 -5.261 1.00 0.11 N ATOM 1025 CA GLU A 156 0.355 -10.353 -6.142 1.00 0.13 C ATOM 1026 C GLU A 156 -1.132 -10.550 -5.899 1.00 0.12 C ATOM 1027 O GLU A 156 -1.922 -10.667 -6.838 1.00 0.15 O ATOM 1028 CB GLU A 156 1.070 -11.704 -5.975 1.00 0.17 C ATOM 1029 CG GLU A 156 1.529 -12.008 -4.559 1.00 0.21 C ATOM 1030 CD GLU A 156 1.931 -13.453 -4.361 1.00 0.62 C ATOM 1031 OE1 GLU A 156 1.037 -14.305 -4.195 1.00 1.08 O ATOM 1032 OE2 GLU A 156 3.145 -13.747 -4.357 1.00 0.63 O ATOM 0 H GLU A 156 1.651 -9.668 -4.640 1.00 0.11 H new ATOM 0 HA GLU A 156 0.507 -9.993 -7.159 1.00 0.13 H new ATOM 0 HB2 GLU A 156 0.399 -12.498 -6.303 1.00 0.17 H new ATOM 0 HB3 GLU A 156 1.937 -11.725 -6.636 1.00 0.17 H new ATOM 0 HG2 GLU A 156 2.374 -11.365 -4.312 1.00 0.21 H new ATOM 0 HG3 GLU A 156 0.727 -11.762 -3.863 1.00 0.21 H new ATOM 1039 N LYS A 157 -1.500 -10.591 -4.637 1.00 0.09 N ATOM 1040 CA LYS A 157 -2.839 -10.966 -4.249 1.00 0.10 C ATOM 1041 C LYS A 157 -3.834 -9.806 -4.331 1.00 0.08 C ATOM 1042 O LYS A 157 -4.972 -9.993 -4.762 1.00 0.10 O ATOM 1043 CB LYS A 157 -2.813 -11.533 -2.832 1.00 0.12 C ATOM 1044 CG LYS A 157 -3.575 -12.841 -2.699 1.00 0.17 C ATOM 1045 CD LYS A 157 -5.050 -12.685 -3.055 1.00 0.21 C ATOM 1046 CE LYS A 157 -5.898 -12.291 -1.849 1.00 0.29 C ATOM 1047 NZ LYS A 157 -7.355 -12.385 -2.132 1.00 1.16 N ATOM 0 H LYS A 157 -0.883 -10.367 -3.857 1.00 0.09 H new ATOM 0 HA LYS A 157 -3.183 -11.721 -4.957 1.00 0.10 H new ATOM 0 HB2 LYS A 157 -1.778 -11.690 -2.529 1.00 0.12 H new ATOM 0 HB3 LYS A 157 -3.238 -10.800 -2.146 1.00 0.12 H new ATOM 0 HG2 LYS A 157 -3.123 -13.591 -3.348 1.00 0.17 H new ATOM 0 HG3 LYS A 157 -3.486 -13.209 -1.677 1.00 0.17 H new ATOM 0 HD2 LYS A 157 -5.156 -11.929 -3.833 1.00 0.21 H new ATOM 0 HD3 LYS A 157 -5.423 -13.622 -3.468 1.00 0.21 H new ATOM 0 HE2 LYS A 157 -5.651 -12.937 -1.007 1.00 0.29 H new ATOM 0 HE3 LYS A 157 -5.652 -11.271 -1.552 1.00 0.29 H new ATOM 0 HZ1 LYS A 157 -7.892 -12.108 -1.285 1.00 1.16 H new ATOM 0 HZ2 LYS A 157 -7.598 -11.749 -2.919 1.00 1.16 H new ATOM 0 HZ3 LYS A 157 -7.596 -13.363 -2.390 1.00 1.16 H new ATOM 1061 N MET A 158 -3.410 -8.614 -3.950 1.00 0.07 N ATOM 1062 CA MET A 158 -4.335 -7.488 -3.838 1.00 0.08 C ATOM 1063 C MET A 158 -4.416 -6.665 -5.111 1.00 0.09 C ATOM 1064 O MET A 158 -5.421 -5.993 -5.347 1.00 0.13 O ATOM 1065 CB MET A 158 -3.966 -6.579 -2.665 1.00 0.09 C ATOM 1066 CG MET A 158 -4.154 -7.240 -1.316 1.00 0.10 C ATOM 1067 SD MET A 158 -5.836 -7.839 -1.076 1.00 0.35 S ATOM 1068 CE MET A 158 -6.763 -6.325 -1.303 1.00 0.18 C ATOM 0 H MET A 158 -2.442 -8.396 -3.714 1.00 0.07 H new ATOM 0 HA MET A 158 -5.317 -7.926 -3.661 1.00 0.08 H new ATOM 0 HB2 MET A 158 -2.927 -6.268 -2.768 1.00 0.09 H new ATOM 0 HB3 MET A 158 -4.575 -5.676 -2.708 1.00 0.09 H new ATOM 0 HG2 MET A 158 -3.457 -8.073 -1.222 1.00 0.10 H new ATOM 0 HG3 MET A 158 -3.908 -6.528 -0.528 1.00 0.10 H new ATOM 0 HE1 MET A 158 -7.805 -6.492 -1.030 1.00 0.18 H new ATOM 0 HE2 MET A 158 -6.343 -5.543 -0.671 1.00 0.18 H new ATOM 0 HE3 MET A 158 -6.707 -6.017 -2.347 1.00 0.18 H new ATOM 1078 N ASN A 159 -3.377 -6.700 -5.929 1.00 0.09 N ATOM 1079 CA ASN A 159 -3.378 -5.907 -7.147 1.00 0.10 C ATOM 1080 C ASN A 159 -4.433 -6.432 -8.117 1.00 0.13 C ATOM 1081 O ASN A 159 -4.428 -7.611 -8.473 1.00 0.16 O ATOM 1082 CB ASN A 159 -2.004 -5.928 -7.818 1.00 0.14 C ATOM 1083 CG ASN A 159 -1.945 -5.011 -9.028 1.00 0.16 C ATOM 1084 OD1 ASN A 159 -2.709 -4.051 -9.127 1.00 0.44 O ATOM 1085 ND2 ASN A 159 -1.017 -5.271 -9.935 1.00 0.38 N ATOM 0 H ASN A 159 -2.537 -7.258 -5.777 1.00 0.09 H new ATOM 0 HA ASN A 159 -3.615 -4.878 -6.878 1.00 0.10 H new ATOM 0 HB2 ASN A 159 -1.244 -5.626 -7.097 1.00 0.14 H new ATOM 0 HB3 ASN A 159 -1.766 -6.947 -8.124 1.00 0.14 H new ATOM 0 HD21 ASN A 159 -0.917 -4.666 -10.750 1.00 0.38 H new ATOM 0 HD22 ASN A 159 -0.402 -6.076 -9.819 1.00 0.38 H new ATOM 1092 N GLY A 160 -5.333 -5.552 -8.535 1.00 0.14 N ATOM 1093 CA GLY A 160 -6.366 -5.936 -9.476 1.00 0.19 C ATOM 1094 C GLY A 160 -7.621 -6.442 -8.790 1.00 0.22 C ATOM 1095 O GLY A 160 -8.511 -6.997 -9.439 1.00 0.29 O ATOM 0 H GLY A 160 -5.366 -4.577 -8.238 1.00 0.14 H new ATOM 0 HA2 GLY A 160 -6.618 -5.080 -10.102 1.00 0.19 H new ATOM 0 HA3 GLY A 160 -5.980 -6.712 -10.137 1.00 0.19 H new ATOM 1099 N MET A 161 -7.700 -6.256 -7.481 1.00 0.22 N ATOM 1100 CA MET A 161 -8.855 -6.692 -6.718 1.00 0.27 C ATOM 1101 C MET A 161 -9.832 -5.555 -6.479 1.00 0.24 C ATOM 1102 O MET A 161 -9.466 -4.385 -6.546 1.00 0.23 O ATOM 1103 CB MET A 161 -8.419 -7.247 -5.375 1.00 0.32 C ATOM 1104 CG MET A 161 -7.846 -8.656 -5.421 1.00 0.68 C ATOM 1105 SD MET A 161 -8.973 -9.865 -6.149 1.00 1.18 S ATOM 1106 CE MET A 161 -8.334 -9.980 -7.822 1.00 1.04 C ATOM 0 H MET A 161 -6.974 -5.804 -6.925 1.00 0.22 H new ATOM 0 HA MET A 161 -9.352 -7.466 -7.303 1.00 0.27 H new ATOM 0 HB2 MET A 161 -7.671 -6.580 -4.948 1.00 0.32 H new ATOM 0 HB3 MET A 161 -9.275 -7.240 -4.700 1.00 0.32 H new ATOM 0 HG2 MET A 161 -6.918 -8.645 -5.993 1.00 0.68 H new ATOM 0 HG3 MET A 161 -7.592 -8.970 -4.409 1.00 0.68 H new ATOM 0 HE1 MET A 161 -9.157 -9.899 -8.532 1.00 1.04 H new ATOM 0 HE2 MET A 161 -7.623 -9.172 -7.996 1.00 1.04 H new ATOM 0 HE3 MET A 161 -7.833 -10.939 -7.955 1.00 1.04 H new ATOM 1116 N LEU A 162 -11.071 -5.915 -6.178 1.00 0.26 N ATOM 1117 CA LEU A 162 -12.106 -4.947 -5.848 1.00 0.26 C ATOM 1118 C LEU A 162 -12.307 -4.934 -4.345 1.00 0.28 C ATOM 1119 O LEU A 162 -12.962 -5.817 -3.796 1.00 0.44 O ATOM 1120 CB LEU A 162 -13.437 -5.299 -6.523 1.00 0.31 C ATOM 1121 CG LEU A 162 -13.464 -5.217 -8.049 1.00 0.34 C ATOM 1122 CD1 LEU A 162 -14.777 -5.765 -8.571 1.00 0.42 C ATOM 1123 CD2 LEU A 162 -13.286 -3.784 -8.515 1.00 0.34 C ATOM 0 H LEU A 162 -11.387 -6.885 -6.156 1.00 0.26 H new ATOM 0 HA LEU A 162 -11.787 -3.968 -6.206 1.00 0.26 H new ATOM 0 HB2 LEU A 162 -13.712 -6.312 -6.230 1.00 0.31 H new ATOM 0 HB3 LEU A 162 -14.206 -4.634 -6.131 1.00 0.31 H new ATOM 0 HG LEU A 162 -12.640 -5.813 -8.440 1.00 0.34 H new ATOM 0 HD11 LEU A 162 -14.790 -5.704 -9.659 1.00 0.42 H new ATOM 0 HD12 LEU A 162 -14.884 -6.806 -8.265 1.00 0.42 H new ATOM 0 HD13 LEU A 162 -15.602 -5.180 -8.165 1.00 0.42 H new ATOM 0 HD21 LEU A 162 -13.309 -3.750 -9.604 1.00 0.34 H new ATOM 0 HD22 LEU A 162 -14.093 -3.169 -8.116 1.00 0.34 H new ATOM 0 HD23 LEU A 162 -12.329 -3.402 -8.160 1.00 0.34 H new ATOM 1135 N LEU A 163 -11.743 -3.944 -3.677 1.00 0.25 N ATOM 1136 CA LEU A 163 -11.801 -3.896 -2.219 1.00 0.33 C ATOM 1137 C LEU A 163 -13.148 -3.407 -1.690 1.00 0.45 C ATOM 1138 O LEU A 163 -13.269 -3.121 -0.502 1.00 1.02 O ATOM 1139 CB LEU A 163 -10.692 -3.000 -1.672 1.00 0.29 C ATOM 1140 CG LEU A 163 -9.576 -3.735 -0.937 1.00 0.31 C ATOM 1141 CD1 LEU A 163 -8.513 -2.757 -0.474 1.00 0.31 C ATOM 1142 CD2 LEU A 163 -10.145 -4.505 0.244 1.00 0.34 C ATOM 0 H LEU A 163 -11.243 -3.168 -4.111 1.00 0.25 H new ATOM 0 HA LEU A 163 -11.665 -4.921 -1.874 1.00 0.33 H new ATOM 0 HB2 LEU A 163 -10.255 -2.441 -2.500 1.00 0.29 H new ATOM 0 HB3 LEU A 163 -11.135 -2.271 -0.994 1.00 0.29 H new ATOM 0 HG LEU A 163 -9.113 -4.444 -1.623 1.00 0.31 H new ATOM 0 HD11 LEU A 163 -7.724 -3.298 0.049 1.00 0.31 H new ATOM 0 HD12 LEU A 163 -8.090 -2.243 -1.337 1.00 0.31 H new ATOM 0 HD13 LEU A 163 -8.960 -2.026 0.200 1.00 0.31 H new ATOM 0 HD21 LEU A 163 -9.339 -5.026 0.761 1.00 0.34 H new ATOM 0 HD22 LEU A 163 -10.629 -3.811 0.932 1.00 0.34 H new ATOM 0 HD23 LEU A 163 -10.876 -5.231 -0.113 1.00 0.34 H new ATOM 1154 N ASN A 164 -14.153 -3.361 -2.562 1.00 0.41 N ATOM 1155 CA ASN A 164 -15.470 -2.803 -2.244 1.00 0.42 C ATOM 1156 C ASN A 164 -16.259 -2.625 -3.518 1.00 0.45 C ATOM 1157 O ASN A 164 -17.335 -3.185 -3.697 1.00 0.72 O ATOM 1158 CB ASN A 164 -15.353 -1.451 -1.521 1.00 0.49 C ATOM 1159 CG ASN A 164 -15.659 -1.561 -0.038 1.00 1.06 C ATOM 1160 OD1 ASN A 164 -16.489 -2.368 0.380 1.00 1.71 O ATOM 1161 ND2 ASN A 164 -14.992 -0.750 0.766 1.00 1.07 N ATOM 0 H ASN A 164 -14.078 -3.712 -3.517 1.00 0.41 H new ATOM 0 HA ASN A 164 -15.980 -3.498 -1.577 1.00 0.42 H new ATOM 0 HB2 ASN A 164 -14.345 -1.057 -1.653 1.00 0.49 H new ATOM 0 HB3 ASN A 164 -16.037 -0.737 -1.979 1.00 0.49 H new ATOM 0 HD21 ASN A 164 -15.158 -0.780 1.772 1.00 1.07 H new ATOM 0 HD22 ASN A 164 -14.312 -0.095 0.380 1.00 1.07 H new ATOM 1168 N ASP A 165 -15.689 -1.828 -4.385 1.00 0.42 N ATOM 1169 CA ASP A 165 -16.222 -1.575 -5.714 1.00 0.44 C ATOM 1170 C ASP A 165 -15.186 -0.810 -6.541 1.00 0.43 C ATOM 1171 O ASP A 165 -15.506 -0.124 -7.508 1.00 0.65 O ATOM 1172 CB ASP A 165 -17.545 -0.798 -5.627 1.00 0.55 C ATOM 1173 CG ASP A 165 -18.217 -0.619 -6.976 1.00 0.71 C ATOM 1174 OD1 ASP A 165 -18.466 -1.633 -7.661 1.00 0.82 O ATOM 1175 OD2 ASP A 165 -18.499 0.535 -7.360 1.00 0.85 O ATOM 0 H ASP A 165 -14.824 -1.323 -4.190 1.00 0.42 H new ATOM 0 HA ASP A 165 -16.431 -2.525 -6.206 1.00 0.44 H new ATOM 0 HB2 ASP A 165 -18.225 -1.323 -4.955 1.00 0.55 H new ATOM 0 HB3 ASP A 165 -17.356 0.182 -5.188 1.00 0.55 H new ATOM 1180 N ARG A 166 -13.923 -0.965 -6.163 1.00 0.32 N ATOM 1181 CA ARG A 166 -12.826 -0.290 -6.831 1.00 0.27 C ATOM 1182 C ARG A 166 -11.648 -1.237 -6.946 1.00 0.24 C ATOM 1183 O ARG A 166 -11.231 -1.843 -5.954 1.00 0.24 O ATOM 1184 CB ARG A 166 -12.390 0.966 -6.072 1.00 0.24 C ATOM 1185 CG ARG A 166 -13.453 2.044 -5.976 1.00 0.27 C ATOM 1186 CD ARG A 166 -12.863 3.343 -5.455 1.00 0.27 C ATOM 1187 NE ARG A 166 -13.886 4.348 -5.177 1.00 0.42 N ATOM 1188 CZ ARG A 166 -13.882 5.574 -5.690 1.00 0.58 C ATOM 1189 NH1 ARG A 166 -12.926 5.941 -6.535 1.00 0.96 N ATOM 1190 NH2 ARG A 166 -14.831 6.438 -5.353 1.00 0.70 N ATOM 0 H ARG A 166 -13.635 -1.561 -5.387 1.00 0.32 H new ATOM 0 HA ARG A 166 -13.170 0.013 -7.820 1.00 0.27 H new ATOM 0 HB2 ARG A 166 -12.089 0.680 -5.064 1.00 0.24 H new ATOM 0 HB3 ARG A 166 -11.510 1.384 -6.561 1.00 0.24 H new ATOM 0 HG2 ARG A 166 -13.898 2.210 -6.957 1.00 0.27 H new ATOM 0 HG3 ARG A 166 -14.254 1.713 -5.315 1.00 0.27 H new ATOM 0 HD2 ARG A 166 -12.298 3.143 -4.545 1.00 0.27 H new ATOM 0 HD3 ARG A 166 -12.159 3.738 -6.187 1.00 0.27 H new ATOM 0 HE ARG A 166 -14.650 4.093 -4.551 1.00 0.42 H new ATOM 0 HH11 ARG A 166 -12.192 5.281 -6.792 1.00 0.96 H new ATOM 0 HH12 ARG A 166 -12.926 6.883 -6.927 1.00 0.96 H new ATOM 0 HH21 ARG A 166 -15.564 6.161 -4.700 1.00 0.70 H new ATOM 0 HH22 ARG A 166 -14.827 7.379 -5.747 1.00 0.70 H new ATOM 1204 N LYS A 167 -11.147 -1.384 -8.157 1.00 0.22 N ATOM 1205 CA LYS A 167 -9.990 -2.221 -8.418 1.00 0.20 C ATOM 1206 C LYS A 167 -8.735 -1.490 -7.974 1.00 0.17 C ATOM 1207 O LYS A 167 -8.389 -0.452 -8.536 1.00 0.22 O ATOM 1208 CB LYS A 167 -9.914 -2.540 -9.912 1.00 0.23 C ATOM 1209 CG LYS A 167 -9.781 -4.020 -10.225 1.00 0.40 C ATOM 1210 CD LYS A 167 -9.912 -4.276 -11.715 1.00 0.47 C ATOM 1211 CE LYS A 167 -10.031 -5.758 -12.021 1.00 0.53 C ATOM 1212 NZ LYS A 167 -10.153 -6.017 -13.480 1.00 1.00 N ATOM 0 H LYS A 167 -11.528 -0.929 -8.986 1.00 0.22 H new ATOM 0 HA LYS A 167 -10.077 -3.155 -7.863 1.00 0.20 H new ATOM 0 HB2 LYS A 167 -10.809 -2.156 -10.400 1.00 0.23 H new ATOM 0 HB3 LYS A 167 -9.064 -2.011 -10.343 1.00 0.23 H new ATOM 0 HG2 LYS A 167 -8.816 -4.384 -9.874 1.00 0.40 H new ATOM 0 HG3 LYS A 167 -10.547 -4.579 -9.688 1.00 0.40 H new ATOM 0 HD2 LYS A 167 -10.788 -3.754 -12.098 1.00 0.47 H new ATOM 0 HD3 LYS A 167 -9.045 -3.866 -12.232 1.00 0.47 H new ATOM 0 HE2 LYS A 167 -9.157 -6.280 -11.632 1.00 0.53 H new ATOM 0 HE3 LYS A 167 -10.901 -6.166 -11.506 1.00 0.53 H new ATOM 0 HZ1 LYS A 167 -10.232 -7.041 -13.645 1.00 1.00 H new ATOM 0 HZ2 LYS A 167 -11.001 -5.541 -13.847 1.00 1.00 H new ATOM 0 HZ3 LYS A 167 -9.311 -5.651 -13.969 1.00 1.00 H new ATOM 1226 N VAL A 168 -8.038 -2.032 -6.994 1.00 0.13 N ATOM 1227 CA VAL A 168 -6.898 -1.340 -6.428 1.00 0.12 C ATOM 1228 C VAL A 168 -5.604 -1.887 -6.988 1.00 0.11 C ATOM 1229 O VAL A 168 -5.482 -3.080 -7.275 1.00 0.13 O ATOM 1230 CB VAL A 168 -6.853 -1.429 -4.885 1.00 0.13 C ATOM 1231 CG1 VAL A 168 -7.946 -0.579 -4.259 1.00 0.17 C ATOM 1232 CG2 VAL A 168 -6.962 -2.873 -4.411 1.00 0.13 C ATOM 0 H VAL A 168 -8.239 -2.941 -6.577 1.00 0.13 H new ATOM 0 HA VAL A 168 -7.012 -0.292 -6.705 1.00 0.12 H new ATOM 0 HB VAL A 168 -5.888 -1.040 -4.561 1.00 0.13 H new ATOM 0 HG11 VAL A 168 -7.892 -0.659 -3.173 1.00 0.17 H new ATOM 0 HG12 VAL A 168 -7.811 0.462 -4.553 1.00 0.17 H new ATOM 0 HG13 VAL A 168 -8.920 -0.929 -4.601 1.00 0.17 H new ATOM 0 HG21 VAL A 168 -6.927 -2.902 -3.322 1.00 0.13 H new ATOM 0 HG22 VAL A 168 -7.904 -3.299 -4.756 1.00 0.13 H new ATOM 0 HG23 VAL A 168 -6.132 -3.452 -4.816 1.00 0.13 H new ATOM 1242 N PHE A 169 -4.647 -0.997 -7.161 1.00 0.11 N ATOM 1243 CA PHE A 169 -3.362 -1.359 -7.706 1.00 0.12 C ATOM 1244 C PHE A 169 -2.324 -1.363 -6.598 1.00 0.10 C ATOM 1245 O PHE A 169 -2.095 -0.344 -5.953 1.00 0.12 O ATOM 1246 CB PHE A 169 -2.975 -0.372 -8.813 1.00 0.18 C ATOM 1247 CG PHE A 169 -1.603 -0.591 -9.381 1.00 0.14 C ATOM 1248 CD1 PHE A 169 -1.400 -1.487 -10.415 1.00 0.25 C ATOM 1249 CD2 PHE A 169 -0.517 0.102 -8.876 1.00 0.18 C ATOM 1250 CE1 PHE A 169 -0.136 -1.689 -10.934 1.00 0.30 C ATOM 1251 CE2 PHE A 169 0.747 -0.096 -9.389 1.00 0.23 C ATOM 1252 CZ PHE A 169 0.940 -0.993 -10.419 1.00 0.26 C ATOM 0 H PHE A 169 -4.741 -0.008 -6.928 1.00 0.11 H new ATOM 0 HA PHE A 169 -3.412 -2.359 -8.138 1.00 0.12 H new ATOM 0 HB2 PHE A 169 -3.705 -0.443 -9.619 1.00 0.18 H new ATOM 0 HB3 PHE A 169 -3.035 0.642 -8.417 1.00 0.18 H new ATOM 0 HD1 PHE A 169 -2.238 -2.034 -10.821 1.00 0.25 H new ATOM 0 HD2 PHE A 169 -0.661 0.806 -8.070 1.00 0.18 H new ATOM 0 HE1 PHE A 169 0.011 -2.391 -11.742 1.00 0.30 H new ATOM 0 HE2 PHE A 169 1.586 0.451 -8.985 1.00 0.23 H new ATOM 0 HZ PHE A 169 1.930 -1.151 -10.822 1.00 0.26 H new ATOM 1262 N VAL A 170 -1.714 -2.511 -6.375 1.00 0.09 N ATOM 1263 CA VAL A 170 -0.674 -2.639 -5.367 1.00 0.10 C ATOM 1264 C VAL A 170 0.642 -2.963 -6.053 1.00 0.11 C ATOM 1265 O VAL A 170 0.725 -3.913 -6.833 1.00 0.13 O ATOM 1266 CB VAL A 170 -0.983 -3.747 -4.326 1.00 0.10 C ATOM 1267 CG1 VAL A 170 0.072 -3.775 -3.233 1.00 0.11 C ATOM 1268 CG2 VAL A 170 -2.364 -3.575 -3.716 1.00 0.09 C ATOM 0 H VAL A 170 -1.920 -3.373 -6.880 1.00 0.09 H new ATOM 0 HA VAL A 170 -0.620 -1.691 -4.832 1.00 0.10 H new ATOM 0 HB VAL A 170 -0.965 -4.700 -4.856 1.00 0.10 H new ATOM 0 HG11 VAL A 170 -0.168 -4.560 -2.516 1.00 0.11 H new ATOM 0 HG12 VAL A 170 1.049 -3.973 -3.675 1.00 0.11 H new ATOM 0 HG13 VAL A 170 0.093 -2.812 -2.723 1.00 0.11 H new ATOM 0 HG21 VAL A 170 -2.544 -4.370 -2.992 1.00 0.09 H new ATOM 0 HG22 VAL A 170 -2.423 -2.608 -3.216 1.00 0.09 H new ATOM 0 HG23 VAL A 170 -3.118 -3.623 -4.502 1.00 0.09 H new ATOM 1278 N GLY A 171 1.656 -2.163 -5.783 1.00 0.12 N ATOM 1279 CA GLY A 171 2.940 -2.369 -6.412 1.00 0.14 C ATOM 1280 C GLY A 171 4.092 -2.026 -5.496 1.00 0.14 C ATOM 1281 O GLY A 171 3.884 -1.648 -4.340 1.00 0.18 O ATOM 0 H GLY A 171 1.614 -1.373 -5.139 1.00 0.12 H new ATOM 0 HA2 GLY A 171 3.026 -3.410 -6.725 1.00 0.14 H new ATOM 0 HA3 GLY A 171 3.002 -1.759 -7.313 1.00 0.14 H new ATOM 1285 N ARG A 172 5.307 -2.167 -6.013 1.00 0.18 N ATOM 1286 CA ARG A 172 6.514 -1.861 -5.256 1.00 0.19 C ATOM 1287 C ARG A 172 6.545 -0.400 -4.827 1.00 0.22 C ATOM 1288 O ARG A 172 6.393 0.502 -5.648 1.00 0.36 O ATOM 1289 CB ARG A 172 7.761 -2.147 -6.096 1.00 0.23 C ATOM 1290 CG ARG A 172 8.035 -3.618 -6.357 1.00 0.32 C ATOM 1291 CD ARG A 172 8.413 -4.358 -5.085 1.00 0.39 C ATOM 1292 NE ARG A 172 9.234 -5.532 -5.369 1.00 1.03 N ATOM 1293 CZ ARG A 172 8.749 -6.746 -5.625 1.00 1.26 C ATOM 1294 NH1 ARG A 172 7.440 -6.957 -5.631 1.00 1.34 N ATOM 1295 NH2 ARG A 172 9.580 -7.745 -5.889 1.00 1.93 N ATOM 0 H ARG A 172 5.482 -2.495 -6.963 1.00 0.18 H new ATOM 0 HA ARG A 172 6.506 -2.495 -4.369 1.00 0.19 H new ATOM 0 HB2 ARG A 172 7.661 -1.636 -7.054 1.00 0.23 H new ATOM 0 HB3 ARG A 172 8.626 -1.715 -5.593 1.00 0.23 H new ATOM 0 HG2 ARG A 172 7.151 -4.080 -6.796 1.00 0.32 H new ATOM 0 HG3 ARG A 172 8.840 -3.714 -7.086 1.00 0.32 H new ATOM 0 HD2 ARG A 172 8.956 -3.686 -4.420 1.00 0.39 H new ATOM 0 HD3 ARG A 172 7.509 -4.664 -4.559 1.00 0.39 H new ATOM 0 HE ARG A 172 10.247 -5.414 -5.371 1.00 1.03 H new ATOM 0 HH11 ARG A 172 6.799 -6.188 -5.439 1.00 1.34 H new ATOM 0 HH12 ARG A 172 7.075 -7.889 -5.828 1.00 1.34 H new ATOM 0 HH21 ARG A 172 10.587 -7.583 -5.896 1.00 1.93 H new ATOM 0 HH22 ARG A 172 9.212 -8.676 -6.085 1.00 1.93 H new ATOM 1309 N PHE A 173 6.737 -0.171 -3.537 1.00 0.23 N ATOM 1310 CA PHE A 173 6.991 1.172 -3.042 1.00 0.29 C ATOM 1311 C PHE A 173 8.438 1.506 -3.362 1.00 0.80 C ATOM 1312 O PHE A 173 9.335 0.766 -2.966 1.00 1.44 O ATOM 1313 CB PHE A 173 6.748 1.238 -1.531 1.00 0.48 C ATOM 1314 CG PHE A 173 6.681 2.624 -0.953 1.00 0.42 C ATOM 1315 CD1 PHE A 173 7.823 3.396 -0.808 1.00 0.72 C ATOM 1316 CD2 PHE A 173 5.468 3.146 -0.537 1.00 0.35 C ATOM 1317 CE1 PHE A 173 7.754 4.663 -0.264 1.00 0.71 C ATOM 1318 CE2 PHE A 173 5.393 4.410 0.009 1.00 0.37 C ATOM 1319 CZ PHE A 173 6.536 5.171 0.146 1.00 0.42 C ATOM 0 H PHE A 173 6.722 -0.894 -2.818 1.00 0.23 H new ATOM 0 HA PHE A 173 6.319 1.889 -3.514 1.00 0.29 H new ATOM 0 HB2 PHE A 173 5.814 0.723 -1.307 1.00 0.48 H new ATOM 0 HB3 PHE A 173 7.544 0.690 -1.027 1.00 0.48 H new ATOM 0 HD1 PHE A 173 8.778 3.002 -1.124 1.00 0.72 H new ATOM 0 HD2 PHE A 173 4.569 2.556 -0.641 1.00 0.35 H new ATOM 0 HE1 PHE A 173 8.650 5.256 -0.159 1.00 0.71 H new ATOM 0 HE2 PHE A 173 4.440 4.804 0.329 1.00 0.37 H new ATOM 0 HZ PHE A 173 6.479 6.161 0.573 1.00 0.42 H new ATOM 1329 N LYS A 174 8.669 2.583 -4.088 1.00 1.17 N ATOM 1330 CA LYS A 174 10.010 2.888 -4.562 1.00 1.67 C ATOM 1331 C LYS A 174 10.921 3.261 -3.400 1.00 1.86 C ATOM 1332 O LYS A 174 11.801 2.489 -3.021 1.00 2.43 O ATOM 1333 CB LYS A 174 9.969 4.021 -5.589 1.00 2.20 C ATOM 1334 CG LYS A 174 8.965 3.789 -6.710 1.00 2.69 C ATOM 1335 CD LYS A 174 8.974 4.936 -7.705 1.00 3.30 C ATOM 1336 CE LYS A 174 7.833 4.830 -8.708 1.00 4.16 C ATOM 1337 NZ LYS A 174 6.506 4.979 -8.055 1.00 4.66 N ATOM 0 H LYS A 174 7.954 3.257 -4.362 1.00 1.17 H new ATOM 0 HA LYS A 174 10.413 1.996 -5.042 1.00 1.67 H new ATOM 0 HB2 LYS A 174 9.724 4.953 -5.080 1.00 2.20 H new ATOM 0 HB3 LYS A 174 10.962 4.145 -6.021 1.00 2.20 H new ATOM 0 HG2 LYS A 174 9.200 2.857 -7.224 1.00 2.69 H new ATOM 0 HG3 LYS A 174 7.966 3.678 -6.289 1.00 2.69 H new ATOM 0 HD2 LYS A 174 8.898 5.882 -7.169 1.00 3.30 H new ATOM 0 HD3 LYS A 174 9.925 4.947 -8.237 1.00 3.30 H new ATOM 0 HE2 LYS A 174 7.950 5.598 -9.473 1.00 4.16 H new ATOM 0 HE3 LYS A 174 7.883 3.866 -9.214 1.00 4.16 H new ATOM 0 HZ1 LYS A 174 5.783 5.172 -8.777 1.00 4.66 H new ATOM 0 HZ2 LYS A 174 6.266 4.101 -7.552 1.00 4.66 H new ATOM 0 HZ3 LYS A 174 6.539 5.768 -7.378 1.00 4.66 H new ATOM 1351 N SER A 175 10.676 4.429 -2.824 1.00 2.06 N ATOM 1352 CA SER A 175 11.507 4.966 -1.759 1.00 2.52 C ATOM 1353 C SER A 175 11.000 6.362 -1.413 1.00 2.93 C ATOM 1354 O SER A 175 9.842 6.689 -1.688 1.00 3.60 O ATOM 1355 CB SER A 175 12.977 5.020 -2.217 1.00 3.15 C ATOM 1356 OG SER A 175 13.853 5.398 -1.166 1.00 3.52 O ATOM 0 H SER A 175 9.894 5.031 -3.083 1.00 2.06 H new ATOM 0 HA SER A 175 11.452 4.328 -0.877 1.00 2.52 H new ATOM 0 HB2 SER A 175 13.272 4.043 -2.600 1.00 3.15 H new ATOM 0 HB3 SER A 175 13.073 5.728 -3.040 1.00 3.15 H new ATOM 0 HG SER A 175 14.774 5.418 -1.499 1.00 3.52 H new ATOM 1362 N ARG A 176 11.855 7.178 -0.813 1.00 3.11 N ATOM 1363 CA ARG A 176 11.532 8.579 -0.576 1.00 3.87 C ATOM 1364 C ARG A 176 11.540 9.314 -1.912 1.00 4.29 C ATOM 1365 O ARG A 176 10.877 10.338 -2.092 1.00 4.77 O ATOM 1366 CB ARG A 176 12.534 9.227 0.389 1.00 4.45 C ATOM 1367 CG ARG A 176 12.604 8.572 1.765 1.00 4.94 C ATOM 1368 CD ARG A 176 13.501 7.343 1.770 1.00 5.64 C ATOM 1369 NE ARG A 176 14.874 7.668 1.381 1.00 6.15 N ATOM 1370 CZ ARG A 176 15.867 6.780 1.334 1.00 6.90 C ATOM 1371 NH1 ARG A 176 15.659 5.518 1.686 1.00 7.24 N ATOM 1372 NH2 ARG A 176 17.076 7.154 0.935 1.00 7.60 N ATOM 0 H ARG A 176 12.777 6.895 -0.481 1.00 3.11 H new ATOM 0 HA ARG A 176 10.546 8.643 -0.116 1.00 3.87 H new ATOM 0 HB2 ARG A 176 13.525 9.198 -0.064 1.00 4.45 H new ATOM 0 HB3 ARG A 176 12.271 10.277 0.514 1.00 4.45 H new ATOM 0 HG2 ARG A 176 12.976 9.295 2.491 1.00 4.94 H new ATOM 0 HG3 ARG A 176 11.600 8.289 2.083 1.00 4.94 H new ATOM 0 HD2 ARG A 176 13.501 6.898 2.765 1.00 5.64 H new ATOM 0 HD3 ARG A 176 13.097 6.596 1.087 1.00 5.64 H new ATOM 0 HE ARG A 176 15.084 8.634 1.130 1.00 6.15 H new ATOM 0 HH11 ARG A 176 14.734 5.221 1.996 1.00 7.24 H new ATOM 0 HH12 ARG A 176 16.424 4.845 1.647 1.00 7.24 H new ATOM 0 HH21 ARG A 176 17.247 8.122 0.664 1.00 7.60 H new ATOM 0 HH22 ARG A 176 17.835 6.473 0.900 1.00 7.60 H new ATOM 1386 N LYS A 177 12.301 8.757 -2.842 1.00 4.61 N ATOM 1387 CA LYS A 177 12.371 9.241 -4.206 1.00 5.47 C ATOM 1388 C LYS A 177 12.510 8.022 -5.114 1.00 6.20 C ATOM 1389 O LYS A 177 12.956 6.971 -4.651 1.00 6.81 O ATOM 1390 CB LYS A 177 13.570 10.194 -4.355 1.00 5.99 C ATOM 1391 CG LYS A 177 13.486 11.150 -5.541 1.00 6.65 C ATOM 1392 CD LYS A 177 14.002 10.527 -6.830 1.00 7.44 C ATOM 1393 CE LYS A 177 13.890 11.493 -8.002 1.00 7.99 C ATOM 1394 NZ LYS A 177 14.717 12.715 -7.807 1.00 8.61 N ATOM 0 H LYS A 177 12.894 7.946 -2.665 1.00 4.61 H new ATOM 0 HA LYS A 177 11.476 9.800 -4.478 1.00 5.47 H new ATOM 0 HB2 LYS A 177 13.666 10.780 -3.441 1.00 5.99 H new ATOM 0 HB3 LYS A 177 14.479 9.600 -4.450 1.00 5.99 H new ATOM 0 HG2 LYS A 177 12.451 11.460 -5.681 1.00 6.65 H new ATOM 0 HG3 LYS A 177 14.061 12.049 -5.320 1.00 6.65 H new ATOM 0 HD2 LYS A 177 15.043 10.230 -6.700 1.00 7.44 H new ATOM 0 HD3 LYS A 177 13.437 9.621 -7.049 1.00 7.44 H new ATOM 0 HE2 LYS A 177 14.201 10.989 -8.917 1.00 7.99 H new ATOM 0 HE3 LYS A 177 12.847 11.780 -8.135 1.00 7.99 H new ATOM 0 HZ1 LYS A 177 14.759 13.251 -8.697 1.00 8.61 H new ATOM 0 HZ2 LYS A 177 14.292 13.307 -7.065 1.00 8.61 H new ATOM 0 HZ3 LYS A 177 15.679 12.441 -7.522 1.00 8.61 H new ATOM 1408 N GLU A 178 12.105 8.132 -6.374 1.00 6.45 N ATOM 1409 CA GLU A 178 12.203 7.001 -7.298 1.00 7.43 C ATOM 1410 C GLU A 178 13.668 6.645 -7.564 1.00 7.96 C ATOM 1411 O GLU A 178 14.314 7.214 -8.443 1.00 8.13 O ATOM 1412 CB GLU A 178 11.466 7.284 -8.617 1.00 7.79 C ATOM 1413 CG GLU A 178 11.658 6.197 -9.667 1.00 8.26 C ATOM 1414 CD GLU A 178 10.854 6.445 -10.924 1.00 8.30 C ATOM 1415 OE1 GLU A 178 11.072 7.487 -11.578 1.00 8.32 O ATOM 1416 OE2 GLU A 178 10.002 5.598 -11.270 1.00 8.55 O ATOM 0 H GLU A 178 11.710 8.981 -6.779 1.00 6.45 H new ATOM 0 HA GLU A 178 11.719 6.147 -6.825 1.00 7.43 H new ATOM 0 HB2 GLU A 178 10.401 7.396 -8.412 1.00 7.79 H new ATOM 0 HB3 GLU A 178 11.814 8.234 -9.022 1.00 7.79 H new ATOM 0 HG2 GLU A 178 12.715 6.131 -9.925 1.00 8.26 H new ATOM 0 HG3 GLU A 178 11.372 5.234 -9.243 1.00 8.26 H new ATOM 1423 N ARG A 179 14.192 5.733 -6.756 1.00 8.49 N ATOM 1424 CA ARG A 179 15.560 5.263 -6.897 1.00 9.26 C ATOM 1425 C ARG A 179 15.617 3.742 -6.855 1.00 10.11 C ATOM 1426 O ARG A 179 16.694 3.153 -6.888 1.00 10.52 O ATOM 1427 CB ARG A 179 16.417 5.816 -5.764 1.00 9.63 C ATOM 1428 CG ARG A 179 16.661 7.312 -5.828 1.00 10.21 C ATOM 1429 CD ARG A 179 17.522 7.767 -4.663 1.00 10.71 C ATOM 1430 NE ARG A 179 18.760 6.993 -4.574 1.00 11.04 N ATOM 1431 CZ ARG A 179 19.305 6.582 -3.429 1.00 11.73 C ATOM 1432 NH1 ARG A 179 18.739 6.889 -2.267 1.00 12.15 N ATOM 1433 NH2 ARG A 179 20.411 5.851 -3.449 1.00 12.18 N ATOM 0 H ARG A 179 13.681 5.300 -5.987 1.00 8.49 H new ATOM 0 HA ARG A 179 15.939 5.610 -7.859 1.00 9.26 H new ATOM 0 HB2 ARG A 179 15.937 5.580 -4.814 1.00 9.63 H new ATOM 0 HB3 ARG A 179 17.379 5.304 -5.771 1.00 9.63 H new ATOM 0 HG2 ARG A 179 17.150 7.566 -6.769 1.00 10.21 H new ATOM 0 HG3 ARG A 179 15.708 7.842 -5.811 1.00 10.21 H new ATOM 0 HD2 ARG A 179 17.761 8.824 -4.777 1.00 10.71 H new ATOM 0 HD3 ARG A 179 16.961 7.666 -3.734 1.00 10.71 H new ATOM 0 HE ARG A 179 19.236 6.753 -5.443 1.00 11.04 H new ATOM 0 HH11 ARG A 179 17.882 7.442 -2.247 1.00 12.15 H new ATOM 0 HH12 ARG A 179 19.161 6.571 -1.394 1.00 12.15 H new ATOM 0 HH21 ARG A 179 20.843 5.604 -4.339 1.00 12.18 H new ATOM 0 HH22 ARG A 179 20.830 5.535 -2.574 1.00 12.18 H new ATOM 1447 N GLU A 180 14.457 3.106 -6.776 1.00 10.55 N ATOM 1448 CA GLU A 180 14.397 1.662 -6.585 1.00 11.52 C ATOM 1449 C GLU A 180 13.394 1.038 -7.558 1.00 12.20 C ATOM 1450 O GLU A 180 12.901 -0.074 -7.352 1.00 12.70 O ATOM 1451 CB GLU A 180 14.017 1.352 -5.132 1.00 11.80 C ATOM 1452 CG GLU A 180 14.292 -0.083 -4.710 1.00 12.14 C ATOM 1453 CD GLU A 180 15.746 -0.471 -4.877 1.00 12.44 C ATOM 1454 OE1 GLU A 180 16.579 -0.058 -4.046 1.00 12.62 O ATOM 1455 OE2 GLU A 180 16.065 -1.190 -5.845 1.00 12.64 O ATOM 0 H GLU A 180 13.548 3.564 -6.841 1.00 10.55 H new ATOM 0 HA GLU A 180 15.376 1.230 -6.790 1.00 11.52 H new ATOM 0 HB2 GLU A 180 14.566 2.025 -4.473 1.00 11.80 H new ATOM 0 HB3 GLU A 180 12.957 1.564 -4.992 1.00 11.80 H new ATOM 0 HG2 GLU A 180 14.003 -0.213 -3.667 1.00 12.14 H new ATOM 0 HG3 GLU A 180 13.670 -0.757 -5.300 1.00 12.14 H new ATOM 1462 N ALA A 181 13.110 1.755 -8.632 1.00 12.41 N ATOM 1463 CA ALA A 181 12.202 1.265 -9.651 1.00 13.20 C ATOM 1464 C ALA A 181 12.969 0.962 -10.931 1.00 13.42 C ATOM 1465 O ALA A 181 12.882 1.699 -11.916 1.00 13.65 O ATOM 1466 CB ALA A 181 11.090 2.271 -9.909 1.00 13.56 C ATOM 0 H ALA A 181 13.497 2.680 -8.820 1.00 12.41 H new ATOM 0 HA ALA A 181 11.742 0.343 -9.296 1.00 13.20 H new ATOM 0 HB1 ALA A 181 10.420 1.884 -10.677 1.00 13.56 H new ATOM 0 HB2 ALA A 181 10.530 2.438 -8.989 1.00 13.56 H new ATOM 0 HB3 ALA A 181 11.523 3.213 -10.246 1.00 13.56 H new ATOM 1472 N GLU A 182 13.750 -0.108 -10.894 1.00 13.52 N ATOM 1473 CA GLU A 182 14.569 -0.495 -12.029 1.00 13.92 C ATOM 1474 C GLU A 182 14.507 -2.005 -12.221 1.00 14.43 C ATOM 1475 O GLU A 182 15.229 -2.730 -11.504 1.00 15.05 O ATOM 1476 CB GLU A 182 16.017 -0.045 -11.815 1.00 13.77 C ATOM 1477 CG GLU A 182 16.860 -0.066 -13.081 1.00 14.19 C ATOM 1478 CD GLU A 182 16.401 0.960 -14.096 1.00 14.38 C ATOM 1479 OE1 GLU A 182 16.838 2.126 -14.009 1.00 14.58 O ATOM 1480 OE2 GLU A 182 15.607 0.601 -14.993 1.00 14.46 O ATOM 1481 OXT GLU A 182 13.716 -2.463 -13.070 1.00 14.36 O ATOM 0 H GLU A 182 13.832 -0.725 -10.086 1.00 13.52 H new ATOM 0 HA GLU A 182 14.185 -0.009 -12.926 1.00 13.92 H new ATOM 0 HB2 GLU A 182 16.017 0.966 -11.406 1.00 13.77 H new ATOM 0 HB3 GLU A 182 16.482 -0.690 -11.069 1.00 13.77 H new ATOM 0 HG2 GLU A 182 17.902 0.122 -12.824 1.00 14.19 H new ATOM 0 HG3 GLU A 182 16.816 -1.060 -13.527 1.00 14.19 H new TER 1488 GLU A 182