USER MOD reduce.3.24.130724 H: found=0, std=0, add=752, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 754 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 128 GLN : amide:sc= 0.483 K(o=1,f=0.2) USER MOD Set 1.2: A 131 CYS SG : rot 118:sc= 0.528 USER MOD Set 2.1: A 99 GLN : amide:sc= 0.518 K(o=1.1,f=-4.7!) USER MOD Set 2.2: A 122 LYS NZ :NH3+ -110:sc= 0.572 (180deg=-0.0973) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot -53:sc= 0.776 USER MOD Single : A 10 ASN : amide:sc= -0.198 K(o=-0.2,f=-2.1!) USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 GLN : amide:sc= -1.7 X(o=-1.7,f=-1.9) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 18:sc= 0.73 USER MOD Single : A 66 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 67 MET CE :methyl -145:sc= -3.58! (180deg=-6.63!) USER MOD Single : A 70 THR OG1 : rot -63:sc= 0.681 USER MOD Single : A 72 SER OG : rot 180:sc= -0.0419 USER MOD Single : A 74 ASN : amide:sc= 0.539 K(o=0.54,f=-2.2!) USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.649 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot -150:sc= -0.98 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= -0.148 X(o=-0.15,f=0) USER MOD Single : A 90 SER OG : rot -35:sc= -0.591 USER MOD Single : A 93 ASN : amide:sc= -2.68 K(o=-2.7,f=-5.9!) USER MOD Single : A 95 ASN : amide:sc= -0.175 K(o=-0.17,f=-2.7!) USER MOD Single : A 96 TYR OH : rot 180:sc= -2.77! USER MOD Single : A 105 SER OG : rot 180:sc= 0.0059 USER MOD Single : A 111 MET CE :methyl -148:sc= -2.81! (180deg=-4.27!) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 69 N LYS A 4 4.802 4.570 -6.747 1.00 24.13 N ATOM 70 CA LYS A 4 5.999 5.394 -6.625 1.00 0.14 C ATOM 71 C LYS A 4 6.872 4.917 -5.468 1.00 44.45 C ATOM 72 O LYS A 4 7.578 5.709 -4.844 1.00 3.41 O ATOM 73 CB LYS A 4 5.614 6.861 -6.416 1.00 21.50 C ATOM 74 CG LYS A 4 4.738 7.092 -5.197 1.00 22.01 C ATOM 75 CD LYS A 4 4.657 8.567 -4.840 1.00 71.25 C ATOM 76 CE LYS A 4 3.228 9.082 -4.921 1.00 30.32 C ATOM 77 NZ LYS A 4 3.171 10.483 -5.420 1.00 52.52 N ATOM 0 HA LYS A 4 6.569 5.302 -7.549 1.00 0.14 H new ATOM 0 HB2 LYS A 4 6.522 7.456 -6.318 1.00 21.50 H new ATOM 0 HB3 LYS A 4 5.091 7.221 -7.302 1.00 21.50 H new ATOM 0 HG2 LYS A 4 3.736 6.708 -5.390 1.00 22.01 H new ATOM 0 HG3 LYS A 4 5.136 6.533 -4.350 1.00 22.01 H new ATOM 0 HD2 LYS A 4 5.044 8.720 -3.833 1.00 71.25 H new ATOM 0 HD3 LYS A 4 5.291 9.141 -5.516 1.00 71.25 H new ATOM 0 HE2 LYS A 4 2.647 8.438 -5.581 1.00 30.32 H new ATOM 0 HE3 LYS A 4 2.766 9.029 -3.935 1.00 30.32 H new ATOM 0 HZ1 LYS A 4 2.180 10.797 -5.461 1.00 52.52 H new ATOM 0 HZ2 LYS A 4 3.704 11.102 -4.777 1.00 52.52 H new ATOM 0 HZ3 LYS A 4 3.588 10.530 -6.371 1.00 52.52 H new ATOM 91 N ASP A 5 6.821 3.620 -5.190 1.00 73.52 N ATOM 92 CA ASP A 5 7.609 3.037 -4.111 1.00 3.04 C ATOM 93 C ASP A 5 9.067 2.871 -4.530 1.00 54.45 C ATOM 94 O ASP A 5 9.583 1.755 -4.587 1.00 4.24 O ATOM 95 CB ASP A 5 7.028 1.684 -3.698 1.00 74.01 C ATOM 96 CG ASP A 5 7.007 0.690 -4.842 1.00 72.43 C ATOM 97 OD1 ASP A 5 7.482 1.041 -5.942 1.00 42.20 O ATOM 98 OD2 ASP A 5 6.514 -0.440 -4.638 1.00 63.03 O ATOM 0 H ASP A 5 6.242 2.951 -5.697 1.00 73.52 H new ATOM 0 HA ASP A 5 7.569 3.716 -3.259 1.00 3.04 H new ATOM 0 HB2 ASP A 5 7.616 1.275 -2.876 1.00 74.01 H new ATOM 0 HB3 ASP A 5 6.014 1.826 -3.325 1.00 74.01 H new ATOM 103 N ILE A 6 9.723 3.989 -4.825 1.00 74.32 N ATOM 104 CA ILE A 6 11.120 3.967 -5.240 1.00 32.22 C ATOM 105 C ILE A 6 12.042 4.345 -4.086 1.00 12.13 C ATOM 106 O ILE A 6 11.645 5.070 -3.173 1.00 21.21 O ATOM 107 CB ILE A 6 11.372 4.925 -6.419 1.00 22.10 C ATOM 108 CG1 ILE A 6 11.146 6.374 -5.984 1.00 43.31 C ATOM 109 CG2 ILE A 6 10.470 4.571 -7.591 1.00 55.14 C ATOM 110 CD1 ILE A 6 11.419 7.383 -7.078 1.00 74.21 C ATOM 0 H ILE A 6 9.309 4.920 -4.784 1.00 74.32 H new ATOM 0 HA ILE A 6 11.339 2.948 -5.558 1.00 32.22 H new ATOM 0 HB ILE A 6 12.409 4.819 -6.739 1.00 22.10 H new ATOM 0 HG12 ILE A 6 10.116 6.487 -5.646 1.00 43.31 H new ATOM 0 HG13 ILE A 6 11.788 6.593 -5.131 1.00 43.31 H new ATOM 0 HG21 ILE A 6 10.660 5.257 -8.416 1.00 55.14 H new ATOM 0 HG22 ILE A 6 10.676 3.550 -7.913 1.00 55.14 H new ATOM 0 HG23 ILE A 6 9.427 4.652 -7.285 1.00 55.14 H new ATOM 0 HD11 ILE A 6 11.238 8.389 -6.699 1.00 74.21 H new ATOM 0 HD12 ILE A 6 12.457 7.298 -7.401 1.00 74.21 H new ATOM 0 HD13 ILE A 6 10.759 7.190 -7.924 1.00 74.21 H new ATOM 122 N ARG A 7 13.275 3.851 -4.134 1.00 14.11 N ATOM 123 CA ARG A 7 14.254 4.138 -3.093 1.00 31.24 C ATOM 124 C ARG A 7 14.993 5.440 -3.385 1.00 43.04 C ATOM 125 O ARG A 7 16.222 5.466 -3.453 1.00 3.02 O ATOM 126 CB ARG A 7 15.254 2.987 -2.973 1.00 23.43 C ATOM 127 CG ARG A 7 14.606 1.645 -2.672 1.00 10.20 C ATOM 128 CD ARG A 7 15.394 0.867 -1.630 1.00 31.20 C ATOM 129 NE ARG A 7 15.633 -0.513 -2.043 1.00 31.50 N ATOM 130 CZ ARG A 7 16.435 -1.347 -1.391 1.00 22.33 C ATOM 131 NH1 ARG A 7 17.072 -0.943 -0.300 1.00 50.03 N ATOM 132 NH2 ARG A 7 16.602 -2.589 -1.829 1.00 15.24 N ATOM 0 H ARG A 7 13.619 3.250 -4.883 1.00 14.11 H new ATOM 0 HA ARG A 7 13.721 4.247 -2.148 1.00 31.24 H new ATOM 0 HB2 ARG A 7 15.818 2.908 -3.903 1.00 23.43 H new ATOM 0 HB3 ARG A 7 15.970 3.220 -2.185 1.00 23.43 H new ATOM 0 HG2 ARG A 7 13.588 1.803 -2.316 1.00 10.20 H new ATOM 0 HG3 ARG A 7 14.536 1.060 -3.589 1.00 10.20 H new ATOM 0 HD2 ARG A 7 16.348 1.363 -1.453 1.00 31.20 H new ATOM 0 HD3 ARG A 7 14.851 0.874 -0.685 1.00 31.20 H new ATOM 0 HE ARG A 7 15.158 -0.855 -2.878 1.00 31.50 H new ATOM 0 HH11 ARG A 7 16.947 0.010 0.040 1.00 50.03 H new ATOM 0 HH12 ARG A 7 17.687 -1.586 0.199 1.00 50.03 H new ATOM 0 HH21 ARG A 7 16.114 -2.904 -2.667 1.00 15.24 H new ATOM 0 HH22 ARG A 7 17.218 -3.228 -1.327 1.00 15.24 H new ATOM 146 N ASP A 8 14.236 6.518 -3.559 1.00 24.22 N ATOM 147 CA ASP A 8 14.819 7.824 -3.844 1.00 24.21 C ATOM 148 C ASP A 8 15.623 7.789 -5.140 1.00 22.20 C ATOM 149 O ASP A 8 16.659 8.445 -5.258 1.00 75.41 O ATOM 150 CB ASP A 8 15.714 8.270 -2.686 1.00 52.44 C ATOM 151 CG ASP A 8 15.680 9.771 -2.474 1.00 41.25 C ATOM 152 OD1 ASP A 8 15.565 10.509 -3.475 1.00 63.23 O ATOM 153 OD2 ASP A 8 15.769 10.208 -1.308 1.00 5.13 O ATOM 0 H ASP A 8 13.217 6.513 -3.508 1.00 24.22 H new ATOM 0 HA ASP A 8 14.006 8.540 -3.961 1.00 24.21 H new ATOM 0 HB2 ASP A 8 15.396 7.769 -1.771 1.00 52.44 H new ATOM 0 HB3 ASP A 8 16.740 7.957 -2.881 1.00 52.44 H new ATOM 158 N TYR A 9 15.140 7.019 -6.109 1.00 23.02 N ATOM 159 CA TYR A 9 15.816 6.896 -7.395 1.00 74.52 C ATOM 160 C TYR A 9 17.247 6.399 -7.214 1.00 11.43 C ATOM 161 O TYR A 9 18.177 7.192 -7.076 1.00 5.12 O ATOM 162 CB TYR A 9 15.819 8.240 -8.124 1.00 53.13 C ATOM 163 CG TYR A 9 14.471 8.624 -8.692 1.00 11.32 C ATOM 164 CD1 TYR A 9 13.869 7.859 -9.684 1.00 4.42 C ATOM 165 CD2 TYR A 9 13.799 9.752 -8.237 1.00 43.30 C ATOM 166 CE1 TYR A 9 12.638 8.207 -10.206 1.00 24.32 C ATOM 167 CE2 TYR A 9 12.567 10.106 -8.752 1.00 45.42 C ATOM 168 CZ TYR A 9 11.991 9.331 -9.736 1.00 63.35 C ATOM 169 OH TYR A 9 10.765 9.681 -10.253 1.00 71.12 O ATOM 0 H TYR A 9 14.283 6.471 -6.028 1.00 23.02 H new ATOM 0 HA TYR A 9 15.271 6.167 -7.994 1.00 74.52 H new ATOM 0 HB2 TYR A 9 16.148 9.017 -7.434 1.00 53.13 H new ATOM 0 HB3 TYR A 9 16.548 8.203 -8.934 1.00 53.13 H new ATOM 0 HD1 TYR A 9 14.372 6.977 -10.053 1.00 4.42 H new ATOM 0 HD2 TYR A 9 14.248 10.363 -7.467 1.00 43.30 H new ATOM 0 HE1 TYR A 9 12.185 7.602 -10.978 1.00 24.32 H new ATOM 0 HE2 TYR A 9 12.058 10.985 -8.386 1.00 45.42 H new ATOM 0 HH TYR A 9 10.824 9.732 -11.230 1.00 71.12 H new ATOM 179 N ASN A 10 17.414 5.081 -7.216 1.00 31.13 N ATOM 180 CA ASN A 10 18.731 4.477 -7.052 1.00 2.04 C ATOM 181 C ASN A 10 18.884 3.253 -7.949 1.00 21.30 C ATOM 182 O ASN A 10 19.577 3.298 -8.966 1.00 11.13 O ATOM 183 CB ASN A 10 18.956 4.083 -5.590 1.00 42.43 C ATOM 184 CG ASN A 10 19.548 5.215 -4.771 1.00 75.53 C ATOM 185 OD1 ASN A 10 20.196 6.112 -5.309 1.00 41.13 O ATOM 186 ND2 ASN A 10 19.326 5.176 -3.463 1.00 32.14 N ATOM 0 H ASN A 10 16.654 4.411 -7.329 1.00 31.13 H new ATOM 0 HA ASN A 10 19.480 5.214 -7.342 1.00 2.04 H new ATOM 0 HB2 ASN A 10 18.008 3.776 -5.149 1.00 42.43 H new ATOM 0 HB3 ASN A 10 19.621 3.221 -5.547 1.00 42.43 H new ATOM 0 HD21 ASN A 10 19.699 5.910 -2.860 1.00 32.14 H new ATOM 0 HD22 ASN A 10 18.783 4.412 -3.060 1.00 32.14 H new ATOM 193 N ASP A 11 18.232 2.160 -7.566 1.00 3.40 N ATOM 194 CA ASP A 11 18.294 0.924 -8.336 1.00 71.34 C ATOM 195 C ASP A 11 17.151 -0.012 -7.954 1.00 63.12 C ATOM 196 O ASP A 11 17.308 -1.233 -7.957 1.00 41.42 O ATOM 197 CB ASP A 11 19.637 0.226 -8.115 1.00 12.02 C ATOM 198 CG ASP A 11 20.076 0.263 -6.664 1.00 42.33 C ATOM 199 OD1 ASP A 11 19.697 -0.653 -5.905 1.00 74.23 O ATOM 200 OD2 ASP A 11 20.800 1.208 -6.288 1.00 43.32 O ATOM 0 H ASP A 11 17.655 2.106 -6.727 1.00 3.40 H new ATOM 0 HA ASP A 11 18.195 1.178 -9.391 1.00 71.34 H new ATOM 0 HB2 ASP A 11 19.563 -0.811 -8.443 1.00 12.02 H new ATOM 0 HB3 ASP A 11 20.397 0.702 -8.734 1.00 12.02 H new ATOM 205 N ALA A 12 16.002 0.569 -7.625 1.00 4.05 N ATOM 206 CA ALA A 12 14.834 -0.213 -7.241 1.00 15.32 C ATOM 207 C ALA A 12 14.403 -1.145 -8.368 1.00 32.43 C ATOM 208 O ALA A 12 13.869 -2.227 -8.121 1.00 71.02 O ATOM 209 CB ALA A 12 13.688 0.709 -6.849 1.00 31.32 C ATOM 0 H ALA A 12 15.855 1.578 -7.617 1.00 4.05 H new ATOM 0 HA ALA A 12 15.104 -0.826 -6.381 1.00 15.32 H new ATOM 0 HB1 ALA A 12 12.822 0.112 -6.564 1.00 31.32 H new ATOM 0 HB2 ALA A 12 13.993 1.331 -6.007 1.00 31.32 H new ATOM 0 HB3 ALA A 12 13.428 1.346 -7.695 1.00 31.32 H new ATOM 215 N ASP A 13 14.637 -0.720 -9.604 1.00 4.41 N ATOM 216 CA ASP A 13 14.274 -1.517 -10.769 1.00 72.43 C ATOM 217 C ASP A 13 14.865 -2.920 -10.673 1.00 73.52 C ATOM 218 O ASP A 13 14.242 -3.897 -11.090 1.00 40.52 O ATOM 219 CB ASP A 13 14.754 -0.835 -12.051 1.00 41.01 C ATOM 220 CG ASP A 13 13.996 0.445 -12.344 1.00 64.04 C ATOM 221 OD1 ASP A 13 13.042 0.753 -11.600 1.00 61.24 O ATOM 222 OD2 ASP A 13 14.357 1.139 -13.318 1.00 62.45 O ATOM 0 H ASP A 13 15.077 0.173 -9.825 1.00 4.41 H new ATOM 0 HA ASP A 13 13.188 -1.600 -10.796 1.00 72.43 H new ATOM 0 HB2 ASP A 13 15.818 -0.612 -11.964 1.00 41.01 H new ATOM 0 HB3 ASP A 13 14.639 -1.522 -12.889 1.00 41.01 H new ATOM 227 N MET A 14 16.070 -3.013 -10.122 1.00 5.31 N ATOM 228 CA MET A 14 16.745 -4.297 -9.971 1.00 42.22 C ATOM 229 C MET A 14 15.890 -5.269 -9.166 1.00 35.41 C ATOM 230 O MET A 14 16.038 -6.485 -9.284 1.00 32.32 O ATOM 231 CB MET A 14 18.102 -4.107 -9.289 1.00 74.43 C ATOM 232 CG MET A 14 18.847 -5.410 -9.046 1.00 15.11 C ATOM 233 SD MET A 14 20.490 -5.151 -8.350 1.00 52.34 S ATOM 234 CE MET A 14 20.406 -6.185 -6.890 1.00 44.33 C ATOM 0 H MET A 14 16.600 -2.215 -9.772 1.00 5.31 H new ATOM 0 HA MET A 14 16.902 -4.716 -10.965 1.00 42.22 H new ATOM 0 HB2 MET A 14 18.720 -3.454 -9.904 1.00 74.43 H new ATOM 0 HB3 MET A 14 17.953 -3.600 -8.336 1.00 74.43 H new ATOM 0 HG2 MET A 14 18.265 -6.036 -8.370 1.00 15.11 H new ATOM 0 HG3 MET A 14 18.937 -5.954 -9.986 1.00 15.11 H new ATOM 0 HE1 MET A 14 21.352 -6.131 -6.351 1.00 44.33 H new ATOM 0 HE2 MET A 14 19.599 -5.838 -6.244 1.00 44.33 H new ATOM 0 HE3 MET A 14 20.216 -7.217 -7.185 1.00 44.33 H new ATOM 244 N ALA A 15 14.995 -4.726 -8.348 1.00 14.44 N ATOM 245 CA ALA A 15 14.114 -5.546 -7.524 1.00 45.44 C ATOM 246 C ALA A 15 13.311 -6.518 -8.381 1.00 33.33 C ATOM 247 O ALA A 15 12.869 -7.563 -7.902 1.00 12.33 O ATOM 248 CB ALA A 15 13.182 -4.663 -6.708 1.00 31.31 C ATOM 0 H ALA A 15 14.860 -3.721 -8.238 1.00 14.44 H new ATOM 0 HA ALA A 15 14.732 -6.129 -6.842 1.00 45.44 H new ATOM 0 HB1 ALA A 15 12.530 -5.288 -6.098 1.00 31.31 H new ATOM 0 HB2 ALA A 15 13.771 -4.013 -6.061 1.00 31.31 H new ATOM 0 HB3 ALA A 15 12.576 -4.055 -7.380 1.00 31.31 H new ATOM 254 N ARG A 16 13.124 -6.168 -9.649 1.00 64.12 N ATOM 255 CA ARG A 16 12.372 -7.010 -10.571 1.00 53.35 C ATOM 256 C ARG A 16 12.919 -8.434 -10.578 1.00 20.14 C ATOM 257 O ARG A 16 12.186 -9.391 -10.831 1.00 62.24 O ATOM 258 CB ARG A 16 12.422 -6.426 -11.985 1.00 24.42 C ATOM 259 CG ARG A 16 11.154 -5.691 -12.386 1.00 70.31 C ATOM 260 CD ARG A 16 10.965 -4.421 -11.572 1.00 20.02 C ATOM 261 NE ARG A 16 10.414 -4.696 -10.248 1.00 34.52 N ATOM 262 CZ ARG A 16 9.169 -5.113 -10.042 1.00 62.22 C ATOM 263 NH1 ARG A 16 8.352 -5.302 -11.069 1.00 14.13 N ATOM 264 NH2 ARG A 16 8.741 -5.343 -8.808 1.00 15.45 N ATOM 0 H ARG A 16 13.483 -5.307 -10.061 1.00 64.12 H new ATOM 0 HA ARG A 16 11.336 -7.039 -10.233 1.00 53.35 H new ATOM 0 HB2 ARG A 16 13.267 -5.741 -12.056 1.00 24.42 H new ATOM 0 HB3 ARG A 16 12.605 -7.232 -12.696 1.00 24.42 H new ATOM 0 HG2 ARG A 16 11.197 -5.442 -13.446 1.00 70.31 H new ATOM 0 HG3 ARG A 16 10.293 -6.345 -12.247 1.00 70.31 H new ATOM 0 HD2 ARG A 16 11.923 -3.912 -11.467 1.00 20.02 H new ATOM 0 HD3 ARG A 16 10.300 -3.743 -12.107 1.00 20.02 H new ATOM 0 HE ARG A 16 11.018 -4.561 -9.437 1.00 34.52 H new ATOM 0 HH11 ARG A 16 8.679 -5.127 -12.019 1.00 14.13 H new ATOM 0 HH12 ARG A 16 7.397 -5.622 -10.909 1.00 14.13 H new ATOM 0 HH21 ARG A 16 9.368 -5.200 -8.016 1.00 15.45 H new ATOM 0 HH22 ARG A 16 7.785 -5.663 -8.651 1.00 15.45 H new ATOM 278 N LEU A 17 14.211 -8.567 -10.297 1.00 73.13 N ATOM 279 CA LEU A 17 14.857 -9.875 -10.271 1.00 1.32 C ATOM 280 C LEU A 17 14.086 -10.845 -9.382 1.00 25.25 C ATOM 281 O LEU A 17 14.086 -12.054 -9.618 1.00 73.01 O ATOM 282 CB LEU A 17 16.298 -9.743 -9.773 1.00 73.34 C ATOM 283 CG LEU A 17 16.473 -9.552 -8.266 1.00 74.14 C ATOM 284 CD1 LEU A 17 16.740 -10.886 -7.587 1.00 5.13 C ATOM 285 CD2 LEU A 17 17.599 -8.570 -7.981 1.00 2.14 C ATOM 0 H LEU A 17 14.831 -7.786 -10.084 1.00 73.13 H new ATOM 0 HA LEU A 17 14.865 -10.270 -11.287 1.00 1.32 H new ATOM 0 HB2 LEU A 17 16.848 -10.636 -10.072 1.00 73.34 H new ATOM 0 HB3 LEU A 17 16.761 -8.898 -10.282 1.00 73.34 H new ATOM 0 HG LEU A 17 15.549 -9.141 -7.860 1.00 74.14 H new ATOM 0 HD11 LEU A 17 16.862 -10.731 -6.515 1.00 5.13 H new ATOM 0 HD12 LEU A 17 15.900 -11.558 -7.763 1.00 5.13 H new ATOM 0 HD13 LEU A 17 17.649 -11.327 -7.996 1.00 5.13 H new ATOM 0 HD21 LEU A 17 17.710 -8.446 -6.904 1.00 2.14 H new ATOM 0 HD22 LEU A 17 18.530 -8.952 -8.400 1.00 2.14 H new ATOM 0 HD23 LEU A 17 17.366 -7.607 -8.435 1.00 2.14 H new ATOM 297 N LEU A 18 13.430 -10.308 -8.359 1.00 72.41 N ATOM 298 CA LEU A 18 12.652 -11.127 -7.435 1.00 4.42 C ATOM 299 C LEU A 18 11.632 -11.976 -8.186 1.00 15.44 C ATOM 300 O LEU A 18 11.266 -13.062 -7.739 1.00 22.40 O ATOM 301 CB LEU A 18 11.941 -10.239 -6.412 1.00 30.22 C ATOM 302 CG LEU A 18 12.701 -9.970 -5.113 1.00 5.01 C ATOM 303 CD1 LEU A 18 12.288 -8.632 -4.520 1.00 44.21 C ATOM 304 CD2 LEU A 18 12.465 -11.093 -4.114 1.00 65.50 C ATOM 0 H LEU A 18 13.421 -9.310 -8.148 1.00 72.41 H new ATOM 0 HA LEU A 18 13.338 -11.795 -6.913 1.00 4.42 H new ATOM 0 HB2 LEU A 18 11.718 -9.282 -6.884 1.00 30.22 H new ATOM 0 HB3 LEU A 18 10.986 -10.701 -6.162 1.00 30.22 H new ATOM 0 HG LEU A 18 13.766 -9.931 -5.340 1.00 5.01 H new ATOM 0 HD11 LEU A 18 12.839 -8.458 -3.596 1.00 44.21 H new ATOM 0 HD12 LEU A 18 12.509 -7.835 -5.230 1.00 44.21 H new ATOM 0 HD13 LEU A 18 11.219 -8.642 -4.308 1.00 44.21 H new ATOM 0 HD21 LEU A 18 13.014 -10.884 -3.196 1.00 65.50 H new ATOM 0 HD22 LEU A 18 11.400 -11.165 -3.892 1.00 65.50 H new ATOM 0 HD23 LEU A 18 12.812 -12.036 -4.538 1.00 65.50 H new ATOM 316 N GLU A 19 11.177 -11.472 -9.329 1.00 62.41 N ATOM 317 CA GLU A 19 10.200 -12.186 -10.142 1.00 74.21 C ATOM 318 C GLU A 19 10.659 -13.615 -10.416 1.00 22.43 C ATOM 319 O GLU A 19 9.846 -14.536 -10.486 1.00 30.42 O ATOM 320 CB GLU A 19 9.969 -11.451 -11.464 1.00 73.22 C ATOM 321 CG GLU A 19 9.033 -10.260 -11.343 1.00 5.11 C ATOM 322 CD GLU A 19 9.375 -9.149 -12.317 1.00 13.11 C ATOM 323 OE1 GLU A 19 10.239 -9.370 -13.191 1.00 12.33 O ATOM 324 OE2 GLU A 19 8.777 -8.058 -12.205 1.00 33.12 O ATOM 0 H GLU A 19 11.469 -10.573 -9.712 1.00 62.41 H new ATOM 0 HA GLU A 19 9.263 -12.224 -9.587 1.00 74.21 H new ATOM 0 HB2 GLU A 19 10.929 -11.110 -11.853 1.00 73.22 H new ATOM 0 HB3 GLU A 19 9.560 -12.151 -12.193 1.00 73.22 H new ATOM 0 HG2 GLU A 19 8.008 -10.588 -11.517 1.00 5.11 H new ATOM 0 HG3 GLU A 19 9.074 -9.872 -10.325 1.00 5.11 H new ATOM 331 N GLN A 20 11.968 -13.791 -10.570 1.00 14.34 N ATOM 332 CA GLN A 20 12.535 -15.107 -10.837 1.00 3.02 C ATOM 333 C GLN A 20 12.091 -16.116 -9.783 1.00 11.43 C ATOM 334 O GLN A 20 12.010 -17.314 -10.052 1.00 21.11 O ATOM 335 CB GLN A 20 14.063 -15.029 -10.874 1.00 35.15 C ATOM 336 CG GLN A 20 14.697 -14.884 -9.500 1.00 45.30 C ATOM 337 CD GLN A 20 14.930 -16.219 -8.820 1.00 42.34 C ATOM 338 OE1 GLN A 20 15.402 -17.171 -9.442 1.00 61.01 O ATOM 339 NE2 GLN A 20 14.600 -16.295 -7.537 1.00 33.35 N ATOM 0 H GLN A 20 12.655 -13.039 -10.514 1.00 14.34 H new ATOM 0 HA GLN A 20 12.171 -15.441 -11.809 1.00 3.02 H new ATOM 0 HB2 GLN A 20 14.453 -15.927 -11.352 1.00 35.15 H new ATOM 0 HB3 GLN A 20 14.361 -14.183 -11.494 1.00 35.15 H new ATOM 0 HG2 GLN A 20 15.647 -14.359 -9.596 1.00 45.30 H new ATOM 0 HG3 GLN A 20 14.055 -14.268 -8.871 1.00 45.30 H new ATOM 0 HE21 GLN A 20 14.212 -15.481 -7.061 1.00 33.35 H new ATOM 0 HE22 GLN A 20 14.735 -17.168 -7.027 1.00 33.35 H new ATOM 348 N TRP A 21 11.805 -15.623 -8.583 1.00 53.43 N ATOM 349 CA TRP A 21 11.369 -16.482 -7.488 1.00 53.32 C ATOM 350 C TRP A 21 10.186 -17.346 -7.912 1.00 3.01 C ATOM 351 O TRP A 21 10.107 -18.521 -7.556 1.00 34.04 O ATOM 352 CB TRP A 21 10.989 -15.638 -6.271 1.00 11.54 C ATOM 353 CG TRP A 21 10.890 -16.433 -5.004 1.00 52.30 C ATOM 354 CD1 TRP A 21 9.748 -16.886 -4.408 1.00 54.11 C ATOM 355 CD2 TRP A 21 11.975 -16.866 -4.177 1.00 63.43 C ATOM 356 NE1 TRP A 21 10.058 -17.575 -3.261 1.00 33.24 N ATOM 357 CE2 TRP A 21 11.418 -17.578 -3.097 1.00 73.32 C ATOM 358 CE3 TRP A 21 13.364 -16.725 -4.245 1.00 52.43 C ATOM 359 CZ2 TRP A 21 12.201 -18.144 -2.095 1.00 65.01 C ATOM 360 CZ3 TRP A 21 14.140 -17.286 -3.250 1.00 23.42 C ATOM 361 CH2 TRP A 21 13.558 -17.990 -2.187 1.00 1.42 C ATOM 0 H TRP A 21 11.867 -14.633 -8.344 1.00 53.43 H new ATOM 0 HA TRP A 21 12.198 -17.138 -7.222 1.00 53.32 H new ATOM 0 HB2 TRP A 21 11.730 -14.849 -6.139 1.00 11.54 H new ATOM 0 HB3 TRP A 21 10.033 -15.150 -6.461 1.00 11.54 H new ATOM 0 HD1 TRP A 21 8.748 -16.726 -4.783 1.00 54.11 H new ATOM 0 HE1 TRP A 21 9.385 -18.014 -2.633 1.00 33.24 H new ATOM 0 HE3 TRP A 21 13.822 -16.187 -5.061 1.00 52.43 H new ATOM 0 HZ2 TRP A 21 11.754 -18.685 -1.274 1.00 65.01 H new ATOM 0 HZ3 TRP A 21 15.214 -17.180 -3.292 1.00 23.42 H new ATOM 0 HH2 TRP A 21 14.192 -18.419 -1.426 1.00 1.42 H new ATOM 372 N GLU A 22 9.271 -16.756 -8.674 1.00 74.32 N ATOM 373 CA GLU A 22 8.092 -17.474 -9.145 1.00 61.41 C ATOM 374 C GLU A 22 8.483 -18.580 -10.122 1.00 11.22 C ATOM 375 O GLU A 22 8.211 -19.757 -9.886 1.00 63.31 O ATOM 376 CB GLU A 22 7.113 -16.508 -9.816 1.00 63.50 C ATOM 377 CG GLU A 22 5.707 -16.573 -9.245 1.00 73.10 C ATOM 378 CD GLU A 22 5.678 -16.380 -7.741 1.00 61.33 C ATOM 379 OE1 GLU A 22 6.180 -15.339 -7.268 1.00 32.23 O ATOM 380 OE2 GLU A 22 5.155 -17.270 -7.038 1.00 53.33 O ATOM 0 H GLU A 22 9.323 -15.784 -8.978 1.00 74.32 H new ATOM 0 HA GLU A 22 7.607 -17.930 -8.282 1.00 61.41 H new ATOM 0 HB2 GLU A 22 7.491 -15.491 -9.713 1.00 63.50 H new ATOM 0 HB3 GLU A 22 7.073 -16.727 -10.883 1.00 63.50 H new ATOM 0 HG2 GLU A 22 5.091 -15.808 -9.718 1.00 73.10 H new ATOM 0 HG3 GLU A 22 5.263 -17.537 -9.492 1.00 73.10 H new ATOM 387 N LYS A 23 9.122 -18.192 -11.220 1.00 52.14 N ATOM 388 CA LYS A 23 9.552 -19.148 -12.234 1.00 55.20 C ATOM 389 C LYS A 23 8.373 -19.979 -12.733 1.00 4.53 C ATOM 390 O LYS A 23 8.549 -21.103 -13.202 1.00 62.01 O ATOM 391 CB LYS A 23 10.636 -20.068 -11.669 1.00 73.53 C ATOM 392 CG LYS A 23 11.476 -20.746 -12.738 1.00 50.41 C ATOM 393 CD LYS A 23 11.960 -22.112 -12.284 1.00 24.31 C ATOM 394 CE LYS A 23 11.584 -23.197 -13.282 1.00 11.05 C ATOM 395 NZ LYS A 23 12.326 -24.464 -13.030 1.00 55.50 N ATOM 0 H LYS A 23 9.354 -17.221 -11.431 1.00 52.14 H new ATOM 0 HA LYS A 23 9.961 -18.589 -13.075 1.00 55.20 H new ATOM 0 HB2 LYS A 23 11.290 -19.488 -11.018 1.00 73.53 H new ATOM 0 HB3 LYS A 23 10.166 -20.832 -11.049 1.00 73.53 H new ATOM 0 HG2 LYS A 23 10.889 -20.852 -13.650 1.00 50.41 H new ATOM 0 HG3 LYS A 23 12.333 -20.118 -12.981 1.00 50.41 H new ATOM 0 HD2 LYS A 23 13.042 -22.092 -12.157 1.00 24.31 H new ATOM 0 HD3 LYS A 23 11.529 -22.347 -11.311 1.00 24.31 H new ATOM 0 HE2 LYS A 23 10.512 -23.387 -13.226 1.00 11.05 H new ATOM 0 HE3 LYS A 23 11.793 -22.849 -14.293 1.00 11.05 H new ATOM 0 HZ1 LYS A 23 12.042 -25.178 -13.731 1.00 55.50 H new ATOM 0 HZ2 LYS A 23 13.348 -24.289 -13.109 1.00 55.50 H new ATOM 0 HZ3 LYS A 23 12.107 -24.811 -12.074 1.00 55.50 H new ATOM 409 N ASP A 24 7.174 -19.417 -12.629 1.00 71.31 N ATOM 410 CA ASP A 24 5.967 -20.105 -13.072 1.00 71.51 C ATOM 411 C ASP A 24 5.903 -20.164 -14.595 1.00 70.42 C ATOM 412 O ASP A 24 5.280 -21.060 -15.166 1.00 13.40 O ATOM 413 CB ASP A 24 4.724 -19.403 -12.524 1.00 35.51 C ATOM 414 CG ASP A 24 3.516 -20.319 -12.474 1.00 25.45 C ATOM 415 OD1 ASP A 24 3.359 -21.144 -13.398 1.00 54.51 O ATOM 416 OD2 ASP A 24 2.729 -20.211 -11.510 1.00 21.41 O ATOM 0 H ASP A 24 7.012 -18.487 -12.242 1.00 71.31 H new ATOM 0 HA ASP A 24 5.998 -21.125 -12.688 1.00 71.51 H new ATOM 0 HB2 ASP A 24 4.934 -19.028 -11.522 1.00 35.51 H new ATOM 0 HB3 ASP A 24 4.495 -18.538 -13.146 1.00 35.51 H new ATOM 421 N ASP A 25 6.550 -19.205 -15.247 1.00 4.22 N ATOM 422 CA ASP A 25 6.567 -19.147 -16.704 1.00 23.21 C ATOM 423 C ASP A 25 5.161 -18.938 -17.256 1.00 34.12 C ATOM 424 O ASP A 25 4.744 -19.617 -18.195 1.00 1.04 O ATOM 425 CB ASP A 25 7.169 -20.430 -17.279 1.00 73.43 C ATOM 426 CG ASP A 25 7.721 -20.235 -18.678 1.00 15.33 C ATOM 427 OD1 ASP A 25 8.020 -19.078 -19.040 1.00 71.05 O ATOM 428 OD2 ASP A 25 7.852 -21.238 -19.410 1.00 21.11 O ATOM 0 H ASP A 25 7.070 -18.456 -14.789 1.00 4.22 H new ATOM 0 HA ASP A 25 7.184 -18.300 -17.002 1.00 23.21 H new ATOM 0 HB2 ASP A 25 7.966 -20.780 -16.623 1.00 73.43 H new ATOM 0 HB3 ASP A 25 6.407 -21.209 -17.298 1.00 73.43 H new ATOM 433 N ASP A 26 4.433 -17.996 -16.666 1.00 44.42 N ATOM 434 CA ASP A 26 3.073 -17.697 -17.099 1.00 2.24 C ATOM 435 C ASP A 26 3.041 -17.334 -18.580 1.00 62.20 C ATOM 436 O ASP A 26 2.024 -17.512 -19.251 1.00 30.33 O ATOM 437 CB ASP A 26 2.491 -16.552 -16.268 1.00 30.10 C ATOM 438 CG ASP A 26 1.681 -17.048 -15.087 1.00 14.05 C ATOM 439 OD1 ASP A 26 2.035 -18.106 -14.527 1.00 23.23 O ATOM 440 OD2 ASP A 26 0.691 -16.378 -14.722 1.00 62.32 O ATOM 0 H ASP A 26 4.762 -17.426 -15.887 1.00 44.42 H new ATOM 0 HA ASP A 26 2.466 -18.590 -16.949 1.00 2.24 H new ATOM 0 HB2 ASP A 26 3.302 -15.919 -15.908 1.00 30.10 H new ATOM 0 HB3 ASP A 26 1.859 -15.931 -16.903 1.00 30.10 H new ATOM 445 N ILE A 27 4.160 -16.824 -19.083 1.00 62.23 N ATOM 446 CA ILE A 27 4.260 -16.437 -20.485 1.00 13.31 C ATOM 447 C ILE A 27 5.431 -17.136 -21.167 1.00 12.12 C ATOM 448 O ILE A 27 6.436 -17.447 -20.529 1.00 62.34 O ATOM 449 CB ILE A 27 4.427 -14.913 -20.637 1.00 74.34 C ATOM 450 CG1 ILE A 27 3.382 -14.177 -19.797 1.00 35.15 C ATOM 451 CG2 ILE A 27 4.315 -14.512 -22.101 1.00 22.13 C ATOM 452 CD1 ILE A 27 1.958 -14.441 -20.235 1.00 41.22 C ATOM 0 H ILE A 27 5.010 -16.669 -18.541 1.00 62.23 H new ATOM 0 HA ILE A 27 3.330 -16.743 -20.964 1.00 13.31 H new ATOM 0 HB ILE A 27 5.417 -14.633 -20.278 1.00 74.34 H new ATOM 0 HG12 ILE A 27 3.493 -14.472 -18.754 1.00 35.15 H new ATOM 0 HG13 ILE A 27 3.576 -13.106 -19.848 1.00 35.15 H new ATOM 0 HG21 ILE A 27 4.435 -13.433 -22.193 1.00 22.13 H new ATOM 0 HG22 ILE A 27 5.093 -15.014 -22.676 1.00 22.13 H new ATOM 0 HG23 ILE A 27 3.337 -14.802 -22.484 1.00 22.13 H new ATOM 0 HD11 ILE A 27 1.272 -13.887 -19.595 1.00 41.22 H new ATOM 0 HD12 ILE A 27 1.830 -14.120 -21.269 1.00 41.22 H new ATOM 0 HD13 ILE A 27 1.745 -15.507 -20.158 1.00 41.22 H new ATOM 1035 N THR A 64 17.903 4.610 -24.677 1.00 44.12 N ATOM 1036 CA THR A 64 16.450 4.662 -24.583 1.00 70.15 C ATOM 1037 C THR A 64 15.929 3.665 -23.554 1.00 45.13 C ATOM 1038 O THR A 64 16.368 2.515 -23.512 1.00 22.14 O ATOM 1039 CB THR A 64 15.789 4.371 -25.944 1.00 35.43 C ATOM 1040 OG1 THR A 64 16.774 4.393 -26.982 1.00 51.25 O ATOM 1041 CG2 THR A 64 14.702 5.391 -26.247 1.00 33.14 C ATOM 0 HA THR A 64 16.189 5.673 -24.269 1.00 70.15 H new ATOM 0 HB THR A 64 15.334 3.382 -25.897 1.00 35.43 H new ATOM 0 HG1 THR A 64 17.666 4.294 -26.589 1.00 51.25 H new ATOM 0 HG21 THR A 64 14.250 5.165 -27.213 1.00 33.14 H new ATOM 0 HG22 THR A 64 13.938 5.350 -25.470 1.00 33.14 H new ATOM 0 HG23 THR A 64 15.138 6.390 -26.275 1.00 33.14 H new ATOM 1049 N LEU A 65 14.991 4.112 -22.727 1.00 5.14 N ATOM 1050 CA LEU A 65 14.410 3.258 -21.697 1.00 12.13 C ATOM 1051 C LEU A 65 12.928 3.014 -21.965 1.00 1.35 C ATOM 1052 O LEU A 65 12.138 3.955 -22.038 1.00 72.35 O ATOM 1053 CB LEU A 65 14.593 3.893 -20.317 1.00 33.30 C ATOM 1054 CG LEU A 65 14.083 5.326 -20.165 1.00 1.34 C ATOM 1055 CD1 LEU A 65 13.320 5.486 -18.859 1.00 20.42 C ATOM 1056 CD2 LEU A 65 15.239 6.313 -20.233 1.00 3.33 C ATOM 0 H LEU A 65 14.616 5.060 -22.749 1.00 5.14 H new ATOM 0 HA LEU A 65 14.927 2.299 -21.720 1.00 12.13 H new ATOM 0 HB2 LEU A 65 14.086 3.268 -19.582 1.00 33.30 H new ATOM 0 HB3 LEU A 65 15.655 3.878 -20.070 1.00 33.30 H new ATOM 0 HG LEU A 65 13.401 5.538 -20.989 1.00 1.34 H new ATOM 0 HD11 LEU A 65 12.965 6.513 -18.769 1.00 20.42 H new ATOM 0 HD12 LEU A 65 12.469 4.805 -18.849 1.00 20.42 H new ATOM 0 HD13 LEU A 65 13.979 5.255 -18.022 1.00 20.42 H new ATOM 0 HD21 LEU A 65 14.858 7.328 -20.123 1.00 3.33 H new ATOM 0 HD22 LEU A 65 15.945 6.102 -19.430 1.00 3.33 H new ATOM 0 HD23 LEU A 65 15.743 6.217 -21.195 1.00 3.33 H new ATOM 1068 N MET A 66 12.559 1.746 -22.107 1.00 33.41 N ATOM 1069 CA MET A 66 11.171 1.378 -22.363 1.00 12.21 C ATOM 1070 C MET A 66 10.950 -0.112 -22.122 1.00 54.33 C ATOM 1071 O MET A 66 11.501 -0.953 -22.832 1.00 12.32 O ATOM 1072 CB MET A 66 10.782 1.738 -23.798 1.00 11.30 C ATOM 1073 CG MET A 66 11.831 1.350 -24.827 1.00 50.44 C ATOM 1074 SD MET A 66 12.625 2.782 -25.583 1.00 23.00 S ATOM 1075 CE MET A 66 11.682 2.932 -27.098 1.00 40.12 C ATOM 0 H MET A 66 13.201 0.956 -22.049 1.00 33.41 H new ATOM 0 HA MET A 66 10.540 1.937 -21.672 1.00 12.21 H new ATOM 0 HB2 MET A 66 9.842 1.245 -24.046 1.00 11.30 H new ATOM 0 HB3 MET A 66 10.604 2.812 -23.859 1.00 11.30 H new ATOM 0 HG2 MET A 66 12.589 0.728 -24.351 1.00 50.44 H new ATOM 0 HG3 MET A 66 11.365 0.745 -25.605 1.00 50.44 H new ATOM 0 HE1 MET A 66 12.055 3.777 -27.677 1.00 40.12 H new ATOM 0 HE2 MET A 66 11.785 2.018 -27.683 1.00 40.12 H new ATOM 0 HE3 MET A 66 10.631 3.093 -26.858 1.00 40.12 H new ATOM 1085 N MET A 67 10.140 -0.431 -21.118 1.00 2.34 N ATOM 1086 CA MET A 67 9.846 -1.820 -20.785 1.00 42.21 C ATOM 1087 C MET A 67 8.505 -1.935 -20.068 1.00 52.01 C ATOM 1088 O MET A 67 8.203 -1.153 -19.166 1.00 74.13 O ATOM 1089 CB MET A 67 10.957 -2.403 -19.910 1.00 23.20 C ATOM 1090 CG MET A 67 10.736 -3.860 -19.538 1.00 33.24 C ATOM 1091 SD MET A 67 11.901 -4.444 -18.292 1.00 4.21 S ATOM 1092 CE MET A 67 13.434 -3.759 -18.916 1.00 24.22 C ATOM 0 H MET A 67 9.676 0.253 -20.521 1.00 2.34 H new ATOM 0 HA MET A 67 9.791 -2.386 -21.715 1.00 42.21 H new ATOM 0 HB2 MET A 67 11.908 -2.311 -20.435 1.00 23.20 H new ATOM 0 HB3 MET A 67 11.038 -1.812 -18.998 1.00 23.20 H new ATOM 0 HG2 MET A 67 9.719 -3.986 -19.166 1.00 33.24 H new ATOM 0 HG3 MET A 67 10.827 -4.477 -20.432 1.00 33.24 H new ATOM 0 HE1 MET A 67 14.252 -4.449 -18.709 1.00 24.22 H new ATOM 0 HE2 MET A 67 13.352 -3.605 -19.992 1.00 24.22 H new ATOM 0 HE3 MET A 67 13.632 -2.805 -18.427 1.00 24.22 H new ATOM 1102 N PHE A 68 7.704 -2.914 -20.475 1.00 32.24 N ATOM 1103 CA PHE A 68 6.394 -3.130 -19.872 1.00 32.55 C ATOM 1104 C PHE A 68 6.171 -4.610 -19.571 1.00 0.23 C ATOM 1105 O PHE A 68 6.189 -5.448 -20.472 1.00 44.12 O ATOM 1106 CB PHE A 68 5.291 -2.615 -20.798 1.00 72.24 C ATOM 1107 CG PHE A 68 5.576 -1.257 -21.372 1.00 50.21 C ATOM 1108 CD1 PHE A 68 5.842 -0.181 -20.541 1.00 1.15 C ATOM 1109 CD2 PHE A 68 5.578 -1.056 -22.743 1.00 5.30 C ATOM 1110 CE1 PHE A 68 6.104 1.070 -21.066 1.00 10.30 C ATOM 1111 CE2 PHE A 68 5.840 0.193 -23.274 1.00 42.23 C ATOM 1112 CZ PHE A 68 6.104 1.257 -22.435 1.00 3.35 C ATOM 0 H PHE A 68 7.939 -3.570 -21.220 1.00 32.24 H new ATOM 0 HA PHE A 68 6.358 -2.577 -18.934 1.00 32.55 H new ATOM 0 HB2 PHE A 68 5.153 -3.324 -21.614 1.00 72.24 H new ATOM 0 HB3 PHE A 68 4.352 -2.577 -20.246 1.00 72.24 H new ATOM 0 HD1 PHE A 68 5.845 -0.322 -19.470 1.00 1.15 H new ATOM 0 HD2 PHE A 68 5.372 -1.885 -23.404 1.00 5.30 H new ATOM 0 HE1 PHE A 68 6.309 1.901 -20.407 1.00 10.30 H new ATOM 0 HE2 PHE A 68 5.838 0.336 -24.344 1.00 42.23 H new ATOM 0 HZ PHE A 68 6.310 2.233 -22.848 1.00 3.35 H new ATOM 1122 N VAL A 69 5.961 -4.923 -18.296 1.00 61.31 N ATOM 1123 CA VAL A 69 5.734 -6.301 -17.875 1.00 3.51 C ATOM 1124 C VAL A 69 4.755 -6.364 -16.708 1.00 24.22 C ATOM 1125 O VAL A 69 4.676 -5.440 -15.898 1.00 54.31 O ATOM 1126 CB VAL A 69 7.051 -6.986 -17.464 1.00 60.02 C ATOM 1127 CG1 VAL A 69 6.825 -8.469 -17.211 1.00 11.34 C ATOM 1128 CG2 VAL A 69 8.116 -6.775 -18.530 1.00 72.30 C ATOM 0 H VAL A 69 5.943 -4.242 -17.537 1.00 61.31 H new ATOM 0 HA VAL A 69 5.310 -6.828 -18.730 1.00 3.51 H new ATOM 0 HB VAL A 69 7.402 -6.533 -16.537 1.00 60.02 H new ATOM 0 HG11 VAL A 69 7.766 -8.936 -16.922 1.00 11.34 H new ATOM 0 HG12 VAL A 69 6.096 -8.595 -16.410 1.00 11.34 H new ATOM 0 HG13 VAL A 69 6.450 -8.940 -18.120 1.00 11.34 H new ATOM 0 HG21 VAL A 69 9.040 -7.265 -18.223 1.00 72.30 H new ATOM 0 HG22 VAL A 69 7.775 -7.200 -19.474 1.00 72.30 H new ATOM 0 HG23 VAL A 69 8.297 -5.708 -18.657 1.00 72.30 H new ATOM 1138 N THR A 70 4.011 -7.463 -16.626 1.00 52.52 N ATOM 1139 CA THR A 70 3.036 -7.648 -15.559 1.00 1.54 C ATOM 1140 C THR A 70 2.552 -9.092 -15.500 1.00 42.11 C ATOM 1141 O THR A 70 1.433 -9.399 -15.910 1.00 72.30 O ATOM 1142 CB THR A 70 1.821 -6.718 -15.740 1.00 3.03 C ATOM 1143 OG1 THR A 70 0.763 -7.118 -14.862 1.00 2.24 O ATOM 1144 CG2 THR A 70 1.330 -6.744 -17.179 1.00 73.11 C ATOM 0 H THR A 70 4.066 -8.238 -17.286 1.00 52.52 H new ATOM 0 HA THR A 70 3.539 -7.398 -14.625 1.00 1.54 H new ATOM 0 HB THR A 70 2.130 -5.701 -15.496 1.00 3.03 H new ATOM 0 HG1 THR A 70 0.467 -8.022 -15.097 1.00 2.24 H new ATOM 0 HG21 THR A 70 0.472 -6.080 -17.283 1.00 73.11 H new ATOM 0 HG22 THR A 70 2.129 -6.411 -17.842 1.00 73.11 H new ATOM 0 HG23 THR A 70 1.037 -7.760 -17.445 1.00 73.11 H new ATOM 1152 N VAL A 71 3.402 -9.976 -14.987 1.00 43.32 N ATOM 1153 CA VAL A 71 3.060 -11.388 -14.873 1.00 62.42 C ATOM 1154 C VAL A 71 3.824 -12.048 -13.730 1.00 75.23 C ATOM 1155 O VAL A 71 4.588 -11.394 -13.022 1.00 4.03 O ATOM 1156 CB VAL A 71 3.360 -12.146 -16.181 1.00 13.44 C ATOM 1157 CG1 VAL A 71 2.324 -11.809 -17.242 1.00 53.12 C ATOM 1158 CG2 VAL A 71 4.763 -11.824 -16.672 1.00 71.34 C ATOM 0 H VAL A 71 4.333 -9.739 -14.644 1.00 43.32 H new ATOM 0 HA VAL A 71 1.990 -11.439 -14.669 1.00 62.42 H new ATOM 0 HB VAL A 71 3.306 -13.216 -15.982 1.00 13.44 H new ATOM 0 HG11 VAL A 71 2.552 -12.353 -18.159 1.00 53.12 H new ATOM 0 HG12 VAL A 71 1.334 -12.094 -16.887 1.00 53.12 H new ATOM 0 HG13 VAL A 71 2.343 -10.738 -17.442 1.00 53.12 H new ATOM 0 HG21 VAL A 71 4.959 -12.367 -17.596 1.00 71.34 H new ATOM 0 HG22 VAL A 71 4.847 -10.753 -16.856 1.00 71.34 H new ATOM 0 HG23 VAL A 71 5.490 -12.121 -15.916 1.00 71.34 H new ATOM 1168 N SER A 72 3.611 -13.349 -13.557 1.00 52.20 N ATOM 1169 CA SER A 72 4.276 -14.098 -12.498 1.00 4.34 C ATOM 1170 C SER A 72 5.362 -15.003 -13.072 1.00 1.22 C ATOM 1171 O SER A 72 5.086 -15.881 -13.888 1.00 24.21 O ATOM 1172 CB SER A 72 3.259 -14.934 -11.718 1.00 42.44 C ATOM 1173 OG SER A 72 1.976 -14.862 -12.316 1.00 22.43 O ATOM 0 H SER A 72 2.983 -13.906 -14.137 1.00 52.20 H new ATOM 0 HA SER A 72 4.743 -13.383 -11.821 1.00 4.34 H new ATOM 0 HB2 SER A 72 3.589 -15.972 -11.681 1.00 42.44 H new ATOM 0 HB3 SER A 72 3.205 -14.580 -10.689 1.00 42.44 H new ATOM 0 HG SER A 72 1.344 -15.406 -11.801 1.00 22.43 H new ATOM 1179 N GLY A 73 6.599 -14.781 -12.638 1.00 45.13 N ATOM 1180 CA GLY A 73 7.709 -15.583 -13.119 1.00 70.31 C ATOM 1181 C GLY A 73 8.512 -14.878 -14.194 1.00 52.20 C ATOM 1182 O GLY A 73 8.132 -14.882 -15.364 1.00 44.43 O ATOM 0 H GLY A 73 6.852 -14.060 -11.962 1.00 45.13 H new ATOM 0 HA2 GLY A 73 8.364 -15.829 -12.283 1.00 70.31 H new ATOM 0 HA3 GLY A 73 7.328 -16.525 -13.514 1.00 70.31 H new ATOM 1186 N ASN A 74 9.624 -14.269 -13.796 1.00 41.10 N ATOM 1187 CA ASN A 74 10.482 -13.554 -14.734 1.00 55.42 C ATOM 1188 C ASN A 74 11.954 -13.789 -14.413 1.00 44.03 C ATOM 1189 O ASN A 74 12.647 -12.919 -13.885 1.00 0.00 O ATOM 1190 CB ASN A 74 10.173 -12.055 -14.699 1.00 24.35 C ATOM 1191 CG ASN A 74 10.466 -11.373 -16.021 1.00 25.21 C ATOM 1192 OD1 ASN A 74 10.615 -12.030 -17.051 1.00 62.14 O ATOM 1193 ND2 ASN A 74 10.551 -10.048 -15.997 1.00 21.11 N ATOM 0 H ASN A 74 9.952 -14.256 -12.830 1.00 41.10 H new ATOM 0 HA ASN A 74 10.282 -13.936 -15.735 1.00 55.42 H new ATOM 0 HB2 ASN A 74 9.124 -11.909 -14.443 1.00 24.35 H new ATOM 0 HB3 ASN A 74 10.762 -11.584 -13.912 1.00 24.35 H new ATOM 0 HD21 ASN A 74 10.747 -9.534 -16.856 1.00 21.11 H new ATOM 0 HD22 ASN A 74 10.420 -9.544 -15.120 1.00 21.11 H new ATOM 1200 N PRO A 75 12.446 -14.993 -14.740 1.00 71.40 N ATOM 1201 CA PRO A 75 13.841 -15.371 -14.497 1.00 63.40 C ATOM 1202 C PRO A 75 14.811 -14.621 -15.403 1.00 44.01 C ATOM 1203 O PRO A 75 15.207 -15.121 -16.457 1.00 54.30 O ATOM 1204 CB PRO A 75 13.863 -16.869 -14.814 1.00 4.14 C ATOM 1205 CG PRO A 75 12.736 -17.071 -15.766 1.00 63.35 C ATOM 1206 CD PRO A 75 11.678 -16.079 -15.372 1.00 54.14 C ATOM 0 HA PRO A 75 14.157 -15.131 -13.482 1.00 63.40 H new ATOM 0 HB2 PRO A 75 14.814 -17.166 -15.257 1.00 4.14 H new ATOM 0 HB3 PRO A 75 13.731 -17.467 -13.912 1.00 4.14 H new ATOM 0 HG2 PRO A 75 13.060 -16.908 -16.794 1.00 63.35 H new ATOM 0 HG3 PRO A 75 12.355 -18.091 -15.709 1.00 63.35 H new ATOM 0 HD2 PRO A 75 11.118 -15.724 -16.237 1.00 54.14 H new ATOM 0 HD3 PRO A 75 10.956 -16.515 -14.682 1.00 54.14 H new ATOM 1214 N THR A 76 15.193 -13.418 -14.986 1.00 51.53 N ATOM 1215 CA THR A 76 16.116 -12.598 -15.761 1.00 3.24 C ATOM 1216 C THR A 76 16.776 -11.538 -14.886 1.00 41.42 C ATOM 1217 O THR A 76 16.816 -10.362 -15.246 1.00 1.54 O ATOM 1218 CB THR A 76 15.402 -11.905 -16.937 1.00 22.43 C ATOM 1219 OG1 THR A 76 14.278 -12.687 -17.356 1.00 63.22 O ATOM 1220 CG2 THR A 76 16.354 -11.708 -18.107 1.00 11.52 C ATOM 0 H THR A 76 14.877 -12.990 -14.116 1.00 51.53 H new ATOM 0 HA THR A 76 16.880 -13.268 -16.155 1.00 3.24 H new ATOM 0 HB THR A 76 15.058 -10.927 -16.600 1.00 22.43 H new ATOM 0 HG1 THR A 76 13.828 -12.239 -18.103 1.00 63.22 H new ATOM 0 HG21 THR A 76 15.828 -11.217 -18.926 1.00 11.52 H new ATOM 0 HG22 THR A 76 17.194 -11.089 -17.792 1.00 11.52 H new ATOM 0 HG23 THR A 76 16.723 -12.677 -18.443 1.00 11.52 H new ATOM 1228 N GLU A 77 17.293 -11.962 -13.737 1.00 72.33 N ATOM 1229 CA GLU A 77 17.951 -11.047 -12.812 1.00 71.41 C ATOM 1230 C GLU A 77 19.019 -10.225 -13.528 1.00 14.34 C ATOM 1231 O GLU A 77 19.108 -9.010 -13.346 1.00 63.23 O ATOM 1232 CB GLU A 77 18.581 -11.824 -11.654 1.00 11.22 C ATOM 1233 CG GLU A 77 19.503 -12.945 -12.103 1.00 33.12 C ATOM 1234 CD GLU A 77 19.818 -13.923 -10.987 1.00 43.24 C ATOM 1235 OE1 GLU A 77 20.710 -13.619 -10.167 1.00 51.54 O ATOM 1236 OE2 GLU A 77 19.175 -14.991 -10.935 1.00 34.45 O ATOM 0 H GLU A 77 17.269 -12.933 -13.425 1.00 72.33 H new ATOM 0 HA GLU A 77 17.198 -10.366 -12.416 1.00 71.41 H new ATOM 0 HB2 GLU A 77 19.143 -11.132 -11.027 1.00 11.22 H new ATOM 0 HB3 GLU A 77 17.788 -12.243 -11.035 1.00 11.22 H new ATOM 0 HG2 GLU A 77 19.040 -13.481 -12.931 1.00 33.12 H new ATOM 0 HG3 GLU A 77 20.432 -12.517 -12.480 1.00 33.12 H new ATOM 1243 N LYS A 78 19.827 -10.895 -14.341 1.00 62.22 N ATOM 1244 CA LYS A 78 20.889 -10.229 -15.086 1.00 0.34 C ATOM 1245 C LYS A 78 20.343 -9.032 -15.858 1.00 63.24 C ATOM 1246 O LYS A 78 20.767 -7.897 -15.642 1.00 60.34 O ATOM 1247 CB LYS A 78 21.557 -11.211 -16.050 1.00 45.45 C ATOM 1248 CG LYS A 78 22.918 -11.694 -15.580 1.00 62.41 C ATOM 1249 CD LYS A 78 24.043 -11.055 -16.377 1.00 23.51 C ATOM 1250 CE LYS A 78 25.380 -11.198 -15.666 1.00 3.40 C ATOM 1251 NZ LYS A 78 26.465 -11.607 -16.601 1.00 32.22 N ATOM 0 H LYS A 78 19.767 -11.901 -14.501 1.00 62.22 H new ATOM 0 HA LYS A 78 21.631 -9.871 -14.372 1.00 0.34 H new ATOM 0 HB2 LYS A 78 20.903 -12.072 -16.189 1.00 45.45 H new ATOM 0 HB3 LYS A 78 21.667 -10.734 -17.024 1.00 45.45 H new ATOM 0 HG2 LYS A 78 23.042 -11.461 -14.522 1.00 62.41 H new ATOM 0 HG3 LYS A 78 22.973 -12.778 -15.676 1.00 62.41 H new ATOM 0 HD2 LYS A 78 24.102 -11.519 -17.362 1.00 23.51 H new ATOM 0 HD3 LYS A 78 23.825 -9.999 -16.535 1.00 23.51 H new ATOM 0 HE2 LYS A 78 25.644 -10.251 -15.195 1.00 3.40 H new ATOM 0 HE3 LYS A 78 25.290 -11.936 -14.869 1.00 3.40 H new ATOM 0 HZ1 LYS A 78 27.360 -11.694 -16.078 1.00 32.22 H new ATOM 0 HZ2 LYS A 78 26.225 -12.523 -17.031 1.00 32.22 H new ATOM 0 HZ3 LYS A 78 26.568 -10.890 -17.348 1.00 32.22 H new ATOM 1265 N GLU A 79 19.400 -9.294 -16.758 1.00 63.51 N ATOM 1266 CA GLU A 79 18.797 -8.238 -17.562 1.00 0.24 C ATOM 1267 C GLU A 79 18.274 -7.111 -16.675 1.00 31.40 C ATOM 1268 O GLU A 79 18.292 -5.942 -17.061 1.00 1.14 O ATOM 1269 CB GLU A 79 17.658 -8.802 -18.414 1.00 1.33 C ATOM 1270 CG GLU A 79 17.120 -7.817 -19.438 1.00 74.44 C ATOM 1271 CD GLU A 79 18.179 -7.362 -20.423 1.00 3.34 C ATOM 1272 OE1 GLU A 79 18.674 -8.207 -21.197 1.00 74.30 O ATOM 1273 OE2 GLU A 79 18.514 -6.158 -20.418 1.00 70.41 O ATOM 0 H GLU A 79 19.038 -10.228 -16.948 1.00 63.51 H new ATOM 0 HA GLU A 79 19.566 -7.833 -18.220 1.00 0.24 H new ATOM 0 HB2 GLU A 79 18.010 -9.695 -18.931 1.00 1.33 H new ATOM 0 HB3 GLU A 79 16.844 -9.113 -17.759 1.00 1.33 H new ATOM 0 HG2 GLU A 79 16.297 -8.279 -19.983 1.00 74.44 H new ATOM 0 HG3 GLU A 79 16.712 -6.948 -18.921 1.00 74.44 H new ATOM 1280 N THR A 80 17.807 -7.472 -15.484 1.00 32.24 N ATOM 1281 CA THR A 80 17.277 -6.494 -14.542 1.00 52.03 C ATOM 1282 C THR A 80 18.311 -5.420 -14.225 1.00 53.54 C ATOM 1283 O THR A 80 18.024 -4.226 -14.309 1.00 53.10 O ATOM 1284 CB THR A 80 16.830 -7.163 -13.229 1.00 34.21 C ATOM 1285 OG1 THR A 80 16.380 -8.498 -13.488 1.00 15.34 O ATOM 1286 CG2 THR A 80 15.715 -6.366 -12.567 1.00 65.15 C ATOM 0 H THR A 80 17.785 -8.435 -15.149 1.00 32.24 H new ATOM 0 HA THR A 80 16.412 -6.033 -15.019 1.00 52.03 H new ATOM 0 HB THR A 80 17.684 -7.192 -12.553 1.00 34.21 H new ATOM 0 HG1 THR A 80 15.694 -8.745 -12.833 1.00 15.34 H new ATOM 0 HG21 THR A 80 15.416 -6.858 -11.642 1.00 65.15 H new ATOM 0 HG22 THR A 80 16.070 -5.360 -12.345 1.00 65.15 H new ATOM 0 HG23 THR A 80 14.860 -6.309 -13.240 1.00 65.15 H new ATOM 1294 N GLU A 81 19.514 -5.852 -13.862 1.00 43.42 N ATOM 1295 CA GLU A 81 20.591 -4.925 -13.533 1.00 13.32 C ATOM 1296 C GLU A 81 20.821 -3.932 -14.669 1.00 34.21 C ATOM 1297 O GLU A 81 21.145 -2.769 -14.434 1.00 4.14 O ATOM 1298 CB GLU A 81 21.883 -5.691 -13.241 1.00 75.23 C ATOM 1299 CG GLU A 81 22.933 -4.862 -12.523 1.00 5.31 C ATOM 1300 CD GLU A 81 24.310 -4.999 -13.144 1.00 70.10 C ATOM 1301 OE1 GLU A 81 24.399 -5.038 -14.389 1.00 34.31 O ATOM 1302 OE2 GLU A 81 25.299 -5.067 -12.384 1.00 72.32 O ATOM 0 H GLU A 81 19.768 -6.837 -13.788 1.00 43.42 H new ATOM 0 HA GLU A 81 20.297 -4.370 -12.642 1.00 13.32 H new ATOM 0 HB2 GLU A 81 21.647 -6.567 -12.636 1.00 75.23 H new ATOM 0 HB3 GLU A 81 22.300 -6.055 -14.180 1.00 75.23 H new ATOM 0 HG2 GLU A 81 22.635 -3.814 -12.537 1.00 5.31 H new ATOM 0 HG3 GLU A 81 22.978 -5.166 -11.477 1.00 5.31 H new ATOM 1309 N GLU A 82 20.650 -4.402 -15.901 1.00 0.21 N ATOM 1310 CA GLU A 82 20.840 -3.556 -17.073 1.00 44.03 C ATOM 1311 C GLU A 82 19.833 -2.410 -17.087 1.00 34.11 C ATOM 1312 O GLU A 82 20.086 -1.354 -17.667 1.00 10.11 O ATOM 1313 CB GLU A 82 20.706 -4.383 -18.354 1.00 21.04 C ATOM 1314 CG GLU A 82 21.310 -3.714 -19.577 1.00 12.42 C ATOM 1315 CD GLU A 82 21.594 -4.694 -20.698 1.00 23.32 C ATOM 1316 OE1 GLU A 82 21.534 -5.916 -20.448 1.00 34.13 O ATOM 1317 OE2 GLU A 82 21.877 -4.239 -21.826 1.00 5.02 O ATOM 0 H GLU A 82 20.381 -5.363 -16.113 1.00 0.21 H new ATOM 0 HA GLU A 82 21.844 -3.134 -17.025 1.00 44.03 H new ATOM 0 HB2 GLU A 82 21.187 -5.350 -18.204 1.00 21.04 H new ATOM 0 HB3 GLU A 82 19.650 -4.578 -18.541 1.00 21.04 H new ATOM 0 HG2 GLU A 82 20.630 -2.943 -19.938 1.00 12.42 H new ATOM 0 HG3 GLU A 82 22.236 -3.215 -19.293 1.00 12.42 H new ATOM 1324 N ILE A 83 18.690 -2.628 -16.445 1.00 11.41 N ATOM 1325 CA ILE A 83 17.644 -1.614 -16.383 1.00 4.24 C ATOM 1326 C ILE A 83 18.155 -0.338 -15.722 1.00 52.42 C ATOM 1327 O ILE A 83 17.900 0.768 -16.202 1.00 25.04 O ATOM 1328 CB ILE A 83 16.413 -2.122 -15.609 1.00 42.41 C ATOM 1329 CG1 ILE A 83 15.855 -3.385 -16.268 1.00 2.21 C ATOM 1330 CG2 ILE A 83 15.347 -1.038 -15.540 1.00 61.44 C ATOM 1331 CD1 ILE A 83 14.747 -4.041 -15.475 1.00 11.14 C ATOM 0 H ILE A 83 18.465 -3.497 -15.961 1.00 11.41 H new ATOM 0 HA ILE A 83 17.353 -1.397 -17.411 1.00 4.24 H new ATOM 0 HB ILE A 83 16.718 -2.370 -14.592 1.00 42.41 H new ATOM 0 HG12 ILE A 83 15.480 -3.132 -17.260 1.00 2.21 H new ATOM 0 HG13 ILE A 83 16.665 -4.101 -16.406 1.00 2.21 H new ATOM 0 HG21 ILE A 83 14.483 -1.412 -14.990 1.00 61.44 H new ATOM 0 HG22 ILE A 83 15.750 -0.163 -15.031 1.00 61.44 H new ATOM 0 HG23 ILE A 83 15.043 -0.762 -16.550 1.00 61.44 H new ATOM 0 HD11 ILE A 83 14.400 -4.930 -16.002 1.00 11.14 H new ATOM 0 HD12 ILE A 83 15.122 -4.325 -14.492 1.00 11.14 H new ATOM 0 HD13 ILE A 83 13.919 -3.341 -15.359 1.00 11.14 H new ATOM 1343 N THR A 84 18.879 -0.497 -14.619 1.00 32.43 N ATOM 1344 CA THR A 84 19.426 0.641 -13.892 1.00 43.22 C ATOM 1345 C THR A 84 20.202 1.566 -14.823 1.00 53.22 C ATOM 1346 O THR A 84 20.194 2.785 -14.651 1.00 35.01 O ATOM 1347 CB THR A 84 20.354 0.185 -12.750 1.00 42.42 C ATOM 1348 OG1 THR A 84 19.624 -0.619 -11.817 1.00 42.03 O ATOM 1349 CG2 THR A 84 20.957 1.383 -12.032 1.00 11.31 C ATOM 0 H THR A 84 19.100 -1.404 -14.209 1.00 32.43 H new ATOM 0 HA THR A 84 18.580 1.182 -13.468 1.00 43.22 H new ATOM 0 HB THR A 84 21.163 -0.405 -13.182 1.00 42.42 H new ATOM 0 HG1 THR A 84 20.221 -0.906 -11.095 1.00 42.03 H new ATOM 0 HG21 THR A 84 21.608 1.036 -11.230 1.00 11.31 H new ATOM 0 HG22 THR A 84 21.536 1.977 -12.739 1.00 11.31 H new ATOM 0 HG23 THR A 84 20.159 1.995 -11.612 1.00 11.31 H new ATOM 1357 N SER A 85 20.870 0.979 -15.811 1.00 5.33 N ATOM 1358 CA SER A 85 21.654 1.752 -16.768 1.00 30.51 C ATOM 1359 C SER A 85 20.760 2.699 -17.562 1.00 44.24 C ATOM 1360 O SER A 85 20.973 3.912 -17.569 1.00 42.43 O ATOM 1361 CB SER A 85 22.400 0.816 -17.721 1.00 74.14 C ATOM 1362 OG SER A 85 23.350 1.528 -18.494 1.00 64.45 O ATOM 0 H SER A 85 20.884 -0.028 -15.970 1.00 5.33 H new ATOM 0 HA SER A 85 22.379 2.346 -16.212 1.00 30.51 H new ATOM 0 HB2 SER A 85 22.903 0.035 -17.150 1.00 74.14 H new ATOM 0 HB3 SER A 85 21.688 0.320 -18.381 1.00 74.14 H new ATOM 0 HG SER A 85 23.815 0.908 -19.094 1.00 64.45 H new ATOM 1368 N LEU A 86 19.760 2.137 -18.231 1.00 73.00 N ATOM 1369 CA LEU A 86 18.832 2.930 -19.030 1.00 1.52 C ATOM 1370 C LEU A 86 18.253 4.079 -18.211 1.00 11.45 C ATOM 1371 O LEU A 86 17.922 5.135 -18.751 1.00 24.12 O ATOM 1372 CB LEU A 86 17.702 2.048 -19.561 1.00 73.44 C ATOM 1373 CG LEU A 86 18.126 0.718 -20.186 1.00 33.21 C ATOM 1374 CD1 LEU A 86 16.924 -0.001 -20.778 1.00 34.30 C ATOM 1375 CD2 LEU A 86 19.191 0.943 -21.249 1.00 3.34 C ATOM 0 H LEU A 86 19.571 1.135 -18.236 1.00 73.00 H new ATOM 0 HA LEU A 86 19.383 3.349 -19.872 1.00 1.52 H new ATOM 0 HB2 LEU A 86 17.015 1.839 -18.741 1.00 73.44 H new ATOM 0 HB3 LEU A 86 17.145 2.615 -20.306 1.00 73.44 H new ATOM 0 HG LEU A 86 18.550 0.090 -19.403 1.00 33.21 H new ATOM 0 HD11 LEU A 86 17.245 -0.945 -21.218 1.00 34.30 H new ATOM 0 HD12 LEU A 86 16.194 -0.197 -19.993 1.00 34.30 H new ATOM 0 HD13 LEU A 86 16.470 0.623 -21.548 1.00 34.30 H new ATOM 0 HD21 LEU A 86 19.480 -0.014 -21.683 1.00 3.34 H new ATOM 0 HD22 LEU A 86 18.794 1.590 -22.031 1.00 3.34 H new ATOM 0 HD23 LEU A 86 20.063 1.415 -20.796 1.00 3.34 H new ATOM 1387 N TRP A 87 18.135 3.867 -16.905 1.00 1.01 N ATOM 1388 CA TRP A 87 17.598 4.886 -16.010 1.00 52.25 C ATOM 1389 C TRP A 87 18.323 6.214 -16.200 1.00 21.10 C ATOM 1390 O TRP A 87 17.698 7.274 -16.227 1.00 20.42 O ATOM 1391 CB TRP A 87 17.715 4.430 -14.555 1.00 40.12 C ATOM 1392 CG TRP A 87 16.499 4.741 -13.735 1.00 45.15 C ATOM 1393 CD1 TRP A 87 15.597 5.743 -13.955 1.00 24.23 C ATOM 1394 CD2 TRP A 87 16.055 4.047 -12.565 1.00 33.11 C ATOM 1395 NE1 TRP A 87 14.619 5.713 -12.991 1.00 14.23 N ATOM 1396 CE2 TRP A 87 14.876 4.682 -12.127 1.00 72.40 C ATOM 1397 CE3 TRP A 87 16.536 2.950 -11.845 1.00 40.04 C ATOM 1398 CZ2 TRP A 87 14.175 4.255 -11.002 1.00 51.02 C ATOM 1399 CZ3 TRP A 87 15.839 2.528 -10.729 1.00 44.10 C ATOM 1400 CH2 TRP A 87 14.669 3.179 -10.317 1.00 30.34 C ATOM 0 H TRP A 87 18.404 2.999 -16.442 1.00 1.01 H new ATOM 0 HA TRP A 87 16.545 5.030 -16.254 1.00 52.25 H new ATOM 0 HB2 TRP A 87 17.895 3.355 -14.532 1.00 40.12 H new ATOM 0 HB3 TRP A 87 18.583 4.908 -14.101 1.00 40.12 H new ATOM 0 HD1 TRP A 87 15.646 6.454 -14.767 1.00 24.23 H new ATOM 0 HE1 TRP A 87 13.829 6.355 -12.929 1.00 14.23 H new ATOM 0 HE3 TRP A 87 17.437 2.441 -12.155 1.00 40.04 H new ATOM 0 HZ2 TRP A 87 13.273 4.756 -10.682 1.00 51.02 H new ATOM 0 HZ3 TRP A 87 16.202 1.682 -10.165 1.00 44.10 H new ATOM 0 HH2 TRP A 87 14.147 2.824 -9.441 1.00 30.34 H new ATOM 1411 N GLN A 88 19.644 6.148 -16.331 1.00 41.20 N ATOM 1412 CA GLN A 88 20.453 7.347 -16.518 1.00 23.24 C ATOM 1413 C GLN A 88 19.959 8.157 -17.711 1.00 71.15 C ATOM 1414 O GLN A 88 19.978 9.387 -17.691 1.00 22.24 O ATOM 1415 CB GLN A 88 21.923 6.970 -16.715 1.00 54.20 C ATOM 1416 CG GLN A 88 22.889 8.097 -16.387 1.00 31.12 C ATOM 1417 CD GLN A 88 24.257 7.591 -15.974 1.00 32.35 C ATOM 1418 OE1 GLN A 88 25.263 7.894 -16.614 1.00 45.24 O ATOM 1419 NE2 GLN A 88 24.301 6.814 -14.897 1.00 53.41 N ATOM 0 H GLN A 88 20.176 5.278 -16.311 1.00 41.20 H new ATOM 0 HA GLN A 88 20.359 7.961 -15.622 1.00 23.24 H new ATOM 0 HB2 GLN A 88 22.156 6.109 -16.088 1.00 54.20 H new ATOM 0 HB3 GLN A 88 22.075 6.662 -17.749 1.00 54.20 H new ATOM 0 HG2 GLN A 88 22.993 8.746 -17.257 1.00 31.12 H new ATOM 0 HG3 GLN A 88 22.473 8.705 -15.584 1.00 31.12 H new ATOM 0 HE21 GLN A 88 23.442 6.588 -14.396 1.00 53.41 H new ATOM 0 HE22 GLN A 88 25.194 6.444 -14.571 1.00 53.41 H new ATOM 1428 N GLY A 89 19.516 7.458 -18.752 1.00 43.05 N ATOM 1429 CA GLY A 89 19.024 8.129 -19.941 1.00 54.21 C ATOM 1430 C GLY A 89 17.822 9.007 -19.655 1.00 14.31 C ATOM 1431 O GLY A 89 17.742 10.138 -20.136 1.00 33.35 O ATOM 0 H GLY A 89 19.489 6.439 -18.793 1.00 43.05 H new ATOM 0 HA2 GLY A 89 19.821 8.738 -20.367 1.00 54.21 H new ATOM 0 HA3 GLY A 89 18.756 7.384 -20.690 1.00 54.21 H new ATOM 1435 N SER A 90 16.883 8.486 -18.871 1.00 41.11 N ATOM 1436 CA SER A 90 15.676 9.228 -18.526 1.00 44.51 C ATOM 1437 C SER A 90 16.027 10.558 -17.865 1.00 31.02 C ATOM 1438 O SER A 90 15.303 11.545 -18.005 1.00 60.34 O ATOM 1439 CB SER A 90 14.791 8.400 -17.593 1.00 64.52 C ATOM 1440 OG SER A 90 13.444 8.835 -17.648 1.00 1.43 O ATOM 0 H SER A 90 16.935 7.553 -18.463 1.00 41.11 H new ATOM 0 HA SER A 90 15.129 9.432 -19.447 1.00 44.51 H new ATOM 0 HB2 SER A 90 14.848 7.348 -17.872 1.00 64.52 H new ATOM 0 HB3 SER A 90 15.161 8.480 -16.571 1.00 64.52 H new ATOM 0 HG SER A 90 13.419 9.807 -17.773 1.00 1.43 H new ATOM 1446 N LEU A 91 17.142 10.576 -17.143 1.00 50.51 N ATOM 1447 CA LEU A 91 17.591 11.784 -16.459 1.00 15.31 C ATOM 1448 C LEU A 91 17.642 12.968 -17.420 1.00 75.41 C ATOM 1449 O LEU A 91 17.106 14.038 -17.132 1.00 53.15 O ATOM 1450 CB LEU A 91 18.969 11.559 -15.836 1.00 22.02 C ATOM 1451 CG LEU A 91 19.264 12.342 -14.556 1.00 15.30 C ATOM 1452 CD1 LEU A 91 20.701 12.119 -14.112 1.00 52.01 C ATOM 1453 CD2 LEU A 91 18.992 13.825 -14.764 1.00 11.11 C ATOM 0 H LEU A 91 17.752 9.768 -17.016 1.00 50.51 H new ATOM 0 HA LEU A 91 16.875 12.011 -15.669 1.00 15.31 H new ATOM 0 HB2 LEU A 91 19.079 10.496 -15.621 1.00 22.02 H new ATOM 0 HB3 LEU A 91 19.726 11.815 -16.577 1.00 22.02 H new ATOM 0 HG LEU A 91 18.603 11.978 -13.770 1.00 15.30 H new ATOM 0 HD11 LEU A 91 20.892 12.684 -13.200 1.00 52.01 H new ATOM 0 HD12 LEU A 91 20.863 11.058 -13.922 1.00 52.01 H new ATOM 0 HD13 LEU A 91 21.380 12.455 -14.896 1.00 52.01 H new ATOM 0 HD21 LEU A 91 19.207 14.367 -13.843 1.00 11.11 H new ATOM 0 HD22 LEU A 91 19.628 14.203 -15.565 1.00 11.11 H new ATOM 0 HD23 LEU A 91 17.946 13.969 -15.034 1.00 11.11 H new ATOM 1465 N PHE A 92 18.288 12.767 -18.564 1.00 33.32 N ATOM 1466 CA PHE A 92 18.408 13.817 -19.569 1.00 34.43 C ATOM 1467 C PHE A 92 17.036 14.218 -20.102 1.00 74.15 C ATOM 1468 O PHE A 92 16.801 15.380 -20.429 1.00 51.44 O ATOM 1469 CB PHE A 92 19.299 13.349 -20.721 1.00 40.42 C ATOM 1470 CG PHE A 92 19.757 14.466 -21.616 1.00 32.14 C ATOM 1471 CD1 PHE A 92 20.924 15.159 -21.339 1.00 24.34 C ATOM 1472 CD2 PHE A 92 19.020 14.822 -22.734 1.00 0.35 C ATOM 1473 CE1 PHE A 92 21.347 16.187 -22.160 1.00 24.15 C ATOM 1474 CE2 PHE A 92 19.438 15.849 -23.558 1.00 43.55 C ATOM 1475 CZ PHE A 92 20.604 16.532 -23.271 1.00 61.15 C ATOM 0 H PHE A 92 18.736 11.887 -18.818 1.00 33.32 H new ATOM 0 HA PHE A 92 18.863 14.688 -19.097 1.00 34.43 H new ATOM 0 HB2 PHE A 92 20.172 12.841 -20.311 1.00 40.42 H new ATOM 0 HB3 PHE A 92 18.754 12.617 -21.317 1.00 40.42 H new ATOM 0 HD1 PHE A 92 21.510 14.893 -20.472 1.00 24.34 H new ATOM 0 HD2 PHE A 92 18.108 14.291 -22.964 1.00 0.35 H new ATOM 0 HE1 PHE A 92 22.258 16.720 -21.933 1.00 24.15 H new ATOM 0 HE2 PHE A 92 18.854 16.118 -24.426 1.00 43.55 H new ATOM 0 HZ PHE A 92 20.934 17.334 -23.915 1.00 61.15 H new ATOM 1485 N ASN A 93 16.133 13.246 -20.188 1.00 62.10 N ATOM 1486 CA ASN A 93 14.784 13.497 -20.683 1.00 65.41 C ATOM 1487 C ASN A 93 14.020 14.418 -19.737 1.00 44.34 C ATOM 1488 O ASN A 93 13.589 15.503 -20.126 1.00 15.10 O ATOM 1489 CB ASN A 93 14.027 12.178 -20.851 1.00 31.14 C ATOM 1490 CG ASN A 93 12.595 12.387 -21.303 1.00 52.25 C ATOM 1491 OD1 ASN A 93 11.773 12.934 -20.568 1.00 2.42 O ATOM 1492 ND2 ASN A 93 12.289 11.951 -22.520 1.00 44.10 N ATOM 0 H ASN A 93 16.311 12.278 -19.921 1.00 62.10 H new ATOM 0 HA ASN A 93 14.865 13.988 -21.653 1.00 65.41 H new ATOM 0 HB2 ASN A 93 14.547 11.554 -21.578 1.00 31.14 H new ATOM 0 HB3 ASN A 93 14.031 11.637 -19.905 1.00 31.14 H new ATOM 0 HD21 ASN A 93 11.341 12.064 -22.879 1.00 44.10 H new ATOM 0 HD22 ASN A 93 13.002 11.503 -23.096 1.00 44.10 H new ATOM 1499 N ALA A 94 13.858 13.978 -18.494 1.00 2.31 N ATOM 1500 CA ALA A 94 13.149 14.764 -17.492 1.00 1.31 C ATOM 1501 C ALA A 94 13.818 14.646 -16.127 1.00 21.43 C ATOM 1502 O ALA A 94 14.504 15.563 -15.680 1.00 3.54 O ATOM 1503 CB ALA A 94 11.695 14.325 -17.409 1.00 53.20 C ATOM 0 H ALA A 94 14.208 13.081 -18.157 1.00 2.31 H new ATOM 0 HA ALA A 94 13.184 15.810 -17.795 1.00 1.31 H new ATOM 0 HB1 ALA A 94 11.178 14.920 -16.657 1.00 53.20 H new ATOM 0 HB2 ALA A 94 11.216 14.468 -18.378 1.00 53.20 H new ATOM 0 HB3 ALA A 94 11.648 13.272 -17.133 1.00 53.20 H new ATOM 1509 N ASN A 95 13.613 13.509 -15.469 1.00 15.10 N ATOM 1510 CA ASN A 95 14.195 13.271 -14.153 1.00 43.33 C ATOM 1511 C ASN A 95 13.814 11.889 -13.631 1.00 40.42 C ATOM 1512 O ASN A 95 13.176 11.764 -12.585 1.00 64.55 O ATOM 1513 CB ASN A 95 13.735 14.346 -13.167 1.00 11.42 C ATOM 1514 CG ASN A 95 12.240 14.591 -13.234 1.00 73.22 C ATOM 1515 OD1 ASN A 95 11.472 13.709 -13.619 1.00 30.45 O ATOM 1516 ND2 ASN A 95 11.820 15.794 -12.860 1.00 34.31 N ATOM 0 H ASN A 95 13.048 12.738 -15.826 1.00 15.10 H new ATOM 0 HA ASN A 95 15.280 13.317 -14.250 1.00 43.33 H new ATOM 0 HB2 ASN A 95 14.006 14.046 -12.155 1.00 11.42 H new ATOM 0 HB3 ASN A 95 14.263 15.277 -13.376 1.00 11.42 H new ATOM 0 HD21 ASN A 95 10.825 16.017 -12.885 1.00 34.31 H new ATOM 0 HD22 ASN A 95 12.492 16.495 -12.548 1.00 34.31 H new ATOM 1523 N TYR A 96 14.209 10.856 -14.366 1.00 63.21 N ATOM 1524 CA TYR A 96 13.908 9.483 -13.979 1.00 32.13 C ATOM 1525 C TYR A 96 12.401 9.261 -13.886 1.00 2.45 C ATOM 1526 O TYR A 96 11.774 9.597 -12.881 1.00 0.32 O ATOM 1527 CB TYR A 96 14.567 9.152 -12.639 1.00 10.44 C ATOM 1528 CG TYR A 96 16.074 9.280 -12.657 1.00 75.41 C ATOM 1529 CD1 TYR A 96 16.818 8.799 -13.728 1.00 34.34 C ATOM 1530 CD2 TYR A 96 16.753 9.879 -11.604 1.00 50.52 C ATOM 1531 CE1 TYR A 96 18.194 8.912 -13.749 1.00 23.03 C ATOM 1532 CE2 TYR A 96 18.129 9.998 -11.617 1.00 41.45 C ATOM 1533 CZ TYR A 96 18.845 9.513 -12.692 1.00 23.03 C ATOM 1534 OH TYR A 96 20.216 9.628 -12.708 1.00 45.30 O ATOM 0 H TYR A 96 14.739 10.943 -15.233 1.00 63.21 H new ATOM 0 HA TYR A 96 14.308 8.820 -14.746 1.00 32.13 H new ATOM 0 HB2 TYR A 96 14.164 9.813 -11.872 1.00 10.44 H new ATOM 0 HB3 TYR A 96 14.301 8.134 -12.354 1.00 10.44 H new ATOM 0 HD1 TYR A 96 16.311 8.329 -14.558 1.00 34.34 H new ATOM 0 HD2 TYR A 96 16.195 10.258 -10.760 1.00 50.52 H new ATOM 0 HE1 TYR A 96 18.757 8.532 -14.588 1.00 23.03 H new ATOM 0 HE2 TYR A 96 18.641 10.468 -10.791 1.00 41.45 H new ATOM 0 HH TYR A 96 20.516 10.076 -11.890 1.00 45.30 H new ATOM 1544 N ASP A 97 11.827 8.693 -14.940 1.00 42.22 N ATOM 1545 CA ASP A 97 10.394 8.424 -14.979 1.00 4.24 C ATOM 1546 C ASP A 97 10.124 6.923 -14.998 1.00 13.14 C ATOM 1547 O ASP A 97 9.751 6.362 -16.028 1.00 33.10 O ATOM 1548 CB ASP A 97 9.763 9.085 -16.205 1.00 34.41 C ATOM 1549 CG ASP A 97 9.255 10.483 -15.912 1.00 62.05 C ATOM 1550 OD1 ASP A 97 8.203 10.606 -15.252 1.00 32.31 O ATOM 1551 OD2 ASP A 97 9.910 11.455 -16.345 1.00 30.30 O ATOM 0 H ASP A 97 12.332 8.410 -15.780 1.00 42.22 H new ATOM 0 HA ASP A 97 9.945 8.844 -14.079 1.00 4.24 H new ATOM 0 HB2 ASP A 97 10.498 9.130 -17.009 1.00 34.41 H new ATOM 0 HB3 ASP A 97 8.938 8.469 -16.562 1.00 34.41 H new ATOM 1556 N VAL A 98 10.315 6.278 -13.851 1.00 60.34 N ATOM 1557 CA VAL A 98 10.092 4.842 -13.736 1.00 74.51 C ATOM 1558 C VAL A 98 9.220 4.516 -12.528 1.00 43.11 C ATOM 1559 O VAL A 98 9.308 5.175 -11.493 1.00 12.25 O ATOM 1560 CB VAL A 98 11.422 4.074 -13.617 1.00 51.33 C ATOM 1561 CG1 VAL A 98 11.182 2.574 -13.691 1.00 14.13 C ATOM 1562 CG2 VAL A 98 12.392 4.521 -14.700 1.00 64.23 C ATOM 0 H VAL A 98 10.624 6.727 -12.989 1.00 60.34 H new ATOM 0 HA VAL A 98 9.580 4.528 -14.646 1.00 74.51 H new ATOM 0 HB VAL A 98 11.866 4.298 -12.647 1.00 51.33 H new ATOM 0 HG11 VAL A 98 12.133 2.049 -13.605 1.00 14.13 H new ATOM 0 HG12 VAL A 98 10.525 2.270 -12.876 1.00 14.13 H new ATOM 0 HG13 VAL A 98 10.716 2.327 -14.645 1.00 14.13 H new ATOM 0 HG21 VAL A 98 13.327 3.969 -14.602 1.00 64.23 H new ATOM 0 HG22 VAL A 98 11.957 4.327 -15.681 1.00 64.23 H new ATOM 0 HG23 VAL A 98 12.588 5.588 -14.595 1.00 64.23 H new ATOM 1572 N GLN A 99 8.381 3.496 -12.669 1.00 34.52 N ATOM 1573 CA GLN A 99 7.493 3.083 -11.588 1.00 72.23 C ATOM 1574 C GLN A 99 7.577 1.577 -11.360 1.00 12.33 C ATOM 1575 O GLN A 99 7.747 0.805 -12.303 1.00 44.01 O ATOM 1576 CB GLN A 99 6.051 3.483 -11.904 1.00 14.12 C ATOM 1577 CG GLN A 99 5.883 4.962 -12.211 1.00 41.34 C ATOM 1578 CD GLN A 99 5.499 5.218 -13.655 1.00 40.34 C ATOM 1579 OE1 GLN A 99 4.525 4.658 -14.159 1.00 41.45 O ATOM 1580 NE2 GLN A 99 6.264 6.068 -14.330 1.00 43.41 N ATOM 0 H GLN A 99 8.297 2.940 -13.520 1.00 34.52 H new ATOM 0 HA GLN A 99 7.812 3.588 -10.676 1.00 72.23 H new ATOM 0 HB2 GLN A 99 5.700 2.901 -12.756 1.00 14.12 H new ATOM 0 HB3 GLN A 99 5.416 3.222 -11.057 1.00 14.12 H new ATOM 0 HG2 GLN A 99 5.119 5.381 -11.556 1.00 41.34 H new ATOM 0 HG3 GLN A 99 6.814 5.483 -11.989 1.00 41.34 H new ATOM 0 HE21 GLN A 99 7.062 6.510 -13.873 1.00 43.41 H new ATOM 0 HE22 GLN A 99 6.054 6.279 -15.306 1.00 43.41 H new ATOM 1589 N ARG A 100 7.456 1.167 -10.101 1.00 42.23 N ATOM 1590 CA ARG A 100 7.520 -0.246 -9.749 1.00 21.02 C ATOM 1591 C ARG A 100 6.406 -0.614 -8.774 1.00 34.22 C ATOM 1592 O ARG A 100 6.026 0.185 -7.918 1.00 3.24 O ATOM 1593 CB ARG A 100 8.881 -0.579 -9.134 1.00 72.21 C ATOM 1594 CG ARG A 100 9.163 -2.070 -9.052 1.00 65.32 C ATOM 1595 CD ARG A 100 10.035 -2.407 -7.853 1.00 23.04 C ATOM 1596 NE ARG A 100 9.318 -2.243 -6.591 1.00 73.12 N ATOM 1597 CZ ARG A 100 9.920 -2.104 -5.416 1.00 3.04 C ATOM 1598 NH1 ARG A 100 11.244 -2.108 -5.341 1.00 20.42 N ATOM 1599 NH2 ARG A 100 9.198 -1.960 -4.312 1.00 4.53 N ATOM 0 H ARG A 100 7.313 1.793 -9.309 1.00 42.23 H new ATOM 0 HA ARG A 100 7.389 -0.828 -10.661 1.00 21.02 H new ATOM 0 HB2 ARG A 100 9.663 -0.102 -9.724 1.00 72.21 H new ATOM 0 HB3 ARG A 100 8.932 -0.152 -8.132 1.00 72.21 H new ATOM 0 HG2 ARG A 100 8.222 -2.616 -8.984 1.00 65.32 H new ATOM 0 HG3 ARG A 100 9.657 -2.399 -9.966 1.00 65.32 H new ATOM 0 HD2 ARG A 100 10.387 -3.435 -7.939 1.00 23.04 H new ATOM 0 HD3 ARG A 100 10.917 -1.766 -7.855 1.00 23.04 H new ATOM 0 HE ARG A 100 8.298 -2.235 -6.614 1.00 73.12 H new ATOM 0 HH11 ARG A 100 11.802 -2.218 -6.187 1.00 20.42 H new ATOM 0 HH12 ARG A 100 11.704 -2.001 -4.437 1.00 20.42 H new ATOM 0 HH21 ARG A 100 8.179 -1.956 -4.366 1.00 4.53 H new ATOM 0 HH22 ARG A 100 9.662 -1.853 -3.410 1.00 4.53 H new ATOM 1613 N PHE A 101 5.885 -1.829 -8.910 1.00 74.02 N ATOM 1614 CA PHE A 101 4.812 -2.303 -8.043 1.00 4.23 C ATOM 1615 C PHE A 101 4.893 -3.815 -7.855 1.00 74.13 C ATOM 1616 O PHE A 101 5.268 -4.546 -8.773 1.00 5.44 O ATOM 1617 CB PHE A 101 3.450 -1.921 -8.625 1.00 60.22 C ATOM 1618 CG PHE A 101 2.337 -1.954 -7.617 1.00 53.05 C ATOM 1619 CD1 PHE A 101 2.219 -0.957 -6.663 1.00 1.31 C ATOM 1620 CD2 PHE A 101 1.408 -2.982 -7.625 1.00 22.45 C ATOM 1621 CE1 PHE A 101 1.196 -0.984 -5.734 1.00 54.43 C ATOM 1622 CE2 PHE A 101 0.382 -3.014 -6.699 1.00 24.32 C ATOM 1623 CZ PHE A 101 0.277 -2.014 -5.752 1.00 33.52 C ATOM 0 H PHE A 101 6.188 -2.504 -9.612 1.00 74.02 H new ATOM 0 HA PHE A 101 4.928 -1.827 -7.069 1.00 4.23 H new ATOM 0 HB2 PHE A 101 3.514 -0.920 -9.051 1.00 60.22 H new ATOM 0 HB3 PHE A 101 3.209 -2.601 -9.442 1.00 60.22 H new ATOM 0 HD1 PHE A 101 2.935 -0.149 -6.645 1.00 1.31 H new ATOM 0 HD2 PHE A 101 1.486 -3.767 -8.363 1.00 22.45 H new ATOM 0 HE1 PHE A 101 1.116 -0.200 -4.995 1.00 54.43 H new ATOM 0 HE2 PHE A 101 -0.337 -3.820 -6.716 1.00 24.32 H new ATOM 0 HZ PHE A 101 -0.523 -2.038 -5.027 1.00 33.52 H new ATOM 1633 N ILE A 102 4.537 -4.277 -6.661 1.00 43.22 N ATOM 1634 CA ILE A 102 4.568 -5.701 -6.353 1.00 63.23 C ATOM 1635 C ILE A 102 3.299 -6.135 -5.628 1.00 52.33 C ATOM 1636 O ILE A 102 2.948 -5.584 -4.584 1.00 62.15 O ATOM 1637 CB ILE A 102 5.790 -6.064 -5.488 1.00 14.42 C ATOM 1638 CG1 ILE A 102 7.084 -5.681 -6.208 1.00 41.10 C ATOM 1639 CG2 ILE A 102 5.781 -7.548 -5.155 1.00 61.10 C ATOM 1640 CD1 ILE A 102 8.271 -5.537 -5.282 1.00 23.34 C ATOM 0 H ILE A 102 4.224 -3.686 -5.891 1.00 43.22 H new ATOM 0 HA ILE A 102 4.638 -6.228 -7.305 1.00 63.23 H new ATOM 0 HB ILE A 102 5.736 -5.502 -4.555 1.00 14.42 H new ATOM 0 HG12 ILE A 102 7.310 -6.438 -6.960 1.00 41.10 H new ATOM 0 HG13 ILE A 102 6.931 -4.741 -6.738 1.00 41.10 H new ATOM 0 HG21 ILE A 102 6.651 -7.789 -4.543 1.00 61.10 H new ATOM 0 HG22 ILE A 102 4.872 -7.792 -4.605 1.00 61.10 H new ATOM 0 HG23 ILE A 102 5.814 -8.128 -6.077 1.00 61.10 H new ATOM 0 HD11 ILE A 102 9.153 -5.264 -5.861 1.00 23.34 H new ATOM 0 HD12 ILE A 102 8.066 -4.760 -4.546 1.00 23.34 H new ATOM 0 HD13 ILE A 102 8.451 -6.483 -4.771 1.00 23.34 H new ATOM 1652 N VAL A 103 2.614 -7.127 -6.188 1.00 13.11 N ATOM 1653 CA VAL A 103 1.384 -7.637 -5.593 1.00 61.45 C ATOM 1654 C VAL A 103 1.192 -9.116 -5.913 1.00 11.35 C ATOM 1655 O VAL A 103 1.241 -9.523 -7.072 1.00 52.34 O ATOM 1656 CB VAL A 103 0.154 -6.853 -6.087 1.00 41.23 C ATOM 1657 CG1 VAL A 103 0.075 -6.883 -7.606 1.00 65.41 C ATOM 1658 CG2 VAL A 103 -1.118 -7.412 -5.468 1.00 41.10 C ATOM 0 H VAL A 103 2.890 -7.593 -7.052 1.00 13.11 H new ATOM 0 HA VAL A 103 1.477 -7.510 -4.514 1.00 61.45 H new ATOM 0 HB VAL A 103 0.258 -5.814 -5.773 1.00 41.23 H new ATOM 0 HG11 VAL A 103 -0.801 -6.324 -7.936 1.00 65.41 H new ATOM 0 HG12 VAL A 103 0.974 -6.431 -8.026 1.00 65.41 H new ATOM 0 HG13 VAL A 103 -0.005 -7.916 -7.946 1.00 65.41 H new ATOM 0 HG21 VAL A 103 -1.977 -6.846 -5.828 1.00 41.10 H new ATOM 0 HG22 VAL A 103 -1.230 -8.459 -5.749 1.00 41.10 H new ATOM 0 HG23 VAL A 103 -1.060 -7.332 -4.382 1.00 41.10 H new ATOM 1668 N GLY A 104 0.972 -9.916 -4.874 1.00 24.23 N ATOM 1669 CA GLY A 104 0.776 -11.341 -5.064 1.00 74.40 C ATOM 1670 C GLY A 104 2.051 -12.054 -5.467 1.00 61.03 C ATOM 1671 O GLY A 104 3.128 -11.751 -4.955 1.00 4.24 O ATOM 0 H GLY A 104 0.926 -9.603 -3.904 1.00 24.23 H new ATOM 0 HA2 GLY A 104 0.395 -11.778 -4.141 1.00 74.40 H new ATOM 0 HA3 GLY A 104 0.017 -11.501 -5.829 1.00 74.40 H new ATOM 1675 N SER A 105 1.930 -13.006 -6.388 1.00 10.55 N ATOM 1676 CA SER A 105 3.082 -13.768 -6.855 1.00 51.44 C ATOM 1677 C SER A 105 3.595 -13.216 -8.182 1.00 64.41 C ATOM 1678 O SER A 105 4.516 -13.771 -8.783 1.00 0.14 O ATOM 1679 CB SER A 105 2.714 -15.244 -7.012 1.00 33.21 C ATOM 1680 OG SER A 105 1.414 -15.502 -6.510 1.00 13.30 O ATOM 0 H SER A 105 1.046 -13.267 -6.825 1.00 10.55 H new ATOM 0 HA SER A 105 3.874 -13.676 -6.112 1.00 51.44 H new ATOM 0 HB2 SER A 105 2.763 -15.524 -8.064 1.00 33.21 H new ATOM 0 HB3 SER A 105 3.440 -15.861 -6.483 1.00 33.21 H new ATOM 0 HG SER A 105 1.202 -16.452 -6.624 1.00 13.30 H new ATOM 1686 N ASP A 106 2.993 -12.122 -8.633 1.00 42.42 N ATOM 1687 CA ASP A 106 3.389 -11.493 -9.888 1.00 61.32 C ATOM 1688 C ASP A 106 3.740 -10.024 -9.673 1.00 63.35 C ATOM 1689 O ASP A 106 3.129 -9.344 -8.850 1.00 10.15 O ATOM 1690 CB ASP A 106 2.268 -11.617 -10.921 1.00 53.30 C ATOM 1691 CG ASP A 106 0.951 -11.060 -10.416 1.00 3.23 C ATOM 1692 OD1 ASP A 106 0.810 -9.820 -10.370 1.00 54.44 O ATOM 1693 OD2 ASP A 106 0.062 -11.864 -10.066 1.00 65.03 O ATOM 0 H ASP A 106 2.229 -11.652 -8.149 1.00 42.42 H new ATOM 0 HA ASP A 106 4.274 -12.008 -10.261 1.00 61.32 H new ATOM 0 HB2 ASP A 106 2.557 -11.091 -11.831 1.00 53.30 H new ATOM 0 HB3 ASP A 106 2.137 -12.666 -11.187 1.00 53.30 H new ATOM 1698 N ARG A 107 4.729 -9.542 -10.419 1.00 61.53 N ATOM 1699 CA ARG A 107 5.163 -8.155 -10.309 1.00 22.13 C ATOM 1700 C ARG A 107 5.119 -7.462 -11.667 1.00 55.42 C ATOM 1701 O ARG A 107 5.293 -8.098 -12.706 1.00 2.20 O ATOM 1702 CB ARG A 107 6.580 -8.086 -9.735 1.00 53.31 C ATOM 1703 CG ARG A 107 6.698 -8.664 -8.334 1.00 45.34 C ATOM 1704 CD ARG A 107 6.897 -10.171 -8.369 1.00 31.03 C ATOM 1705 NE ARG A 107 7.481 -10.675 -7.129 1.00 4.53 N ATOM 1706 CZ ARG A 107 7.788 -11.951 -6.926 1.00 34.12 C ATOM 1707 NH1 ARG A 107 7.566 -12.849 -7.876 1.00 42.54 N ATOM 1708 NH2 ARG A 107 8.317 -12.332 -5.770 1.00 72.22 N ATOM 0 H ARG A 107 5.245 -10.092 -11.106 1.00 61.53 H new ATOM 0 HA ARG A 107 4.479 -7.639 -9.635 1.00 22.13 H new ATOM 0 HB2 ARG A 107 7.258 -8.622 -10.399 1.00 53.31 H new ATOM 0 HB3 ARG A 107 6.906 -7.046 -9.719 1.00 53.31 H new ATOM 0 HG2 ARG A 107 7.536 -8.197 -7.816 1.00 45.34 H new ATOM 0 HG3 ARG A 107 5.799 -8.428 -7.765 1.00 45.34 H new ATOM 0 HD2 ARG A 107 5.938 -10.659 -8.543 1.00 31.03 H new ATOM 0 HD3 ARG A 107 7.544 -10.432 -9.207 1.00 31.03 H new ATOM 0 HE ARG A 107 7.663 -10.010 -6.377 1.00 4.53 H new ATOM 0 HH11 ARG A 107 7.158 -12.560 -8.765 1.00 42.54 H new ATOM 0 HH12 ARG A 107 7.803 -13.828 -7.717 1.00 42.54 H new ATOM 0 HH21 ARG A 107 8.488 -11.644 -5.036 1.00 72.22 H new ATOM 0 HH22 ARG A 107 8.552 -13.312 -5.615 1.00 72.22 H new ATOM 1722 N ALA A 108 4.883 -6.154 -11.651 1.00 11.34 N ATOM 1723 CA ALA A 108 4.817 -5.374 -12.880 1.00 53.23 C ATOM 1724 C ALA A 108 5.875 -4.276 -12.892 1.00 23.31 C ATOM 1725 O ALA A 108 6.197 -3.700 -11.852 1.00 73.12 O ATOM 1726 CB ALA A 108 3.429 -4.773 -13.050 1.00 61.33 C ATOM 0 H ALA A 108 4.734 -5.612 -10.800 1.00 11.34 H new ATOM 0 HA ALA A 108 5.017 -6.044 -13.716 1.00 53.23 H new ATOM 0 HB1 ALA A 108 3.394 -4.193 -13.972 1.00 61.33 H new ATOM 0 HB2 ALA A 108 2.689 -5.572 -13.096 1.00 61.33 H new ATOM 0 HB3 ALA A 108 3.208 -4.123 -12.204 1.00 61.33 H new ATOM 1732 N ILE A 109 6.414 -3.993 -14.073 1.00 11.30 N ATOM 1733 CA ILE A 109 7.436 -2.964 -14.219 1.00 0.23 C ATOM 1734 C ILE A 109 7.086 -1.996 -15.344 1.00 34.21 C ATOM 1735 O ILE A 109 6.533 -2.394 -16.370 1.00 23.01 O ATOM 1736 CB ILE A 109 8.819 -3.580 -14.499 1.00 23.20 C ATOM 1737 CG1 ILE A 109 9.864 -2.478 -14.690 1.00 34.32 C ATOM 1738 CG2 ILE A 109 8.760 -4.479 -15.725 1.00 30.21 C ATOM 1739 CD1 ILE A 109 10.022 -1.581 -13.483 1.00 2.53 C ATOM 0 H ILE A 109 6.160 -4.462 -14.943 1.00 11.30 H new ATOM 0 HA ILE A 109 7.473 -2.421 -13.275 1.00 0.23 H new ATOM 0 HB ILE A 109 9.110 -4.186 -13.641 1.00 23.20 H new ATOM 0 HG12 ILE A 109 10.826 -2.936 -14.921 1.00 34.32 H new ATOM 0 HG13 ILE A 109 9.586 -1.870 -15.551 1.00 34.32 H new ATOM 0 HG21 ILE A 109 9.745 -4.907 -15.910 1.00 30.21 H new ATOM 0 HG22 ILE A 109 8.042 -5.281 -15.554 1.00 30.21 H new ATOM 0 HG23 ILE A 109 8.450 -3.894 -16.591 1.00 30.21 H new ATOM 0 HD11 ILE A 109 10.778 -0.824 -13.689 1.00 2.53 H new ATOM 0 HD12 ILE A 109 9.071 -1.095 -13.264 1.00 2.53 H new ATOM 0 HD13 ILE A 109 10.330 -2.177 -12.624 1.00 2.53 H new ATOM 1751 N PHE A 110 7.412 -0.723 -15.145 1.00 72.34 N ATOM 1752 CA PHE A 110 7.132 0.302 -16.144 1.00 5.12 C ATOM 1753 C PHE A 110 8.173 1.417 -16.084 1.00 73.13 C ATOM 1754 O PHE A 110 8.331 2.078 -15.058 1.00 64.24 O ATOM 1755 CB PHE A 110 5.733 0.883 -15.931 1.00 41.23 C ATOM 1756 CG PHE A 110 5.213 1.643 -17.118 1.00 32.11 C ATOM 1757 CD1 PHE A 110 5.812 2.827 -17.516 1.00 65.24 C ATOM 1758 CD2 PHE A 110 4.125 1.173 -17.835 1.00 74.03 C ATOM 1759 CE1 PHE A 110 5.335 3.528 -18.607 1.00 41.15 C ATOM 1760 CE2 PHE A 110 3.643 1.870 -18.928 1.00 20.24 C ATOM 1761 CZ PHE A 110 4.250 3.048 -19.315 1.00 11.43 C ATOM 0 H PHE A 110 7.870 -0.377 -14.302 1.00 72.34 H new ATOM 0 HA PHE A 110 7.178 -0.163 -17.129 1.00 5.12 H new ATOM 0 HB2 PHE A 110 5.043 0.072 -15.698 1.00 41.23 H new ATOM 0 HB3 PHE A 110 5.751 1.545 -15.065 1.00 41.23 H new ATOM 0 HD1 PHE A 110 6.661 3.206 -16.967 1.00 65.24 H new ATOM 0 HD2 PHE A 110 3.647 0.251 -17.537 1.00 74.03 H new ATOM 0 HE1 PHE A 110 5.810 4.451 -18.906 1.00 41.15 H new ATOM 0 HE2 PHE A 110 2.793 1.493 -19.478 1.00 20.24 H new ATOM 0 HZ PHE A 110 3.877 3.593 -20.170 1.00 11.43 H new ATOM 1771 N MET A 111 8.879 1.619 -17.192 1.00 20.32 N ATOM 1772 CA MET A 111 9.904 2.654 -17.266 1.00 71.52 C ATOM 1773 C MET A 111 9.853 3.374 -18.610 1.00 35.02 C ATOM 1774 O MET A 111 9.787 2.740 -19.664 1.00 31.34 O ATOM 1775 CB MET A 111 11.291 2.044 -17.054 1.00 31.11 C ATOM 1776 CG MET A 111 11.765 1.192 -18.220 1.00 22.21 C ATOM 1777 SD MET A 111 13.338 0.375 -17.889 1.00 3.32 S ATOM 1778 CE MET A 111 14.328 1.760 -17.330 1.00 55.02 C ATOM 0 H MET A 111 8.760 1.080 -18.050 1.00 20.32 H new ATOM 0 HA MET A 111 9.710 3.380 -16.477 1.00 71.52 H new ATOM 0 HB2 MET A 111 12.010 2.846 -16.885 1.00 31.11 H new ATOM 0 HB3 MET A 111 11.276 1.434 -16.151 1.00 31.11 H new ATOM 0 HG2 MET A 111 11.010 0.439 -18.446 1.00 22.21 H new ATOM 0 HG3 MET A 111 11.865 1.819 -19.106 1.00 22.21 H new ATOM 0 HE1 MET A 111 15.367 1.604 -17.619 1.00 55.02 H new ATOM 0 HE2 MET A 111 13.959 2.679 -17.786 1.00 55.02 H new ATOM 0 HE3 MET A 111 14.261 1.841 -16.245 1.00 55.02 H new ATOM 1788 N LEU A 112 9.882 4.701 -18.566 1.00 4.33 N ATOM 1789 CA LEU A 112 9.839 5.508 -19.780 1.00 50.32 C ATOM 1790 C LEU A 112 10.587 6.824 -19.587 1.00 72.40 C ATOM 1791 O LEU A 112 10.543 7.422 -18.512 1.00 22.21 O ATOM 1792 CB LEU A 112 8.389 5.787 -20.179 1.00 72.14 C ATOM 1793 CG LEU A 112 8.024 5.488 -21.634 1.00 32.01 C ATOM 1794 CD1 LEU A 112 8.995 6.176 -22.580 1.00 40.43 C ATOM 1795 CD2 LEU A 112 8.008 3.987 -21.882 1.00 60.31 C ATOM 0 H LEU A 112 9.935 5.241 -17.702 1.00 4.33 H new ATOM 0 HA LEU A 112 10.328 4.947 -20.577 1.00 50.32 H new ATOM 0 HB2 LEU A 112 7.736 5.200 -19.533 1.00 72.14 H new ATOM 0 HB3 LEU A 112 8.174 6.837 -19.980 1.00 72.14 H new ATOM 0 HG LEU A 112 7.024 5.878 -21.825 1.00 32.01 H new ATOM 0 HD11 LEU A 112 8.720 5.952 -23.611 1.00 40.43 H new ATOM 0 HD12 LEU A 112 8.957 7.254 -22.420 1.00 40.43 H new ATOM 0 HD13 LEU A 112 10.006 5.817 -22.388 1.00 40.43 H new ATOM 0 HD21 LEU A 112 7.746 3.793 -22.922 1.00 60.31 H new ATOM 0 HD22 LEU A 112 8.994 3.573 -21.673 1.00 60.31 H new ATOM 0 HD23 LEU A 112 7.272 3.518 -21.229 1.00 60.31 H new ATOM 1807 N ARG A 113 11.271 7.269 -20.636 1.00 13.01 N ATOM 1808 CA ARG A 113 12.027 8.514 -20.582 1.00 2.10 C ATOM 1809 C ARG A 113 11.116 9.690 -20.244 1.00 35.04 C ATOM 1810 O ARG A 113 11.489 10.578 -19.477 1.00 23.54 O ATOM 1811 CB ARG A 113 12.730 8.767 -21.917 1.00 55.32 C ATOM 1812 CG ARG A 113 11.785 8.785 -23.108 1.00 65.53 C ATOM 1813 CD ARG A 113 12.494 8.366 -24.387 1.00 42.20 C ATOM 1814 NE ARG A 113 11.764 7.322 -25.101 1.00 25.33 N ATOM 1815 CZ ARG A 113 10.609 7.527 -25.723 1.00 31.30 C ATOM 1816 NH1 ARG A 113 10.055 8.731 -25.720 1.00 11.33 N ATOM 1817 NH2 ARG A 113 10.005 6.526 -26.351 1.00 24.42 N ATOM 0 H ARG A 113 11.317 6.786 -21.533 1.00 13.01 H new ATOM 0 HA ARG A 113 12.777 8.420 -19.796 1.00 2.10 H new ATOM 0 HB2 ARG A 113 13.256 9.720 -21.866 1.00 55.32 H new ATOM 0 HB3 ARG A 113 13.484 7.995 -22.073 1.00 55.32 H new ATOM 0 HG2 ARG A 113 10.947 8.115 -22.919 1.00 65.53 H new ATOM 0 HG3 ARG A 113 11.371 9.786 -23.231 1.00 65.53 H new ATOM 0 HD2 ARG A 113 12.613 9.233 -25.036 1.00 42.20 H new ATOM 0 HD3 ARG A 113 13.495 8.008 -24.146 1.00 42.20 H new ATOM 0 HE ARG A 113 12.163 6.384 -25.123 1.00 25.33 H new ATOM 0 HH11 ARG A 113 10.516 9.503 -25.239 1.00 11.33 H new ATOM 0 HH12 ARG A 113 9.168 8.885 -26.199 1.00 11.33 H new ATOM 0 HH21 ARG A 113 10.428 5.598 -26.356 1.00 24.42 H new ATOM 0 HH22 ARG A 113 9.118 6.685 -26.828 1.00 24.42 H new ATOM 1831 N ASP A 114 9.919 9.689 -20.821 1.00 2.40 N ATOM 1832 CA ASP A 114 8.954 10.755 -20.581 1.00 14.55 C ATOM 1833 C ASP A 114 8.214 10.532 -19.265 1.00 53.03 C ATOM 1834 O ASP A 114 8.252 11.374 -18.369 1.00 53.01 O ATOM 1835 CB ASP A 114 7.954 10.837 -21.735 1.00 73.00 C ATOM 1836 CG ASP A 114 8.596 11.307 -23.025 1.00 63.23 C ATOM 1837 OD1 ASP A 114 9.243 12.375 -23.011 1.00 31.20 O ATOM 1838 OD2 ASP A 114 8.452 10.607 -24.050 1.00 32.13 O ATOM 0 H ASP A 114 9.594 8.962 -21.458 1.00 2.40 H new ATOM 0 HA ASP A 114 9.499 11.697 -20.516 1.00 14.55 H new ATOM 0 HB2 ASP A 114 7.504 9.857 -21.893 1.00 73.00 H new ATOM 0 HB3 ASP A 114 7.147 11.518 -21.465 1.00 73.00 H new ATOM 1843 N GLY A 115 7.540 9.391 -19.158 1.00 34.04 N ATOM 1844 CA GLY A 115 6.799 9.078 -17.949 1.00 64.12 C ATOM 1845 C GLY A 115 5.341 9.481 -18.042 1.00 20.21 C ATOM 1846 O GLY A 115 4.467 8.634 -18.226 1.00 54.20 O ATOM 0 H GLY A 115 7.494 8.678 -19.886 1.00 34.04 H new ATOM 0 HA2 GLY A 115 6.865 8.008 -17.753 1.00 64.12 H new ATOM 0 HA3 GLY A 115 7.260 9.586 -17.102 1.00 64.12 H new ATOM 1850 N SER A 116 5.077 10.777 -17.912 1.00 44.25 N ATOM 1851 CA SER A 116 3.714 11.290 -17.977 1.00 51.12 C ATOM 1852 C SER A 116 3.008 10.799 -19.237 1.00 72.41 C ATOM 1853 O SER A 116 1.919 10.228 -19.169 1.00 61.54 O ATOM 1854 CB SER A 116 3.720 12.820 -17.946 1.00 71.30 C ATOM 1855 OG SER A 116 2.789 13.314 -16.999 1.00 53.22 O ATOM 0 H SER A 116 5.789 11.491 -17.761 1.00 44.25 H new ATOM 0 HA SER A 116 3.171 10.918 -17.108 1.00 51.12 H new ATOM 0 HB2 SER A 116 4.719 13.178 -17.699 1.00 71.30 H new ATOM 0 HB3 SER A 116 3.478 13.208 -18.935 1.00 71.30 H new ATOM 0 HG SER A 116 2.813 14.294 -16.997 1.00 53.22 H new ATOM 1861 N TYR A 117 3.636 11.025 -20.386 1.00 35.13 N ATOM 1862 CA TYR A 117 3.067 10.608 -21.662 1.00 65.02 C ATOM 1863 C TYR A 117 2.759 9.114 -21.659 1.00 71.21 C ATOM 1864 O TYR A 117 1.728 8.681 -22.172 1.00 74.41 O ATOM 1865 CB TYR A 117 4.029 10.939 -22.805 1.00 1.13 C ATOM 1866 CG TYR A 117 3.379 11.688 -23.946 1.00 13.44 C ATOM 1867 CD1 TYR A 117 3.138 13.054 -23.858 1.00 75.13 C ATOM 1868 CD2 TYR A 117 3.006 11.031 -25.112 1.00 22.34 C ATOM 1869 CE1 TYR A 117 2.543 13.742 -24.898 1.00 12.10 C ATOM 1870 CE2 TYR A 117 2.412 11.711 -26.157 1.00 3.10 C ATOM 1871 CZ TYR A 117 2.182 13.066 -26.045 1.00 43.52 C ATOM 1872 OH TYR A 117 1.591 13.749 -27.084 1.00 30.23 O ATOM 0 H TYR A 117 4.539 11.494 -20.460 1.00 35.13 H new ATOM 0 HA TYR A 117 2.135 11.153 -21.811 1.00 65.02 H new ATOM 0 HB2 TYR A 117 4.854 11.535 -22.414 1.00 1.13 H new ATOM 0 HB3 TYR A 117 4.458 10.013 -23.187 1.00 1.13 H new ATOM 0 HD1 TYR A 117 3.421 13.586 -22.962 1.00 75.13 H new ATOM 0 HD2 TYR A 117 3.184 9.970 -25.203 1.00 22.34 H new ATOM 0 HE1 TYR A 117 2.362 14.803 -24.813 1.00 12.10 H new ATOM 0 HE2 TYR A 117 2.129 11.185 -27.057 1.00 3.10 H new ATOM 0 HH TYR A 117 1.400 13.128 -27.817 1.00 30.23 H new ATOM 1882 N ALA A 118 3.661 8.331 -21.076 1.00 42.24 N ATOM 1883 CA ALA A 118 3.486 6.886 -21.003 1.00 53.12 C ATOM 1884 C ALA A 118 2.360 6.518 -20.043 1.00 31.23 C ATOM 1885 O ALA A 118 1.691 5.499 -20.217 1.00 43.11 O ATOM 1886 CB ALA A 118 4.785 6.217 -20.578 1.00 54.51 C ATOM 0 H ALA A 118 4.521 8.674 -20.647 1.00 42.24 H new ATOM 0 HA ALA A 118 3.214 6.527 -21.996 1.00 53.12 H new ATOM 0 HB1 ALA A 118 4.639 5.138 -20.528 1.00 54.51 H new ATOM 0 HB2 ALA A 118 5.566 6.444 -21.304 1.00 54.51 H new ATOM 0 HB3 ALA A 118 5.082 6.589 -19.597 1.00 54.51 H new ATOM 1892 N TRP A 119 2.157 7.352 -19.030 1.00 32.14 N ATOM 1893 CA TRP A 119 1.112 7.113 -18.041 1.00 33.23 C ATOM 1894 C TRP A 119 -0.233 6.870 -18.717 1.00 41.34 C ATOM 1895 O TRP A 119 -1.078 6.145 -18.195 1.00 14.25 O ATOM 1896 CB TRP A 119 1.007 8.300 -17.082 1.00 22.34 C ATOM 1897 CG TRP A 119 0.134 8.029 -15.894 1.00 71.30 C ATOM 1898 CD1 TRP A 119 -1.231 8.058 -15.857 1.00 20.33 C ATOM 1899 CD2 TRP A 119 0.566 7.690 -14.572 1.00 23.31 C ATOM 1900 NE1 TRP A 119 -1.673 7.757 -14.591 1.00 12.11 N ATOM 1901 CE2 TRP A 119 -0.590 7.526 -13.784 1.00 53.55 C ATOM 1902 CE3 TRP A 119 1.817 7.506 -13.977 1.00 44.11 C ATOM 1903 CZ2 TRP A 119 -0.530 7.190 -12.435 1.00 10.13 C ATOM 1904 CZ3 TRP A 119 1.875 7.173 -12.637 1.00 65.44 C ATOM 1905 CH2 TRP A 119 0.708 7.017 -11.878 1.00 61.53 C ATOM 0 H TRP A 119 2.702 8.200 -18.872 1.00 32.14 H new ATOM 0 HA TRP A 119 1.380 6.220 -17.476 1.00 33.23 H new ATOM 0 HB2 TRP A 119 2.005 8.568 -16.736 1.00 22.34 H new ATOM 0 HB3 TRP A 119 0.615 9.161 -17.623 1.00 22.34 H new ATOM 0 HD1 TRP A 119 -1.869 8.284 -16.699 1.00 20.33 H new ATOM 0 HE1 TRP A 119 -2.649 7.713 -14.299 1.00 12.11 H new ATOM 0 HE3 TRP A 119 2.722 7.622 -14.554 1.00 44.11 H new ATOM 0 HZ2 TRP A 119 -1.429 7.070 -11.848 1.00 10.13 H new ATOM 0 HZ3 TRP A 119 2.837 7.031 -12.167 1.00 65.44 H new ATOM 0 HH2 TRP A 119 0.787 6.755 -10.833 1.00 61.53 H new ATOM 1916 N GLU A 120 -0.423 7.481 -19.883 1.00 10.44 N ATOM 1917 CA GLU A 120 -1.666 7.331 -20.629 1.00 74.14 C ATOM 1918 C GLU A 120 -1.896 5.873 -21.016 1.00 63.41 C ATOM 1919 O GLU A 120 -2.897 5.268 -20.631 1.00 61.33 O ATOM 1920 CB GLU A 120 -1.642 8.205 -21.885 1.00 51.10 C ATOM 1921 CG GLU A 120 -2.785 9.205 -21.953 1.00 25.51 C ATOM 1922 CD GLU A 120 -2.702 10.103 -23.172 1.00 32.31 C ATOM 1923 OE1 GLU A 120 -1.854 11.019 -23.178 1.00 63.34 O ATOM 1924 OE2 GLU A 120 -3.487 9.889 -24.120 1.00 21.33 O ATOM 0 H GLU A 120 0.268 8.084 -20.330 1.00 10.44 H new ATOM 0 HA GLU A 120 -2.486 7.652 -19.987 1.00 74.14 H new ATOM 0 HB2 GLU A 120 -0.696 8.744 -21.924 1.00 51.10 H new ATOM 0 HB3 GLU A 120 -1.679 7.563 -22.765 1.00 51.10 H new ATOM 0 HG2 GLU A 120 -3.733 8.667 -21.966 1.00 25.51 H new ATOM 0 HG3 GLU A 120 -2.780 9.819 -21.053 1.00 25.51 H new ATOM 1931 N ILE A 121 -0.962 5.315 -21.779 1.00 42.23 N ATOM 1932 CA ILE A 121 -1.061 3.929 -22.218 1.00 35.44 C ATOM 1933 C ILE A 121 -0.861 2.967 -21.051 1.00 2.51 C ATOM 1934 O ILE A 121 -1.412 1.867 -21.036 1.00 73.25 O ATOM 1935 CB ILE A 121 -0.029 3.609 -23.315 1.00 3.34 C ATOM 1936 CG1 ILE A 121 -0.073 4.674 -24.413 1.00 20.13 C ATOM 1937 CG2 ILE A 121 -0.286 2.228 -23.898 1.00 25.11 C ATOM 1938 CD1 ILE A 121 1.172 5.530 -24.475 1.00 5.12 C ATOM 0 H ILE A 121 -0.128 5.802 -22.106 1.00 42.23 H new ATOM 0 HA ILE A 121 -2.063 3.799 -22.626 1.00 35.44 H new ATOM 0 HB ILE A 121 0.966 3.614 -22.870 1.00 3.34 H new ATOM 0 HG12 ILE A 121 -0.216 4.185 -25.377 1.00 20.13 H new ATOM 0 HG13 ILE A 121 -0.938 5.317 -24.250 1.00 20.13 H new ATOM 0 HG21 ILE A 121 0.452 2.017 -24.672 1.00 25.11 H new ATOM 0 HG22 ILE A 121 -0.209 1.480 -23.109 1.00 25.11 H new ATOM 0 HG23 ILE A 121 -1.286 2.196 -24.331 1.00 25.11 H new ATOM 0 HD11 ILE A 121 1.070 6.262 -25.276 1.00 5.12 H new ATOM 0 HD12 ILE A 121 1.306 6.047 -23.525 1.00 5.12 H new ATOM 0 HD13 ILE A 121 2.039 4.898 -24.669 1.00 5.12 H new ATOM 1950 N LYS A 122 -0.069 3.391 -20.072 1.00 4.30 N ATOM 1951 CA LYS A 122 0.204 2.571 -18.898 1.00 33.22 C ATOM 1952 C LYS A 122 -1.094 2.081 -18.263 1.00 52.33 C ATOM 1953 O LYS A 122 -1.153 0.979 -17.719 1.00 24.25 O ATOM 1954 CB LYS A 122 1.017 3.364 -17.873 1.00 42.40 C ATOM 1955 CG LYS A 122 1.443 2.544 -16.668 1.00 1.24 C ATOM 1956 CD LYS A 122 0.586 2.853 -15.452 1.00 15.01 C ATOM 1957 CE LYS A 122 1.391 3.546 -14.364 1.00 14.45 C ATOM 1958 NZ LYS A 122 2.412 2.641 -13.767 1.00 52.32 N ATOM 0 H LYS A 122 0.396 4.299 -20.069 1.00 4.30 H new ATOM 0 HA LYS A 122 0.782 1.704 -19.218 1.00 33.22 H new ATOM 0 HB2 LYS A 122 1.905 3.767 -18.360 1.00 42.40 H new ATOM 0 HB3 LYS A 122 0.426 4.214 -17.533 1.00 42.40 H new ATOM 0 HG2 LYS A 122 1.371 1.483 -16.905 1.00 1.24 H new ATOM 0 HG3 LYS A 122 2.489 2.749 -16.439 1.00 1.24 H new ATOM 0 HD2 LYS A 122 -0.250 3.487 -15.747 1.00 15.01 H new ATOM 0 HD3 LYS A 122 0.163 1.928 -15.060 1.00 15.01 H new ATOM 0 HE2 LYS A 122 1.884 4.424 -14.781 1.00 14.45 H new ATOM 0 HE3 LYS A 122 0.717 3.899 -13.583 1.00 14.45 H new ATOM 0 HZ1 LYS A 122 2.136 2.400 -12.794 1.00 52.32 H new ATOM 0 HZ2 LYS A 122 2.479 1.771 -14.333 1.00 52.32 H new ATOM 0 HZ3 LYS A 122 3.336 3.119 -13.757 1.00 52.32 H new ATOM 1972 N ASP A 123 -2.132 2.907 -18.339 1.00 33.22 N ATOM 1973 CA ASP A 123 -3.430 2.557 -17.774 1.00 33.50 C ATOM 1974 C ASP A 123 -3.889 1.190 -18.273 1.00 31.22 C ATOM 1975 O ASP A 123 -4.106 0.270 -17.484 1.00 25.13 O ATOM 1976 CB ASP A 123 -4.470 3.619 -18.132 1.00 40.55 C ATOM 1977 CG ASP A 123 -4.470 4.781 -17.158 1.00 72.11 C ATOM 1978 OD1 ASP A 123 -4.623 4.536 -15.943 1.00 74.25 O ATOM 1979 OD2 ASP A 123 -4.318 5.935 -17.610 1.00 40.33 O ATOM 0 H ASP A 123 -2.100 3.823 -18.786 1.00 33.22 H new ATOM 0 HA ASP A 123 -3.326 2.513 -16.690 1.00 33.50 H new ATOM 0 HB2 ASP A 123 -4.273 3.991 -19.137 1.00 40.55 H new ATOM 0 HB3 ASP A 123 -5.460 3.163 -18.149 1.00 40.55 H new ATOM 1984 N PHE A 124 -4.037 1.064 -19.588 1.00 4.45 N ATOM 1985 CA PHE A 124 -4.472 -0.189 -20.192 1.00 21.31 C ATOM 1986 C PHE A 124 -3.384 -1.253 -20.081 1.00 65.04 C ATOM 1987 O PHE A 124 -3.672 -2.436 -19.895 1.00 50.02 O ATOM 1988 CB PHE A 124 -4.840 0.029 -21.661 1.00 34.12 C ATOM 1989 CG PHE A 124 -6.319 0.146 -21.897 1.00 31.30 C ATOM 1990 CD1 PHE A 124 -7.055 1.148 -21.285 1.00 63.10 C ATOM 1991 CD2 PHE A 124 -6.973 -0.746 -22.731 1.00 74.32 C ATOM 1992 CE1 PHE A 124 -8.416 1.257 -21.500 1.00 65.11 C ATOM 1993 CE2 PHE A 124 -8.334 -0.642 -22.950 1.00 51.14 C ATOM 1994 CZ PHE A 124 -9.056 0.362 -22.335 1.00 22.23 C ATOM 0 H PHE A 124 -3.862 1.815 -20.255 1.00 4.45 H new ATOM 0 HA PHE A 124 -5.352 -0.537 -19.652 1.00 21.31 H new ATOM 0 HB2 PHE A 124 -4.350 0.934 -22.020 1.00 34.12 H new ATOM 0 HB3 PHE A 124 -4.450 -0.800 -22.252 1.00 34.12 H new ATOM 0 HD1 PHE A 124 -6.560 1.852 -20.633 1.00 63.10 H new ATOM 0 HD2 PHE A 124 -6.413 -1.532 -23.216 1.00 74.32 H new ATOM 0 HE1 PHE A 124 -8.979 2.041 -21.016 1.00 65.11 H new ATOM 0 HE2 PHE A 124 -8.832 -1.345 -23.601 1.00 51.14 H new ATOM 0 HZ PHE A 124 -10.119 0.447 -22.507 1.00 22.23 H new ATOM 2004 N LEU A 125 -2.132 -0.824 -20.198 1.00 63.11 N ATOM 2005 CA LEU A 125 -0.998 -1.739 -20.112 1.00 54.41 C ATOM 2006 C LEU A 125 -1.080 -2.589 -18.848 1.00 64.15 C ATOM 2007 O LEU A 125 -1.142 -3.817 -18.917 1.00 4.34 O ATOM 2008 CB LEU A 125 0.316 -0.956 -20.130 1.00 60.45 C ATOM 2009 CG LEU A 125 1.347 -1.401 -21.168 1.00 63.02 C ATOM 2010 CD1 LEU A 125 1.769 -2.841 -20.919 1.00 53.10 C ATOM 2011 CD2 LEU A 125 0.790 -1.242 -22.575 1.00 63.45 C ATOM 0 H LEU A 125 -1.876 0.151 -20.353 1.00 63.11 H new ATOM 0 HA LEU A 125 -1.030 -2.402 -20.976 1.00 54.41 H new ATOM 0 HB2 LEU A 125 0.087 0.096 -20.302 1.00 60.45 H new ATOM 0 HB3 LEU A 125 0.771 -1.026 -19.142 1.00 60.45 H new ATOM 0 HG LEU A 125 2.227 -0.765 -21.073 1.00 63.02 H new ATOM 0 HD11 LEU A 125 2.503 -3.140 -21.668 1.00 53.10 H new ATOM 0 HD12 LEU A 125 2.209 -2.924 -19.925 1.00 53.10 H new ATOM 0 HD13 LEU A 125 0.897 -3.492 -20.985 1.00 53.10 H new ATOM 0 HD21 LEU A 125 1.537 -1.563 -23.301 1.00 63.45 H new ATOM 0 HD22 LEU A 125 -0.106 -1.853 -22.683 1.00 63.45 H new ATOM 0 HD23 LEU A 125 0.540 -0.196 -22.751 1.00 63.45 H new ATOM 2023 N VAL A 126 -1.081 -1.928 -17.695 1.00 50.23 N ATOM 2024 CA VAL A 126 -1.158 -2.623 -16.416 1.00 13.52 C ATOM 2025 C VAL A 126 -2.517 -3.289 -16.234 1.00 31.43 C ATOM 2026 O VAL A 126 -2.631 -4.318 -15.568 1.00 21.25 O ATOM 2027 CB VAL A 126 -0.909 -1.661 -15.239 1.00 1.40 C ATOM 2028 CG1 VAL A 126 -1.970 -0.571 -15.205 1.00 70.34 C ATOM 2029 CG2 VAL A 126 -0.876 -2.425 -13.924 1.00 72.22 C ATOM 0 H VAL A 126 -1.029 -0.912 -17.621 1.00 50.23 H new ATOM 0 HA VAL A 126 -0.380 -3.386 -16.423 1.00 13.52 H new ATOM 0 HB VAL A 126 0.061 -1.185 -15.381 1.00 1.40 H new ATOM 0 HG11 VAL A 126 -1.777 0.099 -14.367 1.00 70.34 H new ATOM 0 HG12 VAL A 126 -1.940 -0.005 -16.136 1.00 70.34 H new ATOM 0 HG13 VAL A 126 -2.954 -1.025 -15.088 1.00 70.34 H new ATOM 0 HG21 VAL A 126 -0.699 -1.730 -13.104 1.00 72.22 H new ATOM 0 HG22 VAL A 126 -1.830 -2.930 -13.772 1.00 72.22 H new ATOM 0 HG23 VAL A 126 -0.075 -3.164 -13.952 1.00 72.22 H new ATOM 2039 N SER A 127 -3.546 -2.696 -16.831 1.00 20.42 N ATOM 2040 CA SER A 127 -4.899 -3.231 -16.732 1.00 70.10 C ATOM 2041 C SER A 127 -4.971 -4.639 -17.316 1.00 41.31 C ATOM 2042 O SER A 127 -5.778 -5.460 -16.883 1.00 73.54 O ATOM 2043 CB SER A 127 -5.886 -2.315 -17.457 1.00 54.23 C ATOM 2044 OG SER A 127 -7.224 -2.727 -17.233 1.00 44.12 O ATOM 0 H SER A 127 -3.469 -1.845 -17.388 1.00 20.42 H new ATOM 0 HA SER A 127 -5.167 -3.280 -15.677 1.00 70.10 H new ATOM 0 HB2 SER A 127 -5.756 -1.289 -17.112 1.00 54.23 H new ATOM 0 HB3 SER A 127 -5.675 -2.321 -18.526 1.00 54.23 H new ATOM 0 HG SER A 127 -7.835 -2.124 -17.706 1.00 44.12 H new ATOM 2050 N GLN A 128 -4.120 -4.908 -18.301 1.00 54.13 N ATOM 2051 CA GLN A 128 -4.088 -6.215 -18.946 1.00 24.54 C ATOM 2052 C GLN A 128 -3.818 -7.318 -17.927 1.00 0.23 C ATOM 2053 O GLN A 128 -4.396 -8.402 -18.003 1.00 62.22 O ATOM 2054 CB GLN A 128 -3.018 -6.242 -20.039 1.00 22.23 C ATOM 2055 CG GLN A 128 -3.556 -6.627 -21.407 1.00 50.54 C ATOM 2056 CD GLN A 128 -3.006 -5.752 -22.517 1.00 71.43 C ATOM 2057 OE1 GLN A 128 -1.812 -5.456 -22.556 1.00 25.23 O ATOM 2058 NE2 GLN A 128 -3.877 -5.334 -23.428 1.00 61.34 N ATOM 0 H GLN A 128 -3.444 -4.239 -18.669 1.00 54.13 H new ATOM 0 HA GLN A 128 -5.064 -6.393 -19.398 1.00 24.54 H new ATOM 0 HB2 GLN A 128 -2.552 -5.259 -20.104 1.00 22.23 H new ATOM 0 HB3 GLN A 128 -2.237 -6.946 -19.754 1.00 22.23 H new ATOM 0 HG2 GLN A 128 -3.306 -7.668 -21.612 1.00 50.54 H new ATOM 0 HG3 GLN A 128 -4.644 -6.556 -21.399 1.00 50.54 H new ATOM 0 HE21 GLN A 128 -4.858 -5.604 -23.357 1.00 61.34 H new ATOM 0 HE22 GLN A 128 -3.565 -4.743 -24.199 1.00 61.34 H new ATOM 2067 N ASP A 129 -2.937 -7.033 -16.974 1.00 70.20 N ATOM 2068 CA ASP A 129 -2.591 -8.000 -15.939 1.00 31.41 C ATOM 2069 C ASP A 129 -1.928 -9.233 -16.546 1.00 44.53 C ATOM 2070 O ASP A 129 -1.982 -10.323 -15.977 1.00 42.12 O ATOM 2071 CB ASP A 129 -3.840 -8.411 -15.157 1.00 62.52 C ATOM 2072 CG ASP A 129 -3.520 -8.835 -13.737 1.00 74.41 C ATOM 2073 OD1 ASP A 129 -3.430 -7.951 -12.860 1.00 40.15 O ATOM 2074 OD2 ASP A 129 -3.360 -10.052 -13.502 1.00 41.34 O ATOM 0 H ASP A 129 -2.450 -6.140 -16.897 1.00 70.20 H new ATOM 0 HA ASP A 129 -1.884 -7.528 -15.258 1.00 31.41 H new ATOM 0 HB2 ASP A 129 -4.542 -7.577 -15.135 1.00 62.52 H new ATOM 0 HB3 ASP A 129 -4.336 -9.232 -15.675 1.00 62.52 H new ATOM 2079 N ARG A 130 -1.303 -9.051 -17.705 1.00 70.22 N ATOM 2080 CA ARG A 130 -0.631 -10.148 -18.391 1.00 32.41 C ATOM 2081 C ARG A 130 0.122 -9.643 -19.618 1.00 4.24 C ATOM 2082 O ARG A 130 -0.401 -9.664 -20.732 1.00 60.03 O ATOM 2083 CB ARG A 130 -1.645 -11.216 -18.806 1.00 54.33 C ATOM 2084 CG ARG A 130 -1.012 -12.547 -19.176 1.00 42.24 C ATOM 2085 CD ARG A 130 -2.041 -13.666 -19.199 1.00 24.44 C ATOM 2086 NE ARG A 130 -1.435 -14.961 -19.499 1.00 45.30 N ATOM 2087 CZ ARG A 130 -2.060 -16.121 -19.335 1.00 71.00 C ATOM 2088 NH1 ARG A 130 -3.304 -16.148 -18.876 1.00 63.31 N ATOM 2089 NH2 ARG A 130 -1.442 -17.257 -19.631 1.00 21.22 N ATOM 0 H ARG A 130 -1.248 -8.154 -18.188 1.00 70.22 H new ATOM 0 HA ARG A 130 0.088 -10.588 -17.700 1.00 32.41 H new ATOM 0 HB2 ARG A 130 -2.349 -11.373 -17.989 1.00 54.33 H new ATOM 0 HB3 ARG A 130 -2.220 -10.848 -19.656 1.00 54.33 H new ATOM 0 HG2 ARG A 130 -0.539 -12.466 -20.155 1.00 42.24 H new ATOM 0 HG3 ARG A 130 -0.226 -12.789 -18.461 1.00 42.24 H new ATOM 0 HD2 ARG A 130 -2.544 -13.716 -18.233 1.00 24.44 H new ATOM 0 HD3 ARG A 130 -2.804 -13.441 -19.944 1.00 24.44 H new ATOM 0 HE ARG A 130 -0.479 -14.975 -19.854 1.00 45.30 H new ATOM 0 HH11 ARG A 130 -3.783 -15.277 -18.648 1.00 63.31 H new ATOM 0 HH12 ARG A 130 -3.782 -17.040 -18.751 1.00 63.31 H new ATOM 0 HH21 ARG A 130 -0.486 -17.240 -19.985 1.00 21.22 H new ATOM 0 HH22 ARG A 130 -1.923 -18.147 -19.505 1.00 21.22 H new ATOM 2103 N CYS A 131 1.352 -9.189 -19.404 1.00 43.32 N ATOM 2104 CA CYS A 131 2.178 -8.676 -20.492 1.00 73.22 C ATOM 2105 C CYS A 131 3.658 -8.909 -20.208 1.00 31.41 C ATOM 2106 O CYS A 131 4.097 -8.846 -19.060 1.00 43.42 O ATOM 2107 CB CYS A 131 1.915 -7.184 -20.700 1.00 73.13 C ATOM 2108 SG CYS A 131 1.122 -6.787 -22.276 1.00 34.01 S ATOM 0 H CYS A 131 1.799 -9.166 -18.488 1.00 43.32 H new ATOM 0 HA CYS A 131 1.912 -9.215 -21.402 1.00 73.22 H new ATOM 0 HB2 CYS A 131 1.286 -6.820 -19.887 1.00 73.13 H new ATOM 0 HB3 CYS A 131 2.861 -6.647 -20.636 1.00 73.13 H new ATOM 0 HG CYS A 131 -0.040 -6.247 -22.054 1.00 34.01 H new ATOM 2114 N ALA A 132 4.422 -9.181 -21.261 1.00 74.40 N ATOM 2115 CA ALA A 132 5.852 -9.424 -21.125 1.00 4.02 C ATOM 2116 C ALA A 132 6.621 -8.856 -22.313 1.00 61.11 C ATOM 2117 O ALA A 132 6.924 -9.572 -23.267 1.00 33.11 O ATOM 2118 CB ALA A 132 6.124 -10.914 -20.982 1.00 32.24 C ATOM 0 H ALA A 132 4.074 -9.238 -22.218 1.00 74.40 H new ATOM 0 HA ALA A 132 6.197 -8.915 -20.225 1.00 4.02 H new ATOM 0 HB1 ALA A 132 7.197 -11.080 -20.881 1.00 32.24 H new ATOM 0 HB2 ALA A 132 5.613 -11.294 -20.097 1.00 32.24 H new ATOM 0 HB3 ALA A 132 5.757 -11.437 -21.865 1.00 32.24 H new ATOM 2124 N GLU A 133 6.933 -7.565 -22.248 1.00 71.43 N ATOM 2125 CA GLU A 133 7.665 -6.902 -23.321 1.00 21.32 C ATOM 2126 C GLU A 133 8.852 -6.119 -22.766 1.00 71.54 C ATOM 2127 O GLU A 133 8.784 -5.558 -21.673 1.00 35.53 O ATOM 2128 CB GLU A 133 6.739 -5.964 -24.097 1.00 15.34 C ATOM 2129 CG GLU A 133 5.458 -6.629 -24.572 1.00 52.20 C ATOM 2130 CD GLU A 133 4.597 -5.704 -25.411 1.00 30.21 C ATOM 2131 OE1 GLU A 133 4.498 -4.509 -25.063 1.00 14.14 O ATOM 2132 OE2 GLU A 133 4.023 -6.175 -26.415 1.00 31.34 O ATOM 0 H GLU A 133 6.691 -6.958 -21.465 1.00 71.43 H new ATOM 0 HA GLU A 133 8.042 -7.669 -23.997 1.00 21.32 H new ATOM 0 HB2 GLU A 133 6.484 -5.114 -23.464 1.00 15.34 H new ATOM 0 HB3 GLU A 133 7.275 -5.570 -24.960 1.00 15.34 H new ATOM 0 HG2 GLU A 133 5.708 -7.515 -25.155 1.00 52.20 H new ATOM 0 HG3 GLU A 133 4.886 -6.967 -23.708 1.00 52.20 H new ATOM 2139 N VAL A 134 9.940 -6.087 -23.529 1.00 41.21 N ATOM 2140 CA VAL A 134 11.142 -5.373 -23.116 1.00 23.14 C ATOM 2141 C VAL A 134 11.834 -4.725 -24.309 1.00 44.33 C ATOM 2142 O VAL A 134 11.902 -5.305 -25.393 1.00 71.24 O ATOM 2143 CB VAL A 134 12.137 -6.312 -22.407 1.00 52.03 C ATOM 2144 CG1 VAL A 134 12.475 -7.500 -23.295 1.00 41.33 C ATOM 2145 CG2 VAL A 134 13.396 -5.555 -22.013 1.00 51.54 C ATOM 0 H VAL A 134 10.014 -6.547 -24.436 1.00 41.21 H new ATOM 0 HA VAL A 134 10.825 -4.598 -22.419 1.00 23.14 H new ATOM 0 HB VAL A 134 11.669 -6.690 -21.498 1.00 52.03 H new ATOM 0 HG11 VAL A 134 13.179 -8.152 -22.778 1.00 41.33 H new ATOM 0 HG12 VAL A 134 11.565 -8.055 -23.522 1.00 41.33 H new ATOM 0 HG13 VAL A 134 12.924 -7.145 -24.223 1.00 41.33 H new ATOM 0 HG21 VAL A 134 14.087 -6.234 -21.514 1.00 51.54 H new ATOM 0 HG22 VAL A 134 13.870 -5.147 -22.906 1.00 51.54 H new ATOM 0 HG23 VAL A 134 13.135 -4.741 -21.337 1.00 51.54 H new ATOM 2155 N THR A 135 12.349 -3.516 -24.103 1.00 61.35 N ATOM 2156 CA THR A 135 13.036 -2.788 -25.162 1.00 50.44 C ATOM 2157 C THR A 135 14.157 -1.923 -24.597 1.00 51.00 C ATOM 2158 O THR A 135 13.917 -1.035 -23.778 1.00 10.11 O ATOM 2159 CB THR A 135 12.062 -1.893 -25.952 1.00 72.32 C ATOM 2160 OG1 THR A 135 11.046 -2.696 -26.563 1.00 75.11 O ATOM 2161 CG2 THR A 135 12.800 -1.101 -27.021 1.00 12.14 C ATOM 0 H THR A 135 12.303 -3.021 -23.212 1.00 61.35 H new ATOM 0 HA THR A 135 13.460 -3.534 -25.834 1.00 50.44 H new ATOM 0 HB THR A 135 11.602 -1.192 -25.256 1.00 72.32 H new ATOM 0 HG1 THR A 135 10.430 -2.120 -27.062 1.00 75.11 H new ATOM 0 HG21 THR A 135 12.092 -0.477 -27.565 1.00 12.14 H new ATOM 0 HG22 THR A 135 13.554 -0.469 -26.551 1.00 12.14 H new ATOM 0 HG23 THR A 135 13.284 -1.789 -27.714 1.00 12.14 H new ATOM 2169 N LEU A 136 15.382 -2.187 -25.039 1.00 15.00 N ATOM 2170 CA LEU A 136 16.541 -1.432 -24.577 1.00 50.42 C ATOM 2171 C LEU A 136 17.615 -1.368 -25.658 1.00 40.44 C ATOM 2172 O LEU A 136 18.125 -2.396 -26.101 1.00 22.23 O ATOM 2173 CB LEU A 136 17.115 -2.065 -23.309 1.00 20.32 C ATOM 2174 CG LEU A 136 17.479 -3.547 -23.404 1.00 73.45 C ATOM 2175 CD1 LEU A 136 18.988 -3.730 -23.370 1.00 41.04 C ATOM 2176 CD2 LEU A 136 16.819 -4.332 -22.280 1.00 22.03 C ATOM 0 H LEU A 136 15.598 -2.918 -25.717 1.00 15.00 H new ATOM 0 HA LEU A 136 16.216 -0.416 -24.353 1.00 50.42 H new ATOM 0 HB2 LEU A 136 18.008 -1.510 -23.022 1.00 20.32 H new ATOM 0 HB3 LEU A 136 16.390 -1.940 -22.505 1.00 20.32 H new ATOM 0 HG LEU A 136 17.109 -3.931 -24.354 1.00 73.45 H new ATOM 0 HD11 LEU A 136 19.227 -4.791 -23.439 1.00 41.04 H new ATOM 0 HD12 LEU A 136 19.438 -3.201 -24.211 1.00 41.04 H new ATOM 0 HD13 LEU A 136 19.382 -3.329 -22.436 1.00 41.04 H new ATOM 0 HD21 LEU A 136 17.089 -5.385 -22.364 1.00 22.03 H new ATOM 0 HD22 LEU A 136 17.158 -3.946 -21.319 1.00 22.03 H new ATOM 0 HD23 LEU A 136 15.736 -4.229 -22.351 1.00 22.03 H new