USER MOD reduce.3.24.130724 H: found=0, std=0, add=720, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 719 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 38 HIS : no HE2:sc= -2.12 K(o=-1,f=-9.5!) USER MOD Set 1.2: A 89 THR OG1 : rot -47:sc= 1.12 USER MOD Set 2.1: A 23 ASN : amide:sc= -0.0178 K(o=-0.018,f=-1.1) USER MOD Set 2.2: A 66 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 12 LYS NZ :NH3+ -165:sc= 0.439 (180deg=0) USER MOD Set 3.2: A 83 TYR OH : rot 30:sc= 0.402 USER MOD Single : A 9 LYS NZ :NH3+ -152:sc= 1.23 (180deg=1.01) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 178:sc= 1.16 (180deg=1.12) USER MOD Single : A 19 GLN : amide:sc= -0.124 K(o=-0.12,f=-0.98) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=-0.062) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 HIS : no HE2:sc= 0.0461 X(o=0.046,f=-0.28) USER MOD Single : A 35 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 37 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0349) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 MET CE :methyl -176:sc= -0.212 (180deg=-0.255) USER MOD Single : A 52 THR OG1 : rot -131:sc= 0.182 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 0:sc= 0.578 USER MOD Single : A 69 ASN :FLIP amide:sc= -2.27! C(o=-2.9!,f=-2.3!) USER MOD Single : A 72 ASN : amide:sc= -2.3 K(o=-2.3,f=-4.9!) USER MOD Single : A 75 LYS NZ :NH3+ 166:sc= -0.0402 (180deg=-0.241) USER MOD Single : A 78 ASN : amide:sc= 0.00401 K(o=0.004,f=-2.9!) USER MOD Single : A 85 ASN : amide:sc= -1.52! C(o=-1.5!,f=-4.4!) USER MOD Single : A 86 MET CE :methyl -160:sc= -0.173 (180deg=-0.663) USER MOD Single : A 91 LYS NZ :NH3+ 160:sc= 0.779 (180deg=0.516) USER MOD ----------------------------------------------------------------- ATOM 58 N ASP A 7 -11.367 -46.317 22.038 1.00 0.00 N ATOM 59 CA ASP A 7 -12.158 -45.613 23.024 1.00 0.00 C ATOM 60 C ASP A 7 -11.494 -45.691 24.385 1.00 0.00 C ATOM 61 O ASP A 7 -11.561 -46.710 25.074 1.00 0.00 O ATOM 62 CB ASP A 7 -13.583 -46.176 23.080 1.00 0.00 C ATOM 63 CG ASP A 7 -14.460 -45.441 24.069 1.00 0.00 C ATOM 64 OD1 ASP A 7 -14.606 -44.201 23.948 1.00 0.00 O ATOM 65 OD2 ASP A 7 -15.030 -46.099 24.960 1.00 0.00 O ATOM 0 HA ASP A 7 -12.222 -44.565 22.732 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -14.032 -46.118 22.088 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -13.543 -47.231 23.350 1.00 0.00 H new ATOM 70 N ILE A 8 -10.840 -44.618 24.758 1.00 0.00 N ATOM 71 CA ILE A 8 -10.126 -44.558 26.009 1.00 0.00 C ATOM 72 C ILE A 8 -11.043 -44.099 27.120 1.00 0.00 C ATOM 73 O ILE A 8 -11.758 -43.101 26.982 1.00 0.00 O ATOM 74 CB ILE A 8 -8.903 -43.623 25.900 1.00 0.00 C ATOM 75 CG1 ILE A 8 -7.962 -44.154 24.813 1.00 0.00 C ATOM 76 CG2 ILE A 8 -8.176 -43.513 27.243 1.00 0.00 C ATOM 77 CD1 ILE A 8 -6.774 -43.275 24.543 1.00 0.00 C ATOM 0 H ILE A 8 -10.788 -43.763 24.204 1.00 0.00 H new ATOM 0 HA ILE A 8 -9.769 -45.561 26.244 1.00 0.00 H new ATOM 0 HB ILE A 8 -9.240 -42.622 25.629 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -7.609 -45.143 25.105 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -8.526 -44.277 23.889 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -7.318 -42.849 27.139 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -8.857 -43.112 27.994 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -7.835 -44.500 27.554 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -6.160 -43.723 23.762 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -7.115 -42.292 24.218 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -6.184 -43.171 25.453 1.00 0.00 H new ATOM 89 N LYS A 9 -11.036 -44.837 28.210 1.00 0.00 N ATOM 90 CA LYS A 9 -11.891 -44.545 29.338 1.00 0.00 C ATOM 91 C LYS A 9 -11.199 -43.541 30.245 1.00 0.00 C ATOM 92 O LYS A 9 -10.014 -43.671 30.516 1.00 0.00 O ATOM 93 CB LYS A 9 -12.163 -45.833 30.127 1.00 0.00 C ATOM 94 CG LYS A 9 -12.596 -47.021 29.270 1.00 0.00 C ATOM 95 CD LYS A 9 -13.898 -46.770 28.522 1.00 0.00 C ATOM 96 CE LYS A 9 -14.279 -47.981 27.684 1.00 0.00 C ATOM 97 NZ LYS A 9 -15.558 -47.786 26.962 1.00 0.00 N ATOM 0 H LYS A 9 -10.439 -45.654 28.338 1.00 0.00 H new ATOM 0 HA LYS A 9 -12.834 -44.132 28.980 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -11.261 -46.106 30.675 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -12.938 -45.634 30.867 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -11.809 -47.250 28.552 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -12.712 -47.898 29.906 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -14.694 -46.548 29.232 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -13.791 -45.896 27.880 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -13.486 -48.186 26.965 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -14.358 -48.856 28.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -16.014 -48.708 26.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -16.186 -47.178 27.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -15.373 -47.335 26.043 1.00 0.00 H new ATOM 111 N GLU A 10 -11.916 -42.547 30.710 1.00 0.00 N ATOM 112 CA GLU A 10 -11.319 -41.573 31.603 1.00 0.00 C ATOM 113 C GLU A 10 -11.869 -41.707 33.004 1.00 0.00 C ATOM 114 O GLU A 10 -13.054 -41.470 33.248 1.00 0.00 O ATOM 115 CB GLU A 10 -11.516 -40.137 31.103 1.00 0.00 C ATOM 116 CG GLU A 10 -10.763 -39.812 29.827 1.00 0.00 C ATOM 117 CD GLU A 10 -10.894 -38.357 29.436 1.00 0.00 C ATOM 118 OE1 GLU A 10 -11.837 -38.021 28.698 1.00 0.00 O ATOM 119 OE2 GLU A 10 -10.051 -37.541 29.869 1.00 0.00 O ATOM 0 H GLU A 10 -12.900 -42.388 30.492 1.00 0.00 H new ATOM 0 HA GLU A 10 -10.249 -41.781 31.620 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -12.580 -39.965 30.937 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -11.199 -39.446 31.884 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -9.709 -40.057 29.958 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -11.138 -40.438 29.017 1.00 0.00 H new ATOM 126 N ILE A 11 -11.013 -42.088 33.919 1.00 0.00 N ATOM 127 CA ILE A 11 -11.385 -42.192 35.304 1.00 0.00 C ATOM 128 C ILE A 11 -10.744 -41.040 36.069 1.00 0.00 C ATOM 129 O ILE A 11 -9.520 -40.986 36.238 1.00 0.00 O ATOM 130 CB ILE A 11 -10.998 -43.587 35.904 1.00 0.00 C ATOM 131 CG1 ILE A 11 -11.832 -44.688 35.224 1.00 0.00 C ATOM 132 CG2 ILE A 11 -11.209 -43.617 37.418 1.00 0.00 C ATOM 133 CD1 ILE A 11 -11.457 -46.099 35.638 1.00 0.00 C ATOM 0 H ILE A 11 -10.042 -42.334 33.724 1.00 0.00 H new ATOM 0 HA ILE A 11 -12.469 -42.119 35.396 1.00 0.00 H new ATOM 0 HB ILE A 11 -9.939 -43.765 35.715 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -12.885 -44.523 35.451 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -11.721 -44.597 34.144 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -10.932 -44.598 37.805 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.589 -42.853 37.887 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -12.257 -43.421 37.643 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -12.092 -46.813 35.113 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -10.414 -46.287 35.385 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -11.596 -46.212 36.713 1.00 0.00 H new ATOM 145 N LYS A 12 -11.581 -40.100 36.494 1.00 0.00 N ATOM 146 CA LYS A 12 -11.112 -38.886 37.145 1.00 0.00 C ATOM 147 C LYS A 12 -11.283 -38.969 38.652 1.00 0.00 C ATOM 148 O LYS A 12 -12.375 -39.239 39.149 1.00 0.00 O ATOM 149 CB LYS A 12 -11.882 -37.680 36.593 1.00 0.00 C ATOM 150 CG LYS A 12 -11.431 -36.333 37.143 1.00 0.00 C ATOM 151 CD LYS A 12 -12.277 -35.195 36.577 1.00 0.00 C ATOM 152 CE LYS A 12 -12.070 -35.031 35.075 1.00 0.00 C ATOM 153 NZ LYS A 12 -12.893 -33.929 34.511 1.00 0.00 N ATOM 0 H LYS A 12 -12.595 -40.158 36.397 1.00 0.00 H new ATOM 0 HA LYS A 12 -10.049 -38.770 36.935 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -11.781 -37.667 35.508 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -12.942 -37.811 36.813 1.00 0.00 H new ATOM 0 HG2 LYS A 12 -11.504 -36.338 38.231 1.00 0.00 H new ATOM 0 HG3 LYS A 12 -10.382 -36.168 36.895 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -13.330 -35.389 36.780 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -12.021 -34.264 37.083 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -11.017 -34.835 34.875 1.00 0.00 H new ATOM 0 HE3 LYS A 12 -12.322 -35.964 34.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -12.921 -34.012 33.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -13.860 -33.989 34.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -12.475 -33.014 34.774 1.00 0.00 H new ATOM 167 N LEU A 13 -10.208 -38.730 39.367 1.00 0.00 N ATOM 168 CA LEU A 13 -10.229 -38.753 40.817 1.00 0.00 C ATOM 169 C LEU A 13 -9.898 -37.373 41.365 1.00 0.00 C ATOM 170 O LEU A 13 -9.683 -36.426 40.598 1.00 0.00 O ATOM 171 CB LEU A 13 -9.258 -39.814 41.377 1.00 0.00 C ATOM 172 CG LEU A 13 -9.531 -41.262 40.936 1.00 0.00 C ATOM 173 CD1 LEU A 13 -8.898 -41.549 39.586 1.00 0.00 C ATOM 174 CD2 LEU A 13 -9.043 -42.256 41.977 1.00 0.00 C ATOM 0 H LEU A 13 -9.296 -38.515 38.965 1.00 0.00 H new ATOM 0 HA LEU A 13 -11.233 -39.028 41.140 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.244 -39.547 41.078 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -9.291 -39.772 42.466 1.00 0.00 H new ATOM 0 HG LEU A 13 -10.610 -41.378 40.839 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -9.106 -42.579 39.298 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -9.313 -40.873 38.839 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -7.820 -41.401 39.651 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -9.250 -43.271 41.637 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -7.970 -42.134 42.122 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -9.559 -42.078 42.920 1.00 0.00 H new ATOM 186 N SER A 14 -9.859 -37.252 42.669 1.00 0.00 N ATOM 187 CA SER A 14 -9.582 -35.986 43.295 1.00 0.00 C ATOM 188 C SER A 14 -8.664 -36.182 44.482 1.00 0.00 C ATOM 189 O SER A 14 -8.567 -37.272 45.010 1.00 0.00 O ATOM 190 CB SER A 14 -10.894 -35.341 43.744 1.00 0.00 C ATOM 191 OG SER A 14 -11.666 -36.244 44.530 1.00 0.00 O ATOM 0 H SER A 14 -10.017 -38.021 43.320 1.00 0.00 H new ATOM 0 HA SER A 14 -9.087 -35.331 42.578 1.00 0.00 H new ATOM 0 HB2 SER A 14 -10.682 -34.441 44.321 1.00 0.00 H new ATOM 0 HB3 SER A 14 -11.468 -35.031 42.871 1.00 0.00 H new ATOM 0 HG SER A 14 -12.499 -35.808 44.806 1.00 0.00 H new ATOM 197 N VAL A 15 -7.974 -35.133 44.875 1.00 0.00 N ATOM 198 CA VAL A 15 -7.134 -35.183 46.055 1.00 0.00 C ATOM 199 C VAL A 15 -8.011 -35.418 47.297 1.00 0.00 C ATOM 200 O VAL A 15 -7.625 -36.129 48.230 1.00 0.00 O ATOM 201 CB VAL A 15 -6.265 -33.904 46.191 1.00 0.00 C ATOM 202 CG1 VAL A 15 -5.449 -33.918 47.473 1.00 0.00 C ATOM 203 CG2 VAL A 15 -5.341 -33.793 45.001 1.00 0.00 C ATOM 0 H VAL A 15 -7.977 -34.233 44.395 1.00 0.00 H new ATOM 0 HA VAL A 15 -6.438 -36.016 45.960 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.932 -33.043 46.227 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -4.853 -33.008 47.535 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -6.120 -33.972 48.331 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -4.788 -34.785 47.474 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -4.731 -32.895 45.097 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -4.693 -34.669 44.960 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -5.931 -33.735 44.086 1.00 0.00 H new ATOM 213 N LYS A 16 -9.201 -34.815 47.291 1.00 0.00 N ATOM 214 CA LYS A 16 -10.189 -35.044 48.341 1.00 0.00 C ATOM 215 C LYS A 16 -10.979 -36.321 48.037 1.00 0.00 C ATOM 216 O LYS A 16 -12.175 -36.270 47.741 1.00 0.00 O ATOM 217 CB LYS A 16 -11.176 -33.873 48.455 1.00 0.00 C ATOM 218 CG LYS A 16 -10.586 -32.560 48.938 1.00 0.00 C ATOM 219 CD LYS A 16 -9.863 -31.815 47.836 1.00 0.00 C ATOM 220 CE LYS A 16 -9.469 -30.426 48.300 1.00 0.00 C ATOM 221 NZ LYS A 16 -8.480 -30.470 49.409 1.00 0.00 N ATOM 0 H LYS A 16 -9.502 -34.163 46.567 1.00 0.00 H new ATOM 0 HA LYS A 16 -9.651 -35.140 49.284 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -11.631 -33.708 47.478 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -11.977 -34.162 49.135 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -11.382 -31.931 49.337 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -9.893 -32.755 49.757 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -8.974 -32.370 47.537 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -10.504 -31.743 46.957 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -9.050 -29.869 47.462 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -10.358 -29.887 48.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -8.212 -29.501 49.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -8.901 -30.949 50.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -7.635 -30.991 49.100 1.00 0.00 H new ATOM 235 N ILE A 17 -10.301 -37.441 48.067 1.00 0.00 N ATOM 236 CA ILE A 17 -10.931 -38.725 47.809 1.00 0.00 C ATOM 237 C ILE A 17 -10.717 -39.683 48.983 1.00 0.00 C ATOM 238 O ILE A 17 -9.718 -39.589 49.706 1.00 0.00 O ATOM 239 CB ILE A 17 -10.368 -39.376 46.519 1.00 0.00 C ATOM 240 CG1 ILE A 17 -11.157 -40.633 46.159 1.00 0.00 C ATOM 241 CG2 ILE A 17 -8.890 -39.708 46.687 1.00 0.00 C ATOM 242 CD1 ILE A 17 -10.754 -41.240 44.837 1.00 0.00 C ATOM 0 H ILE A 17 -9.303 -37.496 48.269 1.00 0.00 H new ATOM 0 HA ILE A 17 -11.997 -38.540 47.680 1.00 0.00 H new ATOM 0 HB ILE A 17 -10.472 -38.659 45.704 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -11.022 -41.375 46.946 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -12.219 -40.389 46.129 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -8.513 -40.164 45.771 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -8.333 -38.794 46.893 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -8.765 -40.404 47.517 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -11.355 -42.129 44.646 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -10.915 -40.515 44.039 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -9.700 -41.515 44.869 1.00 0.00 H new ATOM 254 N ALA A 18 -11.674 -40.570 49.193 1.00 0.00 N ATOM 255 CA ALA A 18 -11.562 -41.586 50.220 1.00 0.00 C ATOM 256 C ALA A 18 -10.736 -42.755 49.699 1.00 0.00 C ATOM 257 O ALA A 18 -10.717 -43.022 48.497 1.00 0.00 O ATOM 258 CB ALA A 18 -12.941 -42.062 50.643 1.00 0.00 C ATOM 0 H ALA A 18 -12.543 -40.605 48.660 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.063 -41.158 51.090 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -12.842 -42.825 51.415 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -13.512 -41.221 51.036 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -13.461 -42.482 49.782 1.00 0.00 H new ATOM 264 N GLN A 19 -10.073 -43.458 50.603 1.00 0.00 N ATOM 265 CA GLN A 19 -9.234 -44.594 50.234 1.00 0.00 C ATOM 266 C GLN A 19 -10.096 -45.703 49.624 1.00 0.00 C ATOM 267 O GLN A 19 -9.678 -46.399 48.696 1.00 0.00 O ATOM 268 CB GLN A 19 -8.475 -45.112 51.466 1.00 0.00 C ATOM 269 CG GLN A 19 -7.441 -46.184 51.159 1.00 0.00 C ATOM 270 CD GLN A 19 -6.286 -45.667 50.317 1.00 0.00 C ATOM 271 OE1 GLN A 19 -5.899 -44.501 50.412 1.00 0.00 O ATOM 272 NE2 GLN A 19 -5.732 -46.526 49.493 1.00 0.00 N ATOM 0 H GLN A 19 -10.098 -43.263 51.604 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.504 -44.273 49.490 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -7.978 -44.272 51.951 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -9.195 -45.512 52.180 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -7.051 -46.584 52.095 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -7.925 -47.009 50.636 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -6.081 -47.483 49.443 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -4.952 -46.236 48.903 1.00 0.00 H new ATOM 281 N ASN A 20 -11.313 -45.834 50.138 1.00 0.00 N ATOM 282 CA ASN A 20 -12.264 -46.829 49.651 1.00 0.00 C ATOM 283 C ASN A 20 -12.621 -46.580 48.188 1.00 0.00 C ATOM 284 O ASN A 20 -12.726 -47.519 47.397 1.00 0.00 O ATOM 285 CB ASN A 20 -13.537 -46.818 50.515 1.00 0.00 C ATOM 286 CG ASN A 20 -14.641 -47.721 49.969 1.00 0.00 C ATOM 287 OD1 ASN A 20 -15.477 -47.287 49.179 1.00 0.00 O ATOM 288 ND2 ASN A 20 -14.653 -48.973 50.389 1.00 0.00 N ATOM 0 H ASN A 20 -11.668 -45.257 50.900 1.00 0.00 H new ATOM 0 HA ASN A 20 -11.792 -47.809 49.724 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -13.285 -47.135 51.527 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -13.912 -45.797 50.585 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -15.373 -49.615 50.057 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -13.943 -49.298 51.045 1.00 0.00 H new ATOM 295 N ASP A 21 -12.792 -45.316 47.829 1.00 0.00 N ATOM 296 CA ASP A 21 -13.153 -44.960 46.461 1.00 0.00 C ATOM 297 C ASP A 21 -12.036 -45.317 45.490 1.00 0.00 C ATOM 298 O ASP A 21 -12.297 -45.773 44.384 1.00 0.00 O ATOM 299 CB ASP A 21 -13.502 -43.479 46.350 1.00 0.00 C ATOM 300 CG ASP A 21 -14.167 -43.137 45.026 1.00 0.00 C ATOM 301 OD1 ASP A 21 -15.347 -43.520 44.828 1.00 0.00 O ATOM 302 OD2 ASP A 21 -13.531 -42.472 44.191 1.00 0.00 O ATOM 0 H ASP A 21 -12.688 -44.522 48.461 1.00 0.00 H new ATOM 0 HA ASP A 21 -14.037 -45.539 46.194 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -14.166 -43.203 47.169 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -12.595 -42.885 46.462 1.00 0.00 H new ATOM 307 N ILE A 22 -10.789 -45.142 45.929 1.00 0.00 N ATOM 308 CA ILE A 22 -9.626 -45.480 45.107 1.00 0.00 C ATOM 309 C ILE A 22 -9.646 -46.974 44.795 1.00 0.00 C ATOM 310 O ILE A 22 -9.404 -47.392 43.659 1.00 0.00 O ATOM 311 CB ILE A 22 -8.296 -45.139 45.831 1.00 0.00 C ATOM 312 CG1 ILE A 22 -8.271 -43.664 46.257 1.00 0.00 C ATOM 313 CG2 ILE A 22 -7.096 -45.454 44.932 1.00 0.00 C ATOM 314 CD1 ILE A 22 -7.065 -43.294 47.093 1.00 0.00 C ATOM 0 H ILE A 22 -10.558 -44.768 46.849 1.00 0.00 H new ATOM 0 HA ILE A 22 -9.681 -44.892 44.191 1.00 0.00 H new ATOM 0 HB ILE A 22 -8.230 -45.757 46.726 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -8.291 -43.037 45.366 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -9.176 -43.443 46.823 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.173 -45.208 45.457 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -7.099 -46.514 44.680 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -7.161 -44.864 44.018 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -7.115 -42.238 47.357 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -7.054 -43.895 48.002 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.155 -43.483 46.523 1.00 0.00 H new ATOM 326 N ASN A 23 -9.963 -47.760 45.813 1.00 0.00 N ATOM 327 CA ASN A 23 -10.054 -49.213 45.697 1.00 0.00 C ATOM 328 C ASN A 23 -11.106 -49.601 44.681 1.00 0.00 C ATOM 329 O ASN A 23 -10.915 -50.506 43.866 1.00 0.00 O ATOM 330 CB ASN A 23 -10.450 -49.798 47.043 1.00 0.00 C ATOM 331 CG ASN A 23 -9.297 -49.892 48.019 1.00 0.00 C ATOM 332 OD1 ASN A 23 -8.148 -50.058 47.626 1.00 0.00 O ATOM 333 ND2 ASN A 23 -9.595 -49.781 49.302 1.00 0.00 N ATOM 0 H ASN A 23 -10.166 -47.409 46.749 1.00 0.00 H new ATOM 0 HA ASN A 23 -9.085 -49.597 45.379 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -11.238 -49.184 47.480 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -10.869 -50.793 46.890 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -8.856 -49.833 50.003 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -10.564 -49.643 49.591 1.00 0.00 H new ATOM 340 N TYR A 24 -12.206 -48.913 44.750 1.00 0.00 N ATOM 341 CA TYR A 24 -13.315 -49.115 43.858 1.00 0.00 C ATOM 342 C TYR A 24 -12.932 -48.782 42.406 1.00 0.00 C ATOM 343 O TYR A 24 -13.261 -49.525 41.483 1.00 0.00 O ATOM 344 CB TYR A 24 -14.475 -48.250 44.339 1.00 0.00 C ATOM 345 CG TYR A 24 -15.701 -48.260 43.465 1.00 0.00 C ATOM 346 CD1 TYR A 24 -16.625 -49.278 43.568 1.00 0.00 C ATOM 347 CD2 TYR A 24 -15.938 -47.242 42.555 1.00 0.00 C ATOM 348 CE1 TYR A 24 -17.761 -49.295 42.786 1.00 0.00 C ATOM 349 CE2 TYR A 24 -17.071 -47.245 41.762 1.00 0.00 C ATOM 350 CZ TYR A 24 -17.981 -48.275 41.884 1.00 0.00 C ATOM 351 OH TYR A 24 -19.118 -48.288 41.100 1.00 0.00 O ATOM 0 H TYR A 24 -12.364 -48.180 45.441 1.00 0.00 H new ATOM 0 HA TYR A 24 -13.610 -50.164 43.867 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -14.760 -48.580 45.338 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -14.124 -47.222 44.430 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -16.456 -50.077 44.274 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -15.227 -46.434 42.464 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -18.473 -50.101 42.879 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -17.242 -46.448 41.053 1.00 0.00 H new ATOM 0 HH TYR A 24 -19.123 -47.499 40.519 1.00 0.00 H new ATOM 361 N LYS A 25 -12.230 -47.664 42.218 1.00 0.00 N ATOM 362 CA LYS A 25 -11.859 -47.197 40.883 1.00 0.00 C ATOM 363 C LYS A 25 -10.913 -48.178 40.169 1.00 0.00 C ATOM 364 O LYS A 25 -11.101 -48.476 38.985 1.00 0.00 O ATOM 365 CB LYS A 25 -11.226 -45.800 40.957 1.00 0.00 C ATOM 366 CG LYS A 25 -12.139 -44.742 41.576 1.00 0.00 C ATOM 367 CD LYS A 25 -13.390 -44.511 40.748 1.00 0.00 C ATOM 368 CE LYS A 25 -14.289 -43.464 41.397 1.00 0.00 C ATOM 369 NZ LYS A 25 -15.526 -43.221 40.623 1.00 0.00 N ATOM 0 H LYS A 25 -11.906 -47.064 42.976 1.00 0.00 H new ATOM 0 HA LYS A 25 -12.775 -47.141 40.294 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -10.306 -45.858 41.539 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -10.948 -45.483 39.952 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -12.423 -45.052 42.582 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.592 -43.804 41.674 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -13.112 -44.186 39.745 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -13.937 -45.448 40.639 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -14.552 -43.789 42.403 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -13.738 -42.529 41.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -16.102 -42.502 41.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -15.279 -42.884 39.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -16.068 -44.105 40.548 1.00 0.00 H new ATOM 383 N VAL A 26 -9.908 -48.690 40.887 1.00 0.00 N ATOM 384 CA VAL A 26 -8.966 -49.636 40.290 1.00 0.00 C ATOM 385 C VAL A 26 -9.635 -50.963 39.965 1.00 0.00 C ATOM 386 O VAL A 26 -9.238 -51.651 39.028 1.00 0.00 O ATOM 387 CB VAL A 26 -7.716 -49.882 41.166 1.00 0.00 C ATOM 388 CG1 VAL A 26 -6.800 -48.673 41.152 1.00 0.00 C ATOM 389 CG2 VAL A 26 -8.101 -50.242 42.585 1.00 0.00 C ATOM 0 H VAL A 26 -9.729 -48.469 41.866 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.631 -49.168 39.364 1.00 0.00 H new ATOM 0 HB VAL A 26 -7.176 -50.728 40.740 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.928 -48.870 41.775 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.478 -48.472 40.130 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -7.335 -47.807 41.540 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -7.200 -50.409 43.175 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.677 -49.427 43.024 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -8.704 -51.150 42.579 1.00 0.00 H new ATOM 399 N LYS A 27 -10.665 -51.309 40.734 1.00 0.00 N ATOM 400 CA LYS A 27 -11.420 -52.536 40.505 1.00 0.00 C ATOM 401 C LYS A 27 -12.032 -52.508 39.107 1.00 0.00 C ATOM 402 O LYS A 27 -11.982 -53.494 38.367 1.00 0.00 O ATOM 403 CB LYS A 27 -12.527 -52.670 41.558 1.00 0.00 C ATOM 404 CG LYS A 27 -13.346 -53.948 41.443 1.00 0.00 C ATOM 405 CD LYS A 27 -14.436 -54.004 42.502 1.00 0.00 C ATOM 406 CE LYS A 27 -15.247 -55.286 42.395 1.00 0.00 C ATOM 407 NZ LYS A 27 -16.327 -55.353 43.410 1.00 0.00 N ATOM 0 H LYS A 27 -10.996 -50.754 41.523 1.00 0.00 H new ATOM 0 HA LYS A 27 -10.749 -53.392 40.585 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -12.077 -52.628 42.550 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -13.197 -51.814 41.476 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -13.796 -54.006 40.452 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -12.691 -54.813 41.547 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -13.987 -53.937 43.493 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -15.096 -53.144 42.393 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -15.683 -55.356 41.398 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -14.585 -56.144 42.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -16.853 -56.243 43.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -15.911 -55.313 44.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -16.975 -54.550 43.281 1.00 0.00 H new ATOM 421 N HIS A 28 -12.602 -51.370 38.763 1.00 0.00 N ATOM 422 CA HIS A 28 -13.202 -51.161 37.455 1.00 0.00 C ATOM 423 C HIS A 28 -12.160 -50.960 36.371 1.00 0.00 C ATOM 424 O HIS A 28 -12.327 -51.428 35.246 1.00 0.00 O ATOM 425 CB HIS A 28 -14.166 -49.985 37.496 1.00 0.00 C ATOM 426 CG HIS A 28 -15.473 -50.335 38.107 1.00 0.00 C ATOM 427 ND1 HIS A 28 -15.682 -50.437 39.466 1.00 0.00 N ATOM 428 CD2 HIS A 28 -16.638 -50.647 37.527 1.00 0.00 C ATOM 429 CE1 HIS A 28 -16.931 -50.803 39.685 1.00 0.00 C ATOM 430 NE2 HIS A 28 -17.532 -50.937 38.524 1.00 0.00 N ATOM 0 H HIS A 28 -12.664 -50.561 39.382 1.00 0.00 H new ATOM 0 HA HIS A 28 -13.755 -52.066 37.203 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -13.713 -49.169 38.060 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -14.330 -49.620 36.482 1.00 0.00 H new ATOM 0 HD1 HIS A 28 -14.983 -50.258 40.187 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -16.837 -50.667 36.466 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -17.382 -50.965 40.653 1.00 0.00 H new ATOM 438 N ALA A 29 -11.083 -50.276 36.717 1.00 0.00 N ATOM 439 CA ALA A 29 -10.018 -49.997 35.763 1.00 0.00 C ATOM 440 C ALA A 29 -9.424 -51.286 35.216 1.00 0.00 C ATOM 441 O ALA A 29 -9.114 -51.379 34.029 1.00 0.00 O ATOM 442 CB ALA A 29 -8.938 -49.147 36.408 1.00 0.00 C ATOM 0 H ALA A 29 -10.921 -49.902 37.652 1.00 0.00 H new ATOM 0 HA ALA A 29 -10.448 -49.442 34.929 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -8.150 -48.948 35.682 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -9.369 -48.204 36.744 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -8.518 -49.678 37.262 1.00 0.00 H new ATOM 448 N LEU A 30 -9.309 -52.286 36.078 1.00 0.00 N ATOM 449 CA LEU A 30 -8.739 -53.571 35.701 1.00 0.00 C ATOM 450 C LEU A 30 -9.566 -54.242 34.612 1.00 0.00 C ATOM 451 O LEU A 30 -9.016 -54.795 33.665 1.00 0.00 O ATOM 452 CB LEU A 30 -8.645 -54.497 36.917 1.00 0.00 C ATOM 453 CG LEU A 30 -7.677 -54.061 38.025 1.00 0.00 C ATOM 454 CD1 LEU A 30 -7.734 -55.030 39.194 1.00 0.00 C ATOM 455 CD2 LEU A 30 -6.259 -53.954 37.488 1.00 0.00 C ATOM 0 H LEU A 30 -9.606 -52.230 37.052 1.00 0.00 H new ATOM 0 HA LEU A 30 -7.737 -53.385 35.313 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -9.640 -54.596 37.350 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -8.348 -55.487 36.572 1.00 0.00 H new ATOM 0 HG LEU A 30 -7.983 -53.076 38.379 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -7.041 -54.705 39.970 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.746 -55.054 39.598 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -7.456 -56.027 38.854 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -5.589 -53.644 38.290 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -5.941 -54.923 37.104 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -6.229 -53.218 36.685 1.00 0.00 H new ATOM 467 N GLU A 31 -10.887 -54.162 34.740 1.00 0.00 N ATOM 468 CA GLU A 31 -11.802 -54.807 33.800 1.00 0.00 C ATOM 469 C GLU A 31 -11.595 -54.285 32.375 1.00 0.00 C ATOM 470 O GLU A 31 -11.547 -55.057 31.415 1.00 0.00 O ATOM 471 CB GLU A 31 -13.250 -54.548 34.224 1.00 0.00 C ATOM 472 CG GLU A 31 -13.616 -55.079 35.598 1.00 0.00 C ATOM 473 CD GLU A 31 -15.059 -54.782 35.967 1.00 0.00 C ATOM 474 OE1 GLU A 31 -15.944 -55.599 35.632 1.00 0.00 O ATOM 475 OE2 GLU A 31 -15.325 -53.729 36.584 1.00 0.00 O ATOM 0 H GLU A 31 -11.352 -53.653 35.492 1.00 0.00 H new ATOM 0 HA GLU A 31 -11.594 -55.877 33.812 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -13.433 -53.474 34.205 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -13.915 -54.998 33.487 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -13.451 -56.156 35.624 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -12.955 -54.637 36.343 1.00 0.00 H new ATOM 482 N PHE A 32 -11.477 -52.972 32.246 1.00 0.00 N ATOM 483 CA PHE A 32 -11.279 -52.346 30.943 1.00 0.00 C ATOM 484 C PHE A 32 -9.930 -52.727 30.359 1.00 0.00 C ATOM 485 O PHE A 32 -9.794 -52.921 29.151 1.00 0.00 O ATOM 486 CB PHE A 32 -11.407 -50.825 31.038 1.00 0.00 C ATOM 487 CG PHE A 32 -12.786 -50.363 31.411 1.00 0.00 C ATOM 488 CD1 PHE A 32 -13.797 -50.326 30.464 1.00 0.00 C ATOM 489 CD2 PHE A 32 -13.075 -49.982 32.706 1.00 0.00 C ATOM 490 CE1 PHE A 32 -15.072 -49.912 30.805 1.00 0.00 C ATOM 491 CE2 PHE A 32 -14.346 -49.569 33.056 1.00 0.00 C ATOM 492 CZ PHE A 32 -15.345 -49.532 32.104 1.00 0.00 C ATOM 0 H PHE A 32 -11.515 -52.317 33.027 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.060 -52.713 30.277 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -10.696 -50.454 31.776 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -11.131 -50.384 30.080 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -13.587 -50.624 29.447 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -12.297 -50.007 33.455 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -15.851 -49.886 30.058 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -14.558 -49.275 34.073 1.00 0.00 H new ATOM 0 HZ PHE A 32 -16.338 -49.206 32.375 1.00 0.00 H new ATOM 502 N LEU A 33 -8.943 -52.846 31.227 1.00 0.00 N ATOM 503 CA LEU A 33 -7.597 -53.208 30.824 1.00 0.00 C ATOM 504 C LEU A 33 -7.591 -54.604 30.218 1.00 0.00 C ATOM 505 O LEU A 33 -6.924 -54.861 29.222 1.00 0.00 O ATOM 506 CB LEU A 33 -6.657 -53.138 32.026 1.00 0.00 C ATOM 507 CG LEU A 33 -6.454 -51.741 32.612 1.00 0.00 C ATOM 508 CD1 LEU A 33 -5.650 -51.818 33.887 1.00 0.00 C ATOM 509 CD2 LEU A 33 -5.780 -50.819 31.608 1.00 0.00 C ATOM 0 H LEU A 33 -9.051 -52.695 32.230 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.248 -52.504 30.069 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.045 -53.790 32.809 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.686 -53.536 31.731 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.434 -51.324 32.843 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.514 -50.815 34.292 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.179 -52.435 34.614 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.676 -52.260 33.677 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.648 -49.832 32.052 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.807 -51.227 31.335 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.401 -50.736 30.716 1.00 0.00 H new ATOM 521 N GLU A 34 -8.361 -55.488 30.821 1.00 0.00 N ATOM 522 CA GLU A 34 -8.505 -56.862 30.354 1.00 0.00 C ATOM 523 C GLU A 34 -9.048 -56.874 28.923 1.00 0.00 C ATOM 524 O GLU A 34 -8.713 -57.745 28.120 1.00 0.00 O ATOM 525 CB GLU A 34 -9.488 -57.608 31.252 1.00 0.00 C ATOM 526 CG GLU A 34 -9.096 -57.660 32.717 1.00 0.00 C ATOM 527 CD GLU A 34 -10.087 -58.429 33.556 1.00 0.00 C ATOM 528 OE1 GLU A 34 -11.296 -58.142 33.471 1.00 0.00 O ATOM 529 OE2 GLU A 34 -9.662 -59.339 34.296 1.00 0.00 O ATOM 0 H GLU A 34 -8.910 -55.277 31.654 1.00 0.00 H new ATOM 0 HA GLU A 34 -7.528 -57.345 30.383 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -10.466 -57.135 31.168 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -9.595 -58.628 30.882 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.112 -58.120 32.810 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -9.010 -56.644 33.103 1.00 0.00 H new ATOM 536 N GLN A 35 -9.887 -55.892 28.630 1.00 0.00 N ATOM 537 CA GLN A 35 -10.518 -55.753 27.327 1.00 0.00 C ATOM 538 C GLN A 35 -9.560 -55.118 26.319 1.00 0.00 C ATOM 539 O GLN A 35 -9.879 -54.996 25.138 1.00 0.00 O ATOM 540 CB GLN A 35 -11.763 -54.884 27.467 1.00 0.00 C ATOM 541 CG GLN A 35 -12.817 -55.467 28.395 1.00 0.00 C ATOM 542 CD GLN A 35 -14.003 -54.540 28.594 1.00 0.00 C ATOM 543 OE1 GLN A 35 -14.312 -53.708 27.734 1.00 0.00 O ATOM 544 NE2 GLN A 35 -14.669 -54.668 29.723 1.00 0.00 N ATOM 0 H GLN A 35 -10.151 -55.164 29.294 1.00 0.00 H new ATOM 0 HA GLN A 35 -10.790 -56.743 26.962 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -11.469 -53.902 27.837 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -12.203 -54.734 26.481 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -13.167 -56.416 27.989 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -12.364 -55.682 29.363 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -14.382 -55.367 30.408 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -15.472 -54.068 29.912 1.00 0.00 H new ATOM 553 N GLY A 36 -8.396 -54.706 26.793 1.00 0.00 N ATOM 554 CA GLY A 36 -7.435 -54.055 25.932 1.00 0.00 C ATOM 555 C GLY A 36 -7.713 -52.576 25.802 1.00 0.00 C ATOM 556 O GLY A 36 -7.240 -51.918 24.876 1.00 0.00 O ATOM 0 H GLY A 36 -8.099 -54.812 27.763 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -6.431 -54.203 26.330 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.458 -54.518 24.945 1.00 0.00 H new ATOM 560 N LYS A 37 -8.487 -52.056 26.732 1.00 0.00 N ATOM 561 CA LYS A 37 -8.844 -50.652 26.745 1.00 0.00 C ATOM 562 C LYS A 37 -7.887 -49.848 27.592 1.00 0.00 C ATOM 563 O LYS A 37 -7.269 -50.363 28.524 1.00 0.00 O ATOM 564 CB LYS A 37 -10.283 -50.456 27.236 1.00 0.00 C ATOM 565 CG LYS A 37 -11.347 -50.824 26.215 1.00 0.00 C ATOM 566 CD LYS A 37 -11.400 -49.796 25.090 1.00 0.00 C ATOM 567 CE LYS A 37 -12.464 -50.145 24.055 1.00 0.00 C ATOM 568 NZ LYS A 37 -12.136 -51.389 23.299 1.00 0.00 N ATOM 0 H LYS A 37 -8.887 -52.595 27.500 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.775 -50.289 25.720 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.434 -51.057 28.133 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.418 -49.413 27.524 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -11.135 -51.810 25.802 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -12.320 -50.885 26.703 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -11.608 -48.811 25.507 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -10.426 -49.738 24.605 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -13.425 -50.269 24.554 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -12.572 -49.316 23.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -12.824 -51.520 22.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -11.180 -51.310 22.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -12.175 -52.206 23.941 1.00 0.00 H new ATOM 582 N HIS A 38 -7.773 -48.589 27.263 1.00 0.00 N ATOM 583 CA HIS A 38 -6.915 -47.688 27.962 1.00 0.00 C ATOM 584 C HIS A 38 -7.696 -46.881 28.968 1.00 0.00 C ATOM 585 O HIS A 38 -8.822 -46.459 28.697 1.00 0.00 O ATOM 586 CB HIS A 38 -6.261 -46.734 26.975 1.00 0.00 C ATOM 587 CG HIS A 38 -4.946 -47.188 26.454 1.00 0.00 C ATOM 588 ND1 HIS A 38 -4.769 -47.857 25.258 1.00 0.00 N ATOM 589 CD2 HIS A 38 -3.728 -47.033 26.974 1.00 0.00 C ATOM 590 CE1 HIS A 38 -3.474 -48.084 25.083 1.00 0.00 C ATOM 591 NE2 HIS A 38 -2.832 -47.585 26.111 1.00 0.00 N ATOM 0 H HIS A 38 -8.283 -48.161 26.490 1.00 0.00 H new ATOM 0 HA HIS A 38 -6.156 -48.273 28.481 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -6.937 -46.582 26.134 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -6.131 -45.766 27.458 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -5.512 -48.131 24.615 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -3.494 -46.554 27.913 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -3.027 -48.591 24.241 1.00 0.00 H new ATOM 599 N VAL A 39 -7.103 -46.675 30.122 1.00 0.00 N ATOM 600 CA VAL A 39 -7.695 -45.850 31.145 1.00 0.00 C ATOM 601 C VAL A 39 -6.826 -44.639 31.362 1.00 0.00 C ATOM 602 O VAL A 39 -5.610 -44.754 31.550 1.00 0.00 O ATOM 603 CB VAL A 39 -7.880 -46.601 32.497 1.00 0.00 C ATOM 604 CG1 VAL A 39 -8.238 -45.623 33.607 1.00 0.00 C ATOM 605 CG2 VAL A 39 -8.967 -47.643 32.384 1.00 0.00 C ATOM 0 H VAL A 39 -6.199 -47.074 30.375 1.00 0.00 H new ATOM 0 HA VAL A 39 -8.688 -45.564 30.799 1.00 0.00 H new ATOM 0 HB VAL A 39 -6.937 -47.091 32.738 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -8.363 -46.166 34.544 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.440 -44.889 33.717 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -9.168 -45.113 33.356 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -9.080 -48.156 33.339 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -9.907 -47.160 32.118 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.699 -48.366 31.613 1.00 0.00 H new ATOM 615 N ARG A 40 -7.433 -43.490 31.313 1.00 0.00 N ATOM 616 CA ARG A 40 -6.735 -42.260 31.521 1.00 0.00 C ATOM 617 C ARG A 40 -7.036 -41.781 32.926 1.00 0.00 C ATOM 618 O ARG A 40 -8.174 -41.408 33.230 1.00 0.00 O ATOM 619 CB ARG A 40 -7.202 -41.225 30.492 1.00 0.00 C ATOM 620 CG ARG A 40 -6.436 -39.914 30.516 1.00 0.00 C ATOM 621 CD ARG A 40 -7.027 -38.921 29.524 1.00 0.00 C ATOM 622 NE ARG A 40 -6.198 -37.723 29.374 1.00 0.00 N ATOM 623 CZ ARG A 40 -6.635 -36.545 28.906 1.00 0.00 C ATOM 624 NH1 ARG A 40 -7.926 -36.350 28.669 1.00 0.00 N ATOM 625 NH2 ARG A 40 -5.779 -35.548 28.712 1.00 0.00 N ATOM 0 H ARG A 40 -8.430 -43.381 31.127 1.00 0.00 H new ATOM 0 HA ARG A 40 -5.661 -42.402 31.401 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -7.119 -41.660 29.496 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -8.258 -41.016 30.661 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -6.463 -39.491 31.520 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -5.389 -40.096 30.275 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -7.141 -39.405 28.554 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -8.024 -38.631 29.855 1.00 0.00 H new ATOM 0 HE ARG A 40 -5.217 -37.790 29.645 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -8.595 -37.100 28.843 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -8.249 -35.450 28.313 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -4.789 -35.678 28.919 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -6.112 -34.652 28.356 1.00 0.00 H new ATOM 639 N PHE A 41 -6.037 -41.814 33.785 1.00 0.00 N ATOM 640 CA PHE A 41 -6.215 -41.380 35.153 1.00 0.00 C ATOM 641 C PHE A 41 -5.893 -39.921 35.261 1.00 0.00 C ATOM 642 O PHE A 41 -4.784 -39.491 34.936 1.00 0.00 O ATOM 643 CB PHE A 41 -5.343 -42.192 36.115 1.00 0.00 C ATOM 644 CG PHE A 41 -5.828 -43.594 36.337 1.00 0.00 C ATOM 645 CD1 PHE A 41 -6.864 -43.846 37.215 1.00 0.00 C ATOM 646 CD2 PHE A 41 -5.246 -44.656 35.671 1.00 0.00 C ATOM 647 CE1 PHE A 41 -7.317 -45.132 37.430 1.00 0.00 C ATOM 648 CE2 PHE A 41 -5.693 -45.946 35.882 1.00 0.00 C ATOM 649 CZ PHE A 41 -6.729 -46.182 36.763 1.00 0.00 C ATOM 0 H PHE A 41 -5.096 -42.136 33.559 1.00 0.00 H new ATOM 0 HA PHE A 41 -7.255 -41.545 35.435 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -4.325 -42.227 35.726 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -5.300 -41.676 37.074 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -7.327 -43.024 37.741 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -4.436 -44.476 34.980 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -8.129 -45.313 38.119 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -5.232 -46.770 35.358 1.00 0.00 H new ATOM 0 HZ PHE A 41 -7.078 -47.191 36.929 1.00 0.00 H new ATOM 659 N ARG A 42 -6.865 -39.158 35.687 1.00 0.00 N ATOM 660 CA ARG A 42 -6.718 -37.731 35.797 1.00 0.00 C ATOM 661 C ARG A 42 -7.195 -37.274 37.156 1.00 0.00 C ATOM 662 O ARG A 42 -8.210 -37.760 37.654 1.00 0.00 O ATOM 663 CB ARG A 42 -7.548 -37.047 34.709 1.00 0.00 C ATOM 664 CG ARG A 42 -7.176 -37.473 33.298 1.00 0.00 C ATOM 665 CD ARG A 42 -8.071 -36.820 32.270 1.00 0.00 C ATOM 666 NE ARG A 42 -7.868 -35.375 32.203 1.00 0.00 N ATOM 667 CZ ARG A 42 -8.640 -34.540 31.500 1.00 0.00 C ATOM 668 NH1 ARG A 42 -9.671 -35.007 30.796 1.00 0.00 N ATOM 669 NH2 ARG A 42 -8.366 -33.243 31.481 1.00 0.00 N ATOM 0 H ARG A 42 -7.781 -39.509 35.967 1.00 0.00 H new ATOM 0 HA ARG A 42 -5.668 -37.466 35.675 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -8.603 -37.264 34.878 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -7.427 -35.967 34.797 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -6.137 -37.209 33.099 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -7.251 -38.557 33.212 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -7.878 -37.259 31.291 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -9.113 -37.028 32.513 1.00 0.00 H new ATOM 0 HE ARG A 42 -7.088 -34.978 32.726 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -9.875 -36.006 30.792 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -10.256 -34.365 30.262 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.567 -32.883 32.002 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -8.954 -32.605 30.945 1.00 0.00 H new ATOM 683 N VAL A 43 -6.473 -36.367 37.756 1.00 0.00 N ATOM 684 CA VAL A 43 -6.873 -35.831 39.041 1.00 0.00 C ATOM 685 C VAL A 43 -6.861 -34.316 39.018 1.00 0.00 C ATOM 686 O VAL A 43 -5.936 -33.692 38.486 1.00 0.00 O ATOM 687 CB VAL A 43 -5.986 -36.356 40.203 1.00 0.00 C ATOM 688 CG1 VAL A 43 -4.520 -36.158 39.911 1.00 0.00 C ATOM 689 CG2 VAL A 43 -6.360 -35.683 41.517 1.00 0.00 C ATOM 0 H VAL A 43 -5.606 -35.981 37.382 1.00 0.00 H new ATOM 0 HA VAL A 43 -7.890 -36.178 39.224 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.169 -37.427 40.296 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -3.929 -36.536 40.745 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -4.254 -36.698 39.003 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -4.316 -35.096 39.774 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.725 -36.067 42.316 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.219 -34.606 41.427 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.404 -35.894 41.750 1.00 0.00 H new ATOM 699 N PHE A 44 -7.897 -33.733 39.576 1.00 0.00 N ATOM 700 CA PHE A 44 -8.022 -32.302 39.643 1.00 0.00 C ATOM 701 C PHE A 44 -7.584 -31.806 41.009 1.00 0.00 C ATOM 702 O PHE A 44 -8.008 -32.344 42.039 1.00 0.00 O ATOM 703 CB PHE A 44 -9.474 -31.890 39.367 1.00 0.00 C ATOM 704 CG PHE A 44 -9.710 -30.406 39.413 1.00 0.00 C ATOM 705 CD1 PHE A 44 -9.380 -29.607 38.331 1.00 0.00 C ATOM 706 CD2 PHE A 44 -10.264 -29.814 40.534 1.00 0.00 C ATOM 707 CE1 PHE A 44 -9.598 -28.244 38.368 1.00 0.00 C ATOM 708 CE2 PHE A 44 -10.484 -28.454 40.578 1.00 0.00 C ATOM 709 CZ PHE A 44 -10.151 -27.666 39.493 1.00 0.00 C ATOM 0 H PHE A 44 -8.675 -34.241 39.996 1.00 0.00 H new ATOM 0 HA PHE A 44 -7.380 -31.852 38.886 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -9.766 -32.263 38.385 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -10.123 -32.373 40.098 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -8.947 -30.055 37.449 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -10.527 -30.425 41.385 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -9.336 -27.631 37.518 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -10.916 -28.005 41.460 1.00 0.00 H new ATOM 0 HZ PHE A 44 -10.323 -26.600 39.525 1.00 0.00 H new ATOM 719 N LEU A 45 -6.725 -30.803 41.024 1.00 0.00 N ATOM 720 CA LEU A 45 -6.285 -30.222 42.272 1.00 0.00 C ATOM 721 C LEU A 45 -7.153 -29.017 42.548 1.00 0.00 C ATOM 722 O LEU A 45 -7.255 -28.114 41.716 1.00 0.00 O ATOM 723 CB LEU A 45 -4.816 -29.805 42.200 1.00 0.00 C ATOM 724 CG LEU A 45 -3.836 -30.866 41.690 1.00 0.00 C ATOM 725 CD1 LEU A 45 -2.421 -30.370 41.812 1.00 0.00 C ATOM 726 CD2 LEU A 45 -4.000 -32.169 42.439 1.00 0.00 C ATOM 0 H LEU A 45 -6.322 -30.378 40.189 1.00 0.00 H new ATOM 0 HA LEU A 45 -6.375 -30.957 43.072 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -4.740 -28.930 41.555 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -4.498 -29.496 43.196 1.00 0.00 H new ATOM 0 HG LEU A 45 -4.058 -31.051 40.639 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -1.735 -31.134 41.446 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -2.302 -29.462 41.221 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -2.200 -30.154 42.857 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -3.291 -32.902 42.054 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.812 -32.005 43.500 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -5.016 -32.541 42.304 1.00 0.00 H new ATOM 738 N LYS A 46 -7.770 -28.988 43.698 1.00 0.00 N ATOM 739 CA LYS A 46 -8.739 -27.962 43.976 1.00 0.00 C ATOM 740 C LYS A 46 -8.191 -26.859 44.878 1.00 0.00 C ATOM 741 O LYS A 46 -7.622 -27.120 45.940 1.00 0.00 O ATOM 742 CB LYS A 46 -9.999 -28.599 44.562 1.00 0.00 C ATOM 743 CG LYS A 46 -11.152 -27.638 44.764 1.00 0.00 C ATOM 744 CD LYS A 46 -12.412 -28.369 45.209 1.00 0.00 C ATOM 745 CE LYS A 46 -12.958 -29.247 44.089 1.00 0.00 C ATOM 746 NZ LYS A 46 -14.275 -29.833 44.421 1.00 0.00 N ATOM 0 H LYS A 46 -7.621 -29.657 44.453 1.00 0.00 H new ATOM 0 HA LYS A 46 -8.990 -27.471 43.036 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -10.324 -29.404 43.903 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -9.749 -29.054 45.521 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -10.879 -26.892 45.510 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -11.349 -27.103 43.835 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -12.191 -28.983 46.082 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -13.169 -27.645 45.511 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -13.046 -28.655 43.178 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -12.249 -30.048 43.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -14.603 -30.421 43.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -14.188 -30.420 45.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -14.961 -29.070 44.593 1.00 0.00 H new ATOM 760 N GLY A 47 -8.356 -25.626 44.425 1.00 0.00 N ATOM 761 CA GLY A 47 -7.940 -24.476 45.200 1.00 0.00 C ATOM 762 C GLY A 47 -6.435 -24.316 45.291 1.00 0.00 C ATOM 763 O GLY A 47 -5.744 -24.198 44.272 1.00 0.00 O ATOM 0 H GLY A 47 -8.776 -25.400 43.523 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -8.366 -23.576 44.756 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -8.349 -24.560 46.207 1.00 0.00 H new ATOM 767 N ARG A 48 -5.929 -24.342 46.514 1.00 0.00 N ATOM 768 CA ARG A 48 -4.510 -24.100 46.795 1.00 0.00 C ATOM 769 C ARG A 48 -3.652 -25.310 46.445 1.00 0.00 C ATOM 770 O ARG A 48 -2.426 -25.237 46.458 1.00 0.00 O ATOM 771 CB ARG A 48 -4.336 -23.755 48.274 1.00 0.00 C ATOM 772 CG ARG A 48 -5.135 -22.540 48.700 1.00 0.00 C ATOM 773 CD ARG A 48 -5.006 -22.280 50.183 1.00 0.00 C ATOM 774 NE ARG A 48 -5.852 -21.167 50.605 1.00 0.00 N ATOM 775 CZ ARG A 48 -6.865 -21.284 51.473 1.00 0.00 C ATOM 776 NH1 ARG A 48 -7.105 -22.448 52.068 1.00 0.00 N ATOM 777 NH2 ARG A 48 -7.627 -20.239 51.749 1.00 0.00 N ATOM 0 H ARG A 48 -6.487 -24.531 47.347 1.00 0.00 H new ATOM 0 HA ARG A 48 -4.180 -23.267 46.174 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -4.638 -24.611 48.878 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -3.280 -23.577 48.478 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -4.792 -21.666 48.146 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -6.185 -22.687 48.446 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -5.281 -23.178 50.736 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -3.966 -22.061 50.426 1.00 0.00 H new ATOM 0 HE ARG A 48 -5.660 -20.244 50.215 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -6.517 -23.256 51.864 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -7.877 -22.533 52.729 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -7.444 -19.341 51.300 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -8.398 -20.331 52.410 1.00 0.00 H new ATOM 791 N GLU A 49 -4.298 -26.419 46.134 1.00 0.00 N ATOM 792 CA GLU A 49 -3.595 -27.645 45.788 1.00 0.00 C ATOM 793 C GLU A 49 -2.835 -27.486 44.472 1.00 0.00 C ATOM 794 O GLU A 49 -1.855 -28.177 44.222 1.00 0.00 O ATOM 795 CB GLU A 49 -4.584 -28.799 45.706 1.00 0.00 C ATOM 796 CG GLU A 49 -5.299 -29.058 47.017 1.00 0.00 C ATOM 797 CD GLU A 49 -6.271 -30.210 46.948 1.00 0.00 C ATOM 798 OE1 GLU A 49 -6.980 -30.342 45.929 1.00 0.00 O ATOM 799 OE2 GLU A 49 -6.351 -30.977 47.940 1.00 0.00 O ATOM 0 H GLU A 49 -5.315 -26.498 46.113 1.00 0.00 H new ATOM 0 HA GLU A 49 -2.864 -27.862 46.567 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -5.321 -28.585 44.932 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -4.056 -29.703 45.401 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -4.560 -29.261 47.792 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -5.835 -28.157 47.315 1.00 0.00 H new ATOM 806 N MET A 50 -3.283 -26.542 43.652 1.00 0.00 N ATOM 807 CA MET A 50 -2.667 -26.275 42.359 1.00 0.00 C ATOM 808 C MET A 50 -1.231 -25.773 42.504 1.00 0.00 C ATOM 809 O MET A 50 -0.446 -25.831 41.557 1.00 0.00 O ATOM 810 CB MET A 50 -3.496 -25.265 41.569 1.00 0.00 C ATOM 811 CG MET A 50 -4.839 -25.804 41.117 1.00 0.00 C ATOM 812 SD MET A 50 -5.803 -24.602 40.183 1.00 0.00 S ATOM 813 CE MET A 50 -7.218 -25.603 39.744 1.00 0.00 C ATOM 0 H MET A 50 -4.081 -25.943 43.864 1.00 0.00 H new ATOM 0 HA MET A 50 -2.637 -27.219 41.815 1.00 0.00 H new ATOM 0 HB2 MET A 50 -3.657 -24.380 42.184 1.00 0.00 H new ATOM 0 HB3 MET A 50 -2.929 -24.946 40.694 1.00 0.00 H new ATOM 0 HG2 MET A 50 -4.680 -26.690 40.503 1.00 0.00 H new ATOM 0 HG3 MET A 50 -5.410 -26.120 41.990 1.00 0.00 H new ATOM 0 HE1 MET A 50 -7.884 -25.029 39.100 1.00 0.00 H new ATOM 0 HE2 MET A 50 -6.883 -26.496 39.216 1.00 0.00 H new ATOM 0 HE3 MET A 50 -7.751 -25.896 40.648 1.00 0.00 H new ATOM 823 N ALA A 51 -0.894 -25.279 43.685 1.00 0.00 N ATOM 824 CA ALA A 51 0.440 -24.766 43.942 1.00 0.00 C ATOM 825 C ALA A 51 1.464 -25.894 44.040 1.00 0.00 C ATOM 826 O ALA A 51 2.670 -25.651 43.980 1.00 0.00 O ATOM 827 CB ALA A 51 0.454 -23.931 45.211 1.00 0.00 C ATOM 0 H ALA A 51 -1.528 -25.223 44.482 1.00 0.00 H new ATOM 0 HA ALA A 51 0.718 -24.133 43.099 1.00 0.00 H new ATOM 0 HB1 ALA A 51 1.462 -23.555 45.388 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.233 -23.092 45.102 1.00 0.00 H new ATOM 0 HB3 ALA A 51 0.143 -24.547 46.055 1.00 0.00 H new ATOM 833 N THR A 52 0.992 -27.120 44.185 1.00 0.00 N ATOM 834 CA THR A 52 1.881 -28.254 44.305 1.00 0.00 C ATOM 835 C THR A 52 1.339 -29.478 43.531 1.00 0.00 C ATOM 836 O THR A 52 0.377 -30.136 43.933 1.00 0.00 O ATOM 837 CB THR A 52 2.169 -28.592 45.799 1.00 0.00 C ATOM 838 OG1 THR A 52 3.103 -29.663 45.895 1.00 0.00 O ATOM 839 CG2 THR A 52 0.891 -28.948 46.558 1.00 0.00 C ATOM 0 H THR A 52 -0.001 -27.352 44.222 1.00 0.00 H new ATOM 0 HA THR A 52 2.832 -27.981 43.848 1.00 0.00 H new ATOM 0 HB THR A 52 2.594 -27.699 46.258 1.00 0.00 H new ATOM 0 HG1 THR A 52 2.764 -30.338 46.520 1.00 0.00 H new ATOM 0 HG21 THR A 52 1.136 -29.177 47.595 1.00 0.00 H new ATOM 0 HG22 THR A 52 0.202 -28.104 46.525 1.00 0.00 H new ATOM 0 HG23 THR A 52 0.423 -29.817 46.095 1.00 0.00 H new ATOM 847 N PRO A 53 1.966 -29.770 42.390 1.00 0.00 N ATOM 848 CA PRO A 53 1.539 -30.847 41.487 1.00 0.00 C ATOM 849 C PRO A 53 1.759 -32.257 42.057 1.00 0.00 C ATOM 850 O PRO A 53 1.113 -33.218 41.623 1.00 0.00 O ATOM 851 CB PRO A 53 2.410 -30.631 40.247 1.00 0.00 C ATOM 852 CG PRO A 53 3.620 -29.922 40.754 1.00 0.00 C ATOM 853 CD PRO A 53 3.164 -29.074 41.894 1.00 0.00 C ATOM 0 HA PRO A 53 0.466 -30.801 41.299 1.00 0.00 H new ATOM 0 HB2 PRO A 53 2.674 -31.579 39.778 1.00 0.00 H new ATOM 0 HB3 PRO A 53 1.889 -30.038 39.495 1.00 0.00 H new ATOM 0 HG2 PRO A 53 4.380 -30.633 41.078 1.00 0.00 H new ATOM 0 HG3 PRO A 53 4.069 -29.311 39.971 1.00 0.00 H new ATOM 0 HD2 PRO A 53 3.930 -28.995 42.666 1.00 0.00 H new ATOM 0 HD3 PRO A 53 2.932 -28.059 41.570 1.00 0.00 H new ATOM 861 N GLU A 54 2.649 -32.375 43.037 1.00 0.00 N ATOM 862 CA GLU A 54 2.982 -33.678 43.607 1.00 0.00 C ATOM 863 C GLU A 54 1.813 -34.314 44.360 1.00 0.00 C ATOM 864 O GLU A 54 1.789 -35.530 44.554 1.00 0.00 O ATOM 865 CB GLU A 54 4.265 -33.621 44.460 1.00 0.00 C ATOM 866 CG GLU A 54 4.383 -32.415 45.384 1.00 0.00 C ATOM 867 CD GLU A 54 3.564 -32.535 46.650 1.00 0.00 C ATOM 868 OE1 GLU A 54 4.089 -33.065 47.647 1.00 0.00 O ATOM 869 OE2 GLU A 54 2.412 -32.073 46.663 1.00 0.00 O ATOM 0 H GLU A 54 3.151 -31.590 43.452 1.00 0.00 H new ATOM 0 HA GLU A 54 3.188 -34.338 42.764 1.00 0.00 H new ATOM 0 HB2 GLU A 54 4.320 -34.527 45.064 1.00 0.00 H new ATOM 0 HB3 GLU A 54 5.126 -33.631 43.792 1.00 0.00 H new ATOM 0 HG2 GLU A 54 5.430 -32.275 45.652 1.00 0.00 H new ATOM 0 HG3 GLU A 54 4.070 -31.522 44.843 1.00 0.00 H new ATOM 876 N ALA A 55 0.843 -33.499 44.768 1.00 0.00 N ATOM 877 CA ALA A 55 -0.346 -34.014 45.431 1.00 0.00 C ATOM 878 C ALA A 55 -1.112 -34.930 44.480 1.00 0.00 C ATOM 879 O ALA A 55 -1.571 -36.008 44.865 1.00 0.00 O ATOM 880 CB ALA A 55 -1.234 -32.864 45.895 1.00 0.00 C ATOM 0 H ALA A 55 0.859 -32.486 44.651 1.00 0.00 H new ATOM 0 HA ALA A 55 -0.044 -34.588 46.307 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -2.119 -33.264 46.389 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -0.681 -32.236 46.594 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -1.537 -32.268 45.034 1.00 0.00 H new ATOM 886 N GLY A 56 -1.226 -34.495 43.228 1.00 0.00 N ATOM 887 CA GLY A 56 -1.867 -35.302 42.212 1.00 0.00 C ATOM 888 C GLY A 56 -1.034 -36.513 41.862 1.00 0.00 C ATOM 889 O GLY A 56 -1.557 -37.601 41.634 1.00 0.00 O ATOM 0 H GLY A 56 -0.883 -33.592 42.901 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -2.847 -35.623 42.565 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -2.031 -34.701 41.318 1.00 0.00 H new ATOM 893 N VAL A 57 0.272 -36.311 41.836 1.00 0.00 N ATOM 894 CA VAL A 57 1.222 -37.359 41.508 1.00 0.00 C ATOM 895 C VAL A 57 1.160 -38.494 42.527 1.00 0.00 C ATOM 896 O VAL A 57 1.125 -39.672 42.158 1.00 0.00 O ATOM 897 CB VAL A 57 2.662 -36.793 41.435 1.00 0.00 C ATOM 898 CG1 VAL A 57 3.668 -37.894 41.177 1.00 0.00 C ATOM 899 CG2 VAL A 57 2.755 -35.728 40.355 1.00 0.00 C ATOM 0 H VAL A 57 0.705 -35.411 42.043 1.00 0.00 H new ATOM 0 HA VAL A 57 0.951 -37.756 40.530 1.00 0.00 H new ATOM 0 HB VAL A 57 2.897 -36.340 42.398 1.00 0.00 H new ATOM 0 HG11 VAL A 57 4.670 -37.468 41.131 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.622 -38.625 41.984 1.00 0.00 H new ATOM 0 HG13 VAL A 57 3.438 -38.383 40.230 1.00 0.00 H new ATOM 0 HG21 VAL A 57 3.772 -35.339 40.315 1.00 0.00 H new ATOM 0 HG22 VAL A 57 2.495 -36.164 39.391 1.00 0.00 H new ATOM 0 HG23 VAL A 57 2.065 -34.916 40.584 1.00 0.00 H new ATOM 909 N ALA A 58 1.113 -38.132 43.807 1.00 0.00 N ATOM 910 CA ALA A 58 1.060 -39.116 44.884 1.00 0.00 C ATOM 911 C ALA A 58 -0.192 -39.973 44.774 1.00 0.00 C ATOM 912 O ALA A 58 -0.147 -41.188 44.978 1.00 0.00 O ATOM 913 CB ALA A 58 1.104 -38.423 46.235 1.00 0.00 C ATOM 0 H ALA A 58 1.111 -37.162 44.123 1.00 0.00 H new ATOM 0 HA ALA A 58 1.930 -39.767 44.793 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.064 -39.169 47.028 1.00 0.00 H new ATOM 0 HB2 ALA A 58 2.028 -37.852 46.321 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.252 -37.750 46.327 1.00 0.00 H new ATOM 919 N LEU A 59 -1.303 -39.332 44.440 1.00 0.00 N ATOM 920 CA LEU A 59 -2.566 -40.032 44.277 1.00 0.00 C ATOM 921 C LEU A 59 -2.465 -41.049 43.143 1.00 0.00 C ATOM 922 O LEU A 59 -2.851 -42.206 43.293 1.00 0.00 O ATOM 923 CB LEU A 59 -3.682 -39.031 43.959 1.00 0.00 C ATOM 924 CG LEU A 59 -5.082 -39.626 43.739 1.00 0.00 C ATOM 925 CD1 LEU A 59 -5.669 -40.145 45.037 1.00 0.00 C ATOM 926 CD2 LEU A 59 -6.004 -38.606 43.120 1.00 0.00 C ATOM 0 H LEU A 59 -1.354 -38.326 44.277 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.796 -40.552 45.207 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -3.740 -38.311 44.775 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -3.400 -38.476 43.064 1.00 0.00 H new ATOM 0 HG LEU A 59 -4.980 -40.467 43.053 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -6.659 -40.559 44.848 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -5.022 -40.922 45.444 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.748 -39.327 45.753 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -6.989 -39.048 42.973 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -6.088 -37.743 43.781 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -5.602 -38.288 42.158 1.00 0.00 H new ATOM 938 N LEU A 60 -1.912 -40.612 42.023 1.00 0.00 N ATOM 939 CA LEU A 60 -1.783 -41.450 40.843 1.00 0.00 C ATOM 940 C LEU A 60 -0.842 -42.628 41.077 1.00 0.00 C ATOM 941 O LEU A 60 -1.117 -43.744 40.633 1.00 0.00 O ATOM 942 CB LEU A 60 -1.321 -40.625 39.650 1.00 0.00 C ATOM 943 CG LEU A 60 -2.296 -39.540 39.190 1.00 0.00 C ATOM 944 CD1 LEU A 60 -1.731 -38.785 38.015 1.00 0.00 C ATOM 945 CD2 LEU A 60 -3.649 -40.136 38.841 1.00 0.00 C ATOM 0 H LEU A 60 -1.541 -39.669 41.907 1.00 0.00 H new ATOM 0 HA LEU A 60 -2.769 -41.861 40.627 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -0.371 -40.154 39.901 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -1.132 -41.299 38.814 1.00 0.00 H new ATOM 0 HG LEU A 60 -2.438 -38.841 40.015 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.438 -38.017 37.702 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -0.790 -38.316 38.302 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -1.555 -39.475 37.190 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.323 -39.343 38.517 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -3.530 -40.862 38.037 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -4.066 -40.631 39.718 1.00 0.00 H new ATOM 957 N GLU A 61 0.267 -42.382 41.765 1.00 0.00 N ATOM 958 CA GLU A 61 1.223 -43.446 42.061 1.00 0.00 C ATOM 959 C GLU A 61 0.594 -44.489 42.975 1.00 0.00 C ATOM 960 O GLU A 61 0.873 -45.686 42.859 1.00 0.00 O ATOM 961 CB GLU A 61 2.493 -42.889 42.689 1.00 0.00 C ATOM 962 CG GLU A 61 3.304 -42.018 41.752 1.00 0.00 C ATOM 963 CD GLU A 61 4.600 -41.565 42.372 1.00 0.00 C ATOM 964 OE1 GLU A 61 4.611 -40.520 43.056 1.00 0.00 O ATOM 965 OE2 GLU A 61 5.619 -42.265 42.194 1.00 0.00 O ATOM 0 H GLU A 61 0.526 -41.464 42.126 1.00 0.00 H new ATOM 0 HA GLU A 61 1.494 -43.922 41.119 1.00 0.00 H new ATOM 0 HB2 GLU A 61 2.227 -42.308 43.572 1.00 0.00 H new ATOM 0 HB3 GLU A 61 3.114 -43.718 43.029 1.00 0.00 H new ATOM 0 HG2 GLU A 61 3.515 -42.571 40.837 1.00 0.00 H new ATOM 0 HG3 GLU A 61 2.715 -41.146 41.469 1.00 0.00 H new ATOM 972 N LYS A 62 -0.254 -44.027 43.882 1.00 0.00 N ATOM 973 CA LYS A 62 -0.972 -44.911 44.780 1.00 0.00 C ATOM 974 C LYS A 62 -1.893 -45.827 43.969 1.00 0.00 C ATOM 975 O LYS A 62 -1.991 -47.029 44.234 1.00 0.00 O ATOM 976 CB LYS A 62 -1.768 -44.086 45.782 1.00 0.00 C ATOM 977 CG LYS A 62 -2.428 -44.904 46.870 1.00 0.00 C ATOM 978 CD LYS A 62 -3.136 -44.008 47.867 1.00 0.00 C ATOM 979 CE LYS A 62 -2.147 -43.152 48.653 1.00 0.00 C ATOM 980 NZ LYS A 62 -2.827 -42.277 49.634 1.00 0.00 N ATOM 0 H LYS A 62 -0.461 -43.037 44.014 1.00 0.00 H new ATOM 0 HA LYS A 62 -0.266 -45.532 45.331 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -1.104 -43.355 46.244 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -2.535 -43.526 45.247 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -3.143 -45.597 46.426 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -1.678 -45.505 47.384 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -3.840 -43.362 47.341 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -3.718 -44.619 48.557 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -1.441 -43.799 49.173 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -1.568 -42.540 47.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -2.119 -41.713 50.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -3.482 -41.641 49.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -3.359 -42.861 50.310 1.00 0.00 H new ATOM 994 N ILE A 63 -2.542 -45.250 42.970 1.00 0.00 N ATOM 995 CA ILE A 63 -3.399 -45.992 42.053 1.00 0.00 C ATOM 996 C ILE A 63 -2.570 -46.992 41.252 1.00 0.00 C ATOM 997 O ILE A 63 -2.955 -48.153 41.087 1.00 0.00 O ATOM 998 CB ILE A 63 -4.118 -45.039 41.066 1.00 0.00 C ATOM 999 CG1 ILE A 63 -4.896 -43.965 41.821 1.00 0.00 C ATOM 1000 CG2 ILE A 63 -5.036 -45.812 40.132 1.00 0.00 C ATOM 1001 CD1 ILE A 63 -5.528 -42.927 40.919 1.00 0.00 C ATOM 0 H ILE A 63 -2.490 -44.251 42.770 1.00 0.00 H new ATOM 0 HA ILE A 63 -4.145 -46.517 42.650 1.00 0.00 H new ATOM 0 HB ILE A 63 -3.357 -44.547 40.460 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -5.676 -44.443 42.414 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -4.225 -43.466 42.520 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -5.528 -45.119 39.450 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -4.450 -46.531 39.559 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -5.788 -46.341 40.717 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -6.064 -42.196 41.525 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.751 -42.422 40.345 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -6.225 -43.414 40.237 1.00 0.00 H new ATOM 1013 N TRP A 64 -1.423 -46.530 40.779 1.00 0.00 N ATOM 1014 CA TRP A 64 -0.534 -47.341 39.966 1.00 0.00 C ATOM 1015 C TRP A 64 -0.129 -48.631 40.669 1.00 0.00 C ATOM 1016 O TRP A 64 -0.132 -49.690 40.060 1.00 0.00 O ATOM 1017 CB TRP A 64 0.711 -46.541 39.551 1.00 0.00 C ATOM 1018 CG TRP A 64 1.749 -47.380 38.867 1.00 0.00 C ATOM 1019 CD1 TRP A 64 3.031 -47.598 39.277 1.00 0.00 C ATOM 1020 CD2 TRP A 64 1.584 -48.140 37.668 1.00 0.00 C ATOM 1021 NE1 TRP A 64 3.661 -48.437 38.396 1.00 0.00 N ATOM 1022 CE2 TRP A 64 2.803 -48.780 37.415 1.00 0.00 C ATOM 1023 CE3 TRP A 64 0.526 -48.335 36.780 1.00 0.00 C ATOM 1024 CZ2 TRP A 64 2.993 -49.607 36.331 1.00 0.00 C ATOM 1025 CZ3 TRP A 64 0.726 -49.158 35.700 1.00 0.00 C ATOM 1026 CH2 TRP A 64 1.951 -49.779 35.489 1.00 0.00 C ATOM 0 H TRP A 64 -1.084 -45.583 40.948 1.00 0.00 H new ATOM 0 HA TRP A 64 -1.088 -47.619 39.069 1.00 0.00 H new ATOM 0 HB2 TRP A 64 0.410 -45.732 38.885 1.00 0.00 H new ATOM 0 HB3 TRP A 64 1.150 -46.080 40.435 1.00 0.00 H new ATOM 0 HD1 TRP A 64 3.482 -47.174 40.162 1.00 0.00 H new ATOM 0 HE1 TRP A 64 4.628 -48.753 38.471 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -0.426 -47.851 36.938 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 3.939 -50.099 36.160 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -0.082 -49.326 35.003 1.00 0.00 H new ATOM 0 HH2 TRP A 64 2.073 -50.418 34.627 1.00 0.00 H new ATOM 1037 N THR A 65 0.177 -48.552 41.954 1.00 0.00 N ATOM 1038 CA THR A 65 0.595 -49.738 42.691 1.00 0.00 C ATOM 1039 C THR A 65 -0.520 -50.786 42.779 1.00 0.00 C ATOM 1040 O THR A 65 -0.258 -51.964 42.995 1.00 0.00 O ATOM 1041 CB THR A 65 1.118 -49.391 44.107 1.00 0.00 C ATOM 1042 OG1 THR A 65 0.207 -48.506 44.781 1.00 0.00 O ATOM 1043 CG2 THR A 65 2.496 -48.750 44.032 1.00 0.00 C ATOM 0 H THR A 65 0.145 -47.693 42.504 1.00 0.00 H new ATOM 0 HA THR A 65 1.419 -50.169 42.123 1.00 0.00 H new ATOM 0 HB THR A 65 1.193 -50.320 44.672 1.00 0.00 H new ATOM 0 HG1 THR A 65 -0.557 -48.316 44.197 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.843 -48.515 45.038 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.194 -49.442 43.560 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.440 -47.834 43.444 1.00 0.00 H new ATOM 1051 N MET A 66 -1.755 -50.355 42.614 1.00 0.00 N ATOM 1052 CA MET A 66 -2.882 -51.263 42.667 1.00 0.00 C ATOM 1053 C MET A 66 -3.116 -51.975 41.328 1.00 0.00 C ATOM 1054 O MET A 66 -3.573 -53.114 41.297 1.00 0.00 O ATOM 1055 CB MET A 66 -4.137 -50.517 43.088 1.00 0.00 C ATOM 1056 CG MET A 66 -4.101 -50.004 44.515 1.00 0.00 C ATOM 1057 SD MET A 66 -5.635 -49.191 44.989 1.00 0.00 S ATOM 1058 CE MET A 66 -5.186 -48.568 46.600 1.00 0.00 C ATOM 0 H MET A 66 -2.003 -49.381 42.442 1.00 0.00 H new ATOM 0 HA MET A 66 -2.648 -52.028 43.407 1.00 0.00 H new ATOM 0 HB2 MET A 66 -4.290 -49.674 42.414 1.00 0.00 H new ATOM 0 HB3 MET A 66 -4.996 -51.178 42.972 1.00 0.00 H new ATOM 0 HG2 MET A 66 -3.909 -50.836 45.193 1.00 0.00 H new ATOM 0 HG3 MET A 66 -3.273 -49.304 44.626 1.00 0.00 H new ATOM 0 HE1 MET A 66 -6.033 -48.035 47.033 1.00 0.00 H new ATOM 0 HE2 MET A 66 -4.911 -49.400 47.248 1.00 0.00 H new ATOM 0 HE3 MET A 66 -4.340 -47.888 46.504 1.00 0.00 H new ATOM 1068 N ILE A 67 -2.802 -51.301 40.227 1.00 0.00 N ATOM 1069 CA ILE A 67 -3.080 -51.851 38.895 1.00 0.00 C ATOM 1070 C ILE A 67 -1.828 -52.300 38.145 1.00 0.00 C ATOM 1071 O ILE A 67 -1.932 -52.882 37.069 1.00 0.00 O ATOM 1072 CB ILE A 67 -3.827 -50.832 38.010 1.00 0.00 C ATOM 1073 CG1 ILE A 67 -2.997 -49.550 37.855 1.00 0.00 C ATOM 1074 CG2 ILE A 67 -5.198 -50.528 38.581 1.00 0.00 C ATOM 1075 CD1 ILE A 67 -3.580 -48.557 36.873 1.00 0.00 C ATOM 0 H ILE A 67 -2.359 -50.382 40.224 1.00 0.00 H new ATOM 0 HA ILE A 67 -3.701 -52.727 39.081 1.00 0.00 H new ATOM 0 HB ILE A 67 -3.967 -51.269 37.021 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -2.903 -49.070 38.829 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -1.991 -49.817 37.532 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -5.707 -49.807 37.941 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -5.783 -51.446 38.631 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -5.091 -50.112 39.583 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -2.937 -47.678 36.819 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -3.649 -49.018 35.887 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -4.575 -48.259 37.204 1.00 0.00 H new ATOM 1087 N GLU A 68 -0.664 -52.060 38.721 1.00 0.00 N ATOM 1088 CA GLU A 68 0.620 -52.351 38.057 1.00 0.00 C ATOM 1089 C GLU A 68 0.741 -53.808 37.576 1.00 0.00 C ATOM 1090 O GLU A 68 1.415 -54.087 36.589 1.00 0.00 O ATOM 1091 CB GLU A 68 1.788 -52.014 38.980 1.00 0.00 C ATOM 1092 CG GLU A 68 1.753 -52.749 40.298 1.00 0.00 C ATOM 1093 CD GLU A 68 3.039 -52.604 41.076 1.00 0.00 C ATOM 1094 OE1 GLU A 68 4.095 -53.033 40.562 1.00 0.00 O ATOM 1095 OE2 GLU A 68 3.001 -52.105 42.211 1.00 0.00 O ATOM 0 H GLU A 68 -0.568 -51.661 39.655 1.00 0.00 H new ATOM 0 HA GLU A 68 0.652 -51.719 37.169 1.00 0.00 H new ATOM 0 HB2 GLU A 68 2.722 -52.247 38.469 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.789 -50.941 39.173 1.00 0.00 H new ATOM 0 HG2 GLU A 68 0.925 -52.372 40.898 1.00 0.00 H new ATOM 0 HG3 GLU A 68 1.560 -53.806 40.116 1.00 0.00 H new ATOM 1102 N ASN A 69 0.103 -54.724 38.269 1.00 0.00 N ATOM 1103 CA ASN A 69 0.177 -56.131 37.897 1.00 0.00 C ATOM 1104 C ASN A 69 -0.632 -56.446 36.625 1.00 0.00 C ATOM 1105 O ASN A 69 -0.346 -57.419 35.935 1.00 0.00 O ATOM 1106 CB ASN A 69 -0.258 -57.037 39.061 1.00 0.00 C ATOM 1107 CG ASN A 69 -1.627 -56.691 39.595 1.00 0.00 C ATOM 1108 OD1 ASN A 69 -2.644 -57.342 39.089 1.00 0.00 O flip ATOM 1109 ND2 ASN A 69 -1.766 -55.833 40.468 1.00 0.00 N flip ATOM 0 H ASN A 69 -0.471 -54.529 39.089 1.00 0.00 H new ATOM 0 HA ASN A 69 1.222 -56.340 37.670 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -0.255 -58.075 38.728 1.00 0.00 H new ATOM 0 HB3 ASN A 69 0.471 -56.959 39.867 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -0.950 -55.346 40.839 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -2.697 -55.610 40.820 1.00 0.00 H new ATOM 1116 N GLU A 70 -1.621 -55.617 36.310 1.00 0.00 N ATOM 1117 CA GLU A 70 -2.449 -55.844 35.118 1.00 0.00 C ATOM 1118 C GLU A 70 -2.204 -54.757 34.070 1.00 0.00 C ATOM 1119 O GLU A 70 -2.493 -54.939 32.883 1.00 0.00 O ATOM 1120 CB GLU A 70 -3.937 -55.854 35.486 1.00 0.00 C ATOM 1121 CG GLU A 70 -4.328 -56.929 36.483 1.00 0.00 C ATOM 1122 CD GLU A 70 -4.028 -58.324 35.996 1.00 0.00 C ATOM 1123 OE1 GLU A 70 -4.613 -58.745 34.979 1.00 0.00 O ATOM 1124 OE2 GLU A 70 -3.204 -59.014 36.636 1.00 0.00 O ATOM 0 H GLU A 70 -1.872 -54.790 36.852 1.00 0.00 H new ATOM 0 HA GLU A 70 -2.170 -56.813 34.704 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -4.204 -54.880 35.897 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -4.523 -55.988 34.577 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -3.799 -56.756 37.421 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -5.393 -56.847 36.698 1.00 0.00 H new ATOM 1131 N ALA A 71 -1.668 -53.640 34.514 1.00 0.00 N ATOM 1132 CA ALA A 71 -1.448 -52.502 33.648 1.00 0.00 C ATOM 1133 C ALA A 71 0.021 -52.163 33.539 1.00 0.00 C ATOM 1134 O ALA A 71 0.794 -52.414 34.457 1.00 0.00 O ATOM 1135 CB ALA A 71 -2.212 -51.290 34.180 1.00 0.00 C ATOM 0 H ALA A 71 -1.374 -53.496 35.480 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.811 -52.764 32.654 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -2.042 -50.436 33.524 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -3.278 -51.517 34.212 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -1.862 -51.051 35.184 1.00 0.00 H new ATOM 1141 N ASN A 72 0.398 -51.612 32.413 1.00 0.00 N ATOM 1142 CA ASN A 72 1.741 -51.142 32.197 1.00 0.00 C ATOM 1143 C ASN A 72 1.708 -49.637 32.087 1.00 0.00 C ATOM 1144 O ASN A 72 0.818 -49.068 31.448 1.00 0.00 O ATOM 1145 CB ASN A 72 2.338 -51.734 30.931 1.00 0.00 C ATOM 1146 CG ASN A 72 2.536 -53.229 31.005 1.00 0.00 C ATOM 1147 OD1 ASN A 72 2.784 -53.785 32.076 1.00 0.00 O ATOM 1148 ND2 ASN A 72 2.439 -53.887 29.872 1.00 0.00 N ATOM 0 H ASN A 72 -0.223 -51.476 31.616 1.00 0.00 H new ATOM 0 HA ASN A 72 2.364 -51.454 33.035 1.00 0.00 H new ATOM 0 HB2 ASN A 72 1.687 -51.502 30.088 1.00 0.00 H new ATOM 0 HB3 ASN A 72 3.298 -51.257 30.733 1.00 0.00 H new ATOM 0 HD21 ASN A 72 2.571 -54.898 29.857 1.00 0.00 H new ATOM 0 HD22 ASN A 72 2.232 -53.387 29.008 1.00 0.00 H new ATOM 1155 N ARG A 73 2.652 -48.999 32.700 1.00 0.00 N ATOM 1156 CA ARG A 73 2.700 -47.569 32.716 1.00 0.00 C ATOM 1157 C ARG A 73 3.193 -47.050 31.380 1.00 0.00 C ATOM 1158 O ARG A 73 4.299 -47.386 30.946 1.00 0.00 O ATOM 1159 CB ARG A 73 3.605 -47.086 33.836 1.00 0.00 C ATOM 1160 CG ARG A 73 3.623 -45.591 33.965 1.00 0.00 C ATOM 1161 CD ARG A 73 4.511 -45.108 35.102 1.00 0.00 C ATOM 1162 NE ARG A 73 5.931 -45.375 34.860 1.00 0.00 N ATOM 1163 CZ ARG A 73 6.918 -45.027 35.694 1.00 0.00 C ATOM 1164 NH1 ARG A 73 6.639 -44.429 36.852 1.00 0.00 N ATOM 1165 NH2 ARG A 73 8.181 -45.276 35.367 1.00 0.00 N ATOM 0 H ARG A 73 3.413 -49.453 33.205 1.00 0.00 H new ATOM 0 HA ARG A 73 1.695 -47.185 32.892 1.00 0.00 H new ATOM 0 HB2 ARG A 73 3.275 -47.523 34.778 1.00 0.00 H new ATOM 0 HB3 ARG A 73 4.619 -47.443 33.657 1.00 0.00 H new ATOM 0 HG2 ARG A 73 3.970 -45.154 33.029 1.00 0.00 H new ATOM 0 HG3 ARG A 73 2.606 -45.233 34.127 1.00 0.00 H new ATOM 0 HD2 ARG A 73 4.365 -44.037 35.242 1.00 0.00 H new ATOM 0 HD3 ARG A 73 4.206 -45.595 36.028 1.00 0.00 H new ATOM 0 HE ARG A 73 6.184 -45.858 33.998 1.00 0.00 H new ATOM 0 HH11 ARG A 73 5.670 -44.235 37.105 1.00 0.00 H new ATOM 0 HH12 ARG A 73 7.394 -44.165 37.485 1.00 0.00 H new ATOM 0 HH21 ARG A 73 8.398 -45.732 34.481 1.00 0.00 H new ATOM 0 HH22 ARG A 73 8.934 -45.011 36.002 1.00 0.00 H new ATOM 1179 N ASP A 74 2.374 -46.262 30.714 1.00 0.00 N ATOM 1180 CA ASP A 74 2.762 -45.700 29.434 1.00 0.00 C ATOM 1181 C ASP A 74 3.548 -44.430 29.629 1.00 0.00 C ATOM 1182 O ASP A 74 4.527 -44.174 28.924 1.00 0.00 O ATOM 1183 CB ASP A 74 1.544 -45.433 28.553 1.00 0.00 C ATOM 1184 CG ASP A 74 1.912 -44.758 27.240 1.00 0.00 C ATOM 1185 OD1 ASP A 74 2.444 -45.447 26.337 1.00 0.00 O ATOM 1186 OD2 ASP A 74 1.664 -43.543 27.102 1.00 0.00 O ATOM 0 H ASP A 74 1.442 -45.997 31.033 1.00 0.00 H new ATOM 0 HA ASP A 74 3.393 -46.432 28.929 1.00 0.00 H new ATOM 0 HB2 ASP A 74 1.037 -46.375 28.344 1.00 0.00 H new ATOM 0 HB3 ASP A 74 0.838 -44.805 29.096 1.00 0.00 H new ATOM 1191 N LYS A 75 3.138 -43.643 30.597 1.00 0.00 N ATOM 1192 CA LYS A 75 3.780 -42.376 30.843 1.00 0.00 C ATOM 1193 C LYS A 75 3.732 -42.040 32.326 1.00 0.00 C ATOM 1194 O LYS A 75 2.863 -42.534 33.059 1.00 0.00 O ATOM 1195 CB LYS A 75 3.080 -41.281 30.045 1.00 0.00 C ATOM 1196 CG LYS A 75 3.834 -39.966 30.010 1.00 0.00 C ATOM 1197 CD LYS A 75 3.091 -38.938 29.194 1.00 0.00 C ATOM 1198 CE LYS A 75 3.846 -37.624 29.133 1.00 0.00 C ATOM 1199 NZ LYS A 75 5.164 -37.773 28.447 1.00 0.00 N ATOM 0 H LYS A 75 2.364 -43.859 31.225 1.00 0.00 H new ATOM 0 HA LYS A 75 4.822 -42.443 30.530 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.930 -41.630 29.023 1.00 0.00 H new ATOM 0 HB3 LYS A 75 2.092 -41.110 30.472 1.00 0.00 H new ATOM 0 HG2 LYS A 75 3.975 -39.596 31.026 1.00 0.00 H new ATOM 0 HG3 LYS A 75 4.826 -40.123 29.587 1.00 0.00 H new ATOM 0 HD2 LYS A 75 2.936 -39.317 28.184 1.00 0.00 H new ATOM 0 HD3 LYS A 75 2.105 -38.772 29.627 1.00 0.00 H new ATOM 0 HE2 LYS A 75 3.244 -36.883 28.607 1.00 0.00 H new ATOM 0 HE3 LYS A 75 4.003 -37.248 30.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 5.542 -36.833 28.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 5.829 -38.267 29.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 5.040 -38.324 27.573 1.00 0.00 H new ATOM 1213 N GLU A 76 4.663 -41.209 32.760 1.00 0.00 N ATOM 1214 CA GLU A 76 4.717 -40.771 34.143 1.00 0.00 C ATOM 1215 C GLU A 76 3.664 -39.705 34.390 1.00 0.00 C ATOM 1216 O GLU A 76 3.241 -39.020 33.452 1.00 0.00 O ATOM 1217 CB GLU A 76 6.092 -40.191 34.474 1.00 0.00 C ATOM 1218 CG GLU A 76 7.224 -41.195 34.475 1.00 0.00 C ATOM 1219 CD GLU A 76 8.529 -40.556 34.875 1.00 0.00 C ATOM 1220 OE1 GLU A 76 9.197 -39.973 34.002 1.00 0.00 O ATOM 1221 OE2 GLU A 76 8.886 -40.611 36.070 1.00 0.00 O ATOM 0 H GLU A 76 5.398 -40.821 32.168 1.00 0.00 H new ATOM 0 HA GLU A 76 4.530 -41.636 34.779 1.00 0.00 H new ATOM 0 HB2 GLU A 76 6.322 -39.407 33.753 1.00 0.00 H new ATOM 0 HB3 GLU A 76 6.044 -39.718 35.455 1.00 0.00 H new ATOM 0 HG2 GLU A 76 6.990 -42.008 35.162 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.322 -41.635 33.483 1.00 0.00 H new ATOM 1228 N PRO A 77 3.216 -39.554 35.645 1.00 0.00 N ATOM 1229 CA PRO A 77 2.252 -38.516 36.006 1.00 0.00 C ATOM 1230 C PRO A 77 2.814 -37.114 35.745 1.00 0.00 C ATOM 1231 O PRO A 77 3.988 -36.833 36.030 1.00 0.00 O ATOM 1232 CB PRO A 77 2.025 -38.740 37.511 1.00 0.00 C ATOM 1233 CG PRO A 77 3.208 -39.529 37.967 1.00 0.00 C ATOM 1234 CD PRO A 77 3.604 -40.379 36.801 1.00 0.00 C ATOM 0 HA PRO A 77 1.335 -38.578 35.420 1.00 0.00 H new ATOM 0 HB2 PRO A 77 1.953 -37.792 38.045 1.00 0.00 H new ATOM 0 HB3 PRO A 77 1.096 -39.280 37.694 1.00 0.00 H new ATOM 0 HG2 PRO A 77 4.024 -38.872 38.267 1.00 0.00 H new ATOM 0 HG3 PRO A 77 2.959 -40.143 38.832 1.00 0.00 H new ATOM 0 HD2 PRO A 77 4.672 -40.595 36.803 1.00 0.00 H new ATOM 0 HD3 PRO A 77 3.085 -41.338 36.805 1.00 0.00 H new ATOM 1242 N ASN A 78 1.980 -36.246 35.214 1.00 0.00 N ATOM 1243 CA ASN A 78 2.386 -34.888 34.894 1.00 0.00 C ATOM 1244 C ASN A 78 1.239 -33.931 35.125 1.00 0.00 C ATOM 1245 O ASN A 78 0.106 -34.351 35.298 1.00 0.00 O ATOM 1246 CB ASN A 78 2.850 -34.787 33.434 1.00 0.00 C ATOM 1247 CG ASN A 78 1.731 -35.039 32.428 1.00 0.00 C ATOM 1248 OD1 ASN A 78 0.835 -35.840 32.657 1.00 0.00 O ATOM 1249 ND2 ASN A 78 1.769 -34.328 31.323 1.00 0.00 N ATOM 0 H ASN A 78 1.007 -36.456 34.992 1.00 0.00 H new ATOM 0 HA ASN A 78 3.217 -34.622 35.547 1.00 0.00 H new ATOM 0 HB2 ASN A 78 3.269 -33.796 33.261 1.00 0.00 H new ATOM 0 HB3 ASN A 78 3.651 -35.506 33.264 1.00 0.00 H new ATOM 0 HD21 ASN A 78 1.035 -34.435 30.622 1.00 0.00 H new ATOM 0 HD22 ASN A 78 2.532 -33.669 31.166 1.00 0.00 H new ATOM 1256 N PHE A 79 1.535 -32.650 35.126 1.00 0.00 N ATOM 1257 CA PHE A 79 0.518 -31.637 35.347 1.00 0.00 C ATOM 1258 C PHE A 79 0.211 -30.894 34.046 1.00 0.00 C ATOM 1259 O PHE A 79 1.044 -30.139 33.529 1.00 0.00 O ATOM 1260 CB PHE A 79 0.984 -30.665 36.443 1.00 0.00 C ATOM 1261 CG PHE A 79 0.019 -29.559 36.773 1.00 0.00 C ATOM 1262 CD1 PHE A 79 -1.078 -29.798 37.584 1.00 0.00 C ATOM 1263 CD2 PHE A 79 0.229 -28.273 36.300 1.00 0.00 C ATOM 1264 CE1 PHE A 79 -1.947 -28.779 37.915 1.00 0.00 C ATOM 1265 CE2 PHE A 79 -0.640 -27.251 36.623 1.00 0.00 C ATOM 1266 CZ PHE A 79 -1.727 -27.501 37.432 1.00 0.00 C ATOM 0 H PHE A 79 2.474 -32.281 34.976 1.00 0.00 H new ATOM 0 HA PHE A 79 -0.402 -32.119 35.679 1.00 0.00 H new ATOM 0 HB2 PHE A 79 1.182 -31.235 37.351 1.00 0.00 H new ATOM 0 HB3 PHE A 79 1.929 -30.220 36.133 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.255 -30.794 37.962 1.00 0.00 H new ATOM 0 HD2 PHE A 79 1.083 -28.069 35.671 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -2.798 -28.978 38.550 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -0.468 -26.255 36.242 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.406 -26.701 37.689 1.00 0.00 H new ATOM 1276 N GLU A 80 -0.982 -31.117 33.527 1.00 0.00 N ATOM 1277 CA GLU A 80 -1.435 -30.482 32.296 1.00 0.00 C ATOM 1278 C GLU A 80 -2.876 -30.039 32.402 1.00 0.00 C ATOM 1279 O GLU A 80 -3.758 -30.830 32.741 1.00 0.00 O ATOM 1280 CB GLU A 80 -1.279 -31.413 31.081 1.00 0.00 C ATOM 1281 CG GLU A 80 0.140 -31.577 30.596 1.00 0.00 C ATOM 1282 CD GLU A 80 0.238 -32.476 29.377 1.00 0.00 C ATOM 1283 OE1 GLU A 80 -0.211 -33.638 29.437 1.00 0.00 O ATOM 1284 OE2 GLU A 80 0.770 -32.024 28.349 1.00 0.00 O ATOM 0 H GLU A 80 -1.668 -31.745 33.946 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.802 -29.607 32.150 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -1.677 -32.395 31.338 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -1.887 -31.027 30.263 1.00 0.00 H new ATOM 0 HG2 GLU A 80 0.554 -30.598 30.355 1.00 0.00 H new ATOM 0 HG3 GLU A 80 0.749 -31.992 31.399 1.00 0.00 H new ATOM 1291 N GLY A 81 -3.107 -28.771 32.123 1.00 0.00 N ATOM 1292 CA GLY A 81 -4.448 -28.236 32.125 1.00 0.00 C ATOM 1293 C GLY A 81 -5.081 -28.243 33.499 1.00 0.00 C ATOM 1294 O GLY A 81 -6.289 -28.459 33.627 1.00 0.00 O ATOM 0 H GLY A 81 -2.380 -28.094 31.892 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -4.427 -27.215 31.745 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -5.067 -28.818 31.442 1.00 0.00 H new ATOM 1298 N ARG A 82 -4.255 -28.025 34.528 1.00 0.00 N ATOM 1299 CA ARG A 82 -4.708 -28.014 35.923 1.00 0.00 C ATOM 1300 C ARG A 82 -5.087 -29.412 36.423 1.00 0.00 C ATOM 1301 O ARG A 82 -5.666 -29.567 37.503 1.00 0.00 O ATOM 1302 CB ARG A 82 -5.842 -27.013 36.122 1.00 0.00 C ATOM 1303 CG ARG A 82 -5.378 -25.569 36.050 1.00 0.00 C ATOM 1304 CD ARG A 82 -6.533 -24.599 36.150 1.00 0.00 C ATOM 1305 NE ARG A 82 -6.073 -23.210 36.166 1.00 0.00 N ATOM 1306 CZ ARG A 82 -6.759 -22.179 35.677 1.00 0.00 C ATOM 1307 NH1 ARG A 82 -7.914 -22.374 35.049 1.00 0.00 N ATOM 1308 NH2 ARG A 82 -6.272 -20.953 35.793 1.00 0.00 N ATOM 0 H ARG A 82 -3.256 -27.852 34.418 1.00 0.00 H new ATOM 0 HA ARG A 82 -3.866 -27.688 36.534 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -6.606 -27.182 35.363 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -6.310 -27.191 37.090 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -4.670 -25.375 36.856 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -4.847 -25.405 35.113 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -7.208 -24.749 35.308 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -7.103 -24.804 37.056 1.00 0.00 H new ATOM 0 HE ARG A 82 -5.162 -23.018 36.582 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -8.281 -23.319 34.939 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -8.433 -21.578 34.677 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -5.375 -20.802 36.255 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -6.794 -20.160 35.420 1.00 0.00 H new ATOM 1322 N TYR A 83 -4.739 -30.418 35.639 1.00 0.00 N ATOM 1323 CA TYR A 83 -4.947 -31.810 36.007 1.00 0.00 C ATOM 1324 C TYR A 83 -3.628 -32.550 36.038 1.00 0.00 C ATOM 1325 O TYR A 83 -2.726 -32.260 35.254 1.00 0.00 O ATOM 1326 CB TYR A 83 -5.875 -32.524 35.016 1.00 0.00 C ATOM 1327 CG TYR A 83 -7.341 -32.199 35.140 1.00 0.00 C ATOM 1328 CD1 TYR A 83 -7.885 -31.062 34.565 1.00 0.00 C ATOM 1329 CD2 TYR A 83 -8.186 -33.058 35.818 1.00 0.00 C ATOM 1330 CE1 TYR A 83 -9.238 -30.792 34.668 1.00 0.00 C ATOM 1331 CE2 TYR A 83 -9.528 -32.797 35.929 1.00 0.00 C ATOM 1332 CZ TYR A 83 -10.054 -31.668 35.354 1.00 0.00 C ATOM 1333 OH TYR A 83 -11.405 -31.419 35.459 1.00 0.00 O ATOM 0 H TYR A 83 -4.303 -30.293 34.726 1.00 0.00 H new ATOM 0 HA TYR A 83 -5.408 -31.812 36.995 1.00 0.00 H new ATOM 0 HB2 TYR A 83 -5.552 -32.279 34.004 1.00 0.00 H new ATOM 0 HB3 TYR A 83 -5.749 -33.600 35.139 1.00 0.00 H new ATOM 0 HD1 TYR A 83 -7.244 -30.377 34.029 1.00 0.00 H new ATOM 0 HD2 TYR A 83 -7.781 -33.952 36.269 1.00 0.00 H new ATOM 0 HE1 TYR A 83 -9.652 -29.903 34.215 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -10.169 -33.479 36.468 1.00 0.00 H new ATOM 0 HH TYR A 83 -11.709 -30.924 34.670 1.00 0.00 H new ATOM 1343 N VAL A 84 -3.508 -33.487 36.943 1.00 0.00 N ATOM 1344 CA VAL A 84 -2.354 -34.352 36.976 1.00 0.00 C ATOM 1345 C VAL A 84 -2.764 -35.653 36.301 1.00 0.00 C ATOM 1346 O VAL A 84 -3.648 -36.363 36.787 1.00 0.00 O ATOM 1347 CB VAL A 84 -1.861 -34.621 38.424 1.00 0.00 C ATOM 1348 CG1 VAL A 84 -0.679 -35.569 38.433 1.00 0.00 C ATOM 1349 CG2 VAL A 84 -1.485 -33.324 39.110 1.00 0.00 C ATOM 0 H VAL A 84 -4.198 -33.672 37.671 1.00 0.00 H new ATOM 0 HA VAL A 84 -1.520 -33.877 36.459 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.681 -35.087 38.970 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.356 -35.738 39.460 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.970 -36.518 37.983 1.00 0.00 H new ATOM 0 HG13 VAL A 84 0.141 -35.134 37.862 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -1.142 -33.534 40.123 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -0.687 -32.835 38.551 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -2.355 -32.668 39.150 1.00 0.00 H new ATOM 1359 N ASN A 85 -2.160 -35.939 35.170 1.00 0.00 N ATOM 1360 CA ASN A 85 -2.568 -37.071 34.356 1.00 0.00 C ATOM 1361 C ASN A 85 -1.529 -38.184 34.361 1.00 0.00 C ATOM 1362 O ASN A 85 -0.328 -37.931 34.483 1.00 0.00 O ATOM 1363 CB ASN A 85 -2.825 -36.622 32.907 1.00 0.00 C ATOM 1364 CG ASN A 85 -3.939 -35.586 32.778 1.00 0.00 C ATOM 1365 OD1 ASN A 85 -4.872 -35.543 33.580 1.00 0.00 O ATOM 1366 ND2 ASN A 85 -3.850 -34.750 31.757 1.00 0.00 N ATOM 0 H ASN A 85 -1.381 -35.403 34.788 1.00 0.00 H new ATOM 0 HA ASN A 85 -3.487 -37.463 34.792 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -1.905 -36.207 32.495 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -3.079 -37.494 32.305 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -4.569 -34.041 31.615 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -3.062 -34.815 31.112 1.00 0.00 H new ATOM 1373 N MET A 86 -2.012 -39.412 34.261 1.00 0.00 N ATOM 1374 CA MET A 86 -1.167 -40.591 34.130 1.00 0.00 C ATOM 1375 C MET A 86 -1.875 -41.596 33.236 1.00 0.00 C ATOM 1376 O MET A 86 -3.063 -41.888 33.429 1.00 0.00 O ATOM 1377 CB MET A 86 -0.824 -41.189 35.509 1.00 0.00 C ATOM 1378 CG MET A 86 0.033 -42.461 35.468 1.00 0.00 C ATOM 1379 SD MET A 86 -0.938 -43.962 35.278 1.00 0.00 S ATOM 1380 CE MET A 86 -1.808 -44.024 36.844 1.00 0.00 C ATOM 0 H MET A 86 -3.010 -39.622 34.268 1.00 0.00 H new ATOM 0 HA MET A 86 -0.217 -40.315 33.673 1.00 0.00 H new ATOM 0 HB2 MET A 86 -0.300 -40.434 36.096 1.00 0.00 H new ATOM 0 HB3 MET A 86 -1.753 -41.412 36.033 1.00 0.00 H new ATOM 0 HG2 MET A 86 0.742 -42.388 34.643 1.00 0.00 H new ATOM 0 HG3 MET A 86 0.617 -42.528 36.386 1.00 0.00 H new ATOM 0 HE1 MET A 86 -2.159 -45.040 37.025 1.00 0.00 H new ATOM 0 HE2 MET A 86 -1.134 -43.724 37.647 1.00 0.00 H new ATOM 0 HE3 MET A 86 -2.661 -43.346 36.814 1.00 0.00 H new ATOM 1390 N LEU A 87 -1.165 -42.105 32.252 1.00 0.00 N ATOM 1391 CA LEU A 87 -1.764 -42.999 31.280 1.00 0.00 C ATOM 1392 C LEU A 87 -1.205 -44.417 31.414 1.00 0.00 C ATOM 1393 O LEU A 87 0.016 -44.621 31.479 1.00 0.00 O ATOM 1394 CB LEU A 87 -1.538 -42.432 29.860 1.00 0.00 C ATOM 1395 CG LEU A 87 -2.343 -43.066 28.695 1.00 0.00 C ATOM 1396 CD1 LEU A 87 -1.751 -44.391 28.259 1.00 0.00 C ATOM 1397 CD2 LEU A 87 -3.809 -43.232 29.068 1.00 0.00 C ATOM 0 H LEU A 87 -0.174 -41.916 32.103 1.00 0.00 H new ATOM 0 HA LEU A 87 -2.836 -43.065 31.466 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.765 -41.366 29.884 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -0.478 -42.526 29.626 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.279 -42.380 27.850 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.343 -44.803 27.442 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -0.725 -44.238 27.923 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -1.758 -45.086 29.098 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.349 -43.678 28.233 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.891 -43.880 29.941 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.239 -42.257 29.298 1.00 0.00 H new ATOM 1409 N VAL A 88 -2.108 -45.385 31.463 1.00 0.00 N ATOM 1410 CA VAL A 88 -1.734 -46.783 31.577 1.00 0.00 C ATOM 1411 C VAL A 88 -2.237 -47.591 30.396 1.00 0.00 C ATOM 1412 O VAL A 88 -3.378 -47.427 29.946 1.00 0.00 O ATOM 1413 CB VAL A 88 -2.253 -47.438 32.879 1.00 0.00 C ATOM 1414 CG1 VAL A 88 -1.507 -46.904 34.080 1.00 0.00 C ATOM 1415 CG2 VAL A 88 -3.757 -47.224 33.040 1.00 0.00 C ATOM 0 H VAL A 88 -3.114 -45.223 31.425 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.644 -46.791 31.595 1.00 0.00 H new ATOM 0 HB VAL A 88 -2.071 -48.511 32.811 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -1.888 -47.378 34.985 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -0.444 -47.123 33.975 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -1.650 -45.826 34.147 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -4.095 -47.695 33.963 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -3.970 -46.156 33.078 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -4.280 -47.669 32.194 1.00 0.00 H new ATOM 1425 N THR A 89 -1.381 -48.434 29.888 1.00 0.00 N ATOM 1426 CA THR A 89 -1.730 -49.325 28.824 1.00 0.00 C ATOM 1427 C THR A 89 -1.870 -50.719 29.401 1.00 0.00 C ATOM 1428 O THR A 89 -1.033 -51.152 30.177 1.00 0.00 O ATOM 1429 CB THR A 89 -0.647 -49.344 27.727 1.00 0.00 C ATOM 1430 OG1 THR A 89 -0.381 -48.012 27.270 1.00 0.00 O ATOM 1431 CG2 THR A 89 -1.065 -50.200 26.548 1.00 0.00 C ATOM 0 H THR A 89 -0.415 -48.520 30.205 1.00 0.00 H new ATOM 0 HA THR A 89 -2.663 -48.987 28.373 1.00 0.00 H new ATOM 0 HB THR A 89 0.254 -49.773 28.165 1.00 0.00 H new ATOM 0 HG1 THR A 89 -1.228 -47.549 27.100 1.00 0.00 H new ATOM 0 HG21 THR A 89 -0.278 -50.190 25.794 1.00 0.00 H new ATOM 0 HG22 THR A 89 -1.234 -51.223 26.883 1.00 0.00 H new ATOM 0 HG23 THR A 89 -1.984 -49.803 26.118 1.00 0.00 H new ATOM 1439 N PRO A 90 -2.926 -51.423 29.056 1.00 0.00 N ATOM 1440 CA PRO A 90 -3.141 -52.790 29.532 1.00 0.00 C ATOM 1441 C PRO A 90 -2.075 -53.717 28.966 1.00 0.00 C ATOM 1442 O PRO A 90 -1.531 -53.453 27.883 1.00 0.00 O ATOM 1443 CB PRO A 90 -4.518 -53.119 28.961 1.00 0.00 C ATOM 1444 CG PRO A 90 -4.595 -52.276 27.738 1.00 0.00 C ATOM 1445 CD PRO A 90 -3.987 -50.983 28.140 1.00 0.00 C ATOM 0 HA PRO A 90 -3.086 -52.901 30.615 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -4.612 -54.179 28.725 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -5.313 -52.878 29.666 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -4.052 -52.729 26.909 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -5.626 -52.145 27.410 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -3.589 -50.435 27.286 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -4.706 -50.328 28.632 1.00 0.00 H new ATOM 1453 N LYS A 91 -1.745 -54.776 29.691 1.00 0.00 N ATOM 1454 CA LYS A 91 -0.735 -55.702 29.226 1.00 0.00 C ATOM 1455 C LYS A 91 -1.228 -56.471 27.999 1.00 0.00 C ATOM 1456 O LYS A 91 -1.884 -57.507 28.118 1.00 0.00 O ATOM 1457 CB LYS A 91 -0.329 -56.677 30.329 1.00 0.00 C ATOM 1458 CG LYS A 91 0.435 -56.031 31.467 1.00 0.00 C ATOM 1459 CD LYS A 91 0.862 -57.052 32.499 1.00 0.00 C ATOM 1460 CE LYS A 91 1.699 -56.413 33.591 1.00 0.00 C ATOM 1461 NZ LYS A 91 2.184 -57.416 34.566 1.00 0.00 N ATOM 0 H LYS A 91 -2.159 -55.010 30.593 1.00 0.00 H new ATOM 0 HA LYS A 91 0.142 -55.119 28.945 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -1.225 -57.152 30.729 1.00 0.00 H new ATOM 0 HB3 LYS A 91 0.284 -57.467 29.895 1.00 0.00 H new ATOM 0 HG2 LYS A 91 1.314 -55.521 31.073 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -0.188 -55.272 31.940 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -0.019 -57.518 32.939 1.00 0.00 H new ATOM 0 HD3 LYS A 91 1.434 -57.844 32.016 1.00 0.00 H new ATOM 0 HE2 LYS A 91 2.550 -55.899 33.144 1.00 0.00 H new ATOM 0 HE3 LYS A 91 1.107 -55.658 34.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 3.001 -57.032 35.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 1.424 -57.642 35.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 2.468 -58.280 34.062 1.00 0.00 H new