USER MOD reduce.3.24.130724 H: found=0, std=0, add=1101, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1101 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 82 ASN : amide:sc= -0.0842 K(o=-5.7,f=-3.2) USER MOD Set 1.2: A 83 ASN : amide:sc= -5.65! K(o=-5.7!,f=-1.3) USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ -172:sc= 0.346 (180deg=0.206) USER MOD Single : A 11 ASN : amide:sc= -0.0253 K(o=-0.025,f=-8.2!) USER MOD Single : A 13 GLN : amide:sc= -4.81! K(o=-4.8!,f=-0.32) USER MOD Single : A 17 SER OG : rot -32:sc= 0.73 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot -170:sc= -0.12 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= -1.09! K(o=-1.1!,f=-0.045) USER MOD Single : A 32 GLN : amide:sc= -0.494 K(o=-0.49,f=-3.4!) USER MOD Single : A 36 MET CE :methyl -172:sc= -1.61 (180deg=-1.72) USER MOD Single : A 37 ASN : amide:sc= -0.695 K(o=-0.7,f=-5!) USER MOD Single : A 45 SER OG : rot -24:sc= 0.502 USER MOD Single : A 46 SER OG : rot 85:sc= 0.519 USER MOD Single : A 47 HIS : no HE2:sc= -1.03 X(o=-1,f=-1.1) USER MOD Single : A 55 THR OG1 : rot -173:sc= -1.22! USER MOD Single : A 58 SER OG : rot -106:sc= 0.45 USER MOD Single : A 68 THR OG1 : rot -10:sc= -1.12! USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 GLN : amide:sc= 0.311 K(o=0.31,f=-0.21) USER MOD Single : A 84 ASN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 94 GLN : amide:sc= -3.55! K(o=-3.5!,f=-0.97) USER MOD Single : A 101 THR OG1 : rot 112:sc= 0.673 USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 122 MET CE :methyl -141:sc= -3.36 (180deg=-6.61!) USER MOD Single : A 125 HIS : no HD1:sc= -0.445 X(o=-0.44,f=-0.68) USER MOD Single : A 128 SER OG : rot 86:sc= 0.226 USER MOD Single : A 130 ASN : amide:sc= -0.568 K(o=-0.57,f=-3.3!) USER MOD Single : A 131 TYR OH : rot 180:sc= 0.191 USER MOD Single : A 136 SER OG : rot 78:sc= 0.395 USER MOD Single : A 143 GLN : amide:sc= -1.15! C(o=-1.2!,f=-9!) USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD ----------------------------------------------------------------- ATOM 44 N VAL A 3 5.537 -2.796 18.267 1.00 33.42 N ATOM 45 CA VAL A 3 6.624 -2.940 17.289 1.00 72.35 C ATOM 46 C VAL A 3 6.553 -4.268 16.507 1.00 62.14 C ATOM 47 O VAL A 3 6.545 -5.356 17.088 1.00 71.12 O ATOM 48 CB VAL A 3 8.011 -2.829 17.977 1.00 73.34 C ATOM 49 CG1 VAL A 3 9.145 -2.989 16.962 1.00 74.33 C ATOM 50 CG2 VAL A 3 8.139 -1.501 18.724 1.00 31.31 C ATOM 0 HA VAL A 3 6.497 -2.124 16.578 1.00 72.35 H new ATOM 0 HB VAL A 3 8.092 -3.640 18.701 1.00 73.34 H new ATOM 0 HG11 VAL A 3 10.105 -2.907 17.473 1.00 74.33 H new ATOM 0 HG12 VAL A 3 9.071 -3.966 16.484 1.00 74.33 H new ATOM 0 HG13 VAL A 3 9.069 -2.208 16.205 1.00 74.33 H new ATOM 0 HG21 VAL A 3 9.118 -1.444 19.199 1.00 31.31 H new ATOM 0 HG22 VAL A 3 8.028 -0.676 18.021 1.00 31.31 H new ATOM 0 HG23 VAL A 3 7.362 -1.436 19.486 1.00 31.31 H new ATOM 60 N TYR A 4 6.503 -4.152 15.182 1.00 72.30 N ATOM 61 CA TYR A 4 6.585 -5.300 14.271 1.00 75.44 C ATOM 62 C TYR A 4 7.842 -5.200 13.399 1.00 41.43 C ATOM 63 O TYR A 4 8.400 -4.115 13.219 1.00 62.40 O ATOM 64 CB TYR A 4 5.348 -5.364 13.360 1.00 32.20 C ATOM 65 CG TYR A 4 4.128 -6.009 13.989 1.00 75.41 C ATOM 66 CD1 TYR A 4 3.348 -5.327 14.915 1.00 74.21 C ATOM 67 CD2 TYR A 4 3.747 -7.302 13.637 1.00 64.20 C ATOM 68 CE1 TYR A 4 2.228 -5.913 15.471 1.00 42.14 C ATOM 69 CE2 TYR A 4 2.630 -7.894 14.191 1.00 3.43 C ATOM 70 CZ TYR A 4 1.873 -7.196 15.107 1.00 64.20 C ATOM 71 OH TYR A 4 0.755 -7.779 15.662 1.00 52.33 O ATOM 0 H TYR A 4 6.404 -3.256 14.704 1.00 72.30 H new ATOM 0 HA TYR A 4 6.630 -6.204 14.878 1.00 75.44 H new ATOM 0 HB2 TYR A 4 5.088 -4.351 13.052 1.00 32.20 H new ATOM 0 HB3 TYR A 4 5.608 -5.915 12.456 1.00 32.20 H new ATOM 0 HD1 TYR A 4 3.622 -4.323 15.204 1.00 74.21 H new ATOM 0 HD2 TYR A 4 4.336 -7.851 12.918 1.00 64.20 H new ATOM 0 HE1 TYR A 4 1.632 -5.369 16.189 1.00 42.14 H new ATOM 0 HE2 TYR A 4 2.351 -8.898 13.908 1.00 3.43 H new ATOM 0 HH TYR A 4 0.643 -8.683 15.300 1.00 52.33 H new ATOM 81 N LYS A 5 8.282 -6.330 12.858 1.00 42.01 N ATOM 82 CA LYS A 5 9.432 -6.357 11.947 1.00 71.24 C ATOM 83 C LYS A 5 9.085 -7.074 10.630 1.00 5.45 C ATOM 84 O LYS A 5 8.118 -7.840 10.570 1.00 4.02 O ATOM 85 CB LYS A 5 10.624 -7.051 12.626 1.00 22.54 C ATOM 86 CG LYS A 5 11.221 -6.278 13.810 1.00 4.42 C ATOM 87 CD LYS A 5 11.241 -7.104 15.097 1.00 13.14 C ATOM 88 CE LYS A 5 11.846 -8.489 14.884 1.00 74.25 C ATOM 89 NZ LYS A 5 13.217 -8.428 14.311 1.00 5.15 N ATOM 0 H LYS A 5 7.863 -7.243 13.032 1.00 42.01 H new ATOM 0 HA LYS A 5 9.700 -5.327 11.710 1.00 71.24 H new ATOM 0 HB2 LYS A 5 10.306 -8.034 12.974 1.00 22.54 H new ATOM 0 HB3 LYS A 5 11.405 -7.213 11.883 1.00 22.54 H new ATOM 0 HG2 LYS A 5 12.237 -5.970 13.564 1.00 4.42 H new ATOM 0 HG3 LYS A 5 10.643 -5.368 13.975 1.00 4.42 H new ATOM 0 HD2 LYS A 5 11.812 -6.573 15.859 1.00 13.14 H new ATOM 0 HD3 LYS A 5 10.224 -7.208 15.476 1.00 13.14 H new ATOM 0 HE2 LYS A 5 11.876 -9.019 15.836 1.00 74.25 H new ATOM 0 HE3 LYS A 5 11.203 -9.065 14.219 1.00 74.25 H new ATOM 0 HZ1 LYS A 5 13.531 -9.387 14.059 1.00 5.15 H new ATOM 0 HZ2 LYS A 5 13.211 -7.831 13.460 1.00 5.15 H new ATOM 0 HZ3 LYS A 5 13.869 -8.023 15.013 1.00 5.15 H new ATOM 103 N PRO A 6 9.871 -6.841 9.548 1.00 44.22 N ATOM 104 CA PRO A 6 9.647 -7.504 8.249 1.00 20.42 C ATOM 105 C PRO A 6 10.009 -8.996 8.300 1.00 32.31 C ATOM 106 O PRO A 6 10.937 -9.459 7.634 1.00 1.11 O ATOM 107 CB PRO A 6 10.572 -6.733 7.292 1.00 13.23 C ATOM 108 CG PRO A 6 11.662 -6.202 8.163 1.00 60.12 C ATOM 109 CD PRO A 6 11.032 -5.923 9.506 1.00 24.03 C ATOM 0 HA PRO A 6 8.602 -7.482 7.941 1.00 20.42 H new ATOM 0 HB2 PRO A 6 10.969 -7.385 6.514 1.00 13.23 H new ATOM 0 HB3 PRO A 6 10.038 -5.926 6.790 1.00 13.23 H new ATOM 0 HG2 PRO A 6 12.472 -6.925 8.256 1.00 60.12 H new ATOM 0 HG3 PRO A 6 12.092 -5.294 7.739 1.00 60.12 H new ATOM 0 HD2 PRO A 6 11.727 -6.119 10.323 1.00 24.03 H new ATOM 0 HD3 PRO A 6 10.722 -4.882 9.594 1.00 24.03 H new ATOM 117 N GLU A 7 9.253 -9.733 9.105 1.00 52.31 N ATOM 118 CA GLU A 7 9.515 -11.148 9.380 1.00 1.04 C ATOM 119 C GLU A 7 8.385 -11.746 10.235 1.00 71.21 C ATOM 120 O GLU A 7 8.011 -12.905 10.064 1.00 33.15 O ATOM 121 CB GLU A 7 10.880 -11.309 10.078 1.00 74.44 C ATOM 122 CG GLU A 7 11.069 -10.406 11.297 1.00 52.21 C ATOM 123 CD GLU A 7 12.523 -10.304 11.738 1.00 65.43 C ATOM 124 OE1 GLU A 7 13.328 -9.687 11.006 1.00 10.24 O ATOM 125 OE2 GLU A 7 12.870 -10.825 12.818 1.00 44.21 O ATOM 0 H GLU A 7 8.434 -9.367 9.591 1.00 52.31 H new ATOM 0 HA GLU A 7 9.547 -11.692 8.436 1.00 1.04 H new ATOM 0 HB2 GLU A 7 10.997 -12.348 10.387 1.00 74.44 H new ATOM 0 HB3 GLU A 7 11.671 -11.099 9.358 1.00 74.44 H new ATOM 0 HG2 GLU A 7 10.694 -9.409 11.066 1.00 52.21 H new ATOM 0 HG3 GLU A 7 10.470 -10.789 12.123 1.00 52.21 H new ATOM 132 N ASP A 8 7.839 -10.937 11.150 1.00 42.51 N ATOM 133 CA ASP A 8 6.665 -11.334 11.937 1.00 5.44 C ATOM 134 C ASP A 8 5.404 -11.348 11.061 1.00 3.53 C ATOM 135 O ASP A 8 4.557 -12.238 11.176 1.00 60.13 O ATOM 136 CB ASP A 8 6.457 -10.369 13.109 1.00 34.20 C ATOM 137 CG ASP A 8 7.670 -10.278 14.010 1.00 15.41 C ATOM 138 OD1 ASP A 8 7.885 -11.208 14.818 1.00 53.13 O ATOM 139 OD2 ASP A 8 8.411 -9.277 13.920 1.00 13.03 O ATOM 0 H ASP A 8 8.191 -10.004 11.364 1.00 42.51 H new ATOM 0 HA ASP A 8 6.842 -12.338 12.322 1.00 5.44 H new ATOM 0 HB2 ASP A 8 6.222 -9.378 12.721 1.00 34.20 H new ATOM 0 HB3 ASP A 8 5.597 -10.695 13.695 1.00 34.20 H new ATOM 144 N VAL A 9 5.299 -10.342 10.193 1.00 13.33 N ATOM 145 CA VAL A 9 4.160 -10.193 9.280 1.00 52.24 C ATOM 146 C VAL A 9 3.910 -11.474 8.458 1.00 4.00 C ATOM 147 O VAL A 9 4.818 -11.990 7.799 1.00 32.02 O ATOM 148 CB VAL A 9 4.384 -9.003 8.309 1.00 65.32 C ATOM 149 CG1 VAL A 9 3.185 -8.814 7.382 1.00 23.54 C ATOM 150 CG2 VAL A 9 4.675 -7.720 9.088 1.00 53.13 C ATOM 0 H VAL A 9 6.000 -9.606 10.101 1.00 13.33 H new ATOM 0 HA VAL A 9 3.284 -10.002 9.900 1.00 52.24 H new ATOM 0 HB VAL A 9 5.251 -9.233 7.690 1.00 65.32 H new ATOM 0 HG11 VAL A 9 3.371 -7.973 6.713 1.00 23.54 H new ATOM 0 HG12 VAL A 9 3.034 -9.719 6.794 1.00 23.54 H new ATOM 0 HG13 VAL A 9 2.293 -8.614 7.976 1.00 23.54 H new ATOM 0 HG21 VAL A 9 4.829 -6.897 8.390 1.00 53.13 H new ATOM 0 HG22 VAL A 9 3.831 -7.490 9.739 1.00 53.13 H new ATOM 0 HG23 VAL A 9 5.572 -7.856 9.692 1.00 53.13 H new ATOM 160 N PRO A 10 2.670 -12.007 8.489 1.00 33.45 N ATOM 161 CA PRO A 10 2.311 -13.231 7.750 1.00 0.10 C ATOM 162 C PRO A 10 2.403 -13.056 6.222 1.00 62.33 C ATOM 163 O PRO A 10 1.769 -12.169 5.643 1.00 70.53 O ATOM 164 CB PRO A 10 0.860 -13.504 8.186 1.00 4.53 C ATOM 165 CG PRO A 10 0.343 -12.182 8.648 1.00 24.22 C ATOM 166 CD PRO A 10 1.524 -11.461 9.244 1.00 44.34 C ATOM 0 HA PRO A 10 2.995 -14.051 7.972 1.00 0.10 H new ATOM 0 HB2 PRO A 10 0.266 -13.894 7.360 1.00 4.53 H new ATOM 0 HB3 PRO A 10 0.820 -14.245 8.984 1.00 4.53 H new ATOM 0 HG2 PRO A 10 -0.081 -11.617 7.818 1.00 24.22 H new ATOM 0 HG3 PRO A 10 -0.450 -12.309 9.385 1.00 24.22 H new ATOM 0 HD2 PRO A 10 1.440 -10.381 9.122 1.00 44.34 H new ATOM 0 HD3 PRO A 10 1.617 -11.655 10.313 1.00 44.34 H new ATOM 174 N ASN A 11 3.206 -13.902 5.578 1.00 54.11 N ATOM 175 CA ASN A 11 3.377 -13.859 4.122 1.00 25.35 C ATOM 176 C ASN A 11 2.077 -14.255 3.400 1.00 42.33 C ATOM 177 O ASN A 11 1.857 -15.425 3.075 1.00 51.14 O ATOM 178 CB ASN A 11 4.530 -14.785 3.698 1.00 54.34 C ATOM 179 CG ASN A 11 4.894 -14.655 2.226 1.00 22.33 C ATOM 180 OD1 ASN A 11 4.068 -14.306 1.387 1.00 52.33 O ATOM 181 ND2 ASN A 11 6.134 -14.946 1.897 1.00 14.34 N ATOM 0 H ASN A 11 3.751 -14.629 6.042 1.00 54.11 H new ATOM 0 HA ASN A 11 3.621 -12.836 3.836 1.00 25.35 H new ATOM 0 HB2 ASN A 11 5.408 -14.562 4.304 1.00 54.34 H new ATOM 0 HB3 ASN A 11 4.253 -15.818 3.907 1.00 54.34 H new ATOM 0 HD21 ASN A 11 6.431 -14.884 0.923 1.00 14.34 H new ATOM 0 HD22 ASN A 11 6.798 -15.233 2.616 1.00 14.34 H new ATOM 188 N VAL A 12 1.212 -13.272 3.154 1.00 40.15 N ATOM 189 CA VAL A 12 -0.077 -13.532 2.500 1.00 64.34 C ATOM 190 C VAL A 12 0.079 -13.917 1.020 1.00 75.14 C ATOM 191 O VAL A 12 -0.805 -14.538 0.448 1.00 51.22 O ATOM 192 CB VAL A 12 -1.046 -12.330 2.620 1.00 51.45 C ATOM 193 CG1 VAL A 12 -1.395 -12.068 4.085 1.00 41.21 C ATOM 194 CG2 VAL A 12 -0.460 -11.080 1.964 1.00 72.34 C ATOM 0 H VAL A 12 1.375 -12.294 3.394 1.00 40.15 H new ATOM 0 HA VAL A 12 -0.504 -14.382 3.032 1.00 64.34 H new ATOM 0 HB VAL A 12 -1.964 -12.581 2.089 1.00 51.45 H new ATOM 0 HG11 VAL A 12 -2.077 -11.220 4.151 1.00 41.21 H new ATOM 0 HG12 VAL A 12 -1.873 -12.951 4.509 1.00 41.21 H new ATOM 0 HG13 VAL A 12 -0.485 -11.846 4.642 1.00 41.21 H new ATOM 0 HG21 VAL A 12 -1.163 -10.253 2.064 1.00 72.34 H new ATOM 0 HG22 VAL A 12 0.479 -10.819 2.452 1.00 72.34 H new ATOM 0 HG23 VAL A 12 -0.278 -11.275 0.907 1.00 72.34 H new ATOM 204 N GLN A 13 1.200 -13.566 0.396 1.00 12.13 N ATOM 205 CA GLN A 13 1.439 -13.956 -1.003 1.00 64.23 C ATOM 206 C GLN A 13 1.685 -15.466 -1.113 1.00 52.25 C ATOM 207 O GLN A 13 1.270 -16.114 -2.077 1.00 64.21 O ATOM 208 CB GLN A 13 2.616 -13.170 -1.594 1.00 14.23 C ATOM 209 CG GLN A 13 2.350 -11.673 -1.695 1.00 14.33 C ATOM 210 CD GLN A 13 1.087 -11.352 -2.474 1.00 51.23 C ATOM 211 OE1 GLN A 13 1.113 -11.192 -3.687 1.00 73.14 O ATOM 212 NE2 GLN A 13 -0.033 -11.265 -1.784 1.00 74.43 N ATOM 0 H GLN A 13 1.950 -13.021 0.822 1.00 12.13 H new ATOM 0 HA GLN A 13 0.546 -13.714 -1.579 1.00 64.23 H new ATOM 0 HB2 GLN A 13 3.500 -13.334 -0.978 1.00 14.23 H new ATOM 0 HB3 GLN A 13 2.843 -13.560 -2.586 1.00 14.23 H new ATOM 0 HG2 GLN A 13 2.269 -11.254 -0.692 1.00 14.33 H new ATOM 0 HG3 GLN A 13 3.201 -11.189 -2.175 1.00 14.33 H new ATOM 0 HE21 GLN A 13 -0.022 -11.404 -0.774 1.00 74.43 H new ATOM 0 HE22 GLN A 13 -0.911 -11.059 -2.261 1.00 74.43 H new ATOM 221 N LEU A 14 2.355 -16.017 -0.109 1.00 54.43 N ATOM 222 CA LEU A 14 2.540 -17.466 0.006 1.00 31.44 C ATOM 223 C LEU A 14 1.218 -18.134 0.436 1.00 54.50 C ATOM 224 O LEU A 14 0.900 -19.251 0.019 1.00 40.11 O ATOM 225 CB LEU A 14 3.682 -17.747 1.013 1.00 62.11 C ATOM 226 CG LEU A 14 4.072 -19.221 1.262 1.00 4.54 C ATOM 227 CD1 LEU A 14 3.157 -19.871 2.298 1.00 64.11 C ATOM 228 CD2 LEU A 14 4.067 -20.017 -0.043 1.00 72.34 C ATOM 0 H LEU A 14 2.784 -15.481 0.645 1.00 54.43 H new ATOM 0 HA LEU A 14 2.819 -17.890 -0.959 1.00 31.44 H new ATOM 0 HB2 LEU A 14 4.571 -17.218 0.669 1.00 62.11 H new ATOM 0 HB3 LEU A 14 3.401 -17.308 1.970 1.00 62.11 H new ATOM 0 HG LEU A 14 5.086 -19.230 1.661 1.00 4.54 H new ATOM 0 HD11 LEU A 14 3.458 -20.907 2.450 1.00 64.11 H new ATOM 0 HD12 LEU A 14 3.232 -19.329 3.241 1.00 64.11 H new ATOM 0 HD13 LEU A 14 2.127 -19.841 1.943 1.00 64.11 H new ATOM 0 HD21 LEU A 14 4.345 -21.051 0.161 1.00 72.34 H new ATOM 0 HD22 LEU A 14 3.070 -19.989 -0.482 1.00 72.34 H new ATOM 0 HD23 LEU A 14 4.783 -19.579 -0.739 1.00 72.34 H new ATOM 240 N ALA A 15 0.445 -17.422 1.254 1.00 3.23 N ATOM 241 CA ALA A 15 -0.844 -17.921 1.746 1.00 54.21 C ATOM 242 C ALA A 15 -2.028 -17.451 0.872 1.00 41.21 C ATOM 243 O ALA A 15 -2.424 -18.138 -0.071 1.00 53.24 O ATOM 244 CB ALA A 15 -1.039 -17.496 3.196 1.00 31.22 C ATOM 0 H ALA A 15 0.688 -16.491 1.594 1.00 3.23 H new ATOM 0 HA ALA A 15 -0.825 -19.009 1.686 1.00 54.21 H new ATOM 0 HB1 ALA A 15 -1.997 -17.868 3.558 1.00 31.22 H new ATOM 0 HB2 ALA A 15 -0.235 -17.907 3.807 1.00 31.22 H new ATOM 0 HB3 ALA A 15 -1.024 -16.408 3.261 1.00 31.22 H new ATOM 250 N ASP A 16 -2.569 -16.268 1.168 1.00 21.31 N ATOM 251 CA ASP A 16 -3.764 -15.759 0.478 1.00 54.14 C ATOM 252 C ASP A 16 -3.419 -14.734 -0.627 1.00 0.32 C ATOM 253 O ASP A 16 -3.583 -13.523 -0.445 1.00 72.44 O ATOM 254 CB ASP A 16 -4.713 -15.124 1.497 1.00 12.33 C ATOM 255 CG ASP A 16 -5.168 -16.114 2.553 1.00 44.14 C ATOM 256 OD1 ASP A 16 -4.397 -16.389 3.495 1.00 61.31 O ATOM 257 OD2 ASP A 16 -6.297 -16.634 2.440 1.00 32.14 O ATOM 0 H ASP A 16 -2.200 -15.640 1.882 1.00 21.31 H new ATOM 0 HA ASP A 16 -4.246 -16.607 -0.009 1.00 54.14 H new ATOM 0 HB2 ASP A 16 -4.215 -14.284 1.980 1.00 12.33 H new ATOM 0 HB3 ASP A 16 -5.584 -14.723 0.979 1.00 12.33 H new ATOM 262 N SER A 17 -2.955 -15.225 -1.778 1.00 33.00 N ATOM 263 CA SER A 17 -2.622 -14.354 -2.923 1.00 42.41 C ATOM 264 C SER A 17 -3.891 -13.804 -3.596 1.00 10.42 C ATOM 265 O SER A 17 -3.818 -13.063 -4.576 1.00 34.04 O ATOM 266 CB SER A 17 -1.784 -15.122 -3.959 1.00 24.20 C ATOM 267 OG SER A 17 -1.414 -14.292 -5.053 1.00 55.05 O ATOM 0 H SER A 17 -2.799 -16.218 -1.949 1.00 33.00 H new ATOM 0 HA SER A 17 -2.042 -13.515 -2.538 1.00 42.41 H new ATOM 0 HB2 SER A 17 -0.887 -15.517 -3.482 1.00 24.20 H new ATOM 0 HB3 SER A 17 -2.352 -15.977 -4.326 1.00 24.20 H new ATOM 0 HG SER A 17 -2.119 -13.631 -5.216 1.00 55.05 H new ATOM 273 N THR A 18 -5.057 -14.192 -3.079 1.00 73.44 N ATOM 274 CA THR A 18 -6.341 -13.692 -3.596 1.00 53.05 C ATOM 275 C THR A 18 -6.688 -12.303 -3.037 1.00 13.45 C ATOM 276 O THR A 18 -7.330 -11.502 -3.714 1.00 11.52 O ATOM 277 CB THR A 18 -7.508 -14.662 -3.286 1.00 45.31 C ATOM 278 OG1 THR A 18 -8.736 -14.150 -3.830 1.00 4.32 O ATOM 279 CG2 THR A 18 -7.666 -14.882 -1.782 1.00 42.54 C ATOM 0 H THR A 18 -5.144 -14.850 -2.304 1.00 73.44 H new ATOM 0 HA THR A 18 -6.215 -13.618 -4.676 1.00 53.05 H new ATOM 0 HB THR A 18 -7.275 -15.620 -3.750 1.00 45.31 H new ATOM 0 HG1 THR A 18 -9.467 -14.772 -3.630 1.00 4.32 H new ATOM 0 HG21 THR A 18 -8.494 -15.568 -1.600 1.00 42.54 H new ATOM 0 HG22 THR A 18 -6.747 -15.307 -1.378 1.00 42.54 H new ATOM 0 HG23 THR A 18 -7.870 -13.929 -1.294 1.00 42.54 H new ATOM 287 N ARG A 19 -6.264 -12.021 -1.802 1.00 5.23 N ATOM 288 CA ARG A 19 -6.559 -10.731 -1.156 1.00 75.20 C ATOM 289 C ARG A 19 -5.364 -9.764 -1.220 1.00 40.32 C ATOM 290 O ARG A 19 -5.533 -8.579 -1.501 1.00 74.10 O ATOM 291 CB ARG A 19 -6.961 -10.940 0.309 1.00 61.22 C ATOM 292 CG ARG A 19 -8.331 -11.581 0.505 1.00 2.34 C ATOM 293 CD ARG A 19 -8.743 -11.556 1.974 1.00 2.24 C ATOM 294 NE ARG A 19 -8.661 -10.203 2.533 1.00 54.01 N ATOM 295 CZ ARG A 19 -9.063 -9.868 3.731 1.00 14.41 C ATOM 296 NH1 ARG A 19 -9.601 -10.743 4.522 1.00 12.33 N ATOM 297 NH2 ARG A 19 -8.925 -8.643 4.129 1.00 43.14 N ATOM 0 H ARG A 19 -5.717 -12.663 -1.228 1.00 5.23 H new ATOM 0 HA ARG A 19 -7.388 -10.286 -1.707 1.00 75.20 H new ATOM 0 HB2 ARG A 19 -6.210 -11.564 0.793 1.00 61.22 H new ATOM 0 HB3 ARG A 19 -6.949 -9.975 0.817 1.00 61.22 H new ATOM 0 HG2 ARG A 19 -9.073 -11.052 -0.093 1.00 2.34 H new ATOM 0 HG3 ARG A 19 -8.309 -12.610 0.148 1.00 2.34 H new ATOM 0 HD2 ARG A 19 -9.762 -11.931 2.073 1.00 2.24 H new ATOM 0 HD3 ARG A 19 -8.100 -12.226 2.545 1.00 2.24 H new ATOM 0 HE ARG A 19 -8.262 -9.471 1.945 1.00 54.01 H new ATOM 0 HH11 ARG A 19 -9.716 -11.708 4.212 1.00 12.33 H new ATOM 0 HH12 ARG A 19 -9.910 -10.466 5.454 1.00 12.33 H new ATOM 0 HH21 ARG A 19 -8.506 -7.950 3.509 1.00 43.14 H new ATOM 0 HH22 ARG A 19 -9.236 -8.372 5.062 1.00 43.14 H new ATOM 311 N LEU A 20 -4.164 -10.286 -0.946 1.00 21.44 N ATOM 312 CA LEU A 20 -2.923 -9.485 -0.942 1.00 35.40 C ATOM 313 C LEU A 20 -2.931 -8.411 0.170 1.00 34.44 C ATOM 314 O LEU A 20 -2.134 -7.471 0.147 1.00 72.52 O ATOM 315 CB LEU A 20 -2.675 -8.819 -2.316 1.00 54.42 C ATOM 316 CG LEU A 20 -2.551 -9.769 -3.532 1.00 70.44 C ATOM 317 CD1 LEU A 20 -3.915 -10.058 -4.156 1.00 43.41 C ATOM 318 CD2 LEU A 20 -1.594 -9.193 -4.576 1.00 72.41 C ATOM 0 H LEU A 20 -4.020 -11.270 -0.721 1.00 21.44 H new ATOM 0 HA LEU A 20 -2.108 -10.179 -0.738 1.00 35.40 H new ATOM 0 HB2 LEU A 20 -3.490 -8.122 -2.509 1.00 54.42 H new ATOM 0 HB3 LEU A 20 -1.761 -8.229 -2.249 1.00 54.42 H new ATOM 0 HG LEU A 20 -2.142 -10.713 -3.172 1.00 70.44 H new ATOM 0 HD11 LEU A 20 -3.791 -10.728 -5.007 1.00 43.41 H new ATOM 0 HD12 LEU A 20 -4.562 -10.528 -3.415 1.00 43.41 H new ATOM 0 HD13 LEU A 20 -4.367 -9.125 -4.492 1.00 43.41 H new ATOM 0 HD21 LEU A 20 -1.523 -9.878 -5.421 1.00 72.41 H new ATOM 0 HD22 LEU A 20 -1.969 -8.229 -4.920 1.00 72.41 H new ATOM 0 HD23 LEU A 20 -0.607 -9.061 -4.132 1.00 72.41 H new ATOM 330 N VAL A 21 -3.809 -8.577 1.161 1.00 23.40 N ATOM 331 CA VAL A 21 -3.969 -7.594 2.244 1.00 62.41 C ATOM 332 C VAL A 21 -3.645 -8.195 3.625 1.00 14.03 C ATOM 333 O VAL A 21 -4.143 -9.267 3.983 1.00 75.10 O ATOM 334 CB VAL A 21 -5.414 -7.026 2.266 1.00 60.44 C ATOM 335 CG1 VAL A 21 -5.609 -6.061 3.433 1.00 13.44 C ATOM 336 CG2 VAL A 21 -5.741 -6.341 0.941 1.00 30.31 C ATOM 0 H VAL A 21 -4.425 -9.386 1.239 1.00 23.40 H new ATOM 0 HA VAL A 21 -3.260 -6.791 2.042 1.00 62.41 H new ATOM 0 HB VAL A 21 -6.101 -7.861 2.403 1.00 60.44 H new ATOM 0 HG11 VAL A 21 -6.630 -5.679 3.423 1.00 13.44 H new ATOM 0 HG12 VAL A 21 -5.426 -6.584 4.372 1.00 13.44 H new ATOM 0 HG13 VAL A 21 -4.910 -5.230 3.339 1.00 13.44 H new ATOM 0 HG21 VAL A 21 -6.758 -5.949 0.975 1.00 30.31 H new ATOM 0 HG22 VAL A 21 -5.042 -5.522 0.773 1.00 30.31 H new ATOM 0 HG23 VAL A 21 -5.657 -7.062 0.128 1.00 30.31 H new ATOM 346 N THR A 22 -2.811 -7.493 4.397 1.00 34.31 N ATOM 347 CA THR A 22 -2.459 -7.910 5.766 1.00 43.50 C ATOM 348 C THR A 22 -2.762 -6.796 6.781 1.00 71.24 C ATOM 349 O THR A 22 -2.021 -5.819 6.876 1.00 4.22 O ATOM 350 CB THR A 22 -0.955 -8.279 5.885 1.00 42.24 C ATOM 351 OG1 THR A 22 -0.609 -9.301 4.940 1.00 34.12 O ATOM 352 CG2 THR A 22 -0.609 -8.759 7.294 1.00 0.14 C ATOM 0 H THR A 22 -2.362 -6.627 4.099 1.00 34.31 H new ATOM 0 HA THR A 22 -3.066 -8.788 5.985 1.00 43.50 H new ATOM 0 HB THR A 22 -0.382 -7.376 5.672 1.00 42.24 H new ATOM 0 HG1 THR A 22 0.293 -9.632 5.132 1.00 34.12 H new ATOM 0 HG21 THR A 22 0.451 -9.009 7.343 1.00 0.14 H new ATOM 0 HG22 THR A 22 -0.829 -7.969 8.012 1.00 0.14 H new ATOM 0 HG23 THR A 22 -1.202 -9.642 7.533 1.00 0.14 H new ATOM 360 N ASP A 23 -3.852 -6.937 7.535 1.00 53.42 N ATOM 361 CA ASP A 23 -4.205 -5.952 8.568 1.00 24.44 C ATOM 362 C ASP A 23 -3.845 -6.467 9.972 1.00 35.53 C ATOM 363 O ASP A 23 -4.470 -7.400 10.482 1.00 33.10 O ATOM 364 CB ASP A 23 -5.702 -5.605 8.488 1.00 51.03 C ATOM 365 CG ASP A 23 -6.130 -4.595 9.548 1.00 74.53 C ATOM 366 OD1 ASP A 23 -5.889 -3.381 9.364 1.00 54.00 O ATOM 367 OD2 ASP A 23 -6.700 -5.010 10.576 1.00 54.20 O ATOM 0 H ASP A 23 -4.505 -7.717 7.454 1.00 53.42 H new ATOM 0 HA ASP A 23 -3.626 -5.047 8.384 1.00 24.44 H new ATOM 0 HB2 ASP A 23 -5.925 -5.204 7.499 1.00 51.03 H new ATOM 0 HB3 ASP A 23 -6.289 -6.516 8.603 1.00 51.03 H new ATOM 372 N GLU A 24 -2.817 -5.874 10.582 1.00 65.33 N ATOM 373 CA GLU A 24 -2.429 -6.216 11.961 1.00 73.24 C ATOM 374 C GLU A 24 -2.537 -4.996 12.889 1.00 32.01 C ATOM 375 O GLU A 24 -2.628 -5.138 14.111 1.00 64.11 O ATOM 376 CB GLU A 24 -1.009 -6.801 12.001 1.00 10.34 C ATOM 377 CG GLU A 24 -0.860 -8.087 11.191 1.00 23.20 C ATOM 378 CD GLU A 24 0.426 -8.841 11.499 1.00 13.21 C ATOM 379 OE1 GLU A 24 1.469 -8.519 10.898 1.00 60.40 O ATOM 380 OE2 GLU A 24 0.387 -9.764 12.348 1.00 1.33 O ATOM 0 H GLU A 24 -2.237 -5.156 10.148 1.00 65.33 H new ATOM 0 HA GLU A 24 -3.123 -6.975 12.321 1.00 73.24 H new ATOM 0 HB2 GLU A 24 -0.307 -6.058 11.622 1.00 10.34 H new ATOM 0 HB3 GLU A 24 -0.735 -6.999 13.037 1.00 10.34 H new ATOM 0 HG2 GLU A 24 -1.712 -8.737 11.392 1.00 23.20 H new ATOM 0 HG3 GLU A 24 -0.887 -7.845 10.128 1.00 23.20 H new ATOM 387 N ALA A 25 -2.499 -3.797 12.305 1.00 40.30 N ATOM 388 CA ALA A 25 -2.788 -2.560 13.043 1.00 33.01 C ATOM 389 C ALA A 25 -4.246 -2.510 13.538 1.00 53.22 C ATOM 390 O ALA A 25 -4.556 -1.813 14.509 1.00 34.13 O ATOM 391 CB ALA A 25 -2.494 -1.346 12.168 1.00 13.53 C ATOM 0 H ALA A 25 -2.271 -3.653 11.321 1.00 40.30 H new ATOM 0 HA ALA A 25 -2.141 -2.544 13.920 1.00 33.01 H new ATOM 0 HB1 ALA A 25 -2.712 -0.435 12.725 1.00 13.53 H new ATOM 0 HB2 ALA A 25 -1.443 -1.352 11.879 1.00 13.53 H new ATOM 0 HB3 ALA A 25 -3.117 -1.382 11.274 1.00 13.53 H new ATOM 397 N GLY A 26 -5.134 -3.241 12.860 1.00 64.53 N ATOM 398 CA GLY A 26 -6.549 -3.252 13.230 1.00 34.43 C ATOM 399 C GLY A 26 -7.289 -2.002 12.766 1.00 3.31 C ATOM 400 O GLY A 26 -8.088 -1.433 13.510 1.00 32.23 O ATOM 0 H GLY A 26 -4.900 -3.828 12.059 1.00 64.53 H new ATOM 0 HA2 GLY A 26 -7.026 -4.132 12.799 1.00 34.43 H new ATOM 0 HA3 GLY A 26 -6.636 -3.340 14.313 1.00 34.43 H new ATOM 404 N LEU A 27 -7.028 -1.575 11.530 1.00 53.12 N ATOM 405 CA LEU A 27 -7.594 -0.325 11.003 1.00 31.25 C ATOM 406 C LEU A 27 -8.553 -0.568 9.823 1.00 10.31 C ATOM 407 O LEU A 27 -9.504 0.190 9.620 1.00 41.20 O ATOM 408 CB LEU A 27 -6.464 0.625 10.573 1.00 24.22 C ATOM 409 CG LEU A 27 -5.504 1.056 11.698 1.00 14.55 C ATOM 410 CD1 LEU A 27 -4.402 1.961 11.154 1.00 65.24 C ATOM 411 CD2 LEU A 27 -6.265 1.754 12.826 1.00 24.15 C ATOM 0 H LEU A 27 -6.429 -2.074 10.872 1.00 53.12 H new ATOM 0 HA LEU A 27 -8.174 0.131 11.805 1.00 31.25 H new ATOM 0 HB2 LEU A 27 -5.883 0.141 9.788 1.00 24.22 H new ATOM 0 HB3 LEU A 27 -6.909 1.518 10.135 1.00 24.22 H new ATOM 0 HG LEU A 27 -5.039 0.158 12.105 1.00 14.55 H new ATOM 0 HD11 LEU A 27 -3.736 2.253 11.966 1.00 65.24 H new ATOM 0 HD12 LEU A 27 -3.834 1.425 10.394 1.00 65.24 H new ATOM 0 HD13 LEU A 27 -4.848 2.852 10.713 1.00 65.24 H new ATOM 0 HD21 LEU A 27 -5.566 2.049 13.608 1.00 24.15 H new ATOM 0 HD22 LEU A 27 -6.765 2.639 12.434 1.00 24.15 H new ATOM 0 HD23 LEU A 27 -7.007 1.072 13.241 1.00 24.15 H new ATOM 423 N LEU A 28 -8.301 -1.617 9.042 1.00 55.22 N ATOM 424 CA LEU A 28 -9.146 -1.938 7.884 1.00 75.42 C ATOM 425 C LEU A 28 -10.480 -2.572 8.313 1.00 30.41 C ATOM 426 O LEU A 28 -10.526 -3.729 8.738 1.00 15.24 O ATOM 427 CB LEU A 28 -8.402 -2.879 6.925 1.00 52.42 C ATOM 428 CG LEU A 28 -7.195 -2.260 6.202 1.00 42.22 C ATOM 429 CD1 LEU A 28 -6.447 -3.316 5.396 1.00 54.43 C ATOM 430 CD2 LEU A 28 -7.641 -1.113 5.298 1.00 21.54 C ATOM 0 H LEU A 28 -7.522 -2.260 9.186 1.00 55.22 H new ATOM 0 HA LEU A 28 -9.369 -1.003 7.370 1.00 75.42 H new ATOM 0 HB2 LEU A 28 -8.061 -3.749 7.487 1.00 52.42 H new ATOM 0 HB3 LEU A 28 -9.107 -3.240 6.176 1.00 52.42 H new ATOM 0 HG LEU A 28 -6.515 -1.861 6.955 1.00 42.22 H new ATOM 0 HD11 LEU A 28 -5.597 -2.855 4.893 1.00 54.43 H new ATOM 0 HD12 LEU A 28 -6.092 -4.100 6.065 1.00 54.43 H new ATOM 0 HD13 LEU A 28 -7.117 -3.749 4.653 1.00 54.43 H new ATOM 0 HD21 LEU A 28 -6.773 -0.688 4.795 1.00 21.54 H new ATOM 0 HD22 LEU A 28 -8.344 -1.488 4.554 1.00 21.54 H new ATOM 0 HD23 LEU A 28 -8.125 -0.343 5.899 1.00 21.54 H new ATOM 442 N SER A 29 -11.565 -1.803 8.209 1.00 71.30 N ATOM 443 CA SER A 29 -12.912 -2.317 8.506 1.00 34.01 C ATOM 444 C SER A 29 -13.393 -3.249 7.383 1.00 10.43 C ATOM 445 O SER A 29 -12.931 -3.143 6.250 1.00 22.10 O ATOM 446 CB SER A 29 -13.904 -1.162 8.692 1.00 11.53 C ATOM 447 OG SER A 29 -15.171 -1.635 9.123 1.00 24.13 O ATOM 0 H SER A 29 -11.542 -0.824 7.923 1.00 71.30 H new ATOM 0 HA SER A 29 -12.861 -2.885 9.435 1.00 34.01 H new ATOM 0 HB2 SER A 29 -13.510 -0.455 9.422 1.00 11.53 H new ATOM 0 HB3 SER A 29 -14.016 -0.621 7.752 1.00 11.53 H new ATOM 0 HG SER A 29 -15.782 -0.877 9.235 1.00 24.13 H new ATOM 453 N ASN A 30 -14.338 -4.136 7.694 1.00 13.31 N ATOM 454 CA ASN A 30 -14.742 -5.211 6.769 1.00 0.35 C ATOM 455 C ASN A 30 -15.099 -4.692 5.358 1.00 50.12 C ATOM 456 O ASN A 30 -14.536 -5.151 4.362 1.00 41.51 O ATOM 457 CB ASN A 30 -15.919 -6.004 7.349 1.00 34.22 C ATOM 458 CG ASN A 30 -16.163 -7.308 6.607 1.00 12.55 C ATOM 459 OD1 ASN A 30 -17.296 -7.758 6.466 1.00 1.24 O ATOM 460 ND2 ASN A 30 -15.103 -7.944 6.143 1.00 41.34 N ATOM 0 H ASN A 30 -14.843 -4.137 8.580 1.00 13.31 H new ATOM 0 HA ASN A 30 -13.877 -5.865 6.659 1.00 0.35 H new ATOM 0 HB2 ASN A 30 -15.726 -6.218 8.400 1.00 34.22 H new ATOM 0 HB3 ASN A 30 -16.820 -5.392 7.309 1.00 34.22 H new ATOM 0 HD21 ASN A 30 -15.215 -8.832 5.654 1.00 41.34 H new ATOM 0 HD22 ASN A 30 -14.172 -7.547 6.274 1.00 41.34 H new ATOM 467 N ALA A 31 -16.032 -3.745 5.277 1.00 75.14 N ATOM 468 CA ALA A 31 -16.433 -3.161 3.988 1.00 52.53 C ATOM 469 C ALA A 31 -15.236 -2.530 3.256 1.00 53.15 C ATOM 470 O ALA A 31 -15.120 -2.634 2.033 1.00 5.14 O ATOM 471 CB ALA A 31 -17.530 -2.122 4.198 1.00 53.34 C ATOM 0 H ALA A 31 -16.526 -3.363 6.083 1.00 75.14 H new ATOM 0 HA ALA A 31 -16.818 -3.967 3.363 1.00 52.53 H new ATOM 0 HB1 ALA A 31 -17.818 -1.697 3.236 1.00 53.34 H new ATOM 0 HB2 ALA A 31 -18.396 -2.596 4.659 1.00 53.34 H new ATOM 0 HB3 ALA A 31 -17.161 -1.329 4.849 1.00 53.34 H new ATOM 477 N GLN A 32 -14.344 -1.890 4.012 1.00 12.24 N ATOM 478 CA GLN A 32 -13.144 -1.271 3.438 1.00 2.24 C ATOM 479 C GLN A 32 -12.138 -2.337 2.981 1.00 13.03 C ATOM 480 O GLN A 32 -11.387 -2.128 2.025 1.00 0.31 O ATOM 481 CB GLN A 32 -12.497 -0.312 4.448 1.00 53.13 C ATOM 482 CG GLN A 32 -13.432 0.807 4.899 1.00 52.11 C ATOM 483 CD GLN A 32 -12.769 1.799 5.839 1.00 45.00 C ATOM 484 OE1 GLN A 32 -11.579 2.065 5.750 1.00 14.42 O ATOM 485 NE2 GLN A 32 -13.537 2.346 6.759 1.00 5.54 N ATOM 0 H GLN A 32 -14.428 -1.785 5.023 1.00 12.24 H new ATOM 0 HA GLN A 32 -13.446 -0.697 2.562 1.00 2.24 H new ATOM 0 HB2 GLN A 32 -12.172 -0.879 5.320 1.00 53.13 H new ATOM 0 HB3 GLN A 32 -11.604 0.127 4.002 1.00 53.13 H new ATOM 0 HG2 GLN A 32 -13.801 1.339 4.022 1.00 52.11 H new ATOM 0 HG3 GLN A 32 -14.299 0.370 5.395 1.00 52.11 H new ATOM 0 HE21 GLN A 32 -14.527 2.103 6.807 1.00 5.54 H new ATOM 0 HE22 GLN A 32 -13.142 3.012 7.423 1.00 5.54 H new ATOM 494 N GLU A 33 -12.133 -3.487 3.662 1.00 11.11 N ATOM 495 CA GLU A 33 -11.321 -4.625 3.227 1.00 2.54 C ATOM 496 C GLU A 33 -11.699 -5.033 1.803 1.00 13.13 C ATOM 497 O GLU A 33 -10.842 -5.140 0.942 1.00 21.50 O ATOM 498 CB GLU A 33 -11.494 -5.836 4.156 1.00 72.02 C ATOM 499 CG GLU A 33 -10.974 -5.629 5.570 1.00 42.11 C ATOM 500 CD GLU A 33 -11.055 -6.905 6.393 1.00 21.52 C ATOM 501 OE1 GLU A 33 -12.115 -7.161 7.004 1.00 23.43 O ATOM 502 OE2 GLU A 33 -10.070 -7.671 6.406 1.00 42.14 O ATOM 0 H GLU A 33 -12.677 -3.653 4.509 1.00 11.11 H new ATOM 0 HA GLU A 33 -10.279 -4.308 3.261 1.00 2.54 H new ATOM 0 HB2 GLU A 33 -12.553 -6.091 4.206 1.00 72.02 H new ATOM 0 HB3 GLU A 33 -10.981 -6.691 3.716 1.00 72.02 H new ATOM 0 HG2 GLU A 33 -9.940 -5.287 5.531 1.00 42.11 H new ATOM 0 HG3 GLU A 33 -11.551 -4.844 6.058 1.00 42.11 H new ATOM 509 N GLU A 34 -12.992 -5.247 1.562 1.00 3.01 N ATOM 510 CA GLU A 34 -13.477 -5.616 0.225 1.00 32.24 C ATOM 511 C GLU A 34 -13.094 -4.558 -0.826 1.00 12.32 C ATOM 512 O GLU A 34 -12.833 -4.886 -1.982 1.00 52.30 O ATOM 513 CB GLU A 34 -14.998 -5.828 0.256 1.00 2.33 C ATOM 514 CG GLU A 34 -15.617 -6.205 -1.091 1.00 1.31 C ATOM 515 CD GLU A 34 -14.979 -7.438 -1.735 1.00 51.23 C ATOM 516 OE1 GLU A 34 -15.062 -8.539 -1.147 1.00 73.22 O ATOM 517 OE2 GLU A 34 -14.386 -7.314 -2.831 1.00 73.04 O ATOM 0 H GLU A 34 -13.723 -5.173 2.270 1.00 3.01 H new ATOM 0 HA GLU A 34 -12.997 -6.551 -0.064 1.00 32.24 H new ATOM 0 HB2 GLU A 34 -15.228 -6.611 0.978 1.00 2.33 H new ATOM 0 HB3 GLU A 34 -15.472 -4.914 0.615 1.00 2.33 H new ATOM 0 HG2 GLU A 34 -16.683 -6.388 -0.953 1.00 1.31 H new ATOM 0 HG3 GLU A 34 -15.524 -5.360 -1.773 1.00 1.31 H new ATOM 524 N VAL A 35 -13.044 -3.290 -0.417 1.00 1.32 N ATOM 525 CA VAL A 35 -12.573 -2.220 -1.301 1.00 51.44 C ATOM 526 C VAL A 35 -11.122 -2.475 -1.751 1.00 5.34 C ATOM 527 O VAL A 35 -10.823 -2.508 -2.946 1.00 51.11 O ATOM 528 CB VAL A 35 -12.659 -0.832 -0.611 1.00 2.51 C ATOM 529 CG1 VAL A 35 -12.062 0.266 -1.496 1.00 72.20 C ATOM 530 CG2 VAL A 35 -14.106 -0.503 -0.241 1.00 72.44 C ATOM 0 H VAL A 35 -13.321 -2.979 0.514 1.00 1.32 H new ATOM 0 HA VAL A 35 -13.226 -2.218 -2.174 1.00 51.44 H new ATOM 0 HB VAL A 35 -12.071 -0.877 0.306 1.00 2.51 H new ATOM 0 HG11 VAL A 35 -12.137 1.226 -0.985 1.00 72.20 H new ATOM 0 HG12 VAL A 35 -11.014 0.042 -1.696 1.00 72.20 H new ATOM 0 HG13 VAL A 35 -12.609 0.312 -2.437 1.00 72.20 H new ATOM 0 HG21 VAL A 35 -14.145 0.474 0.241 1.00 72.44 H new ATOM 0 HG22 VAL A 35 -14.718 -0.487 -1.143 1.00 72.44 H new ATOM 0 HG23 VAL A 35 -14.488 -1.261 0.443 1.00 72.44 H new ATOM 540 N MET A 36 -10.229 -2.677 -0.785 1.00 1.33 N ATOM 541 CA MET A 36 -8.811 -2.917 -1.076 1.00 1.33 C ATOM 542 C MET A 36 -8.597 -4.297 -1.730 1.00 61.31 C ATOM 543 O MET A 36 -7.936 -4.404 -2.763 1.00 0.44 O ATOM 544 CB MET A 36 -7.985 -2.792 0.212 1.00 51.21 C ATOM 545 CG MET A 36 -6.479 -2.890 -0.002 1.00 64.14 C ATOM 546 SD MET A 36 -5.545 -2.508 1.493 1.00 44.32 S ATOM 547 CE MET A 36 -6.053 -0.814 1.781 1.00 71.02 C ATOM 0 H MET A 36 -10.459 -2.680 0.209 1.00 1.33 H new ATOM 0 HA MET A 36 -8.475 -2.163 -1.788 1.00 1.33 H new ATOM 0 HB2 MET A 36 -8.212 -1.837 0.685 1.00 51.21 H new ATOM 0 HB3 MET A 36 -8.294 -3.573 0.906 1.00 51.21 H new ATOM 0 HG2 MET A 36 -6.227 -3.896 -0.337 1.00 64.14 H new ATOM 0 HG3 MET A 36 -6.183 -2.206 -0.797 1.00 64.14 H new ATOM 0 HE1 MET A 36 -5.456 -0.387 2.587 1.00 71.02 H new ATOM 0 HE2 MET A 36 -5.906 -0.231 0.872 1.00 71.02 H new ATOM 0 HE3 MET A 36 -7.107 -0.792 2.060 1.00 71.02 H new ATOM 557 N ASN A 37 -9.171 -5.340 -1.125 1.00 5.41 N ATOM 558 CA ASN A 37 -9.131 -6.703 -1.680 1.00 2.31 C ATOM 559 C ASN A 37 -9.576 -6.712 -3.148 1.00 44.34 C ATOM 560 O ASN A 37 -8.877 -7.229 -4.015 1.00 25.54 O ATOM 561 CB ASN A 37 -10.052 -7.644 -0.882 1.00 12.10 C ATOM 562 CG ASN A 37 -9.631 -7.837 0.566 1.00 41.41 C ATOM 563 OD1 ASN A 37 -8.457 -7.809 0.904 1.00 22.32 O ATOM 564 ND2 ASN A 37 -10.596 -8.052 1.439 1.00 54.43 N ATOM 0 H ASN A 37 -9.675 -5.269 -0.241 1.00 5.41 H new ATOM 0 HA ASN A 37 -8.100 -7.051 -1.611 1.00 2.31 H new ATOM 0 HB2 ASN A 37 -11.067 -7.248 -0.905 1.00 12.10 H new ATOM 0 HB3 ASN A 37 -10.077 -8.616 -1.375 1.00 12.10 H new ATOM 0 HD21 ASN A 37 -10.370 -8.200 2.423 1.00 54.43 H new ATOM 0 HD22 ASN A 37 -11.568 -8.070 1.130 1.00 54.43 H new ATOM 571 N GLY A 38 -10.748 -6.132 -3.412 1.00 34.02 N ATOM 572 CA GLY A 38 -11.270 -6.054 -4.770 1.00 61.42 C ATOM 573 C GLY A 38 -10.331 -5.339 -5.733 1.00 10.22 C ATOM 574 O GLY A 38 -10.129 -5.791 -6.859 1.00 41.41 O ATOM 0 H GLY A 38 -11.349 -5.712 -2.703 1.00 34.02 H new ATOM 0 HA2 GLY A 38 -11.459 -7.062 -5.138 1.00 61.42 H new ATOM 0 HA3 GLY A 38 -12.229 -5.535 -4.755 1.00 61.42 H new ATOM 578 N ARG A 39 -9.755 -4.223 -5.288 1.00 52.33 N ATOM 579 CA ARG A 39 -8.789 -3.468 -6.097 1.00 54.20 C ATOM 580 C ARG A 39 -7.576 -4.337 -6.476 1.00 5.25 C ATOM 581 O ARG A 39 -7.275 -4.512 -7.657 1.00 1.21 O ATOM 582 CB ARG A 39 -8.333 -2.209 -5.330 1.00 60.04 C ATOM 583 CG ARG A 39 -9.145 -0.934 -5.609 1.00 63.42 C ATOM 584 CD ARG A 39 -10.653 -1.180 -5.695 1.00 3.35 C ATOM 585 NE ARG A 39 -11.060 -1.702 -7.003 1.00 31.03 N ATOM 586 CZ ARG A 39 -12.121 -2.442 -7.205 1.00 73.00 C ATOM 587 NH1 ARG A 39 -12.912 -2.746 -6.223 1.00 10.45 N ATOM 588 NH2 ARG A 39 -12.402 -2.852 -8.399 1.00 34.12 N ATOM 0 H ARG A 39 -9.939 -3.818 -4.370 1.00 52.33 H new ATOM 0 HA ARG A 39 -9.280 -3.165 -7.022 1.00 54.20 H new ATOM 0 HB2 ARG A 39 -8.377 -2.420 -4.262 1.00 60.04 H new ATOM 0 HB3 ARG A 39 -7.289 -2.014 -5.574 1.00 60.04 H new ATOM 0 HG2 ARG A 39 -8.947 -0.207 -4.821 1.00 63.42 H new ATOM 0 HG3 ARG A 39 -8.803 -0.492 -6.545 1.00 63.42 H new ATOM 0 HD2 ARG A 39 -10.948 -1.885 -4.918 1.00 3.35 H new ATOM 0 HD3 ARG A 39 -11.182 -0.248 -5.498 1.00 3.35 H new ATOM 0 HE ARG A 39 -10.478 -1.474 -7.809 1.00 31.03 H new ATOM 0 HH11 ARG A 39 -12.710 -2.408 -5.282 1.00 10.45 H new ATOM 0 HH12 ARG A 39 -13.736 -3.323 -6.392 1.00 10.45 H new ATOM 0 HH21 ARG A 39 -11.798 -2.599 -9.181 1.00 34.12 H new ATOM 0 HH22 ARG A 39 -13.228 -3.429 -8.559 1.00 34.12 H new ATOM 602 N LEU A 40 -6.912 -4.907 -5.471 1.00 40.21 N ATOM 603 CA LEU A 40 -5.705 -5.721 -5.694 1.00 50.51 C ATOM 604 C LEU A 40 -6.023 -6.977 -6.521 1.00 5.30 C ATOM 605 O LEU A 40 -5.324 -7.306 -7.487 1.00 61.33 O ATOM 606 CB LEU A 40 -5.090 -6.124 -4.344 1.00 13.33 C ATOM 607 CG LEU A 40 -4.832 -4.963 -3.367 1.00 53.22 C ATOM 608 CD1 LEU A 40 -4.169 -5.460 -2.084 1.00 20.23 C ATOM 609 CD2 LEU A 40 -3.988 -3.879 -4.025 1.00 24.45 C ATOM 0 H LEU A 40 -7.185 -4.823 -4.492 1.00 40.21 H new ATOM 0 HA LEU A 40 -4.990 -5.120 -6.255 1.00 50.51 H new ATOM 0 HB2 LEU A 40 -5.752 -6.843 -3.862 1.00 13.33 H new ATOM 0 HB3 LEU A 40 -4.146 -6.636 -4.532 1.00 13.33 H new ATOM 0 HG LEU A 40 -5.796 -4.530 -3.101 1.00 53.22 H new ATOM 0 HD11 LEU A 40 -3.999 -4.618 -1.413 1.00 20.23 H new ATOM 0 HD12 LEU A 40 -4.819 -6.187 -1.597 1.00 20.23 H new ATOM 0 HD13 LEU A 40 -3.216 -5.930 -2.326 1.00 20.23 H new ATOM 0 HD21 LEU A 40 -3.819 -3.069 -3.316 1.00 24.45 H new ATOM 0 HD22 LEU A 40 -3.030 -4.299 -4.331 1.00 24.45 H new ATOM 0 HD23 LEU A 40 -4.511 -3.492 -4.900 1.00 24.45 H new ATOM 621 N ARG A 41 -7.086 -7.668 -6.129 1.00 1.11 N ATOM 622 CA ARG A 41 -7.559 -8.864 -6.828 1.00 11.41 C ATOM 623 C ARG A 41 -7.875 -8.562 -8.305 1.00 42.20 C ATOM 624 O ARG A 41 -7.453 -9.294 -9.205 1.00 63.30 O ATOM 625 CB ARG A 41 -8.801 -9.400 -6.104 1.00 63.33 C ATOM 626 CG ARG A 41 -9.356 -10.709 -6.648 1.00 3.31 C ATOM 627 CD ARG A 41 -10.570 -11.162 -5.839 1.00 1.24 C ATOM 628 NE ARG A 41 -11.620 -10.137 -5.810 1.00 71.22 N ATOM 629 CZ ARG A 41 -12.259 -9.754 -4.732 1.00 1.04 C ATOM 630 NH1 ARG A 41 -12.013 -10.307 -3.584 1.00 40.53 N ATOM 631 NH2 ARG A 41 -13.157 -8.825 -4.812 1.00 1.33 N ATOM 0 H ARG A 41 -7.648 -7.417 -5.316 1.00 1.11 H new ATOM 0 HA ARG A 41 -6.773 -9.619 -6.817 1.00 11.41 H new ATOM 0 HB2 ARG A 41 -8.556 -9.538 -5.051 1.00 63.33 H new ATOM 0 HB3 ARG A 41 -9.585 -8.644 -6.153 1.00 63.33 H new ATOM 0 HG2 ARG A 41 -9.637 -10.583 -7.694 1.00 3.31 H new ATOM 0 HG3 ARG A 41 -8.584 -11.478 -6.615 1.00 3.31 H new ATOM 0 HD2 ARG A 41 -10.971 -12.080 -6.268 1.00 1.24 H new ATOM 0 HD3 ARG A 41 -10.261 -11.395 -4.820 1.00 1.24 H new ATOM 0 HE ARG A 41 -11.870 -9.691 -6.692 1.00 71.22 H new ATOM 0 HH11 ARG A 41 -11.316 -11.048 -3.514 1.00 40.53 H new ATOM 0 HH12 ARG A 41 -12.517 -10.000 -2.752 1.00 40.53 H new ATOM 0 HH21 ARG A 41 -13.365 -8.393 -5.712 1.00 1.33 H new ATOM 0 HH22 ARG A 41 -13.656 -8.525 -3.975 1.00 1.33 H new ATOM 645 N ALA A 42 -8.603 -7.472 -8.548 1.00 75.52 N ATOM 646 CA ALA A 42 -8.943 -7.051 -9.912 1.00 60.35 C ATOM 647 C ALA A 42 -7.684 -6.739 -10.736 1.00 11.33 C ATOM 648 O ALA A 42 -7.606 -7.082 -11.917 1.00 24.05 O ATOM 649 CB ALA A 42 -9.871 -5.842 -9.882 1.00 12.23 C ATOM 0 H ALA A 42 -8.970 -6.862 -7.818 1.00 75.52 H new ATOM 0 HA ALA A 42 -9.460 -7.880 -10.395 1.00 60.35 H new ATOM 0 HB1 ALA A 42 -10.113 -5.543 -10.902 1.00 12.23 H new ATOM 0 HB2 ALA A 42 -10.788 -6.100 -9.353 1.00 12.23 H new ATOM 0 HB3 ALA A 42 -9.377 -5.016 -9.370 1.00 12.23 H new ATOM 655 N ILE A 43 -6.700 -6.090 -10.108 1.00 13.44 N ATOM 656 CA ILE A 43 -5.425 -5.794 -10.771 1.00 72.11 C ATOM 657 C ILE A 43 -4.713 -7.086 -11.207 1.00 64.44 C ATOM 658 O ILE A 43 -4.263 -7.203 -12.348 1.00 75.24 O ATOM 659 CB ILE A 43 -4.482 -4.967 -9.856 1.00 34.03 C ATOM 660 CG1 ILE A 43 -5.104 -3.596 -9.541 1.00 41.33 C ATOM 661 CG2 ILE A 43 -3.109 -4.791 -10.505 1.00 61.23 C ATOM 662 CD1 ILE A 43 -4.281 -2.751 -8.589 1.00 50.44 C ATOM 0 H ILE A 43 -6.760 -5.760 -9.145 1.00 13.44 H new ATOM 0 HA ILE A 43 -5.660 -5.201 -11.655 1.00 72.11 H new ATOM 0 HB ILE A 43 -4.351 -5.514 -8.922 1.00 34.03 H new ATOM 0 HG12 ILE A 43 -5.240 -3.047 -10.473 1.00 41.33 H new ATOM 0 HG13 ILE A 43 -6.095 -3.748 -9.113 1.00 41.33 H new ATOM 0 HG21 ILE A 43 -2.466 -4.208 -9.845 1.00 61.23 H new ATOM 0 HG22 ILE A 43 -2.660 -5.769 -10.678 1.00 61.23 H new ATOM 0 HG23 ILE A 43 -3.220 -4.270 -11.456 1.00 61.23 H new ATOM 0 HD11 ILE A 43 -4.786 -1.800 -8.417 1.00 50.44 H new ATOM 0 HD12 ILE A 43 -4.166 -3.278 -7.642 1.00 50.44 H new ATOM 0 HD13 ILE A 43 -3.298 -2.566 -9.023 1.00 50.44 H new ATOM 674 N ARG A 44 -4.624 -8.058 -10.303 1.00 73.34 N ATOM 675 CA ARG A 44 -4.016 -9.356 -10.626 1.00 64.20 C ATOM 676 C ARG A 44 -4.840 -10.109 -11.692 1.00 42.51 C ATOM 677 O ARG A 44 -4.288 -10.810 -12.541 1.00 5.51 O ATOM 678 CB ARG A 44 -3.876 -10.210 -9.355 1.00 52.22 C ATOM 679 CG ARG A 44 -3.237 -11.577 -9.593 1.00 22.13 C ATOM 680 CD ARG A 44 -3.109 -12.383 -8.301 1.00 20.31 C ATOM 681 NE ARG A 44 -4.387 -12.499 -7.598 1.00 0.55 N ATOM 682 CZ ARG A 44 -5.196 -13.524 -7.692 1.00 40.41 C ATOM 683 NH1 ARG A 44 -4.903 -14.533 -8.451 1.00 44.02 N ATOM 684 NH2 ARG A 44 -6.303 -13.535 -7.028 1.00 53.22 N ATOM 0 H ARG A 44 -4.962 -7.977 -9.344 1.00 73.34 H new ATOM 0 HA ARG A 44 -3.024 -9.171 -11.038 1.00 64.20 H new ATOM 0 HB2 ARG A 44 -3.278 -9.663 -8.626 1.00 52.22 H new ATOM 0 HB3 ARG A 44 -4.863 -10.353 -8.915 1.00 52.22 H new ATOM 0 HG2 ARG A 44 -3.836 -12.137 -10.311 1.00 22.13 H new ATOM 0 HG3 ARG A 44 -2.250 -11.443 -10.036 1.00 22.13 H new ATOM 0 HD2 ARG A 44 -2.730 -13.379 -8.531 1.00 20.31 H new ATOM 0 HD3 ARG A 44 -2.378 -11.907 -7.648 1.00 20.31 H new ATOM 0 HE ARG A 44 -4.667 -11.727 -6.992 1.00 0.55 H new ATOM 0 HH11 ARG A 44 -4.033 -14.535 -8.984 1.00 44.02 H new ATOM 0 HH12 ARG A 44 -5.542 -15.325 -8.515 1.00 44.02 H new ATOM 0 HH21 ARG A 44 -6.547 -12.745 -6.430 1.00 53.22 H new ATOM 0 HH22 ARG A 44 -6.934 -14.333 -7.101 1.00 53.22 H new ATOM 698 N SER A 45 -6.159 -9.927 -11.661 1.00 64.32 N ATOM 699 CA SER A 45 -7.067 -10.591 -12.615 1.00 24.02 C ATOM 700 C SER A 45 -7.138 -9.823 -13.945 1.00 60.42 C ATOM 701 O SER A 45 -7.813 -10.235 -14.889 1.00 33.53 O ATOM 702 CB SER A 45 -8.474 -10.712 -12.009 1.00 52.31 C ATOM 703 OG SER A 45 -9.355 -11.415 -12.870 1.00 55.44 O ATOM 0 H SER A 45 -6.631 -9.325 -10.986 1.00 64.32 H new ATOM 0 HA SER A 45 -6.671 -11.587 -12.816 1.00 24.02 H new ATOM 0 HB2 SER A 45 -8.415 -11.226 -11.050 1.00 52.31 H new ATOM 0 HB3 SER A 45 -8.873 -9.717 -11.813 1.00 52.31 H new ATOM 0 HG SER A 45 -9.038 -11.341 -13.794 1.00 55.44 H new ATOM 709 N SER A 46 -6.432 -8.697 -14.013 1.00 52.34 N ATOM 710 CA SER A 46 -6.418 -7.859 -15.219 1.00 3.42 C ATOM 711 C SER A 46 -4.986 -7.511 -15.641 1.00 55.14 C ATOM 712 O SER A 46 -4.466 -8.043 -16.621 1.00 75.20 O ATOM 713 CB SER A 46 -7.220 -6.570 -14.980 1.00 23.15 C ATOM 714 OG SER A 46 -8.562 -6.857 -14.613 1.00 14.11 O ATOM 0 H SER A 46 -5.860 -8.340 -13.248 1.00 52.34 H new ATOM 0 HA SER A 46 -6.881 -8.428 -16.025 1.00 3.42 H new ATOM 0 HB2 SER A 46 -6.744 -5.983 -14.195 1.00 23.15 H new ATOM 0 HB3 SER A 46 -7.210 -5.960 -15.884 1.00 23.15 H new ATOM 0 HG SER A 46 -8.612 -7.008 -13.646 1.00 14.11 H new ATOM 720 N HIS A 47 -4.343 -6.638 -14.875 1.00 21.34 N ATOM 721 CA HIS A 47 -3.001 -6.144 -15.204 1.00 54.24 C ATOM 722 C HIS A 47 -1.903 -7.147 -14.816 1.00 73.50 C ATOM 723 O HIS A 47 -0.750 -6.999 -15.225 1.00 72.33 O ATOM 724 CB HIS A 47 -2.771 -4.806 -14.499 1.00 44.43 C ATOM 725 CG HIS A 47 -3.819 -3.795 -14.837 1.00 70.32 C ATOM 726 ND1 HIS A 47 -3.900 -3.262 -16.092 1.00 53.12 N ATOM 727 CD2 HIS A 47 -4.818 -3.286 -14.075 1.00 62.34 C ATOM 728 CE1 HIS A 47 -4.931 -2.447 -16.079 1.00 34.34 C ATOM 729 NE2 HIS A 47 -5.524 -2.426 -14.878 1.00 34.12 N ATOM 0 H HIS A 47 -4.729 -6.252 -14.013 1.00 21.34 H new ATOM 0 HA HIS A 47 -2.944 -6.012 -16.284 1.00 54.24 H new ATOM 0 HB2 HIS A 47 -2.758 -4.964 -13.421 1.00 44.43 H new ATOM 0 HB3 HIS A 47 -1.792 -4.416 -14.776 1.00 44.43 H new ATOM 0 HD1 HIS A 47 -3.284 -3.457 -16.881 1.00 53.12 H new ATOM 0 HD2 HIS A 47 -5.019 -3.513 -13.038 1.00 62.34 H new ATOM 0 HE1 HIS A 47 -5.259 -1.867 -16.929 1.00 34.34 H new ATOM 737 N ALA A 48 -2.275 -8.160 -14.026 1.00 60.31 N ATOM 738 CA ALA A 48 -1.344 -9.212 -13.581 1.00 42.30 C ATOM 739 C ALA A 48 -0.247 -8.660 -12.653 1.00 71.10 C ATOM 740 O ALA A 48 0.790 -9.294 -12.450 1.00 21.31 O ATOM 741 CB ALA A 48 -0.725 -9.921 -14.783 1.00 73.43 C ATOM 0 H ALA A 48 -3.226 -8.277 -13.676 1.00 60.31 H new ATOM 0 HA ALA A 48 -1.921 -9.934 -13.003 1.00 42.30 H new ATOM 0 HB1 ALA A 48 -0.040 -10.695 -14.436 1.00 73.43 H new ATOM 0 HB2 ALA A 48 -1.513 -10.376 -15.382 1.00 73.43 H new ATOM 0 HB3 ALA A 48 -0.179 -9.199 -15.390 1.00 73.43 H new ATOM 747 N VAL A 49 -0.491 -7.484 -12.081 1.00 13.43 N ATOM 748 CA VAL A 49 0.458 -6.855 -11.161 1.00 31.03 C ATOM 749 C VAL A 49 0.255 -7.358 -9.724 1.00 21.44 C ATOM 750 O VAL A 49 -0.873 -7.415 -9.228 1.00 4.34 O ATOM 751 CB VAL A 49 0.320 -5.312 -11.186 1.00 71.13 C ATOM 752 CG1 VAL A 49 1.278 -4.657 -10.193 1.00 11.13 C ATOM 753 CG2 VAL A 49 0.546 -4.773 -12.599 1.00 32.40 C ATOM 0 H VAL A 49 -1.342 -6.944 -12.238 1.00 13.43 H new ATOM 0 HA VAL A 49 1.458 -7.130 -11.496 1.00 31.03 H new ATOM 0 HB VAL A 49 -0.696 -5.060 -10.883 1.00 71.13 H new ATOM 0 HG11 VAL A 49 1.159 -3.574 -10.233 1.00 11.13 H new ATOM 0 HG12 VAL A 49 1.056 -5.010 -9.186 1.00 11.13 H new ATOM 0 HG13 VAL A 49 2.304 -4.919 -10.451 1.00 11.13 H new ATOM 0 HG21 VAL A 49 0.445 -3.688 -12.595 1.00 32.40 H new ATOM 0 HG22 VAL A 49 1.547 -5.043 -12.936 1.00 32.40 H new ATOM 0 HG23 VAL A 49 -0.192 -5.204 -13.275 1.00 32.40 H new ATOM 763 N GLU A 50 1.350 -7.723 -9.063 1.00 72.43 N ATOM 764 CA GLU A 50 1.292 -8.184 -7.674 1.00 4.24 C ATOM 765 C GLU A 50 1.366 -6.988 -6.712 1.00 41.55 C ATOM 766 O GLU A 50 2.446 -6.497 -6.387 1.00 31.14 O ATOM 767 CB GLU A 50 2.427 -9.181 -7.389 1.00 61.33 C ATOM 768 CG GLU A 50 2.438 -10.384 -8.329 1.00 32.21 C ATOM 769 CD GLU A 50 3.494 -11.418 -7.960 1.00 62.02 C ATOM 770 OE1 GLU A 50 4.672 -11.243 -8.337 1.00 3.43 O ATOM 771 OE2 GLU A 50 3.151 -12.414 -7.292 1.00 33.55 O ATOM 0 H GLU A 50 2.288 -7.710 -9.464 1.00 72.43 H new ATOM 0 HA GLU A 50 0.342 -8.695 -7.517 1.00 4.24 H new ATOM 0 HB2 GLU A 50 3.382 -8.662 -7.466 1.00 61.33 H new ATOM 0 HB3 GLU A 50 2.339 -9.535 -6.362 1.00 61.33 H new ATOM 0 HG2 GLU A 50 1.456 -10.856 -8.318 1.00 32.21 H new ATOM 0 HG3 GLU A 50 2.615 -10.040 -9.348 1.00 32.21 H new ATOM 778 N PHE A 51 0.199 -6.532 -6.269 1.00 32.13 N ATOM 779 CA PHE A 51 0.080 -5.344 -5.415 1.00 74.41 C ATOM 780 C PHE A 51 -0.437 -5.740 -4.020 1.00 55.41 C ATOM 781 O PHE A 51 -1.595 -6.119 -3.866 1.00 34.33 O ATOM 782 CB PHE A 51 -0.875 -4.348 -6.097 1.00 60.24 C ATOM 783 CG PHE A 51 -0.977 -2.975 -5.462 1.00 73.23 C ATOM 784 CD1 PHE A 51 -0.221 -2.617 -4.351 1.00 10.42 C ATOM 785 CD2 PHE A 51 -1.847 -2.037 -5.999 1.00 31.11 C ATOM 786 CE1 PHE A 51 -0.336 -1.353 -3.799 1.00 75.44 C ATOM 787 CE2 PHE A 51 -1.962 -0.779 -5.451 1.00 73.25 C ATOM 788 CZ PHE A 51 -1.209 -0.436 -4.352 1.00 31.14 C ATOM 0 H PHE A 51 -0.694 -6.972 -6.489 1.00 32.13 H new ATOM 0 HA PHE A 51 1.056 -4.876 -5.283 1.00 74.41 H new ATOM 0 HB2 PHE A 51 -0.558 -4.224 -7.132 1.00 60.24 H new ATOM 0 HB3 PHE A 51 -1.871 -4.790 -6.120 1.00 60.24 H new ATOM 0 HD1 PHE A 51 0.462 -3.331 -3.915 1.00 10.42 H new ATOM 0 HD2 PHE A 51 -2.444 -2.298 -6.861 1.00 31.11 H new ATOM 0 HE1 PHE A 51 0.256 -1.084 -2.937 1.00 75.44 H new ATOM 0 HE2 PHE A 51 -2.643 -0.062 -5.884 1.00 73.25 H new ATOM 0 HZ PHE A 51 -1.300 0.550 -3.921 1.00 31.14 H new ATOM 798 N ALA A 52 0.431 -5.661 -3.012 1.00 42.11 N ATOM 799 CA ALA A 52 0.078 -6.079 -1.647 1.00 35.21 C ATOM 800 C ALA A 52 0.145 -4.912 -0.649 1.00 43.44 C ATOM 801 O ALA A 52 1.028 -4.057 -0.736 1.00 4.22 O ATOM 802 CB ALA A 52 0.998 -7.211 -1.201 1.00 53.42 C ATOM 0 H ALA A 52 1.384 -5.312 -3.110 1.00 42.11 H new ATOM 0 HA ALA A 52 -0.954 -6.430 -1.663 1.00 35.21 H new ATOM 0 HB1 ALA A 52 0.733 -7.518 -0.189 1.00 53.42 H new ATOM 0 HB2 ALA A 52 0.887 -8.058 -1.878 1.00 53.42 H new ATOM 0 HB3 ALA A 52 2.032 -6.867 -1.217 1.00 53.42 H new ATOM 808 N VAL A 53 -0.787 -4.892 0.308 1.00 11.33 N ATOM 809 CA VAL A 53 -0.848 -3.828 1.321 1.00 21.33 C ATOM 810 C VAL A 53 -0.796 -4.407 2.748 1.00 1.13 C ATOM 811 O VAL A 53 -1.499 -5.366 3.066 1.00 75.14 O ATOM 812 CB VAL A 53 -2.137 -2.978 1.165 1.00 41.41 C ATOM 813 CG1 VAL A 53 -2.169 -1.837 2.185 1.00 15.12 C ATOM 814 CG2 VAL A 53 -2.266 -2.436 -0.258 1.00 45.30 C ATOM 0 H VAL A 53 -1.513 -5.602 0.405 1.00 11.33 H new ATOM 0 HA VAL A 53 0.023 -3.192 1.163 1.00 21.33 H new ATOM 0 HB VAL A 53 -2.990 -3.628 1.358 1.00 41.41 H new ATOM 0 HG11 VAL A 53 -3.083 -1.257 2.054 1.00 15.12 H new ATOM 0 HG12 VAL A 53 -2.143 -2.250 3.194 1.00 15.12 H new ATOM 0 HG13 VAL A 53 -1.304 -1.191 2.035 1.00 15.12 H new ATOM 0 HG21 VAL A 53 -3.177 -1.844 -0.341 1.00 45.30 H new ATOM 0 HG22 VAL A 53 -1.404 -1.810 -0.488 1.00 45.30 H new ATOM 0 HG23 VAL A 53 -2.308 -3.267 -0.962 1.00 45.30 H new ATOM 824 N VAL A 54 0.037 -3.813 3.601 1.00 44.41 N ATOM 825 CA VAL A 54 0.197 -4.263 4.992 1.00 35.14 C ATOM 826 C VAL A 54 -0.013 -3.101 5.979 1.00 64.15 C ATOM 827 O VAL A 54 0.461 -1.990 5.745 1.00 65.41 O ATOM 828 CB VAL A 54 1.610 -4.862 5.229 1.00 13.24 C ATOM 829 CG1 VAL A 54 1.749 -5.390 6.658 1.00 43.31 C ATOM 830 CG2 VAL A 54 1.909 -5.961 4.214 1.00 24.44 C ATOM 0 H VAL A 54 0.618 -3.012 3.355 1.00 44.41 H new ATOM 0 HA VAL A 54 -0.558 -5.030 5.164 1.00 35.14 H new ATOM 0 HB VAL A 54 2.341 -4.065 5.093 1.00 13.24 H new ATOM 0 HG11 VAL A 54 2.748 -5.804 6.797 1.00 43.31 H new ATOM 0 HG12 VAL A 54 1.592 -4.574 7.364 1.00 43.31 H new ATOM 0 HG13 VAL A 54 1.006 -6.168 6.832 1.00 43.31 H new ATOM 0 HG21 VAL A 54 2.904 -6.366 4.399 1.00 24.44 H new ATOM 0 HG22 VAL A 54 1.170 -6.756 4.310 1.00 24.44 H new ATOM 0 HG23 VAL A 54 1.867 -5.547 3.207 1.00 24.44 H new ATOM 840 N THR A 55 -0.722 -3.358 7.079 1.00 40.32 N ATOM 841 CA THR A 55 -0.939 -2.339 8.121 1.00 3.42 C ATOM 842 C THR A 55 -0.374 -2.799 9.472 1.00 73.24 C ATOM 843 O THR A 55 -0.759 -3.849 9.995 1.00 74.33 O ATOM 844 CB THR A 55 -2.444 -2.013 8.312 1.00 50.03 C ATOM 845 OG1 THR A 55 -3.114 -3.105 8.958 1.00 44.44 O ATOM 846 CG2 THR A 55 -3.116 -1.729 6.975 1.00 33.33 C ATOM 0 H THR A 55 -1.157 -4.259 7.276 1.00 40.32 H new ATOM 0 HA THR A 55 -0.418 -1.444 7.782 1.00 3.42 H new ATOM 0 HB THR A 55 -2.514 -1.123 8.937 1.00 50.03 H new ATOM 0 HG1 THR A 55 -4.079 -2.933 8.976 1.00 44.44 H new ATOM 0 HG21 THR A 55 -4.170 -1.504 7.138 1.00 33.33 H new ATOM 0 HG22 THR A 55 -2.632 -0.876 6.498 1.00 33.33 H new ATOM 0 HG23 THR A 55 -3.028 -2.603 6.330 1.00 33.33 H new ATOM 854 N LEU A 56 0.529 -2.006 10.044 1.00 13.11 N ATOM 855 CA LEU A 56 1.134 -2.330 11.343 1.00 72.33 C ATOM 856 C LEU A 56 1.001 -1.161 12.335 1.00 32.42 C ATOM 857 O LEU A 56 1.026 0.008 11.937 1.00 14.32 O ATOM 858 CB LEU A 56 2.618 -2.670 11.173 1.00 24.22 C ATOM 859 CG LEU A 56 2.941 -3.823 10.208 1.00 41.13 C ATOM 860 CD1 LEU A 56 4.444 -3.918 9.980 1.00 55.41 C ATOM 861 CD2 LEU A 56 2.402 -5.148 10.742 1.00 61.24 C ATOM 0 H LEU A 56 0.861 -1.134 9.632 1.00 13.11 H new ATOM 0 HA LEU A 56 0.599 -3.192 11.742 1.00 72.33 H new ATOM 0 HB2 LEU A 56 3.137 -1.777 10.826 1.00 24.22 H new ATOM 0 HB3 LEU A 56 3.028 -2.917 12.152 1.00 24.22 H new ATOM 0 HG LEU A 56 2.453 -3.615 9.256 1.00 41.13 H new ATOM 0 HD11 LEU A 56 4.657 -4.739 9.295 1.00 55.41 H new ATOM 0 HD12 LEU A 56 4.807 -2.984 9.551 1.00 55.41 H new ATOM 0 HD13 LEU A 56 4.945 -4.100 10.931 1.00 55.41 H new ATOM 0 HD21 LEU A 56 2.643 -5.948 10.042 1.00 61.24 H new ATOM 0 HD22 LEU A 56 2.857 -5.363 11.709 1.00 61.24 H new ATOM 0 HD23 LEU A 56 1.320 -5.081 10.857 1.00 61.24 H new ATOM 873 N PRO A 57 0.860 -1.460 13.645 1.00 53.51 N ATOM 874 CA PRO A 57 0.799 -0.422 14.689 1.00 42.23 C ATOM 875 C PRO A 57 2.087 0.411 14.761 1.00 52.23 C ATOM 876 O PRO A 57 2.063 1.631 14.606 1.00 43.11 O ATOM 877 CB PRO A 57 0.602 -1.223 15.991 1.00 75.20 C ATOM 878 CG PRO A 57 0.116 -2.567 15.558 1.00 52.31 C ATOM 879 CD PRO A 57 0.739 -2.816 14.211 1.00 14.01 C ATOM 0 HA PRO A 57 0.004 0.298 14.496 1.00 42.23 H new ATOM 0 HB2 PRO A 57 1.535 -1.303 16.548 1.00 75.20 H new ATOM 0 HB3 PRO A 57 -0.120 -0.736 16.647 1.00 75.20 H new ATOM 0 HG2 PRO A 57 0.408 -3.337 16.272 1.00 52.31 H new ATOM 0 HG3 PRO A 57 -0.972 -2.587 15.495 1.00 52.31 H new ATOM 0 HD2 PRO A 57 1.709 -3.304 14.299 1.00 14.01 H new ATOM 0 HD3 PRO A 57 0.114 -3.458 13.590 1.00 14.01 H new ATOM 887 N SER A 58 3.217 -0.262 14.978 1.00 53.32 N ATOM 888 CA SER A 58 4.512 0.416 15.103 1.00 10.30 C ATOM 889 C SER A 58 5.642 -0.433 14.514 1.00 13.24 C ATOM 890 O SER A 58 5.579 -1.657 14.539 1.00 52.44 O ATOM 891 CB SER A 58 4.822 0.704 16.582 1.00 52.34 C ATOM 892 OG SER A 58 3.783 1.448 17.204 1.00 22.41 O ATOM 0 H SER A 58 3.264 -1.277 15.071 1.00 53.32 H new ATOM 0 HA SER A 58 4.448 1.352 14.548 1.00 10.30 H new ATOM 0 HB2 SER A 58 4.964 -0.237 17.114 1.00 52.34 H new ATOM 0 HB3 SER A 58 5.759 1.256 16.656 1.00 52.34 H new ATOM 0 HG SER A 58 4.079 2.372 17.341 1.00 22.41 H new ATOM 898 N ILE A 59 6.670 0.219 13.976 1.00 72.34 N ATOM 899 CA ILE A 59 7.889 -0.486 13.540 1.00 10.01 C ATOM 900 C ILE A 59 9.072 -0.145 14.463 1.00 60.31 C ATOM 901 O ILE A 59 10.178 -0.668 14.307 1.00 43.43 O ATOM 902 CB ILE A 59 8.255 -0.161 12.067 1.00 53.54 C ATOM 903 CG1 ILE A 59 8.457 1.353 11.873 1.00 22.34 C ATOM 904 CG2 ILE A 59 7.178 -0.694 11.120 1.00 64.24 C ATOM 905 CD1 ILE A 59 8.829 1.748 10.457 1.00 73.34 C ATOM 0 H ILE A 59 6.691 1.228 13.829 1.00 72.34 H new ATOM 0 HA ILE A 59 7.680 -1.554 13.603 1.00 10.01 H new ATOM 0 HB ILE A 59 9.196 -0.656 11.829 1.00 53.54 H new ATOM 0 HG12 ILE A 59 7.540 1.871 12.155 1.00 22.34 H new ATOM 0 HG13 ILE A 59 9.238 1.695 12.552 1.00 22.34 H new ATOM 0 HG21 ILE A 59 7.449 -0.458 10.091 1.00 64.24 H new ATOM 0 HG22 ILE A 59 7.095 -1.775 11.235 1.00 64.24 H new ATOM 0 HG23 ILE A 59 6.221 -0.229 11.359 1.00 64.24 H new ATOM 0 HD11 ILE A 59 8.954 2.829 10.402 1.00 73.34 H new ATOM 0 HD12 ILE A 59 9.763 1.260 10.177 1.00 73.34 H new ATOM 0 HD13 ILE A 59 8.038 1.439 9.773 1.00 73.34 H new ATOM 917 N GLY A 60 8.817 0.742 15.424 1.00 32.14 N ATOM 918 CA GLY A 60 9.809 1.087 16.433 1.00 3.43 C ATOM 919 C GLY A 60 11.108 1.655 15.869 1.00 34.20 C ATOM 920 O GLY A 60 11.127 2.748 15.298 1.00 61.22 O ATOM 0 H GLY A 60 7.929 1.234 15.522 1.00 32.14 H new ATOM 0 HA2 GLY A 60 9.375 1.815 17.118 1.00 3.43 H new ATOM 0 HA3 GLY A 60 10.039 0.197 17.018 1.00 3.43 H new ATOM 924 N ASP A 61 12.191 0.903 16.032 1.00 64.33 N ATOM 925 CA ASP A 61 13.536 1.355 15.661 1.00 32.31 C ATOM 926 C ASP A 61 13.874 1.053 14.188 1.00 0.22 C ATOM 927 O ASP A 61 14.979 1.347 13.727 1.00 72.21 O ATOM 928 CB ASP A 61 14.556 0.683 16.588 1.00 75.43 C ATOM 929 CG ASP A 61 14.251 0.941 18.054 1.00 51.11 C ATOM 930 OD1 ASP A 61 13.242 0.407 18.561 1.00 22.31 O ATOM 931 OD2 ASP A 61 15.004 1.693 18.706 1.00 60.05 O ATOM 0 H ASP A 61 12.166 -0.038 16.425 1.00 64.33 H new ATOM 0 HA ASP A 61 13.573 2.438 15.774 1.00 32.31 H new ATOM 0 HB2 ASP A 61 14.561 -0.391 16.403 1.00 75.43 H new ATOM 0 HB3 ASP A 61 15.555 1.052 16.355 1.00 75.43 H new ATOM 936 N ALA A 62 12.930 0.467 13.457 1.00 11.11 N ATOM 937 CA ALA A 62 13.143 0.126 12.046 1.00 61.14 C ATOM 938 C ALA A 62 12.735 1.281 11.110 1.00 71.53 C ATOM 939 O ALA A 62 11.756 1.983 11.367 1.00 53.40 O ATOM 940 CB ALA A 62 12.369 -1.140 11.695 1.00 30.53 C ATOM 0 H ALA A 62 12.008 0.217 13.815 1.00 11.11 H new ATOM 0 HA ALA A 62 14.209 -0.050 11.901 1.00 61.14 H new ATOM 0 HB1 ALA A 62 12.532 -1.387 10.646 1.00 30.53 H new ATOM 0 HB2 ALA A 62 12.716 -1.963 12.320 1.00 30.53 H new ATOM 0 HB3 ALA A 62 11.305 -0.976 11.868 1.00 30.53 H new ATOM 946 N PRO A 63 13.498 1.511 10.020 1.00 44.44 N ATOM 947 CA PRO A 63 13.141 2.498 8.990 1.00 4.42 C ATOM 948 C PRO A 63 12.065 1.972 8.020 1.00 11.14 C ATOM 949 O PRO A 63 12.069 0.796 7.653 1.00 62.14 O ATOM 950 CB PRO A 63 14.468 2.740 8.236 1.00 2.22 C ATOM 951 CG PRO A 63 15.512 1.952 8.969 1.00 11.21 C ATOM 952 CD PRO A 63 14.782 0.868 9.713 1.00 4.24 C ATOM 0 HA PRO A 63 12.716 3.400 9.429 1.00 4.42 H new ATOM 0 HB2 PRO A 63 14.392 2.415 7.198 1.00 2.22 H new ATOM 0 HB3 PRO A 63 14.720 3.800 8.220 1.00 2.22 H new ATOM 0 HG2 PRO A 63 16.236 1.526 8.274 1.00 11.21 H new ATOM 0 HG3 PRO A 63 16.067 2.589 9.657 1.00 11.21 H new ATOM 0 HD2 PRO A 63 14.654 -0.027 9.105 1.00 4.24 H new ATOM 0 HD3 PRO A 63 15.312 0.566 10.616 1.00 4.24 H new ATOM 960 N LEU A 64 11.158 2.853 7.594 1.00 1.42 N ATOM 961 CA LEU A 64 10.075 2.473 6.675 1.00 45.22 C ATOM 962 C LEU A 64 10.614 1.911 5.344 1.00 23.31 C ATOM 963 O LEU A 64 10.216 0.829 4.907 1.00 60.50 O ATOM 964 CB LEU A 64 9.171 3.688 6.413 1.00 14.42 C ATOM 965 CG LEU A 64 8.009 3.456 5.432 1.00 2.43 C ATOM 966 CD1 LEU A 64 7.092 2.336 5.919 1.00 0.33 C ATOM 967 CD2 LEU A 64 7.223 4.749 5.223 1.00 70.24 C ATOM 0 H LEU A 64 11.149 3.835 7.869 1.00 1.42 H new ATOM 0 HA LEU A 64 9.498 1.679 7.149 1.00 45.22 H new ATOM 0 HB2 LEU A 64 8.758 4.022 7.365 1.00 14.42 H new ATOM 0 HB3 LEU A 64 9.788 4.501 6.031 1.00 14.42 H new ATOM 0 HG LEU A 64 8.429 3.148 4.475 1.00 2.43 H new ATOM 0 HD11 LEU A 64 6.280 2.195 5.206 1.00 0.33 H new ATOM 0 HD12 LEU A 64 7.662 1.411 6.008 1.00 0.33 H new ATOM 0 HD13 LEU A 64 6.678 2.602 6.892 1.00 0.33 H new ATOM 0 HD21 LEU A 64 6.404 4.569 4.526 1.00 70.24 H new ATOM 0 HD22 LEU A 64 6.820 5.088 6.177 1.00 70.24 H new ATOM 0 HD23 LEU A 64 7.884 5.515 4.816 1.00 70.24 H new ATOM 979 N GLU A 65 11.523 2.648 4.711 1.00 35.14 N ATOM 980 CA GLU A 65 12.108 2.235 3.424 1.00 75.04 C ATOM 981 C GLU A 65 12.915 0.929 3.542 1.00 70.14 C ATOM 982 O GLU A 65 12.937 0.113 2.617 1.00 44.35 O ATOM 983 CB GLU A 65 12.988 3.362 2.872 1.00 24.53 C ATOM 984 CG GLU A 65 14.130 3.762 3.799 1.00 4.35 C ATOM 985 CD GLU A 65 14.814 5.043 3.357 1.00 61.13 C ATOM 986 OE1 GLU A 65 14.325 6.134 3.719 1.00 43.32 O ATOM 987 OE2 GLU A 65 15.831 4.971 2.638 1.00 3.41 O ATOM 0 H GLU A 65 11.876 3.538 5.064 1.00 35.14 H new ATOM 0 HA GLU A 65 11.288 2.039 2.733 1.00 75.04 H new ATOM 0 HB2 GLU A 65 13.403 3.050 1.914 1.00 24.53 H new ATOM 0 HB3 GLU A 65 12.365 4.236 2.680 1.00 24.53 H new ATOM 0 HG2 GLU A 65 13.745 3.890 4.811 1.00 4.35 H new ATOM 0 HG3 GLU A 65 14.863 2.956 3.836 1.00 4.35 H new ATOM 994 N ASP A 66 13.583 0.741 4.677 1.00 64.53 N ATOM 995 CA ASP A 66 14.311 -0.499 4.950 1.00 3.02 C ATOM 996 C ASP A 66 13.330 -1.673 5.114 1.00 15.50 C ATOM 997 O ASP A 66 13.549 -2.766 4.592 1.00 64.03 O ATOM 998 CB ASP A 66 15.164 -0.317 6.213 1.00 44.33 C ATOM 999 CG ASP A 66 16.035 -1.520 6.526 1.00 11.32 C ATOM 1000 OD1 ASP A 66 17.096 -1.674 5.886 1.00 50.25 O ATOM 1001 OD2 ASP A 66 15.669 -2.314 7.416 1.00 64.52 O ATOM 0 H ASP A 66 13.636 1.432 5.425 1.00 64.53 H new ATOM 0 HA ASP A 66 14.966 -0.728 4.110 1.00 3.02 H new ATOM 0 HB2 ASP A 66 15.799 0.561 6.091 1.00 44.33 H new ATOM 0 HB3 ASP A 66 14.508 -0.121 7.061 1.00 44.33 H new ATOM 1006 N PHE A 67 12.235 -1.416 5.825 1.00 0.42 N ATOM 1007 CA PHE A 67 11.188 -2.415 6.061 1.00 60.21 C ATOM 1008 C PHE A 67 10.558 -2.909 4.744 1.00 32.25 C ATOM 1009 O PHE A 67 10.492 -4.116 4.485 1.00 40.13 O ATOM 1010 CB PHE A 67 10.099 -1.806 6.962 1.00 20.40 C ATOM 1011 CG PHE A 67 9.013 -2.772 7.372 1.00 71.01 C ATOM 1012 CD1 PHE A 67 8.006 -3.135 6.487 1.00 62.01 C ATOM 1013 CD2 PHE A 67 8.996 -3.316 8.648 1.00 4.43 C ATOM 1014 CE1 PHE A 67 7.017 -4.020 6.862 1.00 10.05 C ATOM 1015 CE2 PHE A 67 8.006 -4.200 9.026 1.00 5.00 C ATOM 1016 CZ PHE A 67 7.017 -4.554 8.132 1.00 64.43 C ATOM 0 H PHE A 67 12.046 -0.511 6.255 1.00 0.42 H new ATOM 0 HA PHE A 67 11.645 -3.275 6.550 1.00 60.21 H new ATOM 0 HB2 PHE A 67 10.570 -1.406 7.860 1.00 20.40 H new ATOM 0 HB3 PHE A 67 9.642 -0.965 6.440 1.00 20.40 H new ATOM 0 HD1 PHE A 67 7.997 -2.718 5.491 1.00 62.01 H new ATOM 0 HD2 PHE A 67 9.767 -3.044 9.354 1.00 4.43 H new ATOM 0 HE1 PHE A 67 6.243 -4.294 6.161 1.00 10.05 H new ATOM 0 HE2 PHE A 67 8.006 -4.615 10.023 1.00 5.00 H new ATOM 0 HZ PHE A 67 6.244 -5.248 8.427 1.00 64.43 H new ATOM 1026 N THR A 68 10.093 -1.962 3.923 1.00 25.13 N ATOM 1027 CA THR A 68 9.351 -2.273 2.686 1.00 22.21 C ATOM 1028 C THR A 68 10.073 -3.289 1.789 1.00 0.00 C ATOM 1029 O THR A 68 9.470 -4.266 1.339 1.00 41.03 O ATOM 1030 CB THR A 68 9.065 -0.989 1.864 1.00 0.12 C ATOM 1031 OG1 THR A 68 10.262 -0.214 1.712 1.00 61.40 O ATOM 1032 CG2 THR A 68 7.989 -0.140 2.533 1.00 13.32 C ATOM 0 H THR A 68 10.216 -0.963 4.091 1.00 25.13 H new ATOM 0 HA THR A 68 8.413 -2.721 3.014 1.00 22.21 H new ATOM 0 HB THR A 68 8.708 -1.296 0.881 1.00 0.12 H new ATOM 0 HG1 THR A 68 10.965 -0.582 2.286 1.00 61.40 H new ATOM 0 HG21 THR A 68 7.808 0.754 1.936 1.00 13.32 H new ATOM 0 HG22 THR A 68 7.067 -0.717 2.612 1.00 13.32 H new ATOM 0 HG23 THR A 68 8.322 0.150 3.530 1.00 13.32 H new ATOM 1040 N LEU A 69 11.359 -3.070 1.539 1.00 35.44 N ATOM 1041 CA LEU A 69 12.129 -3.949 0.649 1.00 43.51 C ATOM 1042 C LEU A 69 12.295 -5.360 1.245 1.00 40.41 C ATOM 1043 O LEU A 69 12.082 -6.364 0.561 1.00 24.24 O ATOM 1044 CB LEU A 69 13.506 -3.336 0.357 1.00 54.32 C ATOM 1045 CG LEU A 69 14.386 -4.133 -0.625 1.00 15.23 C ATOM 1046 CD1 LEU A 69 13.698 -4.273 -1.983 1.00 34.03 C ATOM 1047 CD2 LEU A 69 15.756 -3.476 -0.779 1.00 54.21 C ATOM 0 H LEU A 69 11.894 -2.297 1.935 1.00 35.44 H new ATOM 0 HA LEU A 69 11.571 -4.044 -0.283 1.00 43.51 H new ATOM 0 HB2 LEU A 69 13.361 -2.332 -0.043 1.00 54.32 H new ATOM 0 HB3 LEU A 69 14.045 -3.230 1.298 1.00 54.32 H new ATOM 0 HG LEU A 69 14.531 -5.132 -0.214 1.00 15.23 H new ATOM 0 HD11 LEU A 69 14.339 -4.839 -2.659 1.00 34.03 H new ATOM 0 HD12 LEU A 69 12.750 -4.796 -1.858 1.00 34.03 H new ATOM 0 HD13 LEU A 69 13.514 -3.283 -2.401 1.00 34.03 H new ATOM 0 HD21 LEU A 69 16.361 -4.055 -1.477 1.00 54.21 H new ATOM 0 HD22 LEU A 69 15.633 -2.462 -1.160 1.00 54.21 H new ATOM 0 HD23 LEU A 69 16.254 -3.441 0.190 1.00 54.21 H new ATOM 1059 N LYS A 70 12.663 -5.426 2.522 1.00 61.25 N ATOM 1060 CA LYS A 70 12.928 -6.706 3.194 1.00 53.44 C ATOM 1061 C LYS A 70 11.664 -7.578 3.299 1.00 64.13 C ATOM 1062 O LYS A 70 11.727 -8.802 3.146 1.00 5.15 O ATOM 1063 CB LYS A 70 13.529 -6.439 4.581 1.00 71.34 C ATOM 1064 CG LYS A 70 14.844 -5.666 4.515 1.00 34.52 C ATOM 1065 CD LYS A 70 15.329 -5.219 5.889 1.00 70.43 C ATOM 1066 CE LYS A 70 15.670 -6.394 6.795 1.00 75.21 C ATOM 1067 NZ LYS A 70 16.218 -5.937 8.099 1.00 21.34 N ATOM 0 H LYS A 70 12.786 -4.608 3.118 1.00 61.25 H new ATOM 0 HA LYS A 70 13.643 -7.266 2.591 1.00 53.44 H new ATOM 0 HB2 LYS A 70 12.812 -5.878 5.181 1.00 71.34 H new ATOM 0 HB3 LYS A 70 13.696 -7.389 5.089 1.00 71.34 H new ATOM 0 HG2 LYS A 70 15.606 -6.291 4.050 1.00 34.52 H new ATOM 0 HG3 LYS A 70 14.716 -4.792 3.877 1.00 34.52 H new ATOM 0 HD2 LYS A 70 16.209 -4.586 5.773 1.00 70.43 H new ATOM 0 HD3 LYS A 70 14.559 -4.610 6.363 1.00 70.43 H new ATOM 0 HE2 LYS A 70 14.776 -6.994 6.965 1.00 75.21 H new ATOM 0 HE3 LYS A 70 16.397 -7.038 6.299 1.00 75.21 H new ATOM 0 HZ1 LYS A 70 16.439 -6.763 8.691 1.00 21.34 H new ATOM 0 HZ2 LYS A 70 17.084 -5.385 7.937 1.00 21.34 H new ATOM 0 HZ3 LYS A 70 15.514 -5.343 8.582 1.00 21.34 H new ATOM 1081 N LEU A 71 10.518 -6.949 3.552 1.00 35.10 N ATOM 1082 CA LEU A 71 9.237 -7.667 3.558 1.00 62.12 C ATOM 1083 C LEU A 71 8.860 -8.109 2.134 1.00 54.20 C ATOM 1084 O LEU A 71 8.385 -9.224 1.918 1.00 2.41 O ATOM 1085 CB LEU A 71 8.123 -6.788 4.150 1.00 73.22 C ATOM 1086 CG LEU A 71 6.731 -7.449 4.221 1.00 52.34 C ATOM 1087 CD1 LEU A 71 6.749 -8.671 5.138 1.00 74.01 C ATOM 1088 CD2 LEU A 71 5.676 -6.445 4.681 1.00 11.34 C ATOM 0 H LEU A 71 10.446 -5.952 3.754 1.00 35.10 H new ATOM 0 HA LEU A 71 9.349 -8.553 4.183 1.00 62.12 H new ATOM 0 HB2 LEU A 71 8.416 -6.487 5.156 1.00 73.22 H new ATOM 0 HB3 LEU A 71 8.045 -5.878 3.555 1.00 73.22 H new ATOM 0 HG LEU A 71 6.469 -7.785 3.218 1.00 52.34 H new ATOM 0 HD11 LEU A 71 5.755 -9.117 5.169 1.00 74.01 H new ATOM 0 HD12 LEU A 71 7.463 -9.401 4.757 1.00 74.01 H new ATOM 0 HD13 LEU A 71 7.042 -8.367 6.143 1.00 74.01 H new ATOM 0 HD21 LEU A 71 4.703 -6.934 4.723 1.00 11.34 H new ATOM 0 HD22 LEU A 71 5.937 -6.070 5.671 1.00 11.34 H new ATOM 0 HD23 LEU A 71 5.634 -5.613 3.978 1.00 11.34 H new ATOM 1100 N ALA A 72 9.097 -7.231 1.163 1.00 73.03 N ATOM 1101 CA ALA A 72 8.786 -7.522 -0.240 1.00 40.03 C ATOM 1102 C ALA A 72 9.578 -8.730 -0.775 1.00 42.53 C ATOM 1103 O ALA A 72 9.038 -9.557 -1.515 1.00 1.33 O ATOM 1104 CB ALA A 72 9.048 -6.289 -1.102 1.00 1.52 C ATOM 0 H ALA A 72 9.504 -6.309 1.319 1.00 73.03 H new ATOM 0 HA ALA A 72 7.729 -7.783 -0.293 1.00 40.03 H new ATOM 0 HB1 ALA A 72 8.814 -6.516 -2.142 1.00 1.52 H new ATOM 0 HB2 ALA A 72 8.421 -5.466 -0.760 1.00 1.52 H new ATOM 0 HB3 ALA A 72 10.097 -6.004 -1.020 1.00 1.52 H new ATOM 1110 N ARG A 73 10.858 -8.831 -0.407 1.00 54.51 N ATOM 1111 CA ARG A 73 11.720 -9.922 -0.894 1.00 4.40 C ATOM 1112 C ARG A 73 11.192 -11.307 -0.484 1.00 64.03 C ATOM 1113 O ARG A 73 11.069 -12.204 -1.320 1.00 24.04 O ATOM 1114 CB ARG A 73 13.164 -9.746 -0.400 1.00 74.24 C ATOM 1115 CG ARG A 73 13.862 -8.506 -0.955 1.00 55.24 C ATOM 1116 CD ARG A 73 15.360 -8.518 -0.663 1.00 61.42 C ATOM 1117 NE ARG A 73 16.035 -9.646 -1.308 1.00 23.42 N ATOM 1118 CZ ARG A 73 17.329 -9.747 -1.454 1.00 55.03 C ATOM 1119 NH1 ARG A 73 18.123 -8.834 -0.993 1.00 64.00 N ATOM 1120 NH2 ARG A 73 17.831 -10.769 -2.066 1.00 41.05 N ATOM 0 H ARG A 73 11.322 -8.177 0.223 1.00 54.51 H new ATOM 0 HA ARG A 73 11.706 -9.868 -1.983 1.00 4.40 H new ATOM 0 HB2 ARG A 73 13.161 -9.692 0.689 1.00 74.24 H new ATOM 0 HB3 ARG A 73 13.741 -10.629 -0.674 1.00 74.24 H new ATOM 0 HG2 ARG A 73 13.702 -8.451 -2.032 1.00 55.24 H new ATOM 0 HG3 ARG A 73 13.414 -7.612 -0.520 1.00 55.24 H new ATOM 0 HD2 ARG A 73 15.804 -7.584 -1.008 1.00 61.42 H new ATOM 0 HD3 ARG A 73 15.519 -8.568 0.414 1.00 61.42 H new ATOM 0 HE ARG A 73 15.455 -10.404 -1.668 1.00 23.42 H new ATOM 0 HH11 ARG A 73 17.740 -8.022 -0.508 1.00 64.00 H new ATOM 0 HH12 ARG A 73 19.132 -8.926 -1.115 1.00 64.00 H new ATOM 0 HH21 ARG A 73 17.217 -11.495 -2.434 1.00 41.05 H new ATOM 0 HH22 ARG A 73 18.841 -10.849 -2.181 1.00 41.05 H new ATOM 1134 N GLN A 74 10.872 -11.481 0.795 1.00 35.55 N ATOM 1135 CA GLN A 74 10.353 -12.768 1.287 1.00 2.31 C ATOM 1136 C GLN A 74 8.966 -13.082 0.689 1.00 13.10 C ATOM 1137 O GLN A 74 8.540 -14.239 0.648 1.00 1.53 O ATOM 1138 CB GLN A 74 10.293 -12.769 2.819 1.00 23.11 C ATOM 1139 CG GLN A 74 9.417 -11.671 3.405 1.00 63.51 C ATOM 1140 CD GLN A 74 9.401 -11.676 4.922 1.00 72.23 C ATOM 1141 OE1 GLN A 74 8.578 -12.334 5.548 1.00 60.44 O ATOM 1142 NE2 GLN A 74 10.309 -10.944 5.526 1.00 54.14 N ATOM 0 H GLN A 74 10.959 -10.758 1.510 1.00 35.55 H new ATOM 0 HA GLN A 74 11.038 -13.551 0.963 1.00 2.31 H new ATOM 0 HB2 GLN A 74 9.921 -13.736 3.157 1.00 23.11 H new ATOM 0 HB3 GLN A 74 11.304 -12.662 3.212 1.00 23.11 H new ATOM 0 HG2 GLN A 74 9.773 -10.703 3.054 1.00 63.51 H new ATOM 0 HG3 GLN A 74 8.398 -11.790 3.035 1.00 63.51 H new ATOM 0 HE21 GLN A 74 10.980 -10.408 4.976 1.00 54.14 H new ATOM 0 HE22 GLN A 74 10.343 -10.912 6.545 1.00 54.14 H new ATOM 1151 N TRP A 75 8.273 -12.044 0.219 1.00 44.03 N ATOM 1152 CA TRP A 75 6.980 -12.208 -0.464 1.00 30.04 C ATOM 1153 C TRP A 75 7.165 -12.385 -1.983 1.00 74.41 C ATOM 1154 O TRP A 75 6.193 -12.394 -2.742 1.00 54.44 O ATOM 1155 CB TRP A 75 6.074 -10.999 -0.183 1.00 3.32 C ATOM 1156 CG TRP A 75 5.586 -10.918 1.239 1.00 24.50 C ATOM 1157 CD1 TRP A 75 6.175 -11.458 2.346 1.00 51.41 C ATOM 1158 CD2 TRP A 75 4.408 -10.248 1.702 1.00 33.45 C ATOM 1159 NE1 TRP A 75 5.437 -11.170 3.465 1.00 22.12 N ATOM 1160 CE2 TRP A 75 4.347 -10.428 3.097 1.00 25.14 C ATOM 1161 CE3 TRP A 75 3.398 -9.515 1.075 1.00 73.44 C ATOM 1162 CZ2 TRP A 75 3.320 -9.902 3.872 1.00 31.25 C ATOM 1163 CZ3 TRP A 75 2.378 -8.993 1.846 1.00 60.41 C ATOM 1164 CH2 TRP A 75 2.346 -9.189 3.232 1.00 73.24 C ATOM 0 H TRP A 75 8.583 -11.075 0.297 1.00 44.03 H new ATOM 0 HA TRP A 75 6.509 -13.110 -0.074 1.00 30.04 H new ATOM 0 HB2 TRP A 75 6.619 -10.086 -0.422 1.00 3.32 H new ATOM 0 HB3 TRP A 75 5.213 -11.040 -0.850 1.00 3.32 H new ATOM 0 HD1 TRP A 75 7.091 -12.030 2.341 1.00 51.41 H new ATOM 0 HE1 TRP A 75 5.663 -11.461 4.416 1.00 22.12 H new ATOM 0 HE3 TRP A 75 3.414 -9.359 0.006 1.00 73.44 H new ATOM 0 HZ2 TRP A 75 3.293 -10.051 4.941 1.00 31.25 H new ATOM 0 HZ3 TRP A 75 1.592 -8.424 1.372 1.00 60.41 H new ATOM 0 HH2 TRP A 75 1.535 -8.768 3.807 1.00 73.24 H new ATOM 1175 N GLY A 76 8.417 -12.516 -2.421 1.00 0.52 N ATOM 1176 CA GLY A 76 8.707 -12.737 -3.835 1.00 4.51 C ATOM 1177 C GLY A 76 8.811 -11.445 -4.645 1.00 71.13 C ATOM 1178 O GLY A 76 9.793 -11.226 -5.357 1.00 34.23 O ATOM 0 H GLY A 76 9.241 -12.473 -1.821 1.00 0.52 H new ATOM 0 HA2 GLY A 76 9.643 -13.289 -3.924 1.00 4.51 H new ATOM 0 HA3 GLY A 76 7.925 -13.364 -4.264 1.00 4.51 H new ATOM 1182 N VAL A 77 7.807 -10.578 -4.518 1.00 55.03 N ATOM 1183 CA VAL A 77 7.728 -9.332 -5.292 1.00 65.10 C ATOM 1184 C VAL A 77 8.987 -8.447 -5.159 1.00 21.11 C ATOM 1185 O VAL A 77 9.307 -7.667 -6.057 1.00 71.00 O ATOM 1186 CB VAL A 77 6.483 -8.512 -4.874 1.00 51.12 C ATOM 1187 CG1 VAL A 77 5.206 -9.302 -5.143 1.00 33.35 C ATOM 1188 CG2 VAL A 77 6.565 -8.094 -3.406 1.00 13.21 C ATOM 0 H VAL A 77 7.025 -10.716 -3.878 1.00 55.03 H new ATOM 0 HA VAL A 77 7.651 -9.633 -6.337 1.00 65.10 H new ATOM 0 HB VAL A 77 6.459 -7.604 -5.477 1.00 51.12 H new ATOM 0 HG11 VAL A 77 4.342 -8.710 -4.843 1.00 33.35 H new ATOM 0 HG12 VAL A 77 5.137 -9.531 -6.206 1.00 33.35 H new ATOM 0 HG13 VAL A 77 5.225 -10.230 -4.572 1.00 33.35 H new ATOM 0 HG21 VAL A 77 5.677 -7.520 -3.141 1.00 13.21 H new ATOM 0 HG22 VAL A 77 6.623 -8.983 -2.777 1.00 13.21 H new ATOM 0 HG23 VAL A 77 7.453 -7.481 -3.251 1.00 13.21 H new ATOM 1256 N ASN A 82 11.107 -7.777 -8.504 1.00 70.44 N ATOM 1257 CA ASN A 82 10.330 -8.628 -9.417 1.00 31.25 C ATOM 1258 C ASN A 82 9.441 -7.758 -10.323 1.00 53.35 C ATOM 1259 O ASN A 82 8.838 -6.799 -9.852 1.00 53.43 O ATOM 1260 CB ASN A 82 9.482 -9.618 -8.603 1.00 31.05 C ATOM 1261 CG ASN A 82 8.610 -10.511 -9.465 1.00 5.21 C ATOM 1262 OD1 ASN A 82 8.931 -10.796 -10.613 1.00 41.11 O ATOM 1263 ND2 ASN A 82 7.501 -10.966 -8.918 1.00 54.14 N ATOM 0 HA ASN A 82 11.010 -9.194 -10.053 1.00 31.25 H new ATOM 0 HB2 ASN A 82 10.142 -10.240 -7.999 1.00 31.05 H new ATOM 0 HB3 ASN A 82 8.849 -9.061 -7.912 1.00 31.05 H new ATOM 0 HD21 ASN A 82 6.881 -11.574 -9.453 1.00 54.14 H new ATOM 0 HD22 ASN A 82 7.263 -10.710 -7.960 1.00 54.14 H new ATOM 1270 N ASN A 83 9.352 -8.112 -11.613 1.00 62.20 N ATOM 1271 CA ASN A 83 8.712 -7.250 -12.628 1.00 75.11 C ATOM 1272 C ASN A 83 7.437 -6.527 -12.120 1.00 52.12 C ATOM 1273 O ASN A 83 7.445 -5.307 -11.957 1.00 1.14 O ATOM 1274 CB ASN A 83 8.416 -8.035 -13.924 1.00 42.43 C ATOM 1275 CG ASN A 83 7.378 -9.137 -13.770 1.00 23.32 C ATOM 1276 OD1 ASN A 83 6.614 -9.415 -14.688 1.00 12.35 O ATOM 1277 ND2 ASN A 83 7.340 -9.777 -12.622 1.00 61.30 N ATOM 0 H ASN A 83 9.715 -8.991 -11.983 1.00 62.20 H new ATOM 0 HA ASN A 83 9.438 -6.467 -12.847 1.00 75.11 H new ATOM 0 HB2 ASN A 83 8.075 -7.336 -14.688 1.00 42.43 H new ATOM 0 HB3 ASN A 83 9.344 -8.476 -14.287 1.00 42.43 H new ATOM 0 HD21 ASN A 83 6.663 -10.526 -12.478 1.00 61.30 H new ATOM 0 HD22 ASN A 83 7.988 -9.525 -11.876 1.00 61.30 H new ATOM 1284 N ASN A 84 6.368 -7.262 -11.834 1.00 42.12 N ATOM 1285 CA ASN A 84 5.096 -6.640 -11.443 1.00 44.22 C ATOM 1286 C ASN A 84 4.929 -6.600 -9.918 1.00 65.34 C ATOM 1287 O ASN A 84 3.808 -6.553 -9.410 1.00 15.31 O ATOM 1288 CB ASN A 84 3.922 -7.395 -12.072 1.00 4.45 C ATOM 1289 CG ASN A 84 3.960 -7.372 -13.586 1.00 24.04 C ATOM 1290 OD1 ASN A 84 4.493 -6.454 -14.199 1.00 1.41 O ATOM 1291 ND2 ASN A 84 3.377 -8.374 -14.200 1.00 71.34 N ATOM 0 H ASN A 84 6.350 -8.281 -11.863 1.00 42.12 H new ATOM 0 HA ASN A 84 5.107 -5.613 -11.808 1.00 44.22 H new ATOM 0 HB2 ASN A 84 3.933 -8.429 -11.727 1.00 4.45 H new ATOM 0 HB3 ASN A 84 2.986 -6.955 -11.729 1.00 4.45 H new ATOM 0 HD21 ASN A 84 3.358 -8.406 -15.219 1.00 71.34 H new ATOM 0 HD22 ASN A 84 2.943 -9.121 -13.658 1.00 71.34 H new ATOM 1298 N GLY A 85 6.044 -6.598 -9.198 1.00 11.55 N ATOM 1299 CA GLY A 85 5.997 -6.545 -7.745 1.00 51.02 C ATOM 1300 C GLY A 85 5.750 -5.139 -7.203 1.00 42.42 C ATOM 1301 O GLY A 85 6.448 -4.192 -7.572 1.00 24.32 O ATOM 0 H GLY A 85 6.984 -6.632 -9.594 1.00 11.55 H new ATOM 0 HA2 GLY A 85 5.209 -7.209 -7.389 1.00 51.02 H new ATOM 0 HA3 GLY A 85 6.937 -6.922 -7.343 1.00 51.02 H new ATOM 1305 N LEU A 86 4.747 -5.002 -6.338 1.00 54.42 N ATOM 1306 CA LEU A 86 4.436 -3.720 -5.698 1.00 60.52 C ATOM 1307 C LEU A 86 3.937 -3.928 -4.258 1.00 13.33 C ATOM 1308 O LEU A 86 2.919 -4.581 -4.026 1.00 2.53 O ATOM 1309 CB LEU A 86 3.387 -2.958 -6.523 1.00 71.11 C ATOM 1310 CG LEU A 86 2.952 -1.591 -5.957 1.00 54.40 C ATOM 1311 CD1 LEU A 86 4.151 -0.660 -5.782 1.00 34.02 C ATOM 1312 CD2 LEU A 86 1.900 -0.947 -6.861 1.00 70.02 C ATOM 0 H LEU A 86 4.131 -5.766 -6.061 1.00 54.42 H new ATOM 0 HA LEU A 86 5.351 -3.129 -5.655 1.00 60.52 H new ATOM 0 HB2 LEU A 86 3.783 -2.805 -7.527 1.00 71.11 H new ATOM 0 HB3 LEU A 86 2.503 -3.587 -6.622 1.00 71.11 H new ATOM 0 HG LEU A 86 2.511 -1.759 -4.974 1.00 54.40 H new ATOM 0 HD11 LEU A 86 3.814 0.296 -5.382 1.00 34.02 H new ATOM 0 HD12 LEU A 86 4.864 -1.111 -5.092 1.00 34.02 H new ATOM 0 HD13 LEU A 86 4.631 -0.500 -6.747 1.00 34.02 H new ATOM 0 HD21 LEU A 86 1.605 0.017 -6.446 1.00 70.02 H new ATOM 0 HD22 LEU A 86 2.317 -0.801 -7.857 1.00 70.02 H new ATOM 0 HD23 LEU A 86 1.028 -1.597 -6.925 1.00 70.02 H new ATOM 1324 N LEU A 87 4.659 -3.370 -3.290 1.00 11.14 N ATOM 1325 CA LEU A 87 4.278 -3.488 -1.876 1.00 31.14 C ATOM 1326 C LEU A 87 3.968 -2.116 -1.256 1.00 14.44 C ATOM 1327 O LEU A 87 4.628 -1.122 -1.559 1.00 15.55 O ATOM 1328 CB LEU A 87 5.396 -4.177 -1.078 1.00 12.22 C ATOM 1329 CG LEU A 87 5.090 -4.423 0.413 1.00 61.41 C ATOM 1330 CD1 LEU A 87 3.923 -5.396 0.583 1.00 42.20 C ATOM 1331 CD2 LEU A 87 6.328 -4.935 1.142 1.00 12.42 C ATOM 0 H LEU A 87 5.510 -2.832 -3.453 1.00 11.14 H new ATOM 0 HA LEU A 87 3.372 -4.093 -1.830 1.00 31.14 H new ATOM 0 HB2 LEU A 87 5.618 -5.135 -1.549 1.00 12.22 H new ATOM 0 HB3 LEU A 87 6.298 -3.570 -1.151 1.00 12.22 H new ATOM 0 HG LEU A 87 4.801 -3.470 0.856 1.00 61.41 H new ATOM 0 HD11 LEU A 87 3.730 -5.551 1.645 1.00 42.20 H new ATOM 0 HD12 LEU A 87 3.033 -4.983 0.109 1.00 42.20 H new ATOM 0 HD13 LEU A 87 4.173 -6.349 0.117 1.00 42.20 H new ATOM 0 HD21 LEU A 87 6.089 -5.102 2.192 1.00 12.42 H new ATOM 0 HD22 LEU A 87 6.654 -5.872 0.691 1.00 12.42 H new ATOM 0 HD23 LEU A 87 7.127 -4.198 1.064 1.00 12.42 H new ATOM 1343 N LEU A 88 2.956 -2.081 -0.389 1.00 11.12 N ATOM 1344 CA LEU A 88 2.576 -0.865 0.342 1.00 21.24 C ATOM 1345 C LEU A 88 2.475 -1.145 1.849 1.00 22.31 C ATOM 1346 O LEU A 88 1.667 -1.965 2.281 1.00 15.22 O ATOM 1347 CB LEU A 88 1.232 -0.338 -0.183 1.00 51.45 C ATOM 1348 CG LEU A 88 0.629 0.846 0.598 1.00 65.23 C ATOM 1349 CD1 LEU A 88 1.550 2.065 0.549 1.00 21.42 C ATOM 1350 CD2 LEU A 88 -0.762 1.188 0.062 1.00 42.44 C ATOM 0 H LEU A 88 2.376 -2.891 -0.172 1.00 11.12 H new ATOM 0 HA LEU A 88 3.347 -0.111 0.182 1.00 21.24 H new ATOM 0 HB2 LEU A 88 1.362 -0.036 -1.222 1.00 51.45 H new ATOM 0 HB3 LEU A 88 0.513 -1.158 -0.177 1.00 51.45 H new ATOM 0 HG LEU A 88 0.530 0.549 1.642 1.00 65.23 H new ATOM 0 HD11 LEU A 88 1.099 2.885 1.108 1.00 21.42 H new ATOM 0 HD12 LEU A 88 2.513 1.811 0.991 1.00 21.42 H new ATOM 0 HD13 LEU A 88 1.695 2.370 -0.487 1.00 21.42 H new ATOM 0 HD21 LEU A 88 -1.173 2.026 0.625 1.00 42.44 H new ATOM 0 HD22 LEU A 88 -0.690 1.459 -0.991 1.00 42.44 H new ATOM 0 HD23 LEU A 88 -1.416 0.323 0.170 1.00 42.44 H new ATOM 1362 N VAL A 89 3.297 -0.465 2.648 1.00 60.24 N ATOM 1363 CA VAL A 89 3.291 -0.660 4.107 1.00 14.11 C ATOM 1364 C VAL A 89 2.810 0.597 4.854 1.00 4.34 C ATOM 1365 O VAL A 89 3.297 1.701 4.611 1.00 52.42 O ATOM 1366 CB VAL A 89 4.698 -1.054 4.629 1.00 31.00 C ATOM 1367 CG1 VAL A 89 4.680 -1.266 6.144 1.00 12.14 C ATOM 1368 CG2 VAL A 89 5.208 -2.306 3.912 1.00 24.30 C ATOM 0 H VAL A 89 3.974 0.223 2.317 1.00 60.24 H new ATOM 0 HA VAL A 89 2.592 -1.472 4.305 1.00 14.11 H new ATOM 0 HB VAL A 89 5.382 -0.233 4.413 1.00 31.00 H new ATOM 0 HG11 VAL A 89 5.678 -1.541 6.485 1.00 12.14 H new ATOM 0 HG12 VAL A 89 4.370 -0.345 6.637 1.00 12.14 H new ATOM 0 HG13 VAL A 89 3.979 -2.063 6.391 1.00 12.14 H new ATOM 0 HG21 VAL A 89 6.196 -2.566 4.292 1.00 24.30 H new ATOM 0 HG22 VAL A 89 4.521 -3.133 4.091 1.00 24.30 H new ATOM 0 HG23 VAL A 89 5.271 -2.112 2.841 1.00 24.30 H new ATOM 1378 N LEU A 90 1.847 0.411 5.759 1.00 43.32 N ATOM 1379 CA LEU A 90 1.335 1.490 6.615 1.00 13.14 C ATOM 1380 C LEU A 90 1.915 1.390 8.034 1.00 72.41 C ATOM 1381 O LEU A 90 1.777 0.361 8.699 1.00 73.23 O ATOM 1382 CB LEU A 90 -0.199 1.418 6.704 1.00 24.33 C ATOM 1383 CG LEU A 90 -0.840 2.368 7.741 1.00 24.40 C ATOM 1384 CD1 LEU A 90 -0.970 3.787 7.199 1.00 31.34 C ATOM 1385 CD2 LEU A 90 -2.190 1.837 8.216 1.00 32.10 C ATOM 0 H LEU A 90 1.398 -0.491 5.921 1.00 43.32 H new ATOM 0 HA LEU A 90 1.639 2.437 6.169 1.00 13.14 H new ATOM 0 HB2 LEU A 90 -0.616 1.643 5.722 1.00 24.33 H new ATOM 0 HB3 LEU A 90 -0.486 0.395 6.945 1.00 24.33 H new ATOM 0 HG LEU A 90 -0.172 2.406 8.602 1.00 24.40 H new ATOM 0 HD11 LEU A 90 -1.425 4.426 7.956 1.00 31.34 H new ATOM 0 HD12 LEU A 90 0.018 4.172 6.946 1.00 31.34 H new ATOM 0 HD13 LEU A 90 -1.596 3.780 6.307 1.00 31.34 H new ATOM 0 HD21 LEU A 90 -2.616 2.527 8.945 1.00 32.10 H new ATOM 0 HD22 LEU A 90 -2.865 1.746 7.365 1.00 32.10 H new ATOM 0 HD23 LEU A 90 -2.054 0.859 8.678 1.00 32.10 H new ATOM 1397 N VAL A 91 2.551 2.463 8.498 1.00 70.13 N ATOM 1398 CA VAL A 91 3.059 2.525 9.873 1.00 14.33 C ATOM 1399 C VAL A 91 2.277 3.551 10.706 1.00 31.41 C ATOM 1400 O VAL A 91 2.547 4.753 10.647 1.00 71.43 O ATOM 1401 CB VAL A 91 4.567 2.877 9.909 1.00 21.24 C ATOM 1402 CG1 VAL A 91 5.084 2.928 11.349 1.00 20.50 C ATOM 1403 CG2 VAL A 91 5.366 1.876 9.079 1.00 22.14 C ATOM 0 H VAL A 91 2.728 3.302 7.946 1.00 70.13 H new ATOM 0 HA VAL A 91 2.922 1.534 10.305 1.00 14.33 H new ATOM 0 HB VAL A 91 4.698 3.868 9.474 1.00 21.24 H new ATOM 0 HG11 VAL A 91 6.145 3.177 11.346 1.00 20.50 H new ATOM 0 HG12 VAL A 91 4.535 3.687 11.906 1.00 20.50 H new ATOM 0 HG13 VAL A 91 4.941 1.956 11.822 1.00 20.50 H new ATOM 0 HG21 VAL A 91 6.424 2.137 9.114 1.00 22.14 H new ATOM 0 HG22 VAL A 91 5.226 0.874 9.484 1.00 22.14 H new ATOM 0 HG23 VAL A 91 5.020 1.902 8.046 1.00 22.14 H new ATOM 1413 N LEU A 92 1.312 3.060 11.482 1.00 30.55 N ATOM 1414 CA LEU A 92 0.470 3.910 12.339 1.00 63.12 C ATOM 1415 C LEU A 92 1.319 4.789 13.278 1.00 41.41 C ATOM 1416 O LEU A 92 1.022 5.966 13.486 1.00 1.44 O ATOM 1417 CB LEU A 92 -0.481 3.022 13.155 1.00 44.03 C ATOM 1418 CG LEU A 92 -1.415 3.748 14.141 1.00 64.34 C ATOM 1419 CD1 LEU A 92 -2.366 4.684 13.405 1.00 53.13 C ATOM 1420 CD2 LEU A 92 -2.194 2.740 14.985 1.00 50.22 C ATOM 0 H LEU A 92 1.088 2.066 11.538 1.00 30.55 H new ATOM 0 HA LEU A 92 -0.106 4.580 11.700 1.00 63.12 H new ATOM 0 HB2 LEU A 92 -1.095 2.450 12.460 1.00 44.03 H new ATOM 0 HB3 LEU A 92 0.118 2.305 13.716 1.00 44.03 H new ATOM 0 HG LEU A 92 -0.799 4.352 14.808 1.00 64.34 H new ATOM 0 HD11 LEU A 92 -3.014 5.184 14.125 1.00 53.13 H new ATOM 0 HD12 LEU A 92 -1.791 5.429 12.856 1.00 53.13 H new ATOM 0 HD13 LEU A 92 -2.974 4.109 12.707 1.00 53.13 H new ATOM 0 HD21 LEU A 92 -2.848 3.272 15.675 1.00 50.22 H new ATOM 0 HD22 LEU A 92 -2.794 2.106 14.332 1.00 50.22 H new ATOM 0 HD23 LEU A 92 -1.496 2.122 15.550 1.00 50.22 H new ATOM 1432 N ASP A 93 2.383 4.201 13.819 1.00 31.35 N ATOM 1433 CA ASP A 93 3.313 4.896 14.720 1.00 23.33 C ATOM 1434 C ASP A 93 3.826 6.224 14.126 1.00 34.24 C ATOM 1435 O ASP A 93 4.002 7.210 14.842 1.00 4.42 O ATOM 1436 CB ASP A 93 4.497 3.969 15.013 1.00 22.50 C ATOM 1437 CG ASP A 93 5.392 4.474 16.130 1.00 13.45 C ATOM 1438 OD1 ASP A 93 6.281 5.299 15.859 1.00 33.42 O ATOM 1439 OD2 ASP A 93 5.211 4.032 17.286 1.00 41.05 O ATOM 0 H ASP A 93 2.630 3.226 13.647 1.00 31.35 H new ATOM 0 HA ASP A 93 2.776 5.143 15.636 1.00 23.33 H new ATOM 0 HB2 ASP A 93 4.120 2.981 15.278 1.00 22.50 H new ATOM 0 HB3 ASP A 93 5.090 3.851 14.106 1.00 22.50 H new ATOM 1444 N GLN A 94 4.063 6.239 12.816 1.00 64.22 N ATOM 1445 CA GLN A 94 4.609 7.423 12.136 1.00 12.44 C ATOM 1446 C GLN A 94 3.594 8.058 11.169 1.00 25.14 C ATOM 1447 O GLN A 94 3.854 9.120 10.605 1.00 31.15 O ATOM 1448 CB GLN A 94 5.874 7.039 11.355 1.00 22.12 C ATOM 1449 CG GLN A 94 7.024 6.545 12.224 1.00 70.01 C ATOM 1450 CD GLN A 94 8.242 6.145 11.404 1.00 73.01 C ATOM 1451 OE1 GLN A 94 9.107 6.962 11.109 1.00 12.12 O ATOM 1452 NE2 GLN A 94 8.319 4.885 11.025 1.00 52.20 N ATOM 0 H GLN A 94 3.887 5.446 12.199 1.00 64.22 H new ATOM 0 HA GLN A 94 4.845 8.157 12.906 1.00 12.44 H new ATOM 0 HB2 GLN A 94 5.619 6.262 10.634 1.00 22.12 H new ATOM 0 HB3 GLN A 94 6.211 7.905 10.785 1.00 22.12 H new ATOM 0 HG2 GLN A 94 7.305 7.328 12.929 1.00 70.01 H new ATOM 0 HG3 GLN A 94 6.690 5.691 12.813 1.00 70.01 H new ATOM 0 HE21 GLN A 94 7.584 4.228 11.286 1.00 52.20 H new ATOM 0 HE22 GLN A 94 9.114 4.567 10.471 1.00 52.20 H new ATOM 1461 N ARG A 95 2.449 7.398 10.976 1.00 43.53 N ATOM 1462 CA ARG A 95 1.446 7.824 9.982 1.00 13.43 C ATOM 1463 C ARG A 95 2.045 7.892 8.564 1.00 53.24 C ATOM 1464 O ARG A 95 1.540 8.601 7.693 1.00 53.34 O ATOM 1465 CB ARG A 95 0.840 9.183 10.363 1.00 52.10 C ATOM 1466 CG ARG A 95 -0.003 9.150 11.635 1.00 62.11 C ATOM 1467 CD ARG A 95 -0.668 10.496 11.894 1.00 20.11 C ATOM 1468 NE ARG A 95 -1.584 10.457 13.029 1.00 41.33 N ATOM 1469 CZ ARG A 95 -2.188 11.505 13.518 1.00 64.24 C ATOM 1470 NH1 ARG A 95 -2.001 12.680 12.999 1.00 43.43 N ATOM 1471 NH2 ARG A 95 -2.981 11.375 14.528 1.00 64.54 N ATOM 0 H ARG A 95 2.188 6.560 11.496 1.00 43.53 H new ATOM 0 HA ARG A 95 0.655 7.074 9.980 1.00 13.43 H new ATOM 0 HB2 ARG A 95 1.646 9.906 10.492 1.00 52.10 H new ATOM 0 HB3 ARG A 95 0.222 9.538 9.538 1.00 52.10 H new ATOM 0 HG2 ARG A 95 -0.766 8.376 11.548 1.00 62.11 H new ATOM 0 HG3 ARG A 95 0.626 8.884 12.484 1.00 62.11 H new ATOM 0 HD2 ARG A 95 0.100 11.248 12.076 1.00 20.11 H new ATOM 0 HD3 ARG A 95 -1.212 10.806 11.002 1.00 20.11 H new ATOM 0 HE ARG A 95 -1.763 9.554 13.468 1.00 41.33 H new ATOM 0 HH11 ARG A 95 -1.376 12.791 12.200 1.00 43.43 H new ATOM 0 HH12 ARG A 95 -2.479 13.492 13.390 1.00 43.43 H new ATOM 0 HH21 ARG A 95 -3.134 10.455 14.941 1.00 64.54 H new ATOM 0 HH22 ARG A 95 -3.455 12.192 14.913 1.00 64.54 H new ATOM 1485 N ARG A 96 3.113 7.130 8.339 1.00 64.01 N ATOM 1486 CA ARG A 96 3.794 7.104 7.040 1.00 14.11 C ATOM 1487 C ARG A 96 3.517 5.804 6.281 1.00 62.44 C ATOM 1488 O ARG A 96 3.357 4.740 6.880 1.00 64.41 O ATOM 1489 CB ARG A 96 5.310 7.269 7.217 1.00 41.04 C ATOM 1490 CG ARG A 96 5.739 8.661 7.658 1.00 34.11 C ATOM 1491 CD ARG A 96 7.246 8.742 7.893 1.00 70.04 C ATOM 1492 NE ARG A 96 7.669 10.076 8.312 1.00 42.43 N ATOM 1493 CZ ARG A 96 8.903 10.411 8.581 1.00 71.33 C ATOM 1494 NH1 ARG A 96 9.871 9.557 8.456 1.00 55.35 N ATOM 1495 NH2 ARG A 96 9.169 11.615 8.963 1.00 62.51 N ATOM 0 H ARG A 96 3.530 6.518 9.041 1.00 64.01 H new ATOM 0 HA ARG A 96 3.400 7.938 6.459 1.00 14.11 H new ATOM 0 HB2 ARG A 96 5.660 6.544 7.952 1.00 41.04 H new ATOM 0 HB3 ARG A 96 5.803 7.031 6.274 1.00 41.04 H new ATOM 0 HG2 ARG A 96 5.450 9.388 6.899 1.00 34.11 H new ATOM 0 HG3 ARG A 96 5.213 8.930 8.574 1.00 34.11 H new ATOM 0 HD2 ARG A 96 7.533 8.016 8.654 1.00 70.04 H new ATOM 0 HD3 ARG A 96 7.770 8.468 6.977 1.00 70.04 H new ATOM 0 HE ARG A 96 6.952 10.796 8.401 1.00 42.43 H new ATOM 0 HH11 ARG A 96 9.675 8.606 8.143 1.00 55.35 H new ATOM 0 HH12 ARG A 96 10.828 9.836 8.670 1.00 55.35 H new ATOM 0 HH21 ARG A 96 8.418 12.299 9.053 1.00 62.51 H new ATOM 0 HH22 ARG A 96 10.130 11.882 9.174 1.00 62.51 H new ATOM 1509 N VAL A 97 3.473 5.908 4.958 1.00 22.51 N ATOM 1510 CA VAL A 97 3.325 4.740 4.079 1.00 24.31 C ATOM 1511 C VAL A 97 4.333 4.810 2.925 1.00 31.42 C ATOM 1512 O VAL A 97 4.820 5.890 2.585 1.00 54.40 O ATOM 1513 CB VAL A 97 1.892 4.620 3.494 1.00 5.32 C ATOM 1514 CG1 VAL A 97 0.850 4.627 4.600 1.00 0.21 C ATOM 1515 CG2 VAL A 97 1.611 5.725 2.478 1.00 14.13 C ATOM 0 H VAL A 97 3.538 6.796 4.461 1.00 22.51 H new ATOM 0 HA VAL A 97 3.516 3.859 4.692 1.00 24.31 H new ATOM 0 HB VAL A 97 1.829 3.665 2.973 1.00 5.32 H new ATOM 0 HG11 VAL A 97 -0.145 4.542 4.163 1.00 0.21 H new ATOM 0 HG12 VAL A 97 1.025 3.786 5.270 1.00 0.21 H new ATOM 0 HG13 VAL A 97 0.921 5.559 5.161 1.00 0.21 H new ATOM 0 HG21 VAL A 97 0.600 5.612 2.088 1.00 14.13 H new ATOM 0 HG22 VAL A 97 1.707 6.697 2.962 1.00 14.13 H new ATOM 0 HG23 VAL A 97 2.326 5.656 1.658 1.00 14.13 H new ATOM 1525 N ARG A 98 4.653 3.669 2.325 1.00 4.40 N ATOM 1526 CA ARG A 98 5.612 3.638 1.213 1.00 53.32 C ATOM 1527 C ARG A 98 5.294 2.523 0.208 1.00 65.34 C ATOM 1528 O ARG A 98 4.958 1.402 0.592 1.00 50.44 O ATOM 1529 CB ARG A 98 7.039 3.447 1.746 1.00 23.34 C ATOM 1530 CG ARG A 98 8.109 3.481 0.658 1.00 63.44 C ATOM 1531 CD ARG A 98 9.493 3.147 1.205 1.00 32.44 C ATOM 1532 NE ARG A 98 10.520 3.214 0.166 1.00 10.14 N ATOM 1533 CZ ARG A 98 10.863 2.217 -0.605 1.00 31.44 C ATOM 1534 NH1 ARG A 98 10.314 1.059 -0.475 1.00 73.51 N ATOM 1535 NH2 ARG A 98 11.773 2.381 -1.505 1.00 75.40 N ATOM 0 H ARG A 98 4.270 2.759 2.582 1.00 4.40 H new ATOM 0 HA ARG A 98 5.532 4.594 0.695 1.00 53.32 H new ATOM 0 HB2 ARG A 98 7.252 4.227 2.477 1.00 23.34 H new ATOM 0 HB3 ARG A 98 7.097 2.493 2.271 1.00 23.34 H new ATOM 0 HG2 ARG A 98 7.849 2.772 -0.128 1.00 63.44 H new ATOM 0 HG3 ARG A 98 8.129 4.470 0.201 1.00 63.44 H new ATOM 0 HD2 ARG A 98 9.743 3.840 2.008 1.00 32.44 H new ATOM 0 HD3 ARG A 98 9.480 2.147 1.639 1.00 32.44 H new ATOM 0 HE ARG A 98 11.003 4.103 0.034 1.00 10.14 H new ATOM 0 HH11 ARG A 98 9.600 0.910 0.238 1.00 73.51 H new ATOM 0 HH12 ARG A 98 10.593 0.291 -1.085 1.00 73.51 H new ATOM 0 HH21 ARG A 98 12.224 3.289 -1.614 1.00 75.40 H new ATOM 0 HH22 ARG A 98 12.041 1.603 -2.107 1.00 75.40 H new ATOM 1549 N PHE A 99 5.406 2.849 -1.082 1.00 11.42 N ATOM 1550 CA PHE A 99 5.280 1.862 -2.161 1.00 33.13 C ATOM 1551 C PHE A 99 6.668 1.361 -2.603 1.00 43.25 C ATOM 1552 O PHE A 99 7.662 2.079 -2.485 1.00 23.11 O ATOM 1553 CB PHE A 99 4.561 2.471 -3.376 1.00 0.32 C ATOM 1554 CG PHE A 99 3.142 2.918 -3.109 1.00 22.42 C ATOM 1555 CD1 PHE A 99 2.874 4.211 -2.681 1.00 74.55 C ATOM 1556 CD2 PHE A 99 2.077 2.048 -3.303 1.00 41.05 C ATOM 1557 CE1 PHE A 99 1.577 4.624 -2.448 1.00 3.23 C ATOM 1558 CE2 PHE A 99 0.778 2.458 -3.072 1.00 12.55 C ATOM 1559 CZ PHE A 99 0.527 3.747 -2.645 1.00 34.32 C ATOM 0 H PHE A 99 5.586 3.799 -1.408 1.00 11.42 H new ATOM 0 HA PHE A 99 4.696 1.026 -1.776 1.00 33.13 H new ATOM 0 HB2 PHE A 99 5.136 3.326 -3.731 1.00 0.32 H new ATOM 0 HB3 PHE A 99 4.551 1.737 -4.181 1.00 0.32 H new ATOM 0 HD1 PHE A 99 3.690 4.902 -2.528 1.00 74.55 H new ATOM 0 HD2 PHE A 99 2.266 1.039 -3.638 1.00 41.05 H new ATOM 0 HE1 PHE A 99 1.383 5.632 -2.112 1.00 3.23 H new ATOM 0 HE2 PHE A 99 -0.041 1.771 -3.225 1.00 12.55 H new ATOM 0 HZ PHE A 99 -0.488 4.069 -2.465 1.00 34.32 H new ATOM 1569 N GLU A 100 6.732 0.131 -3.105 1.00 54.25 N ATOM 1570 CA GLU A 100 7.979 -0.420 -3.657 1.00 1.14 C ATOM 1571 C GLU A 100 7.703 -1.196 -4.954 1.00 23.25 C ATOM 1572 O GLU A 100 7.025 -2.223 -4.932 1.00 71.33 O ATOM 1573 CB GLU A 100 8.665 -1.339 -2.631 1.00 13.41 C ATOM 1574 CG GLU A 100 10.042 -1.834 -3.069 1.00 2.12 C ATOM 1575 CD GLU A 100 11.053 -0.702 -3.214 1.00 71.25 C ATOM 1576 OE1 GLU A 100 11.146 -0.108 -4.308 1.00 55.42 O ATOM 1577 OE2 GLU A 100 11.743 -0.390 -2.225 1.00 5.11 O ATOM 0 H GLU A 100 5.938 -0.508 -3.144 1.00 54.25 H new ATOM 0 HA GLU A 100 8.645 0.413 -3.883 1.00 1.14 H new ATOM 0 HB2 GLU A 100 8.765 -0.803 -1.687 1.00 13.41 H new ATOM 0 HB3 GLU A 100 8.023 -2.200 -2.442 1.00 13.41 H new ATOM 0 HG2 GLU A 100 10.413 -2.556 -2.342 1.00 2.12 H new ATOM 0 HG3 GLU A 100 9.950 -2.358 -4.020 1.00 2.12 H new ATOM 1584 N THR A 101 8.224 -0.695 -6.075 1.00 60.35 N ATOM 1585 CA THR A 101 7.984 -1.308 -7.395 1.00 0.12 C ATOM 1586 C THR A 101 9.124 -2.217 -7.849 1.00 5.32 C ATOM 1587 O THR A 101 10.269 -2.094 -7.404 1.00 4.33 O ATOM 1588 CB THR A 101 7.779 -0.243 -8.504 1.00 24.32 C ATOM 1589 OG1 THR A 101 8.703 0.845 -8.332 1.00 4.53 O ATOM 1590 CG2 THR A 101 6.351 0.281 -8.522 1.00 34.52 C ATOM 0 H THR A 101 8.817 0.135 -6.102 1.00 60.35 H new ATOM 0 HA THR A 101 7.078 -1.899 -7.258 1.00 0.12 H new ATOM 0 HB THR A 101 7.970 -0.726 -9.462 1.00 24.32 H new ATOM 0 HG1 THR A 101 9.351 0.844 -9.068 1.00 4.53 H new ATOM 0 HG21 THR A 101 6.246 1.025 -9.312 1.00 34.52 H new ATOM 0 HG22 THR A 101 5.663 -0.544 -8.707 1.00 34.52 H new ATOM 0 HG23 THR A 101 6.119 0.738 -7.560 1.00 34.52 H new ATOM 1598 N GLY A 102 8.790 -3.136 -8.747 1.00 10.12 N ATOM 1599 CA GLY A 102 9.797 -3.897 -9.467 1.00 74.41 C ATOM 1600 C GLY A 102 10.062 -3.330 -10.853 1.00 62.33 C ATOM 1601 O GLY A 102 9.345 -2.443 -11.323 1.00 54.21 O ATOM 0 H GLY A 102 7.828 -3.371 -8.992 1.00 10.12 H new ATOM 0 HA2 GLY A 102 10.725 -3.902 -8.895 1.00 74.41 H new ATOM 0 HA3 GLY A 102 9.472 -4.934 -9.556 1.00 74.41 H new ATOM 1605 N TYR A 103 11.082 -3.861 -11.516 1.00 12.02 N ATOM 1606 CA TYR A 103 11.485 -3.400 -12.849 1.00 2.14 C ATOM 1607 C TYR A 103 10.313 -3.362 -13.854 1.00 71.13 C ATOM 1608 O TYR A 103 10.329 -2.591 -14.814 1.00 43.33 O ATOM 1609 CB TYR A 103 12.609 -4.309 -13.373 1.00 54.35 C ATOM 1610 CG TYR A 103 12.794 -4.251 -14.875 1.00 72.32 C ATOM 1611 CD1 TYR A 103 13.478 -3.202 -15.478 1.00 64.21 C ATOM 1612 CD2 TYR A 103 12.263 -5.243 -15.688 1.00 21.14 C ATOM 1613 CE1 TYR A 103 13.624 -3.143 -16.852 1.00 60.33 C ATOM 1614 CE2 TYR A 103 12.408 -5.196 -17.061 1.00 20.02 C ATOM 1615 CZ TYR A 103 13.089 -4.144 -17.639 1.00 10.34 C ATOM 1616 OH TYR A 103 13.226 -4.089 -19.010 1.00 21.43 O ATOM 0 H TYR A 103 11.655 -4.622 -11.150 1.00 12.02 H new ATOM 0 HA TYR A 103 11.838 -2.373 -12.752 1.00 2.14 H new ATOM 0 HB2 TYR A 103 13.545 -4.028 -12.890 1.00 54.35 H new ATOM 0 HB3 TYR A 103 12.396 -5.338 -13.082 1.00 54.35 H new ATOM 0 HD1 TYR A 103 13.902 -2.421 -14.864 1.00 64.21 H new ATOM 0 HD2 TYR A 103 11.727 -6.066 -15.239 1.00 21.14 H new ATOM 0 HE1 TYR A 103 14.153 -2.319 -17.307 1.00 60.33 H new ATOM 0 HE2 TYR A 103 11.991 -5.978 -17.678 1.00 20.02 H new ATOM 0 HH TYR A 103 12.794 -4.870 -19.414 1.00 21.43 H new ATOM 1626 N GLY A 104 9.285 -4.169 -13.614 1.00 14.43 N ATOM 1627 CA GLY A 104 8.190 -4.294 -14.572 1.00 72.31 C ATOM 1628 C GLY A 104 7.181 -3.158 -14.472 1.00 2.44 C ATOM 1629 O GLY A 104 6.374 -2.949 -15.380 1.00 41.54 O ATOM 0 H GLY A 104 9.186 -4.741 -12.775 1.00 14.43 H new ATOM 0 HA2 GLY A 104 8.599 -4.322 -15.582 1.00 72.31 H new ATOM 0 HA3 GLY A 104 7.678 -5.243 -14.409 1.00 72.31 H new ATOM 1633 N LEU A 105 7.221 -2.428 -13.359 1.00 42.22 N ATOM 1634 CA LEU A 105 6.291 -1.324 -13.116 1.00 53.03 C ATOM 1635 C LEU A 105 6.973 0.047 -13.217 1.00 5.23 C ATOM 1636 O LEU A 105 6.295 1.066 -13.254 1.00 62.01 O ATOM 1637 CB LEU A 105 5.651 -1.489 -11.733 1.00 31.33 C ATOM 1638 CG LEU A 105 4.838 -2.780 -11.547 1.00 12.44 C ATOM 1639 CD1 LEU A 105 4.310 -2.890 -10.121 1.00 0.22 C ATOM 1640 CD2 LEU A 105 3.695 -2.844 -12.558 1.00 43.34 C ATOM 0 H LEU A 105 7.892 -2.582 -12.606 1.00 42.22 H new ATOM 0 HA LEU A 105 5.525 -1.360 -13.891 1.00 53.03 H new ATOM 0 HB2 LEU A 105 6.437 -1.460 -10.979 1.00 31.33 H new ATOM 0 HB3 LEU A 105 4.999 -0.636 -11.546 1.00 31.33 H new ATOM 0 HG LEU A 105 5.499 -3.628 -11.725 1.00 12.44 H new ATOM 0 HD11 LEU A 105 3.738 -3.812 -10.015 1.00 0.22 H new ATOM 0 HD12 LEU A 105 5.147 -2.900 -9.423 1.00 0.22 H new ATOM 0 HD13 LEU A 105 3.667 -2.037 -9.904 1.00 0.22 H new ATOM 0 HD21 LEU A 105 3.130 -3.765 -12.411 1.00 43.34 H new ATOM 0 HD22 LEU A 105 3.036 -1.988 -12.416 1.00 43.34 H new ATOM 0 HD23 LEU A 105 4.102 -2.825 -13.569 1.00 43.34 H new ATOM 1652 N GLU A 106 8.307 0.068 -13.281 1.00 73.52 N ATOM 1653 CA GLU A 106 9.076 1.328 -13.363 1.00 71.31 C ATOM 1654 C GLU A 106 8.550 2.275 -14.460 1.00 34.43 C ATOM 1655 O GLU A 106 8.623 3.499 -14.325 1.00 63.34 O ATOM 1656 CB GLU A 106 10.562 1.022 -13.619 1.00 12.24 C ATOM 1657 CG GLU A 106 11.302 0.454 -12.411 1.00 23.22 C ATOM 1658 CD GLU A 106 11.479 1.472 -11.293 1.00 74.34 C ATOM 1659 OE1 GLU A 106 12.265 2.428 -11.472 1.00 61.34 O ATOM 1660 OE2 GLU A 106 10.840 1.321 -10.230 1.00 53.11 O ATOM 0 H GLU A 106 8.885 -0.772 -13.278 1.00 73.52 H new ATOM 0 HA GLU A 106 8.954 1.836 -12.406 1.00 71.31 H new ATOM 0 HB2 GLU A 106 10.638 0.313 -14.444 1.00 12.24 H new ATOM 0 HB3 GLU A 106 11.060 1.938 -13.938 1.00 12.24 H new ATOM 0 HG2 GLU A 106 10.755 -0.407 -12.028 1.00 23.22 H new ATOM 0 HG3 GLU A 106 12.281 0.095 -12.727 1.00 23.22 H new ATOM 1667 N GLY A 107 8.033 1.707 -15.545 1.00 10.04 N ATOM 1668 CA GLY A 107 7.527 2.516 -16.649 1.00 51.35 C ATOM 1669 C GLY A 107 6.128 3.085 -16.412 1.00 43.34 C ATOM 1670 O GLY A 107 5.742 4.077 -17.032 1.00 50.20 O ATOM 0 H GLY A 107 7.954 0.700 -15.683 1.00 10.04 H new ATOM 0 HA2 GLY A 107 8.218 3.340 -16.829 1.00 51.35 H new ATOM 0 HA3 GLY A 107 7.513 1.909 -17.554 1.00 51.35 H new ATOM 1674 N TYR A 108 5.361 2.458 -15.521 1.00 43.12 N ATOM 1675 CA TYR A 108 3.982 2.886 -15.237 1.00 2.13 C ATOM 1676 C TYR A 108 3.895 3.661 -13.913 1.00 40.32 C ATOM 1677 O TYR A 108 3.159 4.638 -13.790 1.00 43.22 O ATOM 1678 CB TYR A 108 3.054 1.664 -15.164 1.00 71.41 C ATOM 1679 CG TYR A 108 3.220 0.693 -16.317 1.00 24.11 C ATOM 1680 CD1 TYR A 108 2.755 1.002 -17.591 1.00 14.14 C ATOM 1681 CD2 TYR A 108 3.847 -0.534 -16.129 1.00 10.22 C ATOM 1682 CE1 TYR A 108 2.910 0.118 -18.639 1.00 31.23 C ATOM 1683 CE2 TYR A 108 4.006 -1.422 -17.172 1.00 52.43 C ATOM 1684 CZ TYR A 108 3.535 -1.094 -18.426 1.00 32.45 C ATOM 1685 OH TYR A 108 3.693 -1.978 -19.471 1.00 14.12 O ATOM 0 H TYR A 108 5.667 1.650 -14.980 1.00 43.12 H new ATOM 0 HA TYR A 108 3.669 3.545 -16.047 1.00 2.13 H new ATOM 0 HB2 TYR A 108 3.239 1.136 -14.228 1.00 71.41 H new ATOM 0 HB3 TYR A 108 2.020 2.007 -15.138 1.00 71.41 H new ATOM 0 HD1 TYR A 108 2.265 1.949 -17.763 1.00 14.14 H new ATOM 0 HD2 TYR A 108 4.216 -0.796 -15.148 1.00 10.22 H new ATOM 0 HE1 TYR A 108 2.544 0.373 -19.622 1.00 31.23 H new ATOM 0 HE2 TYR A 108 4.497 -2.370 -17.008 1.00 52.43 H new ATOM 0 HH TYR A 108 4.153 -2.782 -19.152 1.00 14.12 H new ATOM 1695 N LEU A 109 4.660 3.206 -12.927 1.00 13.23 N ATOM 1696 CA LEU A 109 4.630 3.762 -11.571 1.00 12.32 C ATOM 1697 C LEU A 109 6.045 4.142 -11.092 1.00 41.55 C ATOM 1698 O LEU A 109 6.675 3.399 -10.337 1.00 40.32 O ATOM 1699 CB LEU A 109 4.017 2.729 -10.609 1.00 41.24 C ATOM 1700 CG LEU A 109 2.585 2.275 -10.944 1.00 40.14 C ATOM 1701 CD1 LEU A 109 2.247 0.970 -10.222 1.00 61.03 C ATOM 1702 CD2 LEU A 109 1.576 3.369 -10.590 1.00 34.04 C ATOM 0 H LEU A 109 5.322 2.439 -13.042 1.00 13.23 H new ATOM 0 HA LEU A 109 4.022 4.667 -11.583 1.00 12.32 H new ATOM 0 HB2 LEU A 109 4.662 1.851 -10.589 1.00 41.24 H new ATOM 0 HB3 LEU A 109 4.020 3.149 -9.603 1.00 41.24 H new ATOM 0 HG LEU A 109 2.527 2.092 -12.017 1.00 40.14 H new ATOM 0 HD11 LEU A 109 1.230 0.668 -10.473 1.00 61.03 H new ATOM 0 HD12 LEU A 109 2.944 0.192 -10.532 1.00 61.03 H new ATOM 0 HD13 LEU A 109 2.325 1.119 -9.145 1.00 61.03 H new ATOM 0 HD21 LEU A 109 0.570 3.029 -10.834 1.00 34.04 H new ATOM 0 HD22 LEU A 109 1.636 3.588 -9.524 1.00 34.04 H new ATOM 0 HD23 LEU A 109 1.802 4.271 -11.159 1.00 34.04 H new ATOM 1714 N PRO A 110 6.583 5.291 -11.550 1.00 33.55 N ATOM 1715 CA PRO A 110 7.914 5.758 -11.124 1.00 32.25 C ATOM 1716 C PRO A 110 7.917 6.318 -9.688 1.00 61.11 C ATOM 1717 O PRO A 110 6.863 6.647 -9.134 1.00 35.15 O ATOM 1718 CB PRO A 110 8.236 6.854 -12.146 1.00 13.25 C ATOM 1719 CG PRO A 110 6.902 7.384 -12.558 1.00 30.11 C ATOM 1720 CD PRO A 110 5.957 6.210 -12.523 1.00 64.42 C ATOM 0 HA PRO A 110 8.646 4.951 -11.098 1.00 32.25 H new ATOM 0 HB2 PRO A 110 8.856 7.636 -11.707 1.00 13.25 H new ATOM 0 HB3 PRO A 110 8.784 6.453 -12.998 1.00 13.25 H new ATOM 0 HG2 PRO A 110 6.570 8.172 -11.882 1.00 30.11 H new ATOM 0 HG3 PRO A 110 6.947 7.819 -13.557 1.00 30.11 H new ATOM 0 HD2 PRO A 110 4.958 6.509 -12.207 1.00 64.42 H new ATOM 0 HD3 PRO A 110 5.856 5.747 -13.505 1.00 64.42 H new ATOM 1728 N ASP A 111 9.111 6.439 -9.103 1.00 33.41 N ATOM 1729 CA ASP A 111 9.267 6.861 -7.704 1.00 2.25 C ATOM 1730 C ASP A 111 8.520 8.177 -7.404 1.00 63.04 C ATOM 1731 O ASP A 111 7.836 8.296 -6.385 1.00 51.31 O ATOM 1732 CB ASP A 111 10.757 7.011 -7.380 1.00 53.41 C ATOM 1733 CG ASP A 111 11.015 7.224 -5.899 1.00 3.21 C ATOM 1734 OD1 ASP A 111 10.940 6.243 -5.134 1.00 31.44 O ATOM 1735 OD2 ASP A 111 11.317 8.364 -5.492 1.00 61.14 O ATOM 0 H ASP A 111 9.993 6.249 -9.579 1.00 33.41 H new ATOM 0 HA ASP A 111 8.824 6.092 -7.071 1.00 2.25 H new ATOM 0 HB2 ASP A 111 11.289 6.120 -7.713 1.00 53.41 H new ATOM 0 HB3 ASP A 111 11.164 7.853 -7.940 1.00 53.41 H new ATOM 1740 N GLY A 112 8.654 9.158 -8.299 1.00 54.12 N ATOM 1741 CA GLY A 112 7.966 10.438 -8.131 1.00 54.23 C ATOM 1742 C GLY A 112 6.444 10.304 -8.108 1.00 11.53 C ATOM 1743 O GLY A 112 5.767 10.965 -7.317 1.00 22.35 O ATOM 0 H GLY A 112 9.227 9.091 -9.140 1.00 54.12 H new ATOM 0 HA2 GLY A 112 8.298 10.902 -7.202 1.00 54.23 H new ATOM 0 HA3 GLY A 112 8.253 11.107 -8.942 1.00 54.23 H new ATOM 1747 N LEU A 113 5.900 9.449 -8.974 1.00 31.33 N ATOM 1748 CA LEU A 113 4.453 9.200 -9.000 1.00 10.10 C ATOM 1749 C LEU A 113 3.988 8.526 -7.700 1.00 43.32 C ATOM 1750 O LEU A 113 3.019 8.965 -7.076 1.00 64.43 O ATOM 1751 CB LEU A 113 4.071 8.332 -10.209 1.00 55.11 C ATOM 1752 CG LEU A 113 2.577 7.967 -10.312 1.00 41.00 C ATOM 1753 CD1 LEU A 113 1.713 9.223 -10.380 1.00 65.11 C ATOM 1754 CD2 LEU A 113 2.323 7.066 -11.518 1.00 63.51 C ATOM 0 H LEU A 113 6.433 8.919 -9.664 1.00 31.33 H new ATOM 0 HA LEU A 113 3.951 10.164 -9.089 1.00 10.10 H new ATOM 0 HB2 LEU A 113 4.364 8.856 -11.119 1.00 55.11 H new ATOM 0 HB3 LEU A 113 4.652 7.410 -10.172 1.00 55.11 H new ATOM 0 HG LEU A 113 2.300 7.417 -9.413 1.00 41.00 H new ATOM 0 HD11 LEU A 113 0.663 8.939 -10.452 1.00 65.11 H new ATOM 0 HD12 LEU A 113 1.867 9.819 -9.481 1.00 65.11 H new ATOM 0 HD13 LEU A 113 1.991 9.809 -11.256 1.00 65.11 H new ATOM 0 HD21 LEU A 113 1.262 6.820 -11.572 1.00 63.51 H new ATOM 0 HD22 LEU A 113 2.622 7.584 -12.429 1.00 63.51 H new ATOM 0 HD23 LEU A 113 2.903 6.149 -11.416 1.00 63.51 H new ATOM 1766 N LEU A 114 4.686 7.463 -7.298 1.00 44.04 N ATOM 1767 CA LEU A 114 4.387 6.769 -6.039 1.00 33.12 C ATOM 1768 C LEU A 114 4.428 7.745 -4.854 1.00 53.24 C ATOM 1769 O LEU A 114 3.548 7.734 -3.990 1.00 54.02 O ATOM 1770 CB LEU A 114 5.389 5.626 -5.807 1.00 40.35 C ATOM 1771 CG LEU A 114 5.404 4.530 -6.887 1.00 1.14 C ATOM 1772 CD1 LEU A 114 6.503 3.508 -6.602 1.00 53.34 C ATOM 1773 CD2 LEU A 114 4.041 3.844 -6.980 1.00 43.41 C ATOM 0 H LEU A 114 5.463 7.062 -7.824 1.00 44.04 H new ATOM 0 HA LEU A 114 3.382 6.353 -6.113 1.00 33.12 H new ATOM 0 HB2 LEU A 114 6.389 6.052 -5.733 1.00 40.35 H new ATOM 0 HB3 LEU A 114 5.168 5.162 -4.846 1.00 40.35 H new ATOM 0 HG LEU A 114 5.615 5.001 -7.847 1.00 1.14 H new ATOM 0 HD11 LEU A 114 6.497 2.742 -7.377 1.00 53.34 H new ATOM 0 HD12 LEU A 114 7.472 4.008 -6.594 1.00 53.34 H new ATOM 0 HD13 LEU A 114 6.326 3.044 -5.632 1.00 53.34 H new ATOM 0 HD21 LEU A 114 4.074 3.073 -7.749 1.00 43.41 H new ATOM 0 HD22 LEU A 114 3.796 3.389 -6.020 1.00 43.41 H new ATOM 0 HD23 LEU A 114 3.280 4.581 -7.237 1.00 43.41 H new ATOM 1785 N SER A 115 5.452 8.597 -4.836 1.00 42.05 N ATOM 1786 CA SER A 115 5.599 9.619 -3.788 1.00 4.15 C ATOM 1787 C SER A 115 4.405 10.583 -3.785 1.00 25.32 C ATOM 1788 O SER A 115 3.876 10.928 -2.726 1.00 64.33 O ATOM 1789 CB SER A 115 6.902 10.410 -3.975 1.00 2.12 C ATOM 1790 OG SER A 115 7.100 11.338 -2.916 1.00 53.43 O ATOM 0 H SER A 115 6.196 8.604 -5.534 1.00 42.05 H new ATOM 0 HA SER A 115 5.633 9.102 -2.829 1.00 4.15 H new ATOM 0 HB2 SER A 115 7.745 9.721 -4.020 1.00 2.12 H new ATOM 0 HB3 SER A 115 6.874 10.941 -4.926 1.00 2.12 H new ATOM 0 HG SER A 115 7.938 11.826 -3.061 1.00 53.43 H new ATOM 1796 N ARG A 116 3.979 11.012 -4.975 1.00 51.03 N ATOM 1797 CA ARG A 116 2.802 11.874 -5.096 1.00 74.11 C ATOM 1798 C ARG A 116 1.565 11.214 -4.480 1.00 14.44 C ATOM 1799 O ARG A 116 0.901 11.805 -3.638 1.00 54.52 O ATOM 1800 CB ARG A 116 2.498 12.225 -6.558 1.00 11.40 C ATOM 1801 CG ARG A 116 1.181 12.988 -6.709 1.00 71.34 C ATOM 1802 CD ARG A 116 0.780 13.210 -8.159 1.00 74.01 C ATOM 1803 NE ARG A 116 -0.585 13.723 -8.246 1.00 44.23 N ATOM 1804 CZ ARG A 116 -1.175 14.083 -9.347 1.00 74.50 C ATOM 1805 NH1 ARG A 116 -0.552 14.057 -10.481 1.00 73.13 N ATOM 1806 NH2 ARG A 116 -2.400 14.485 -9.305 1.00 50.23 N ATOM 0 H ARG A 116 4.427 10.779 -5.861 1.00 51.03 H new ATOM 0 HA ARG A 116 3.036 12.790 -4.554 1.00 74.11 H new ATOM 0 HB2 ARG A 116 3.312 12.826 -6.962 1.00 11.40 H new ATOM 0 HB3 ARG A 116 2.455 11.309 -7.148 1.00 11.40 H new ATOM 0 HG2 ARG A 116 0.390 12.438 -6.200 1.00 71.34 H new ATOM 0 HG3 ARG A 116 1.269 13.954 -6.211 1.00 71.34 H new ATOM 0 HD2 ARG A 116 1.468 13.913 -8.628 1.00 74.01 H new ATOM 0 HD3 ARG A 116 0.857 12.273 -8.710 1.00 74.01 H new ATOM 0 HE ARG A 116 -1.115 13.805 -7.378 1.00 44.23 H new ATOM 0 HH11 ARG A 116 0.420 13.750 -10.522 1.00 73.13 H new ATOM 0 HH12 ARG A 116 -1.033 14.343 -11.334 1.00 73.13 H new ATOM 0 HH21 ARG A 116 -2.896 14.518 -8.414 1.00 50.23 H new ATOM 0 HH22 ARG A 116 -2.873 14.770 -10.163 1.00 50.23 H new ATOM 1820 N ILE A 117 1.265 9.985 -4.905 1.00 31.55 N ATOM 1821 CA ILE A 117 0.088 9.255 -4.413 1.00 10.45 C ATOM 1822 C ILE A 117 0.040 9.248 -2.876 1.00 73.22 C ATOM 1823 O ILE A 117 -1.024 9.428 -2.272 1.00 32.12 O ATOM 1824 CB ILE A 117 0.072 7.799 -4.947 1.00 44.34 C ATOM 1825 CG1 ILE A 117 0.026 7.798 -6.487 1.00 14.43 C ATOM 1826 CG2 ILE A 117 -1.110 7.016 -4.365 1.00 61.43 C ATOM 1827 CD1 ILE A 117 0.097 6.416 -7.108 1.00 30.31 C ATOM 0 H ILE A 117 1.820 9.471 -5.590 1.00 31.55 H new ATOM 0 HA ILE A 117 -0.795 9.774 -4.786 1.00 10.45 H new ATOM 0 HB ILE A 117 0.989 7.304 -4.628 1.00 44.34 H new ATOM 0 HG12 ILE A 117 -0.894 8.284 -6.813 1.00 14.43 H new ATOM 0 HG13 ILE A 117 0.854 8.397 -6.865 1.00 14.43 H new ATOM 0 HG21 ILE A 117 -1.099 5.998 -4.755 1.00 61.43 H new ATOM 0 HG22 ILE A 117 -1.029 6.990 -3.278 1.00 61.43 H new ATOM 0 HG23 ILE A 117 -2.043 7.503 -4.648 1.00 61.43 H new ATOM 0 HD11 ILE A 117 0.059 6.503 -8.194 1.00 30.31 H new ATOM 0 HD12 ILE A 117 1.029 5.933 -6.815 1.00 30.31 H new ATOM 0 HD13 ILE A 117 -0.746 5.818 -6.762 1.00 30.31 H new ATOM 1839 N ILE A 118 1.204 9.067 -2.256 1.00 25.24 N ATOM 1840 CA ILE A 118 1.329 9.143 -0.799 1.00 2.33 C ATOM 1841 C ILE A 118 0.887 10.521 -0.272 1.00 51.34 C ATOM 1842 O ILE A 118 0.150 10.622 0.704 1.00 51.25 O ATOM 1843 CB ILE A 118 2.787 8.867 -0.346 1.00 51.10 C ATOM 1844 CG1 ILE A 118 3.233 7.461 -0.794 1.00 61.35 C ATOM 1845 CG2 ILE A 118 2.927 9.024 1.172 1.00 60.53 C ATOM 1846 CD1 ILE A 118 4.683 7.143 -0.484 1.00 73.02 C ATOM 0 H ILE A 118 2.079 8.866 -2.741 1.00 25.24 H new ATOM 0 HA ILE A 118 0.675 8.377 -0.383 1.00 2.33 H new ATOM 0 HB ILE A 118 3.437 9.602 -0.821 1.00 51.10 H new ATOM 0 HG12 ILE A 118 2.598 6.719 -0.310 1.00 61.35 H new ATOM 0 HG13 ILE A 118 3.073 7.366 -1.868 1.00 61.35 H new ATOM 0 HG21 ILE A 118 3.958 8.825 1.465 1.00 60.53 H new ATOM 0 HG22 ILE A 118 2.658 10.040 1.459 1.00 60.53 H new ATOM 0 HG23 ILE A 118 2.265 8.318 1.673 1.00 60.53 H new ATOM 0 HD11 ILE A 118 4.917 6.136 -0.831 1.00 73.02 H new ATOM 0 HD12 ILE A 118 5.329 7.860 -0.990 1.00 73.02 H new ATOM 0 HD13 ILE A 118 4.847 7.203 0.592 1.00 73.02 H new ATOM 1858 N HIS A 119 1.323 11.589 -0.929 1.00 3.32 N ATOM 1859 CA HIS A 119 0.992 12.942 -0.471 1.00 45.44 C ATOM 1860 C HIS A 119 -0.397 13.399 -0.962 1.00 33.25 C ATOM 1861 O HIS A 119 -1.022 14.267 -0.352 1.00 50.35 O ATOM 1862 CB HIS A 119 2.072 13.939 -0.923 1.00 22.43 C ATOM 1863 CG HIS A 119 2.422 14.945 0.131 1.00 11.21 C ATOM 1864 ND1 HIS A 119 1.559 15.935 0.557 1.00 61.22 N ATOM 1865 CD2 HIS A 119 3.540 15.081 0.879 1.00 41.34 C ATOM 1866 CE1 HIS A 119 2.130 16.628 1.520 1.00 30.05 C ATOM 1867 NE2 HIS A 119 3.329 16.133 1.734 1.00 51.42 N ATOM 0 H HIS A 119 1.899 11.552 -1.770 1.00 3.32 H new ATOM 0 HA HIS A 119 0.960 12.916 0.618 1.00 45.44 H new ATOM 0 HB2 HIS A 119 2.970 13.389 -1.205 1.00 22.43 H new ATOM 0 HB3 HIS A 119 1.725 14.461 -1.815 1.00 22.43 H new ATOM 0 HD2 HIS A 119 4.432 14.475 0.815 1.00 41.34 H new ATOM 0 HE1 HIS A 119 1.688 17.462 2.045 1.00 30.05 H new ATOM 0 HE2 HIS A 119 3.996 16.476 2.425 1.00 51.42 H new ATOM 1876 N ASP A 120 -0.883 12.792 -2.040 1.00 51.02 N ATOM 1877 CA ASP A 120 -2.120 13.228 -2.702 1.00 41.23 C ATOM 1878 C ASP A 120 -3.368 12.613 -2.040 1.00 21.11 C ATOM 1879 O ASP A 120 -4.269 13.332 -1.608 1.00 41.15 O ATOM 1880 CB ASP A 120 -2.069 12.843 -4.194 1.00 11.41 C ATOM 1881 CG ASP A 120 -3.030 13.649 -5.063 1.00 12.34 C ATOM 1882 OD1 ASP A 120 -4.194 13.851 -4.657 1.00 74.33 O ATOM 1883 OD2 ASP A 120 -2.618 14.101 -6.154 1.00 4.53 O ATOM 0 H ASP A 120 -0.438 11.988 -2.482 1.00 51.02 H new ATOM 0 HA ASP A 120 -2.194 14.311 -2.602 1.00 41.23 H new ATOM 0 HB2 ASP A 120 -1.053 12.983 -4.563 1.00 11.41 H new ATOM 0 HB3 ASP A 120 -2.301 11.783 -4.296 1.00 11.41 H new ATOM 1888 N ARG A 121 -3.414 11.280 -1.953 1.00 54.55 N ATOM 1889 CA ARG A 121 -4.621 10.578 -1.480 1.00 63.44 C ATOM 1890 C ARG A 121 -4.379 9.754 -0.197 1.00 1.45 C ATOM 1891 O ARG A 121 -5.261 9.022 0.245 1.00 14.23 O ATOM 1892 CB ARG A 121 -5.169 9.683 -2.605 1.00 41.20 C ATOM 1893 CG ARG A 121 -5.568 10.467 -3.855 1.00 13.53 C ATOM 1894 CD ARG A 121 -5.969 9.561 -5.015 1.00 21.42 C ATOM 1895 NE ARG A 121 -7.198 8.809 -4.753 1.00 33.33 N ATOM 1896 CZ ARG A 121 -8.068 8.484 -5.679 1.00 71.34 C ATOM 1897 NH1 ARG A 121 -7.894 8.861 -6.907 1.00 64.13 N ATOM 1898 NH2 ARG A 121 -9.120 7.792 -5.373 1.00 34.34 N ATOM 0 H ARG A 121 -2.638 10.666 -2.201 1.00 54.55 H new ATOM 0 HA ARG A 121 -5.357 11.338 -1.217 1.00 63.44 H new ATOM 0 HB2 ARG A 121 -4.414 8.943 -2.873 1.00 41.20 H new ATOM 0 HB3 ARG A 121 -6.036 9.135 -2.235 1.00 41.20 H new ATOM 0 HG2 ARG A 121 -6.399 11.130 -3.613 1.00 13.53 H new ATOM 0 HG3 ARG A 121 -4.735 11.099 -4.164 1.00 13.53 H new ATOM 0 HD2 ARG A 121 -6.103 10.166 -5.912 1.00 21.42 H new ATOM 0 HD3 ARG A 121 -5.158 8.862 -5.220 1.00 21.42 H new ATOM 0 HE ARG A 121 -7.389 8.521 -3.793 1.00 33.33 H new ATOM 0 HH11 ARG A 121 -7.075 9.415 -7.159 1.00 64.13 H new ATOM 0 HH12 ARG A 121 -8.576 8.604 -7.621 1.00 64.13 H new ATOM 0 HH21 ARG A 121 -9.274 7.498 -4.409 1.00 34.34 H new ATOM 0 HH22 ARG A 121 -9.794 7.542 -6.097 1.00 34.34 H new ATOM 1912 N MET A 122 -3.193 9.878 0.399 1.00 54.54 N ATOM 1913 CA MET A 122 -2.899 9.225 1.691 1.00 4.13 C ATOM 1914 C MET A 122 -2.806 10.257 2.836 1.00 75.24 C ATOM 1915 O MET A 122 -3.603 10.236 3.777 1.00 10.45 O ATOM 1916 CB MET A 122 -1.584 8.438 1.607 1.00 22.34 C ATOM 1917 CG MET A 122 -1.602 7.258 0.645 1.00 14.44 C ATOM 1918 SD MET A 122 -2.582 5.877 1.258 1.00 35.14 S ATOM 1919 CE MET A 122 -2.054 4.573 0.149 1.00 41.25 C ATOM 0 H MET A 122 -2.418 10.420 0.016 1.00 54.54 H new ATOM 0 HA MET A 122 -3.720 8.541 1.906 1.00 4.13 H new ATOM 0 HB2 MET A 122 -0.788 9.120 1.307 1.00 22.34 H new ATOM 0 HB3 MET A 122 -1.332 8.072 2.603 1.00 22.34 H new ATOM 0 HG2 MET A 122 -2.001 7.584 -0.316 1.00 14.44 H new ATOM 0 HG3 MET A 122 -0.580 6.923 0.468 1.00 14.44 H new ATOM 0 HE1 MET A 122 -2.909 3.951 -0.115 1.00 41.25 H new ATOM 0 HE2 MET A 122 -1.632 5.013 -0.755 1.00 41.25 H new ATOM 0 HE3 MET A 122 -1.299 3.961 0.641 1.00 41.25 H new ATOM 1929 N ILE A 123 -1.826 11.166 2.733 1.00 35.44 N ATOM 1930 CA ILE A 123 -1.558 12.184 3.773 1.00 42.35 C ATOM 1931 C ILE A 123 -2.827 12.925 4.269 1.00 55.13 C ATOM 1932 O ILE A 123 -3.071 12.974 5.478 1.00 62.44 O ATOM 1933 CB ILE A 123 -0.507 13.223 3.281 1.00 61.30 C ATOM 1934 CG1 ILE A 123 0.875 12.564 3.117 1.00 43.22 C ATOM 1935 CG2 ILE A 123 -0.424 14.422 4.230 1.00 45.24 C ATOM 1936 CD1 ILE A 123 1.500 12.100 4.417 1.00 41.11 C ATOM 0 H ILE A 123 -1.196 11.221 1.932 1.00 35.44 H new ATOM 0 HA ILE A 123 -1.163 11.628 4.623 1.00 42.35 H new ATOM 0 HB ILE A 123 -0.832 13.589 2.307 1.00 61.30 H new ATOM 0 HG12 ILE A 123 0.780 11.709 2.447 1.00 43.22 H new ATOM 0 HG13 ILE A 123 1.548 13.273 2.636 1.00 43.22 H new ATOM 0 HG21 ILE A 123 0.318 15.129 3.859 1.00 45.24 H new ATOM 0 HG22 ILE A 123 -1.396 14.911 4.284 1.00 45.24 H new ATOM 0 HG23 ILE A 123 -0.135 14.080 5.224 1.00 45.24 H new ATOM 0 HD11 ILE A 123 2.471 11.648 4.213 1.00 41.11 H new ATOM 0 HD12 ILE A 123 1.630 12.953 5.083 1.00 41.11 H new ATOM 0 HD13 ILE A 123 0.850 11.365 4.891 1.00 41.11 H new ATOM 1948 N PRO A 124 -3.656 13.517 3.370 1.00 33.32 N ATOM 1949 CA PRO A 124 -4.858 14.272 3.784 1.00 33.42 C ATOM 1950 C PRO A 124 -5.794 13.452 4.688 1.00 31.01 C ATOM 1951 O PRO A 124 -6.418 13.986 5.609 1.00 21.25 O ATOM 1952 CB PRO A 124 -5.551 14.629 2.452 1.00 3.20 C ATOM 1953 CG PRO A 124 -4.926 13.730 1.434 1.00 2.14 C ATOM 1954 CD PRO A 124 -3.516 13.500 1.902 1.00 61.42 C ATOM 0 HA PRO A 124 -4.595 15.145 4.381 1.00 33.42 H new ATOM 0 HB2 PRO A 124 -6.627 14.468 2.512 1.00 3.20 H new ATOM 0 HB3 PRO A 124 -5.399 15.678 2.198 1.00 3.20 H new ATOM 0 HG2 PRO A 124 -5.471 12.789 1.356 1.00 2.14 H new ATOM 0 HG3 PRO A 124 -4.940 14.189 0.446 1.00 2.14 H new ATOM 0 HD2 PRO A 124 -3.120 12.550 1.544 1.00 61.42 H new ATOM 0 HD3 PRO A 124 -2.840 14.280 1.550 1.00 61.42 H new ATOM 1962 N HIS A 125 -5.867 12.148 4.434 1.00 63.41 N ATOM 1963 CA HIS A 125 -6.706 11.253 5.231 1.00 20.11 C ATOM 1964 C HIS A 125 -6.041 10.913 6.573 1.00 63.03 C ATOM 1965 O HIS A 125 -6.694 10.923 7.617 1.00 52.32 O ATOM 1966 CB HIS A 125 -7.014 9.973 4.447 1.00 61.14 C ATOM 1967 CG HIS A 125 -7.869 10.214 3.239 1.00 11.32 C ATOM 1968 ND1 HIS A 125 -9.234 10.319 3.344 1.00 13.51 N ATOM 1969 CD2 HIS A 125 -7.514 10.373 1.941 1.00 5.54 C ATOM 1970 CE1 HIS A 125 -9.678 10.543 2.120 1.00 14.33 C ATOM 1971 NE2 HIS A 125 -8.672 10.585 1.238 1.00 32.54 N ATOM 0 H HIS A 125 -5.355 11.686 3.682 1.00 63.41 H new ATOM 0 HA HIS A 125 -7.642 11.770 5.443 1.00 20.11 H new ATOM 0 HB2 HIS A 125 -6.077 9.511 4.135 1.00 61.14 H new ATOM 0 HB3 HIS A 125 -7.516 9.263 5.104 1.00 61.14 H new ATOM 0 HD2 HIS A 125 -6.513 10.339 1.538 1.00 5.54 H new ATOM 0 HE1 HIS A 125 -10.719 10.675 1.864 1.00 14.33 H new ATOM 0 HE2 HIS A 125 -8.752 10.744 0.234 1.00 32.54 H new ATOM 1979 N PHE A 126 -4.737 10.632 6.545 1.00 13.23 N ATOM 1980 CA PHE A 126 -3.987 10.314 7.771 1.00 21.03 C ATOM 1981 C PHE A 126 -4.043 11.475 8.775 1.00 20.33 C ATOM 1982 O PHE A 126 -4.222 11.262 9.975 1.00 25.14 O ATOM 1983 CB PHE A 126 -2.524 9.975 7.441 1.00 21.21 C ATOM 1984 CG PHE A 126 -2.356 8.783 6.531 1.00 74.55 C ATOM 1985 CD1 PHE A 126 -3.351 7.818 6.422 1.00 24.12 C ATOM 1986 CD2 PHE A 126 -1.200 8.630 5.780 1.00 60.30 C ATOM 1987 CE1 PHE A 126 -3.193 6.732 5.584 1.00 24.32 C ATOM 1988 CE2 PHE A 126 -1.040 7.545 4.943 1.00 64.21 C ATOM 1989 CZ PHE A 126 -2.038 6.596 4.844 1.00 32.41 C ATOM 0 H PHE A 126 -4.176 10.617 5.693 1.00 13.23 H new ATOM 0 HA PHE A 126 -4.457 9.443 8.228 1.00 21.03 H new ATOM 0 HB2 PHE A 126 -2.058 10.843 6.974 1.00 21.21 H new ATOM 0 HB3 PHE A 126 -1.988 9.787 8.371 1.00 21.21 H new ATOM 0 HD1 PHE A 126 -4.258 7.919 6.999 1.00 24.12 H new ATOM 0 HD2 PHE A 126 -0.416 9.369 5.851 1.00 60.30 H new ATOM 0 HE1 PHE A 126 -3.974 5.990 5.508 1.00 24.32 H new ATOM 0 HE2 PHE A 126 -0.134 7.438 4.365 1.00 64.21 H new ATOM 0 HZ PHE A 126 -1.914 5.748 4.187 1.00 32.41 H new ATOM 1999 N ARG A 127 -3.896 12.701 8.272 1.00 34.21 N ATOM 2000 CA ARG A 127 -4.013 13.906 9.108 1.00 14.13 C ATOM 2001 C ARG A 127 -5.398 13.991 9.773 1.00 73.33 C ATOM 2002 O ARG A 127 -5.530 14.443 10.910 1.00 64.25 O ATOM 2003 CB ARG A 127 -3.770 15.165 8.263 1.00 3.01 C ATOM 2004 CG ARG A 127 -2.366 15.258 7.672 1.00 14.14 C ATOM 2005 CD ARG A 127 -2.229 16.450 6.728 1.00 25.24 C ATOM 2006 NE ARG A 127 -2.508 17.724 7.392 1.00 50.45 N ATOM 2007 CZ ARG A 127 -3.228 18.681 6.873 1.00 11.12 C ATOM 2008 NH1 ARG A 127 -3.805 18.528 5.723 1.00 53.43 N ATOM 2009 NH2 ARG A 127 -3.375 19.796 7.511 1.00 71.13 N ATOM 0 H ARG A 127 -3.696 12.891 7.290 1.00 34.21 H new ATOM 0 HA ARG A 127 -3.257 13.842 9.891 1.00 14.13 H new ATOM 0 HB2 ARG A 127 -4.497 15.190 7.451 1.00 3.01 H new ATOM 0 HB3 ARG A 127 -3.951 16.045 8.881 1.00 3.01 H new ATOM 0 HG2 ARG A 127 -1.637 15.346 8.478 1.00 14.14 H new ATOM 0 HG3 ARG A 127 -2.136 14.339 7.133 1.00 14.14 H new ATOM 0 HD2 ARG A 127 -1.219 16.471 6.318 1.00 25.24 H new ATOM 0 HD3 ARG A 127 -2.912 16.325 5.888 1.00 25.24 H new ATOM 0 HE ARG A 127 -2.114 17.874 8.321 1.00 50.45 H new ATOM 0 HH11 ARG A 127 -3.699 17.652 5.212 1.00 53.43 H new ATOM 0 HH12 ARG A 127 -4.365 19.284 5.329 1.00 53.43 H new ATOM 0 HH21 ARG A 127 -2.929 19.927 8.419 1.00 71.13 H new ATOM 0 HH22 ARG A 127 -3.937 20.545 7.107 1.00 71.13 H new ATOM 2023 N SER A 128 -6.422 13.551 9.047 1.00 20.33 N ATOM 2024 CA SER A 128 -7.805 13.565 9.547 1.00 71.25 C ATOM 2025 C SER A 128 -8.111 12.344 10.431 1.00 1.23 C ATOM 2026 O SER A 128 -9.087 12.342 11.184 1.00 2.44 O ATOM 2027 CB SER A 128 -8.789 13.610 8.368 1.00 12.13 C ATOM 2028 OG SER A 128 -8.640 14.810 7.616 1.00 64.01 O ATOM 0 H SER A 128 -6.325 13.177 8.103 1.00 20.33 H new ATOM 0 HA SER A 128 -7.921 14.458 10.161 1.00 71.25 H new ATOM 0 HB2 SER A 128 -8.623 12.749 7.720 1.00 12.13 H new ATOM 0 HB3 SER A 128 -9.811 13.536 8.741 1.00 12.13 H new ATOM 0 HG SER A 128 -7.939 14.689 6.942 1.00 64.01 H new ATOM 2034 N GLY A 129 -7.269 11.315 10.345 1.00 30.22 N ATOM 2035 CA GLY A 129 -7.498 10.075 11.091 1.00 51.35 C ATOM 2036 C GLY A 129 -8.072 8.957 10.220 1.00 13.13 C ATOM 2037 O GLY A 129 -8.273 7.830 10.680 1.00 0.14 O ATOM 0 H GLY A 129 -6.426 11.313 9.770 1.00 30.22 H new ATOM 0 HA2 GLY A 129 -6.558 9.741 11.530 1.00 51.35 H new ATOM 0 HA3 GLY A 129 -8.182 10.274 11.916 1.00 51.35 H new ATOM 2041 N ASN A 130 -8.330 9.268 8.955 1.00 3.41 N ATOM 2042 CA ASN A 130 -8.888 8.304 8.003 1.00 71.14 C ATOM 2043 C ASN A 130 -7.789 7.394 7.421 1.00 2.22 C ATOM 2044 O ASN A 130 -7.543 7.396 6.217 1.00 75.15 O ATOM 2045 CB ASN A 130 -9.601 9.054 6.869 1.00 75.11 C ATOM 2046 CG ASN A 130 -10.754 9.913 7.351 1.00 4.12 C ATOM 2047 OD1 ASN A 130 -10.762 10.399 8.477 1.00 1.30 O ATOM 2048 ND2 ASN A 130 -11.736 10.113 6.495 1.00 34.22 N ATOM 0 H ASN A 130 -8.160 10.192 8.557 1.00 3.41 H new ATOM 0 HA ASN A 130 -9.602 7.673 8.532 1.00 71.14 H new ATOM 0 HB2 ASN A 130 -8.879 9.685 6.350 1.00 75.11 H new ATOM 0 HB3 ASN A 130 -9.974 8.332 6.143 1.00 75.11 H new ATOM 0 HD21 ASN A 130 -12.536 10.688 6.761 1.00 34.22 H new ATOM 0 HD22 ASN A 130 -11.696 9.693 5.566 1.00 34.22 H new ATOM 2055 N TYR A 131 -7.144 6.607 8.282 1.00 54.15 N ATOM 2056 CA TYR A 131 -6.024 5.745 7.867 1.00 14.42 C ATOM 2057 C TYR A 131 -6.432 4.745 6.769 1.00 32.34 C ATOM 2058 O TYR A 131 -5.884 4.759 5.667 1.00 1.42 O ATOM 2059 CB TYR A 131 -5.459 4.988 9.080 1.00 53.00 C ATOM 2060 CG TYR A 131 -4.902 5.898 10.162 1.00 64.42 C ATOM 2061 CD1 TYR A 131 -3.601 6.383 10.089 1.00 61.24 C ATOM 2062 CD2 TYR A 131 -5.678 6.272 11.256 1.00 14.53 C ATOM 2063 CE1 TYR A 131 -3.092 7.212 11.070 1.00 43.42 C ATOM 2064 CE2 TYR A 131 -5.175 7.100 12.240 1.00 42.55 C ATOM 2065 CZ TYR A 131 -3.882 7.567 12.144 1.00 24.22 C ATOM 2066 OH TYR A 131 -3.376 8.394 13.122 1.00 72.12 O ATOM 0 H TYR A 131 -7.374 6.545 9.274 1.00 54.15 H new ATOM 0 HA TYR A 131 -5.255 6.395 7.449 1.00 14.42 H new ATOM 0 HB2 TYR A 131 -6.246 4.368 9.509 1.00 53.00 H new ATOM 0 HB3 TYR A 131 -4.671 4.315 8.742 1.00 53.00 H new ATOM 0 HD1 TYR A 131 -2.978 6.107 9.251 1.00 61.24 H new ATOM 0 HD2 TYR A 131 -6.692 5.908 11.336 1.00 14.53 H new ATOM 0 HE1 TYR A 131 -2.080 7.581 10.996 1.00 43.42 H new ATOM 0 HE2 TYR A 131 -5.792 7.380 13.081 1.00 42.55 H new ATOM 0 HH TYR A 131 -4.060 8.548 13.807 1.00 72.12 H new ATOM 2076 N ALA A 132 -7.398 3.882 7.075 1.00 73.20 N ATOM 2077 CA ALA A 132 -7.865 2.869 6.117 1.00 62.22 C ATOM 2078 C ALA A 132 -8.509 3.508 4.871 1.00 41.22 C ATOM 2079 O ALA A 132 -8.382 2.993 3.755 1.00 15.55 O ATOM 2080 CB ALA A 132 -8.839 1.921 6.802 1.00 63.22 C ATOM 0 H ALA A 132 -7.875 3.860 7.976 1.00 73.20 H new ATOM 0 HA ALA A 132 -6.997 2.306 5.773 1.00 62.22 H new ATOM 0 HB1 ALA A 132 -9.182 1.173 6.087 1.00 63.22 H new ATOM 0 HB2 ALA A 132 -8.340 1.426 7.635 1.00 63.22 H new ATOM 0 HB3 ALA A 132 -9.694 2.485 7.175 1.00 63.22 H new ATOM 2086 N GLU A 133 -9.204 4.627 5.077 1.00 52.14 N ATOM 2087 CA GLU A 133 -9.802 5.404 3.981 1.00 73.15 C ATOM 2088 C GLU A 133 -8.723 5.859 2.979 1.00 4.02 C ATOM 2089 O GLU A 133 -8.852 5.661 1.765 1.00 75.35 O ATOM 2090 CB GLU A 133 -10.531 6.626 4.565 1.00 33.02 C ATOM 2091 CG GLU A 133 -11.261 7.499 3.544 1.00 72.40 C ATOM 2092 CD GLU A 133 -12.556 6.880 3.038 1.00 51.40 C ATOM 2093 OE1 GLU A 133 -12.512 6.070 2.093 1.00 61.02 O ATOM 2094 OE2 GLU A 133 -13.629 7.206 3.591 1.00 41.44 O ATOM 0 H GLU A 133 -9.370 5.022 6.002 1.00 52.14 H new ATOM 0 HA GLU A 133 -10.513 4.773 3.447 1.00 73.15 H new ATOM 0 HB2 GLU A 133 -11.253 6.279 5.304 1.00 33.02 H new ATOM 0 HB3 GLU A 133 -9.805 7.243 5.094 1.00 33.02 H new ATOM 0 HG2 GLU A 133 -11.481 8.467 3.995 1.00 72.40 H new ATOM 0 HG3 GLU A 133 -10.600 7.685 2.697 1.00 72.40 H new ATOM 2101 N GLY A 134 -7.652 6.459 3.508 1.00 64.40 N ATOM 2102 CA GLY A 134 -6.540 6.908 2.675 1.00 64.44 C ATOM 2103 C GLY A 134 -5.862 5.767 1.927 1.00 72.43 C ATOM 2104 O GLY A 134 -5.612 5.865 0.723 1.00 13.31 O ATOM 0 H GLY A 134 -7.535 6.643 4.504 1.00 64.40 H new ATOM 0 HA2 GLY A 134 -6.904 7.642 1.956 1.00 64.44 H new ATOM 0 HA3 GLY A 134 -5.804 7.413 3.301 1.00 64.44 H new ATOM 2108 N LEU A 135 -5.572 4.676 2.640 1.00 32.22 N ATOM 2109 CA LEU A 135 -4.987 3.479 2.022 1.00 52.04 C ATOM 2110 C LEU A 135 -5.797 3.031 0.800 1.00 21.04 C ATOM 2111 O LEU A 135 -5.245 2.788 -0.273 1.00 13.11 O ATOM 2112 CB LEU A 135 -4.910 2.331 3.035 1.00 75.03 C ATOM 2113 CG LEU A 135 -3.953 2.547 4.215 1.00 42.04 C ATOM 2114 CD1 LEU A 135 -3.987 1.343 5.150 1.00 13.20 C ATOM 2115 CD2 LEU A 135 -2.530 2.812 3.719 1.00 23.03 C ATOM 0 H LEU A 135 -5.732 4.595 3.644 1.00 32.22 H new ATOM 0 HA LEU A 135 -3.980 3.739 1.695 1.00 52.04 H new ATOM 0 HB2 LEU A 135 -5.910 2.152 3.430 1.00 75.03 H new ATOM 0 HB3 LEU A 135 -4.609 1.426 2.508 1.00 75.03 H new ATOM 0 HG LEU A 135 -4.282 3.425 4.771 1.00 42.04 H new ATOM 0 HD11 LEU A 135 -3.304 1.510 5.983 1.00 13.20 H new ATOM 0 HD12 LEU A 135 -4.999 1.208 5.532 1.00 13.20 H new ATOM 0 HD13 LEU A 135 -3.683 0.450 4.604 1.00 13.20 H new ATOM 0 HD21 LEU A 135 -1.869 2.962 4.573 1.00 23.03 H new ATOM 0 HD22 LEU A 135 -2.183 1.958 3.137 1.00 23.03 H new ATOM 0 HD23 LEU A 135 -2.523 3.705 3.093 1.00 23.03 H new ATOM 2127 N SER A 136 -7.112 2.936 0.973 1.00 11.42 N ATOM 2128 CA SER A 136 -8.013 2.542 -0.117 1.00 52.14 C ATOM 2129 C SER A 136 -7.961 3.545 -1.282 1.00 72.32 C ATOM 2130 O SER A 136 -7.996 3.154 -2.451 1.00 63.14 O ATOM 2131 CB SER A 136 -9.450 2.407 0.404 1.00 12.33 C ATOM 2132 OG SER A 136 -9.532 1.438 1.441 1.00 53.42 O ATOM 0 H SER A 136 -7.583 3.126 1.858 1.00 11.42 H new ATOM 0 HA SER A 136 -7.678 1.576 -0.494 1.00 52.14 H new ATOM 0 HB2 SER A 136 -9.797 3.371 0.775 1.00 12.33 H new ATOM 0 HB3 SER A 136 -10.111 2.124 -0.415 1.00 12.33 H new ATOM 0 HG SER A 136 -9.195 1.824 2.277 1.00 53.42 H new ATOM 2138 N GLU A 137 -7.859 4.837 -0.959 1.00 40.42 N ATOM 2139 CA GLU A 137 -7.730 5.888 -1.981 1.00 75.53 C ATOM 2140 C GLU A 137 -6.422 5.749 -2.776 1.00 44.30 C ATOM 2141 O GLU A 137 -6.417 5.855 -4.005 1.00 72.03 O ATOM 2142 CB GLU A 137 -7.808 7.284 -1.337 1.00 32.14 C ATOM 2143 CG GLU A 137 -9.229 7.754 -1.032 1.00 31.22 C ATOM 2144 CD GLU A 137 -10.015 8.095 -2.292 1.00 42.23 C ATOM 2145 OE1 GLU A 137 -10.402 7.170 -3.034 1.00 71.44 O ATOM 2146 OE2 GLU A 137 -10.233 9.295 -2.562 1.00 63.23 O ATOM 0 H GLU A 137 -7.863 5.184 0.000 1.00 40.42 H new ATOM 0 HA GLU A 137 -8.561 5.769 -2.676 1.00 75.53 H new ATOM 0 HB2 GLU A 137 -7.233 7.277 -0.411 1.00 32.14 H new ATOM 0 HB3 GLU A 137 -7.333 8.006 -2.002 1.00 32.14 H new ATOM 0 HG2 GLU A 137 -9.755 6.975 -0.479 1.00 31.22 H new ATOM 0 HG3 GLU A 137 -9.187 8.631 -0.386 1.00 31.22 H new ATOM 2153 N GLY A 138 -5.315 5.530 -2.069 1.00 10.31 N ATOM 2154 CA GLY A 138 -4.028 5.334 -2.727 1.00 72.02 C ATOM 2155 C GLY A 138 -3.999 4.095 -3.616 1.00 75.45 C ATOM 2156 O GLY A 138 -3.536 4.152 -4.755 1.00 62.12 O ATOM 0 H GLY A 138 -5.284 5.484 -1.050 1.00 10.31 H new ATOM 0 HA2 GLY A 138 -3.796 6.213 -3.329 1.00 72.02 H new ATOM 0 HA3 GLY A 138 -3.248 5.251 -1.970 1.00 72.02 H new ATOM 2160 N VAL A 139 -4.496 2.977 -3.094 1.00 15.10 N ATOM 2161 CA VAL A 139 -4.598 1.735 -3.869 1.00 31.32 C ATOM 2162 C VAL A 139 -5.443 1.939 -5.138 1.00 31.22 C ATOM 2163 O VAL A 139 -5.043 1.551 -6.238 1.00 3.12 O ATOM 2164 CB VAL A 139 -5.219 0.596 -3.022 1.00 12.22 C ATOM 2165 CG1 VAL A 139 -5.451 -0.653 -3.867 1.00 30.21 C ATOM 2166 CG2 VAL A 139 -4.338 0.274 -1.815 1.00 73.23 C ATOM 0 H VAL A 139 -4.836 2.901 -2.135 1.00 15.10 H new ATOM 0 HA VAL A 139 -3.585 1.454 -4.156 1.00 31.32 H new ATOM 0 HB VAL A 139 -6.187 0.941 -2.657 1.00 12.22 H new ATOM 0 HG11 VAL A 139 -5.887 -1.436 -3.247 1.00 30.21 H new ATOM 0 HG12 VAL A 139 -6.131 -0.417 -4.686 1.00 30.21 H new ATOM 0 HG13 VAL A 139 -4.501 -0.999 -4.273 1.00 30.21 H new ATOM 0 HG21 VAL A 139 -4.794 -0.528 -1.235 1.00 73.23 H new ATOM 0 HG22 VAL A 139 -3.352 -0.041 -2.158 1.00 73.23 H new ATOM 0 HG23 VAL A 139 -4.238 1.162 -1.190 1.00 73.23 H new ATOM 2176 N LEU A 140 -6.616 2.552 -4.973 1.00 40.02 N ATOM 2177 CA LEU A 140 -7.498 2.866 -6.103 1.00 20.21 C ATOM 2178 C LEU A 140 -6.781 3.760 -7.131 1.00 34.24 C ATOM 2179 O LEU A 140 -6.904 3.560 -8.341 1.00 34.52 O ATOM 2180 CB LEU A 140 -8.771 3.559 -5.597 1.00 24.33 C ATOM 2181 CG LEU A 140 -9.831 3.869 -6.669 1.00 71.52 C ATOM 2182 CD1 LEU A 140 -10.307 2.587 -7.348 1.00 52.24 C ATOM 2183 CD2 LEU A 140 -11.008 4.625 -6.056 1.00 65.24 C ATOM 0 H LEU A 140 -6.980 2.843 -4.066 1.00 40.02 H new ATOM 0 HA LEU A 140 -7.769 1.932 -6.596 1.00 20.21 H new ATOM 0 HB2 LEU A 140 -9.227 2.929 -4.833 1.00 24.33 H new ATOM 0 HB3 LEU A 140 -8.486 4.493 -5.112 1.00 24.33 H new ATOM 0 HG LEU A 140 -9.373 4.504 -7.428 1.00 71.52 H new ATOM 0 HD11 LEU A 140 -11.056 2.831 -8.102 1.00 52.24 H new ATOM 0 HD12 LEU A 140 -9.461 2.092 -7.824 1.00 52.24 H new ATOM 0 HD13 LEU A 140 -10.745 1.922 -6.604 1.00 52.24 H new ATOM 0 HD21 LEU A 140 -11.747 4.836 -6.829 1.00 65.24 H new ATOM 0 HD22 LEU A 140 -11.463 4.017 -5.274 1.00 65.24 H new ATOM 0 HD23 LEU A 140 -10.654 5.563 -5.627 1.00 65.24 H new ATOM 2195 N ALA A 141 -6.021 4.738 -6.632 1.00 33.11 N ATOM 2196 CA ALA A 141 -5.240 5.638 -7.491 1.00 43.21 C ATOM 2197 C ALA A 141 -4.229 4.858 -8.343 1.00 71.21 C ATOM 2198 O ALA A 141 -4.177 5.014 -9.566 1.00 71.20 O ATOM 2199 CB ALA A 141 -4.524 6.688 -6.645 1.00 40.42 C ATOM 0 H ALA A 141 -5.928 4.929 -5.634 1.00 33.11 H new ATOM 0 HA ALA A 141 -5.931 6.140 -8.168 1.00 43.21 H new ATOM 0 HB1 ALA A 141 -3.949 7.348 -7.294 1.00 40.42 H new ATOM 0 HB2 ALA A 141 -5.259 7.273 -6.092 1.00 40.42 H new ATOM 0 HB3 ALA A 141 -3.852 6.194 -5.944 1.00 40.42 H new ATOM 2205 N VAL A 142 -3.432 4.011 -7.688 1.00 24.23 N ATOM 2206 CA VAL A 142 -2.461 3.162 -8.386 1.00 54.43 C ATOM 2207 C VAL A 142 -3.153 2.294 -9.449 1.00 12.34 C ATOM 2208 O VAL A 142 -2.715 2.231 -10.602 1.00 71.51 O ATOM 2209 CB VAL A 142 -1.700 2.242 -7.398 1.00 63.30 C ATOM 2210 CG1 VAL A 142 -0.717 1.338 -8.139 1.00 62.44 C ATOM 2211 CG2 VAL A 142 -0.980 3.068 -6.334 1.00 15.21 C ATOM 0 H VAL A 142 -3.439 3.894 -6.675 1.00 24.23 H new ATOM 0 HA VAL A 142 -1.747 3.828 -8.871 1.00 54.43 H new ATOM 0 HB VAL A 142 -2.431 1.606 -6.899 1.00 63.30 H new ATOM 0 HG11 VAL A 142 -0.196 0.703 -7.423 1.00 62.44 H new ATOM 0 HG12 VAL A 142 -1.260 0.715 -8.849 1.00 62.44 H new ATOM 0 HG13 VAL A 142 0.008 1.951 -8.675 1.00 62.44 H new ATOM 0 HG21 VAL A 142 -0.453 2.402 -5.651 1.00 15.21 H new ATOM 0 HG22 VAL A 142 -0.265 3.736 -6.814 1.00 15.21 H new ATOM 0 HG23 VAL A 142 -1.708 3.657 -5.776 1.00 15.21 H new ATOM 2221 N GLN A 143 -4.238 1.630 -9.050 1.00 40.13 N ATOM 2222 CA GLN A 143 -5.031 0.820 -9.982 1.00 70.33 C ATOM 2223 C GLN A 143 -5.446 1.625 -11.223 1.00 60.42 C ATOM 2224 O GLN A 143 -5.355 1.130 -12.343 1.00 54.15 O ATOM 2225 CB GLN A 143 -6.287 0.258 -9.298 1.00 55.44 C ATOM 2226 CG GLN A 143 -7.135 -0.611 -10.227 1.00 51.34 C ATOM 2227 CD GLN A 143 -8.369 -1.195 -9.561 1.00 12.45 C ATOM 2228 OE1 GLN A 143 -8.948 -0.610 -8.655 1.00 42.22 O ATOM 2229 NE2 GLN A 143 -8.783 -2.360 -10.016 1.00 25.11 N ATOM 0 H GLN A 143 -4.589 1.635 -8.092 1.00 40.13 H new ATOM 0 HA GLN A 143 -4.395 -0.006 -10.299 1.00 70.33 H new ATOM 0 HB2 GLN A 143 -5.989 -0.331 -8.431 1.00 55.44 H new ATOM 0 HB3 GLN A 143 -6.894 1.085 -8.929 1.00 55.44 H new ATOM 0 HG2 GLN A 143 -7.444 -0.015 -11.085 1.00 51.34 H new ATOM 0 HG3 GLN A 143 -6.520 -1.425 -10.610 1.00 51.34 H new ATOM 0 HE21 GLN A 143 -8.277 -2.821 -10.772 1.00 25.11 H new ATOM 0 HE22 GLN A 143 -9.609 -2.801 -9.612 1.00 25.11 H new ATOM 2238 N GLN A 144 -5.899 2.864 -11.018 1.00 40.44 N ATOM 2239 CA GLN A 144 -6.344 3.722 -12.125 1.00 35.00 C ATOM 2240 C GLN A 144 -5.195 4.090 -13.080 1.00 15.41 C ATOM 2241 O GLN A 144 -5.402 4.197 -14.293 1.00 11.11 O ATOM 2242 CB GLN A 144 -7.025 4.985 -11.587 1.00 75.53 C ATOM 2243 CG GLN A 144 -8.378 4.710 -10.938 1.00 62.42 C ATOM 2244 CD GLN A 144 -9.062 5.968 -10.437 1.00 53.44 C ATOM 2245 OE1 GLN A 144 -8.413 6.927 -10.031 1.00 25.40 O ATOM 2246 NE2 GLN A 144 -10.379 5.981 -10.481 1.00 5.02 N ATOM 0 H GLN A 144 -5.968 3.298 -10.097 1.00 40.44 H new ATOM 0 HA GLN A 144 -7.068 3.148 -12.704 1.00 35.00 H new ATOM 0 HB2 GLN A 144 -6.369 5.460 -10.857 1.00 75.53 H new ATOM 0 HB3 GLN A 144 -7.159 5.694 -12.404 1.00 75.53 H new ATOM 0 HG2 GLN A 144 -9.027 4.213 -11.660 1.00 62.42 H new ATOM 0 HG3 GLN A 144 -8.242 4.021 -10.105 1.00 62.42 H new ATOM 0 HE21 GLN A 144 -10.886 5.165 -10.825 1.00 5.02 H new ATOM 0 HE22 GLN A 144 -10.891 6.807 -10.171 1.00 5.02 H new ATOM 2255 N VAL A 145 -3.991 4.283 -12.538 1.00 24.42 N ATOM 2256 CA VAL A 145 -2.804 4.532 -13.372 1.00 4.14 C ATOM 2257 C VAL A 145 -2.556 3.351 -14.326 1.00 53.23 C ATOM 2258 O VAL A 145 -2.316 3.531 -15.523 1.00 63.03 O ATOM 2259 CB VAL A 145 -1.534 4.764 -12.512 1.00 62.43 C ATOM 2260 CG1 VAL A 145 -0.313 5.023 -13.398 1.00 72.53 C ATOM 2261 CG2 VAL A 145 -1.746 5.915 -11.531 1.00 22.42 C ATOM 0 H VAL A 145 -3.808 4.273 -11.535 1.00 24.42 H new ATOM 0 HA VAL A 145 -3.003 5.436 -13.947 1.00 4.14 H new ATOM 0 HB VAL A 145 -1.347 3.857 -11.937 1.00 62.43 H new ATOM 0 HG11 VAL A 145 0.564 5.183 -12.771 1.00 72.53 H new ATOM 0 HG12 VAL A 145 -0.144 4.163 -14.046 1.00 72.53 H new ATOM 0 HG13 VAL A 145 -0.488 5.908 -14.009 1.00 72.53 H new ATOM 0 HG21 VAL A 145 -0.842 6.059 -10.939 1.00 22.42 H new ATOM 0 HG22 VAL A 145 -1.967 6.828 -12.084 1.00 22.42 H new ATOM 0 HG23 VAL A 145 -2.580 5.680 -10.869 1.00 22.42 H new ATOM 2271 N LEU A 146 -2.626 2.139 -13.778 1.00 13.42 N ATOM 2272 CA LEU A 146 -2.483 0.916 -14.571 1.00 43.53 C ATOM 2273 C LEU A 146 -3.712 0.689 -15.469 1.00 50.40 C ATOM 2274 O LEU A 146 -3.591 0.209 -16.596 1.00 0.14 O ATOM 2275 CB LEU A 146 -2.286 -0.291 -13.642 1.00 15.31 C ATOM 2276 CG LEU A 146 -1.059 -0.217 -12.716 1.00 34.14 C ATOM 2277 CD1 LEU A 146 -1.028 -1.406 -11.758 1.00 52.31 C ATOM 2278 CD2 LEU A 146 0.232 -0.145 -13.532 1.00 4.42 C ATOM 0 H LEU A 146 -2.782 1.976 -12.783 1.00 13.42 H new ATOM 0 HA LEU A 146 -1.608 1.028 -15.212 1.00 43.53 H new ATOM 0 HB2 LEU A 146 -3.178 -0.404 -13.026 1.00 15.31 H new ATOM 0 HB3 LEU A 146 -2.205 -1.190 -14.254 1.00 15.31 H new ATOM 0 HG LEU A 146 -1.138 0.694 -12.122 1.00 34.14 H new ATOM 0 HD11 LEU A 146 -0.152 -1.331 -11.114 1.00 52.31 H new ATOM 0 HD12 LEU A 146 -1.930 -1.404 -11.146 1.00 52.31 H new ATOM 0 HD13 LEU A 146 -0.980 -2.333 -12.330 1.00 52.31 H new ATOM 0 HD21 LEU A 146 1.087 -0.093 -12.857 1.00 4.42 H new ATOM 0 HD22 LEU A 146 0.317 -1.033 -14.158 1.00 4.42 H new ATOM 0 HD23 LEU A 146 0.214 0.743 -14.164 1.00 4.42 H new ATOM 2290 N ASP A 147 -4.892 1.049 -14.959 1.00 70.30 N ATOM 2291 CA ASP A 147 -6.159 0.838 -15.669 1.00 70.21 C ATOM 2292 C ASP A 147 -6.173 1.595 -17.004 1.00 63.24 C ATOM 2293 O ASP A 147 -6.409 1.009 -18.061 1.00 44.33 O ATOM 2294 CB ASP A 147 -7.333 1.282 -14.787 1.00 11.41 C ATOM 2295 CG ASP A 147 -8.668 0.755 -15.280 1.00 15.53 C ATOM 2296 OD1 ASP A 147 -8.968 -0.428 -15.023 1.00 22.12 O ATOM 2297 OD2 ASP A 147 -9.425 1.514 -15.919 1.00 2.44 O ATOM 0 H ASP A 147 -4.998 1.493 -14.047 1.00 70.30 H new ATOM 0 HA ASP A 147 -6.261 -0.225 -15.886 1.00 70.21 H new ATOM 0 HB2 ASP A 147 -7.166 0.938 -13.766 1.00 11.41 H new ATOM 0 HB3 ASP A 147 -7.366 2.371 -14.755 1.00 11.41 H new