USER MOD reduce.3.24.130724 H: found=0, std=0, add=1336, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1264 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 101 THR OG1 : rot -3:sc= -1.37! USER MOD Set 1.2: A 103 ASN : amide:sc= 0.906 X(o=-0.47,f=-0.74) USER MOD Set 2.1: A 24 ASN : amide:sc= -0.666 K(o=0.54,f=-3.7) USER MOD Set 2.2: A 62 LYS NZ :NH3+ 166:sc= 1.2 (180deg=0) USER MOD Set 3.1: A 10 TYR OH : rot 30:sc= 0.906 USER MOD Set 3.2: A 96 LYS NZ :NH3+ -152:sc= 0.478 (180deg=-0.00606) USER MOD Set 4.1: A -3 SER OG : rot 180:sc=-0.000863 USER MOD Set 4.2: A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 3 TYR OH : rot 63:sc= -0.726 USER MOD Set 5.2: A 100 TYR OH : rot 77:sc= -2.32! USER MOD Set 6.1: A 0 MET CE :methyl -140:sc= -0.916 (180deg=-2.51) USER MOD Set 6.2: A 31 THR OG1 : rot 160:sc= -0.206 USER MOD Single : A 2 LYS NZ :NH3+ 143:sc= 1.58 (180deg=-0.242!) USER MOD Single : A -1 HIS : no HD1:sc= 1.15 K(o=1.1,f=-5.2!) USER MOD Single : A -4 SER OG : rot 160:sc= 0 USER MOD Single : A -5 HIS :FLIP no HD1:sc= 0.0617 F(o=-1.4,f=0.062) USER MOD Single : A -6 HIS : no HD1:sc= 0 X(o=0,f=-0.0021) USER MOD Single : A -7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -8 HIS : no HD1:sc= 0 X(o=0,f=-0.035) USER MOD Single : A -9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 14 MET CE :methyl -167:sc= -0.355 (180deg=-1.27) USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 SER OG : rot -108:sc= 1.28 USER MOD Single : A 30 LYS NZ :NH3+ 172:sc= 2.15 (180deg=1.96) USER MOD Single : A 38 LYS NZ :NH3+ 155:sc= 0.571 (180deg=-1.06!) USER MOD Single : A 42 TYR OH : rot 148:sc= 0.46 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 ASN : amide:sc= -4.35! C(o=-4.4!,f=-8.5!) USER MOD Single : A 45 THR OG1 : rot -70:sc= 1.23 USER MOD Single : A 48 SER OG : rot -160:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 152:sc= 0 (180deg=-0.507) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot -2:sc= -0.617 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 HIS : no HD1:sc= -0.0495 X(o=-0.05,f=-0.048) USER MOD Single : A 69 MET CE :methyl -153:sc= -2.05 (180deg=-5.24!) USER MOD Single : A 71 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00114) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 164:sc= -0.04 (180deg=-0.293) USER MOD Single : A 88 SER OG : rot -78:sc= 0.74 USER MOD Single : A 99 TYR OH : rot 165:sc= 0 USER MOD Single : A -10 HIS : no HD1:sc=-0.00248 X(o=-0.0025,f=0) USER MOD Single : A -11 SER OG : rot 180:sc= 0 USER MOD Single : A -12 SER OG : rot 180:sc= 0.112 USER MOD Single : A -14 MET CE :methyl 164:sc= -0.111 (180deg=-0.463) USER MOD Single : A -14 MET N :NH3+ -129:sc= -0.194 (180deg=-0.377) USER MOD Single : A 106 THR OG1 : rot 180:sc= -0.0392 USER MOD Single : A 107 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.133) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 SER OG : rot -3:sc= 0.281 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ 154:sc= 1.27 (180deg=1.03) USER MOD Single : A 121 TYR OH : rot 30:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 MET CE :methyl -141:sc= -1.27 (180deg=-1.52) USER MOD Single : A 125 SER OG : rot 96:sc= 1.23 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 GLN : amide:sc= -1.14 K(o=-1.1,f=-4.3!) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 SER OG : rot -85:sc= 1.1 USER MOD Single : A 147 LYS NZ :NH3+ 125:sc= 1.2 (180deg=0.536) USER MOD Single : A 150 LYS NZ :NH3+ -174:sc= 1.25 (180deg=1.19) USER MOD Single : A 155 ASN : amide:sc= 0.224 K(o=0.22,f=-0.3) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A -14 8.626 34.416 -0.870 1.00 23.34 N ATOM 2 CA MET A -14 7.216 34.115 -1.203 1.00 23.09 C ATOM 3 C MET A -14 6.295 35.182 -0.625 1.00 22.83 C ATOM 4 O MET A -14 5.292 34.867 0.013 1.00 23.06 O ATOM 5 CB MET A -14 6.821 32.740 -0.657 1.00 23.32 C ATOM 6 CG MET A -14 7.643 31.593 -1.219 1.00 23.49 C ATOM 7 SD MET A -14 7.253 30.016 -0.434 1.00 23.59 S ATOM 8 CE MET A -14 5.538 29.810 -0.905 1.00 23.42 C ATOM 0 H1 MET A -14 9.202 34.384 -1.736 1.00 23.34 H new ATOM 0 H2 MET A -14 8.688 35.365 -0.448 1.00 23.34 H new ATOM 0 H3 MET A -14 8.981 33.712 -0.192 1.00 23.34 H new ATOM 0 HA MET A -14 7.114 34.108 -2.288 1.00 23.09 H new ATOM 0 HB2 MET A -14 6.922 32.749 0.428 1.00 23.32 H new ATOM 0 HB3 MET A -14 5.769 32.561 -0.877 1.00 23.32 H new ATOM 0 HG2 MET A -14 7.466 31.515 -2.292 1.00 23.49 H new ATOM 0 HG3 MET A -14 8.703 31.810 -1.085 1.00 23.49 H new ATOM 0 HE1 MET A -14 5.239 28.774 -0.746 1.00 23.42 H new ATOM 0 HE2 MET A -14 4.913 30.465 -0.298 1.00 23.42 H new ATOM 0 HE3 MET A -14 5.417 30.065 -1.958 1.00 23.42 H new ATOM 20 N GLY A -13 6.647 36.445 -0.841 1.00 22.47 N ATOM 21 CA GLY A -13 5.859 37.539 -0.310 1.00 22.32 C ATOM 22 C GLY A -13 5.980 37.652 1.198 1.00 21.64 C ATOM 23 O GLY A -13 6.869 37.047 1.805 1.00 21.33 O ATOM 0 H GLY A -13 7.467 36.730 -1.376 1.00 22.47 H new ATOM 0 HA2 GLY A -13 6.181 38.473 -0.770 1.00 22.32 H new ATOM 0 HA3 GLY A -13 4.813 37.395 -0.579 1.00 22.32 H new ATOM 27 N SER A -12 5.096 38.426 1.806 1.00 21.51 N ATOM 28 CA SER A -12 5.105 38.594 3.250 1.00 20.97 C ATOM 29 C SER A -12 3.693 38.836 3.786 1.00 20.41 C ATOM 30 O SER A -12 3.050 37.918 4.297 1.00 20.34 O ATOM 31 CB SER A -12 6.047 39.738 3.639 1.00 21.18 C ATOM 32 OG SER A -12 5.873 40.859 2.783 1.00 21.36 O ATOM 0 H SER A -12 4.364 38.947 1.323 1.00 21.51 H new ATOM 0 HA SER A -12 5.472 37.673 3.704 1.00 20.97 H new ATOM 0 HB2 SER A -12 5.859 40.033 4.671 1.00 21.18 H new ATOM 0 HB3 SER A -12 7.080 39.395 3.588 1.00 21.18 H new ATOM 0 HG SER A -12 6.484 41.575 3.054 1.00 21.36 H new ATOM 38 N SER A -11 3.202 40.061 3.651 1.00 20.15 N ATOM 39 CA SER A -11 1.877 40.397 4.145 1.00 19.73 C ATOM 40 C SER A -11 0.992 40.938 3.025 1.00 19.37 C ATOM 41 O SER A -11 -0.175 40.562 2.914 1.00 19.50 O ATOM 42 CB SER A -11 1.979 41.417 5.284 1.00 20.02 C ATOM 43 OG SER A -11 0.708 41.690 5.850 1.00 20.19 O ATOM 0 H SER A -11 3.699 40.833 3.206 1.00 20.15 H new ATOM 0 HA SER A -11 1.417 39.486 4.527 1.00 19.73 H new ATOM 0 HB2 SER A -11 2.648 41.037 6.056 1.00 20.02 H new ATOM 0 HB3 SER A -11 2.418 42.341 4.908 1.00 20.02 H new ATOM 0 HG SER A -11 0.806 42.343 6.575 1.00 20.19 H new ATOM 49 N HIS A -10 1.550 41.806 2.188 1.00 19.05 N ATOM 50 CA HIS A -10 0.776 42.451 1.130 1.00 18.80 C ATOM 51 C HIS A -10 0.365 41.448 0.060 1.00 17.89 C ATOM 52 O HIS A -10 -0.817 41.144 -0.097 1.00 17.81 O ATOM 53 CB HIS A -10 1.567 43.603 0.497 1.00 19.29 C ATOM 54 CG HIS A -10 1.869 44.725 1.443 1.00 20.11 C ATOM 55 ND1 HIS A -10 2.962 45.551 1.310 1.00 20.55 N ATOM 56 CD2 HIS A -10 1.210 45.155 2.545 1.00 20.68 C ATOM 57 CE1 HIS A -10 2.961 46.437 2.287 1.00 21.33 C ATOM 58 NE2 HIS A -10 1.910 46.220 3.053 1.00 21.42 N ATOM 0 H HIS A -10 2.532 42.079 2.220 1.00 19.05 H new ATOM 0 HA HIS A -10 -0.127 42.857 1.585 1.00 18.80 H new ATOM 0 HB2 HIS A -10 2.505 43.212 0.101 1.00 19.29 H new ATOM 0 HB3 HIS A -10 1.003 43.996 -0.349 1.00 19.29 H new ATOM 0 HD2 HIS A -10 0.300 44.736 2.950 1.00 20.68 H new ATOM 0 HE1 HIS A -10 3.699 47.212 2.435 1.00 21.33 H new ATOM 0 HE2 HIS A -10 1.659 46.755 3.885 1.00 21.42 H new ATOM 67 N HIS A -9 1.341 40.924 -0.669 1.00 17.33 N ATOM 68 CA HIS A -9 1.069 39.952 -1.721 1.00 16.53 C ATOM 69 C HIS A -9 1.919 38.709 -1.537 1.00 15.50 C ATOM 70 O HIS A -9 3.146 38.769 -1.608 1.00 15.25 O ATOM 71 CB HIS A -9 1.331 40.548 -3.107 1.00 16.68 C ATOM 72 CG HIS A -9 0.294 41.529 -3.556 1.00 17.20 C ATOM 73 ND1 HIS A -9 0.483 42.893 -3.534 1.00 17.69 N ATOM 74 CD2 HIS A -9 -0.947 41.331 -4.059 1.00 17.45 C ATOM 75 CE1 HIS A -9 -0.598 43.490 -4.001 1.00 18.20 C ATOM 76 NE2 HIS A -9 -1.480 42.565 -4.325 1.00 18.08 N ATOM 0 H HIS A -9 2.328 41.155 -0.552 1.00 17.33 H new ATOM 0 HA HIS A -9 0.016 39.681 -1.650 1.00 16.53 H new ATOM 0 HB2 HIS A -9 2.303 41.041 -3.101 1.00 16.68 H new ATOM 0 HB3 HIS A -9 1.389 39.738 -3.834 1.00 16.68 H new ATOM 0 HD2 HIS A -9 -1.428 40.378 -4.221 1.00 17.45 H new ATOM 0 HE1 HIS A -9 -0.737 44.556 -4.101 1.00 18.20 H new ATOM 0 HE2 HIS A -9 -2.408 42.740 -4.711 1.00 18.08 H new ATOM 85 N HIS A -8 1.266 37.585 -1.287 1.00 15.05 N ATOM 86 CA HIS A -8 1.961 36.314 -1.161 1.00 14.17 C ATOM 87 C HIS A -8 1.074 35.169 -1.647 1.00 13.33 C ATOM 88 O HIS A -8 1.097 34.067 -1.097 1.00 13.18 O ATOM 89 CB HIS A -8 2.437 36.078 0.285 1.00 14.48 C ATOM 90 CG HIS A -8 1.347 35.939 1.306 1.00 15.02 C ATOM 91 ND1 HIS A -8 1.017 34.734 1.881 1.00 15.53 N ATOM 92 CD2 HIS A -8 0.542 36.860 1.883 1.00 15.28 C ATOM 93 CE1 HIS A -8 0.060 34.919 2.767 1.00 16.06 C ATOM 94 NE2 HIS A -8 -0.251 36.203 2.791 1.00 15.93 N ATOM 0 H HIS A -8 0.255 37.527 -1.167 1.00 15.05 H new ATOM 0 HA HIS A -8 2.848 36.348 -1.793 1.00 14.17 H new ATOM 0 HB2 HIS A -8 3.048 35.176 0.306 1.00 14.48 H new ATOM 0 HB3 HIS A -8 3.082 36.907 0.577 1.00 14.48 H new ATOM 0 HD2 HIS A -8 0.526 37.918 1.669 1.00 15.28 H new ATOM 0 HE1 HIS A -8 -0.395 34.149 3.373 1.00 16.06 H new ATOM 0 HE2 HIS A -8 -0.961 36.633 3.384 1.00 15.93 H new ATOM 103 N HIS A -7 0.289 35.437 -2.685 1.00 12.97 N ATOM 104 CA HIS A -7 -0.538 34.405 -3.299 1.00 12.32 C ATOM 105 C HIS A -7 0.293 33.592 -4.281 1.00 11.63 C ATOM 106 O HIS A -7 1.464 33.902 -4.507 1.00 11.60 O ATOM 107 CB HIS A -7 -1.747 35.010 -4.018 1.00 12.67 C ATOM 108 CG HIS A -7 -2.903 35.323 -3.118 1.00 12.79 C ATOM 109 ND1 HIS A -7 -3.728 34.355 -2.582 1.00 12.93 N ATOM 110 CD2 HIS A -7 -3.378 36.506 -2.669 1.00 13.01 C ATOM 111 CE1 HIS A -7 -4.659 34.931 -1.846 1.00 13.22 C ATOM 112 NE2 HIS A -7 -4.469 36.236 -1.880 1.00 13.27 N ATOM 0 H HIS A -7 0.208 36.357 -3.118 1.00 12.97 H new ATOM 0 HA HIS A -7 -0.908 33.755 -2.506 1.00 12.32 H new ATOM 0 HB2 HIS A -7 -1.435 35.925 -4.522 1.00 12.67 H new ATOM 0 HB3 HIS A -7 -2.080 34.317 -4.791 1.00 12.67 H new ATOM 0 HD2 HIS A -7 -2.974 37.483 -2.890 1.00 13.01 H new ATOM 0 HE1 HIS A -7 -5.444 34.421 -1.307 1.00 13.22 H new ATOM 0 HE2 HIS A -7 -5.039 36.931 -1.399 1.00 13.27 H new ATOM 121 N HIS A -6 -0.317 32.561 -4.866 1.00 11.27 N ATOM 122 CA HIS A -6 0.388 31.654 -5.771 1.00 10.81 C ATOM 123 C HIS A -6 1.569 31.019 -5.052 1.00 10.06 C ATOM 124 O HIS A -6 2.686 31.001 -5.565 1.00 10.07 O ATOM 125 CB HIS A -6 0.873 32.382 -7.035 1.00 11.05 C ATOM 126 CG HIS A -6 -0.226 32.845 -7.940 1.00 11.45 C ATOM 127 ND1 HIS A -6 -0.620 34.161 -8.031 1.00 11.75 N ATOM 128 CD2 HIS A -6 -1.005 32.161 -8.809 1.00 11.82 C ATOM 129 CE1 HIS A -6 -1.593 34.266 -8.915 1.00 12.27 C ATOM 130 NE2 HIS A -6 -1.846 33.068 -9.404 1.00 12.33 N ATOM 0 H HIS A -6 -1.302 32.333 -4.728 1.00 11.27 H new ATOM 0 HA HIS A -6 -0.312 30.878 -6.080 1.00 10.81 H new ATOM 0 HB2 HIS A -6 1.470 33.244 -6.737 1.00 11.05 H new ATOM 0 HB3 HIS A -6 1.531 31.716 -7.593 1.00 11.05 H new ATOM 0 HD2 HIS A -6 -0.971 31.098 -8.999 1.00 11.82 H new ATOM 0 HE1 HIS A -6 -2.098 35.180 -9.192 1.00 12.27 H new ATOM 0 HE2 HIS A -6 -2.551 32.851 -10.109 1.00 12.33 H new ATOM 139 N HIS A -5 1.310 30.499 -3.856 1.00 9.63 N ATOM 140 CA HIS A -5 2.365 29.924 -3.023 1.00 9.11 C ATOM 141 C HIS A -5 2.767 28.533 -3.517 1.00 8.16 C ATOM 142 O HIS A -5 2.652 27.536 -2.803 1.00 8.12 O ATOM 143 CB HIS A -5 1.964 29.899 -1.531 1.00 9.69 C ATOM 144 CG HIS A -5 0.658 29.224 -1.220 1.00 10.23 C ATOM 145 ND1 HIS A -5 -0.616 29.583 -1.508 1.00 10.62 N flip ATOM 146 CD2 HIS A -5 0.561 28.061 -0.481 1.00 10.71 C flip ATOM 147 CE1 HIS A -5 -1.443 28.644 -0.947 1.00 11.27 C flip ATOM 148 NE2 HIS A -5 -0.710 27.738 -0.333 1.00 11.33 N flip ATOM 0 H HIS A -5 0.379 30.463 -3.441 1.00 9.63 H new ATOM 0 HA HIS A -5 3.238 30.571 -3.112 1.00 9.11 H new ATOM 0 HB2 HIS A -5 2.753 29.399 -0.970 1.00 9.69 H new ATOM 0 HB3 HIS A -5 1.917 30.926 -1.169 1.00 9.69 H new ATOM 0 HD2 HIS A -5 1.396 27.502 -0.085 1.00 10.71 H new ATOM 0 HE1 HIS A -5 -2.522 28.647 -1.000 1.00 11.27 H new ATOM 0 HE2 HIS A -5 -1.064 26.925 0.171 1.00 11.33 H new ATOM 157 N SER A -4 3.234 28.497 -4.755 1.00 7.67 N ATOM 158 CA SER A -4 3.750 27.292 -5.377 1.00 6.97 C ATOM 159 C SER A -4 4.726 27.680 -6.479 1.00 6.27 C ATOM 160 O SER A -4 4.450 28.618 -7.233 1.00 6.26 O ATOM 161 CB SER A -4 2.602 26.449 -5.942 1.00 7.36 C ATOM 162 OG SER A -4 1.680 27.252 -6.661 1.00 7.95 O ATOM 0 H SER A -4 3.265 29.316 -5.362 1.00 7.67 H new ATOM 0 HA SER A -4 4.271 26.691 -4.631 1.00 6.97 H new ATOM 0 HB2 SER A -4 3.004 25.676 -6.598 1.00 7.36 H new ATOM 0 HB3 SER A -4 2.087 25.940 -5.128 1.00 7.36 H new ATOM 0 HG SER A -4 1.155 26.686 -7.265 1.00 7.95 H new ATOM 168 N SER A -3 5.858 26.989 -6.551 1.00 6.06 N ATOM 169 CA SER A -3 6.940 27.356 -7.461 1.00 5.84 C ATOM 170 C SER A -3 6.436 27.596 -8.885 1.00 5.11 C ATOM 171 O SER A -3 6.597 28.689 -9.439 1.00 5.39 O ATOM 172 CB SER A -3 8.011 26.264 -7.444 1.00 6.61 C ATOM 173 OG SER A -3 7.432 24.982 -7.632 1.00 7.36 O ATOM 0 H SER A -3 6.052 26.163 -5.985 1.00 6.06 H new ATOM 0 HA SER A -3 7.370 28.296 -7.116 1.00 5.84 H new ATOM 0 HB2 SER A -3 8.743 26.455 -8.229 1.00 6.61 H new ATOM 0 HB3 SER A -3 8.547 26.290 -6.495 1.00 6.61 H new ATOM 0 HG SER A -3 8.136 24.300 -7.619 1.00 7.36 H new ATOM 179 N GLY A -2 5.807 26.586 -9.461 1.00 4.57 N ATOM 180 CA GLY A -2 5.279 26.705 -10.804 1.00 4.26 C ATOM 181 C GLY A -2 5.201 25.365 -11.488 1.00 3.39 C ATOM 182 O GLY A -2 4.163 24.991 -12.033 1.00 3.57 O ATOM 0 H GLY A -2 5.651 25.679 -9.020 1.00 4.57 H new ATOM 0 HA2 GLY A -2 4.286 27.154 -10.767 1.00 4.26 H new ATOM 0 HA3 GLY A -2 5.911 27.376 -11.386 1.00 4.26 H new ATOM 186 N HIS A -1 6.302 24.631 -11.441 1.00 2.94 N ATOM 187 CA HIS A -1 6.352 23.288 -11.992 1.00 2.48 C ATOM 188 C HIS A -1 5.748 22.310 -10.990 1.00 1.95 C ATOM 189 O HIS A -1 6.451 21.512 -10.369 1.00 2.40 O ATOM 190 CB HIS A -1 7.802 22.905 -12.330 1.00 3.02 C ATOM 191 CG HIS A -1 7.944 21.597 -13.052 1.00 3.37 C ATOM 192 ND1 HIS A -1 7.792 21.467 -14.416 1.00 4.00 N ATOM 193 CD2 HIS A -1 8.238 20.357 -12.591 1.00 3.77 C ATOM 194 CE1 HIS A -1 7.985 20.205 -14.759 1.00 4.52 C ATOM 195 NE2 HIS A -1 8.258 19.514 -13.672 1.00 4.43 N ATOM 0 H HIS A -1 7.178 24.947 -11.024 1.00 2.94 H new ATOM 0 HA HIS A -1 5.773 23.249 -12.915 1.00 2.48 H new ATOM 0 HB2 HIS A -1 8.240 23.694 -12.942 1.00 3.02 H new ATOM 0 HB3 HIS A -1 8.378 22.861 -11.406 1.00 3.02 H new ATOM 0 HD2 HIS A -1 8.422 20.084 -11.563 1.00 3.77 H new ATOM 0 HE1 HIS A -1 7.928 19.808 -15.762 1.00 4.52 H new ATOM 0 HE2 HIS A -1 8.453 18.513 -13.639 1.00 4.43 H new ATOM 204 N MET A 0 4.442 22.408 -10.814 1.00 1.39 N ATOM 205 CA MET A 0 3.736 21.556 -9.876 1.00 1.16 C ATOM 206 C MET A 0 3.322 20.274 -10.562 1.00 1.03 C ATOM 207 O MET A 0 2.815 20.300 -11.685 1.00 1.08 O ATOM 208 CB MET A 0 2.501 22.263 -9.319 1.00 1.34 C ATOM 209 CG MET A 0 2.801 23.604 -8.676 1.00 1.63 C ATOM 210 SD MET A 0 4.119 23.521 -7.447 1.00 2.00 S ATOM 211 CE MET A 0 3.414 22.375 -6.267 1.00 1.61 C ATOM 0 H MET A 0 3.848 23.072 -11.311 1.00 1.39 H new ATOM 0 HA MET A 0 4.406 21.329 -9.047 1.00 1.16 H new ATOM 0 HB2 MET A 0 1.783 22.410 -10.126 1.00 1.34 H new ATOM 0 HB3 MET A 0 2.025 21.616 -8.583 1.00 1.34 H new ATOM 0 HG2 MET A 0 3.080 24.318 -9.451 1.00 1.63 H new ATOM 0 HG3 MET A 0 1.895 23.984 -8.204 1.00 1.63 H new ATOM 0 HE1 MET A 0 3.644 22.708 -5.255 1.00 1.61 H new ATOM 0 HE2 MET A 0 2.333 22.335 -6.400 1.00 1.61 H new ATOM 0 HE3 MET A 0 3.836 21.383 -6.427 1.00 1.61 H new ATOM 221 N PHE A 1 3.547 19.156 -9.900 1.00 1.03 N ATOM 222 CA PHE A 1 3.211 17.866 -10.480 1.00 1.07 C ATOM 223 C PHE A 1 1.712 17.619 -10.375 1.00 0.89 C ATOM 224 O PHE A 1 1.059 18.046 -9.413 1.00 0.81 O ATOM 225 CB PHE A 1 3.986 16.726 -9.801 1.00 1.39 C ATOM 226 CG PHE A 1 3.440 16.316 -8.460 1.00 0.93 C ATOM 227 CD1 PHE A 1 3.609 17.126 -7.352 1.00 1.15 C ATOM 228 CD2 PHE A 1 2.754 15.117 -8.312 1.00 1.11 C ATOM 229 CE1 PHE A 1 3.106 16.754 -6.124 1.00 1.47 C ATOM 230 CE2 PHE A 1 2.247 14.741 -7.080 1.00 1.14 C ATOM 231 CZ PHE A 1 2.426 15.561 -5.989 1.00 1.31 C ATOM 0 H PHE A 1 3.958 19.112 -8.967 1.00 1.03 H new ATOM 0 HA PHE A 1 3.499 17.885 -11.531 1.00 1.07 H new ATOM 0 HB2 PHE A 1 3.985 15.859 -10.461 1.00 1.39 H new ATOM 0 HB3 PHE A 1 5.025 17.032 -9.679 1.00 1.39 H new ATOM 0 HD1 PHE A 1 4.141 18.061 -7.450 1.00 1.15 H new ATOM 0 HD2 PHE A 1 2.615 14.472 -9.167 1.00 1.11 H new ATOM 0 HE1 PHE A 1 3.244 17.397 -5.267 1.00 1.47 H new ATOM 0 HE2 PHE A 1 1.713 13.808 -6.975 1.00 1.14 H new ATOM 0 HZ PHE A 1 2.034 15.270 -5.026 1.00 1.31 H new ATOM 241 N LYS A 2 1.169 16.941 -11.364 1.00 0.96 N ATOM 242 CA LYS A 2 -0.236 16.595 -11.362 1.00 0.98 C ATOM 243 C LYS A 2 -0.391 15.090 -11.449 1.00 1.01 C ATOM 244 O LYS A 2 0.484 14.390 -11.951 1.00 1.42 O ATOM 245 CB LYS A 2 -0.975 17.272 -12.519 1.00 1.14 C ATOM 246 CG LYS A 2 -1.016 18.787 -12.414 1.00 1.62 C ATOM 247 CD LYS A 2 -1.954 19.412 -13.442 1.00 2.02 C ATOM 248 CE LYS A 2 -1.390 19.379 -14.863 1.00 2.67 C ATOM 249 NZ LYS A 2 -1.507 18.040 -15.504 1.00 3.15 N ATOM 0 H LYS A 2 1.683 16.617 -12.184 1.00 0.96 H new ATOM 0 HA LYS A 2 -0.677 16.951 -10.431 1.00 0.98 H new ATOM 0 HB2 LYS A 2 -0.495 16.995 -13.457 1.00 1.14 H new ATOM 0 HB3 LYS A 2 -1.996 16.892 -12.559 1.00 1.14 H new ATOM 0 HG2 LYS A 2 -1.337 19.071 -11.412 1.00 1.62 H new ATOM 0 HG3 LYS A 2 -0.011 19.186 -12.552 1.00 1.62 H new ATOM 0 HD2 LYS A 2 -2.908 18.885 -13.423 1.00 2.02 H new ATOM 0 HD3 LYS A 2 -2.155 20.446 -13.161 1.00 2.02 H new ATOM 0 HE2 LYS A 2 -1.914 20.115 -15.473 1.00 2.67 H new ATOM 0 HE3 LYS A 2 -0.341 19.674 -14.839 1.00 2.67 H new ATOM 0 HZ1 LYS A 2 -1.724 18.157 -16.514 1.00 3.15 H new ATOM 0 HZ2 LYS A 2 -0.609 17.526 -15.400 1.00 3.15 H new ATOM 0 HZ3 LYS A 2 -2.270 17.501 -15.046 1.00 3.15 H new ATOM 263 N TYR A 3 -1.518 14.605 -10.969 1.00 0.91 N ATOM 264 CA TYR A 3 -1.780 13.176 -10.896 1.00 0.94 C ATOM 265 C TYR A 3 -2.301 12.688 -12.227 1.00 1.01 C ATOM 266 O TYR A 3 -2.597 11.511 -12.420 1.00 0.90 O ATOM 267 CB TYR A 3 -2.761 12.918 -9.763 1.00 1.02 C ATOM 268 CG TYR A 3 -2.295 13.589 -8.499 1.00 1.12 C ATOM 269 CD1 TYR A 3 -1.347 12.987 -7.686 1.00 1.31 C ATOM 270 CD2 TYR A 3 -2.748 14.854 -8.157 1.00 1.36 C ATOM 271 CE1 TYR A 3 -0.872 13.621 -6.560 1.00 1.62 C ATOM 272 CE2 TYR A 3 -2.269 15.500 -7.039 1.00 1.78 C ATOM 273 CZ TYR A 3 -1.332 14.879 -6.241 1.00 1.87 C ATOM 274 OH TYR A 3 -0.852 15.521 -5.125 1.00 2.35 O ATOM 0 H TYR A 3 -2.279 15.187 -10.618 1.00 0.91 H new ATOM 0 HA TYR A 3 -0.865 12.623 -10.685 1.00 0.94 H new ATOM 0 HB2 TYR A 3 -3.748 13.291 -10.037 1.00 1.02 H new ATOM 0 HB3 TYR A 3 -2.860 11.845 -9.597 1.00 1.02 H new ATOM 0 HD1 TYR A 3 -0.975 12.005 -7.940 1.00 1.31 H new ATOM 0 HD2 TYR A 3 -3.487 15.340 -8.776 1.00 1.36 H new ATOM 0 HE1 TYR A 3 -0.142 13.134 -5.930 1.00 1.62 H new ATOM 0 HE2 TYR A 3 -2.626 16.488 -6.789 1.00 1.78 H new ATOM 0 HH TYR A 3 0.109 15.682 -5.228 1.00 2.35 H new ATOM 284 N GLU A 4 -2.406 13.632 -13.138 1.00 1.38 N ATOM 285 CA GLU A 4 -2.687 13.349 -14.525 1.00 1.74 C ATOM 286 C GLU A 4 -1.382 13.010 -15.233 1.00 1.24 C ATOM 287 O GLU A 4 -1.380 12.383 -16.290 1.00 1.52 O ATOM 288 CB GLU A 4 -3.319 14.571 -15.183 1.00 2.44 C ATOM 289 CG GLU A 4 -4.378 15.243 -14.328 1.00 3.05 C ATOM 290 CD GLU A 4 -4.876 16.530 -14.944 1.00 3.65 C ATOM 291 OE1 GLU A 4 -4.065 17.460 -15.116 1.00 3.95 O ATOM 292 OE2 GLU A 4 -6.080 16.622 -15.253 1.00 4.16 O ATOM 0 H GLU A 4 -2.297 14.625 -12.933 1.00 1.38 H new ATOM 0 HA GLU A 4 -3.378 12.509 -14.595 1.00 1.74 H new ATOM 0 HB2 GLU A 4 -2.537 15.295 -15.413 1.00 2.44 H new ATOM 0 HB3 GLU A 4 -3.766 14.272 -16.131 1.00 2.44 H new ATOM 0 HG2 GLU A 4 -5.216 14.561 -14.188 1.00 3.05 H new ATOM 0 HG3 GLU A 4 -3.967 15.450 -13.340 1.00 3.05 H new ATOM 299 N ASP A 5 -0.267 13.421 -14.627 1.00 0.71 N ATOM 300 CA ASP A 5 1.039 13.256 -15.253 1.00 0.73 C ATOM 301 C ASP A 5 1.717 12.004 -14.735 1.00 0.72 C ATOM 302 O ASP A 5 2.701 11.530 -15.304 1.00 0.90 O ATOM 303 CB ASP A 5 1.927 14.474 -14.991 1.00 1.07 C ATOM 304 CG ASP A 5 1.392 15.734 -15.634 1.00 1.83 C ATOM 305 OD1 ASP A 5 0.607 16.451 -14.983 1.00 2.57 O ATOM 306 OD2 ASP A 5 1.750 16.015 -16.797 1.00 2.15 O ATOM 0 H ASP A 5 -0.245 13.867 -13.710 1.00 0.71 H new ATOM 0 HA ASP A 5 0.888 13.161 -16.328 1.00 0.73 H new ATOM 0 HB2 ASP A 5 2.016 14.629 -13.916 1.00 1.07 H new ATOM 0 HB3 ASP A 5 2.930 14.276 -15.369 1.00 1.07 H new ATOM 311 N ILE A 6 1.184 11.478 -13.641 1.00 0.58 N ATOM 312 CA ILE A 6 1.674 10.239 -13.071 1.00 0.55 C ATOM 313 C ILE A 6 1.130 9.081 -13.889 1.00 0.54 C ATOM 314 O ILE A 6 -0.065 9.054 -14.187 1.00 0.58 O ATOM 315 CB ILE A 6 1.221 10.078 -11.601 1.00 0.55 C ATOM 316 CG1 ILE A 6 1.672 11.280 -10.767 1.00 0.63 C ATOM 317 CG2 ILE A 6 1.766 8.783 -11.008 1.00 0.56 C ATOM 318 CD1 ILE A 6 1.243 11.202 -9.315 1.00 0.69 C ATOM 0 H ILE A 6 0.407 11.897 -13.130 1.00 0.58 H new ATOM 0 HA ILE A 6 2.764 10.252 -13.091 1.00 0.55 H new ATOM 0 HB ILE A 6 0.132 10.032 -11.582 1.00 0.55 H new ATOM 0 HG12 ILE A 6 2.758 11.358 -10.813 1.00 0.63 H new ATOM 0 HG13 ILE A 6 1.268 12.191 -11.209 1.00 0.63 H new ATOM 0 HG21 ILE A 6 1.436 8.689 -9.973 1.00 0.56 H new ATOM 0 HG22 ILE A 6 1.397 7.935 -11.585 1.00 0.56 H new ATOM 0 HG23 ILE A 6 2.855 8.798 -11.041 1.00 0.56 H new ATOM 0 HD11 ILE A 6 1.596 12.086 -8.783 1.00 0.69 H new ATOM 0 HD12 ILE A 6 0.155 11.155 -9.259 1.00 0.69 H new ATOM 0 HD13 ILE A 6 1.669 10.309 -8.857 1.00 0.69 H new ATOM 325 N PRO A 7 2.004 8.142 -14.300 1.00 0.53 N ATOM 326 CA PRO A 7 1.611 6.956 -15.068 1.00 0.55 C ATOM 327 C PRO A 7 0.305 6.346 -14.573 1.00 0.53 C ATOM 328 O PRO A 7 0.257 5.718 -13.512 1.00 0.52 O ATOM 329 CB PRO A 7 2.784 6.006 -14.834 1.00 0.55 C ATOM 330 CG PRO A 7 3.962 6.911 -14.723 1.00 0.60 C ATOM 331 CD PRO A 7 3.462 8.171 -14.060 1.00 0.54 C ATOM 0 HA PRO A 7 1.423 7.180 -16.118 1.00 0.55 H new ATOM 0 HB2 PRO A 7 2.646 5.417 -13.927 1.00 0.55 H new ATOM 0 HB3 PRO A 7 2.898 5.301 -15.658 1.00 0.55 H new ATOM 0 HG2 PRO A 7 4.754 6.449 -14.134 1.00 0.60 H new ATOM 0 HG3 PRO A 7 4.381 7.128 -15.706 1.00 0.60 H new ATOM 0 HD2 PRO A 7 3.692 8.180 -12.995 1.00 0.54 H new ATOM 0 HD3 PRO A 7 3.921 9.060 -14.493 1.00 0.54 H new ATOM 339 N ALA A 8 -0.751 6.536 -15.358 1.00 0.55 N ATOM 340 CA ALA A 8 -2.091 6.126 -14.965 1.00 0.54 C ATOM 341 C ALA A 8 -2.187 4.619 -14.806 1.00 0.55 C ATOM 342 O ALA A 8 -3.056 4.122 -14.088 1.00 0.56 O ATOM 343 CB ALA A 8 -3.114 6.618 -15.973 1.00 0.57 C ATOM 0 H ALA A 8 -0.701 6.975 -16.277 1.00 0.55 H new ATOM 0 HA ALA A 8 -2.305 6.578 -13.996 1.00 0.54 H new ATOM 0 HB1 ALA A 8 -4.110 6.303 -15.664 1.00 0.57 H new ATOM 0 HB2 ALA A 8 -3.078 7.706 -16.026 1.00 0.57 H new ATOM 0 HB3 ALA A 8 -2.889 6.199 -16.954 1.00 0.57 H new ATOM 349 N ASP A 9 -1.279 3.893 -15.452 1.00 0.55 N ATOM 350 CA ASP A 9 -1.274 2.440 -15.354 1.00 0.57 C ATOM 351 C ASP A 9 -0.990 2.027 -13.916 1.00 0.54 C ATOM 352 O ASP A 9 -1.421 0.976 -13.444 1.00 0.55 O ATOM 353 CB ASP A 9 -0.223 1.837 -16.289 1.00 0.61 C ATOM 354 CG ASP A 9 -0.566 2.022 -17.753 1.00 0.93 C ATOM 355 OD1 ASP A 9 -1.441 1.290 -18.261 1.00 1.33 O ATOM 356 OD2 ASP A 9 0.030 2.907 -18.401 1.00 1.37 O ATOM 0 H ASP A 9 -0.545 4.284 -16.043 1.00 0.55 H new ATOM 0 HA ASP A 9 -2.253 2.066 -15.653 1.00 0.57 H new ATOM 0 HB2 ASP A 9 0.744 2.297 -16.086 1.00 0.61 H new ATOM 0 HB3 ASP A 9 -0.121 0.773 -16.076 1.00 0.61 H new ATOM 361 N TYR A 10 -0.240 2.893 -13.238 1.00 0.52 N ATOM 362 CA TYR A 10 0.148 2.694 -11.852 1.00 0.50 C ATOM 363 C TYR A 10 -0.862 3.343 -10.910 1.00 0.49 C ATOM 364 O TYR A 10 -1.038 2.899 -9.775 1.00 0.51 O ATOM 365 CB TYR A 10 1.548 3.278 -11.621 1.00 0.52 C ATOM 366 CG TYR A 10 1.917 3.470 -10.165 1.00 0.53 C ATOM 367 CD1 TYR A 10 2.327 2.405 -9.376 1.00 0.59 C ATOM 368 CD2 TYR A 10 1.856 4.730 -9.582 1.00 0.59 C ATOM 369 CE1 TYR A 10 2.664 2.591 -8.047 1.00 0.66 C ATOM 370 CE2 TYR A 10 2.192 4.923 -8.260 1.00 0.66 C ATOM 371 CZ TYR A 10 2.594 3.853 -7.495 1.00 0.70 C ATOM 372 OH TYR A 10 2.930 4.046 -6.172 1.00 0.80 O ATOM 0 H TYR A 10 0.116 3.759 -13.643 1.00 0.52 H new ATOM 0 HA TYR A 10 0.167 1.625 -11.641 1.00 0.50 H new ATOM 0 HB2 TYR A 10 2.283 2.620 -12.085 1.00 0.52 H new ATOM 0 HB3 TYR A 10 1.615 4.240 -12.129 1.00 0.52 H new ATOM 0 HD1 TYR A 10 2.384 1.416 -9.806 1.00 0.59 H new ATOM 0 HD2 TYR A 10 1.539 5.574 -10.177 1.00 0.59 H new ATOM 0 HE1 TYR A 10 2.980 1.752 -7.445 1.00 0.66 H new ATOM 0 HE2 TYR A 10 2.140 5.911 -7.826 1.00 0.66 H new ATOM 0 HH TYR A 10 3.607 3.389 -5.907 1.00 0.80 H new ATOM 382 N ARG A 11 -1.531 4.394 -11.376 1.00 0.48 N ATOM 383 CA ARG A 11 -2.533 5.065 -10.555 1.00 0.49 C ATOM 384 C ARG A 11 -3.727 4.143 -10.354 1.00 0.50 C ATOM 385 O ARG A 11 -4.479 4.270 -9.386 1.00 0.54 O ATOM 386 CB ARG A 11 -2.973 6.385 -11.187 1.00 0.51 C ATOM 387 CG ARG A 11 -1.929 7.489 -11.117 1.00 0.48 C ATOM 388 CD ARG A 11 -2.369 8.599 -10.176 1.00 0.60 C ATOM 389 NE ARG A 11 -3.584 9.259 -10.648 1.00 0.88 N ATOM 390 CZ ARG A 11 -4.485 9.837 -9.854 1.00 1.19 C ATOM 391 NH1 ARG A 11 -4.354 9.782 -8.533 1.00 1.61 N ATOM 392 NH2 ARG A 11 -5.532 10.457 -10.386 1.00 1.73 N ATOM 0 H ARG A 11 -1.400 4.795 -12.305 1.00 0.48 H new ATOM 0 HA ARG A 11 -2.090 5.297 -9.586 1.00 0.49 H new ATOM 0 HB2 ARG A 11 -3.228 6.207 -12.232 1.00 0.51 H new ATOM 0 HB3 ARG A 11 -3.881 6.727 -10.691 1.00 0.51 H new ATOM 0 HG2 ARG A 11 -0.980 7.075 -10.777 1.00 0.48 H new ATOM 0 HG3 ARG A 11 -1.760 7.898 -12.113 1.00 0.48 H new ATOM 0 HD2 ARG A 11 -2.542 8.186 -9.182 1.00 0.60 H new ATOM 0 HD3 ARG A 11 -1.569 9.334 -10.081 1.00 0.60 H new ATOM 0 HE ARG A 11 -3.754 9.279 -11.653 1.00 0.88 H new ATOM 0 HH11 ARG A 11 -3.559 9.295 -8.119 1.00 1.61 H new ATOM 0 HH12 ARG A 11 -5.048 10.227 -7.933 1.00 1.61 H new ATOM 0 HH21 ARG A 11 -5.645 10.490 -11.399 1.00 1.73 H new ATOM 0 HH22 ARG A 11 -6.224 10.900 -9.781 1.00 1.73 H new ATOM 406 N ASP A 12 -3.878 3.211 -11.285 1.00 0.48 N ATOM 407 CA ASP A 12 -4.871 2.150 -11.184 1.00 0.50 C ATOM 408 C ASP A 12 -4.577 1.252 -9.985 1.00 0.52 C ATOM 409 O ASP A 12 -5.486 0.689 -9.376 1.00 0.62 O ATOM 410 CB ASP A 12 -4.850 1.305 -12.460 1.00 0.51 C ATOM 411 CG ASP A 12 -6.022 0.347 -12.534 1.00 0.76 C ATOM 412 OD1 ASP A 12 -5.925 -0.767 -11.991 1.00 0.99 O ATOM 413 OD2 ASP A 12 -7.051 0.705 -13.143 1.00 1.02 O ATOM 0 H ASP A 12 -3.314 3.169 -12.134 1.00 0.48 H new ATOM 0 HA ASP A 12 -5.853 2.605 -11.054 1.00 0.50 H new ATOM 0 HB2 ASP A 12 -4.866 1.963 -13.329 1.00 0.51 H new ATOM 0 HB3 ASP A 12 -3.919 0.740 -12.504 1.00 0.51 H new ATOM 418 N LEU A 13 -3.296 1.134 -9.646 1.00 0.50 N ATOM 419 CA LEU A 13 -2.867 0.260 -8.561 1.00 0.53 C ATOM 420 C LEU A 13 -3.038 0.964 -7.216 1.00 0.62 C ATOM 421 O LEU A 13 -2.996 0.334 -6.162 1.00 0.93 O ATOM 422 CB LEU A 13 -1.397 -0.156 -8.733 1.00 0.49 C ATOM 423 CG LEU A 13 -0.967 -0.571 -10.148 1.00 0.44 C ATOM 424 CD1 LEU A 13 0.453 -1.125 -10.128 1.00 0.78 C ATOM 425 CD2 LEU A 13 -1.928 -1.588 -10.744 1.00 0.88 C ATOM 0 H LEU A 13 -2.537 1.634 -10.109 1.00 0.50 H new ATOM 0 HA LEU A 13 -3.490 -0.634 -8.588 1.00 0.53 H new ATOM 0 HB2 LEU A 13 -0.767 0.674 -8.414 1.00 0.49 H new ATOM 0 HB3 LEU A 13 -1.195 -0.987 -8.057 1.00 0.49 H new ATOM 0 HG LEU A 13 -0.990 0.317 -10.780 1.00 0.44 H new ATOM 0 HD11 LEU A 13 0.745 -1.415 -11.137 1.00 0.78 H new ATOM 0 HD12 LEU A 13 1.137 -0.361 -9.758 1.00 0.78 H new ATOM 0 HD13 LEU A 13 0.495 -1.996 -9.474 1.00 0.78 H new ATOM 0 HD21 LEU A 13 -1.595 -1.860 -11.745 1.00 0.88 H new ATOM 0 HD22 LEU A 13 -1.952 -2.478 -10.115 1.00 0.88 H new ATOM 0 HD23 LEU A 13 -2.927 -1.156 -10.799 1.00 0.88 H new ATOM 437 N MET A 14 -3.227 2.278 -7.264 1.00 0.55 N ATOM 438 CA MET A 14 -3.399 3.073 -6.055 1.00 0.64 C ATOM 439 C MET A 14 -4.755 2.791 -5.415 1.00 0.55 C ATOM 440 O MET A 14 -5.781 2.827 -6.093 1.00 0.53 O ATOM 441 CB MET A 14 -3.311 4.568 -6.365 1.00 0.82 C ATOM 442 CG MET A 14 -1.946 5.060 -6.813 1.00 0.97 C ATOM 443 SD MET A 14 -1.951 6.847 -7.092 1.00 1.15 S ATOM 444 CE MET A 14 -0.257 7.139 -7.581 1.00 1.04 C ATOM 0 H MET A 14 -3.265 2.816 -8.130 1.00 0.55 H new ATOM 0 HA MET A 14 -2.599 2.796 -5.368 1.00 0.64 H new ATOM 0 HB2 MET A 14 -4.037 4.804 -7.143 1.00 0.82 H new ATOM 0 HB3 MET A 14 -3.605 5.124 -5.475 1.00 0.82 H new ATOM 0 HG2 MET A 14 -1.201 4.810 -6.058 1.00 0.97 H new ATOM 0 HG3 MET A 14 -1.655 4.547 -7.730 1.00 0.97 H new ATOM 0 HE1 MET A 14 -0.052 8.209 -7.561 1.00 1.04 H new ATOM 0 HE2 MET A 14 0.414 6.628 -6.891 1.00 1.04 H new ATOM 0 HE3 MET A 14 -0.099 6.758 -8.590 1.00 1.04 H new ATOM 454 N PRO A 15 -4.780 2.509 -4.104 1.00 0.62 N ATOM 455 CA PRO A 15 -6.031 2.302 -3.373 1.00 0.67 C ATOM 456 C PRO A 15 -6.892 3.565 -3.358 1.00 0.59 C ATOM 457 O PRO A 15 -6.407 4.636 -2.995 1.00 0.57 O ATOM 458 CB PRO A 15 -5.581 1.952 -1.948 1.00 0.88 C ATOM 459 CG PRO A 15 -4.142 1.581 -2.067 1.00 0.90 C ATOM 460 CD PRO A 15 -3.605 2.359 -3.234 1.00 0.74 C ATOM 0 HA PRO A 15 -6.644 1.527 -3.833 1.00 0.67 H new ATOM 0 HB2 PRO A 15 -5.714 2.799 -1.275 1.00 0.88 H new ATOM 0 HB3 PRO A 15 -6.167 1.127 -1.542 1.00 0.88 H new ATOM 0 HG2 PRO A 15 -3.600 1.825 -1.153 1.00 0.90 H new ATOM 0 HG3 PRO A 15 -4.028 0.509 -2.228 1.00 0.90 H new ATOM 0 HD2 PRO A 15 -3.206 3.325 -2.925 1.00 0.74 H new ATOM 0 HD3 PRO A 15 -2.797 1.827 -3.736 1.00 0.74 H new ATOM 468 N PRO A 16 -8.164 3.455 -3.782 1.00 0.65 N ATOM 469 CA PRO A 16 -9.076 4.599 -3.954 1.00 0.70 C ATOM 470 C PRO A 16 -8.979 5.661 -2.856 1.00 0.71 C ATOM 471 O PRO A 16 -8.866 6.853 -3.149 1.00 0.74 O ATOM 472 CB PRO A 16 -10.446 3.933 -3.926 1.00 0.85 C ATOM 473 CG PRO A 16 -10.217 2.602 -4.549 1.00 0.96 C ATOM 474 CD PRO A 16 -8.825 2.184 -4.150 1.00 0.76 C ATOM 0 HA PRO A 16 -8.845 5.154 -4.863 1.00 0.70 H new ATOM 0 HB2 PRO A 16 -10.821 3.837 -2.907 1.00 0.85 H new ATOM 0 HB3 PRO A 16 -11.182 4.512 -4.483 1.00 0.85 H new ATOM 0 HG2 PRO A 16 -10.955 1.878 -4.203 1.00 0.96 H new ATOM 0 HG3 PRO A 16 -10.310 2.659 -5.634 1.00 0.96 H new ATOM 0 HD2 PRO A 16 -8.842 1.486 -3.313 1.00 0.76 H new ATOM 0 HD3 PRO A 16 -8.307 1.687 -4.970 1.00 0.76 H new ATOM 482 N GLU A 17 -9.012 5.232 -1.599 1.00 0.78 N ATOM 483 CA GLU A 17 -9.021 6.165 -0.476 1.00 0.89 C ATOM 484 C GLU A 17 -7.641 6.770 -0.230 1.00 0.84 C ATOM 485 O GLU A 17 -7.525 7.856 0.327 1.00 1.13 O ATOM 486 CB GLU A 17 -9.531 5.465 0.776 1.00 1.09 C ATOM 487 CG GLU A 17 -10.925 4.889 0.601 1.00 1.48 C ATOM 488 CD GLU A 17 -11.347 4.026 1.764 1.00 1.36 C ATOM 489 OE1 GLU A 17 -11.013 2.824 1.760 1.00 1.65 O ATOM 490 OE2 GLU A 17 -12.021 4.540 2.683 1.00 1.83 O ATOM 0 H GLU A 17 -9.033 4.248 -1.332 1.00 0.78 H new ATOM 0 HA GLU A 17 -9.693 6.986 -0.726 1.00 0.89 H new ATOM 0 HB2 GLU A 17 -8.843 4.664 1.045 1.00 1.09 H new ATOM 0 HB3 GLU A 17 -9.536 6.172 1.606 1.00 1.09 H new ATOM 0 HG2 GLU A 17 -11.638 5.704 0.481 1.00 1.48 H new ATOM 0 HG3 GLU A 17 -10.958 4.299 -0.315 1.00 1.48 H new ATOM 497 N ALA A 18 -6.596 6.075 -0.654 1.00 0.72 N ATOM 498 CA ALA A 18 -5.245 6.621 -0.576 1.00 0.73 C ATOM 499 C ALA A 18 -5.051 7.640 -1.687 1.00 0.62 C ATOM 500 O ALA A 18 -4.242 8.561 -1.576 1.00 0.72 O ATOM 501 CB ALA A 18 -4.207 5.510 -0.670 1.00 0.82 C ATOM 0 H ALA A 18 -6.654 5.138 -1.053 1.00 0.72 H new ATOM 0 HA ALA A 18 -5.112 7.114 0.387 1.00 0.73 H new ATOM 0 HB1 ALA A 18 -3.207 5.940 -0.610 1.00 0.82 H new ATOM 0 HB2 ALA A 18 -4.350 4.808 0.151 1.00 0.82 H new ATOM 0 HB3 ALA A 18 -4.320 4.986 -1.619 1.00 0.82 H new ATOM 507 N ARG A 19 -5.812 7.459 -2.760 1.00 0.52 N ATOM 508 CA ARG A 19 -5.848 8.423 -3.846 1.00 0.49 C ATOM 509 C ARG A 19 -6.581 9.680 -3.409 1.00 0.50 C ATOM 510 O ARG A 19 -6.291 10.765 -3.895 1.00 0.52 O ATOM 511 CB ARG A 19 -6.545 7.838 -5.072 1.00 0.52 C ATOM 512 CG ARG A 19 -5.726 6.804 -5.815 1.00 0.64 C ATOM 513 CD ARG A 19 -6.496 6.235 -6.997 1.00 0.72 C ATOM 514 NE ARG A 19 -7.062 7.287 -7.842 1.00 1.01 N ATOM 515 CZ ARG A 19 -7.064 7.267 -9.175 1.00 1.43 C ATOM 516 NH1 ARG A 19 -6.459 6.289 -9.840 1.00 1.46 N ATOM 517 NH2 ARG A 19 -7.664 8.238 -9.846 1.00 2.16 N ATOM 0 H ARG A 19 -6.415 6.648 -2.899 1.00 0.52 H new ATOM 0 HA ARG A 19 -4.819 8.670 -4.107 1.00 0.49 H new ATOM 0 HB2 ARG A 19 -7.486 7.385 -4.760 1.00 0.52 H new ATOM 0 HB3 ARG A 19 -6.794 8.649 -5.757 1.00 0.52 H new ATOM 0 HG2 ARG A 19 -4.798 7.256 -6.166 1.00 0.64 H new ATOM 0 HG3 ARG A 19 -5.451 5.998 -5.135 1.00 0.64 H new ATOM 0 HD2 ARG A 19 -5.833 5.609 -7.594 1.00 0.72 H new ATOM 0 HD3 ARG A 19 -7.298 5.593 -6.632 1.00 0.72 H new ATOM 0 HE ARG A 19 -7.484 8.092 -7.379 1.00 1.01 H new ATOM 0 HH11 ARG A 19 -5.986 5.542 -9.331 1.00 1.46 H new ATOM 0 HH12 ARG A 19 -6.467 6.285 -10.860 1.00 1.46 H new ATOM 0 HH21 ARG A 19 -8.122 8.998 -9.343 1.00 2.16 H new ATOM 0 HH22 ARG A 19 -7.668 8.226 -10.866 1.00 2.16 H new ATOM 531 N ASP A 20 -7.532 9.508 -2.491 1.00 0.53 N ATOM 532 CA ASP A 20 -8.340 10.615 -1.973 1.00 0.57 C ATOM 533 C ASP A 20 -7.453 11.778 -1.544 1.00 0.56 C ATOM 534 O ASP A 20 -7.630 12.902 -2.003 1.00 0.57 O ATOM 535 CB ASP A 20 -9.186 10.144 -0.786 1.00 0.63 C ATOM 536 CG ASP A 20 -10.250 11.142 -0.378 1.00 0.80 C ATOM 537 OD1 ASP A 20 -9.933 12.092 0.370 1.00 0.98 O ATOM 538 OD2 ASP A 20 -11.418 10.967 -0.784 1.00 1.06 O ATOM 0 H ASP A 20 -7.764 8.601 -2.086 1.00 0.53 H new ATOM 0 HA ASP A 20 -9.000 10.956 -2.771 1.00 0.57 H new ATOM 0 HB2 ASP A 20 -9.663 9.198 -1.041 1.00 0.63 H new ATOM 0 HB3 ASP A 20 -8.532 9.952 0.065 1.00 0.63 H new ATOM 543 N PHE A 21 -6.480 11.485 -0.684 1.00 0.57 N ATOM 544 CA PHE A 21 -5.524 12.484 -0.209 1.00 0.57 C ATOM 545 C PHE A 21 -4.851 13.219 -1.368 1.00 0.55 C ATOM 546 O PHE A 21 -5.016 14.424 -1.494 1.00 0.64 O ATOM 547 CB PHE A 21 -4.474 11.839 0.707 1.00 0.60 C ATOM 548 CG PHE A 21 -3.466 12.816 1.250 1.00 0.59 C ATOM 549 CD1 PHE A 21 -3.780 13.627 2.329 1.00 0.62 C ATOM 550 CD2 PHE A 21 -2.209 12.932 0.675 1.00 0.64 C ATOM 551 CE1 PHE A 21 -2.860 14.534 2.826 1.00 0.65 C ATOM 552 CE2 PHE A 21 -1.287 13.839 1.165 1.00 0.65 C ATOM 553 CZ PHE A 21 -1.613 14.640 2.242 1.00 0.63 C ATOM 0 H PHE A 21 -6.332 10.553 -0.298 1.00 0.57 H new ATOM 0 HA PHE A 21 -6.081 13.222 0.368 1.00 0.57 H new ATOM 0 HB2 PHE A 21 -4.981 11.352 1.540 1.00 0.60 H new ATOM 0 HB3 PHE A 21 -3.950 11.060 0.153 1.00 0.60 H new ATOM 0 HD1 PHE A 21 -4.755 13.550 2.788 1.00 0.62 H new ATOM 0 HD2 PHE A 21 -1.947 12.306 -0.166 1.00 0.64 H new ATOM 0 HE1 PHE A 21 -3.117 15.158 3.669 1.00 0.65 H new ATOM 0 HE2 PHE A 21 -0.313 13.921 0.706 1.00 0.65 H new ATOM 0 HZ PHE A 21 -0.894 15.348 2.627 1.00 0.63 H new ATOM 563 N LEU A 22 -4.114 12.528 -2.219 1.00 0.56 N ATOM 564 CA LEU A 22 -3.418 13.211 -3.317 1.00 0.55 C ATOM 565 C LEU A 22 -4.399 13.746 -4.369 1.00 0.54 C ATOM 566 O LEU A 22 -4.056 14.665 -5.094 1.00 0.57 O ATOM 567 CB LEU A 22 -2.352 12.321 -3.963 1.00 0.56 C ATOM 568 CG LEU A 22 -1.190 11.897 -3.064 1.00 0.65 C ATOM 569 CD1 LEU A 22 -0.466 10.704 -3.674 1.00 1.04 C ATOM 570 CD2 LEU A 22 -0.221 13.052 -2.867 1.00 1.13 C ATOM 0 H LEU A 22 -3.978 11.518 -2.182 1.00 0.56 H new ATOM 0 HA LEU A 22 -2.906 14.067 -2.876 1.00 0.55 H new ATOM 0 HB2 LEU A 22 -2.839 11.422 -4.340 1.00 0.56 H new ATOM 0 HB3 LEU A 22 -1.943 12.847 -4.826 1.00 0.56 H new ATOM 0 HG LEU A 22 -1.589 11.610 -2.091 1.00 0.65 H new ATOM 0 HD11 LEU A 22 0.360 10.410 -3.026 1.00 1.04 H new ATOM 0 HD12 LEU A 22 -1.161 9.871 -3.777 1.00 1.04 H new ATOM 0 HD13 LEU A 22 -0.078 10.977 -4.655 1.00 1.04 H new ATOM 0 HD21 LEU A 22 0.600 12.733 -2.225 1.00 1.13 H new ATOM 0 HD22 LEU A 22 0.175 13.364 -3.834 1.00 1.13 H new ATOM 0 HD23 LEU A 22 -0.742 13.889 -2.401 1.00 1.13 H new ATOM 582 N GLN A 23 -5.606 13.240 -4.433 1.00 0.52 N ATOM 583 CA GLN A 23 -6.649 13.908 -5.211 1.00 0.52 C ATOM 584 C GLN A 23 -6.985 15.285 -4.611 1.00 0.53 C ATOM 585 O GLN A 23 -7.352 16.219 -5.327 1.00 0.54 O ATOM 586 CB GLN A 23 -7.898 13.036 -5.258 1.00 0.53 C ATOM 587 CG GLN A 23 -9.063 13.684 -5.987 1.00 0.78 C ATOM 588 CD GLN A 23 -10.236 12.746 -6.170 1.00 1.38 C ATOM 589 OE1 GLN A 23 -11.125 12.664 -5.320 1.00 2.05 O ATOM 590 NE2 GLN A 23 -10.252 12.037 -7.287 1.00 2.06 N ATOM 0 H GLN A 23 -5.899 12.381 -3.967 1.00 0.52 H new ATOM 0 HA GLN A 23 -6.279 14.061 -6.225 1.00 0.52 H new ATOM 0 HB2 GLN A 23 -7.654 12.092 -5.746 1.00 0.53 H new ATOM 0 HB3 GLN A 23 -8.204 12.799 -4.239 1.00 0.53 H new ATOM 0 HG2 GLN A 23 -9.390 14.563 -5.431 1.00 0.78 H new ATOM 0 HG3 GLN A 23 -8.726 14.032 -6.964 1.00 0.78 H new ATOM 0 HE21 GLN A 23 -9.496 12.135 -7.964 1.00 2.06 H new ATOM 0 HE22 GLN A 23 -11.021 11.392 -7.471 1.00 2.06 H new ATOM 599 N ASN A 24 -6.863 15.393 -3.291 1.00 0.58 N ATOM 600 CA ASN A 24 -7.137 16.644 -2.574 1.00 0.65 C ATOM 601 C ASN A 24 -6.110 17.729 -2.894 1.00 0.60 C ATOM 602 O ASN A 24 -6.483 18.872 -3.166 1.00 0.63 O ATOM 603 CB ASN A 24 -7.171 16.413 -1.057 1.00 0.85 C ATOM 604 CG ASN A 24 -8.480 15.822 -0.560 1.00 1.10 C ATOM 605 OD1 ASN A 24 -8.870 16.040 0.588 1.00 1.84 O ATOM 606 ND2 ASN A 24 -9.166 15.070 -1.402 1.00 1.21 N ATOM 0 H ASN A 24 -6.574 14.623 -2.687 1.00 0.58 H new ATOM 0 HA ASN A 24 -8.115 16.986 -2.913 1.00 0.65 H new ATOM 0 HB2 ASN A 24 -6.354 15.747 -0.781 1.00 0.85 H new ATOM 0 HB3 ASN A 24 -6.995 17.361 -0.550 1.00 0.85 H new ATOM 0 HD21 ASN A 24 -10.048 14.650 -1.108 1.00 1.21 H new ATOM 0 HD22 ASN A 24 -8.814 14.910 -2.346 1.00 1.21 H new ATOM 613 N LEU A 25 -4.823 17.382 -2.843 1.00 0.60 N ATOM 614 CA LEU A 25 -3.758 18.348 -3.106 1.00 0.65 C ATOM 615 C LEU A 25 -3.881 18.935 -4.506 1.00 0.64 C ATOM 616 O LEU A 25 -4.186 18.231 -5.472 1.00 0.64 O ATOM 617 CB LEU A 25 -2.377 17.708 -2.942 1.00 0.76 C ATOM 618 CG LEU A 25 -1.946 17.344 -1.519 1.00 0.59 C ATOM 619 CD1 LEU A 25 -1.896 18.568 -0.639 1.00 0.81 C ATOM 620 CD2 LEU A 25 -2.845 16.300 -0.904 1.00 1.05 C ATOM 0 H LEU A 25 -4.495 16.442 -2.623 1.00 0.60 H new ATOM 0 HA LEU A 25 -3.865 19.150 -2.375 1.00 0.65 H new ATOM 0 HB2 LEU A 25 -2.349 16.802 -3.547 1.00 0.76 H new ATOM 0 HB3 LEU A 25 -1.635 18.391 -3.357 1.00 0.76 H new ATOM 0 HG LEU A 25 -0.944 16.920 -1.592 1.00 0.59 H new ATOM 0 HD11 LEU A 25 -1.587 18.281 0.366 1.00 0.81 H new ATOM 0 HD12 LEU A 25 -1.181 19.282 -1.049 1.00 0.81 H new ATOM 0 HD13 LEU A 25 -2.884 19.027 -0.598 1.00 0.81 H new ATOM 0 HD21 LEU A 25 -2.501 16.073 0.105 1.00 1.05 H new ATOM 0 HD22 LEU A 25 -3.867 16.678 -0.863 1.00 1.05 H new ATOM 0 HD23 LEU A 25 -2.817 15.394 -1.509 1.00 1.05 H new ATOM 632 N SER A 26 -3.614 20.230 -4.601 1.00 0.73 N ATOM 633 CA SER A 26 -3.804 20.963 -5.841 1.00 0.83 C ATOM 634 C SER A 26 -2.508 21.629 -6.301 1.00 1.02 C ATOM 635 O SER A 26 -1.922 21.224 -7.309 1.00 1.78 O ATOM 636 CB SER A 26 -4.911 22.008 -5.670 1.00 0.93 C ATOM 637 OG SER A 26 -5.059 22.803 -6.837 1.00 1.72 O ATOM 0 H SER A 26 -3.263 20.796 -3.828 1.00 0.73 H new ATOM 0 HA SER A 26 -4.101 20.251 -6.611 1.00 0.83 H new ATOM 0 HB2 SER A 26 -5.854 21.508 -5.447 1.00 0.93 H new ATOM 0 HB3 SER A 26 -4.680 22.648 -4.819 1.00 0.93 H new ATOM 0 HG SER A 26 -4.715 23.704 -6.665 1.00 1.72 H new ATOM 643 N ASP A 27 -2.050 22.635 -5.565 1.00 0.96 N ATOM 644 CA ASP A 27 -0.884 23.407 -5.984 1.00 1.11 C ATOM 645 C ASP A 27 -0.117 23.979 -4.792 1.00 1.13 C ATOM 646 O ASP A 27 0.980 23.517 -4.480 1.00 1.95 O ATOM 647 CB ASP A 27 -1.292 24.523 -6.967 1.00 1.42 C ATOM 648 CG ASP A 27 -2.419 25.410 -6.462 1.00 1.84 C ATOM 649 OD1 ASP A 27 -3.599 25.019 -6.590 1.00 2.19 O ATOM 650 OD2 ASP A 27 -2.134 26.510 -5.945 1.00 2.39 O ATOM 0 H ASP A 27 -2.464 22.934 -4.682 1.00 0.96 H new ATOM 0 HA ASP A 27 -0.210 22.723 -6.500 1.00 1.11 H new ATOM 0 HB2 ASP A 27 -0.421 25.144 -7.178 1.00 1.42 H new ATOM 0 HB3 ASP A 27 -1.595 24.069 -7.910 1.00 1.42 H new ATOM 655 N GLY A 28 -0.698 24.962 -4.114 1.00 0.93 N ATOM 656 CA GLY A 28 -0.017 25.618 -3.013 1.00 0.87 C ATOM 657 C GLY A 28 0.207 24.698 -1.835 1.00 0.75 C ATOM 658 O GLY A 28 1.147 24.881 -1.061 1.00 0.73 O ATOM 0 H GLY A 28 -1.634 25.318 -4.309 1.00 0.93 H new ATOM 0 HA2 GLY A 28 0.944 25.998 -3.360 1.00 0.87 H new ATOM 0 HA3 GLY A 28 -0.602 26.479 -2.690 1.00 0.87 H new ATOM 662 N ASP A 29 -0.658 23.713 -1.702 1.00 0.70 N ATOM 663 CA ASP A 29 -0.546 22.727 -0.639 1.00 0.67 C ATOM 664 C ASP A 29 0.594 21.753 -0.920 1.00 0.59 C ATOM 665 O ASP A 29 1.296 21.325 -0.009 1.00 0.60 O ATOM 666 CB ASP A 29 -1.872 21.977 -0.457 1.00 0.80 C ATOM 667 CG ASP A 29 -2.600 21.714 -1.764 1.00 1.47 C ATOM 668 OD1 ASP A 29 -1.953 21.317 -2.754 1.00 2.25 O ATOM 669 OD2 ASP A 29 -3.829 21.932 -1.820 1.00 1.74 O ATOM 0 H ASP A 29 -1.455 23.571 -2.322 1.00 0.70 H new ATOM 0 HA ASP A 29 -0.320 23.251 0.290 1.00 0.67 H new ATOM 0 HB2 ASP A 29 -1.678 21.027 0.040 1.00 0.80 H new ATOM 0 HB3 ASP A 29 -2.520 22.555 0.202 1.00 0.80 H new ATOM 674 N LYS A 30 0.790 21.428 -2.189 1.00 0.63 N ATOM 675 CA LYS A 30 1.869 20.534 -2.599 1.00 0.65 C ATOM 676 C LYS A 30 3.232 21.148 -2.292 1.00 0.61 C ATOM 677 O LYS A 30 4.205 20.437 -2.034 1.00 0.65 O ATOM 678 CB LYS A 30 1.763 20.232 -4.091 1.00 0.78 C ATOM 679 CG LYS A 30 0.492 19.501 -4.478 1.00 0.92 C ATOM 680 CD LYS A 30 0.385 19.344 -5.981 1.00 0.89 C ATOM 681 CE LYS A 30 -0.789 18.463 -6.361 1.00 0.96 C ATOM 682 NZ LYS A 30 -1.113 18.577 -7.807 1.00 1.31 N ATOM 0 H LYS A 30 0.214 21.771 -2.958 1.00 0.63 H new ATOM 0 HA LYS A 30 1.773 19.606 -2.036 1.00 0.65 H new ATOM 0 HB2 LYS A 30 1.816 21.168 -4.647 1.00 0.78 H new ATOM 0 HB3 LYS A 30 2.622 19.633 -4.393 1.00 0.78 H new ATOM 0 HG2 LYS A 30 0.476 18.519 -4.005 1.00 0.92 H new ATOM 0 HG3 LYS A 30 -0.373 20.049 -4.105 1.00 0.92 H new ATOM 0 HD2 LYS A 30 0.272 20.324 -6.444 1.00 0.89 H new ATOM 0 HD3 LYS A 30 1.307 18.912 -6.370 1.00 0.89 H new ATOM 0 HE2 LYS A 30 -0.559 17.425 -6.120 1.00 0.96 H new ATOM 0 HE3 LYS A 30 -1.661 18.742 -5.769 1.00 0.96 H new ATOM 0 HZ1 LYS A 30 -1.828 17.865 -8.060 1.00 1.31 H new ATOM 0 HZ2 LYS A 30 -1.486 19.527 -8.005 1.00 1.31 H new ATOM 0 HZ3 LYS A 30 -0.252 18.419 -8.369 1.00 1.31 H new ATOM 696 N THR A 31 3.286 22.470 -2.327 1.00 0.60 N ATOM 697 CA THR A 31 4.497 23.211 -2.009 1.00 0.61 C ATOM 698 C THR A 31 5.010 22.858 -0.622 1.00 0.52 C ATOM 699 O THR A 31 6.206 22.637 -0.422 1.00 0.54 O ATOM 700 CB THR A 31 4.224 24.719 -2.053 1.00 0.68 C ATOM 701 OG1 THR A 31 3.665 25.065 -3.323 1.00 0.80 O ATOM 702 CG2 THR A 31 5.495 25.522 -1.816 1.00 0.76 C ATOM 0 H THR A 31 2.492 23.060 -2.577 1.00 0.60 H new ATOM 0 HA THR A 31 5.248 22.941 -2.751 1.00 0.61 H new ATOM 0 HB THR A 31 3.520 24.961 -1.257 1.00 0.68 H new ATOM 0 HG1 THR A 31 3.201 25.926 -3.253 1.00 0.80 H new ATOM 0 HG21 THR A 31 5.265 26.587 -1.854 1.00 0.76 H new ATOM 0 HG22 THR A 31 5.905 25.274 -0.837 1.00 0.76 H new ATOM 0 HG23 THR A 31 6.227 25.281 -2.587 1.00 0.76 H new ATOM 710 N VAL A 32 4.098 22.784 0.330 1.00 0.50 N ATOM 711 CA VAL A 32 4.485 22.599 1.708 1.00 0.50 C ATOM 712 C VAL A 32 4.825 21.130 1.974 1.00 0.47 C ATOM 713 O VAL A 32 5.648 20.825 2.838 1.00 0.48 O ATOM 714 CB VAL A 32 3.398 23.112 2.673 1.00 0.57 C ATOM 715 CG1 VAL A 32 2.236 22.153 2.761 1.00 0.60 C ATOM 716 CG2 VAL A 32 3.989 23.381 4.037 1.00 0.85 C ATOM 0 H VAL A 32 3.092 22.849 0.172 1.00 0.50 H new ATOM 0 HA VAL A 32 5.380 23.193 1.893 1.00 0.50 H new ATOM 0 HB VAL A 32 3.011 24.050 2.275 1.00 0.57 H new ATOM 0 HG11 VAL A 32 1.490 22.548 3.450 1.00 0.60 H new ATOM 0 HG12 VAL A 32 1.790 22.031 1.774 1.00 0.60 H new ATOM 0 HG13 VAL A 32 2.588 21.187 3.122 1.00 0.60 H new ATOM 0 HG21 VAL A 32 3.209 23.743 4.707 1.00 0.85 H new ATOM 0 HG22 VAL A 32 4.413 22.460 4.438 1.00 0.85 H new ATOM 0 HG23 VAL A 32 4.772 24.134 3.952 1.00 0.85 H new ATOM 720 N LEU A 33 4.202 20.218 1.218 1.00 0.48 N ATOM 721 CA LEU A 33 4.614 18.817 1.207 1.00 0.49 C ATOM 722 C LEU A 33 6.091 18.716 0.844 1.00 0.50 C ATOM 723 O LEU A 33 6.858 18.011 1.495 1.00 0.54 O ATOM 724 CB LEU A 33 3.800 18.025 0.178 1.00 0.53 C ATOM 725 CG LEU A 33 2.494 17.376 0.659 1.00 0.58 C ATOM 726 CD1 LEU A 33 2.760 16.413 1.796 1.00 0.98 C ATOM 727 CD2 LEU A 33 1.462 18.410 1.064 1.00 0.74 C ATOM 0 H LEU A 33 3.412 20.429 0.608 1.00 0.48 H new ATOM 0 HA LEU A 33 4.443 18.403 2.200 1.00 0.49 H new ATOM 0 HB2 LEU A 33 3.559 18.694 -0.648 1.00 0.53 H new ATOM 0 HB3 LEU A 33 4.439 17.239 -0.224 1.00 0.53 H new ATOM 0 HG LEU A 33 2.082 16.818 -0.182 1.00 0.58 H new ATOM 0 HD11 LEU A 33 1.821 15.965 2.121 1.00 0.98 H new ATOM 0 HD12 LEU A 33 3.438 15.629 1.458 1.00 0.98 H new ATOM 0 HD13 LEU A 33 3.213 16.950 2.629 1.00 0.98 H new ATOM 0 HD21 LEU A 33 0.554 17.907 1.397 1.00 0.74 H new ATOM 0 HD22 LEU A 33 1.858 19.020 1.876 1.00 0.74 H new ATOM 0 HD23 LEU A 33 1.231 19.047 0.210 1.00 0.74 H new ATOM 739 N LYS A 34 6.471 19.444 -0.204 1.00 0.51 N ATOM 740 CA LYS A 34 7.850 19.479 -0.685 1.00 0.56 C ATOM 741 C LYS A 34 8.801 19.926 0.431 1.00 0.53 C ATOM 742 O LYS A 34 9.966 19.523 0.483 1.00 0.59 O ATOM 743 CB LYS A 34 7.934 20.429 -1.887 1.00 0.65 C ATOM 744 CG LYS A 34 9.328 20.614 -2.459 1.00 0.93 C ATOM 745 CD LYS A 34 9.374 21.761 -3.463 1.00 0.89 C ATOM 746 CE LYS A 34 8.436 21.533 -4.642 1.00 1.70 C ATOM 747 NZ LYS A 34 8.417 22.698 -5.567 1.00 2.41 N ATOM 0 H LYS A 34 5.831 20.027 -0.744 1.00 0.51 H new ATOM 0 HA LYS A 34 8.153 18.479 -0.994 1.00 0.56 H new ATOM 0 HB2 LYS A 34 7.281 20.054 -2.675 1.00 0.65 H new ATOM 0 HB3 LYS A 34 7.547 21.403 -1.589 1.00 0.65 H new ATOM 0 HG2 LYS A 34 10.031 20.810 -1.650 1.00 0.93 H new ATOM 0 HG3 LYS A 34 9.649 19.692 -2.944 1.00 0.93 H new ATOM 0 HD2 LYS A 34 9.105 22.691 -2.962 1.00 0.89 H new ATOM 0 HD3 LYS A 34 10.394 21.880 -3.830 1.00 0.89 H new ATOM 0 HE2 LYS A 34 8.747 20.642 -5.187 1.00 1.70 H new ATOM 0 HE3 LYS A 34 7.428 21.345 -4.273 1.00 1.70 H new ATOM 0 HZ1 LYS A 34 7.768 22.504 -6.356 1.00 2.41 H new ATOM 0 HZ2 LYS A 34 8.096 23.544 -5.054 1.00 2.41 H new ATOM 0 HZ3 LYS A 34 9.374 22.862 -5.939 1.00 2.41 H new ATOM 761 N GLU A 35 8.283 20.745 1.327 1.00 0.47 N ATOM 762 CA GLU A 35 9.042 21.239 2.463 1.00 0.47 C ATOM 763 C GLU A 35 9.128 20.188 3.571 1.00 0.46 C ATOM 764 O GLU A 35 10.145 20.090 4.255 1.00 0.57 O ATOM 765 CB GLU A 35 8.406 22.522 2.987 1.00 0.47 C ATOM 766 CG GLU A 35 8.443 23.658 1.977 1.00 0.61 C ATOM 767 CD GLU A 35 9.857 24.079 1.637 1.00 1.26 C ATOM 768 OE1 GLU A 35 10.406 24.944 2.351 1.00 1.47 O ATOM 769 OE2 GLU A 35 10.430 23.542 0.662 1.00 1.96 O ATOM 0 H GLU A 35 7.323 21.088 1.289 1.00 0.47 H new ATOM 0 HA GLU A 35 10.059 21.453 2.134 1.00 0.47 H new ATOM 0 HB2 GLU A 35 7.371 22.322 3.263 1.00 0.47 H new ATOM 0 HB3 GLU A 35 8.923 22.833 3.895 1.00 0.47 H new ATOM 0 HG2 GLU A 35 7.930 23.349 1.067 1.00 0.61 H new ATOM 0 HG3 GLU A 35 7.898 24.513 2.376 1.00 0.61 H new ATOM 776 N VAL A 36 8.075 19.397 3.728 1.00 0.41 N ATOM 777 CA VAL A 36 8.052 18.326 4.726 1.00 0.42 C ATOM 778 C VAL A 36 8.981 17.185 4.308 1.00 0.50 C ATOM 779 O VAL A 36 9.818 16.727 5.084 1.00 0.62 O ATOM 780 CB VAL A 36 6.620 17.783 4.922 1.00 0.43 C ATOM 781 CG1 VAL A 36 6.609 16.580 5.853 1.00 0.98 C ATOM 782 CG2 VAL A 36 5.710 18.877 5.459 1.00 0.74 C ATOM 0 H VAL A 36 7.220 19.474 3.177 1.00 0.41 H new ATOM 0 HA VAL A 36 8.399 18.744 5.671 1.00 0.42 H new ATOM 0 HB VAL A 36 6.247 17.458 3.951 1.00 0.43 H new ATOM 0 HG11 VAL A 36 5.587 16.221 5.971 1.00 0.98 H new ATOM 0 HG12 VAL A 36 7.226 15.787 5.430 1.00 0.98 H new ATOM 0 HG13 VAL A 36 7.007 16.869 6.826 1.00 0.98 H new ATOM 0 HG21 VAL A 36 4.704 18.480 5.592 1.00 0.74 H new ATOM 0 HG22 VAL A 36 6.091 19.229 6.417 1.00 0.74 H new ATOM 0 HG23 VAL A 36 5.682 19.707 4.752 1.00 0.74 H new ATOM 786 N PHE A 37 8.831 16.751 3.068 1.00 0.49 N ATOM 787 CA PHE A 37 9.675 15.730 2.469 1.00 0.54 C ATOM 788 C PHE A 37 11.155 16.092 2.482 1.00 0.59 C ATOM 789 O PHE A 37 12.012 15.207 2.445 1.00 0.66 O ATOM 790 CB PHE A 37 9.190 15.484 1.047 1.00 0.57 C ATOM 791 CG PHE A 37 7.905 14.702 1.055 1.00 0.57 C ATOM 792 CD1 PHE A 37 7.827 13.457 1.650 1.00 0.66 C ATOM 793 CD2 PHE A 37 6.779 15.207 0.423 1.00 0.74 C ATOM 794 CE1 PHE A 37 6.653 12.733 1.619 1.00 0.68 C ATOM 795 CE2 PHE A 37 5.600 14.488 0.393 1.00 0.83 C ATOM 796 CZ PHE A 37 5.530 13.263 1.152 1.00 0.71 C ATOM 0 H PHE A 37 8.109 17.103 2.440 1.00 0.49 H new ATOM 0 HA PHE A 37 9.591 14.823 3.067 1.00 0.54 H new ATOM 0 HB2 PHE A 37 9.040 16.436 0.538 1.00 0.57 H new ATOM 0 HB3 PHE A 37 9.950 14.940 0.487 1.00 0.57 H new ATOM 0 HD1 PHE A 37 8.695 13.046 2.145 1.00 0.66 H new ATOM 0 HD2 PHE A 37 6.824 16.176 -0.052 1.00 0.74 H new ATOM 0 HE1 PHE A 37 6.648 11.716 1.982 1.00 0.68 H new ATOM 0 HE2 PHE A 37 4.754 14.833 -0.183 1.00 0.83 H new ATOM 0 HZ PHE A 37 4.579 12.785 1.337 1.00 0.71 H new ATOM 806 N LYS A 38 11.473 17.379 2.533 1.00 0.60 N ATOM 807 CA LYS A 38 12.870 17.780 2.626 1.00 0.69 C ATOM 808 C LYS A 38 13.232 18.167 4.059 1.00 0.78 C ATOM 809 O LYS A 38 14.260 18.795 4.306 1.00 1.02 O ATOM 810 CB LYS A 38 13.194 18.922 1.660 1.00 0.75 C ATOM 811 CG LYS A 38 13.135 18.525 0.191 1.00 0.76 C ATOM 812 CD LYS A 38 13.656 19.635 -0.718 1.00 0.91 C ATOM 813 CE LYS A 38 12.595 20.683 -1.043 1.00 1.37 C ATOM 814 NZ LYS A 38 12.048 21.357 0.167 1.00 2.18 N ATOM 0 H LYS A 38 10.801 18.146 2.512 1.00 0.60 H new ATOM 0 HA LYS A 38 13.476 16.921 2.338 1.00 0.69 H new ATOM 0 HB2 LYS A 38 12.495 19.740 1.833 1.00 0.75 H new ATOM 0 HB3 LYS A 38 14.191 19.302 1.884 1.00 0.75 H new ATOM 0 HG2 LYS A 38 13.724 17.621 0.035 1.00 0.76 H new ATOM 0 HG3 LYS A 38 12.107 18.286 -0.080 1.00 0.76 H new ATOM 0 HD2 LYS A 38 14.505 20.122 -0.239 1.00 0.91 H new ATOM 0 HD3 LYS A 38 14.022 19.196 -1.646 1.00 0.91 H new ATOM 0 HE2 LYS A 38 13.026 21.433 -1.706 1.00 1.37 H new ATOM 0 HE3 LYS A 38 11.779 20.208 -1.587 1.00 1.37 H new ATOM 0 HZ1 LYS A 38 11.683 22.295 -0.093 1.00 2.18 H new ATOM 0 HZ2 LYS A 38 11.277 20.784 0.565 1.00 2.18 H new ATOM 0 HZ3 LYS A 38 12.802 21.463 0.876 1.00 2.18 H new ATOM 828 N ALA A 39 12.370 17.801 4.997 1.00 0.71 N ATOM 829 CA ALA A 39 12.614 18.059 6.408 1.00 0.87 C ATOM 830 C ALA A 39 12.635 16.757 7.199 1.00 0.82 C ATOM 831 O ALA A 39 12.375 16.743 8.403 1.00 1.56 O ATOM 832 CB ALA A 39 11.567 19.010 6.969 1.00 1.06 C ATOM 0 H ALA A 39 11.491 17.322 4.804 1.00 0.71 H new ATOM 0 HA ALA A 39 13.592 18.531 6.503 1.00 0.87 H new ATOM 0 HB1 ALA A 39 11.768 19.190 8.025 1.00 1.06 H new ATOM 0 HB2 ALA A 39 11.605 19.955 6.426 1.00 1.06 H new ATOM 0 HB3 ALA A 39 10.577 18.568 6.858 1.00 1.06 H new ATOM 838 N GLY A 40 12.917 15.660 6.510 1.00 0.78 N ATOM 839 CA GLY A 40 13.079 14.382 7.178 1.00 1.03 C ATOM 840 C GLY A 40 14.483 14.207 7.731 1.00 1.29 C ATOM 841 O GLY A 40 15.124 15.188 8.103 1.00 1.54 O ATOM 0 H GLY A 40 13.037 15.631 5.497 1.00 0.78 H new ATOM 0 HA2 GLY A 40 12.356 14.302 7.990 1.00 1.03 H new ATOM 0 HA3 GLY A 40 12.861 13.576 6.477 1.00 1.03 H new ATOM 845 N PRO A 41 14.997 12.969 7.813 1.00 1.37 N ATOM 846 CA PRO A 41 14.271 11.752 7.453 1.00 1.22 C ATOM 847 C PRO A 41 13.305 11.316 8.549 1.00 1.09 C ATOM 848 O PRO A 41 13.404 11.761 9.695 1.00 1.18 O ATOM 849 CB PRO A 41 15.380 10.701 7.275 1.00 1.37 C ATOM 850 CG PRO A 41 16.676 11.424 7.470 1.00 1.60 C ATOM 851 CD PRO A 41 16.352 12.653 8.263 1.00 1.68 C ATOM 0 HA PRO A 41 13.659 11.895 6.563 1.00 1.22 H new ATOM 0 HB2 PRO A 41 15.272 9.894 8.000 1.00 1.37 H new ATOM 0 HB3 PRO A 41 15.332 10.248 6.285 1.00 1.37 H new ATOM 0 HG2 PRO A 41 17.396 10.798 7.998 1.00 1.60 H new ATOM 0 HG3 PRO A 41 17.124 11.686 6.511 1.00 1.60 H new ATOM 0 HD2 PRO A 41 16.390 12.466 9.336 1.00 1.68 H new ATOM 0 HD3 PRO A 41 17.049 13.465 8.056 1.00 1.68 H new ATOM 859 N TYR A 42 12.370 10.455 8.187 1.00 0.99 N ATOM 860 CA TYR A 42 11.366 9.970 9.118 1.00 0.92 C ATOM 861 C TYR A 42 11.474 8.465 9.268 1.00 0.97 C ATOM 862 O TYR A 42 11.608 7.735 8.288 1.00 1.08 O ATOM 863 CB TYR A 42 9.964 10.360 8.639 1.00 0.85 C ATOM 864 CG TYR A 42 9.791 11.852 8.452 1.00 0.87 C ATOM 865 CD1 TYR A 42 10.110 12.739 9.472 1.00 0.90 C ATOM 866 CD2 TYR A 42 9.310 12.371 7.257 1.00 0.99 C ATOM 867 CE1 TYR A 42 9.956 14.100 9.307 1.00 1.02 C ATOM 868 CE2 TYR A 42 9.152 13.733 7.085 1.00 1.10 C ATOM 869 CZ TYR A 42 9.477 14.592 8.114 1.00 1.12 C ATOM 870 OH TYR A 42 9.327 15.947 7.950 1.00 1.28 O ATOM 0 H TYR A 42 12.285 10.074 7.245 1.00 0.99 H new ATOM 0 HA TYR A 42 11.540 10.430 10.091 1.00 0.92 H new ATOM 0 HB2 TYR A 42 9.756 9.856 7.695 1.00 0.85 H new ATOM 0 HB3 TYR A 42 9.228 10.003 9.360 1.00 0.85 H new ATOM 0 HD1 TYR A 42 10.485 12.357 10.410 1.00 0.90 H new ATOM 0 HD2 TYR A 42 9.056 11.700 6.450 1.00 0.99 H new ATOM 0 HE1 TYR A 42 10.210 14.776 10.110 1.00 1.02 H new ATOM 0 HE2 TYR A 42 8.776 14.123 6.150 1.00 1.10 H new ATOM 0 HH TYR A 42 9.485 16.182 7.012 1.00 1.28 H new ATOM 880 N LYS A 43 11.432 8.023 10.507 1.00 0.96 N ATOM 881 CA LYS A 43 11.518 6.612 10.836 1.00 1.01 C ATOM 882 C LYS A 43 10.127 6.009 10.901 1.00 0.98 C ATOM 883 O LYS A 43 9.961 4.796 11.053 1.00 1.06 O ATOM 884 CB LYS A 43 12.227 6.448 12.179 1.00 1.10 C ATOM 885 CG LYS A 43 13.668 6.937 12.163 1.00 1.72 C ATOM 886 CD LYS A 43 14.270 6.986 13.558 1.00 2.26 C ATOM 887 CE LYS A 43 13.572 8.018 14.430 1.00 2.94 C ATOM 888 NZ LYS A 43 14.229 8.165 15.753 1.00 3.51 N ATOM 0 H LYS A 43 11.337 8.633 11.319 1.00 0.96 H new ATOM 0 HA LYS A 43 12.086 6.093 10.064 1.00 1.01 H new ATOM 0 HB2 LYS A 43 11.674 6.994 12.943 1.00 1.10 H new ATOM 0 HB3 LYS A 43 12.211 5.396 12.464 1.00 1.10 H new ATOM 0 HG2 LYS A 43 14.267 6.279 11.533 1.00 1.72 H new ATOM 0 HG3 LYS A 43 13.709 7.930 11.716 1.00 1.72 H new ATOM 0 HD2 LYS A 43 14.193 6.003 14.023 1.00 2.26 H new ATOM 0 HD3 LYS A 43 15.331 7.224 13.489 1.00 2.26 H new ATOM 0 HE2 LYS A 43 13.567 8.981 13.919 1.00 2.94 H new ATOM 0 HE3 LYS A 43 12.531 7.728 14.573 1.00 2.94 H new ATOM 0 HZ1 LYS A 43 13.722 8.878 16.315 1.00 3.51 H new ATOM 0 HZ2 LYS A 43 14.211 7.253 16.253 1.00 3.51 H new ATOM 0 HZ3 LYS A 43 15.215 8.467 15.619 1.00 3.51 H new ATOM 902 N ASN A 44 9.125 6.867 10.785 1.00 0.88 N ATOM 903 CA ASN A 44 7.738 6.449 10.851 1.00 0.85 C ATOM 904 C ASN A 44 6.864 7.463 10.127 1.00 0.80 C ATOM 905 O ASN A 44 7.181 8.655 10.079 1.00 0.85 O ATOM 906 CB ASN A 44 7.305 6.331 12.313 1.00 0.89 C ATOM 907 CG ASN A 44 7.492 7.630 13.064 1.00 0.95 C ATOM 908 OD1 ASN A 44 6.564 8.430 13.190 1.00 1.52 O ATOM 909 ND2 ASN A 44 8.701 7.858 13.552 1.00 1.10 N ATOM 0 H ASN A 44 9.252 7.869 10.643 1.00 0.88 H new ATOM 0 HA ASN A 44 7.628 5.477 10.370 1.00 0.85 H new ATOM 0 HB2 ASN A 44 6.257 6.033 12.358 1.00 0.89 H new ATOM 0 HB3 ASN A 44 7.881 5.544 12.800 1.00 0.89 H new ATOM 0 HD21 ASN A 44 8.893 8.724 14.056 1.00 1.10 H new ATOM 0 HD22 ASN A 44 9.441 7.168 13.425 1.00 1.10 H new ATOM 916 N THR A 45 5.764 6.975 9.571 1.00 0.77 N ATOM 917 CA THR A 45 4.850 7.795 8.788 1.00 0.76 C ATOM 918 C THR A 45 4.247 8.925 9.632 1.00 0.74 C ATOM 919 O THR A 45 3.882 9.977 9.109 1.00 0.92 O ATOM 920 CB THR A 45 3.711 6.926 8.220 1.00 0.84 C ATOM 921 OG1 THR A 45 4.246 5.711 7.668 1.00 1.05 O ATOM 922 CG2 THR A 45 2.934 7.674 7.148 1.00 1.18 C ATOM 0 H THR A 45 5.480 5.999 9.650 1.00 0.77 H new ATOM 0 HA THR A 45 5.422 8.237 7.972 1.00 0.76 H new ATOM 0 HB THR A 45 3.030 6.687 9.037 1.00 0.84 H new ATOM 0 HG1 THR A 45 4.739 5.915 6.846 1.00 1.05 H new ATOM 0 HG21 THR A 45 2.137 7.037 6.765 1.00 1.18 H new ATOM 0 HG22 THR A 45 2.502 8.578 7.576 1.00 1.18 H new ATOM 0 HG23 THR A 45 3.606 7.944 6.333 1.00 1.18 H new ATOM 930 N GLU A 46 4.168 8.697 10.939 1.00 0.72 N ATOM 931 CA GLU A 46 3.576 9.658 11.865 1.00 0.71 C ATOM 932 C GLU A 46 4.396 10.941 11.952 1.00 0.66 C ATOM 933 O GLU A 46 3.836 12.021 12.125 1.00 0.65 O ATOM 934 CB GLU A 46 3.435 9.029 13.248 1.00 0.79 C ATOM 935 CG GLU A 46 2.564 7.785 13.255 1.00 1.41 C ATOM 936 CD GLU A 46 2.482 7.143 14.619 1.00 1.82 C ATOM 937 OE1 GLU A 46 3.373 6.337 14.953 1.00 2.24 O ATOM 938 OE2 GLU A 46 1.525 7.440 15.364 1.00 2.12 O ATOM 0 H GLU A 46 4.510 7.846 11.385 1.00 0.72 H new ATOM 0 HA GLU A 46 2.590 9.924 11.484 1.00 0.71 H new ATOM 0 HB2 GLU A 46 4.425 8.773 13.626 1.00 0.79 H new ATOM 0 HB3 GLU A 46 3.012 9.764 13.933 1.00 0.79 H new ATOM 0 HG2 GLU A 46 1.560 8.046 12.919 1.00 1.41 H new ATOM 0 HG3 GLU A 46 2.961 7.064 12.541 1.00 1.41 H new ATOM 945 N GLU A 47 5.711 10.828 11.818 1.00 0.67 N ATOM 946 CA GLU A 47 6.579 12.001 11.844 1.00 0.67 C ATOM 947 C GLU A 47 6.269 12.932 10.677 1.00 0.60 C ATOM 948 O GLU A 47 6.333 14.155 10.810 1.00 0.58 O ATOM 949 CB GLU A 47 8.050 11.590 11.809 1.00 0.73 C ATOM 950 CG GLU A 47 8.551 11.013 13.115 1.00 0.98 C ATOM 951 CD GLU A 47 10.045 10.771 13.102 1.00 1.64 C ATOM 952 OE1 GLU A 47 10.500 9.891 12.342 1.00 2.26 O ATOM 953 OE2 GLU A 47 10.774 11.464 13.844 1.00 2.03 O ATOM 0 H GLU A 47 6.199 9.942 11.691 1.00 0.67 H new ATOM 0 HA GLU A 47 6.389 12.535 12.775 1.00 0.67 H new ATOM 0 HB2 GLU A 47 8.194 10.854 11.018 1.00 0.73 H new ATOM 0 HB3 GLU A 47 8.655 12.459 11.550 1.00 0.73 H new ATOM 0 HG2 GLU A 47 8.303 11.694 13.929 1.00 0.98 H new ATOM 0 HG3 GLU A 47 8.035 10.074 13.316 1.00 0.98 H new ATOM 960 N SER A 48 5.918 12.348 9.540 1.00 0.58 N ATOM 961 CA SER A 48 5.542 13.128 8.373 1.00 0.54 C ATOM 962 C SER A 48 4.201 13.809 8.622 1.00 0.51 C ATOM 963 O SER A 48 3.974 14.937 8.185 1.00 0.49 O ATOM 964 CB SER A 48 5.462 12.228 7.138 1.00 0.57 C ATOM 965 OG SER A 48 5.299 12.987 5.949 1.00 1.19 O ATOM 0 H SER A 48 5.886 11.338 9.402 1.00 0.58 H new ATOM 0 HA SER A 48 6.299 13.891 8.194 1.00 0.54 H new ATOM 0 HB2 SER A 48 6.368 11.627 7.066 1.00 0.57 H new ATOM 0 HB3 SER A 48 4.628 11.535 7.245 1.00 0.57 H new ATOM 0 HG SER A 48 4.940 12.413 5.241 1.00 1.19 H new ATOM 971 N ILE A 49 3.325 13.113 9.335 1.00 0.51 N ATOM 972 CA ILE A 49 2.021 13.649 9.695 1.00 0.49 C ATOM 973 C ILE A 49 2.183 14.818 10.657 1.00 0.49 C ATOM 974 O ILE A 49 1.536 15.854 10.514 1.00 0.47 O ATOM 975 CB ILE A 49 1.135 12.558 10.335 1.00 0.51 C ATOM 976 CG1 ILE A 49 0.888 11.424 9.332 1.00 0.52 C ATOM 977 CG2 ILE A 49 -0.183 13.147 10.821 1.00 0.50 C ATOM 978 CD1 ILE A 49 0.079 10.274 9.893 1.00 0.55 C ATOM 0 H ILE A 49 3.497 12.168 9.677 1.00 0.51 H new ATOM 0 HA ILE A 49 1.533 13.999 8.785 1.00 0.49 H new ATOM 0 HB ILE A 49 1.657 12.149 11.200 1.00 0.51 H new ATOM 0 HG12 ILE A 49 0.371 11.828 8.462 1.00 0.52 H new ATOM 0 HG13 ILE A 49 1.849 11.044 8.984 1.00 0.52 H new ATOM 0 HG21 ILE A 49 -0.790 12.360 11.268 1.00 0.50 H new ATOM 0 HG22 ILE A 49 0.016 13.919 11.565 1.00 0.50 H new ATOM 0 HG23 ILE A 49 -0.719 13.584 9.979 1.00 0.50 H new ATOM 0 HD11 ILE A 49 -0.053 9.513 9.124 1.00 0.55 H new ATOM 0 HD12 ILE A 49 0.603 9.842 10.745 1.00 0.55 H new ATOM 0 HD13 ILE A 49 -0.897 10.638 10.214 1.00 0.55 H new ATOM 985 N ALA A 50 3.071 14.637 11.624 1.00 0.52 N ATOM 986 CA ALA A 50 3.400 15.673 12.592 1.00 0.53 C ATOM 987 C ALA A 50 3.935 16.921 11.901 1.00 0.50 C ATOM 988 O ALA A 50 3.465 18.034 12.156 1.00 0.50 O ATOM 989 CB ALA A 50 4.431 15.142 13.565 1.00 0.57 C ATOM 0 H ALA A 50 3.584 13.766 11.760 1.00 0.52 H new ATOM 0 HA ALA A 50 2.492 15.947 13.128 1.00 0.53 H new ATOM 0 HB1 ALA A 50 4.679 15.916 14.291 1.00 0.57 H new ATOM 0 HB2 ALA A 50 4.027 14.273 14.085 1.00 0.57 H new ATOM 0 HB3 ALA A 50 5.330 14.854 13.021 1.00 0.57 H new ATOM 995 N ALA A 51 4.920 16.729 11.030 1.00 0.49 N ATOM 996 CA ALA A 51 5.514 17.832 10.288 1.00 0.48 C ATOM 997 C ALA A 51 4.461 18.552 9.455 1.00 0.45 C ATOM 998 O ALA A 51 4.451 19.780 9.366 1.00 0.47 O ATOM 999 CB ALA A 51 6.634 17.318 9.397 1.00 0.50 C ATOM 0 H ALA A 51 5.324 15.816 10.821 1.00 0.49 H new ATOM 0 HA ALA A 51 5.929 18.545 11.001 1.00 0.48 H new ATOM 0 HB1 ALA A 51 7.072 18.150 8.846 1.00 0.50 H new ATOM 0 HB2 ALA A 51 7.401 16.846 10.012 1.00 0.50 H new ATOM 0 HB3 ALA A 51 6.233 16.588 8.693 1.00 0.50 H new ATOM 1005 N LEU A 52 3.562 17.771 8.864 1.00 0.42 N ATOM 1006 CA LEU A 52 2.484 18.320 8.052 1.00 0.40 C ATOM 1007 C LEU A 52 1.482 19.080 8.903 1.00 0.39 C ATOM 1008 O LEU A 52 0.972 20.105 8.475 1.00 0.40 O ATOM 1009 CB LEU A 52 1.775 17.222 7.259 1.00 0.40 C ATOM 1010 CG LEU A 52 2.324 16.966 5.859 1.00 0.41 C ATOM 1011 CD1 LEU A 52 1.702 15.712 5.267 1.00 0.45 C ATOM 1012 CD2 LEU A 52 2.048 18.164 4.963 1.00 0.41 C ATOM 0 H LEU A 52 3.560 16.753 8.933 1.00 0.42 H new ATOM 0 HA LEU A 52 2.935 19.019 7.348 1.00 0.40 H new ATOM 0 HB2 LEU A 52 1.830 16.294 7.828 1.00 0.40 H new ATOM 0 HB3 LEU A 52 0.720 17.482 7.175 1.00 0.40 H new ATOM 0 HG LEU A 52 3.402 16.818 5.928 1.00 0.41 H new ATOM 0 HD11 LEU A 52 2.104 15.543 4.268 1.00 0.45 H new ATOM 0 HD12 LEU A 52 1.934 14.856 5.901 1.00 0.45 H new ATOM 0 HD13 LEU A 52 0.621 15.836 5.207 1.00 0.45 H new ATOM 0 HD21 LEU A 52 2.444 17.971 3.966 1.00 0.41 H new ATOM 0 HD22 LEU A 52 0.973 18.332 4.901 1.00 0.41 H new ATOM 0 HD23 LEU A 52 2.529 19.049 5.380 1.00 0.41 H new ATOM 1024 N LYS A 53 1.203 18.588 10.100 1.00 0.39 N ATOM 1025 CA LYS A 53 0.303 19.289 11.005 1.00 0.39 C ATOM 1026 C LYS A 53 0.857 20.665 11.363 1.00 0.40 C ATOM 1027 O LYS A 53 0.114 21.642 11.461 1.00 0.45 O ATOM 1028 CB LYS A 53 0.070 18.475 12.275 1.00 0.41 C ATOM 1029 CG LYS A 53 -0.877 17.303 12.090 1.00 0.42 C ATOM 1030 CD LYS A 53 -1.085 16.572 13.403 1.00 0.52 C ATOM 1031 CE LYS A 53 -2.141 15.487 13.286 1.00 0.52 C ATOM 1032 NZ LYS A 53 -2.411 14.841 14.600 1.00 1.22 N ATOM 0 H LYS A 53 1.582 17.715 10.466 1.00 0.39 H new ATOM 0 HA LYS A 53 -0.650 19.419 10.493 1.00 0.39 H new ATOM 0 HB2 LYS A 53 1.028 18.102 12.636 1.00 0.41 H new ATOM 0 HB3 LYS A 53 -0.328 19.132 13.048 1.00 0.41 H new ATOM 0 HG2 LYS A 53 -1.835 17.659 11.710 1.00 0.42 H new ATOM 0 HG3 LYS A 53 -0.474 16.617 11.345 1.00 0.42 H new ATOM 0 HD2 LYS A 53 -0.143 16.128 13.725 1.00 0.52 H new ATOM 0 HD3 LYS A 53 -1.381 17.285 14.173 1.00 0.52 H new ATOM 0 HE2 LYS A 53 -3.063 15.917 12.895 1.00 0.52 H new ATOM 0 HE3 LYS A 53 -1.812 14.734 12.570 1.00 0.52 H new ATOM 0 HZ1 LYS A 53 -3.388 14.485 14.617 1.00 1.22 H new ATOM 0 HZ2 LYS A 53 -1.751 14.049 14.740 1.00 1.22 H new ATOM 0 HZ3 LYS A 53 -2.283 15.537 15.362 1.00 1.22 H new ATOM 1046 N LYS A 54 2.170 20.732 11.553 1.00 0.39 N ATOM 1047 CA LYS A 54 2.837 21.987 11.875 1.00 0.41 C ATOM 1048 C LYS A 54 2.823 22.935 10.672 1.00 0.41 C ATOM 1049 O LYS A 54 2.430 24.100 10.784 1.00 0.47 O ATOM 1050 CB LYS A 54 4.279 21.713 12.320 1.00 0.44 C ATOM 1051 CG LYS A 54 5.066 22.967 12.669 1.00 1.24 C ATOM 1052 CD LYS A 54 4.434 23.731 13.824 1.00 1.63 C ATOM 1053 CE LYS A 54 4.502 22.952 15.128 1.00 2.24 C ATOM 1054 NZ LYS A 54 3.909 23.716 16.258 1.00 3.05 N ATOM 0 H LYS A 54 2.795 19.928 11.489 1.00 0.39 H new ATOM 0 HA LYS A 54 2.297 22.467 12.692 1.00 0.41 H new ATOM 0 HB2 LYS A 54 4.262 21.054 13.188 1.00 0.44 H new ATOM 0 HB3 LYS A 54 4.799 21.179 11.524 1.00 0.44 H new ATOM 0 HG2 LYS A 54 6.088 22.693 12.931 1.00 1.24 H new ATOM 0 HG3 LYS A 54 5.124 23.614 11.794 1.00 1.24 H new ATOM 0 HD2 LYS A 54 4.942 24.688 13.947 1.00 1.63 H new ATOM 0 HD3 LYS A 54 3.393 23.951 13.587 1.00 1.63 H new ATOM 0 HE2 LYS A 54 3.975 22.005 15.014 1.00 2.24 H new ATOM 0 HE3 LYS A 54 5.541 22.714 15.356 1.00 2.24 H new ATOM 0 HZ1 LYS A 54 3.974 23.153 17.130 1.00 3.05 H new ATOM 0 HZ2 LYS A 54 4.427 24.609 16.383 1.00 3.05 H new ATOM 0 HZ3 LYS A 54 2.911 23.922 16.052 1.00 3.05 H new ATOM 1068 N LYS A 55 3.249 22.421 9.528 1.00 0.42 N ATOM 1069 CA LYS A 55 3.314 23.194 8.294 1.00 0.48 C ATOM 1070 C LYS A 55 1.928 23.585 7.780 1.00 0.47 C ATOM 1071 O LYS A 55 1.722 24.726 7.362 1.00 0.58 O ATOM 1072 CB LYS A 55 4.062 22.403 7.225 1.00 0.55 C ATOM 1073 CG LYS A 55 5.563 22.324 7.440 1.00 1.23 C ATOM 1074 CD LYS A 55 6.219 23.676 7.230 1.00 1.16 C ATOM 1075 CE LYS A 55 7.359 23.588 6.230 1.00 1.03 C ATOM 1076 NZ LYS A 55 8.047 24.893 6.054 1.00 1.48 N ATOM 0 H LYS A 55 3.560 21.455 9.428 1.00 0.42 H new ATOM 0 HA LYS A 55 3.850 24.117 8.515 1.00 0.48 H new ATOM 0 HB2 LYS A 55 3.658 21.391 7.190 1.00 0.55 H new ATOM 0 HB3 LYS A 55 3.870 22.857 6.253 1.00 0.55 H new ATOM 0 HG2 LYS A 55 5.770 21.969 8.450 1.00 1.23 H new ATOM 0 HG3 LYS A 55 5.994 21.597 6.752 1.00 1.23 H new ATOM 0 HD2 LYS A 55 5.477 24.392 6.876 1.00 1.16 H new ATOM 0 HD3 LYS A 55 6.595 24.051 8.182 1.00 1.16 H new ATOM 0 HE2 LYS A 55 8.079 22.841 6.565 1.00 1.03 H new ATOM 0 HE3 LYS A 55 6.973 23.249 5.269 1.00 1.03 H new ATOM 0 HZ1 LYS A 55 8.818 24.789 5.364 1.00 1.48 H new ATOM 0 HZ2 LYS A 55 7.367 25.600 5.709 1.00 1.48 H new ATOM 0 HZ3 LYS A 55 8.439 25.205 6.966 1.00 1.48 H new ATOM 1090 N SER A 56 0.986 22.667 7.798 1.00 0.39 N ATOM 1091 CA SER A 56 -0.361 22.964 7.339 1.00 0.39 C ATOM 1092 C SER A 56 -1.379 22.115 8.089 1.00 0.38 C ATOM 1093 O SER A 56 -1.600 20.954 7.744 1.00 0.38 O ATOM 1094 CB SER A 56 -0.477 22.737 5.828 1.00 0.40 C ATOM 1095 OG SER A 56 0.377 23.616 5.110 1.00 1.16 O ATOM 0 H SER A 56 1.123 21.710 8.124 1.00 0.39 H new ATOM 0 HA SER A 56 -0.572 24.014 7.544 1.00 0.39 H new ATOM 0 HB2 SER A 56 -0.221 21.704 5.592 1.00 0.40 H new ATOM 0 HB3 SER A 56 -1.509 22.890 5.513 1.00 0.40 H new ATOM 0 HG SER A 56 0.837 24.211 5.738 1.00 1.16 H new ATOM 1101 N PRO A 57 -1.988 22.696 9.140 1.00 0.41 N ATOM 1102 CA PRO A 57 -2.857 21.978 10.082 1.00 0.43 C ATOM 1103 C PRO A 57 -3.781 20.976 9.404 1.00 0.44 C ATOM 1104 O PRO A 57 -3.783 19.782 9.725 1.00 0.45 O ATOM 1105 CB PRO A 57 -3.683 23.106 10.694 1.00 0.48 C ATOM 1106 CG PRO A 57 -2.769 24.282 10.693 1.00 0.58 C ATOM 1107 CD PRO A 57 -1.876 24.127 9.489 1.00 0.45 C ATOM 0 HA PRO A 57 -2.280 21.387 10.793 1.00 0.43 H new ATOM 0 HB2 PRO A 57 -4.582 23.302 10.109 1.00 0.48 H new ATOM 0 HB3 PRO A 57 -4.008 22.857 11.704 1.00 0.48 H new ATOM 0 HG2 PRO A 57 -3.334 25.213 10.640 1.00 0.58 H new ATOM 0 HG3 PRO A 57 -2.181 24.318 11.610 1.00 0.58 H new ATOM 0 HD2 PRO A 57 -2.201 24.765 8.667 1.00 0.45 H new ATOM 0 HD3 PRO A 57 -0.846 24.402 9.718 1.00 0.45 H new ATOM 1115 N GLU A 58 -4.557 21.492 8.458 1.00 0.47 N ATOM 1116 CA GLU A 58 -5.540 20.709 7.726 1.00 0.51 C ATOM 1117 C GLU A 58 -4.900 19.577 6.934 1.00 0.47 C ATOM 1118 O GLU A 58 -5.489 18.507 6.818 1.00 0.47 O ATOM 1119 CB GLU A 58 -6.325 21.609 6.779 1.00 0.65 C ATOM 1120 CG GLU A 58 -6.948 22.811 7.462 1.00 1.44 C ATOM 1121 CD GLU A 58 -7.563 23.771 6.473 1.00 1.92 C ATOM 1122 OE1 GLU A 58 -6.828 24.621 5.927 1.00 2.45 O ATOM 1123 OE2 GLU A 58 -8.790 23.679 6.242 1.00 2.42 O ATOM 0 H GLU A 58 -4.520 22.472 8.177 1.00 0.47 H new ATOM 0 HA GLU A 58 -6.210 20.265 8.462 1.00 0.51 H new ATOM 0 HB2 GLU A 58 -5.662 21.955 5.986 1.00 0.65 H new ATOM 0 HB3 GLU A 58 -7.112 21.024 6.303 1.00 0.65 H new ATOM 0 HG2 GLU A 58 -7.712 22.474 8.162 1.00 1.44 H new ATOM 0 HG3 GLU A 58 -6.188 23.330 8.046 1.00 1.44 H new ATOM 1130 N LEU A 59 -3.698 19.785 6.405 1.00 0.46 N ATOM 1131 CA LEU A 59 -3.084 18.760 5.574 1.00 0.48 C ATOM 1132 C LEU A 59 -2.654 17.600 6.451 1.00 0.43 C ATOM 1133 O LEU A 59 -2.805 16.431 6.097 1.00 0.47 O ATOM 1134 CB LEU A 59 -1.882 19.302 4.799 1.00 0.56 C ATOM 1135 CG LEU A 59 -2.213 20.294 3.681 1.00 0.67 C ATOM 1136 CD1 LEU A 59 -0.961 20.627 2.889 1.00 1.15 C ATOM 1137 CD2 LEU A 59 -3.291 19.738 2.760 1.00 1.42 C ATOM 0 H LEU A 59 -3.143 20.631 6.533 1.00 0.46 H new ATOM 0 HA LEU A 59 -3.821 18.426 4.843 1.00 0.48 H new ATOM 0 HB2 LEU A 59 -1.206 19.787 5.503 1.00 0.56 H new ATOM 0 HB3 LEU A 59 -1.341 18.460 4.366 1.00 0.56 H new ATOM 0 HG LEU A 59 -2.596 21.207 4.137 1.00 0.67 H new ATOM 0 HD11 LEU A 59 -1.209 21.333 2.097 1.00 1.15 H new ATOM 0 HD12 LEU A 59 -0.219 21.071 3.552 1.00 1.15 H new ATOM 0 HD13 LEU A 59 -0.556 19.716 2.449 1.00 1.15 H new ATOM 0 HD21 LEU A 59 -3.508 20.462 1.975 1.00 1.42 H new ATOM 0 HD22 LEU A 59 -2.942 18.809 2.310 1.00 1.42 H new ATOM 0 HD23 LEU A 59 -4.197 19.545 3.335 1.00 1.42 H new ATOM 1149 N GLY A 60 -2.115 17.961 7.613 1.00 0.37 N ATOM 1150 CA GLY A 60 -1.743 16.984 8.609 1.00 0.36 C ATOM 1151 C GLY A 60 -2.944 16.213 9.105 1.00 0.35 C ATOM 1152 O GLY A 60 -2.845 15.031 9.406 1.00 0.36 O ATOM 0 H GLY A 60 -1.929 18.928 7.880 1.00 0.37 H new ATOM 0 HA2 GLY A 60 -1.014 16.292 8.187 1.00 0.36 H new ATOM 0 HA3 GLY A 60 -1.259 17.484 9.448 1.00 0.36 H new ATOM 1156 N ALA A 61 -4.081 16.890 9.194 1.00 0.37 N ATOM 1157 CA ALA A 61 -5.331 16.238 9.551 1.00 0.42 C ATOM 1158 C ALA A 61 -5.790 15.314 8.422 1.00 0.44 C ATOM 1159 O ALA A 61 -6.237 14.196 8.670 1.00 0.48 O ATOM 1160 CB ALA A 61 -6.398 17.273 9.863 1.00 0.45 C ATOM 0 H ALA A 61 -4.162 17.892 9.023 1.00 0.37 H new ATOM 0 HA ALA A 61 -5.167 15.635 10.444 1.00 0.42 H new ATOM 0 HB1 ALA A 61 -7.327 16.769 10.128 1.00 0.45 H new ATOM 0 HB2 ALA A 61 -6.070 17.893 10.697 1.00 0.45 H new ATOM 0 HB3 ALA A 61 -6.563 17.901 8.987 1.00 0.45 H new ATOM 1166 N LYS A 62 -5.664 15.795 7.188 1.00 0.45 N ATOM 1167 CA LYS A 62 -5.996 15.007 6.004 1.00 0.50 C ATOM 1168 C LYS A 62 -5.227 13.691 5.991 1.00 0.54 C ATOM 1169 O LYS A 62 -5.817 12.615 5.870 1.00 0.69 O ATOM 1170 CB LYS A 62 -5.672 15.795 4.729 1.00 0.53 C ATOM 1171 CG LYS A 62 -6.655 16.910 4.411 1.00 0.90 C ATOM 1172 CD LYS A 62 -7.977 16.361 3.904 1.00 1.25 C ATOM 1173 CE LYS A 62 -8.917 17.479 3.487 1.00 1.51 C ATOM 1174 NZ LYS A 62 -10.157 16.957 2.856 1.00 2.17 N ATOM 0 H LYS A 62 -5.331 16.737 6.981 1.00 0.45 H new ATOM 0 HA LYS A 62 -7.064 14.792 6.037 1.00 0.50 H new ATOM 0 HB2 LYS A 62 -4.674 16.224 4.825 1.00 0.53 H new ATOM 0 HB3 LYS A 62 -5.642 15.103 3.887 1.00 0.53 H new ATOM 0 HG2 LYS A 62 -6.828 17.509 5.305 1.00 0.90 H new ATOM 0 HG3 LYS A 62 -6.224 17.573 3.661 1.00 0.90 H new ATOM 0 HD2 LYS A 62 -7.797 15.700 3.057 1.00 1.25 H new ATOM 0 HD3 LYS A 62 -8.446 15.760 4.683 1.00 1.25 H new ATOM 0 HE2 LYS A 62 -9.178 18.077 4.360 1.00 1.51 H new ATOM 0 HE3 LYS A 62 -8.406 18.141 2.788 1.00 1.51 H new ATOM 0 HZ1 LYS A 62 -10.866 17.716 2.803 1.00 2.17 H new ATOM 0 HZ2 LYS A 62 -9.942 16.616 1.897 1.00 2.17 H new ATOM 0 HZ3 LYS A 62 -10.533 16.172 3.426 1.00 2.17 H new ATOM 1188 N VAL A 63 -3.909 13.782 6.123 1.00 0.45 N ATOM 1189 CA VAL A 63 -3.059 12.600 6.106 1.00 0.48 C ATOM 1190 C VAL A 63 -3.254 11.762 7.370 1.00 0.46 C ATOM 1191 O VAL A 63 -3.135 10.540 7.335 1.00 0.53 O ATOM 1192 CB VAL A 63 -1.573 12.984 5.938 1.00 0.48 C ATOM 1193 CG1 VAL A 63 -1.091 13.818 7.107 1.00 1.12 C ATOM 1194 CG2 VAL A 63 -0.704 11.747 5.753 1.00 1.12 C ATOM 0 H VAL A 63 -3.407 14.662 6.243 1.00 0.45 H new ATOM 0 HA VAL A 63 -3.355 11.997 5.247 1.00 0.48 H new ATOM 0 HB VAL A 63 -1.486 13.590 5.036 1.00 0.48 H new ATOM 0 HG11 VAL A 63 -0.041 14.074 6.963 1.00 1.12 H new ATOM 0 HG12 VAL A 63 -1.682 14.731 7.171 1.00 1.12 H new ATOM 0 HG13 VAL A 63 -1.202 13.249 8.030 1.00 1.12 H new ATOM 0 HG21 VAL A 63 0.337 12.048 5.637 1.00 1.12 H new ATOM 0 HG22 VAL A 63 -0.800 11.101 6.626 1.00 1.12 H new ATOM 0 HG23 VAL A 63 -1.026 11.206 4.864 1.00 1.12 H new ATOM 1198 N GLU A 64 -3.574 12.425 8.474 1.00 0.41 N ATOM 1199 CA GLU A 64 -3.798 11.744 9.747 1.00 0.42 C ATOM 1200 C GLU A 64 -4.980 10.790 9.633 1.00 0.50 C ATOM 1201 O GLU A 64 -4.833 9.585 9.832 1.00 0.55 O ATOM 1202 CB GLU A 64 -4.059 12.763 10.861 1.00 0.42 C ATOM 1203 CG GLU A 64 -3.592 12.325 12.245 1.00 0.53 C ATOM 1204 CD GLU A 64 -4.303 11.093 12.765 1.00 1.11 C ATOM 1205 OE1 GLU A 64 -5.458 11.219 13.226 1.00 1.66 O ATOM 1206 OE2 GLU A 64 -3.720 9.991 12.691 1.00 1.70 O ATOM 0 H GLU A 64 -3.685 13.438 8.515 1.00 0.41 H new ATOM 0 HA GLU A 64 -2.903 11.174 9.994 1.00 0.42 H new ATOM 0 HB2 GLU A 64 -3.562 13.698 10.603 1.00 0.42 H new ATOM 0 HB3 GLU A 64 -5.128 12.971 10.902 1.00 0.42 H new ATOM 0 HG2 GLU A 64 -2.520 12.129 12.212 1.00 0.53 H new ATOM 0 HG3 GLU A 64 -3.744 13.145 12.947 1.00 0.53 H new ATOM 1213 N LYS A 65 -6.142 11.334 9.276 1.00 0.58 N ATOM 1214 CA LYS A 65 -7.364 10.541 9.207 1.00 0.69 C ATOM 1215 C LYS A 65 -7.210 9.435 8.173 1.00 0.71 C ATOM 1216 O LYS A 65 -7.655 8.305 8.372 1.00 0.76 O ATOM 1217 CB LYS A 65 -8.561 11.417 8.835 1.00 0.84 C ATOM 1218 CG LYS A 65 -8.738 12.635 9.722 1.00 1.92 C ATOM 1219 CD LYS A 65 -9.918 13.474 9.264 1.00 2.40 C ATOM 1220 CE LYS A 65 -9.960 14.813 9.975 1.00 3.23 C ATOM 1221 NZ LYS A 65 -11.156 15.609 9.591 1.00 3.96 N ATOM 0 H LYS A 65 -6.261 12.317 9.031 1.00 0.58 H new ATOM 0 HA LYS A 65 -7.540 10.103 10.190 1.00 0.69 H new ATOM 0 HB2 LYS A 65 -8.449 11.747 7.802 1.00 0.84 H new ATOM 0 HB3 LYS A 65 -9.467 10.813 8.881 1.00 0.84 H new ATOM 0 HG2 LYS A 65 -8.891 12.319 10.754 1.00 1.92 H new ATOM 0 HG3 LYS A 65 -7.830 13.238 9.704 1.00 1.92 H new ATOM 0 HD2 LYS A 65 -9.855 13.635 8.188 1.00 2.40 H new ATOM 0 HD3 LYS A 65 -10.845 12.932 9.452 1.00 2.40 H new ATOM 0 HE2 LYS A 65 -9.963 14.651 11.053 1.00 3.23 H new ATOM 0 HE3 LYS A 65 -9.058 15.377 9.739 1.00 3.23 H new ATOM 0 HZ1 LYS A 65 -11.147 16.517 10.099 1.00 3.96 H new ATOM 0 HZ2 LYS A 65 -11.141 15.786 8.566 1.00 3.96 H new ATOM 0 HZ3 LYS A 65 -12.018 15.082 9.839 1.00 3.96 H new ATOM 1235 N LEU A 66 -6.551 9.781 7.073 1.00 0.72 N ATOM 1236 CA LEU A 66 -6.331 8.855 5.975 1.00 0.80 C ATOM 1237 C LEU A 66 -5.441 7.708 6.437 1.00 0.76 C ATOM 1238 O LEU A 66 -5.680 6.545 6.111 1.00 1.07 O ATOM 1239 CB LEU A 66 -5.672 9.598 4.803 1.00 0.84 C ATOM 1240 CG LEU A 66 -6.109 9.177 3.396 1.00 0.77 C ATOM 1241 CD1 LEU A 66 -5.808 7.707 3.138 1.00 1.50 C ATOM 1242 CD2 LEU A 66 -7.586 9.473 3.195 1.00 1.37 C ATOM 0 H LEU A 66 -6.156 10.709 6.920 1.00 0.72 H new ATOM 0 HA LEU A 66 -7.287 8.447 5.647 1.00 0.80 H new ATOM 0 HB2 LEU A 66 -5.872 10.663 4.918 1.00 0.84 H new ATOM 0 HB3 LEU A 66 -4.593 9.466 4.879 1.00 0.84 H new ATOM 0 HG LEU A 66 -5.536 9.758 2.674 1.00 0.77 H new ATOM 0 HD11 LEU A 66 -6.130 7.441 2.131 1.00 1.50 H new ATOM 0 HD12 LEU A 66 -4.736 7.533 3.234 1.00 1.50 H new ATOM 0 HD13 LEU A 66 -6.342 7.093 3.864 1.00 1.50 H new ATOM 0 HD21 LEU A 66 -7.885 9.170 2.192 1.00 1.37 H new ATOM 0 HD22 LEU A 66 -8.171 8.921 3.930 1.00 1.37 H new ATOM 0 HD23 LEU A 66 -7.763 10.541 3.319 1.00 1.37 H new ATOM 1254 N HIS A 67 -4.448 8.040 7.241 1.00 0.52 N ATOM 1255 CA HIS A 67 -3.468 7.064 7.687 1.00 0.55 C ATOM 1256 C HIS A 67 -4.064 6.230 8.802 1.00 0.44 C ATOM 1257 O HIS A 67 -3.708 5.070 8.989 1.00 0.45 O ATOM 1258 CB HIS A 67 -2.198 7.771 8.158 1.00 0.67 C ATOM 1259 CG HIS A 67 -1.069 6.843 8.485 1.00 0.94 C ATOM 1260 ND1 HIS A 67 -0.550 6.707 9.753 1.00 1.62 N ATOM 1261 CD2 HIS A 67 -0.346 6.018 7.694 1.00 1.85 C ATOM 1262 CE1 HIS A 67 0.446 5.844 9.727 1.00 2.13 C ATOM 1263 NE2 HIS A 67 0.590 5.408 8.490 1.00 2.34 N ATOM 0 H HIS A 67 -4.298 8.983 7.601 1.00 0.52 H new ATOM 0 HA HIS A 67 -3.202 6.408 6.858 1.00 0.55 H new ATOM 0 HB2 HIS A 67 -1.872 8.464 7.383 1.00 0.67 H new ATOM 0 HB3 HIS A 67 -2.432 8.367 9.040 1.00 0.67 H new ATOM 0 HD2 HIS A 67 -0.481 5.867 6.633 1.00 1.85 H new ATOM 0 HE1 HIS A 67 1.044 5.544 10.575 1.00 2.13 H new ATOM 0 HE2 HIS A 67 1.284 4.729 8.177 1.00 2.34 H new ATOM 1272 N ALA A 68 -4.972 6.845 9.537 1.00 0.39 N ATOM 1273 CA ALA A 68 -5.712 6.180 10.588 1.00 0.36 C ATOM 1274 C ALA A 68 -6.579 5.056 10.030 1.00 0.34 C ATOM 1275 O ALA A 68 -6.691 3.989 10.634 1.00 0.37 O ATOM 1276 CB ALA A 68 -6.569 7.202 11.305 1.00 0.40 C ATOM 0 H ALA A 68 -5.217 7.828 9.419 1.00 0.39 H new ATOM 0 HA ALA A 68 -5.007 5.730 11.288 1.00 0.36 H new ATOM 0 HB1 ALA A 68 -7.132 6.712 12.100 1.00 0.40 H new ATOM 0 HB2 ALA A 68 -5.931 7.974 11.735 1.00 0.40 H new ATOM 0 HB3 ALA A 68 -7.262 7.657 10.597 1.00 0.40 H new ATOM 1282 N MET A 69 -7.194 5.295 8.875 1.00 0.33 N ATOM 1283 CA MET A 69 -7.997 4.267 8.217 1.00 0.37 C ATOM 1284 C MET A 69 -7.100 3.118 7.797 1.00 0.37 C ATOM 1285 O MET A 69 -7.409 1.952 8.024 1.00 0.42 O ATOM 1286 CB MET A 69 -8.700 4.819 6.980 1.00 0.46 C ATOM 1287 CG MET A 69 -9.451 6.114 7.213 1.00 0.44 C ATOM 1288 SD MET A 69 -10.309 6.670 5.730 1.00 0.72 S ATOM 1289 CE MET A 69 -9.043 6.407 4.486 1.00 0.55 C ATOM 0 H MET A 69 -7.153 6.185 8.378 1.00 0.33 H new ATOM 0 HA MET A 69 -8.752 3.925 8.924 1.00 0.37 H new ATOM 0 HB2 MET A 69 -7.959 4.979 6.197 1.00 0.46 H new ATOM 0 HB3 MET A 69 -9.399 4.069 6.609 1.00 0.46 H new ATOM 0 HG2 MET A 69 -10.172 5.976 8.019 1.00 0.44 H new ATOM 0 HG3 MET A 69 -8.753 6.885 7.539 1.00 0.44 H new ATOM 0 HE1 MET A 69 -9.196 7.100 3.659 1.00 0.55 H new ATOM 0 HE2 MET A 69 -8.060 6.578 4.925 1.00 0.55 H new ATOM 0 HE3 MET A 69 -9.103 5.383 4.117 1.00 0.55 H new ATOM 1299 N VAL A 70 -5.984 3.478 7.179 1.00 0.36 N ATOM 1300 CA VAL A 70 -4.963 2.530 6.782 1.00 0.39 C ATOM 1301 C VAL A 70 -4.479 1.737 7.991 1.00 0.38 C ATOM 1302 O VAL A 70 -4.310 0.519 7.928 1.00 0.38 O ATOM 1303 CB VAL A 70 -3.784 3.293 6.141 1.00 0.42 C ATOM 1304 CG1 VAL A 70 -2.639 2.366 5.798 1.00 0.79 C ATOM 1305 CG2 VAL A 70 -4.256 4.044 4.906 1.00 0.70 C ATOM 0 H VAL A 70 -5.764 4.445 6.939 1.00 0.36 H new ATOM 0 HA VAL A 70 -5.381 1.831 6.058 1.00 0.39 H new ATOM 0 HB VAL A 70 -3.412 4.011 6.872 1.00 0.42 H new ATOM 0 HG11 VAL A 70 -1.828 2.940 5.349 1.00 0.79 H new ATOM 0 HG12 VAL A 70 -2.280 1.880 6.705 1.00 0.79 H new ATOM 0 HG13 VAL A 70 -2.982 1.609 5.092 1.00 0.79 H new ATOM 0 HG21 VAL A 70 -3.416 4.579 4.462 1.00 0.70 H new ATOM 0 HG22 VAL A 70 -4.659 3.336 4.182 1.00 0.70 H new ATOM 0 HG23 VAL A 70 -5.031 4.756 5.188 1.00 0.70 H new ATOM 1309 N LYS A 71 -4.283 2.437 9.099 1.00 0.40 N ATOM 1310 CA LYS A 71 -3.882 1.808 10.347 1.00 0.43 C ATOM 1311 C LYS A 71 -4.967 0.862 10.850 1.00 0.44 C ATOM 1312 O LYS A 71 -4.660 -0.212 11.343 1.00 0.45 O ATOM 1313 CB LYS A 71 -3.549 2.872 11.403 1.00 0.48 C ATOM 1314 CG LYS A 71 -3.273 2.317 12.799 1.00 1.22 C ATOM 1315 CD LYS A 71 -2.189 1.248 12.787 1.00 1.30 C ATOM 1316 CE LYS A 71 -0.868 1.784 12.270 1.00 0.75 C ATOM 1317 NZ LYS A 71 -0.217 2.708 13.234 1.00 1.47 N ATOM 0 H LYS A 71 -4.397 3.449 9.158 1.00 0.40 H new ATOM 0 HA LYS A 71 -2.984 1.219 10.161 1.00 0.43 H new ATOM 0 HB2 LYS A 71 -2.676 3.434 11.071 1.00 0.48 H new ATOM 0 HB3 LYS A 71 -4.378 3.577 11.464 1.00 0.48 H new ATOM 0 HG2 LYS A 71 -2.972 3.131 13.459 1.00 1.22 H new ATOM 0 HG3 LYS A 71 -4.191 1.897 13.210 1.00 1.22 H new ATOM 0 HD2 LYS A 71 -2.052 0.859 13.796 1.00 1.30 H new ATOM 0 HD3 LYS A 71 -2.510 0.413 12.164 1.00 1.30 H new ATOM 0 HE2 LYS A 71 -0.198 0.950 12.060 1.00 0.75 H new ATOM 0 HE3 LYS A 71 -1.034 2.305 11.327 1.00 0.75 H new ATOM 0 HZ1 LYS A 71 0.690 3.035 12.844 1.00 1.47 H new ATOM 0 HZ2 LYS A 71 -0.836 3.526 13.403 1.00 1.47 H new ATOM 0 HZ3 LYS A 71 -0.048 2.211 14.132 1.00 1.47 H new ATOM 1331 N SER A 72 -6.226 1.248 10.702 1.00 0.45 N ATOM 1332 CA SER A 72 -7.337 0.388 11.097 1.00 0.49 C ATOM 1333 C SER A 72 -7.253 -0.959 10.372 1.00 0.45 C ATOM 1334 O SER A 72 -7.611 -2.003 10.921 1.00 0.49 O ATOM 1335 CB SER A 72 -8.673 1.084 10.795 1.00 0.56 C ATOM 1336 OG SER A 72 -9.777 0.279 11.174 1.00 1.26 O ATOM 0 H SER A 72 -6.505 2.148 10.313 1.00 0.45 H new ATOM 0 HA SER A 72 -7.276 0.202 12.169 1.00 0.49 H new ATOM 0 HB2 SER A 72 -8.716 2.035 11.325 1.00 0.56 H new ATOM 0 HB3 SER A 72 -8.734 1.309 9.730 1.00 0.56 H new ATOM 0 HG SER A 72 -10.611 0.751 10.970 1.00 1.26 H new ATOM 1342 N LYS A 73 -6.751 -0.919 9.144 1.00 0.39 N ATOM 1343 CA LYS A 73 -6.579 -2.115 8.332 1.00 0.38 C ATOM 1344 C LYS A 73 -5.319 -2.870 8.754 1.00 0.33 C ATOM 1345 O LYS A 73 -5.367 -4.068 9.002 1.00 0.38 O ATOM 1346 CB LYS A 73 -6.487 -1.746 6.846 1.00 0.44 C ATOM 1347 CG LYS A 73 -7.468 -0.671 6.403 1.00 0.62 C ATOM 1348 CD LYS A 73 -8.909 -1.128 6.527 1.00 0.78 C ATOM 1349 CE LYS A 73 -9.867 -0.039 6.077 1.00 0.88 C ATOM 1350 NZ LYS A 73 -11.292 -0.446 6.211 1.00 1.54 N ATOM 0 H LYS A 73 -6.453 -0.058 8.685 1.00 0.39 H new ATOM 0 HA LYS A 73 -7.446 -2.758 8.485 1.00 0.38 H new ATOM 0 HB2 LYS A 73 -5.474 -1.407 6.631 1.00 0.44 H new ATOM 0 HB3 LYS A 73 -6.656 -2.643 6.250 1.00 0.44 H new ATOM 0 HG2 LYS A 73 -7.319 0.225 7.005 1.00 0.62 H new ATOM 0 HG3 LYS A 73 -7.263 -0.398 5.368 1.00 0.62 H new ATOM 0 HD2 LYS A 73 -9.063 -2.024 5.925 1.00 0.78 H new ATOM 0 HD3 LYS A 73 -9.121 -1.398 7.562 1.00 0.78 H new ATOM 0 HE2 LYS A 73 -9.692 0.861 6.666 1.00 0.88 H new ATOM 0 HE3 LYS A 73 -9.661 0.216 5.037 1.00 0.88 H new ATOM 0 HZ1 LYS A 73 -11.906 0.330 5.892 1.00 1.54 H new ATOM 0 HZ2 LYS A 73 -11.468 -1.289 5.628 1.00 1.54 H new ATOM 0 HZ3 LYS A 73 -11.499 -0.664 7.207 1.00 1.54 H new ATOM 1364 N ILE A 74 -4.205 -2.164 8.859 1.00 0.28 N ATOM 1365 CA ILE A 74 -2.927 -2.791 9.191 1.00 0.28 C ATOM 1366 C ILE A 74 -2.905 -3.289 10.640 1.00 0.28 C ATOM 1367 O ILE A 74 -2.200 -4.240 10.975 1.00 0.30 O ATOM 1368 CB ILE A 74 -1.756 -1.820 8.919 1.00 0.30 C ATOM 1369 CG1 ILE A 74 -1.735 -1.487 7.428 1.00 0.30 C ATOM 1370 CG2 ILE A 74 -0.426 -2.419 9.353 1.00 0.34 C ATOM 1371 CD1 ILE A 74 -0.667 -0.503 7.021 1.00 0.32 C ATOM 0 H ILE A 74 -4.155 -1.155 8.720 1.00 0.28 H new ATOM 0 HA ILE A 74 -2.806 -3.661 8.546 1.00 0.28 H new ATOM 0 HB ILE A 74 -1.903 -0.910 9.501 1.00 0.30 H new ATOM 0 HG12 ILE A 74 -1.595 -2.410 6.865 1.00 0.30 H new ATOM 0 HG13 ILE A 74 -2.708 -1.085 7.145 1.00 0.30 H new ATOM 0 HG21 ILE A 74 0.376 -1.710 9.148 1.00 0.34 H new ATOM 0 HG22 ILE A 74 -0.455 -2.635 10.421 1.00 0.34 H new ATOM 0 HG23 ILE A 74 -0.245 -3.342 8.801 1.00 0.34 H new ATOM 0 HD11 ILE A 74 -0.726 -0.325 5.947 1.00 0.32 H new ATOM 0 HD12 ILE A 74 -0.816 0.437 7.553 1.00 0.32 H new ATOM 0 HD13 ILE A 74 0.314 -0.908 7.268 1.00 0.32 H new ATOM 1378 N ALA A 75 -3.709 -2.665 11.485 1.00 0.31 N ATOM 1379 CA ALA A 75 -3.857 -3.102 12.871 1.00 0.32 C ATOM 1380 C ALA A 75 -4.589 -4.433 12.913 1.00 0.32 C ATOM 1381 O ALA A 75 -4.299 -5.305 13.731 1.00 0.35 O ATOM 1382 CB ALA A 75 -4.630 -2.074 13.680 1.00 0.34 C ATOM 0 H ALA A 75 -4.272 -1.851 11.238 1.00 0.31 H new ATOM 0 HA ALA A 75 -2.864 -3.214 13.305 1.00 0.32 H new ATOM 0 HB1 ALA A 75 -4.728 -2.420 14.709 1.00 0.34 H new ATOM 0 HB2 ALA A 75 -4.096 -1.124 13.666 1.00 0.34 H new ATOM 0 HB3 ALA A 75 -5.621 -1.940 13.246 1.00 0.34 H new ATOM 1388 N ALA A 76 -5.538 -4.568 11.998 1.00 0.31 N ATOM 1389 CA ALA A 76 -6.364 -5.757 11.876 1.00 0.32 C ATOM 1390 C ALA A 76 -5.699 -6.779 10.958 1.00 0.34 C ATOM 1391 O ALA A 76 -6.251 -7.847 10.681 1.00 0.49 O ATOM 1392 CB ALA A 76 -7.726 -5.363 11.325 1.00 0.35 C ATOM 0 H ALA A 76 -5.757 -3.846 11.312 1.00 0.31 H new ATOM 0 HA ALA A 76 -6.486 -6.213 12.859 1.00 0.32 H new ATOM 0 HB1 ALA A 76 -8.351 -6.251 11.231 1.00 0.35 H new ATOM 0 HB2 ALA A 76 -8.202 -4.655 12.003 1.00 0.35 H new ATOM 0 HB3 ALA A 76 -7.602 -4.901 10.346 1.00 0.35 H new ATOM 1398 N LEU A 77 -4.507 -6.443 10.500 1.00 0.34 N ATOM 1399 CA LEU A 77 -3.751 -7.294 9.601 1.00 0.31 C ATOM 1400 C LEU A 77 -2.815 -8.175 10.411 1.00 0.32 C ATOM 1401 O LEU A 77 -2.160 -7.703 11.344 1.00 0.33 O ATOM 1402 CB LEU A 77 -2.958 -6.414 8.632 1.00 0.30 C ATOM 1403 CG LEU A 77 -2.431 -7.086 7.362 1.00 0.38 C ATOM 1404 CD1 LEU A 77 -3.520 -7.920 6.707 1.00 0.71 C ATOM 1405 CD2 LEU A 77 -1.944 -6.014 6.403 1.00 0.58 C ATOM 0 H LEU A 77 -4.036 -5.571 10.741 1.00 0.34 H new ATOM 0 HA LEU A 77 -4.424 -7.933 9.030 1.00 0.31 H new ATOM 0 HB2 LEU A 77 -3.592 -5.578 8.336 1.00 0.30 H new ATOM 0 HB3 LEU A 77 -2.109 -5.994 9.172 1.00 0.30 H new ATOM 0 HG LEU A 77 -1.607 -7.750 7.621 1.00 0.38 H new ATOM 0 HD11 LEU A 77 -3.126 -8.390 5.806 1.00 0.71 H new ATOM 0 HD12 LEU A 77 -3.855 -8.691 7.401 1.00 0.71 H new ATOM 0 HD13 LEU A 77 -4.361 -7.278 6.444 1.00 0.71 H new ATOM 0 HD21 LEU A 77 -1.566 -6.483 5.494 1.00 0.58 H new ATOM 0 HD22 LEU A 77 -2.770 -5.348 6.152 1.00 0.58 H new ATOM 0 HD23 LEU A 77 -1.146 -5.440 6.874 1.00 0.58 H new ATOM 1417 N GLY A 78 -2.780 -9.458 10.079 1.00 0.36 N ATOM 1418 CA GLY A 78 -1.912 -10.381 10.780 1.00 0.42 C ATOM 1419 C GLY A 78 -0.452 -10.032 10.594 1.00 0.46 C ATOM 1420 O GLY A 78 -0.096 -9.420 9.586 1.00 0.76 O ATOM 0 H GLY A 78 -3.339 -9.876 9.335 1.00 0.36 H new ATOM 0 HA2 GLY A 78 -2.155 -10.373 11.843 1.00 0.42 H new ATOM 0 HA3 GLY A 78 -2.092 -11.394 10.420 1.00 0.42 H new ATOM 1424 N PRO A 79 0.415 -10.407 11.553 1.00 0.66 N ATOM 1425 CA PRO A 79 1.855 -10.103 11.521 1.00 0.86 C ATOM 1426 C PRO A 79 2.495 -10.310 10.149 1.00 0.60 C ATOM 1427 O PRO A 79 3.343 -9.520 9.727 1.00 0.64 O ATOM 1428 CB PRO A 79 2.430 -11.101 12.522 1.00 1.32 C ATOM 1429 CG PRO A 79 1.346 -11.284 13.524 1.00 1.56 C ATOM 1430 CD PRO A 79 0.049 -11.168 12.766 1.00 1.10 C ATOM 0 HA PRO A 79 2.047 -9.055 11.753 1.00 0.86 H new ATOM 0 HB2 PRO A 79 2.689 -12.044 12.040 1.00 1.32 H new ATOM 0 HB3 PRO A 79 3.340 -10.720 12.986 1.00 1.32 H new ATOM 0 HG2 PRO A 79 1.426 -12.256 14.011 1.00 1.56 H new ATOM 0 HG3 PRO A 79 1.408 -10.528 14.307 1.00 1.56 H new ATOM 0 HD2 PRO A 79 -0.357 -12.148 12.516 1.00 1.10 H new ATOM 0 HD3 PRO A 79 -0.710 -10.648 13.350 1.00 1.10 H new ATOM 1438 N GLU A 80 2.071 -11.360 9.455 1.00 0.51 N ATOM 1439 CA GLU A 80 2.634 -11.709 8.162 1.00 0.49 C ATOM 1440 C GLU A 80 2.372 -10.602 7.157 1.00 0.42 C ATOM 1441 O GLU A 80 3.299 -10.064 6.548 1.00 0.49 O ATOM 1442 CB GLU A 80 2.026 -13.023 7.657 1.00 0.70 C ATOM 1443 CG GLU A 80 2.621 -13.515 6.345 1.00 1.25 C ATOM 1444 CD GLU A 80 4.035 -14.037 6.498 1.00 1.79 C ATOM 1445 OE1 GLU A 80 4.844 -13.401 7.202 1.00 2.52 O ATOM 1446 OE2 GLU A 80 4.343 -15.102 5.923 1.00 2.19 O ATOM 0 H GLU A 80 1.332 -11.988 9.772 1.00 0.51 H new ATOM 0 HA GLU A 80 3.711 -11.836 8.276 1.00 0.49 H new ATOM 0 HB2 GLU A 80 2.164 -13.791 8.418 1.00 0.70 H new ATOM 0 HB3 GLU A 80 0.952 -12.889 7.530 1.00 0.70 H new ATOM 0 HG2 GLU A 80 1.989 -14.305 5.939 1.00 1.25 H new ATOM 0 HG3 GLU A 80 2.616 -12.700 5.621 1.00 1.25 H new ATOM 1453 N ALA A 81 1.107 -10.239 7.016 1.00 0.36 N ATOM 1454 CA ALA A 81 0.724 -9.267 6.006 1.00 0.34 C ATOM 1455 C ALA A 81 0.991 -7.850 6.487 1.00 0.31 C ATOM 1456 O ALA A 81 1.239 -6.948 5.688 1.00 0.32 O ATOM 1457 CB ALA A 81 -0.722 -9.451 5.595 1.00 0.36 C ATOM 0 H ALA A 81 0.337 -10.598 7.581 1.00 0.36 H new ATOM 0 HA ALA A 81 1.339 -9.436 5.122 1.00 0.34 H new ATOM 0 HB1 ALA A 81 -0.982 -8.711 4.838 1.00 0.36 H new ATOM 0 HB2 ALA A 81 -0.859 -10.452 5.186 1.00 0.36 H new ATOM 0 HB3 ALA A 81 -1.367 -9.323 6.465 1.00 0.36 H new ATOM 1463 N LYS A 82 0.942 -7.671 7.802 1.00 0.31 N ATOM 1464 CA LYS A 82 1.245 -6.390 8.425 1.00 0.33 C ATOM 1465 C LYS A 82 2.629 -5.911 8.002 1.00 0.33 C ATOM 1466 O LYS A 82 2.810 -4.747 7.650 1.00 0.32 O ATOM 1467 CB LYS A 82 1.172 -6.511 9.951 1.00 0.41 C ATOM 1468 CG LYS A 82 1.346 -5.188 10.680 1.00 0.60 C ATOM 1469 CD LYS A 82 1.345 -5.367 12.191 1.00 0.86 C ATOM 1470 CE LYS A 82 0.014 -5.903 12.698 1.00 1.33 C ATOM 1471 NZ LYS A 82 0.005 -6.060 14.175 1.00 2.04 N ATOM 0 H LYS A 82 0.692 -8.407 8.463 1.00 0.31 H new ATOM 0 HA LYS A 82 0.506 -5.660 8.096 1.00 0.33 H new ATOM 0 HB2 LYS A 82 0.210 -6.943 10.226 1.00 0.41 H new ATOM 0 HB3 LYS A 82 1.942 -7.205 10.288 1.00 0.41 H new ATOM 0 HG2 LYS A 82 2.282 -4.724 10.370 1.00 0.60 H new ATOM 0 HG3 LYS A 82 0.543 -4.508 10.395 1.00 0.60 H new ATOM 0 HD2 LYS A 82 2.144 -6.051 12.476 1.00 0.86 H new ATOM 0 HD3 LYS A 82 1.558 -4.411 12.670 1.00 0.86 H new ATOM 0 HE2 LYS A 82 -0.787 -5.226 12.400 1.00 1.33 H new ATOM 0 HE3 LYS A 82 -0.192 -6.866 12.230 1.00 1.33 H new ATOM 0 HZ1 LYS A 82 -0.919 -6.427 14.479 1.00 2.04 H new ATOM 0 HZ2 LYS A 82 0.752 -6.726 14.458 1.00 2.04 H new ATOM 0 HZ3 LYS A 82 0.176 -5.137 14.623 1.00 2.04 H new ATOM 1485 N GLY A 83 3.595 -6.828 8.016 1.00 0.37 N ATOM 1486 CA GLY A 83 4.950 -6.492 7.613 1.00 0.41 C ATOM 1487 C GLY A 83 5.011 -5.999 6.184 1.00 0.39 C ATOM 1488 O GLY A 83 5.697 -5.025 5.884 1.00 0.41 O ATOM 0 H GLY A 83 3.462 -7.799 8.300 1.00 0.37 H new ATOM 0 HA2 GLY A 83 5.346 -5.725 8.278 1.00 0.41 H new ATOM 0 HA3 GLY A 83 5.588 -7.369 7.721 1.00 0.41 H new ATOM 1492 N PHE A 84 4.273 -6.661 5.310 1.00 0.37 N ATOM 1493 CA PHE A 84 4.206 -6.271 3.914 1.00 0.37 C ATOM 1494 C PHE A 84 3.508 -4.923 3.756 1.00 0.34 C ATOM 1495 O PHE A 84 3.965 -4.062 3.004 1.00 0.37 O ATOM 1496 CB PHE A 84 3.479 -7.346 3.103 1.00 0.39 C ATOM 1497 CG PHE A 84 3.059 -6.890 1.737 1.00 0.74 C ATOM 1498 CD1 PHE A 84 4.003 -6.466 0.818 1.00 0.71 C ATOM 1499 CD2 PHE A 84 1.727 -6.903 1.367 1.00 1.22 C ATOM 1500 CE1 PHE A 84 3.624 -6.061 -0.445 1.00 1.13 C ATOM 1501 CE2 PHE A 84 1.344 -6.500 0.106 1.00 1.65 C ATOM 1502 CZ PHE A 84 2.276 -6.016 -0.776 1.00 1.59 C ATOM 0 H PHE A 84 3.708 -7.477 5.546 1.00 0.37 H new ATOM 0 HA PHE A 84 5.224 -6.170 3.537 1.00 0.37 H new ATOM 0 HB2 PHE A 84 4.130 -8.215 3.002 1.00 0.39 H new ATOM 0 HB3 PHE A 84 2.597 -7.671 3.655 1.00 0.39 H new ATOM 0 HD1 PHE A 84 5.047 -6.452 1.093 1.00 0.71 H new ATOM 0 HD2 PHE A 84 0.979 -7.232 2.073 1.00 1.22 H new ATOM 0 HE1 PHE A 84 4.371 -5.780 -1.172 1.00 1.13 H new ATOM 0 HE2 PHE A 84 0.307 -6.566 -0.188 1.00 1.65 H new ATOM 0 HZ PHE A 84 1.963 -5.602 -1.723 1.00 1.59 H new ATOM 1512 N ALA A 85 2.406 -4.743 4.471 1.00 0.30 N ATOM 1513 CA ALA A 85 1.618 -3.519 4.375 1.00 0.30 C ATOM 1514 C ALA A 85 2.439 -2.295 4.766 1.00 0.32 C ATOM 1515 O ALA A 85 2.430 -1.281 4.071 1.00 0.41 O ATOM 1516 CB ALA A 85 0.380 -3.622 5.250 1.00 0.28 C ATOM 0 H ALA A 85 2.035 -5.431 5.127 1.00 0.30 H new ATOM 0 HA ALA A 85 1.313 -3.399 3.336 1.00 0.30 H new ATOM 0 HB1 ALA A 85 -0.200 -2.702 5.170 1.00 0.28 H new ATOM 0 HB2 ALA A 85 -0.229 -4.465 4.922 1.00 0.28 H new ATOM 0 HB3 ALA A 85 0.679 -3.773 6.287 1.00 0.28 H new ATOM 1522 N GLU A 86 3.173 -2.407 5.865 1.00 0.31 N ATOM 1523 CA GLU A 86 3.965 -1.290 6.367 1.00 0.37 C ATOM 1524 C GLU A 86 5.098 -0.944 5.403 1.00 0.44 C ATOM 1525 O GLU A 86 5.602 0.179 5.395 1.00 0.70 O ATOM 1526 CB GLU A 86 4.532 -1.613 7.750 1.00 0.43 C ATOM 1527 CG GLU A 86 3.467 -1.984 8.768 1.00 0.55 C ATOM 1528 CD GLU A 86 4.017 -2.069 10.173 1.00 0.95 C ATOM 1529 OE1 GLU A 86 4.047 -1.030 10.863 1.00 1.11 O ATOM 1530 OE2 GLU A 86 4.430 -3.170 10.596 1.00 1.96 O ATOM 0 H GLU A 86 3.237 -3.257 6.425 1.00 0.31 H new ATOM 0 HA GLU A 86 3.308 -0.424 6.449 1.00 0.37 H new ATOM 0 HB2 GLU A 86 5.241 -2.436 7.661 1.00 0.43 H new ATOM 0 HB3 GLU A 86 5.089 -0.751 8.116 1.00 0.43 H new ATOM 0 HG2 GLU A 86 2.667 -1.245 8.738 1.00 0.55 H new ATOM 0 HG3 GLU A 86 3.026 -2.943 8.495 1.00 0.55 H new ATOM 1537 N LYS A 87 5.493 -1.911 4.588 1.00 0.41 N ATOM 1538 CA LYS A 87 6.544 -1.695 3.607 1.00 0.49 C ATOM 1539 C LYS A 87 5.978 -1.154 2.302 1.00 0.49 C ATOM 1540 O LYS A 87 6.470 -0.159 1.779 1.00 0.57 O ATOM 1541 CB LYS A 87 7.330 -2.984 3.354 1.00 0.57 C ATOM 1542 CG LYS A 87 8.557 -3.133 4.242 1.00 0.69 C ATOM 1543 CD LYS A 87 8.197 -3.122 5.720 1.00 1.25 C ATOM 1544 CE LYS A 87 9.434 -3.150 6.606 1.00 1.75 C ATOM 1545 NZ LYS A 87 10.290 -1.949 6.411 1.00 2.12 N ATOM 0 H LYS A 87 5.101 -2.853 4.587 1.00 0.41 H new ATOM 0 HA LYS A 87 7.226 -0.950 4.015 1.00 0.49 H new ATOM 0 HB2 LYS A 87 6.672 -3.838 3.512 1.00 0.57 H new ATOM 0 HB3 LYS A 87 7.642 -3.011 2.310 1.00 0.57 H new ATOM 0 HG2 LYS A 87 9.068 -4.065 4.000 1.00 0.69 H new ATOM 0 HG3 LYS A 87 9.256 -2.323 4.033 1.00 0.69 H new ATOM 0 HD2 LYS A 87 7.610 -2.231 5.944 1.00 1.25 H new ATOM 0 HD3 LYS A 87 7.568 -3.983 5.947 1.00 1.25 H new ATOM 0 HE2 LYS A 87 9.130 -3.212 7.651 1.00 1.75 H new ATOM 0 HE3 LYS A 87 10.014 -4.047 6.389 1.00 1.75 H new ATOM 0 HZ1 LYS A 87 10.960 -1.868 7.202 1.00 2.12 H new ATOM 0 HZ2 LYS A 87 10.817 -2.040 5.519 1.00 2.12 H new ATOM 0 HZ3 LYS A 87 9.692 -1.099 6.375 1.00 2.12 H new ATOM 1559 N SER A 88 4.924 -1.789 1.799 1.00 0.46 N ATOM 1560 CA SER A 88 4.338 -1.407 0.519 1.00 0.51 C ATOM 1561 C SER A 88 3.820 0.030 0.559 1.00 0.51 C ATOM 1562 O SER A 88 3.980 0.783 -0.405 1.00 0.57 O ATOM 1563 CB SER A 88 3.217 -2.377 0.135 1.00 0.56 C ATOM 1564 OG SER A 88 2.350 -2.613 1.232 1.00 0.48 O ATOM 0 H SER A 88 4.458 -2.571 2.259 1.00 0.46 H new ATOM 0 HA SER A 88 5.117 -1.460 -0.241 1.00 0.51 H new ATOM 0 HB2 SER A 88 2.649 -1.969 -0.701 1.00 0.56 H new ATOM 0 HB3 SER A 88 3.647 -3.320 -0.202 1.00 0.56 H new ATOM 0 HG SER A 88 2.773 -3.241 1.854 1.00 0.48 H new ATOM 1570 N ILE A 89 3.219 0.409 1.683 1.00 0.50 N ATOM 1571 CA ILE A 89 2.746 1.772 1.879 1.00 0.56 C ATOM 1572 C ILE A 89 3.903 2.770 1.782 1.00 0.55 C ATOM 1573 O ILE A 89 3.791 3.781 1.097 1.00 0.59 O ATOM 1574 CB ILE A 89 1.997 1.930 3.234 1.00 0.63 C ATOM 1575 CG1 ILE A 89 0.498 1.640 3.063 1.00 0.83 C ATOM 1576 CG2 ILE A 89 2.192 3.322 3.825 1.00 0.79 C ATOM 1577 CD1 ILE A 89 0.178 0.243 2.576 1.00 1.09 C ATOM 0 H ILE A 89 3.048 -0.213 2.474 1.00 0.50 H new ATOM 0 HA ILE A 89 2.035 1.989 1.081 1.00 0.56 H new ATOM 0 HB ILE A 89 2.424 1.205 3.926 1.00 0.63 H new ATOM 0 HG12 ILE A 89 -0.001 1.801 4.019 1.00 0.83 H new ATOM 0 HG13 ILE A 89 0.080 2.360 2.360 1.00 0.83 H new ATOM 0 HG21 ILE A 89 1.654 3.394 4.770 1.00 0.79 H new ATOM 0 HG22 ILE A 89 3.254 3.499 3.997 1.00 0.79 H new ATOM 0 HG23 ILE A 89 1.807 4.069 3.131 1.00 0.79 H new ATOM 0 HD11 ILE A 89 -0.902 0.128 2.485 1.00 1.09 H new ATOM 0 HD12 ILE A 89 0.644 0.081 1.604 1.00 1.09 H new ATOM 0 HD13 ILE A 89 0.562 -0.487 3.288 1.00 1.09 H new ATOM 1584 N GLU A 90 5.024 2.458 2.429 1.00 0.53 N ATOM 1585 CA GLU A 90 6.184 3.348 2.421 1.00 0.60 C ATOM 1586 C GLU A 90 6.875 3.348 1.058 1.00 0.56 C ATOM 1587 O GLU A 90 7.370 4.384 0.605 1.00 0.63 O ATOM 1588 CB GLU A 90 7.178 2.962 3.518 1.00 0.69 C ATOM 1589 CG GLU A 90 6.817 3.516 4.890 1.00 1.28 C ATOM 1590 CD GLU A 90 6.845 5.034 4.930 1.00 2.08 C ATOM 1591 OE1 GLU A 90 7.589 5.648 4.137 1.00 2.41 O ATOM 1592 OE2 GLU A 90 6.121 5.628 5.758 1.00 2.82 O ATOM 0 H GLU A 90 5.154 1.599 2.964 1.00 0.53 H new ATOM 0 HA GLU A 90 5.822 4.357 2.619 1.00 0.60 H new ATOM 0 HB2 GLU A 90 7.236 1.875 3.578 1.00 0.69 H new ATOM 0 HB3 GLU A 90 8.170 3.319 3.240 1.00 0.69 H new ATOM 0 HG2 GLU A 90 5.823 3.167 5.169 1.00 1.28 H new ATOM 0 HG3 GLU A 90 7.513 3.123 5.631 1.00 1.28 H new ATOM 1599 N ILE A 91 6.909 2.190 0.409 1.00 0.47 N ATOM 1600 CA ILE A 91 7.464 2.082 -0.934 1.00 0.46 C ATOM 1601 C ILE A 91 6.675 2.956 -1.907 1.00 0.47 C ATOM 1602 O ILE A 91 7.245 3.790 -2.613 1.00 0.51 O ATOM 1603 CB ILE A 91 7.463 0.616 -1.428 1.00 0.43 C ATOM 1604 CG1 ILE A 91 8.449 -0.222 -0.601 1.00 0.43 C ATOM 1605 CG2 ILE A 91 7.813 0.556 -2.908 1.00 0.49 C ATOM 1606 CD1 ILE A 91 8.386 -1.712 -0.883 1.00 0.45 C ATOM 0 H ILE A 91 6.558 1.312 0.792 1.00 0.47 H new ATOM 0 HA ILE A 91 8.497 2.429 -0.894 1.00 0.46 H new ATOM 0 HB ILE A 91 6.464 0.201 -1.297 1.00 0.43 H new ATOM 0 HG12 ILE A 91 9.462 0.131 -0.796 1.00 0.43 H new ATOM 0 HG13 ILE A 91 8.252 -0.055 0.458 1.00 0.43 H new ATOM 0 HG21 ILE A 91 7.808 -0.482 -3.241 1.00 0.49 H new ATOM 0 HG22 ILE A 91 7.078 1.124 -3.479 1.00 0.49 H new ATOM 0 HG23 ILE A 91 8.803 0.983 -3.065 1.00 0.49 H new ATOM 0 HD11 ILE A 91 9.113 -2.232 -0.259 1.00 0.45 H new ATOM 0 HD12 ILE A 91 7.385 -2.083 -0.660 1.00 0.45 H new ATOM 0 HD13 ILE A 91 8.614 -1.893 -1.933 1.00 0.45 H new ATOM 1613 N ALA A 92 5.359 2.781 -1.914 1.00 0.47 N ATOM 1614 CA ALA A 92 4.489 3.562 -2.776 1.00 0.53 C ATOM 1615 C ALA A 92 4.490 5.030 -2.360 1.00 0.60 C ATOM 1616 O ALA A 92 4.366 5.921 -3.202 1.00 0.64 O ATOM 1617 CB ALA A 92 3.075 3.000 -2.747 1.00 0.56 C ATOM 0 H ALA A 92 4.872 2.102 -1.329 1.00 0.47 H new ATOM 0 HA ALA A 92 4.869 3.498 -3.796 1.00 0.53 H new ATOM 0 HB1 ALA A 92 2.434 3.595 -3.397 1.00 0.56 H new ATOM 0 HB2 ALA A 92 3.087 1.967 -3.095 1.00 0.56 H new ATOM 0 HB3 ALA A 92 2.690 3.035 -1.728 1.00 0.56 H new ATOM 1623 N ARG A 93 4.609 5.267 -1.059 1.00 0.66 N ATOM 1624 CA ARG A 93 4.676 6.624 -0.523 1.00 0.77 C ATOM 1625 C ARG A 93 5.882 7.369 -1.080 1.00 0.68 C ATOM 1626 O ARG A 93 5.768 8.527 -1.468 1.00 0.68 O ATOM 1627 CB ARG A 93 4.750 6.605 1.006 1.00 0.99 C ATOM 1628 CG ARG A 93 4.927 7.984 1.617 1.00 1.55 C ATOM 1629 CD ARG A 93 5.151 7.911 3.117 1.00 1.83 C ATOM 1630 NE ARG A 93 5.586 9.198 3.657 1.00 2.71 N ATOM 1631 CZ ARG A 93 6.563 9.333 4.553 1.00 3.44 C ATOM 1632 NH1 ARG A 93 7.142 8.264 5.079 1.00 3.55 N ATOM 1633 NH2 ARG A 93 6.950 10.540 4.940 1.00 4.42 N ATOM 0 H ARG A 93 4.661 4.534 -0.352 1.00 0.66 H new ATOM 0 HA ARG A 93 3.767 7.142 -0.828 1.00 0.77 H new ATOM 0 HB2 ARG A 93 3.839 6.155 1.401 1.00 0.99 H new ATOM 0 HB3 ARG A 93 5.580 5.969 1.315 1.00 0.99 H new ATOM 0 HG2 ARG A 93 5.774 8.484 1.147 1.00 1.55 H new ATOM 0 HG3 ARG A 93 4.044 8.589 1.410 1.00 1.55 H new ATOM 0 HD2 ARG A 93 4.229 7.602 3.609 1.00 1.83 H new ATOM 0 HD3 ARG A 93 5.900 7.151 3.337 1.00 1.83 H new ATOM 0 HE ARG A 93 5.115 10.041 3.329 1.00 2.71 H new ATOM 0 HH11 ARG A 93 6.841 7.331 4.799 1.00 3.55 H new ATOM 0 HH12 ARG A 93 7.889 8.374 5.764 1.00 3.55 H new ATOM 0 HH21 ARG A 93 6.500 11.369 4.552 1.00 4.42 H new ATOM 0 HH22 ARG A 93 7.698 10.640 5.626 1.00 4.42 H new ATOM 1647 N GLY A 94 7.018 6.684 -1.149 1.00 0.66 N ATOM 1648 CA GLY A 94 8.248 7.317 -1.594 1.00 0.65 C ATOM 1649 C GLY A 94 8.154 7.792 -3.027 1.00 0.56 C ATOM 1650 O GLY A 94 8.729 8.817 -3.392 1.00 0.56 O ATOM 0 H GLY A 94 7.110 5.698 -0.904 1.00 0.66 H new ATOM 0 HA2 GLY A 94 8.475 8.163 -0.946 1.00 0.65 H new ATOM 0 HA3 GLY A 94 9.074 6.612 -1.499 1.00 0.65 H new ATOM 1654 N ILE A 95 7.394 7.057 -3.825 1.00 0.52 N ATOM 1655 CA ILE A 95 7.195 7.396 -5.225 1.00 0.48 C ATOM 1656 C ILE A 95 6.527 8.765 -5.356 1.00 0.47 C ATOM 1657 O ILE A 95 7.003 9.635 -6.083 1.00 0.49 O ATOM 1658 CB ILE A 95 6.338 6.322 -5.935 1.00 0.50 C ATOM 1659 CG1 ILE A 95 7.043 4.958 -5.893 1.00 0.53 C ATOM 1660 CG2 ILE A 95 6.040 6.731 -7.370 1.00 0.52 C ATOM 1661 CD1 ILE A 95 8.413 4.959 -6.542 1.00 0.55 C ATOM 0 H ILE A 95 6.902 6.216 -3.523 1.00 0.52 H new ATOM 0 HA ILE A 95 8.173 7.433 -5.704 1.00 0.48 H new ATOM 0 HB ILE A 95 5.390 6.235 -5.405 1.00 0.50 H new ATOM 0 HG12 ILE A 95 7.143 4.643 -4.854 1.00 0.53 H new ATOM 0 HG13 ILE A 95 6.415 4.219 -6.391 1.00 0.53 H new ATOM 0 HG21 ILE A 95 5.436 5.961 -7.850 1.00 0.52 H new ATOM 0 HG22 ILE A 95 5.494 7.675 -7.374 1.00 0.52 H new ATOM 0 HG23 ILE A 95 6.976 6.851 -7.916 1.00 0.52 H new ATOM 0 HD11 ILE A 95 8.849 3.962 -6.474 1.00 0.55 H new ATOM 0 HD12 ILE A 95 8.319 5.243 -7.590 1.00 0.55 H new ATOM 0 HD13 ILE A 95 9.058 5.673 -6.029 1.00 0.55 H new ATOM 1668 N LYS A 96 5.445 8.970 -4.615 1.00 0.50 N ATOM 1669 CA LYS A 96 4.727 10.240 -4.659 1.00 0.54 C ATOM 1670 C LYS A 96 5.198 11.160 -3.541 1.00 0.57 C ATOM 1671 O LYS A 96 4.504 12.088 -3.151 1.00 0.83 O ATOM 1672 CB LYS A 96 3.207 10.049 -4.594 1.00 0.64 C ATOM 1673 CG LYS A 96 2.630 9.258 -5.760 1.00 1.47 C ATOM 1674 CD LYS A 96 2.731 7.757 -5.537 1.00 1.78 C ATOM 1675 CE LYS A 96 1.731 7.275 -4.499 1.00 1.90 C ATOM 1676 NZ LYS A 96 1.845 5.812 -4.269 1.00 2.70 N ATOM 0 H LYS A 96 5.046 8.279 -3.980 1.00 0.50 H new ATOM 0 HA LYS A 96 4.953 10.704 -5.619 1.00 0.54 H new ATOM 0 HB2 LYS A 96 2.955 9.540 -3.664 1.00 0.64 H new ATOM 0 HB3 LYS A 96 2.729 11.028 -4.561 1.00 0.64 H new ATOM 0 HG2 LYS A 96 1.585 9.534 -5.903 1.00 1.47 H new ATOM 0 HG3 LYS A 96 3.158 9.525 -6.675 1.00 1.47 H new ATOM 0 HD2 LYS A 96 2.557 7.237 -6.479 1.00 1.78 H new ATOM 0 HD3 LYS A 96 3.741 7.504 -5.214 1.00 1.78 H new ATOM 0 HE2 LYS A 96 1.895 7.805 -3.561 1.00 1.90 H new ATOM 0 HE3 LYS A 96 0.720 7.515 -4.828 1.00 1.90 H new ATOM 0 HZ1 LYS A 96 0.924 5.436 -3.965 1.00 2.70 H new ATOM 0 HZ2 LYS A 96 2.137 5.344 -5.151 1.00 2.70 H new ATOM 0 HZ3 LYS A 96 2.554 5.631 -3.530 1.00 2.70 H new ATOM 1690 N ALA A 97 6.390 10.889 -3.046 1.00 0.50 N ATOM 1691 CA ALA A 97 7.083 11.812 -2.164 1.00 0.53 C ATOM 1692 C ALA A 97 8.199 12.488 -2.934 1.00 0.46 C ATOM 1693 O ALA A 97 8.477 13.670 -2.741 1.00 0.48 O ATOM 1694 CB ALA A 97 7.634 11.083 -0.951 1.00 0.63 C ATOM 0 H ALA A 97 6.904 10.030 -3.241 1.00 0.50 H new ATOM 0 HA ALA A 97 6.382 12.566 -1.807 1.00 0.53 H new ATOM 0 HB1 ALA A 97 8.149 11.792 -0.303 1.00 0.63 H new ATOM 0 HB2 ALA A 97 6.815 10.619 -0.402 1.00 0.63 H new ATOM 0 HB3 ALA A 97 8.334 10.314 -1.276 1.00 0.63 H new ATOM 1700 N ARG A 98 8.808 11.745 -3.841 1.00 0.41 N ATOM 1701 CA ARG A 98 9.822 12.315 -4.706 1.00 0.44 C ATOM 1702 C ARG A 98 9.155 13.058 -5.854 1.00 0.44 C ATOM 1703 O ARG A 98 9.776 13.906 -6.489 1.00 0.53 O ATOM 1704 CB ARG A 98 10.814 11.253 -5.192 1.00 0.51 C ATOM 1705 CG ARG A 98 10.166 10.142 -5.998 1.00 1.02 C ATOM 1706 CD ARG A 98 11.116 8.974 -6.220 1.00 0.81 C ATOM 1707 NE ARG A 98 11.485 8.329 -4.962 1.00 1.51 N ATOM 1708 CZ ARG A 98 11.803 7.041 -4.844 1.00 1.94 C ATOM 1709 NH1 ARG A 98 11.756 6.232 -5.895 1.00 1.37 N ATOM 1710 NH2 ARG A 98 12.151 6.556 -3.660 1.00 3.10 N ATOM 0 H ARG A 98 8.620 10.755 -3.996 1.00 0.41 H new ATOM 0 HA ARG A 98 10.411 13.033 -4.136 1.00 0.44 H new ATOM 0 HB2 ARG A 98 11.579 11.734 -5.801 1.00 0.51 H new ATOM 0 HB3 ARG A 98 11.320 10.818 -4.330 1.00 0.51 H new ATOM 0 HG2 ARG A 98 9.274 9.791 -5.480 1.00 1.02 H new ATOM 0 HG3 ARG A 98 9.842 10.534 -6.962 1.00 1.02 H new ATOM 0 HD2 ARG A 98 10.647 8.244 -6.879 1.00 0.81 H new ATOM 0 HD3 ARG A 98 12.015 9.327 -6.725 1.00 0.81 H new ATOM 0 HE ARG A 98 11.500 8.903 -4.119 1.00 1.51 H new ATOM 0 HH11 ARG A 98 11.474 6.595 -6.806 1.00 1.37 H new ATOM 0 HH12 ARG A 98 12.002 5.247 -5.792 1.00 1.37 H new ATOM 0 HH21 ARG A 98 12.174 7.169 -2.845 1.00 3.10 H new ATOM 0 HH22 ARG A 98 12.395 5.570 -3.564 1.00 3.10 H new ATOM 1724 N TYR A 99 7.868 12.803 -6.069 1.00 0.44 N ATOM 1725 CA TYR A 99 7.074 13.669 -6.933 1.00 0.50 C ATOM 1726 C TYR A 99 6.967 15.051 -6.294 1.00 0.54 C ATOM 1727 O TYR A 99 6.987 16.073 -6.981 1.00 0.64 O ATOM 1728 CB TYR A 99 5.671 13.100 -7.163 1.00 0.53 C ATOM 1729 CG TYR A 99 5.520 12.305 -8.444 1.00 0.59 C ATOM 1730 CD1 TYR A 99 5.544 12.927 -9.685 1.00 0.73 C ATOM 1731 CD2 TYR A 99 5.363 10.926 -8.407 1.00 0.60 C ATOM 1732 CE1 TYR A 99 5.415 12.198 -10.853 1.00 0.85 C ATOM 1733 CE2 TYR A 99 5.232 10.189 -9.569 1.00 0.71 C ATOM 1734 CZ TYR A 99 5.228 10.858 -10.803 1.00 0.83 C ATOM 1735 OH TYR A 99 5.134 10.102 -11.949 1.00 0.97 O ATOM 0 H TYR A 99 7.359 12.017 -5.664 1.00 0.44 H new ATOM 0 HA TYR A 99 7.571 13.736 -7.901 1.00 0.50 H new ATOM 0 HB2 TYR A 99 5.409 12.461 -6.320 1.00 0.53 H new ATOM 0 HB3 TYR A 99 4.956 13.923 -7.174 1.00 0.53 H new ATOM 0 HD1 TYR A 99 5.666 13.999 -9.739 1.00 0.73 H new ATOM 0 HD2 TYR A 99 5.343 10.420 -7.453 1.00 0.60 H new ATOM 0 HE1 TYR A 99 5.464 12.699 -11.808 1.00 0.85 H new ATOM 0 HE2 TYR A 99 5.134 9.114 -9.528 1.00 0.71 H new ATOM 0 HH TYR A 99 5.242 9.154 -11.725 1.00 0.97 H new ATOM 1745 N TYR A 100 6.881 15.065 -4.966 1.00 0.51 N ATOM 1746 CA TYR A 100 6.769 16.306 -4.211 1.00 0.58 C ATOM 1747 C TYR A 100 8.094 17.048 -4.134 1.00 0.58 C ATOM 1748 O TYR A 100 8.149 18.254 -4.352 1.00 0.71 O ATOM 1749 CB TYR A 100 6.261 16.042 -2.799 1.00 0.57 C ATOM 1750 CG TYR A 100 4.760 16.011 -2.694 1.00 0.72 C ATOM 1751 CD1 TYR A 100 3.994 17.123 -3.010 1.00 1.03 C ATOM 1752 CD2 TYR A 100 4.107 14.860 -2.292 1.00 0.97 C ATOM 1753 CE1 TYR A 100 2.619 17.088 -2.922 1.00 1.26 C ATOM 1754 CE2 TYR A 100 2.733 14.816 -2.202 1.00 1.16 C ATOM 1755 CZ TYR A 100 1.995 15.981 -2.489 1.00 1.21 C ATOM 1756 OH TYR A 100 0.626 15.885 -2.424 1.00 1.48 O ATOM 0 H TYR A 100 6.887 14.224 -4.389 1.00 0.51 H new ATOM 0 HA TYR A 100 6.053 16.931 -4.745 1.00 0.58 H new ATOM 0 HB2 TYR A 100 6.661 15.090 -2.450 1.00 0.57 H new ATOM 0 HB3 TYR A 100 6.648 16.813 -2.133 1.00 0.57 H new ATOM 0 HD1 TYR A 100 4.483 18.031 -3.330 1.00 1.03 H new ATOM 0 HD2 TYR A 100 4.684 13.981 -2.045 1.00 0.97 H new ATOM 0 HE1 TYR A 100 2.041 17.956 -3.203 1.00 1.26 H new ATOM 0 HE2 TYR A 100 2.230 13.904 -1.916 1.00 1.16 H new ATOM 0 HH TYR A 100 0.265 15.742 -3.324 1.00 1.48 H new ATOM 1766 N THR A 101 9.158 16.318 -3.822 1.00 0.55 N ATOM 1767 CA THR A 101 10.477 16.909 -3.611 1.00 0.66 C ATOM 1768 C THR A 101 11.003 17.645 -4.845 1.00 0.71 C ATOM 1769 O THR A 101 11.864 18.517 -4.735 1.00 0.71 O ATOM 1770 CB THR A 101 11.493 15.827 -3.212 1.00 0.71 C ATOM 1771 OG1 THR A 101 11.499 14.772 -4.186 1.00 0.65 O ATOM 1772 CG2 THR A 101 11.159 15.266 -1.835 1.00 0.87 C ATOM 0 H THR A 101 9.133 15.305 -3.708 1.00 0.55 H new ATOM 0 HA THR A 101 10.359 17.637 -2.809 1.00 0.66 H new ATOM 0 HB THR A 101 12.484 16.278 -3.173 1.00 0.71 H new ATOM 0 HG1 THR A 101 10.819 14.952 -4.868 1.00 0.65 H new ATOM 0 HG21 THR A 101 11.888 14.501 -1.567 1.00 0.87 H new ATOM 0 HG22 THR A 101 11.188 16.069 -1.098 1.00 0.87 H new ATOM 0 HG23 THR A 101 10.162 14.826 -1.853 1.00 0.87 H new ATOM 1780 N GLY A 102 10.473 17.294 -6.012 1.00 0.82 N ATOM 1781 CA GLY A 102 10.975 17.849 -7.253 1.00 0.95 C ATOM 1782 C GLY A 102 11.833 16.857 -8.011 1.00 0.95 C ATOM 1783 O GLY A 102 12.756 17.241 -8.732 1.00 1.16 O ATOM 0 H GLY A 102 9.703 16.634 -6.119 1.00 0.82 H new ATOM 0 HA2 GLY A 102 10.137 18.156 -7.878 1.00 0.95 H new ATOM 0 HA3 GLY A 102 11.558 18.745 -7.040 1.00 0.95 H new ATOM 1787 N ASN A 103 11.537 15.577 -7.833 1.00 0.82 N ATOM 1788 CA ASN A 103 12.265 14.508 -8.497 1.00 0.89 C ATOM 1789 C ASN A 103 11.273 13.521 -9.098 1.00 0.98 C ATOM 1790 O ASN A 103 11.144 12.396 -8.619 1.00 1.83 O ATOM 1791 CB ASN A 103 13.184 13.779 -7.507 1.00 0.90 C ATOM 1792 CG ASN A 103 14.225 14.682 -6.870 1.00 1.28 C ATOM 1793 OD1 ASN A 103 15.299 14.907 -7.429 1.00 1.76 O ATOM 1794 ND2 ASN A 103 13.928 15.186 -5.679 1.00 1.65 N ATOM 0 H ASN A 103 10.786 15.252 -7.224 1.00 0.82 H new ATOM 0 HA ASN A 103 12.882 14.940 -9.285 1.00 0.89 H new ATOM 0 HB2 ASN A 103 12.576 13.329 -6.722 1.00 0.90 H new ATOM 0 HB3 ASN A 103 13.689 12.964 -8.025 1.00 0.90 H new ATOM 0 HD21 ASN A 103 14.600 15.782 -5.195 1.00 1.65 H new ATOM 0 HD22 ASN A 103 13.028 14.977 -5.247 1.00 1.65 H new ATOM 1801 N GLU A 104 10.559 13.969 -10.130 1.00 0.56 N ATOM 1802 CA GLU A 104 9.506 13.175 -10.771 1.00 0.56 C ATOM 1803 C GLU A 104 10.035 11.829 -11.269 1.00 0.49 C ATOM 1804 O GLU A 104 10.836 11.776 -12.206 1.00 0.55 O ATOM 1805 CB GLU A 104 8.905 13.965 -11.931 1.00 0.67 C ATOM 1806 CG GLU A 104 8.201 15.237 -11.489 1.00 0.80 C ATOM 1807 CD GLU A 104 7.832 16.127 -12.655 1.00 1.15 C ATOM 1808 OE1 GLU A 104 6.741 15.946 -13.231 1.00 1.75 O ATOM 1809 OE2 GLU A 104 8.641 17.008 -13.006 1.00 1.17 O ATOM 0 H GLU A 104 10.692 14.891 -10.546 1.00 0.56 H new ATOM 0 HA GLU A 104 8.736 12.970 -10.027 1.00 0.56 H new ATOM 0 HB2 GLU A 104 9.696 14.222 -12.636 1.00 0.67 H new ATOM 0 HB3 GLU A 104 8.196 13.332 -12.464 1.00 0.67 H new ATOM 0 HG2 GLU A 104 7.299 14.976 -10.935 1.00 0.80 H new ATOM 0 HG3 GLU A 104 8.847 15.788 -10.805 1.00 0.80 H new ATOM 1816 N PRO A 105 9.603 10.732 -10.616 1.00 0.44 N ATOM 1817 CA PRO A 105 10.002 9.361 -10.967 1.00 0.44 C ATOM 1818 C PRO A 105 9.829 9.030 -12.445 1.00 0.42 C ATOM 1819 O PRO A 105 8.922 9.537 -13.111 1.00 0.47 O ATOM 1820 CB PRO A 105 9.049 8.497 -10.150 1.00 0.48 C ATOM 1821 CG PRO A 105 8.674 9.325 -8.979 1.00 0.53 C ATOM 1822 CD PRO A 105 8.722 10.759 -9.433 1.00 0.49 C ATOM 0 HA PRO A 105 11.061 9.205 -10.763 1.00 0.44 H new ATOM 0 HB2 PRO A 105 8.171 8.221 -10.733 1.00 0.48 H new ATOM 0 HB3 PRO A 105 9.529 7.569 -9.838 1.00 0.48 H new ATOM 0 HG2 PRO A 105 7.677 9.064 -8.624 1.00 0.53 H new ATOM 0 HG3 PRO A 105 9.362 9.158 -8.150 1.00 0.53 H new ATOM 0 HD2 PRO A 105 7.729 11.131 -9.684 1.00 0.49 H new ATOM 0 HD3 PRO A 105 9.119 11.411 -8.655 1.00 0.49 H new ATOM 1830 N THR A 106 10.691 8.162 -12.944 1.00 0.42 N ATOM 1831 CA THR A 106 10.547 7.632 -14.284 1.00 0.42 C ATOM 1832 C THR A 106 9.670 6.380 -14.227 1.00 0.39 C ATOM 1833 O THR A 106 9.397 5.881 -13.132 1.00 0.41 O ATOM 1834 CB THR A 106 11.923 7.304 -14.905 1.00 0.50 C ATOM 1835 OG1 THR A 106 11.775 6.870 -16.261 1.00 1.48 O ATOM 1836 CG2 THR A 106 12.639 6.227 -14.106 1.00 1.05 C ATOM 0 H THR A 106 11.502 7.809 -12.436 1.00 0.42 H new ATOM 0 HA THR A 106 10.076 8.383 -14.918 1.00 0.42 H new ATOM 0 HB THR A 106 12.520 8.216 -14.882 1.00 0.50 H new ATOM 0 HG1 THR A 106 12.657 6.669 -16.638 1.00 1.48 H new ATOM 0 HG21 THR A 106 13.605 6.015 -14.565 1.00 1.05 H new ATOM 0 HG22 THR A 106 12.791 6.573 -13.084 1.00 1.05 H new ATOM 0 HG23 THR A 106 12.035 5.320 -14.096 1.00 1.05 H new ATOM 1844 N LYS A 107 9.225 5.867 -15.370 1.00 0.39 N ATOM 1845 CA LYS A 107 8.321 4.718 -15.370 1.00 0.39 C ATOM 1846 C LYS A 107 8.993 3.533 -14.687 1.00 0.36 C ATOM 1847 O LYS A 107 8.365 2.792 -13.930 1.00 0.38 O ATOM 1848 CB LYS A 107 7.926 4.326 -16.797 1.00 0.43 C ATOM 1849 CG LYS A 107 6.853 3.248 -16.866 1.00 1.33 C ATOM 1850 CD LYS A 107 5.453 3.843 -16.876 1.00 1.66 C ATOM 1851 CE LYS A 107 5.163 4.536 -18.198 1.00 2.22 C ATOM 1852 NZ LYS A 107 3.772 5.054 -18.277 1.00 2.88 N ATOM 0 H LYS A 107 9.470 6.220 -16.295 1.00 0.39 H new ATOM 0 HA LYS A 107 7.419 4.997 -14.826 1.00 0.39 H new ATOM 0 HB2 LYS A 107 7.570 5.213 -17.322 1.00 0.43 H new ATOM 0 HB3 LYS A 107 8.813 3.977 -17.326 1.00 0.43 H new ATOM 0 HG2 LYS A 107 6.999 2.647 -17.764 1.00 1.33 H new ATOM 0 HG3 LYS A 107 6.957 2.577 -16.013 1.00 1.33 H new ATOM 0 HD2 LYS A 107 4.719 3.056 -16.706 1.00 1.66 H new ATOM 0 HD3 LYS A 107 5.352 4.556 -16.058 1.00 1.66 H new ATOM 0 HE2 LYS A 107 5.863 5.361 -18.333 1.00 2.22 H new ATOM 0 HE3 LYS A 107 5.334 3.836 -19.016 1.00 2.22 H new ATOM 0 HZ1 LYS A 107 3.577 5.379 -19.245 1.00 2.88 H new ATOM 0 HZ2 LYS A 107 3.105 4.297 -18.025 1.00 2.88 H new ATOM 0 HZ3 LYS A 107 3.659 5.849 -17.616 1.00 2.88 H new ATOM 1866 N ASP A 108 10.290 3.401 -14.941 1.00 0.36 N ATOM 1867 CA ASP A 108 11.078 2.284 -14.434 1.00 0.38 C ATOM 1868 C ASP A 108 11.145 2.301 -12.909 1.00 0.36 C ATOM 1869 O ASP A 108 11.214 1.249 -12.277 1.00 0.38 O ATOM 1870 CB ASP A 108 12.492 2.319 -15.021 1.00 0.47 C ATOM 1871 CG ASP A 108 12.503 2.153 -16.529 1.00 1.29 C ATOM 1872 OD1 ASP A 108 12.365 3.168 -17.247 1.00 2.24 O ATOM 1873 OD2 ASP A 108 12.656 1.009 -17.006 1.00 1.26 O ATOM 0 H ASP A 108 10.824 4.064 -15.503 1.00 0.36 H new ATOM 0 HA ASP A 108 10.586 1.362 -14.743 1.00 0.38 H new ATOM 0 HB2 ASP A 108 12.966 3.265 -14.760 1.00 0.47 H new ATOM 0 HB3 ASP A 108 13.089 1.528 -14.568 1.00 0.47 H new ATOM 1878 N ASP A 109 11.106 3.499 -12.326 1.00 0.36 N ATOM 1879 CA ASP A 109 11.139 3.650 -10.875 1.00 0.37 C ATOM 1880 C ASP A 109 9.894 3.024 -10.262 1.00 0.34 C ATOM 1881 O ASP A 109 9.968 2.287 -9.276 1.00 0.36 O ATOM 1882 CB ASP A 109 11.220 5.139 -10.513 1.00 0.39 C ATOM 1883 CG ASP A 109 11.501 5.379 -9.040 1.00 0.88 C ATOM 1884 OD1 ASP A 109 12.270 4.598 -8.441 1.00 0.94 O ATOM 1885 OD2 ASP A 109 10.996 6.382 -8.490 1.00 1.73 O ATOM 0 H ASP A 109 11.051 4.379 -12.839 1.00 0.36 H new ATOM 0 HA ASP A 109 12.018 3.142 -10.478 1.00 0.37 H new ATOM 0 HB2 ASP A 109 12.003 5.609 -11.108 1.00 0.39 H new ATOM 0 HB3 ASP A 109 10.281 5.624 -10.781 1.00 0.39 H new ATOM 1890 N LEU A 110 8.754 3.303 -10.882 1.00 0.30 N ATOM 1891 CA LEU A 110 7.479 2.743 -10.453 1.00 0.30 C ATOM 1892 C LEU A 110 7.437 1.244 -10.702 1.00 0.29 C ATOM 1893 O LEU A 110 7.015 0.478 -9.837 1.00 0.33 O ATOM 1894 CB LEU A 110 6.309 3.419 -11.180 1.00 0.30 C ATOM 1895 CG LEU A 110 5.901 4.797 -10.653 1.00 0.38 C ATOM 1896 CD1 LEU A 110 7.050 5.778 -10.738 1.00 0.82 C ATOM 1897 CD2 LEU A 110 4.704 5.325 -11.425 1.00 0.82 C ATOM 0 H LEU A 110 8.687 3.920 -11.691 1.00 0.30 H new ATOM 0 HA LEU A 110 7.382 2.928 -9.383 1.00 0.30 H new ATOM 0 HB2 LEU A 110 6.569 3.517 -12.234 1.00 0.30 H new ATOM 0 HB3 LEU A 110 5.443 2.760 -11.126 1.00 0.30 H new ATOM 0 HG LEU A 110 5.626 4.687 -9.604 1.00 0.38 H new ATOM 0 HD11 LEU A 110 6.730 6.748 -10.357 1.00 0.82 H new ATOM 0 HD12 LEU A 110 7.886 5.412 -10.142 1.00 0.82 H new ATOM 0 HD13 LEU A 110 7.363 5.882 -11.777 1.00 0.82 H new ATOM 0 HD21 LEU A 110 4.426 6.306 -11.039 1.00 0.82 H new ATOM 0 HD22 LEU A 110 4.961 5.410 -12.481 1.00 0.82 H new ATOM 0 HD23 LEU A 110 3.865 4.638 -11.310 1.00 0.82 H new ATOM 1909 N LYS A 111 7.887 0.827 -11.882 1.00 0.28 N ATOM 1910 CA LYS A 111 7.921 -0.588 -12.231 1.00 0.31 C ATOM 1911 C LYS A 111 8.694 -1.370 -11.176 1.00 0.33 C ATOM 1912 O LYS A 111 8.251 -2.415 -10.700 1.00 0.35 O ATOM 1913 CB LYS A 111 8.569 -0.784 -13.603 1.00 0.37 C ATOM 1914 CG LYS A 111 7.800 -0.117 -14.733 1.00 0.93 C ATOM 1915 CD LYS A 111 8.432 -0.390 -16.089 1.00 0.92 C ATOM 1916 CE LYS A 111 8.366 -1.865 -16.447 1.00 1.02 C ATOM 1917 NZ LYS A 111 8.863 -2.128 -17.821 1.00 1.74 N ATOM 0 H LYS A 111 8.233 1.450 -12.612 1.00 0.28 H new ATOM 0 HA LYS A 111 6.897 -0.960 -12.270 1.00 0.31 H new ATOM 0 HB2 LYS A 111 9.583 -0.385 -13.578 1.00 0.37 H new ATOM 0 HB3 LYS A 111 8.651 -1.851 -13.809 1.00 0.37 H new ATOM 0 HG2 LYS A 111 6.771 -0.477 -14.733 1.00 0.93 H new ATOM 0 HG3 LYS A 111 7.762 0.959 -14.560 1.00 0.93 H new ATOM 0 HD2 LYS A 111 7.921 0.194 -16.854 1.00 0.92 H new ATOM 0 HD3 LYS A 111 9.472 -0.063 -16.080 1.00 0.92 H new ATOM 0 HE2 LYS A 111 8.957 -2.438 -15.732 1.00 1.02 H new ATOM 0 HE3 LYS A 111 7.337 -2.213 -16.361 1.00 1.02 H new ATOM 0 HZ1 LYS A 111 8.800 -3.146 -18.024 1.00 1.74 H new ATOM 0 HZ2 LYS A 111 8.284 -1.602 -18.506 1.00 1.74 H new ATOM 0 HZ3 LYS A 111 9.854 -1.820 -17.897 1.00 1.74 H new ATOM 1931 N ALA A 112 9.852 -0.833 -10.811 1.00 0.36 N ATOM 1932 CA ALA A 112 10.696 -1.426 -9.787 1.00 0.42 C ATOM 1933 C ALA A 112 10.019 -1.412 -8.419 1.00 0.43 C ATOM 1934 O ALA A 112 10.083 -2.398 -7.682 1.00 0.47 O ATOM 1935 CB ALA A 112 12.027 -0.693 -9.722 1.00 0.46 C ATOM 0 H ALA A 112 10.229 0.023 -11.217 1.00 0.36 H new ATOM 0 HA ALA A 112 10.869 -2.467 -10.059 1.00 0.42 H new ATOM 0 HB1 ALA A 112 12.653 -1.144 -8.952 1.00 0.46 H new ATOM 0 HB2 ALA A 112 12.529 -0.765 -10.687 1.00 0.46 H new ATOM 0 HB3 ALA A 112 11.853 0.356 -9.481 1.00 0.46 H new ATOM 1941 N SER A 113 9.384 -0.296 -8.074 1.00 0.41 N ATOM 1942 CA SER A 113 8.758 -0.158 -6.766 1.00 0.45 C ATOM 1943 C SER A 113 7.605 -1.143 -6.577 1.00 0.40 C ATOM 1944 O SER A 113 7.458 -1.721 -5.500 1.00 0.44 O ATOM 1945 CB SER A 113 8.286 1.280 -6.534 1.00 0.54 C ATOM 1946 OG SER A 113 7.333 1.685 -7.501 1.00 1.34 O ATOM 0 H SER A 113 9.290 0.520 -8.678 1.00 0.41 H new ATOM 0 HA SER A 113 9.516 -0.397 -6.020 1.00 0.45 H new ATOM 0 HB2 SER A 113 7.851 1.363 -5.538 1.00 0.54 H new ATOM 0 HB3 SER A 113 9.143 1.953 -6.565 1.00 0.54 H new ATOM 0 HG SER A 113 7.210 0.969 -8.159 1.00 1.34 H new ATOM 1952 N VAL A 114 6.805 -1.375 -7.620 1.00 0.36 N ATOM 1953 CA VAL A 114 5.671 -2.276 -7.493 1.00 0.36 C ATOM 1954 C VAL A 114 6.168 -3.718 -7.516 1.00 0.35 C ATOM 1955 O VAL A 114 5.559 -4.618 -6.948 1.00 0.37 O ATOM 1956 CB VAL A 114 4.622 -2.063 -8.616 1.00 0.36 C ATOM 1957 CG1 VAL A 114 4.293 -0.587 -8.786 1.00 0.65 C ATOM 1958 CG2 VAL A 114 5.075 -2.664 -9.935 1.00 0.56 C ATOM 0 H VAL A 114 6.922 -0.958 -8.543 1.00 0.36 H new ATOM 0 HA VAL A 114 5.178 -2.060 -6.545 1.00 0.36 H new ATOM 0 HB VAL A 114 3.716 -2.585 -8.310 1.00 0.36 H new ATOM 0 HG11 VAL A 114 3.555 -0.468 -9.580 1.00 0.65 H new ATOM 0 HG12 VAL A 114 3.889 -0.195 -7.853 1.00 0.65 H new ATOM 0 HG13 VAL A 114 5.199 -0.040 -9.047 1.00 0.65 H new ATOM 0 HG21 VAL A 114 4.312 -2.493 -10.694 1.00 0.56 H new ATOM 0 HG22 VAL A 114 6.008 -2.195 -10.247 1.00 0.56 H new ATOM 0 HG23 VAL A 114 5.230 -3.736 -9.812 1.00 0.56 H new ATOM 1962 N LYS A 115 7.294 -3.917 -8.188 1.00 0.35 N ATOM 1963 CA LYS A 115 7.941 -5.208 -8.267 1.00 0.37 C ATOM 1964 C LYS A 115 8.369 -5.689 -6.890 1.00 0.35 C ATOM 1965 O LYS A 115 8.286 -6.876 -6.579 1.00 0.37 O ATOM 1966 CB LYS A 115 9.166 -5.094 -9.166 1.00 0.48 C ATOM 1967 CG LYS A 115 9.856 -6.413 -9.415 1.00 0.84 C ATOM 1968 CD LYS A 115 11.179 -6.221 -10.130 1.00 0.81 C ATOM 1969 CE LYS A 115 10.985 -5.703 -11.543 1.00 1.16 C ATOM 1970 NZ LYS A 115 12.277 -5.561 -12.259 1.00 1.72 N ATOM 0 H LYS A 115 7.783 -3.179 -8.695 1.00 0.35 H new ATOM 0 HA LYS A 115 7.234 -5.929 -8.677 1.00 0.37 H new ATOM 0 HB2 LYS A 115 8.866 -4.664 -10.122 1.00 0.48 H new ATOM 0 HB3 LYS A 115 9.876 -4.402 -8.713 1.00 0.48 H new ATOM 0 HG2 LYS A 115 10.025 -6.922 -8.466 1.00 0.84 H new ATOM 0 HG3 LYS A 115 9.209 -7.057 -10.011 1.00 0.84 H new ATOM 0 HD2 LYS A 115 11.798 -5.521 -9.568 1.00 0.81 H new ATOM 0 HD3 LYS A 115 11.717 -7.169 -10.161 1.00 0.81 H new ATOM 0 HE2 LYS A 115 10.337 -6.384 -12.094 1.00 1.16 H new ATOM 0 HE3 LYS A 115 10.479 -4.738 -11.510 1.00 1.16 H new ATOM 0 HZ1 LYS A 115 12.104 -5.205 -13.221 1.00 1.72 H new ATOM 0 HZ2 LYS A 115 12.886 -4.892 -11.747 1.00 1.72 H new ATOM 0 HZ3 LYS A 115 12.748 -6.487 -12.312 1.00 1.72 H new ATOM 1984 N GLU A 116 8.827 -4.767 -6.060 1.00 0.36 N ATOM 1985 CA GLU A 116 9.345 -5.120 -4.770 1.00 0.38 C ATOM 1986 C GLU A 116 8.214 -5.419 -3.784 1.00 0.37 C ATOM 1987 O GLU A 116 8.341 -6.311 -2.952 1.00 0.38 O ATOM 1988 CB GLU A 116 10.289 -4.021 -4.291 1.00 0.43 C ATOM 1989 CG GLU A 116 10.486 -3.987 -2.803 1.00 0.80 C ATOM 1990 CD GLU A 116 11.742 -3.246 -2.407 1.00 1.30 C ATOM 1991 OE1 GLU A 116 11.759 -2.002 -2.483 1.00 2.27 O ATOM 1992 OE2 GLU A 116 12.730 -3.914 -2.033 1.00 1.32 O ATOM 0 H GLU A 116 8.846 -3.768 -6.267 1.00 0.36 H new ATOM 0 HA GLU A 116 9.921 -6.042 -4.841 1.00 0.38 H new ATOM 0 HB2 GLU A 116 11.258 -4.154 -4.772 1.00 0.43 H new ATOM 0 HB3 GLU A 116 9.901 -3.056 -4.617 1.00 0.43 H new ATOM 0 HG2 GLU A 116 9.624 -3.512 -2.335 1.00 0.80 H new ATOM 0 HG3 GLU A 116 10.533 -5.007 -2.422 1.00 0.80 H new ATOM 1999 N VAL A 117 7.094 -4.716 -3.898 1.00 0.36 N ATOM 2000 CA VAL A 117 5.913 -5.066 -3.110 1.00 0.38 C ATOM 2001 C VAL A 117 5.440 -6.477 -3.477 1.00 0.38 C ATOM 2002 O VAL A 117 4.996 -7.233 -2.621 1.00 0.43 O ATOM 2003 CB VAL A 117 4.752 -4.042 -3.273 1.00 0.43 C ATOM 2004 CG1 VAL A 117 5.280 -2.620 -3.208 1.00 0.81 C ATOM 2005 CG2 VAL A 117 3.945 -4.262 -4.541 1.00 0.78 C ATOM 0 H VAL A 117 6.976 -3.913 -4.516 1.00 0.36 H new ATOM 0 HA VAL A 117 6.206 -5.038 -2.061 1.00 0.38 H new ATOM 0 HB VAL A 117 4.069 -4.205 -2.439 1.00 0.43 H new ATOM 0 HG11 VAL A 117 4.453 -1.919 -3.324 1.00 0.81 H new ATOM 0 HG12 VAL A 117 5.763 -2.455 -2.245 1.00 0.81 H new ATOM 0 HG13 VAL A 117 6.003 -2.463 -4.008 1.00 0.81 H new ATOM 0 HG21 VAL A 117 3.150 -3.519 -4.600 1.00 0.78 H new ATOM 0 HG22 VAL A 117 4.597 -4.165 -5.409 1.00 0.78 H new ATOM 0 HG23 VAL A 117 3.508 -5.260 -4.525 1.00 0.78 H new ATOM 2009 N LEU A 118 5.589 -6.845 -4.742 1.00 0.36 N ATOM 2010 CA LEU A 118 5.265 -8.199 -5.182 1.00 0.36 C ATOM 2011 C LEU A 118 6.313 -9.180 -4.683 1.00 0.36 C ATOM 2012 O LEU A 118 5.996 -10.314 -4.344 1.00 0.38 O ATOM 2013 CB LEU A 118 5.185 -8.266 -6.708 1.00 0.41 C ATOM 2014 CG LEU A 118 3.966 -7.596 -7.339 1.00 0.49 C ATOM 2015 CD1 LEU A 118 4.318 -7.089 -8.718 1.00 1.21 C ATOM 2016 CD2 LEU A 118 2.809 -8.575 -7.442 1.00 0.88 C ATOM 0 H LEU A 118 5.930 -6.230 -5.480 1.00 0.36 H new ATOM 0 HA LEU A 118 4.294 -8.468 -4.766 1.00 0.36 H new ATOM 0 HB2 LEU A 118 6.083 -7.806 -7.121 1.00 0.41 H new ATOM 0 HB3 LEU A 118 5.196 -9.314 -7.008 1.00 0.41 H new ATOM 0 HG LEU A 118 3.665 -6.762 -6.706 1.00 0.49 H new ATOM 0 HD11 LEU A 118 3.445 -6.612 -9.164 1.00 1.21 H new ATOM 0 HD12 LEU A 118 5.129 -6.365 -8.643 1.00 1.21 H new ATOM 0 HD13 LEU A 118 4.634 -7.924 -9.343 1.00 1.21 H new ATOM 0 HD21 LEU A 118 1.951 -8.078 -7.894 1.00 0.88 H new ATOM 0 HD22 LEU A 118 3.104 -9.423 -8.060 1.00 0.88 H new ATOM 0 HD23 LEU A 118 2.541 -8.928 -6.446 1.00 0.88 H new ATOM 2028 N LYS A 119 7.555 -8.720 -4.613 1.00 0.36 N ATOM 2029 CA LYS A 119 8.653 -9.538 -4.143 1.00 0.37 C ATOM 2030 C LYS A 119 8.373 -9.986 -2.719 1.00 0.36 C ATOM 2031 O LYS A 119 8.593 -11.142 -2.354 1.00 0.38 O ATOM 2032 CB LYS A 119 9.947 -8.729 -4.215 1.00 0.39 C ATOM 2033 CG LYS A 119 11.123 -9.383 -3.522 1.00 0.43 C ATOM 2034 CD LYS A 119 12.378 -8.525 -3.609 1.00 0.67 C ATOM 2035 CE LYS A 119 12.189 -7.168 -2.940 1.00 0.57 C ATOM 2036 NZ LYS A 119 13.415 -6.334 -3.018 1.00 0.95 N ATOM 0 H LYS A 119 7.824 -7.773 -4.880 1.00 0.36 H new ATOM 0 HA LYS A 119 8.759 -10.424 -4.770 1.00 0.37 H new ATOM 0 HB2 LYS A 119 10.202 -8.563 -5.262 1.00 0.39 H new ATOM 0 HB3 LYS A 119 9.776 -7.749 -3.770 1.00 0.39 H new ATOM 0 HG2 LYS A 119 10.876 -9.560 -2.475 1.00 0.43 H new ATOM 0 HG3 LYS A 119 11.316 -10.356 -3.973 1.00 0.43 H new ATOM 0 HD2 LYS A 119 13.209 -9.049 -3.137 1.00 0.67 H new ATOM 0 HD3 LYS A 119 12.646 -8.379 -4.655 1.00 0.67 H new ATOM 0 HE2 LYS A 119 11.361 -6.641 -3.415 1.00 0.57 H new ATOM 0 HE3 LYS A 119 11.916 -7.314 -1.895 1.00 0.57 H new ATOM 0 HZ1 LYS A 119 13.154 -5.328 -2.973 1.00 0.95 H new ATOM 0 HZ2 LYS A 119 14.043 -6.564 -2.222 1.00 0.95 H new ATOM 0 HZ3 LYS A 119 13.908 -6.524 -3.914 1.00 0.95 H new ATOM 2050 N LEU A 120 7.874 -9.055 -1.924 1.00 0.36 N ATOM 2051 CA LEU A 120 7.464 -9.352 -0.575 1.00 0.37 C ATOM 2052 C LEU A 120 6.162 -10.140 -0.554 1.00 0.36 C ATOM 2053 O LEU A 120 6.045 -11.128 0.175 1.00 0.38 O ATOM 2054 CB LEU A 120 7.306 -8.063 0.236 1.00 0.39 C ATOM 2055 CG LEU A 120 8.606 -7.466 0.767 1.00 0.42 C ATOM 2056 CD1 LEU A 120 9.511 -7.007 -0.356 1.00 1.06 C ATOM 2057 CD2 LEU A 120 8.316 -6.325 1.730 1.00 0.99 C ATOM 0 H LEU A 120 7.745 -8.081 -2.199 1.00 0.36 H new ATOM 0 HA LEU A 120 8.243 -9.965 -0.121 1.00 0.37 H new ATOM 0 HB2 LEU A 120 6.811 -7.319 -0.388 1.00 0.39 H new ATOM 0 HB3 LEU A 120 6.645 -8.262 1.080 1.00 0.39 H new ATOM 0 HG LEU A 120 9.133 -8.251 1.309 1.00 0.42 H new ATOM 0 HD11 LEU A 120 10.426 -6.588 0.062 1.00 1.06 H new ATOM 0 HD12 LEU A 120 9.759 -7.856 -0.994 1.00 1.06 H new ATOM 0 HD13 LEU A 120 9.001 -6.246 -0.947 1.00 1.06 H new ATOM 0 HD21 LEU A 120 9.255 -5.912 2.098 1.00 0.99 H new ATOM 0 HD22 LEU A 120 7.755 -5.546 1.213 1.00 0.99 H new ATOM 0 HD23 LEU A 120 7.730 -6.698 2.570 1.00 0.99 H new ATOM 2069 N TYR A 121 5.180 -9.723 -1.355 1.00 0.35 N ATOM 2070 CA TYR A 121 3.848 -10.300 -1.235 1.00 0.36 C ATOM 2071 C TYR A 121 3.795 -11.731 -1.776 1.00 0.38 C ATOM 2072 O TYR A 121 3.026 -12.559 -1.284 1.00 0.41 O ATOM 2073 CB TYR A 121 2.787 -9.390 -1.877 1.00 0.37 C ATOM 2074 CG TYR A 121 1.464 -10.068 -2.153 1.00 0.56 C ATOM 2075 CD1 TYR A 121 0.544 -10.288 -1.138 1.00 0.84 C ATOM 2076 CD2 TYR A 121 1.142 -10.499 -3.435 1.00 0.74 C ATOM 2077 CE1 TYR A 121 -0.659 -10.918 -1.389 1.00 1.13 C ATOM 2078 CE2 TYR A 121 -0.057 -11.131 -3.692 1.00 1.05 C ATOM 2079 CZ TYR A 121 -0.952 -11.338 -2.665 1.00 1.23 C ATOM 2080 OH TYR A 121 -2.143 -11.976 -2.918 1.00 1.54 O ATOM 0 H TYR A 121 5.280 -9.007 -2.074 1.00 0.35 H new ATOM 0 HA TYR A 121 3.611 -10.366 -0.173 1.00 0.36 H new ATOM 0 HB2 TYR A 121 2.614 -8.537 -1.221 1.00 0.37 H new ATOM 0 HB3 TYR A 121 3.182 -8.997 -2.814 1.00 0.37 H new ATOM 0 HD1 TYR A 121 0.773 -9.961 -0.134 1.00 0.84 H new ATOM 0 HD2 TYR A 121 1.841 -10.337 -4.242 1.00 0.74 H new ATOM 0 HE1 TYR A 121 -1.365 -11.080 -0.588 1.00 1.13 H new ATOM 0 HE2 TYR A 121 -0.293 -11.462 -4.693 1.00 1.05 H new ATOM 0 HH TYR A 121 -2.826 -11.653 -2.294 1.00 1.54 H new ATOM 2090 N LYS A 122 4.620 -12.029 -2.771 1.00 0.40 N ATOM 2091 CA LYS A 122 4.706 -13.382 -3.311 1.00 0.45 C ATOM 2092 C LYS A 122 5.274 -14.347 -2.275 1.00 0.43 C ATOM 2093 O LYS A 122 4.863 -15.504 -2.194 1.00 0.46 O ATOM 2094 CB LYS A 122 5.590 -13.412 -4.563 1.00 0.52 C ATOM 2095 CG LYS A 122 4.943 -12.810 -5.802 1.00 0.60 C ATOM 2096 CD LYS A 122 3.771 -13.648 -6.283 1.00 1.21 C ATOM 2097 CE LYS A 122 3.217 -13.130 -7.599 1.00 1.27 C ATOM 2098 NZ LYS A 122 2.082 -13.958 -8.081 1.00 1.98 N ATOM 0 H LYS A 122 5.239 -11.354 -3.221 1.00 0.40 H new ATOM 0 HA LYS A 122 3.696 -13.694 -3.575 1.00 0.45 H new ATOM 0 HB2 LYS A 122 6.515 -12.875 -4.353 1.00 0.52 H new ATOM 0 HB3 LYS A 122 5.863 -14.446 -4.776 1.00 0.52 H new ATOM 0 HG2 LYS A 122 4.601 -11.799 -5.580 1.00 0.60 H new ATOM 0 HG3 LYS A 122 5.684 -12.729 -6.597 1.00 0.60 H new ATOM 0 HD2 LYS A 122 4.089 -14.684 -6.404 1.00 1.21 H new ATOM 0 HD3 LYS A 122 2.984 -13.642 -5.529 1.00 1.21 H new ATOM 0 HE2 LYS A 122 2.888 -12.098 -7.474 1.00 1.27 H new ATOM 0 HE3 LYS A 122 4.008 -13.124 -8.349 1.00 1.27 H new ATOM 0 HZ1 LYS A 122 1.730 -13.574 -8.981 1.00 1.98 H new ATOM 0 HZ2 LYS A 122 2.403 -14.937 -8.224 1.00 1.98 H new ATOM 0 HZ3 LYS A 122 1.318 -13.943 -7.376 1.00 1.98 H new ATOM 2112 N ALA A 123 6.212 -13.853 -1.477 1.00 0.42 N ATOM 2113 CA ALA A 123 6.950 -14.688 -0.540 1.00 0.43 C ATOM 2114 C ALA A 123 6.231 -14.859 0.798 1.00 0.43 C ATOM 2115 O ALA A 123 6.706 -15.593 1.666 1.00 0.70 O ATOM 2116 CB ALA A 123 8.338 -14.106 -0.315 1.00 0.49 C ATOM 0 H ALA A 123 6.481 -12.869 -1.461 1.00 0.42 H new ATOM 0 HA ALA A 123 7.027 -15.680 -0.986 1.00 0.43 H new ATOM 0 HB1 ALA A 123 8.887 -14.734 0.387 1.00 0.49 H new ATOM 0 HB2 ALA A 123 8.874 -14.067 -1.263 1.00 0.49 H new ATOM 0 HB3 ALA A 123 8.249 -13.099 0.093 1.00 0.49 H new ATOM 2122 N MET A 124 5.107 -14.175 0.986 1.00 0.44 N ATOM 2123 CA MET A 124 4.356 -14.314 2.231 1.00 0.42 C ATOM 2124 C MET A 124 3.607 -15.637 2.268 1.00 0.42 C ATOM 2125 O MET A 124 3.288 -16.207 1.224 1.00 0.42 O ATOM 2126 CB MET A 124 3.366 -13.166 2.418 1.00 0.41 C ATOM 2127 CG MET A 124 4.020 -11.844 2.776 1.00 0.45 C ATOM 2128 SD MET A 124 2.850 -10.654 3.456 1.00 0.50 S ATOM 2129 CE MET A 124 1.652 -10.551 2.134 1.00 0.46 C ATOM 0 H MET A 124 4.701 -13.531 0.307 1.00 0.44 H new ATOM 0 HA MET A 124 5.079 -14.287 3.046 1.00 0.42 H new ATOM 0 HB2 MET A 124 2.793 -13.040 1.499 1.00 0.41 H new ATOM 0 HB3 MET A 124 2.657 -13.434 3.202 1.00 0.41 H new ATOM 0 HG2 MET A 124 4.815 -12.021 3.500 1.00 0.45 H new ATOM 0 HG3 MET A 124 4.487 -11.421 1.886 1.00 0.45 H new ATOM 0 HE1 MET A 124 1.322 -9.518 2.022 1.00 0.46 H new ATOM 0 HE2 MET A 124 2.107 -10.890 1.203 1.00 0.46 H new ATOM 0 HE3 MET A 124 0.795 -11.182 2.370 1.00 0.46 H new ATOM 2139 N SER A 125 3.336 -16.124 3.470 1.00 0.47 N ATOM 2140 CA SER A 125 2.553 -17.337 3.643 1.00 0.54 C ATOM 2141 C SER A 125 1.129 -17.132 3.125 1.00 0.58 C ATOM 2142 O SER A 125 0.565 -16.051 3.306 1.00 0.92 O ATOM 2143 CB SER A 125 2.530 -17.731 5.117 1.00 0.62 C ATOM 2144 OG SER A 125 3.839 -17.700 5.665 1.00 1.18 O ATOM 0 H SER A 125 3.648 -15.696 4.342 1.00 0.47 H new ATOM 0 HA SER A 125 3.014 -18.140 3.068 1.00 0.54 H new ATOM 0 HB2 SER A 125 1.883 -17.051 5.670 1.00 0.62 H new ATOM 0 HB3 SER A 125 2.109 -18.731 5.225 1.00 0.62 H new ATOM 0 HG SER A 125 3.985 -16.842 6.115 1.00 1.18 H new ATOM 2150 N ASP A 126 0.564 -18.140 2.471 1.00 0.44 N ATOM 2151 CA ASP A 126 -0.711 -17.984 1.756 1.00 0.43 C ATOM 2152 C ASP A 126 -1.804 -17.392 2.638 1.00 0.39 C ATOM 2153 O ASP A 126 -2.514 -16.469 2.222 1.00 0.38 O ATOM 2154 CB ASP A 126 -1.179 -19.319 1.178 1.00 0.47 C ATOM 2155 CG ASP A 126 -0.236 -19.853 0.125 1.00 1.37 C ATOM 2156 OD1 ASP A 126 -0.290 -19.375 -1.025 1.00 1.81 O ATOM 2157 OD2 ASP A 126 0.562 -20.758 0.441 1.00 2.21 O ATOM 0 H ASP A 126 0.964 -19.077 2.417 1.00 0.44 H new ATOM 0 HA ASP A 126 -0.526 -17.283 0.942 1.00 0.43 H new ATOM 0 HB2 ASP A 126 -1.271 -20.048 1.983 1.00 0.47 H new ATOM 0 HB3 ASP A 126 -2.171 -19.196 0.744 1.00 0.47 H new ATOM 2162 N ALA A 127 -1.923 -17.911 3.855 1.00 0.38 N ATOM 2163 CA ALA A 127 -2.928 -17.437 4.801 1.00 0.37 C ATOM 2164 C ALA A 127 -2.737 -15.953 5.109 1.00 0.33 C ATOM 2165 O ALA A 127 -3.702 -15.224 5.337 1.00 0.34 O ATOM 2166 CB ALA A 127 -2.872 -18.258 6.078 1.00 0.42 C ATOM 0 H ALA A 127 -1.333 -18.663 4.211 1.00 0.38 H new ATOM 0 HA ALA A 127 -3.911 -17.560 4.346 1.00 0.37 H new ATOM 0 HB1 ALA A 127 -3.626 -17.896 6.777 1.00 0.42 H new ATOM 0 HB2 ALA A 127 -3.066 -19.305 5.846 1.00 0.42 H new ATOM 0 HB3 ALA A 127 -1.884 -18.163 6.529 1.00 0.42 H new ATOM 2172 N GLY A 128 -1.488 -15.515 5.092 1.00 0.31 N ATOM 2173 CA GLY A 128 -1.185 -14.120 5.326 1.00 0.31 C ATOM 2174 C GLY A 128 -1.532 -13.267 4.122 1.00 0.29 C ATOM 2175 O GLY A 128 -1.974 -12.126 4.265 1.00 0.30 O ATOM 0 H GLY A 128 -0.674 -16.105 4.919 1.00 0.31 H new ATOM 0 HA2 GLY A 128 -1.740 -13.767 6.195 1.00 0.31 H new ATOM 0 HA3 GLY A 128 -0.126 -14.011 5.558 1.00 0.31 H new ATOM 2179 N LYS A 129 -1.357 -13.841 2.936 1.00 0.32 N ATOM 2180 CA LYS A 129 -1.650 -13.144 1.689 1.00 0.39 C ATOM 2181 C LYS A 129 -3.149 -12.900 1.557 1.00 0.35 C ATOM 2182 O LYS A 129 -3.588 -11.811 1.190 1.00 0.36 O ATOM 2183 CB LYS A 129 -1.158 -13.967 0.494 1.00 0.56 C ATOM 2184 CG LYS A 129 0.347 -14.198 0.482 1.00 0.58 C ATOM 2185 CD LYS A 129 0.758 -15.159 -0.625 1.00 0.59 C ATOM 2186 CE LYS A 129 0.507 -14.577 -2.007 1.00 0.94 C ATOM 2187 NZ LYS A 129 0.785 -15.565 -3.084 1.00 1.32 N ATOM 0 H LYS A 129 -1.012 -14.793 2.812 1.00 0.32 H new ATOM 0 HA LYS A 129 -1.133 -12.185 1.702 1.00 0.39 H new ATOM 0 HB2 LYS A 129 -1.664 -14.932 0.497 1.00 0.56 H new ATOM 0 HB3 LYS A 129 -1.445 -13.460 -0.427 1.00 0.56 H new ATOM 0 HG2 LYS A 129 0.861 -13.246 0.347 1.00 0.58 H new ATOM 0 HG3 LYS A 129 0.662 -14.597 1.446 1.00 0.58 H new ATOM 0 HD2 LYS A 129 1.816 -15.401 -0.520 1.00 0.59 H new ATOM 0 HD3 LYS A 129 0.205 -16.092 -0.519 1.00 0.59 H new ATOM 0 HE2 LYS A 129 -0.529 -14.244 -2.078 1.00 0.94 H new ATOM 0 HE3 LYS A 129 1.135 -13.698 -2.150 1.00 0.94 H new ATOM 0 HZ1 LYS A 129 0.602 -15.129 -4.010 1.00 1.32 H new ATOM 0 HZ2 LYS A 129 1.780 -15.864 -3.033 1.00 1.32 H new ATOM 0 HZ3 LYS A 129 0.168 -16.393 -2.963 1.00 1.32 H new ATOM 2201 N ALA A 130 -3.920 -13.941 1.860 1.00 0.35 N ATOM 2202 CA ALA A 130 -5.380 -13.880 1.820 1.00 0.37 C ATOM 2203 C ALA A 130 -5.914 -12.815 2.757 1.00 0.33 C ATOM 2204 O ALA A 130 -6.839 -12.072 2.423 1.00 0.38 O ATOM 2205 CB ALA A 130 -5.959 -15.223 2.223 1.00 0.42 C ATOM 0 H ALA A 130 -3.552 -14.850 2.140 1.00 0.35 H new ATOM 0 HA ALA A 130 -5.676 -13.629 0.801 1.00 0.37 H new ATOM 0 HB1 ALA A 130 -7.047 -15.174 2.192 1.00 0.42 H new ATOM 0 HB2 ALA A 130 -5.611 -15.991 1.533 1.00 0.42 H new ATOM 0 HB3 ALA A 130 -5.635 -15.470 3.234 1.00 0.42 H new ATOM 2211 N ASP A 131 -5.314 -12.752 3.932 1.00 0.29 N ATOM 2212 CA ASP A 131 -5.770 -11.868 4.990 1.00 0.29 C ATOM 2213 C ASP A 131 -5.456 -10.418 4.643 1.00 0.27 C ATOM 2214 O ASP A 131 -6.153 -9.496 5.069 1.00 0.30 O ATOM 2215 CB ASP A 131 -5.112 -12.297 6.295 1.00 0.30 C ATOM 2216 CG ASP A 131 -5.539 -11.478 7.498 1.00 0.40 C ATOM 2217 OD1 ASP A 131 -6.738 -11.514 7.850 1.00 0.55 O ATOM 2218 OD2 ASP A 131 -4.693 -10.763 8.070 1.00 0.45 O ATOM 0 H ASP A 131 -4.498 -13.311 4.180 1.00 0.29 H new ATOM 0 HA ASP A 131 -6.852 -11.938 5.103 1.00 0.29 H new ATOM 0 HB2 ASP A 131 -5.345 -13.345 6.480 1.00 0.30 H new ATOM 0 HB3 ASP A 131 -4.030 -12.226 6.185 1.00 0.30 H new ATOM 2223 N PHE A 132 -4.422 -10.230 3.834 1.00 0.24 N ATOM 2224 CA PHE A 132 -4.108 -8.919 3.283 1.00 0.22 C ATOM 2225 C PHE A 132 -5.251 -8.443 2.392 1.00 0.23 C ATOM 2226 O PHE A 132 -5.527 -7.248 2.306 1.00 0.25 O ATOM 2227 CB PHE A 132 -2.799 -8.973 2.485 1.00 0.23 C ATOM 2228 CG PHE A 132 -2.437 -7.671 1.827 1.00 0.24 C ATOM 2229 CD1 PHE A 132 -1.914 -6.625 2.569 1.00 0.33 C ATOM 2230 CD2 PHE A 132 -2.627 -7.491 0.465 1.00 0.26 C ATOM 2231 CE1 PHE A 132 -1.586 -5.426 1.968 1.00 0.39 C ATOM 2232 CE2 PHE A 132 -2.300 -6.294 -0.141 1.00 0.30 C ATOM 2233 CZ PHE A 132 -1.778 -5.260 0.611 1.00 0.36 C ATOM 0 H PHE A 132 -3.785 -10.972 3.544 1.00 0.24 H new ATOM 0 HA PHE A 132 -3.982 -8.214 4.104 1.00 0.22 H new ATOM 0 HB2 PHE A 132 -1.990 -9.270 3.152 1.00 0.23 H new ATOM 0 HB3 PHE A 132 -2.882 -9.745 1.720 1.00 0.23 H new ATOM 0 HD1 PHE A 132 -1.761 -6.749 3.631 1.00 0.33 H new ATOM 0 HD2 PHE A 132 -3.035 -8.296 -0.128 1.00 0.26 H new ATOM 0 HE1 PHE A 132 -1.180 -4.619 2.559 1.00 0.39 H new ATOM 0 HE2 PHE A 132 -2.452 -6.167 -1.203 1.00 0.30 H new ATOM 0 HZ PHE A 132 -1.521 -4.324 0.139 1.00 0.36 H new ATOM 2243 N GLY A 133 -5.931 -9.389 1.761 1.00 0.22 N ATOM 2244 CA GLY A 133 -7.036 -9.057 0.886 1.00 0.24 C ATOM 2245 C GLY A 133 -8.285 -8.651 1.641 1.00 0.23 C ATOM 2246 O GLY A 133 -9.275 -8.250 1.036 1.00 0.27 O ATOM 0 H GLY A 133 -5.735 -10.387 1.840 1.00 0.22 H new ATOM 0 HA2 GLY A 133 -6.737 -8.244 0.224 1.00 0.24 H new ATOM 0 HA3 GLY A 133 -7.263 -9.915 0.254 1.00 0.24 H new ATOM 2250 N LYS A 134 -8.240 -8.760 2.961 1.00 0.27 N ATOM 2251 CA LYS A 134 -9.374 -8.376 3.789 1.00 0.29 C ATOM 2252 C LYS A 134 -9.204 -6.939 4.266 1.00 0.30 C ATOM 2253 O LYS A 134 -10.165 -6.174 4.353 1.00 0.39 O ATOM 2254 CB LYS A 134 -9.484 -9.309 4.995 1.00 0.34 C ATOM 2255 CG LYS A 134 -9.500 -10.786 4.636 1.00 0.63 C ATOM 2256 CD LYS A 134 -9.479 -11.659 5.880 1.00 1.29 C ATOM 2257 CE LYS A 134 -10.749 -11.496 6.695 1.00 1.61 C ATOM 2258 NZ LYS A 134 -10.668 -12.205 7.995 1.00 2.43 N ATOM 0 H LYS A 134 -7.434 -9.110 3.480 1.00 0.27 H new ATOM 0 HA LYS A 134 -10.285 -8.453 3.196 1.00 0.29 H new ATOM 0 HB2 LYS A 134 -8.647 -9.118 5.666 1.00 0.34 H new ATOM 0 HB3 LYS A 134 -10.394 -9.070 5.545 1.00 0.34 H new ATOM 0 HG2 LYS A 134 -10.390 -11.009 4.048 1.00 0.63 H new ATOM 0 HG3 LYS A 134 -8.638 -11.020 4.011 1.00 0.63 H new ATOM 0 HD2 LYS A 134 -9.362 -12.703 5.591 1.00 1.29 H new ATOM 0 HD3 LYS A 134 -8.616 -11.400 6.493 1.00 1.29 H new ATOM 0 HE2 LYS A 134 -10.934 -10.436 6.871 1.00 1.61 H new ATOM 0 HE3 LYS A 134 -11.597 -11.877 6.126 1.00 1.61 H new ATOM 0 HZ1 LYS A 134 -11.555 -12.069 8.521 1.00 2.43 H new ATOM 0 HZ2 LYS A 134 -10.517 -13.220 7.828 1.00 2.43 H new ATOM 0 HZ3 LYS A 134 -9.875 -11.824 8.549 1.00 2.43 H new ATOM 2272 N GLN A 135 -7.963 -6.592 4.564 1.00 0.30 N ATOM 2273 CA GLN A 135 -7.624 -5.273 5.076 1.00 0.31 C ATOM 2274 C GLN A 135 -7.290 -4.318 3.939 1.00 0.30 C ATOM 2275 O GLN A 135 -7.593 -3.129 4.011 1.00 0.36 O ATOM 2276 CB GLN A 135 -6.465 -5.392 6.070 1.00 0.33 C ATOM 2277 CG GLN A 135 -6.791 -6.330 7.221 1.00 0.51 C ATOM 2278 CD GLN A 135 -8.092 -5.963 7.912 1.00 0.71 C ATOM 2279 OE1 GLN A 135 -8.468 -4.790 7.984 1.00 1.83 O ATOM 2280 NE2 GLN A 135 -8.808 -6.964 8.401 1.00 0.75 N ATOM 0 H GLN A 135 -7.162 -7.215 4.458 1.00 0.30 H new ATOM 0 HA GLN A 135 -8.487 -4.859 5.598 1.00 0.31 H new ATOM 0 HB2 GLN A 135 -5.578 -5.753 5.550 1.00 0.33 H new ATOM 0 HB3 GLN A 135 -6.224 -4.405 6.465 1.00 0.33 H new ATOM 0 HG2 GLN A 135 -6.856 -7.352 6.847 1.00 0.51 H new ATOM 0 HG3 GLN A 135 -5.978 -6.308 7.947 1.00 0.51 H new ATOM 0 HE21 GLN A 135 -8.466 -7.922 8.323 1.00 0.75 H new ATOM 0 HE22 GLN A 135 -9.702 -6.777 8.855 1.00 0.75 H new ATOM 2289 N PHE A 136 -6.687 -4.841 2.878 1.00 0.26 N ATOM 2290 CA PHE A 136 -6.431 -4.048 1.681 1.00 0.26 C ATOM 2291 C PHE A 136 -6.843 -4.821 0.430 1.00 0.23 C ATOM 2292 O PHE A 136 -5.996 -5.274 -0.346 1.00 0.24 O ATOM 2293 CB PHE A 136 -4.960 -3.625 1.599 1.00 0.31 C ATOM 2294 CG PHE A 136 -4.599 -2.561 2.597 1.00 0.34 C ATOM 2295 CD1 PHE A 136 -5.225 -1.324 2.584 1.00 0.57 C ATOM 2296 CD2 PHE A 136 -3.620 -2.802 3.548 1.00 0.27 C ATOM 2297 CE1 PHE A 136 -4.879 -0.354 3.497 1.00 0.69 C ATOM 2298 CE2 PHE A 136 -3.268 -1.830 4.461 1.00 0.37 C ATOM 2299 CZ PHE A 136 -3.964 -0.594 4.446 1.00 0.58 C ATOM 0 H PHE A 136 -6.367 -5.808 2.822 1.00 0.26 H new ATOM 0 HA PHE A 136 -7.033 -3.142 1.742 1.00 0.26 H new ATOM 0 HB2 PHE A 136 -4.327 -4.497 1.761 1.00 0.31 H new ATOM 0 HB3 PHE A 136 -4.748 -3.260 0.594 1.00 0.31 H new ATOM 0 HD1 PHE A 136 -5.991 -1.120 1.851 1.00 0.57 H new ATOM 0 HD2 PHE A 136 -3.127 -3.762 3.574 1.00 0.27 H new ATOM 0 HE1 PHE A 136 -5.352 0.616 3.448 1.00 0.69 H new ATOM 0 HE2 PHE A 136 -2.477 -2.007 5.174 1.00 0.37 H new ATOM 0 HZ PHE A 136 -3.757 0.153 5.198 1.00 0.58 H new ATOM 2309 N PRO A 137 -8.163 -4.958 0.209 1.00 0.26 N ATOM 2310 CA PRO A 137 -8.709 -5.715 -0.923 1.00 0.30 C ATOM 2311 C PRO A 137 -8.334 -5.087 -2.254 1.00 0.29 C ATOM 2312 O PRO A 137 -8.189 -5.778 -3.262 1.00 0.30 O ATOM 2313 CB PRO A 137 -10.227 -5.646 -0.720 1.00 0.38 C ATOM 2314 CG PRO A 137 -10.419 -5.225 0.698 1.00 0.63 C ATOM 2315 CD PRO A 137 -9.231 -4.379 1.040 1.00 0.34 C ATOM 0 HA PRO A 137 -8.321 -6.733 -0.952 1.00 0.30 H new ATOM 0 HB2 PRO A 137 -10.683 -4.933 -1.407 1.00 0.38 H new ATOM 0 HB3 PRO A 137 -10.693 -6.613 -0.909 1.00 0.38 H new ATOM 0 HG2 PRO A 137 -11.346 -4.663 0.817 1.00 0.63 H new ATOM 0 HG3 PRO A 137 -10.485 -6.091 1.357 1.00 0.63 H new ATOM 0 HD2 PRO A 137 -9.402 -3.329 0.804 1.00 0.34 H new ATOM 0 HD3 PRO A 137 -8.990 -4.432 2.102 1.00 0.34 H new ATOM 2323 N PHE A 138 -8.163 -3.773 -2.236 1.00 0.32 N ATOM 2324 CA PHE A 138 -7.845 -3.016 -3.437 1.00 0.36 C ATOM 2325 C PHE A 138 -6.485 -3.412 -3.987 1.00 0.35 C ATOM 2326 O PHE A 138 -6.308 -3.525 -5.195 1.00 0.36 O ATOM 2327 CB PHE A 138 -7.871 -1.520 -3.135 1.00 0.43 C ATOM 2328 CG PHE A 138 -9.172 -1.058 -2.548 1.00 0.86 C ATOM 2329 CD1 PHE A 138 -10.286 -0.876 -3.351 1.00 1.21 C ATOM 2330 CD2 PHE A 138 -9.277 -0.796 -1.192 1.00 1.56 C ATOM 2331 CE1 PHE A 138 -11.482 -0.443 -2.813 1.00 1.88 C ATOM 2332 CE2 PHE A 138 -10.470 -0.364 -0.647 1.00 2.23 C ATOM 2333 CZ PHE A 138 -11.587 -0.218 -1.463 1.00 2.31 C ATOM 0 H PHE A 138 -8.240 -3.204 -1.393 1.00 0.32 H new ATOM 0 HA PHE A 138 -8.598 -3.243 -4.192 1.00 0.36 H new ATOM 0 HB2 PHE A 138 -7.063 -1.281 -2.444 1.00 0.43 H new ATOM 0 HB3 PHE A 138 -7.678 -0.967 -4.054 1.00 0.43 H new ATOM 0 HD1 PHE A 138 -10.218 -1.075 -4.410 1.00 1.21 H new ATOM 0 HD2 PHE A 138 -8.416 -0.931 -0.554 1.00 1.56 H new ATOM 0 HE1 PHE A 138 -12.335 -0.281 -3.455 1.00 1.88 H new ATOM 0 HE2 PHE A 138 -10.535 -0.141 0.408 1.00 2.23 H new ATOM 0 HZ PHE A 138 -12.535 0.072 -1.035 1.00 2.31 H new ATOM 2343 N LEU A 139 -5.529 -3.639 -3.096 1.00 0.35 N ATOM 2344 CA LEU A 139 -4.184 -4.010 -3.509 1.00 0.36 C ATOM 2345 C LEU A 139 -4.108 -5.502 -3.811 1.00 0.33 C ATOM 2346 O LEU A 139 -3.483 -5.910 -4.788 1.00 0.35 O ATOM 2347 CB LEU A 139 -3.162 -3.625 -2.439 1.00 0.40 C ATOM 2348 CG LEU A 139 -2.978 -2.121 -2.227 1.00 0.48 C ATOM 2349 CD1 LEU A 139 -2.039 -1.858 -1.060 1.00 1.02 C ATOM 2350 CD2 LEU A 139 -2.444 -1.467 -3.495 1.00 0.86 C ATOM 0 H LEU A 139 -5.660 -3.573 -2.087 1.00 0.35 H new ATOM 0 HA LEU A 139 -3.945 -3.462 -4.420 1.00 0.36 H new ATOM 0 HB2 LEU A 139 -3.463 -4.075 -1.493 1.00 0.40 H new ATOM 0 HB3 LEU A 139 -2.198 -4.059 -2.706 1.00 0.40 H new ATOM 0 HG LEU A 139 -3.949 -1.685 -1.994 1.00 0.48 H new ATOM 0 HD11 LEU A 139 -1.920 -0.783 -0.924 1.00 1.02 H new ATOM 0 HD12 LEU A 139 -2.456 -2.295 -0.152 1.00 1.02 H new ATOM 0 HD13 LEU A 139 -1.068 -2.307 -1.266 1.00 1.02 H new ATOM 0 HD21 LEU A 139 -2.319 -0.397 -3.328 1.00 0.86 H new ATOM 0 HD22 LEU A 139 -1.482 -1.909 -3.755 1.00 0.86 H new ATOM 0 HD23 LEU A 139 -3.149 -1.626 -4.311 1.00 0.86 H new ATOM 2362 N ALA A 140 -4.772 -6.310 -2.990 1.00 0.30 N ATOM 2363 CA ALA A 140 -4.810 -7.753 -3.212 1.00 0.28 C ATOM 2364 C ALA A 140 -5.453 -8.060 -4.562 1.00 0.28 C ATOM 2365 O ALA A 140 -5.120 -9.049 -5.215 1.00 0.35 O ATOM 2366 CB ALA A 140 -5.558 -8.447 -2.087 1.00 0.25 C ATOM 0 H ALA A 140 -5.288 -5.993 -2.169 1.00 0.30 H new ATOM 0 HA ALA A 140 -3.788 -8.133 -3.222 1.00 0.28 H new ATOM 0 HB1 ALA A 140 -5.576 -9.521 -2.270 1.00 0.25 H new ATOM 0 HB2 ALA A 140 -5.056 -8.249 -1.140 1.00 0.25 H new ATOM 0 HB3 ALA A 140 -6.580 -8.070 -2.042 1.00 0.25 H new ATOM 2372 N LYS A 141 -6.371 -7.193 -4.964 1.00 0.26 N ATOM 2373 CA LYS A 141 -6.981 -7.237 -6.284 1.00 0.27 C ATOM 2374 C LYS A 141 -5.919 -7.259 -7.379 1.00 0.29 C ATOM 2375 O LYS A 141 -5.722 -8.266 -8.062 1.00 0.30 O ATOM 2376 CB LYS A 141 -7.853 -5.997 -6.483 1.00 0.28 C ATOM 2377 CG LYS A 141 -8.621 -6.009 -7.793 1.00 0.36 C ATOM 2378 CD LYS A 141 -9.463 -4.759 -7.959 1.00 1.15 C ATOM 2379 CE LYS A 141 -10.279 -4.809 -9.240 1.00 1.76 C ATOM 2380 NZ LYS A 141 -11.097 -3.585 -9.422 1.00 2.58 N ATOM 0 H LYS A 141 -6.716 -6.433 -4.378 1.00 0.26 H new ATOM 0 HA LYS A 141 -7.580 -8.145 -6.349 1.00 0.27 H new ATOM 0 HB2 LYS A 141 -8.559 -5.921 -5.656 1.00 0.28 H new ATOM 0 HB3 LYS A 141 -7.223 -5.108 -6.447 1.00 0.28 H new ATOM 0 HG2 LYS A 141 -7.921 -6.090 -8.625 1.00 0.36 H new ATOM 0 HG3 LYS A 141 -9.264 -6.889 -7.830 1.00 0.36 H new ATOM 0 HD2 LYS A 141 -10.131 -4.651 -7.104 1.00 1.15 H new ATOM 0 HD3 LYS A 141 -8.817 -3.881 -7.971 1.00 1.15 H new ATOM 0 HE2 LYS A 141 -9.610 -4.929 -10.092 1.00 1.76 H new ATOM 0 HE3 LYS A 141 -10.931 -5.682 -9.221 1.00 1.76 H new ATOM 0 HZ1 LYS A 141 -11.639 -3.658 -10.307 1.00 2.58 H new ATOM 0 HZ2 LYS A 141 -11.753 -3.484 -8.622 1.00 2.58 H new ATOM 0 HZ3 LYS A 141 -10.473 -2.754 -9.465 1.00 2.58 H new ATOM 2394 N VAL A 142 -5.236 -6.128 -7.524 1.00 0.31 N ATOM 2395 CA VAL A 142 -4.268 -5.920 -8.587 1.00 0.36 C ATOM 2396 C VAL A 142 -3.113 -6.928 -8.539 1.00 0.37 C ATOM 2397 O VAL A 142 -2.559 -7.292 -9.582 1.00 0.44 O ATOM 2398 CB VAL A 142 -3.726 -4.457 -8.566 1.00 0.40 C ATOM 2399 CG1 VAL A 142 -4.181 -3.711 -7.326 1.00 0.50 C ATOM 2400 CG2 VAL A 142 -2.217 -4.418 -8.633 1.00 0.48 C ATOM 0 H VAL A 142 -5.342 -5.327 -6.902 1.00 0.31 H new ATOM 0 HA VAL A 142 -4.794 -6.086 -9.527 1.00 0.36 H new ATOM 0 HB VAL A 142 -4.135 -3.968 -9.450 1.00 0.40 H new ATOM 0 HG11 VAL A 142 -3.784 -2.696 -7.346 1.00 0.50 H new ATOM 0 HG12 VAL A 142 -5.270 -3.675 -7.302 1.00 0.50 H new ATOM 0 HG13 VAL A 142 -3.816 -4.226 -6.437 1.00 0.50 H new ATOM 0 HG21 VAL A 142 -1.879 -3.382 -8.616 1.00 0.48 H new ATOM 0 HG22 VAL A 142 -1.801 -4.950 -7.777 1.00 0.48 H new ATOM 0 HG23 VAL A 142 -1.881 -4.894 -9.554 1.00 0.48 H new ATOM 2404 N PHE A 143 -2.753 -7.394 -7.346 1.00 0.33 N ATOM 2405 CA PHE A 143 -1.602 -8.281 -7.223 1.00 0.36 C ATOM 2406 C PHE A 143 -1.934 -9.672 -7.751 1.00 0.40 C ATOM 2407 O PHE A 143 -1.175 -10.239 -8.537 1.00 0.47 O ATOM 2408 CB PHE A 143 -1.099 -8.373 -5.776 1.00 0.36 C ATOM 2409 CG PHE A 143 -0.705 -7.054 -5.165 1.00 0.34 C ATOM 2410 CD1 PHE A 143 -0.407 -5.970 -5.973 1.00 0.47 C ATOM 2411 CD2 PHE A 143 -0.616 -6.902 -3.791 1.00 0.58 C ATOM 2412 CE1 PHE A 143 -0.027 -4.762 -5.421 1.00 0.47 C ATOM 2413 CE2 PHE A 143 -0.237 -5.698 -3.234 1.00 0.62 C ATOM 2414 CZ PHE A 143 -0.015 -4.614 -4.030 1.00 0.39 C ATOM 0 H PHE A 143 -3.229 -7.178 -6.470 1.00 0.33 H new ATOM 0 HA PHE A 143 -0.802 -7.852 -7.826 1.00 0.36 H new ATOM 0 HB2 PHE A 143 -1.878 -8.825 -5.162 1.00 0.36 H new ATOM 0 HB3 PHE A 143 -0.240 -9.044 -5.745 1.00 0.36 H new ATOM 0 HD1 PHE A 143 -0.472 -6.070 -7.046 1.00 0.47 H new ATOM 0 HD2 PHE A 143 -0.847 -7.738 -3.147 1.00 0.58 H new ATOM 0 HE1 PHE A 143 0.259 -3.938 -6.058 1.00 0.47 H new ATOM 0 HE2 PHE A 143 -0.116 -5.614 -2.164 1.00 0.62 H new ATOM 0 HZ PHE A 143 0.169 -3.646 -3.589 1.00 0.39 H new ATOM 2424 N GLU A 144 -3.082 -10.205 -7.342 1.00 0.41 N ATOM 2425 CA GLU A 144 -3.462 -11.567 -7.708 1.00 0.45 C ATOM 2426 C GLU A 144 -3.905 -11.655 -9.164 1.00 0.45 C ATOM 2427 O GLU A 144 -3.716 -12.684 -9.815 1.00 0.54 O ATOM 2428 CB GLU A 144 -4.569 -12.092 -6.796 1.00 0.47 C ATOM 2429 CG GLU A 144 -4.189 -12.098 -5.327 1.00 0.60 C ATOM 2430 CD GLU A 144 -5.098 -12.975 -4.495 1.00 1.55 C ATOM 2431 OE1 GLU A 144 -6.191 -12.515 -4.110 1.00 2.58 O ATOM 2432 OE2 GLU A 144 -4.725 -14.132 -4.223 1.00 1.55 O ATOM 0 H GLU A 144 -3.763 -9.718 -6.760 1.00 0.41 H new ATOM 0 HA GLU A 144 -2.576 -12.190 -7.582 1.00 0.45 H new ATOM 0 HB2 GLU A 144 -5.461 -11.480 -6.930 1.00 0.47 H new ATOM 0 HB3 GLU A 144 -4.830 -13.106 -7.100 1.00 0.47 H new ATOM 0 HG2 GLU A 144 -3.161 -12.445 -5.223 1.00 0.60 H new ATOM 0 HG3 GLU A 144 -4.222 -11.079 -4.943 1.00 0.60 H new ATOM 2439 N SER A 145 -4.484 -10.578 -9.679 1.00 0.43 N ATOM 2440 CA SER A 145 -4.910 -10.543 -11.073 1.00 0.49 C ATOM 2441 C SER A 145 -3.703 -10.434 -12.002 1.00 0.57 C ATOM 2442 O SER A 145 -3.799 -10.692 -13.202 1.00 1.32 O ATOM 2443 CB SER A 145 -5.874 -9.379 -11.304 1.00 0.50 C ATOM 2444 OG SER A 145 -5.374 -8.179 -10.739 1.00 1.29 O ATOM 0 H SER A 145 -4.669 -9.722 -9.157 1.00 0.43 H new ATOM 0 HA SER A 145 -5.430 -11.474 -11.299 1.00 0.49 H new ATOM 0 HB2 SER A 145 -6.033 -9.242 -12.374 1.00 0.50 H new ATOM 0 HB3 SER A 145 -6.844 -9.614 -10.865 1.00 0.50 H new ATOM 0 HG SER A 145 -5.624 -8.134 -9.792 1.00 1.29 H new ATOM 2450 N GLY A 146 -2.567 -10.056 -11.430 1.00 0.79 N ATOM 2451 CA GLY A 146 -1.343 -9.982 -12.197 1.00 0.78 C ATOM 2452 C GLY A 146 -1.088 -8.602 -12.756 1.00 0.70 C ATOM 2453 O GLY A 146 -0.091 -8.380 -13.438 1.00 1.09 O ATOM 0 H GLY A 146 -2.473 -9.799 -10.447 1.00 0.79 H new ATOM 0 HA2 GLY A 146 -0.505 -10.274 -11.565 1.00 0.78 H new ATOM 0 HA3 GLY A 146 -1.389 -10.699 -13.017 1.00 0.78 H new ATOM 2457 N LYS A 147 -1.974 -7.667 -12.454 1.00 0.54 N ATOM 2458 CA LYS A 147 -1.852 -6.312 -12.970 1.00 0.48 C ATOM 2459 C LYS A 147 -0.558 -5.662 -12.493 1.00 0.40 C ATOM 2460 O LYS A 147 0.168 -5.055 -13.283 1.00 0.45 O ATOM 2461 CB LYS A 147 -3.057 -5.470 -12.562 1.00 0.54 C ATOM 2462 CG LYS A 147 -2.961 -4.026 -13.018 1.00 0.83 C ATOM 2463 CD LYS A 147 -4.221 -3.251 -12.683 1.00 1.15 C ATOM 2464 CE LYS A 147 -5.357 -3.612 -13.617 1.00 1.55 C ATOM 2465 NZ LYS A 147 -6.627 -2.962 -13.212 1.00 1.98 N ATOM 0 H LYS A 147 -2.785 -7.820 -11.855 1.00 0.54 H new ATOM 0 HA LYS A 147 -1.823 -6.367 -14.058 1.00 0.48 H new ATOM 0 HB2 LYS A 147 -3.961 -5.916 -12.978 1.00 0.54 H new ATOM 0 HB3 LYS A 147 -3.159 -5.495 -11.477 1.00 0.54 H new ATOM 0 HG2 LYS A 147 -2.103 -3.550 -12.543 1.00 0.83 H new ATOM 0 HG3 LYS A 147 -2.788 -3.994 -14.094 1.00 0.83 H new ATOM 0 HD2 LYS A 147 -4.514 -3.458 -11.654 1.00 1.15 H new ATOM 0 HD3 LYS A 147 -4.020 -2.182 -12.748 1.00 1.15 H new ATOM 0 HE2 LYS A 147 -5.102 -3.311 -14.633 1.00 1.55 H new ATOM 0 HE3 LYS A 147 -5.489 -4.694 -13.628 1.00 1.55 H new ATOM 0 HZ1 LYS A 147 -7.009 -2.419 -14.012 1.00 1.98 H new ATOM 0 HZ2 LYS A 147 -7.314 -3.689 -12.928 1.00 1.98 H new ATOM 0 HZ3 LYS A 147 -6.450 -2.322 -12.412 1.00 1.98 H new ATOM 2479 N ALA A 148 -0.262 -5.803 -11.209 1.00 0.33 N ATOM 2480 CA ALA A 148 0.985 -5.285 -10.666 1.00 0.29 C ATOM 2481 C ALA A 148 2.165 -6.041 -11.253 1.00 0.31 C ATOM 2482 O ALA A 148 3.190 -5.452 -11.579 1.00 0.34 O ATOM 2483 CB ALA A 148 1.000 -5.381 -9.149 1.00 0.33 C ATOM 0 H ALA A 148 -0.863 -6.268 -10.529 1.00 0.33 H new ATOM 0 HA ALA A 148 1.066 -4.233 -10.940 1.00 0.29 H new ATOM 0 HB1 ALA A 148 1.943 -4.987 -8.769 1.00 0.33 H new ATOM 0 HB2 ALA A 148 0.173 -4.801 -8.740 1.00 0.33 H new ATOM 0 HB3 ALA A 148 0.895 -6.424 -8.849 1.00 0.33 H new ATOM 2489 N ALA A 149 1.991 -7.348 -11.402 1.00 0.35 N ATOM 2490 CA ALA A 149 3.029 -8.217 -11.938 1.00 0.41 C ATOM 2491 C ALA A 149 3.458 -7.779 -13.337 1.00 0.43 C ATOM 2492 O ALA A 149 4.643 -7.792 -13.671 1.00 0.51 O ATOM 2493 CB ALA A 149 2.530 -9.649 -11.973 1.00 0.48 C ATOM 0 H ALA A 149 1.129 -7.834 -11.155 1.00 0.35 H new ATOM 0 HA ALA A 149 3.899 -8.148 -11.285 1.00 0.41 H new ATOM 0 HB1 ALA A 149 3.310 -10.296 -12.375 1.00 0.48 H new ATOM 0 HB2 ALA A 149 2.276 -9.971 -10.963 1.00 0.48 H new ATOM 0 HB3 ALA A 149 1.645 -9.711 -12.607 1.00 0.48 H new ATOM 2499 N LYS A 150 2.481 -7.389 -14.147 1.00 0.41 N ATOM 2500 CA LYS A 150 2.734 -6.975 -15.521 1.00 0.46 C ATOM 2501 C LYS A 150 3.353 -5.582 -15.570 1.00 0.45 C ATOM 2502 O LYS A 150 4.206 -5.305 -16.414 1.00 0.59 O ATOM 2503 CB LYS A 150 1.443 -7.028 -16.346 1.00 0.53 C ATOM 2504 CG LYS A 150 1.176 -8.388 -16.983 1.00 1.16 C ATOM 2505 CD LYS A 150 1.259 -9.520 -15.970 1.00 1.45 C ATOM 2506 CE LYS A 150 1.170 -10.880 -16.638 1.00 1.96 C ATOM 2507 NZ LYS A 150 1.445 -11.986 -15.684 1.00 2.82 N ATOM 0 H LYS A 150 1.499 -7.351 -13.873 1.00 0.41 H new ATOM 0 HA LYS A 150 3.449 -7.672 -15.958 1.00 0.46 H new ATOM 0 HB2 LYS A 150 0.602 -6.766 -15.704 1.00 0.53 H new ATOM 0 HB3 LYS A 150 1.493 -6.273 -17.131 1.00 0.53 H new ATOM 0 HG2 LYS A 150 0.188 -8.385 -17.443 1.00 1.16 H new ATOM 0 HG3 LYS A 150 1.898 -8.562 -17.781 1.00 1.16 H new ATOM 0 HD2 LYS A 150 2.196 -9.446 -15.418 1.00 1.45 H new ATOM 0 HD3 LYS A 150 0.453 -9.418 -15.244 1.00 1.45 H new ATOM 0 HE2 LYS A 150 0.176 -11.009 -17.067 1.00 1.96 H new ATOM 0 HE3 LYS A 150 1.881 -10.927 -17.462 1.00 1.96 H new ATOM 0 HZ1 LYS A 150 1.475 -12.889 -16.199 1.00 2.82 H new ATOM 0 HZ2 LYS A 150 2.360 -11.823 -15.218 1.00 2.82 H new ATOM 0 HZ3 LYS A 150 0.693 -12.021 -14.967 1.00 2.82 H new ATOM 2521 N PHE A 151 2.931 -4.714 -14.657 1.00 0.35 N ATOM 2522 CA PHE A 151 3.531 -3.391 -14.531 1.00 0.36 C ATOM 2523 C PHE A 151 4.968 -3.518 -14.037 1.00 0.40 C ATOM 2524 O PHE A 151 5.847 -2.755 -14.436 1.00 0.46 O ATOM 2525 CB PHE A 151 2.719 -2.517 -13.569 1.00 0.34 C ATOM 2526 CG PHE A 151 3.120 -1.068 -13.602 1.00 0.33 C ATOM 2527 CD1 PHE A 151 2.545 -0.198 -14.514 1.00 0.46 C ATOM 2528 CD2 PHE A 151 4.079 -0.580 -12.731 1.00 0.43 C ATOM 2529 CE1 PHE A 151 2.921 1.131 -14.555 1.00 0.49 C ATOM 2530 CE2 PHE A 151 4.457 0.747 -12.768 1.00 0.44 C ATOM 2531 CZ PHE A 151 3.879 1.604 -13.682 1.00 0.39 C ATOM 0 H PHE A 151 2.178 -4.902 -13.995 1.00 0.35 H new ATOM 0 HA PHE A 151 3.530 -2.915 -15.511 1.00 0.36 H new ATOM 0 HB2 PHE A 151 1.661 -2.600 -13.818 1.00 0.34 H new ATOM 0 HB3 PHE A 151 2.838 -2.897 -12.554 1.00 0.34 H new ATOM 0 HD1 PHE A 151 1.795 -0.562 -15.200 1.00 0.46 H new ATOM 0 HD2 PHE A 151 4.537 -1.245 -12.014 1.00 0.43 H new ATOM 0 HE1 PHE A 151 2.465 1.799 -15.270 1.00 0.49 H new ATOM 0 HE2 PHE A 151 5.205 1.115 -12.081 1.00 0.44 H new ATOM 0 HZ PHE A 151 4.176 2.642 -13.714 1.00 0.39 H new ATOM 2541 N ALA A 152 5.191 -4.495 -13.173 1.00 0.39 N ATOM 2542 CA ALA A 152 6.513 -4.774 -12.641 1.00 0.44 C ATOM 2543 C ALA A 152 7.410 -5.404 -13.697 1.00 0.52 C ATOM 2544 O ALA A 152 8.620 -5.163 -13.730 1.00 0.59 O ATOM 2545 CB ALA A 152 6.401 -5.689 -11.437 1.00 0.44 C ATOM 0 H ALA A 152 4.461 -5.115 -12.822 1.00 0.39 H new ATOM 0 HA ALA A 152 6.965 -3.830 -12.336 1.00 0.44 H new ATOM 0 HB1 ALA A 152 7.396 -5.895 -11.042 1.00 0.44 H new ATOM 0 HB2 ALA A 152 5.798 -5.206 -10.668 1.00 0.44 H new ATOM 0 HB3 ALA A 152 5.928 -6.625 -11.734 1.00 0.44 H new ATOM 2551 N GLY A 153 6.800 -6.203 -14.567 1.00 0.65 N ATOM 2552 CA GLY A 153 7.535 -6.859 -15.629 1.00 0.84 C ATOM 2553 C GLY A 153 8.086 -8.207 -15.214 1.00 1.06 C ATOM 2554 O GLY A 153 9.072 -8.678 -15.781 1.00 1.62 O ATOM 0 H GLY A 153 5.801 -6.408 -14.553 1.00 0.65 H new ATOM 0 HA2 GLY A 153 6.881 -6.989 -16.491 1.00 0.84 H new ATOM 0 HA3 GLY A 153 8.357 -6.217 -15.946 1.00 0.84 H new ATOM 2558 N GLU A 154 7.451 -8.842 -14.237 1.00 0.99 N ATOM 2559 CA GLU A 154 7.951 -10.107 -13.713 1.00 1.35 C ATOM 2560 C GLU A 154 7.121 -11.302 -14.177 1.00 1.52 C ATOM 2561 O GLU A 154 7.117 -11.646 -15.359 1.00 2.33 O ATOM 2562 CB GLU A 154 8.050 -10.065 -12.187 1.00 1.95 C ATOM 2563 CG GLU A 154 6.808 -9.543 -11.486 1.00 2.50 C ATOM 2564 CD GLU A 154 6.793 -9.930 -10.030 1.00 3.37 C ATOM 2565 OE1 GLU A 154 6.386 -11.060 -9.717 1.00 3.70 O ATOM 2566 OE2 GLU A 154 7.167 -9.085 -9.188 1.00 4.12 O ATOM 0 H GLU A 154 6.596 -8.506 -13.794 1.00 0.99 H new ATOM 0 HA GLU A 154 8.953 -10.244 -14.120 1.00 1.35 H new ATOM 0 HB2 GLU A 154 8.262 -11.070 -11.822 1.00 1.95 H new ATOM 0 HB3 GLU A 154 8.898 -9.440 -11.908 1.00 1.95 H new ATOM 0 HG2 GLU A 154 6.767 -8.457 -11.576 1.00 2.50 H new ATOM 0 HG3 GLU A 154 5.919 -9.937 -11.978 1.00 2.50 H new ATOM 2573 N ASN A 155 6.421 -11.920 -13.241 1.00 1.82 N ATOM 2574 CA ASN A 155 5.670 -13.147 -13.498 1.00 2.70 C ATOM 2575 C ASN A 155 4.576 -12.919 -14.537 1.00 3.48 C ATOM 2576 O ASN A 155 3.905 -11.865 -14.494 1.00 3.96 O ATOM 2577 CB ASN A 155 5.076 -13.728 -12.202 1.00 2.84 C ATOM 2578 CG ASN A 155 3.874 -12.964 -11.672 1.00 3.21 C ATOM 2579 OD1 ASN A 155 2.738 -13.225 -12.065 1.00 3.95 O ATOM 2580 ND2 ASN A 155 4.106 -12.044 -10.748 1.00 3.15 N ATOM 2581 OXT ASN A 155 4.396 -13.798 -15.404 1.00 4.01 O ATOM 0 H ASN A 155 6.354 -11.588 -12.279 1.00 1.82 H new ATOM 0 HA ASN A 155 6.373 -13.877 -13.900 1.00 2.70 H new ATOM 0 HB2 ASN A 155 4.785 -14.763 -12.381 1.00 2.84 H new ATOM 0 HB3 ASN A 155 5.850 -13.743 -11.435 1.00 2.84 H new ATOM 0 HD21 ASN A 155 3.329 -11.525 -10.338 1.00 3.15 H new ATOM 0 HD22 ASN A 155 5.062 -11.854 -10.446 1.00 3.15 H new TER 2588 ASN A 155