USER MOD reduce.3.24.130724 H: found=0, std=0, add=1419, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1415 hydrogens (21 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 120 THR OG1 : rot -140:sc= 1.04 USER MOD Set 1.2: A 134 SER OG : rot 100:sc= 0.833 USER MOD Set 2.1: A 92 HIS : no HE2:sc= 0.181 K(o=-0.45,f=-7.8!) USER MOD Set 2.2: A 94 MET CE :methyl -167:sc= -0.758 (180deg=-1.07) USER MOD Set 2.3: A 121 GLN : amide:sc= 0.128 K(o=-0.45,f=-5.6!) USER MOD Set 3.1: A 48 HIS : no HE2:sc= 1.76 K(o=3.7,f=-6!) USER MOD Set 3.2: A 56 LYS NZ :NH3+ -159:sc= 1.94 (180deg=0.811) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 80:sc= 0.935 USER MOD Single : A 13 MET CE :methyl 180:sc= -0.021 (180deg=-0.021) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 20 MET CE :methyl -165:sc= -0.171 (180deg=-1.03) USER MOD Single : A 22 THR OG1 : rot -107:sc= 0.114 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HD1:sc= -0.413 X(o=-0.41,f=-0.043) USER MOD Single : A 33 GLN : amide:sc= 0.771 K(o=0.77,f=-0.0097) USER MOD Single : A 35 GLN : amide:sc= 1.16 K(o=1.2,f=-0.12) USER MOD Single : A 36 GLN : amide:sc= -0.343 X(o=-0.34,f=-0.061) USER MOD Single : A 39 TYR OH : rot 30:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot 135:sc= 1.41 USER MOD Single : A 43 SER OG : rot -164:sc= 0.749 USER MOD Single : A 45 CYS SG : rot 25:sc= 0.166 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.00202 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= 0.926 K(o=0.93,f=-0.86) USER MOD Single : A 63 TYR OH : rot 162:sc= 0.206 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot -30:sc= 0 USER MOD Single : A 72 GLN : amide:sc= -0.123 X(o=-0.12,f=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 ASN : amide:sc=-0.00289 K(o=-0.0029,f=-0.67) USER MOD Single : A 87 ASN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 96 ASN : amide:sc= 0.783 K(o=0.78,f=-0.22) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= 0.999 K(o=1,f=-0.25) USER MOD Single : A 113 HIS : no HE2:sc= -0.344 K(o=-0.34,f=-3.1!) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl -153:sc= -0.367 (180deg=-0.889) USER MOD Single : A 136 SER OG : rot -125:sc= 1.2 USER MOD Single : A 138 CYS SG : rot -71:sc= 0.307 USER MOD Single : A 139 SER OG : rot 180:sc= 0.0926 USER MOD Single : A 147 SER OG : rot 71:sc= 0.363 USER MOD Single : A 151 GLN : amide:sc= -0.0583 X(o=-0.058,f=-0.54) USER MOD Single : A 153 LYS NZ :NH3+ -155:sc= 0.838 (180deg=0.546) USER MOD Single : A 154 MET CE :methyl -177:sc= -0.779 (180deg=-0.805) USER MOD Single : A 155 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 161 SER OG : rot -150:sc= -0.0225 USER MOD Single : A 163 MET CE :methyl -172:sc= 0 (180deg=-0.142) USER MOD Single : A 166 MET CE :methyl 178:sc= -1.22 (180deg=-1.23) USER MOD Single : A 169 ASN : amide:sc= -0.326 X(o=-0.33,f=-0.21) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 4.360 32.508 15.476 1.00 8.40 N ATOM 2 CA MET A 1 3.067 31.981 14.963 1.00 7.80 C ATOM 3 C MET A 1 3.226 30.565 14.401 1.00 6.63 C ATOM 4 O MET A 1 2.784 29.622 15.054 1.00 7.20 O ATOM 5 CB MET A 1 2.381 32.925 13.950 1.00 8.30 C ATOM 6 CG MET A 1 1.719 34.127 14.638 1.00 9.58 C ATOM 7 SD MET A 1 0.665 35.149 13.564 1.00 10.41 S ATOM 8 CE MET A 1 1.916 35.993 12.556 1.00 10.53 C ATOM 0 H1 MET A 1 4.220 33.468 15.850 1.00 8.40 H new ATOM 0 H2 MET A 1 4.711 31.889 16.235 1.00 8.40 H new ATOM 0 H3 MET A 1 5.055 32.536 14.703 1.00 8.40 H new ATOM 0 HA MET A 1 2.397 31.929 15.821 1.00 7.80 H new ATOM 0 HB2 MET A 1 3.118 33.281 13.230 1.00 8.30 H new ATOM 0 HB3 MET A 1 1.629 32.370 13.389 1.00 8.30 H new ATOM 0 HG2 MET A 1 1.117 33.763 15.471 1.00 9.58 H new ATOM 0 HG3 MET A 1 2.500 34.759 15.061 1.00 9.58 H new ATOM 0 HE1 MET A 1 1.424 36.658 11.846 1.00 10.53 H new ATOM 0 HE2 MET A 1 2.572 36.575 13.203 1.00 10.53 H new ATOM 0 HE3 MET A 1 2.504 35.254 12.012 1.00 10.53 H new ATOM 20 N SER A 2 3.817 30.417 13.206 1.00 5.59 N ATOM 21 CA SER A 2 3.954 29.170 12.413 1.00 4.93 C ATOM 22 C SER A 2 2.656 28.824 11.652 1.00 4.58 C ATOM 23 O SER A 2 1.551 29.181 12.070 1.00 5.75 O ATOM 24 CB SER A 2 4.461 27.957 13.220 1.00 5.52 C ATOM 25 OG SER A 2 5.700 28.247 13.862 1.00 6.44 O ATOM 0 H SER A 2 4.242 31.213 12.730 1.00 5.59 H new ATOM 0 HA SER A 2 4.734 29.390 11.684 1.00 4.93 H new ATOM 0 HB2 SER A 2 3.718 27.677 13.967 1.00 5.52 H new ATOM 0 HB3 SER A 2 4.584 27.101 12.557 1.00 5.52 H new ATOM 0 HG SER A 2 5.998 27.462 14.368 1.00 6.44 H new ATOM 31 N ASP A 3 2.779 28.151 10.502 1.00 4.09 N ATOM 32 CA ASP A 3 1.676 27.968 9.545 1.00 5.31 C ATOM 33 C ASP A 3 0.707 26.842 9.943 1.00 5.24 C ATOM 34 O ASP A 3 -0.491 26.938 9.671 1.00 6.57 O ATOM 35 CB ASP A 3 2.258 27.678 8.152 1.00 6.30 C ATOM 36 CG ASP A 3 3.261 28.749 7.696 1.00 6.95 C ATOM 37 OD1 ASP A 3 2.829 29.780 7.127 1.00 7.92 O ATOM 38 OD2 ASP A 3 4.482 28.553 7.914 1.00 6.90 O ATOM 0 H ASP A 3 3.652 27.714 10.205 1.00 4.09 H new ATOM 0 HA ASP A 3 1.098 28.892 9.542 1.00 5.31 H new ATOM 0 HB2 ASP A 3 2.750 26.706 8.163 1.00 6.30 H new ATOM 0 HB3 ASP A 3 1.445 27.615 7.429 1.00 6.30 H new ATOM 43 N LYS A 4 1.230 25.777 10.571 1.00 3.92 N ATOM 44 CA LYS A 4 0.489 24.632 11.141 1.00 3.57 C ATOM 45 C LYS A 4 -0.214 23.749 10.086 1.00 3.30 C ATOM 46 O LYS A 4 -0.992 22.867 10.444 1.00 3.10 O ATOM 47 CB LYS A 4 -0.485 25.108 12.242 1.00 3.48 C ATOM 48 CG LYS A 4 0.217 25.836 13.406 1.00 3.80 C ATOM 49 CD LYS A 4 -0.780 26.631 14.259 1.00 3.98 C ATOM 50 CE LYS A 4 -1.252 27.883 13.503 1.00 5.50 C ATOM 51 NZ LYS A 4 -2.338 28.592 14.226 1.00 5.98 N ATOM 0 H LYS A 4 2.237 25.683 10.704 1.00 3.92 H new ATOM 0 HA LYS A 4 1.235 23.980 11.595 1.00 3.57 H new ATOM 0 HB2 LYS A 4 -1.225 25.775 11.799 1.00 3.48 H new ATOM 0 HB3 LYS A 4 -1.026 24.247 12.635 1.00 3.48 H new ATOM 0 HG2 LYS A 4 0.733 25.108 14.032 1.00 3.80 H new ATOM 0 HG3 LYS A 4 0.976 26.510 13.009 1.00 3.80 H new ATOM 0 HD2 LYS A 4 -1.636 26.004 14.508 1.00 3.98 H new ATOM 0 HD3 LYS A 4 -0.313 26.921 15.200 1.00 3.98 H new ATOM 0 HE2 LYS A 4 -0.409 28.560 13.360 1.00 5.50 H new ATOM 0 HE3 LYS A 4 -1.603 27.597 12.511 1.00 5.50 H new ATOM 0 HZ1 LYS A 4 -2.627 29.430 13.682 1.00 5.98 H new ATOM 0 HZ2 LYS A 4 -3.152 27.955 14.340 1.00 5.98 H new ATOM 0 HZ3 LYS A 4 -1.996 28.888 15.163 1.00 5.98 H new ATOM 65 N ASP A 5 0.055 23.934 8.791 1.00 3.33 N ATOM 66 CA ASP A 5 -0.596 23.184 7.704 1.00 3.09 C ATOM 67 C ASP A 5 -0.307 21.674 7.768 1.00 2.68 C ATOM 68 O ASP A 5 -1.204 20.879 7.516 1.00 2.47 O ATOM 69 CB ASP A 5 -0.166 23.774 6.354 1.00 3.42 C ATOM 70 CG ASP A 5 -0.849 23.067 5.170 1.00 4.17 C ATOM 71 OD1 ASP A 5 -2.066 23.287 4.962 1.00 4.97 O ATOM 72 OD2 ASP A 5 -0.158 22.317 4.441 1.00 4.47 O ATOM 0 H ASP A 5 0.738 24.615 8.460 1.00 3.33 H new ATOM 0 HA ASP A 5 -1.675 23.288 7.822 1.00 3.09 H new ATOM 0 HB2 ASP A 5 -0.408 24.837 6.330 1.00 3.42 H new ATOM 0 HB3 ASP A 5 0.916 23.691 6.250 1.00 3.42 H new ATOM 77 N PHE A 6 0.900 21.271 8.184 1.00 2.62 N ATOM 78 CA PHE A 6 1.260 19.866 8.430 1.00 2.29 C ATOM 79 C PHE A 6 0.426 19.254 9.568 1.00 2.22 C ATOM 80 O PHE A 6 -0.093 18.145 9.437 1.00 1.96 O ATOM 81 CB PHE A 6 2.769 19.793 8.737 1.00 2.35 C ATOM 82 CG PHE A 6 3.209 18.542 9.479 1.00 2.27 C ATOM 83 CD1 PHE A 6 3.209 17.288 8.837 1.00 3.10 C ATOM 84 CD2 PHE A 6 3.581 18.627 10.837 1.00 2.36 C ATOM 85 CE1 PHE A 6 3.582 16.131 9.546 1.00 3.55 C ATOM 86 CE2 PHE A 6 3.953 17.471 11.544 1.00 2.83 C ATOM 87 CZ PHE A 6 3.955 16.221 10.899 1.00 3.25 C ATOM 0 H PHE A 6 1.666 21.920 8.362 1.00 2.62 H new ATOM 0 HA PHE A 6 1.039 19.278 7.539 1.00 2.29 H new ATOM 0 HB2 PHE A 6 3.320 19.854 7.798 1.00 2.35 H new ATOM 0 HB3 PHE A 6 3.048 20.666 9.328 1.00 2.35 H new ATOM 0 HD1 PHE A 6 2.922 17.214 7.798 1.00 3.10 H new ATOM 0 HD2 PHE A 6 3.580 19.585 11.336 1.00 2.36 H new ATOM 0 HE1 PHE A 6 3.582 15.172 9.050 1.00 3.55 H new ATOM 0 HE2 PHE A 6 4.238 17.542 12.583 1.00 2.83 H new ATOM 0 HZ PHE A 6 4.242 15.332 11.442 1.00 3.25 H new ATOM 97 N PHE A 7 0.266 19.997 10.669 1.00 2.48 N ATOM 98 CA PHE A 7 -0.538 19.599 11.826 1.00 2.48 C ATOM 99 C PHE A 7 -2.024 19.541 11.462 1.00 2.36 C ATOM 100 O PHE A 7 -2.718 18.611 11.851 1.00 2.16 O ATOM 101 CB PHE A 7 -0.289 20.597 12.969 1.00 2.82 C ATOM 102 CG PHE A 7 -1.302 20.541 14.099 1.00 2.95 C ATOM 103 CD1 PHE A 7 -1.217 19.540 15.085 1.00 2.14 C ATOM 104 CD2 PHE A 7 -2.346 21.486 14.150 1.00 4.57 C ATOM 105 CE1 PHE A 7 -2.170 19.487 16.118 1.00 2.19 C ATOM 106 CE2 PHE A 7 -3.301 21.429 15.181 1.00 4.72 C ATOM 107 CZ PHE A 7 -3.214 20.431 16.167 1.00 3.21 C ATOM 0 H PHE A 7 0.703 20.912 10.781 1.00 2.48 H new ATOM 0 HA PHE A 7 -0.244 18.600 12.148 1.00 2.48 H new ATOM 0 HB2 PHE A 7 0.704 20.415 13.381 1.00 2.82 H new ATOM 0 HB3 PHE A 7 -0.283 21.606 12.556 1.00 2.82 H new ATOM 0 HD1 PHE A 7 -0.420 18.812 15.048 1.00 2.14 H new ATOM 0 HD2 PHE A 7 -2.413 22.256 13.396 1.00 4.57 H new ATOM 0 HE1 PHE A 7 -2.101 18.720 16.876 1.00 2.19 H new ATOM 0 HE2 PHE A 7 -4.102 22.153 15.215 1.00 4.72 H new ATOM 0 HZ PHE A 7 -3.946 20.388 16.960 1.00 3.21 H new ATOM 117 N SER A 8 -2.511 20.519 10.704 1.00 2.50 N ATOM 118 CA SER A 8 -3.909 20.612 10.278 1.00 2.47 C ATOM 119 C SER A 8 -4.268 19.512 9.267 1.00 2.16 C ATOM 120 O SER A 8 -5.332 18.900 9.362 1.00 2.02 O ATOM 121 CB SER A 8 -4.168 22.008 9.693 1.00 2.79 C ATOM 122 OG SER A 8 -5.553 22.226 9.461 1.00 2.88 O ATOM 0 H SER A 8 -1.935 21.287 10.360 1.00 2.50 H new ATOM 0 HA SER A 8 -4.550 20.461 11.146 1.00 2.47 H new ATOM 0 HB2 SER A 8 -3.789 22.767 10.378 1.00 2.79 H new ATOM 0 HB3 SER A 8 -3.619 22.119 8.758 1.00 2.79 H new ATOM 0 HG SER A 8 -5.685 23.123 9.090 1.00 2.88 H new ATOM 128 N TRP A 9 -3.352 19.187 8.345 1.00 2.06 N ATOM 129 CA TRP A 9 -3.506 18.096 7.376 1.00 1.82 C ATOM 130 C TRP A 9 -3.532 16.759 8.119 1.00 1.49 C ATOM 131 O TRP A 9 -4.436 15.956 7.896 1.00 1.30 O ATOM 132 CB TRP A 9 -2.376 18.167 6.330 1.00 1.89 C ATOM 133 CG TRP A 9 -2.498 17.326 5.087 1.00 1.87 C ATOM 134 CD1 TRP A 9 -2.869 16.026 5.012 1.00 1.90 C ATOM 135 CD2 TRP A 9 -2.208 17.720 3.704 1.00 2.59 C ATOM 136 NE1 TRP A 9 -2.868 15.607 3.697 1.00 1.83 N ATOM 137 CE2 TRP A 9 -2.460 16.607 2.846 1.00 2.24 C ATOM 138 CE3 TRP A 9 -1.749 18.905 3.087 1.00 3.89 C ATOM 139 CZ2 TRP A 9 -2.278 16.667 1.455 1.00 2.92 C ATOM 140 CZ3 TRP A 9 -1.556 18.976 1.693 1.00 4.76 C ATOM 141 CH2 TRP A 9 -1.822 17.863 0.876 1.00 4.24 C ATOM 0 H TRP A 9 -2.467 19.685 8.251 1.00 2.06 H new ATOM 0 HA TRP A 9 -4.449 18.193 6.839 1.00 1.82 H new ATOM 0 HB2 TRP A 9 -2.276 19.207 6.019 1.00 1.89 H new ATOM 0 HB3 TRP A 9 -1.446 17.892 6.827 1.00 1.89 H new ATOM 0 HD1 TRP A 9 -3.128 15.407 5.858 1.00 1.90 H new ATOM 0 HE1 TRP A 9 -3.137 14.671 3.394 1.00 1.83 H new ATOM 0 HE3 TRP A 9 -1.542 19.773 3.695 1.00 3.89 H new ATOM 0 HZ2 TRP A 9 -2.486 15.805 0.838 1.00 2.92 H new ATOM 0 HZ3 TRP A 9 -1.201 19.894 1.248 1.00 4.76 H new ATOM 0 HH2 TRP A 9 -1.676 17.927 -0.192 1.00 4.24 H new ATOM 152 N ARG A 10 -2.614 16.563 9.077 1.00 1.51 N ATOM 153 CA ARG A 10 -2.607 15.393 9.963 1.00 1.31 C ATOM 154 C ARG A 10 -3.924 15.300 10.745 1.00 1.35 C ATOM 155 O ARG A 10 -4.584 14.268 10.698 1.00 1.22 O ATOM 156 CB ARG A 10 -1.368 15.436 10.878 1.00 1.52 C ATOM 157 CG ARG A 10 -1.370 14.310 11.926 1.00 1.58 C ATOM 158 CD ARG A 10 -0.029 14.168 12.655 1.00 2.06 C ATOM 159 NE ARG A 10 0.979 13.503 11.807 1.00 3.14 N ATOM 160 CZ ARG A 10 2.163 13.047 12.201 1.00 3.97 C ATOM 161 NH1 ARG A 10 2.606 13.222 13.429 1.00 3.56 N ATOM 162 NH2 ARG A 10 2.926 12.396 11.351 1.00 5.77 N ATOM 0 H ARG A 10 -1.852 17.216 9.259 1.00 1.51 H new ATOM 0 HA ARG A 10 -2.537 14.483 9.368 1.00 1.31 H new ATOM 0 HB2 ARG A 10 -0.468 15.359 10.269 1.00 1.52 H new ATOM 0 HB3 ARG A 10 -1.328 16.400 11.385 1.00 1.52 H new ATOM 0 HG2 ARG A 10 -2.156 14.502 12.656 1.00 1.58 H new ATOM 0 HG3 ARG A 10 -1.613 13.367 11.437 1.00 1.58 H new ATOM 0 HD2 ARG A 10 0.333 15.153 12.948 1.00 2.06 H new ATOM 0 HD3 ARG A 10 -0.171 13.595 13.571 1.00 2.06 H new ATOM 0 HE ARG A 10 0.744 13.382 10.822 1.00 3.14 H new ATOM 0 HH11 ARG A 10 2.035 13.721 14.111 1.00 3.56 H new ATOM 0 HH12 ARG A 10 3.520 12.859 13.698 1.00 3.56 H new ATOM 0 HH21 ARG A 10 2.608 12.243 10.394 1.00 5.77 H new ATOM 0 HH22 ARG A 10 3.836 12.044 11.649 1.00 5.77 H new ATOM 176 N ARG A 11 -4.369 16.391 11.374 1.00 1.56 N ATOM 177 CA ARG A 11 -5.621 16.472 12.146 1.00 1.62 C ATOM 178 C ARG A 11 -6.840 16.125 11.279 1.00 1.44 C ATOM 179 O ARG A 11 -7.685 15.334 11.698 1.00 1.31 O ATOM 180 CB ARG A 11 -5.721 17.885 12.755 1.00 1.98 C ATOM 181 CG ARG A 11 -6.950 18.092 13.649 1.00 2.21 C ATOM 182 CD ARG A 11 -6.972 19.510 14.236 1.00 2.63 C ATOM 183 NE ARG A 11 -8.186 19.743 15.042 1.00 2.82 N ATOM 184 CZ ARG A 11 -8.374 19.429 16.321 1.00 2.83 C ATOM 185 NH1 ARG A 11 -7.446 18.837 17.043 1.00 3.36 N ATOM 186 NH2 ARG A 11 -9.522 19.713 16.897 1.00 3.24 N ATOM 0 H ARG A 11 -3.855 17.272 11.362 1.00 1.56 H new ATOM 0 HA ARG A 11 -5.611 15.736 12.950 1.00 1.62 H new ATOM 0 HB2 ARG A 11 -4.822 18.083 13.339 1.00 1.98 H new ATOM 0 HB3 ARG A 11 -5.744 18.617 11.948 1.00 1.98 H new ATOM 0 HG2 ARG A 11 -7.858 17.920 13.071 1.00 2.21 H new ATOM 0 HG3 ARG A 11 -6.944 17.360 14.457 1.00 2.21 H new ATOM 0 HD2 ARG A 11 -6.088 19.662 14.855 1.00 2.63 H new ATOM 0 HD3 ARG A 11 -6.925 20.240 13.428 1.00 2.63 H new ATOM 0 HE ARG A 11 -8.967 20.195 14.566 1.00 2.82 H new ATOM 0 HH11 ARG A 11 -6.546 18.603 16.624 1.00 3.36 H new ATOM 0 HH12 ARG A 11 -7.627 18.612 18.021 1.00 3.36 H new ATOM 0 HH21 ARG A 11 -10.261 20.171 16.363 1.00 3.24 H new ATOM 0 HH22 ARG A 11 -9.673 19.475 17.877 1.00 3.24 H new ATOM 200 N THR A 12 -6.887 16.646 10.047 1.00 1.49 N ATOM 201 CA THR A 12 -7.929 16.375 9.038 1.00 1.48 C ATOM 202 C THR A 12 -7.916 14.912 8.614 1.00 1.23 C ATOM 203 O THR A 12 -8.980 14.305 8.528 1.00 1.25 O ATOM 204 CB THR A 12 -7.752 17.314 7.837 1.00 1.68 C ATOM 205 OG1 THR A 12 -7.909 18.641 8.283 1.00 1.94 O ATOM 206 CG2 THR A 12 -8.791 17.080 6.740 1.00 1.77 C ATOM 0 H THR A 12 -6.175 17.293 9.708 1.00 1.49 H new ATOM 0 HA THR A 12 -8.906 16.569 9.482 1.00 1.48 H new ATOM 0 HB THR A 12 -6.763 17.121 7.421 1.00 1.68 H new ATOM 0 HG1 THR A 12 -7.076 18.947 8.700 1.00 1.94 H new ATOM 0 HG21 THR A 12 -8.614 17.773 5.918 1.00 1.77 H new ATOM 0 HG22 THR A 12 -8.710 16.056 6.375 1.00 1.77 H new ATOM 0 HG23 THR A 12 -9.790 17.244 7.144 1.00 1.77 H new ATOM 214 N MET A 13 -6.738 14.319 8.405 1.00 1.04 N ATOM 215 CA MET A 13 -6.612 12.895 8.075 1.00 0.86 C ATOM 216 C MET A 13 -7.056 12.025 9.257 1.00 0.71 C ATOM 217 O MET A 13 -7.852 11.115 9.063 1.00 0.67 O ATOM 218 CB MET A 13 -5.167 12.549 7.649 1.00 0.78 C ATOM 219 CG MET A 13 -5.074 11.917 6.251 1.00 1.29 C ATOM 220 SD MET A 13 -4.748 13.030 4.856 1.00 1.91 S ATOM 221 CE MET A 13 -6.266 14.011 4.792 1.00 1.63 C ATOM 0 H MET A 13 -5.846 14.810 8.459 1.00 1.04 H new ATOM 0 HA MET A 13 -7.268 12.685 7.230 1.00 0.86 H new ATOM 0 HB2 MET A 13 -4.564 13.457 7.670 1.00 0.78 H new ATOM 0 HB3 MET A 13 -4.736 11.863 8.378 1.00 0.78 H new ATOM 0 HG2 MET A 13 -4.287 11.164 6.273 1.00 1.29 H new ATOM 0 HG3 MET A 13 -6.010 11.394 6.054 1.00 1.29 H new ATOM 0 HE1 MET A 13 -6.198 14.734 3.979 1.00 1.63 H new ATOM 0 HE2 MET A 13 -7.118 13.353 4.622 1.00 1.63 H new ATOM 0 HE3 MET A 13 -6.398 14.539 5.736 1.00 1.63 H new ATOM 231 N LEU A 14 -6.634 12.338 10.487 1.00 0.78 N ATOM 232 CA LEU A 14 -7.016 11.608 11.707 1.00 0.84 C ATOM 233 C LEU A 14 -8.535 11.630 11.899 1.00 0.82 C ATOM 234 O LEU A 14 -9.133 10.588 12.166 1.00 0.82 O ATOM 235 CB LEU A 14 -6.282 12.211 12.937 1.00 1.10 C ATOM 236 CG LEU A 14 -5.008 11.474 13.412 1.00 1.57 C ATOM 237 CD1 LEU A 14 -5.302 10.070 13.963 1.00 1.72 C ATOM 238 CD2 LEU A 14 -3.953 11.389 12.307 1.00 3.41 C ATOM 0 H LEU A 14 -6.005 13.120 10.669 1.00 0.78 H new ATOM 0 HA LEU A 14 -6.714 10.566 11.605 1.00 0.84 H new ATOM 0 HB2 LEU A 14 -6.012 13.241 12.702 1.00 1.10 H new ATOM 0 HB3 LEU A 14 -6.985 12.248 13.769 1.00 1.10 H new ATOM 0 HG LEU A 14 -4.611 12.075 14.230 1.00 1.57 H new ATOM 0 HD11 LEU A 14 -4.371 9.601 14.281 1.00 1.72 H new ATOM 0 HD12 LEU A 14 -5.978 10.148 14.814 1.00 1.72 H new ATOM 0 HD13 LEU A 14 -5.766 9.464 13.185 1.00 1.72 H new ATOM 0 HD21 LEU A 14 -3.075 10.864 12.682 1.00 3.41 H new ATOM 0 HD22 LEU A 14 -4.362 10.848 11.454 1.00 3.41 H new ATOM 0 HD23 LEU A 14 -3.670 12.395 11.996 1.00 3.41 H new ATOM 250 N LEU A 15 -9.166 12.790 11.691 1.00 0.87 N ATOM 251 CA LEU A 15 -10.612 12.968 11.790 1.00 0.87 C ATOM 252 C LEU A 15 -11.324 12.160 10.694 1.00 0.74 C ATOM 253 O LEU A 15 -12.254 11.421 11.010 1.00 0.72 O ATOM 254 CB LEU A 15 -10.895 14.489 11.776 1.00 1.06 C ATOM 255 CG LEU A 15 -12.249 14.986 12.323 1.00 1.15 C ATOM 256 CD1 LEU A 15 -13.434 14.545 11.462 1.00 1.07 C ATOM 257 CD2 LEU A 15 -12.479 14.568 13.784 1.00 1.21 C ATOM 0 H LEU A 15 -8.672 13.648 11.444 1.00 0.87 H new ATOM 0 HA LEU A 15 -11.017 12.573 12.721 1.00 0.87 H new ATOM 0 HB2 LEU A 15 -10.106 14.979 12.346 1.00 1.06 H new ATOM 0 HB3 LEU A 15 -10.806 14.834 10.746 1.00 1.06 H new ATOM 0 HG LEU A 15 -12.192 16.074 12.282 1.00 1.15 H new ATOM 0 HD11 LEU A 15 -14.360 14.924 11.896 1.00 1.07 H new ATOM 0 HD12 LEU A 15 -13.318 14.940 10.453 1.00 1.07 H new ATOM 0 HD13 LEU A 15 -13.470 13.456 11.423 1.00 1.07 H new ATOM 0 HD21 LEU A 15 -13.445 14.942 14.122 1.00 1.21 H new ATOM 0 HD22 LEU A 15 -12.465 13.481 13.858 1.00 1.21 H new ATOM 0 HD23 LEU A 15 -11.690 14.984 14.410 1.00 1.21 H new ATOM 269 N ARG A 16 -10.838 12.191 9.444 1.00 0.76 N ATOM 270 CA ARG A 16 -11.347 11.352 8.339 1.00 0.85 C ATOM 271 C ARG A 16 -11.229 9.854 8.648 1.00 0.81 C ATOM 272 O ARG A 16 -12.204 9.122 8.505 1.00 0.93 O ATOM 273 CB ARG A 16 -10.552 11.640 7.055 1.00 1.04 C ATOM 274 CG ARG A 16 -10.971 12.920 6.323 1.00 1.40 C ATOM 275 CD ARG A 16 -9.860 13.330 5.343 1.00 1.54 C ATOM 276 NE ARG A 16 -10.363 13.762 4.030 1.00 1.66 N ATOM 277 CZ ARG A 16 -10.993 14.887 3.720 1.00 1.58 C ATOM 278 NH1 ARG A 16 -11.300 15.797 4.621 1.00 2.35 N ATOM 279 NH2 ARG A 16 -11.322 15.104 2.466 1.00 2.18 N ATOM 0 H ARG A 16 -10.072 12.804 9.165 1.00 0.76 H new ATOM 0 HA ARG A 16 -12.401 11.601 8.211 1.00 0.85 H new ATOM 0 HB2 ARG A 16 -9.494 11.710 7.306 1.00 1.04 H new ATOM 0 HB3 ARG A 16 -10.664 10.795 6.376 1.00 1.04 H new ATOM 0 HG2 ARG A 16 -11.905 12.756 5.785 1.00 1.40 H new ATOM 0 HG3 ARG A 16 -11.153 13.720 7.040 1.00 1.40 H new ATOM 0 HD2 ARG A 16 -9.278 14.139 5.784 1.00 1.54 H new ATOM 0 HD3 ARG A 16 -9.181 12.489 5.204 1.00 1.54 H new ATOM 0 HE ARG A 16 -10.207 13.113 3.259 1.00 1.66 H new ATOM 0 HH11 ARG A 16 -11.053 15.650 5.599 1.00 2.35 H new ATOM 0 HH12 ARG A 16 -11.785 16.649 4.340 1.00 2.35 H new ATOM 0 HH21 ARG A 16 -11.092 14.413 1.752 1.00 2.18 H new ATOM 0 HH22 ARG A 16 -11.807 15.963 2.207 1.00 2.18 H new ATOM 293 N PHE A 17 -10.076 9.394 9.141 1.00 0.74 N ATOM 294 CA PHE A 17 -9.825 7.987 9.467 1.00 0.86 C ATOM 295 C PHE A 17 -10.690 7.516 10.648 1.00 0.96 C ATOM 296 O PHE A 17 -11.178 6.386 10.636 1.00 1.13 O ATOM 297 CB PHE A 17 -8.317 7.776 9.694 1.00 0.85 C ATOM 298 CG PHE A 17 -7.457 7.799 8.432 1.00 0.84 C ATOM 299 CD1 PHE A 17 -7.681 6.868 7.397 1.00 1.63 C ATOM 300 CD2 PHE A 17 -6.360 8.679 8.331 1.00 1.94 C ATOM 301 CE1 PHE A 17 -6.827 6.827 6.277 1.00 1.69 C ATOM 302 CE2 PHE A 17 -5.495 8.635 7.225 1.00 1.96 C ATOM 303 CZ PHE A 17 -5.733 7.710 6.193 1.00 0.97 C ATOM 0 H PHE A 17 -9.277 9.999 9.328 1.00 0.74 H new ATOM 0 HA PHE A 17 -10.123 7.361 8.626 1.00 0.86 H new ATOM 0 HB2 PHE A 17 -7.957 8.549 10.373 1.00 0.85 H new ATOM 0 HB3 PHE A 17 -8.172 6.819 10.195 1.00 0.85 H new ATOM 0 HD1 PHE A 17 -8.512 6.182 7.463 1.00 1.63 H new ATOM 0 HD2 PHE A 17 -6.182 9.398 9.117 1.00 1.94 H new ATOM 0 HE1 PHE A 17 -7.011 6.118 5.483 1.00 1.69 H new ATOM 0 HE2 PHE A 17 -4.652 9.308 7.168 1.00 1.96 H new ATOM 0 HZ PHE A 17 -5.077 7.677 5.336 1.00 0.97 H new ATOM 313 N GLN A 18 -10.958 8.394 11.621 1.00 0.91 N ATOM 314 CA GLN A 18 -11.928 8.160 12.699 1.00 1.04 C ATOM 315 C GLN A 18 -13.394 8.191 12.201 1.00 1.03 C ATOM 316 O GLN A 18 -14.266 7.585 12.827 1.00 1.22 O ATOM 317 CB GLN A 18 -11.670 9.204 13.803 1.00 1.10 C ATOM 318 CG GLN A 18 -12.347 8.858 15.141 1.00 1.36 C ATOM 319 CD GLN A 18 -11.930 9.784 16.292 1.00 2.37 C ATOM 320 OE1 GLN A 18 -11.485 10.912 16.114 1.00 3.02 O ATOM 321 NE2 GLN A 18 -12.055 9.342 17.528 1.00 3.30 N ATOM 0 H GLN A 18 -10.500 9.303 11.683 1.00 0.91 H new ATOM 0 HA GLN A 18 -11.788 7.155 13.097 1.00 1.04 H new ATOM 0 HB2 GLN A 18 -10.596 9.297 13.961 1.00 1.10 H new ATOM 0 HB3 GLN A 18 -12.027 10.176 13.464 1.00 1.10 H new ATOM 0 HG2 GLN A 18 -13.429 8.910 15.017 1.00 1.36 H new ATOM 0 HG3 GLN A 18 -12.105 7.829 15.407 1.00 1.36 H new ATOM 0 HE21 GLN A 18 -12.423 8.406 17.700 1.00 3.30 H new ATOM 0 HE22 GLN A 18 -11.784 9.936 18.312 1.00 3.30 H new ATOM 330 N ARG A 19 -13.677 8.862 11.072 1.00 0.92 N ATOM 331 CA ARG A 19 -15.023 9.023 10.498 1.00 0.96 C ATOM 332 C ARG A 19 -15.580 7.753 9.838 1.00 1.18 C ATOM 333 O ARG A 19 -16.799 7.562 9.827 1.00 1.45 O ATOM 334 CB ARG A 19 -15.014 10.143 9.430 1.00 1.07 C ATOM 335 CG ARG A 19 -16.238 11.060 9.542 1.00 1.28 C ATOM 336 CD ARG A 19 -16.015 12.110 10.639 1.00 1.22 C ATOM 337 NE ARG A 19 -17.284 12.711 11.083 1.00 1.50 N ATOM 338 CZ ARG A 19 -18.095 12.234 12.023 1.00 1.75 C ATOM 339 NH1 ARG A 19 -17.832 11.121 12.679 1.00 2.44 N ATOM 340 NH2 ARG A 19 -19.201 12.879 12.318 1.00 2.28 N ATOM 0 H ARG A 19 -12.954 9.321 10.517 1.00 0.92 H new ATOM 0 HA ARG A 19 -15.668 9.269 11.342 1.00 0.96 H new ATOM 0 HB2 ARG A 19 -14.106 10.737 9.536 1.00 1.07 H new ATOM 0 HB3 ARG A 19 -14.987 9.695 8.437 1.00 1.07 H new ATOM 0 HG2 ARG A 19 -16.420 11.554 8.587 1.00 1.28 H new ATOM 0 HG3 ARG A 19 -17.125 10.469 9.769 1.00 1.28 H new ATOM 0 HD2 ARG A 19 -15.514 11.647 11.489 1.00 1.22 H new ATOM 0 HD3 ARG A 19 -15.353 12.891 10.266 1.00 1.22 H new ATOM 0 HE ARG A 19 -17.569 13.577 10.625 1.00 1.50 H new ATOM 0 HH11 ARG A 19 -16.983 10.595 12.472 1.00 2.44 H new ATOM 0 HH12 ARG A 19 -18.478 10.786 13.394 1.00 2.44 H new ATOM 0 HH21 ARG A 19 -19.435 13.742 11.827 1.00 2.28 H new ATOM 0 HH22 ARG A 19 -19.826 12.517 13.038 1.00 2.28 H new ATOM 354 N MET A 20 -14.708 6.941 9.228 1.00 1.13 N ATOM 355 CA MET A 20 -15.069 5.942 8.210 1.00 1.17 C ATOM 356 C MET A 20 -16.190 4.980 8.635 1.00 1.27 C ATOM 357 O MET A 20 -16.110 4.361 9.699 1.00 2.40 O ATOM 358 CB MET A 20 -13.831 5.138 7.779 1.00 1.14 C ATOM 359 CG MET A 20 -12.665 6.010 7.298 1.00 1.19 C ATOM 360 SD MET A 20 -13.036 7.185 5.978 1.00 1.10 S ATOM 361 CE MET A 20 -11.343 7.720 5.648 1.00 1.10 C ATOM 0 H MET A 20 -13.709 6.959 9.432 1.00 1.13 H new ATOM 0 HA MET A 20 -15.461 6.515 7.370 1.00 1.17 H new ATOM 0 HB2 MET A 20 -13.495 4.528 8.618 1.00 1.14 H new ATOM 0 HB3 MET A 20 -14.114 4.453 6.980 1.00 1.14 H new ATOM 0 HG2 MET A 20 -12.278 6.566 8.152 1.00 1.19 H new ATOM 0 HG3 MET A 20 -11.865 5.353 6.957 1.00 1.19 H new ATOM 0 HE1 MET A 20 -11.359 8.634 5.054 1.00 1.10 H new ATOM 0 HE2 MET A 20 -10.831 7.910 6.591 1.00 1.10 H new ATOM 0 HE3 MET A 20 -10.815 6.940 5.099 1.00 1.10 H new ATOM 371 N GLU A 21 -17.205 4.809 7.782 1.00 0.83 N ATOM 372 CA GLU A 21 -18.274 3.821 7.998 1.00 0.93 C ATOM 373 C GLU A 21 -17.800 2.375 7.791 1.00 1.04 C ATOM 374 O GLU A 21 -18.265 1.470 8.490 1.00 1.21 O ATOM 375 CB GLU A 21 -19.511 4.079 7.119 1.00 1.46 C ATOM 376 CG GLU A 21 -19.241 4.270 5.621 1.00 3.69 C ATOM 377 CD GLU A 21 -20.309 3.620 4.727 1.00 5.04 C ATOM 378 OE1 GLU A 21 -21.515 3.931 4.880 1.00 4.94 O ATOM 379 OE2 GLU A 21 -19.942 2.805 3.847 1.00 6.64 O ATOM 0 H GLU A 21 -17.311 5.349 6.923 1.00 0.83 H new ATOM 0 HA GLU A 21 -18.558 3.947 9.043 1.00 0.93 H new ATOM 0 HB2 GLU A 21 -20.200 3.243 7.240 1.00 1.46 H new ATOM 0 HB3 GLU A 21 -20.019 4.968 7.493 1.00 1.46 H new ATOM 0 HG2 GLU A 21 -19.191 5.336 5.400 1.00 3.69 H new ATOM 0 HG3 GLU A 21 -18.266 3.848 5.377 1.00 3.69 H new ATOM 386 N THR A 22 -16.908 2.160 6.813 1.00 1.12 N ATOM 387 CA THR A 22 -16.439 0.846 6.358 1.00 1.39 C ATOM 388 C THR A 22 -14.969 0.848 5.958 1.00 1.22 C ATOM 389 O THR A 22 -14.388 1.888 5.640 1.00 1.01 O ATOM 390 CB THR A 22 -17.283 0.317 5.190 1.00 1.76 C ATOM 391 OG1 THR A 22 -17.183 1.208 4.101 1.00 1.62 O ATOM 392 CG2 THR A 22 -18.751 0.083 5.546 1.00 2.22 C ATOM 0 H THR A 22 -16.478 2.928 6.298 1.00 1.12 H new ATOM 0 HA THR A 22 -16.554 0.183 7.215 1.00 1.39 H new ATOM 0 HB THR A 22 -16.880 -0.661 4.927 1.00 1.76 H new ATOM 0 HG1 THR A 22 -18.022 1.706 4.007 1.00 1.62 H new ATOM 0 HG21 THR A 22 -19.283 -0.290 4.671 1.00 2.22 H new ATOM 0 HG22 THR A 22 -18.818 -0.649 6.351 1.00 2.22 H new ATOM 0 HG23 THR A 22 -19.201 1.021 5.871 1.00 2.22 H new ATOM 400 N ALA A 23 -14.388 -0.353 5.886 1.00 1.33 N ATOM 401 CA ALA A 23 -13.041 -0.595 5.367 1.00 1.23 C ATOM 402 C ALA A 23 -12.909 -0.123 3.912 1.00 1.11 C ATOM 403 O ALA A 23 -11.843 0.338 3.507 1.00 0.99 O ATOM 404 CB ALA A 23 -12.752 -2.096 5.493 1.00 1.43 C ATOM 0 H ALA A 23 -14.855 -1.205 6.196 1.00 1.33 H new ATOM 0 HA ALA A 23 -12.313 -0.024 5.943 1.00 1.23 H new ATOM 0 HB1 ALA A 23 -11.752 -2.307 5.113 1.00 1.43 H new ATOM 0 HB2 ALA A 23 -12.812 -2.391 6.540 1.00 1.43 H new ATOM 0 HB3 ALA A 23 -13.486 -2.658 4.915 1.00 1.43 H new ATOM 410 N GLU A 24 -14.006 -0.182 3.152 1.00 1.19 N ATOM 411 CA GLU A 24 -14.074 0.358 1.797 1.00 1.15 C ATOM 412 C GLU A 24 -13.858 1.875 1.798 1.00 1.00 C ATOM 413 O GLU A 24 -13.048 2.364 1.016 1.00 0.91 O ATOM 414 CB GLU A 24 -15.364 -0.055 1.075 1.00 1.36 C ATOM 415 CG GLU A 24 -15.592 -1.575 1.122 1.00 1.68 C ATOM 416 CD GLU A 24 -16.554 -2.032 0.016 1.00 1.85 C ATOM 417 OE1 GLU A 24 -16.084 -2.340 -1.105 1.00 2.92 O ATOM 418 OE2 GLU A 24 -17.783 -2.102 0.261 1.00 2.28 O ATOM 0 H GLU A 24 -14.877 -0.610 3.465 1.00 1.19 H new ATOM 0 HA GLU A 24 -13.257 -0.081 1.224 1.00 1.15 H new ATOM 0 HB2 GLU A 24 -16.213 0.453 1.532 1.00 1.36 H new ATOM 0 HB3 GLU A 24 -15.318 0.272 0.036 1.00 1.36 H new ATOM 0 HG2 GLU A 24 -14.638 -2.091 1.013 1.00 1.68 H new ATOM 0 HG3 GLU A 24 -15.996 -1.854 2.095 1.00 1.68 H new ATOM 425 N GLU A 25 -14.486 2.623 2.716 1.00 1.02 N ATOM 426 CA GLU A 25 -14.248 4.065 2.848 1.00 0.96 C ATOM 427 C GLU A 25 -12.811 4.375 3.318 1.00 0.83 C ATOM 428 O GLU A 25 -12.194 5.312 2.803 1.00 0.78 O ATOM 429 CB GLU A 25 -15.293 4.708 3.777 1.00 1.08 C ATOM 430 CG GLU A 25 -15.435 6.211 3.479 1.00 1.35 C ATOM 431 CD GLU A 25 -16.385 6.952 4.436 1.00 2.12 C ATOM 432 OE1 GLU A 25 -16.848 6.362 5.439 1.00 2.86 O ATOM 433 OE2 GLU A 25 -16.681 8.143 4.175 1.00 2.75 O ATOM 0 H GLU A 25 -15.165 2.250 3.380 1.00 1.02 H new ATOM 0 HA GLU A 25 -14.357 4.506 1.857 1.00 0.96 H new ATOM 0 HB2 GLU A 25 -16.256 4.214 3.646 1.00 1.08 H new ATOM 0 HB3 GLU A 25 -14.999 4.565 4.817 1.00 1.08 H new ATOM 0 HG2 GLU A 25 -14.450 6.675 3.529 1.00 1.35 H new ATOM 0 HG3 GLU A 25 -15.795 6.336 2.458 1.00 1.35 H new ATOM 440 N VAL A 26 -12.244 3.561 4.225 1.00 0.82 N ATOM 441 CA VAL A 26 -10.841 3.704 4.681 1.00 0.73 C ATOM 442 C VAL A 26 -9.885 3.615 3.485 1.00 0.69 C ATOM 443 O VAL A 26 -9.057 4.507 3.289 1.00 0.58 O ATOM 444 CB VAL A 26 -10.421 2.658 5.751 1.00 0.78 C ATOM 445 CG1 VAL A 26 -8.957 2.865 6.169 1.00 0.69 C ATOM 446 CG2 VAL A 26 -11.262 2.689 7.037 1.00 0.90 C ATOM 0 H VAL A 26 -12.740 2.786 4.665 1.00 0.82 H new ATOM 0 HA VAL A 26 -10.778 4.684 5.154 1.00 0.73 H new ATOM 0 HB VAL A 26 -10.578 1.696 5.263 1.00 0.78 H new ATOM 0 HG11 VAL A 26 -8.684 2.122 6.919 1.00 0.69 H new ATOM 0 HG12 VAL A 26 -8.311 2.756 5.298 1.00 0.69 H new ATOM 0 HG13 VAL A 26 -8.836 3.864 6.588 1.00 0.69 H new ATOM 0 HG21 VAL A 26 -10.900 1.927 7.727 1.00 0.90 H new ATOM 0 HG22 VAL A 26 -11.178 3.671 7.503 1.00 0.90 H new ATOM 0 HG23 VAL A 26 -12.306 2.492 6.794 1.00 0.90 H new ATOM 456 N TYR A 27 -10.016 2.569 2.658 1.00 0.80 N ATOM 457 CA TYR A 27 -9.131 2.373 1.509 1.00 0.83 C ATOM 458 C TYR A 27 -9.444 3.362 0.365 1.00 0.81 C ATOM 459 O TYR A 27 -8.550 3.808 -0.353 1.00 0.79 O ATOM 460 CB TYR A 27 -9.093 0.891 1.087 1.00 0.97 C ATOM 461 CG TYR A 27 -9.975 0.460 -0.076 1.00 1.09 C ATOM 462 CD1 TYR A 27 -9.707 0.914 -1.383 1.00 1.55 C ATOM 463 CD2 TYR A 27 -11.034 -0.441 0.136 1.00 2.03 C ATOM 464 CE1 TYR A 27 -10.524 0.525 -2.459 1.00 1.65 C ATOM 465 CE2 TYR A 27 -11.871 -0.826 -0.930 1.00 2.18 C ATOM 466 CZ TYR A 27 -11.620 -0.338 -2.234 1.00 1.45 C ATOM 467 OH TYR A 27 -12.421 -0.700 -3.274 1.00 1.65 O ATOM 0 H TYR A 27 -10.728 1.847 2.766 1.00 0.80 H new ATOM 0 HA TYR A 27 -8.112 2.617 1.808 1.00 0.83 H new ATOM 0 HB2 TYR A 27 -8.062 0.641 0.836 1.00 0.97 H new ATOM 0 HB3 TYR A 27 -9.365 0.289 1.954 1.00 0.97 H new ATOM 0 HD1 TYR A 27 -8.865 1.567 -1.560 1.00 1.55 H new ATOM 0 HD2 TYR A 27 -11.207 -0.841 1.124 1.00 2.03 H new ATOM 0 HE1 TYR A 27 -10.314 0.885 -3.455 1.00 1.65 H new ATOM 0 HE2 TYR A 27 -12.702 -1.492 -0.752 1.00 2.18 H new ATOM 0 HH TYR A 27 -13.127 -1.297 -2.950 1.00 1.65 H new ATOM 477 N HIS A 28 -10.706 3.755 0.208 1.00 0.84 N ATOM 478 CA HIS A 28 -11.128 4.755 -0.770 1.00 0.85 C ATOM 479 C HIS A 28 -10.490 6.126 -0.500 1.00 0.78 C ATOM 480 O HIS A 28 -9.997 6.744 -1.439 1.00 0.79 O ATOM 481 CB HIS A 28 -12.660 4.809 -0.777 1.00 0.92 C ATOM 482 CG HIS A 28 -13.290 5.796 -1.723 1.00 0.98 C ATOM 483 ND1 HIS A 28 -14.252 6.723 -1.389 1.00 1.03 N ATOM 484 CD2 HIS A 28 -13.150 5.834 -3.086 1.00 1.11 C ATOM 485 CE1 HIS A 28 -14.691 7.295 -2.521 1.00 1.15 C ATOM 486 NE2 HIS A 28 -14.045 6.791 -3.590 1.00 1.20 N ATOM 0 H HIS A 28 -11.475 3.382 0.765 1.00 0.84 H new ATOM 0 HA HIS A 28 -10.780 4.468 -1.762 1.00 0.85 H new ATOM 0 HB2 HIS A 28 -13.036 3.815 -1.020 1.00 0.92 H new ATOM 0 HB3 HIS A 28 -12.998 5.040 0.233 1.00 0.92 H new ATOM 0 HD2 HIS A 28 -12.470 5.232 -3.670 1.00 1.11 H new ATOM 0 HE1 HIS A 28 -15.457 8.055 -2.568 1.00 1.15 H new ATOM 0 HE2 HIS A 28 -14.179 7.052 -4.567 1.00 1.20 H new ATOM 494 N GLU A 29 -10.413 6.589 0.753 1.00 0.74 N ATOM 495 CA GLU A 29 -9.765 7.876 1.056 1.00 0.70 C ATOM 496 C GLU A 29 -8.273 7.868 0.680 1.00 0.68 C ATOM 497 O GLU A 29 -7.772 8.837 0.104 1.00 0.68 O ATOM 498 CB GLU A 29 -9.953 8.191 2.549 1.00 0.74 C ATOM 499 CG GLU A 29 -9.323 9.516 3.016 1.00 1.01 C ATOM 500 CD GLU A 29 -9.966 10.766 2.390 1.00 1.14 C ATOM 501 OE1 GLU A 29 -11.173 10.753 2.061 1.00 2.52 O ATOM 502 OE2 GLU A 29 -9.281 11.810 2.287 1.00 2.09 O ATOM 0 H GLU A 29 -10.786 6.100 1.567 1.00 0.74 H new ATOM 0 HA GLU A 29 -10.235 8.654 0.455 1.00 0.70 H new ATOM 0 HB2 GLU A 29 -11.020 8.216 2.769 1.00 0.74 H new ATOM 0 HB3 GLU A 29 -9.526 7.376 3.134 1.00 0.74 H new ATOM 0 HG2 GLU A 29 -9.403 9.583 4.101 1.00 1.01 H new ATOM 0 HG3 GLU A 29 -8.260 9.507 2.775 1.00 1.01 H new ATOM 509 N ILE A 30 -7.555 6.773 0.957 1.00 0.67 N ATOM 510 CA ILE A 30 -6.122 6.689 0.609 1.00 0.65 C ATOM 511 C ILE A 30 -5.895 6.532 -0.904 1.00 0.66 C ATOM 512 O ILE A 30 -4.922 7.075 -1.425 1.00 0.65 O ATOM 513 CB ILE A 30 -5.377 5.617 1.435 1.00 0.67 C ATOM 514 CG1 ILE A 30 -5.795 4.185 1.065 1.00 0.73 C ATOM 515 CG2 ILE A 30 -5.596 5.872 2.941 1.00 0.73 C ATOM 516 CD1 ILE A 30 -4.993 3.095 1.765 1.00 0.84 C ATOM 0 H ILE A 30 -7.931 5.942 1.414 1.00 0.67 H new ATOM 0 HA ILE A 30 -5.681 7.647 0.886 1.00 0.65 H new ATOM 0 HB ILE A 30 -4.317 5.703 1.198 1.00 0.67 H new ATOM 0 HG12 ILE A 30 -6.850 4.054 1.305 1.00 0.73 H new ATOM 0 HG13 ILE A 30 -5.695 4.057 -0.013 1.00 0.73 H new ATOM 0 HG21 ILE A 30 -5.069 5.113 3.519 1.00 0.73 H new ATOM 0 HG22 ILE A 30 -5.213 6.859 3.202 1.00 0.73 H new ATOM 0 HG23 ILE A 30 -6.661 5.825 3.167 1.00 0.73 H new ATOM 0 HD11 ILE A 30 -5.353 2.117 1.447 1.00 0.84 H new ATOM 0 HD12 ILE A 30 -3.939 3.195 1.506 1.00 0.84 H new ATOM 0 HD13 ILE A 30 -5.112 3.192 2.844 1.00 0.84 H new ATOM 528 N GLU A 31 -6.798 5.855 -1.624 1.00 0.71 N ATOM 529 CA GLU A 31 -6.710 5.719 -3.081 1.00 0.78 C ATOM 530 C GLU A 31 -7.073 7.033 -3.791 1.00 0.75 C ATOM 531 O GLU A 31 -6.393 7.432 -4.739 1.00 0.74 O ATOM 532 CB GLU A 31 -7.468 4.472 -3.578 1.00 0.93 C ATOM 533 CG GLU A 31 -8.966 4.562 -3.903 1.00 1.58 C ATOM 534 CD GLU A 31 -9.226 4.421 -5.409 1.00 1.86 C ATOM 535 OE1 GLU A 31 -9.215 3.278 -5.922 1.00 2.76 O ATOM 536 OE2 GLU A 31 -9.446 5.453 -6.084 1.00 2.50 O ATOM 0 H GLU A 31 -7.607 5.388 -1.214 1.00 0.71 H new ATOM 0 HA GLU A 31 -5.672 5.536 -3.357 1.00 0.78 H new ATOM 0 HB2 GLU A 31 -6.962 4.122 -4.478 1.00 0.93 H new ATOM 0 HB3 GLU A 31 -7.347 3.696 -2.822 1.00 0.93 H new ATOM 0 HG2 GLU A 31 -9.503 3.781 -3.366 1.00 1.58 H new ATOM 0 HG3 GLU A 31 -9.358 5.517 -3.553 1.00 1.58 H new ATOM 543 N LEU A 32 -8.064 7.772 -3.276 1.00 0.76 N ATOM 544 CA LEU A 32 -8.381 9.135 -3.701 1.00 0.78 C ATOM 545 C LEU A 32 -7.207 10.093 -3.482 1.00 0.75 C ATOM 546 O LEU A 32 -6.972 10.948 -4.334 1.00 0.77 O ATOM 547 CB LEU A 32 -9.624 9.640 -2.943 1.00 0.84 C ATOM 548 CG LEU A 32 -10.981 9.108 -3.442 1.00 0.94 C ATOM 549 CD1 LEU A 32 -12.076 9.722 -2.558 1.00 0.94 C ATOM 550 CD2 LEU A 32 -11.251 9.456 -4.912 1.00 1.11 C ATOM 0 H LEU A 32 -8.678 7.429 -2.537 1.00 0.76 H new ATOM 0 HA LEU A 32 -8.586 9.110 -4.771 1.00 0.78 H new ATOM 0 HB2 LEU A 32 -9.517 9.375 -1.891 1.00 0.84 H new ATOM 0 HB3 LEU A 32 -9.641 10.729 -2.997 1.00 0.84 H new ATOM 0 HG LEU A 32 -10.972 8.020 -3.377 1.00 0.94 H new ATOM 0 HD11 LEU A 32 -13.052 9.364 -2.886 1.00 0.94 H new ATOM 0 HD12 LEU A 32 -11.913 9.430 -1.521 1.00 0.94 H new ATOM 0 HD13 LEU A 32 -12.042 10.808 -2.639 1.00 0.94 H new ATOM 0 HD21 LEU A 32 -12.221 9.056 -5.208 1.00 1.11 H new ATOM 0 HD22 LEU A 32 -11.252 10.539 -5.035 1.00 1.11 H new ATOM 0 HD23 LEU A 32 -10.472 9.021 -5.538 1.00 1.11 H new ATOM 562 N GLN A 33 -6.441 9.953 -2.396 1.00 0.74 N ATOM 563 CA GLN A 33 -5.261 10.788 -2.159 1.00 0.76 C ATOM 564 C GLN A 33 -4.164 10.541 -3.213 1.00 0.70 C ATOM 565 O GLN A 33 -3.469 11.485 -3.587 1.00 0.81 O ATOM 566 CB GLN A 33 -4.762 10.574 -0.716 1.00 0.80 C ATOM 567 CG GLN A 33 -3.526 11.403 -0.316 1.00 0.92 C ATOM 568 CD GLN A 33 -3.728 12.917 -0.409 1.00 1.65 C ATOM 569 OE1 GLN A 33 -4.049 13.591 0.561 1.00 2.52 O ATOM 570 NE2 GLN A 33 -3.548 13.511 -1.572 1.00 2.73 N ATOM 0 H GLN A 33 -6.619 9.265 -1.664 1.00 0.74 H new ATOM 0 HA GLN A 33 -5.538 11.836 -2.268 1.00 0.76 H new ATOM 0 HB2 GLN A 33 -5.575 10.810 -0.029 1.00 0.80 H new ATOM 0 HB3 GLN A 33 -4.529 9.518 -0.583 1.00 0.80 H new ATOM 0 HG2 GLN A 33 -3.246 11.147 0.706 1.00 0.92 H new ATOM 0 HG3 GLN A 33 -2.690 11.120 -0.955 1.00 0.92 H new ATOM 0 HE21 GLN A 33 -3.280 12.962 -2.389 1.00 2.73 H new ATOM 0 HE22 GLN A 33 -3.676 14.519 -1.655 1.00 2.73 H new ATOM 579 N ALA A 34 -4.033 9.318 -3.742 1.00 0.61 N ATOM 580 CA ALA A 34 -3.168 9.019 -4.888 1.00 0.60 C ATOM 581 C ALA A 34 -3.739 9.546 -6.219 1.00 0.60 C ATOM 582 O ALA A 34 -3.002 10.133 -7.017 1.00 0.64 O ATOM 583 CB ALA A 34 -2.930 7.507 -4.930 1.00 0.64 C ATOM 0 H ALA A 34 -4.529 8.502 -3.383 1.00 0.61 H new ATOM 0 HA ALA A 34 -2.219 9.540 -4.759 1.00 0.60 H new ATOM 0 HB1 ALA A 34 -2.288 7.263 -5.776 1.00 0.64 H new ATOM 0 HB2 ALA A 34 -2.448 7.189 -4.006 1.00 0.64 H new ATOM 0 HB3 ALA A 34 -3.884 6.991 -5.038 1.00 0.64 H new ATOM 589 N GLN A 35 -5.048 9.378 -6.454 1.00 0.62 N ATOM 590 CA GLN A 35 -5.731 9.897 -7.649 1.00 0.67 C ATOM 591 C GLN A 35 -5.640 11.429 -7.736 1.00 0.73 C ATOM 592 O GLN A 35 -5.463 11.973 -8.827 1.00 0.76 O ATOM 593 CB GLN A 35 -7.217 9.486 -7.660 1.00 0.77 C ATOM 594 CG GLN A 35 -7.464 7.968 -7.783 1.00 0.80 C ATOM 595 CD GLN A 35 -8.486 7.596 -8.865 1.00 1.32 C ATOM 596 OE1 GLN A 35 -8.465 8.083 -9.990 1.00 1.72 O ATOM 597 NE2 GLN A 35 -9.427 6.722 -8.576 1.00 1.92 N ATOM 0 H GLN A 35 -5.667 8.876 -5.817 1.00 0.62 H new ATOM 0 HA GLN A 35 -5.224 9.463 -8.511 1.00 0.67 H new ATOM 0 HB2 GLN A 35 -7.686 9.844 -6.743 1.00 0.77 H new ATOM 0 HB3 GLN A 35 -7.713 9.990 -8.489 1.00 0.77 H new ATOM 0 HG2 GLN A 35 -6.519 7.471 -8.002 1.00 0.80 H new ATOM 0 HG3 GLN A 35 -7.809 7.586 -6.822 1.00 0.80 H new ATOM 0 HE21 GLN A 35 -9.466 6.303 -7.647 1.00 1.92 H new ATOM 0 HE22 GLN A 35 -10.117 6.464 -9.281 1.00 1.92 H new ATOM 606 N GLN A 36 -5.711 12.122 -6.594 1.00 0.77 N ATOM 607 CA GLN A 36 -5.657 13.583 -6.493 1.00 0.89 C ATOM 608 C GLN A 36 -4.365 14.195 -7.043 1.00 0.87 C ATOM 609 O GLN A 36 -4.356 15.384 -7.368 1.00 1.09 O ATOM 610 CB GLN A 36 -5.874 14.028 -5.030 1.00 0.96 C ATOM 611 CG GLN A 36 -7.345 14.358 -4.719 1.00 1.24 C ATOM 612 CD GLN A 36 -7.911 15.600 -5.433 1.00 1.51 C ATOM 613 OE1 GLN A 36 -9.094 15.902 -5.332 1.00 2.04 O ATOM 614 NE2 GLN A 36 -7.139 16.377 -6.175 1.00 2.17 N ATOM 0 H GLN A 36 -5.811 11.666 -5.687 1.00 0.77 H new ATOM 0 HA GLN A 36 -6.464 13.958 -7.122 1.00 0.89 H new ATOM 0 HB2 GLN A 36 -5.534 13.238 -4.360 1.00 0.96 H new ATOM 0 HB3 GLN A 36 -5.259 14.905 -4.827 1.00 0.96 H new ATOM 0 HG2 GLN A 36 -7.957 13.496 -4.986 1.00 1.24 H new ATOM 0 HG3 GLN A 36 -7.448 14.500 -3.643 1.00 1.24 H new ATOM 0 HE21 GLN A 36 -6.149 16.158 -6.283 1.00 2.17 H new ATOM 0 HE22 GLN A 36 -7.534 17.195 -6.639 1.00 2.17 H new ATOM 623 N LEU A 37 -3.274 13.423 -7.064 1.00 0.74 N ATOM 624 CA LEU A 37 -1.945 13.842 -7.517 1.00 0.84 C ATOM 625 C LEU A 37 -1.611 13.343 -8.940 1.00 0.86 C ATOM 626 O LEU A 37 -0.504 13.588 -9.423 1.00 0.99 O ATOM 627 CB LEU A 37 -0.921 13.342 -6.476 1.00 0.85 C ATOM 628 CG LEU A 37 -1.197 13.770 -5.017 1.00 0.89 C ATOM 629 CD1 LEU A 37 -0.144 13.154 -4.087 1.00 1.07 C ATOM 630 CD2 LEU A 37 -1.228 15.295 -4.843 1.00 1.38 C ATOM 0 H LEU A 37 -3.294 12.452 -6.754 1.00 0.74 H new ATOM 0 HA LEU A 37 -1.913 14.929 -7.590 1.00 0.84 H new ATOM 0 HB2 LEU A 37 -0.888 12.253 -6.517 1.00 0.85 H new ATOM 0 HB3 LEU A 37 0.067 13.702 -6.762 1.00 0.85 H new ATOM 0 HG LEU A 37 -2.188 13.401 -4.754 1.00 0.89 H new ATOM 0 HD11 LEU A 37 -0.343 13.459 -3.060 1.00 1.07 H new ATOM 0 HD12 LEU A 37 -0.187 12.067 -4.158 1.00 1.07 H new ATOM 0 HD13 LEU A 37 0.847 13.498 -4.382 1.00 1.07 H new ATOM 0 HD21 LEU A 37 -1.426 15.538 -3.799 1.00 1.38 H new ATOM 0 HD22 LEU A 37 -0.266 15.714 -5.137 1.00 1.38 H new ATOM 0 HD23 LEU A 37 -2.014 15.717 -5.469 1.00 1.38 H new ATOM 642 N GLU A 38 -2.539 12.636 -9.601 1.00 0.76 N ATOM 643 CA GLU A 38 -2.378 12.003 -10.919 1.00 0.75 C ATOM 644 C GLU A 38 -1.173 11.031 -10.981 1.00 0.86 C ATOM 645 O GLU A 38 -0.425 11.012 -11.962 1.00 0.97 O ATOM 646 CB GLU A 38 -2.356 13.036 -12.071 1.00 0.78 C ATOM 647 CG GLU A 38 -3.668 13.809 -12.271 1.00 1.85 C ATOM 648 CD GLU A 38 -3.632 15.219 -11.663 1.00 3.28 C ATOM 649 OE1 GLU A 38 -2.900 16.091 -12.192 1.00 3.57 O ATOM 650 OE2 GLU A 38 -4.378 15.485 -10.695 1.00 4.73 O ATOM 0 H GLU A 38 -3.469 12.482 -9.212 1.00 0.76 H new ATOM 0 HA GLU A 38 -3.267 11.390 -11.064 1.00 0.75 H new ATOM 0 HB2 GLU A 38 -1.555 13.751 -11.883 1.00 0.78 H new ATOM 0 HB3 GLU A 38 -2.111 12.519 -12.999 1.00 0.78 H new ATOM 0 HG2 GLU A 38 -3.880 13.884 -13.338 1.00 1.85 H new ATOM 0 HG3 GLU A 38 -4.487 13.247 -11.822 1.00 1.85 H new ATOM 657 N TYR A 39 -0.958 10.222 -9.934 1.00 0.91 N ATOM 658 CA TYR A 39 0.160 9.265 -9.878 1.00 0.97 C ATOM 659 C TYR A 39 0.072 8.196 -10.989 1.00 0.96 C ATOM 660 O TYR A 39 0.933 8.172 -11.872 1.00 1.00 O ATOM 661 CB TYR A 39 0.235 8.627 -8.475 1.00 0.99 C ATOM 662 CG TYR A 39 1.084 9.350 -7.435 1.00 1.12 C ATOM 663 CD1 TYR A 39 1.272 10.747 -7.479 1.00 2.34 C ATOM 664 CD2 TYR A 39 1.708 8.605 -6.410 1.00 1.73 C ATOM 665 CE1 TYR A 39 2.078 11.392 -6.522 1.00 2.53 C ATOM 666 CE2 TYR A 39 2.520 9.242 -5.450 1.00 1.79 C ATOM 667 CZ TYR A 39 2.704 10.642 -5.504 1.00 1.56 C ATOM 668 OH TYR A 39 3.486 11.269 -4.581 1.00 1.85 O ATOM 0 H TYR A 39 -1.551 10.211 -9.104 1.00 0.91 H new ATOM 0 HA TYR A 39 1.084 9.814 -10.061 1.00 0.97 H new ATOM 0 HB2 TYR A 39 -0.780 8.542 -8.086 1.00 0.99 H new ATOM 0 HB3 TYR A 39 0.621 7.613 -8.583 1.00 0.99 H new ATOM 0 HD1 TYR A 39 0.793 11.327 -8.254 1.00 2.34 H new ATOM 0 HD2 TYR A 39 1.561 7.536 -6.361 1.00 1.73 H new ATOM 0 HE1 TYR A 39 2.217 12.462 -6.567 1.00 2.53 H new ATOM 0 HE2 TYR A 39 3.000 8.662 -4.676 1.00 1.79 H new ATOM 0 HH TYR A 39 3.160 12.183 -4.443 1.00 1.85 H new ATOM 678 N ASP A 40 -0.959 7.340 -10.933 1.00 0.94 N ATOM 679 CA ASP A 40 -1.267 6.178 -11.795 1.00 0.92 C ATOM 680 C ASP A 40 -2.346 5.308 -11.117 1.00 0.83 C ATOM 681 O ASP A 40 -3.538 5.540 -11.320 1.00 1.00 O ATOM 682 CB ASP A 40 -0.006 5.376 -12.181 1.00 0.92 C ATOM 683 CG ASP A 40 -0.298 4.087 -12.957 1.00 0.85 C ATOM 684 OD1 ASP A 40 -0.934 4.173 -14.034 1.00 2.14 O ATOM 685 OD2 ASP A 40 0.157 3.022 -12.480 1.00 2.05 O ATOM 0 H ASP A 40 -1.672 7.451 -10.212 1.00 0.94 H new ATOM 0 HA ASP A 40 -1.666 6.543 -12.741 1.00 0.92 H new ATOM 0 HB2 ASP A 40 0.645 6.010 -12.783 1.00 0.92 H new ATOM 0 HB3 ASP A 40 0.544 5.125 -11.274 1.00 0.92 H new ATOM 690 N TYR A 41 -1.935 4.346 -10.281 1.00 0.63 N ATOM 691 CA TYR A 41 -2.805 3.392 -9.577 1.00 0.59 C ATOM 692 C TYR A 41 -2.426 3.193 -8.089 1.00 0.52 C ATOM 693 O TYR A 41 -1.336 3.550 -7.636 1.00 0.56 O ATOM 694 CB TYR A 41 -2.763 2.027 -10.291 1.00 0.64 C ATOM 695 CG TYR A 41 -3.238 1.956 -11.736 1.00 0.80 C ATOM 696 CD1 TYR A 41 -4.523 2.410 -12.090 1.00 1.32 C ATOM 697 CD2 TYR A 41 -2.432 1.344 -12.717 1.00 1.90 C ATOM 698 CE1 TYR A 41 -4.981 2.297 -13.417 1.00 1.35 C ATOM 699 CE2 TYR A 41 -2.867 1.253 -14.052 1.00 2.10 C ATOM 700 CZ TYR A 41 -4.144 1.741 -14.410 1.00 1.22 C ATOM 701 OH TYR A 41 -4.585 1.644 -15.696 1.00 1.44 O ATOM 0 H TYR A 41 -0.948 4.204 -10.067 1.00 0.63 H new ATOM 0 HA TYR A 41 -3.809 3.817 -9.599 1.00 0.59 H new ATOM 0 HB2 TYR A 41 -1.735 1.667 -10.260 1.00 0.64 H new ATOM 0 HB3 TYR A 41 -3.363 1.328 -9.709 1.00 0.64 H new ATOM 0 HD1 TYR A 41 -5.162 2.848 -11.338 1.00 1.32 H new ATOM 0 HD2 TYR A 41 -1.469 0.940 -12.441 1.00 1.90 H new ATOM 0 HE1 TYR A 41 -5.973 2.636 -13.676 1.00 1.35 H new ATOM 0 HE2 TYR A 41 -2.227 0.811 -14.801 1.00 2.10 H new ATOM 0 HH TYR A 41 -3.886 1.240 -16.252 1.00 1.44 H new ATOM 711 N TYR A 42 -3.335 2.563 -7.340 1.00 0.47 N ATOM 712 CA TYR A 42 -3.210 2.184 -5.925 1.00 0.40 C ATOM 713 C TYR A 42 -3.360 0.656 -5.726 1.00 0.38 C ATOM 714 O TYR A 42 -4.016 -0.021 -6.521 1.00 0.49 O ATOM 715 CB TYR A 42 -4.268 2.981 -5.127 1.00 0.49 C ATOM 716 CG TYR A 42 -4.989 2.193 -4.050 1.00 1.51 C ATOM 717 CD1 TYR A 42 -4.469 2.128 -2.744 1.00 2.97 C ATOM 718 CD2 TYR A 42 -6.143 1.459 -4.389 1.00 2.51 C ATOM 719 CE1 TYR A 42 -5.101 1.325 -1.777 1.00 4.11 C ATOM 720 CE2 TYR A 42 -6.774 0.650 -3.432 1.00 3.58 C ATOM 721 CZ TYR A 42 -6.249 0.579 -2.125 1.00 4.11 C ATOM 722 OH TYR A 42 -6.854 -0.210 -1.202 1.00 5.39 O ATOM 0 H TYR A 42 -4.236 2.285 -7.728 1.00 0.47 H new ATOM 0 HA TYR A 42 -2.213 2.430 -5.559 1.00 0.40 H new ATOM 0 HB2 TYR A 42 -3.781 3.839 -4.663 1.00 0.49 H new ATOM 0 HB3 TYR A 42 -5.008 3.373 -5.825 1.00 0.49 H new ATOM 0 HD1 TYR A 42 -3.586 2.694 -2.484 1.00 2.97 H new ATOM 0 HD2 TYR A 42 -6.544 1.519 -5.390 1.00 2.51 H new ATOM 0 HE1 TYR A 42 -4.710 1.279 -0.771 1.00 4.11 H new ATOM 0 HE2 TYR A 42 -7.656 0.085 -3.695 1.00 3.58 H new ATOM 0 HH TYR A 42 -7.825 -0.083 -1.248 1.00 5.39 H new ATOM 732 N SER A 43 -2.804 0.126 -4.635 1.00 0.37 N ATOM 733 CA SER A 43 -2.857 -1.283 -4.227 1.00 0.57 C ATOM 734 C SER A 43 -2.797 -1.443 -2.688 1.00 0.60 C ATOM 735 O SER A 43 -2.192 -0.629 -1.984 1.00 0.40 O ATOM 736 CB SER A 43 -1.668 -1.991 -4.879 1.00 0.89 C ATOM 737 OG SER A 43 -1.571 -3.358 -4.536 1.00 1.30 O ATOM 0 H SER A 43 -2.276 0.697 -3.975 1.00 0.37 H new ATOM 0 HA SER A 43 -3.802 -1.720 -4.548 1.00 0.57 H new ATOM 0 HB2 SER A 43 -1.751 -1.901 -5.962 1.00 0.89 H new ATOM 0 HB3 SER A 43 -0.748 -1.485 -4.586 1.00 0.89 H new ATOM 0 HG SER A 43 -0.675 -3.688 -4.757 1.00 1.30 H new ATOM 743 N LEU A 44 -3.421 -2.502 -2.163 1.00 0.96 N ATOM 744 CA LEU A 44 -3.490 -2.882 -0.746 1.00 1.07 C ATOM 745 C LEU A 44 -3.609 -4.406 -0.624 1.00 1.03 C ATOM 746 O LEU A 44 -4.318 -5.032 -1.413 1.00 1.00 O ATOM 747 CB LEU A 44 -4.718 -2.201 -0.122 1.00 1.11 C ATOM 748 CG LEU A 44 -4.921 -2.397 1.399 1.00 1.24 C ATOM 749 CD1 LEU A 44 -4.383 -1.211 2.200 1.00 1.78 C ATOM 750 CD2 LEU A 44 -6.403 -2.582 1.709 1.00 1.44 C ATOM 0 H LEU A 44 -3.926 -3.162 -2.755 1.00 0.96 H new ATOM 0 HA LEU A 44 -2.587 -2.564 -0.225 1.00 1.07 H new ATOM 0 HB2 LEU A 44 -4.653 -1.131 -0.322 1.00 1.11 H new ATOM 0 HB3 LEU A 44 -5.608 -2.567 -0.634 1.00 1.11 H new ATOM 0 HG LEU A 44 -4.364 -3.287 1.691 1.00 1.24 H new ATOM 0 HD11 LEU A 44 -4.544 -1.387 3.264 1.00 1.78 H new ATOM 0 HD12 LEU A 44 -3.316 -1.097 2.009 1.00 1.78 H new ATOM 0 HD13 LEU A 44 -4.905 -0.302 1.899 1.00 1.78 H new ATOM 0 HD21 LEU A 44 -6.536 -2.719 2.782 1.00 1.44 H new ATOM 0 HD22 LEU A 44 -6.955 -1.700 1.385 1.00 1.44 H new ATOM 0 HD23 LEU A 44 -6.778 -3.459 1.182 1.00 1.44 H new ATOM 762 N CYS A 45 -3.012 -4.987 0.419 1.00 1.02 N ATOM 763 CA CYS A 45 -3.356 -6.324 0.910 1.00 0.84 C ATOM 764 C CYS A 45 -3.443 -6.328 2.447 1.00 0.76 C ATOM 765 O CYS A 45 -2.717 -5.602 3.125 1.00 0.94 O ATOM 766 CB CYS A 45 -2.334 -7.325 0.362 1.00 1.19 C ATOM 767 SG CYS A 45 -2.709 -9.035 0.859 1.00 1.74 S ATOM 0 H CYS A 45 -2.268 -4.538 0.953 1.00 1.02 H new ATOM 0 HA CYS A 45 -4.342 -6.623 0.554 1.00 0.84 H new ATOM 0 HB2 CYS A 45 -2.313 -7.261 -0.726 1.00 1.19 H new ATOM 0 HB3 CYS A 45 -1.339 -7.056 0.716 1.00 1.19 H new ATOM 0 HG CYS A 45 -3.980 -9.145 1.111 1.00 1.74 H new ATOM 773 N VAL A 46 -4.346 -7.147 2.977 1.00 0.59 N ATOM 774 CA VAL A 46 -4.710 -7.273 4.395 1.00 0.57 C ATOM 775 C VAL A 46 -4.656 -8.755 4.768 1.00 0.61 C ATOM 776 O VAL A 46 -5.187 -9.591 4.033 1.00 0.67 O ATOM 777 CB VAL A 46 -6.134 -6.720 4.645 1.00 0.57 C ATOM 778 CG1 VAL A 46 -6.525 -6.797 6.131 1.00 1.33 C ATOM 779 CG2 VAL A 46 -6.273 -5.264 4.167 1.00 1.52 C ATOM 0 H VAL A 46 -4.883 -7.787 2.392 1.00 0.59 H new ATOM 0 HA VAL A 46 -4.014 -6.698 5.006 1.00 0.57 H new ATOM 0 HB VAL A 46 -6.808 -7.351 4.066 1.00 0.57 H new ATOM 0 HG11 VAL A 46 -7.531 -6.399 6.264 1.00 1.33 H new ATOM 0 HG12 VAL A 46 -6.499 -7.836 6.461 1.00 1.33 H new ATOM 0 HG13 VAL A 46 -5.822 -6.211 6.723 1.00 1.33 H new ATOM 0 HG21 VAL A 46 -7.287 -4.913 4.360 1.00 1.52 H new ATOM 0 HG22 VAL A 46 -5.563 -4.635 4.704 1.00 1.52 H new ATOM 0 HG23 VAL A 46 -6.068 -5.211 3.098 1.00 1.52 H new ATOM 789 N ARG A 47 -4.000 -9.077 5.887 1.00 0.72 N ATOM 790 CA ARG A 47 -3.670 -10.448 6.291 1.00 0.82 C ATOM 791 C ARG A 47 -3.910 -10.662 7.790 1.00 0.92 C ATOM 792 O ARG A 47 -3.325 -9.986 8.638 1.00 1.04 O ATOM 793 CB ARG A 47 -2.204 -10.762 5.928 1.00 0.93 C ATOM 794 CG ARG A 47 -1.941 -10.606 4.421 1.00 2.01 C ATOM 795 CD ARG A 47 -0.621 -11.245 3.982 1.00 2.16 C ATOM 796 NE ARG A 47 -0.630 -11.467 2.527 1.00 3.61 N ATOM 797 CZ ARG A 47 0.079 -12.375 1.871 1.00 4.05 C ATOM 798 NH1 ARG A 47 1.082 -13.021 2.428 1.00 3.55 N ATOM 799 NH2 ARG A 47 -0.231 -12.649 0.625 1.00 5.45 N ATOM 0 H ARG A 47 -3.676 -8.376 6.553 1.00 0.72 H new ATOM 0 HA ARG A 47 -4.327 -11.131 5.752 1.00 0.82 H new ATOM 0 HB2 ARG A 47 -1.542 -10.097 6.483 1.00 0.93 H new ATOM 0 HB3 ARG A 47 -1.964 -11.780 6.235 1.00 0.93 H new ATOM 0 HG2 ARG A 47 -2.762 -11.059 3.864 1.00 2.01 H new ATOM 0 HG3 ARG A 47 -1.929 -9.546 4.166 1.00 2.01 H new ATOM 0 HD2 ARG A 47 0.214 -10.599 4.255 1.00 2.16 H new ATOM 0 HD3 ARG A 47 -0.475 -12.192 4.502 1.00 2.16 H new ATOM 0 HE ARG A 47 -1.239 -10.866 1.971 1.00 3.61 H new ATOM 0 HH11 ARG A 47 1.337 -12.829 3.397 1.00 3.55 H new ATOM 0 HH12 ARG A 47 1.604 -13.713 1.891 1.00 3.55 H new ATOM 0 HH21 ARG A 47 -1.008 -12.166 0.175 1.00 5.45 H new ATOM 0 HH22 ARG A 47 0.305 -13.345 0.107 1.00 5.45 H new ATOM 813 N HIS A 48 -4.744 -11.645 8.123 1.00 0.95 N ATOM 814 CA HIS A 48 -5.078 -12.016 9.502 1.00 1.08 C ATOM 815 C HIS A 48 -4.966 -13.544 9.719 1.00 1.20 C ATOM 816 O HIS A 48 -5.865 -14.293 9.313 1.00 1.12 O ATOM 817 CB HIS A 48 -6.456 -11.444 9.902 1.00 1.07 C ATOM 818 CG HIS A 48 -7.523 -11.312 8.839 1.00 2.28 C ATOM 819 ND1 HIS A 48 -8.383 -10.245 8.730 1.00 3.23 N ATOM 820 CD2 HIS A 48 -7.850 -12.191 7.842 1.00 3.59 C ATOM 821 CE1 HIS A 48 -9.200 -10.463 7.688 1.00 4.70 C ATOM 822 NE2 HIS A 48 -8.919 -11.648 7.116 1.00 4.96 N ATOM 0 H HIS A 48 -5.219 -12.221 7.428 1.00 0.95 H new ATOM 0 HA HIS A 48 -4.345 -11.565 10.172 1.00 1.08 H new ATOM 0 HB2 HIS A 48 -6.857 -12.073 10.697 1.00 1.07 H new ATOM 0 HB3 HIS A 48 -6.292 -10.455 10.330 1.00 1.07 H new ATOM 0 HD1 HIS A 48 -8.398 -9.426 9.338 1.00 3.23 H new ATOM 0 HD2 HIS A 48 -7.368 -13.138 7.648 1.00 3.59 H new ATOM 0 HE1 HIS A 48 -9.972 -9.785 7.356 1.00 4.70 H new ATOM 830 N PRO A 49 -3.893 -14.038 10.375 1.00 1.56 N ATOM 831 CA PRO A 49 -3.683 -15.463 10.626 1.00 1.79 C ATOM 832 C PRO A 49 -4.533 -15.928 11.824 1.00 1.68 C ATOM 833 O PRO A 49 -4.010 -16.285 12.880 1.00 2.13 O ATOM 834 CB PRO A 49 -2.167 -15.602 10.828 1.00 2.29 C ATOM 835 CG PRO A 49 -1.788 -14.283 11.498 1.00 2.32 C ATOM 836 CD PRO A 49 -2.730 -13.279 10.834 1.00 1.88 C ATOM 0 HA PRO A 49 -4.006 -16.108 9.809 1.00 1.79 H new ATOM 0 HB2 PRO A 49 -1.920 -16.459 11.455 1.00 2.29 H new ATOM 0 HB3 PRO A 49 -1.644 -15.739 9.881 1.00 2.29 H new ATOM 0 HG2 PRO A 49 -1.935 -14.322 12.577 1.00 2.32 H new ATOM 0 HG3 PRO A 49 -0.742 -14.029 11.327 1.00 2.32 H new ATOM 0 HD2 PRO A 49 -3.028 -12.502 11.539 1.00 1.88 H new ATOM 0 HD3 PRO A 49 -2.238 -12.780 9.999 1.00 1.88 H new ATOM 844 N VAL A 50 -5.863 -15.893 11.671 1.00 1.29 N ATOM 845 CA VAL A 50 -6.813 -16.255 12.743 1.00 1.18 C ATOM 846 C VAL A 50 -6.716 -17.760 13.063 1.00 1.41 C ATOM 847 O VAL A 50 -6.720 -18.565 12.129 1.00 1.68 O ATOM 848 CB VAL A 50 -8.283 -15.923 12.394 1.00 1.10 C ATOM 849 CG1 VAL A 50 -9.198 -16.052 13.626 1.00 1.30 C ATOM 850 CG2 VAL A 50 -8.478 -14.504 11.859 1.00 1.15 C ATOM 0 H VAL A 50 -6.316 -15.613 10.801 1.00 1.29 H new ATOM 0 HA VAL A 50 -6.529 -15.655 13.607 1.00 1.18 H new ATOM 0 HB VAL A 50 -8.545 -16.644 11.620 1.00 1.10 H new ATOM 0 HG11 VAL A 50 -10.223 -15.812 13.345 1.00 1.30 H new ATOM 0 HG12 VAL A 50 -9.156 -17.073 14.005 1.00 1.30 H new ATOM 0 HG13 VAL A 50 -8.864 -15.363 14.401 1.00 1.30 H new ATOM 0 HG21 VAL A 50 -9.532 -14.341 11.635 1.00 1.15 H new ATOM 0 HG22 VAL A 50 -8.151 -13.784 12.609 1.00 1.15 H new ATOM 0 HG23 VAL A 50 -7.890 -14.374 10.950 1.00 1.15 H new ATOM 860 N PRO A 51 -6.669 -18.162 14.350 1.00 1.50 N ATOM 861 CA PRO A 51 -6.634 -19.569 14.748 1.00 1.74 C ATOM 862 C PRO A 51 -8.032 -20.206 14.862 1.00 1.58 C ATOM 863 O PRO A 51 -8.165 -21.422 14.733 1.00 1.86 O ATOM 864 CB PRO A 51 -5.893 -19.563 16.087 1.00 2.03 C ATOM 865 CG PRO A 51 -6.237 -18.212 16.708 1.00 1.94 C ATOM 866 CD PRO A 51 -6.485 -17.294 15.507 1.00 1.65 C ATOM 0 HA PRO A 51 -6.137 -20.182 13.996 1.00 1.74 H new ATOM 0 HB2 PRO A 51 -6.217 -20.386 16.724 1.00 2.03 H new ATOM 0 HB3 PRO A 51 -4.818 -19.673 15.946 1.00 2.03 H new ATOM 0 HG2 PRO A 51 -7.119 -18.280 17.345 1.00 1.94 H new ATOM 0 HG3 PRO A 51 -5.422 -17.841 17.330 1.00 1.94 H new ATOM 0 HD2 PRO A 51 -7.366 -16.673 15.669 1.00 1.65 H new ATOM 0 HD3 PRO A 51 -5.643 -16.619 15.355 1.00 1.65 H new ATOM 874 N PHE A 52 -9.073 -19.393 15.079 1.00 1.37 N ATOM 875 CA PHE A 52 -10.478 -19.804 15.212 1.00 1.55 C ATOM 876 C PHE A 52 -11.204 -20.015 13.867 1.00 1.88 C ATOM 877 O PHE A 52 -12.277 -20.626 13.850 1.00 2.28 O ATOM 878 CB PHE A 52 -11.224 -18.739 16.035 1.00 1.67 C ATOM 879 CG PHE A 52 -10.792 -18.634 17.486 1.00 1.75 C ATOM 880 CD1 PHE A 52 -9.739 -17.776 17.856 1.00 3.15 C ATOM 881 CD2 PHE A 52 -11.459 -19.384 18.474 1.00 2.00 C ATOM 882 CE1 PHE A 52 -9.357 -17.667 19.205 1.00 3.45 C ATOM 883 CE2 PHE A 52 -11.078 -19.274 19.822 1.00 2.12 C ATOM 884 CZ PHE A 52 -10.027 -18.415 20.190 1.00 2.36 C ATOM 0 H PHE A 52 -8.954 -18.384 15.171 1.00 1.37 H new ATOM 0 HA PHE A 52 -10.479 -20.774 15.709 1.00 1.55 H new ATOM 0 HB2 PHE A 52 -11.084 -17.769 15.558 1.00 1.67 H new ATOM 0 HB3 PHE A 52 -12.291 -18.959 16.004 1.00 1.67 H new ATOM 0 HD1 PHE A 52 -9.223 -17.200 17.102 1.00 3.15 H new ATOM 0 HD2 PHE A 52 -12.266 -20.046 18.195 1.00 2.00 H new ATOM 0 HE1 PHE A 52 -8.548 -17.008 19.485 1.00 3.45 H new ATOM 0 HE2 PHE A 52 -11.593 -19.850 20.577 1.00 2.12 H new ATOM 0 HZ PHE A 52 -9.735 -18.330 21.226 1.00 2.36 H new ATOM 894 N THR A 53 -10.644 -19.520 12.754 1.00 1.81 N ATOM 895 CA THR A 53 -11.188 -19.671 11.391 1.00 2.13 C ATOM 896 C THR A 53 -10.094 -20.073 10.402 1.00 2.15 C ATOM 897 O THR A 53 -8.921 -20.149 10.769 1.00 1.93 O ATOM 898 CB THR A 53 -11.988 -18.423 10.976 1.00 2.18 C ATOM 899 OG1 THR A 53 -12.884 -18.818 9.960 1.00 2.70 O ATOM 900 CG2 THR A 53 -11.190 -17.225 10.482 1.00 1.96 C ATOM 0 H THR A 53 -9.774 -18.987 12.775 1.00 1.81 H new ATOM 0 HA THR A 53 -11.903 -20.494 11.382 1.00 2.13 H new ATOM 0 HB THR A 53 -12.469 -18.066 11.887 1.00 2.18 H new ATOM 0 HG1 THR A 53 -13.413 -18.045 9.672 1.00 2.70 H new ATOM 0 HG21 THR A 53 -11.872 -16.415 10.223 1.00 1.96 H new ATOM 0 HG22 THR A 53 -10.512 -16.891 11.267 1.00 1.96 H new ATOM 0 HG23 THR A 53 -10.614 -17.510 9.602 1.00 1.96 H new ATOM 908 N ARG A 54 -10.461 -20.352 9.148 1.00 2.63 N ATOM 909 CA ARG A 54 -9.502 -20.714 8.094 1.00 2.79 C ATOM 910 C ARG A 54 -8.594 -19.515 7.750 1.00 2.09 C ATOM 911 O ARG A 54 -9.078 -18.376 7.750 1.00 1.73 O ATOM 912 CB ARG A 54 -10.227 -21.242 6.843 1.00 3.52 C ATOM 913 CG ARG A 54 -10.511 -22.756 6.867 1.00 4.06 C ATOM 914 CD ARG A 54 -11.061 -23.273 8.203 1.00 5.41 C ATOM 915 NE ARG A 54 -11.561 -24.654 8.089 1.00 6.19 N ATOM 916 CZ ARG A 54 -11.719 -25.522 9.083 1.00 7.17 C ATOM 917 NH1 ARG A 54 -11.418 -25.222 10.331 1.00 7.66 N ATOM 918 NH2 ARG A 54 -12.190 -26.724 8.832 1.00 7.82 N ATOM 0 H ARG A 54 -11.431 -20.334 8.832 1.00 2.63 H new ATOM 0 HA ARG A 54 -8.870 -21.518 8.471 1.00 2.79 H new ATOM 0 HB2 ARG A 54 -11.171 -20.709 6.732 1.00 3.52 H new ATOM 0 HB3 ARG A 54 -9.625 -21.011 5.964 1.00 3.52 H new ATOM 0 HG2 ARG A 54 -11.224 -22.993 6.078 1.00 4.06 H new ATOM 0 HG3 ARG A 54 -9.590 -23.291 6.635 1.00 4.06 H new ATOM 0 HD2 ARG A 54 -10.278 -23.231 8.960 1.00 5.41 H new ATOM 0 HD3 ARG A 54 -11.866 -22.621 8.542 1.00 5.41 H new ATOM 0 HE ARG A 54 -11.811 -24.976 7.154 1.00 6.19 H new ATOM 0 HH11 ARG A 54 -11.051 -24.298 10.559 1.00 7.66 H new ATOM 0 HH12 ARG A 54 -11.552 -25.914 11.068 1.00 7.66 H new ATOM 0 HH21 ARG A 54 -12.433 -26.987 7.877 1.00 7.82 H new ATOM 0 HH22 ARG A 54 -12.313 -27.393 9.592 1.00 7.82 H new ATOM 932 N PRO A 55 -7.302 -19.745 7.441 1.00 2.27 N ATOM 933 CA PRO A 55 -6.358 -18.681 7.127 1.00 2.00 C ATOM 934 C PRO A 55 -6.733 -18.056 5.783 1.00 1.95 C ATOM 935 O PRO A 55 -7.089 -18.756 4.834 1.00 2.38 O ATOM 936 CB PRO A 55 -4.977 -19.339 7.121 1.00 2.90 C ATOM 937 CG PRO A 55 -5.273 -20.786 6.728 1.00 3.57 C ATOM 938 CD PRO A 55 -6.663 -21.047 7.312 1.00 3.17 C ATOM 0 HA PRO A 55 -6.368 -17.866 7.851 1.00 2.00 H new ATOM 0 HB2 PRO A 55 -4.307 -18.859 6.408 1.00 2.90 H new ATOM 0 HB3 PRO A 55 -4.499 -19.278 8.099 1.00 2.90 H new ATOM 0 HG2 PRO A 55 -5.263 -20.916 5.646 1.00 3.57 H new ATOM 0 HG3 PRO A 55 -4.532 -21.471 7.139 1.00 3.57 H new ATOM 0 HD2 PRO A 55 -7.242 -21.702 6.661 1.00 3.17 H new ATOM 0 HD3 PRO A 55 -6.591 -21.543 8.280 1.00 3.17 H new ATOM 946 N LYS A 56 -6.684 -16.724 5.718 1.00 1.55 N ATOM 947 CA LYS A 56 -7.274 -15.945 4.623 1.00 1.47 C ATOM 948 C LYS A 56 -6.632 -14.555 4.466 1.00 1.38 C ATOM 949 O LYS A 56 -6.040 -14.011 5.403 1.00 1.36 O ATOM 950 CB LYS A 56 -8.808 -15.878 4.797 1.00 1.61 C ATOM 951 CG LYS A 56 -9.259 -15.213 6.109 1.00 1.82 C ATOM 952 CD LYS A 56 -10.784 -15.283 6.271 1.00 3.57 C ATOM 953 CE LYS A 56 -11.208 -14.915 7.698 1.00 5.01 C ATOM 954 NZ LYS A 56 -11.092 -13.465 7.983 1.00 6.64 N ATOM 0 H LYS A 56 -6.231 -16.149 6.428 1.00 1.55 H new ATOM 0 HA LYS A 56 -7.059 -16.460 3.686 1.00 1.47 H new ATOM 0 HB2 LYS A 56 -9.235 -15.329 3.958 1.00 1.61 H new ATOM 0 HB3 LYS A 56 -9.213 -16.889 4.756 1.00 1.61 H new ATOM 0 HG2 LYS A 56 -8.778 -15.706 6.954 1.00 1.82 H new ATOM 0 HG3 LYS A 56 -8.937 -14.172 6.122 1.00 1.82 H new ATOM 0 HD2 LYS A 56 -11.259 -14.605 5.562 1.00 3.57 H new ATOM 0 HD3 LYS A 56 -11.132 -16.288 6.033 1.00 3.57 H new ATOM 0 HE2 LYS A 56 -12.240 -15.229 7.857 1.00 5.01 H new ATOM 0 HE3 LYS A 56 -10.594 -15.469 8.408 1.00 5.01 H new ATOM 0 HZ1 LYS A 56 -11.040 -13.316 9.011 1.00 6.64 H new ATOM 0 HZ2 LYS A 56 -10.231 -13.091 7.535 1.00 6.64 H new ATOM 0 HZ3 LYS A 56 -11.923 -12.969 7.603 1.00 6.64 H new ATOM 968 N VAL A 57 -6.761 -13.995 3.263 1.00 1.41 N ATOM 969 CA VAL A 57 -6.186 -12.706 2.846 1.00 1.25 C ATOM 970 C VAL A 57 -7.187 -11.957 1.962 1.00 1.15 C ATOM 971 O VAL A 57 -7.906 -12.573 1.172 1.00 1.34 O ATOM 972 CB VAL A 57 -4.819 -12.856 2.128 1.00 1.26 C ATOM 973 CG1 VAL A 57 -3.789 -13.585 3.009 1.00 2.43 C ATOM 974 CG2 VAL A 57 -4.909 -13.590 0.779 1.00 3.20 C ATOM 0 H VAL A 57 -7.292 -14.443 2.516 1.00 1.41 H new ATOM 0 HA VAL A 57 -5.991 -12.129 3.750 1.00 1.25 H new ATOM 0 HB VAL A 57 -4.495 -11.833 1.938 1.00 1.26 H new ATOM 0 HG11 VAL A 57 -2.845 -13.670 2.471 1.00 2.43 H new ATOM 0 HG12 VAL A 57 -3.633 -13.021 3.929 1.00 2.43 H new ATOM 0 HG13 VAL A 57 -4.159 -14.581 3.253 1.00 2.43 H new ATOM 0 HG21 VAL A 57 -3.916 -13.658 0.335 1.00 3.20 H new ATOM 0 HG22 VAL A 57 -5.305 -14.593 0.936 1.00 3.20 H new ATOM 0 HG23 VAL A 57 -5.570 -13.040 0.109 1.00 3.20 H new ATOM 984 N ALA A 58 -7.238 -10.635 2.112 1.00 0.93 N ATOM 985 CA ALA A 58 -8.019 -9.731 1.268 1.00 0.90 C ATOM 986 C ALA A 58 -7.096 -8.695 0.616 1.00 0.68 C ATOM 987 O ALA A 58 -6.083 -8.305 1.201 1.00 0.53 O ATOM 988 CB ALA A 58 -9.102 -9.062 2.123 1.00 0.92 C ATOM 0 H ALA A 58 -6.722 -10.148 2.845 1.00 0.93 H new ATOM 0 HA ALA A 58 -8.504 -10.289 0.467 1.00 0.90 H new ATOM 0 HB1 ALA A 58 -9.690 -8.386 1.502 1.00 0.92 H new ATOM 0 HB2 ALA A 58 -9.755 -9.826 2.546 1.00 0.92 H new ATOM 0 HB3 ALA A 58 -8.633 -8.498 2.929 1.00 0.92 H new ATOM 994 N PHE A 59 -7.454 -8.226 -0.577 1.00 0.80 N ATOM 995 CA PHE A 59 -6.672 -7.252 -1.336 1.00 0.64 C ATOM 996 C PHE A 59 -7.555 -6.405 -2.258 1.00 0.55 C ATOM 997 O PHE A 59 -8.573 -6.870 -2.775 1.00 0.68 O ATOM 998 CB PHE A 59 -5.497 -7.939 -2.065 1.00 0.65 C ATOM 999 CG PHE A 59 -5.759 -9.288 -2.726 1.00 0.69 C ATOM 1000 CD1 PHE A 59 -6.673 -9.404 -3.792 1.00 1.87 C ATOM 1001 CD2 PHE A 59 -5.042 -10.429 -2.306 1.00 1.93 C ATOM 1002 CE1 PHE A 59 -6.892 -10.651 -4.407 1.00 1.88 C ATOM 1003 CE2 PHE A 59 -5.259 -11.674 -2.924 1.00 1.97 C ATOM 1004 CZ PHE A 59 -6.188 -11.787 -3.971 1.00 0.81 C ATOM 0 H PHE A 59 -8.309 -8.516 -1.051 1.00 0.80 H new ATOM 0 HA PHE A 59 -6.229 -6.545 -0.634 1.00 0.64 H new ATOM 0 HB2 PHE A 59 -5.134 -7.255 -2.832 1.00 0.65 H new ATOM 0 HB3 PHE A 59 -4.688 -8.070 -1.346 1.00 0.65 H new ATOM 0 HD1 PHE A 59 -7.208 -8.532 -4.139 1.00 1.87 H new ATOM 0 HD2 PHE A 59 -4.322 -10.346 -1.505 1.00 1.93 H new ATOM 0 HE1 PHE A 59 -7.603 -10.735 -5.216 1.00 1.88 H new ATOM 0 HE2 PHE A 59 -4.711 -12.544 -2.593 1.00 1.97 H new ATOM 0 HZ PHE A 59 -6.361 -12.744 -4.440 1.00 0.81 H new ATOM 1014 N TYR A 60 -7.158 -5.143 -2.438 1.00 0.43 N ATOM 1015 CA TYR A 60 -7.904 -4.115 -3.175 1.00 0.53 C ATOM 1016 C TYR A 60 -6.950 -3.250 -4.014 1.00 0.50 C ATOM 1017 O TYR A 60 -5.838 -2.937 -3.582 1.00 0.51 O ATOM 1018 CB TYR A 60 -8.709 -3.241 -2.193 1.00 0.66 C ATOM 1019 CG TYR A 60 -9.677 -4.006 -1.306 1.00 0.73 C ATOM 1020 CD1 TYR A 60 -10.731 -4.744 -1.881 1.00 2.04 C ATOM 1021 CD2 TYR A 60 -9.501 -4.017 0.092 1.00 2.12 C ATOM 1022 CE1 TYR A 60 -11.576 -5.526 -1.071 1.00 2.22 C ATOM 1023 CE2 TYR A 60 -10.344 -4.794 0.910 1.00 2.07 C ATOM 1024 CZ TYR A 60 -11.378 -5.561 0.329 1.00 1.00 C ATOM 1025 OH TYR A 60 -12.176 -6.334 1.119 1.00 1.17 O ATOM 0 H TYR A 60 -6.276 -4.794 -2.062 1.00 0.43 H new ATOM 0 HA TYR A 60 -8.599 -4.608 -3.855 1.00 0.53 H new ATOM 0 HB2 TYR A 60 -8.011 -2.695 -1.559 1.00 0.66 H new ATOM 0 HB3 TYR A 60 -9.269 -2.500 -2.763 1.00 0.66 H new ATOM 0 HD1 TYR A 60 -10.891 -4.709 -2.948 1.00 2.04 H new ATOM 0 HD2 TYR A 60 -8.715 -3.426 0.539 1.00 2.12 H new ATOM 0 HE1 TYR A 60 -12.375 -6.099 -1.518 1.00 2.22 H new ATOM 0 HE2 TYR A 60 -10.200 -4.803 1.980 1.00 2.07 H new ATOM 0 HH TYR A 60 -11.900 -6.240 2.055 1.00 1.17 H new ATOM 1035 N THR A 61 -7.382 -2.860 -5.214 1.00 0.58 N ATOM 1036 CA THR A 61 -6.543 -2.222 -6.240 1.00 0.57 C ATOM 1037 C THR A 61 -7.373 -1.337 -7.161 1.00 1.00 C ATOM 1038 O THR A 61 -8.527 -1.639 -7.460 1.00 1.30 O ATOM 1039 CB THR A 61 -5.816 -3.270 -7.103 1.00 0.57 C ATOM 1040 OG1 THR A 61 -6.618 -4.420 -7.290 1.00 2.75 O ATOM 1041 CG2 THR A 61 -4.447 -3.696 -6.611 1.00 1.77 C ATOM 0 H THR A 61 -8.350 -2.981 -5.511 1.00 0.58 H new ATOM 0 HA THR A 61 -5.811 -1.615 -5.708 1.00 0.57 H new ATOM 0 HB THR A 61 -5.646 -2.752 -8.047 1.00 0.57 H new ATOM 0 HG1 THR A 61 -6.135 -5.069 -7.842 1.00 2.75 H new ATOM 0 HG21 THR A 61 -4.029 -4.435 -7.294 1.00 1.77 H new ATOM 0 HG22 THR A 61 -3.789 -2.828 -6.569 1.00 1.77 H new ATOM 0 HG23 THR A 61 -4.537 -4.132 -5.616 1.00 1.77 H new ATOM 1049 N ASN A 62 -6.738 -0.279 -7.671 1.00 1.21 N ATOM 1050 CA ASN A 62 -7.221 0.489 -8.829 1.00 1.55 C ATOM 1051 C ASN A 62 -6.720 -0.115 -10.170 1.00 1.20 C ATOM 1052 O ASN A 62 -7.092 0.338 -11.251 1.00 1.18 O ATOM 1053 CB ASN A 62 -6.792 1.958 -8.655 1.00 2.05 C ATOM 1054 CG ASN A 62 -7.730 2.923 -9.378 1.00 2.53 C ATOM 1055 OD1 ASN A 62 -7.532 3.278 -10.533 1.00 3.71 O ATOM 1056 ND2 ASN A 62 -8.779 3.383 -8.724 1.00 2.44 N ATOM 0 H ASN A 62 -5.862 0.076 -7.288 1.00 1.21 H new ATOM 0 HA ASN A 62 -8.309 0.439 -8.872 1.00 1.55 H new ATOM 0 HB2 ASN A 62 -6.768 2.204 -7.593 1.00 2.05 H new ATOM 0 HB3 ASN A 62 -5.778 2.086 -9.035 1.00 2.05 H new ATOM 0 HD21 ASN A 62 -9.421 4.031 -9.181 1.00 2.44 H new ATOM 0 HD22 ASN A 62 -8.949 3.090 -7.762 1.00 2.44 H new ATOM 1063 N TYR A 63 -5.870 -1.149 -10.094 1.00 0.97 N ATOM 1064 CA TYR A 63 -5.202 -1.837 -11.207 1.00 0.81 C ATOM 1065 C TYR A 63 -6.160 -2.336 -12.320 1.00 0.88 C ATOM 1066 O TYR A 63 -7.295 -2.728 -12.021 1.00 0.99 O ATOM 1067 CB TYR A 63 -4.394 -3.020 -10.633 1.00 0.72 C ATOM 1068 CG TYR A 63 -3.130 -2.723 -9.852 1.00 0.64 C ATOM 1069 CD1 TYR A 63 -2.537 -1.446 -9.844 1.00 1.95 C ATOM 1070 CD2 TYR A 63 -2.517 -3.773 -9.146 1.00 1.60 C ATOM 1071 CE1 TYR A 63 -1.420 -1.182 -9.037 1.00 1.93 C ATOM 1072 CE2 TYR A 63 -1.376 -3.522 -8.361 1.00 1.63 C ATOM 1073 CZ TYR A 63 -0.821 -2.223 -8.302 1.00 0.66 C ATOM 1074 OH TYR A 63 0.289 -1.961 -7.558 1.00 0.77 O ATOM 0 H TYR A 63 -5.614 -1.553 -9.193 1.00 0.97 H new ATOM 0 HA TYR A 63 -4.555 -1.106 -11.692 1.00 0.81 H new ATOM 0 HB2 TYR A 63 -5.058 -3.591 -9.984 1.00 0.72 H new ATOM 0 HB3 TYR A 63 -4.124 -3.671 -11.464 1.00 0.72 H new ATOM 0 HD1 TYR A 63 -2.946 -0.662 -10.465 1.00 1.95 H new ATOM 0 HD2 TYR A 63 -2.922 -4.772 -9.206 1.00 1.60 H new ATOM 0 HE1 TYR A 63 -1.020 -0.181 -8.980 1.00 1.93 H new ATOM 0 HE2 TYR A 63 -0.922 -4.326 -7.801 1.00 1.63 H new ATOM 0 HH TYR A 63 0.413 -2.671 -6.894 1.00 0.77 H new ATOM 1084 N PRO A 64 -5.703 -2.356 -13.592 1.00 0.85 N ATOM 1085 CA PRO A 64 -6.492 -2.820 -14.728 1.00 0.94 C ATOM 1086 C PRO A 64 -6.704 -4.333 -14.642 1.00 0.90 C ATOM 1087 O PRO A 64 -5.814 -5.065 -14.208 1.00 0.82 O ATOM 1088 CB PRO A 64 -5.710 -2.421 -15.986 1.00 0.97 C ATOM 1089 CG PRO A 64 -4.263 -2.306 -15.510 1.00 0.79 C ATOM 1090 CD PRO A 64 -4.394 -1.904 -14.044 1.00 0.76 C ATOM 0 HA PRO A 64 -7.486 -2.373 -14.744 1.00 0.94 H new ATOM 0 HB2 PRO A 64 -5.812 -3.169 -16.772 1.00 0.97 H new ATOM 0 HB3 PRO A 64 -6.070 -1.477 -16.396 1.00 0.97 H new ATOM 0 HG2 PRO A 64 -3.729 -3.250 -15.620 1.00 0.79 H new ATOM 0 HG3 PRO A 64 -3.712 -1.560 -16.082 1.00 0.79 H new ATOM 0 HD2 PRO A 64 -3.603 -2.358 -13.448 1.00 0.76 H new ATOM 0 HD3 PRO A 64 -4.299 -0.824 -13.931 1.00 0.76 H new ATOM 1098 N GLU A 65 -7.871 -4.817 -15.079 1.00 0.96 N ATOM 1099 CA GLU A 65 -8.243 -6.231 -14.956 1.00 0.94 C ATOM 1100 C GLU A 65 -7.268 -7.170 -15.686 1.00 0.94 C ATOM 1101 O GLU A 65 -7.083 -8.307 -15.262 1.00 0.91 O ATOM 1102 CB GLU A 65 -9.690 -6.435 -15.436 1.00 1.02 C ATOM 1103 CG GLU A 65 -9.839 -6.462 -16.964 1.00 1.10 C ATOM 1104 CD GLU A 65 -11.315 -6.542 -17.380 1.00 1.19 C ATOM 1105 OE1 GLU A 65 -11.883 -7.661 -17.400 1.00 1.51 O ATOM 1106 OE2 GLU A 65 -11.917 -5.489 -17.700 1.00 2.28 O ATOM 0 H GLU A 65 -8.584 -4.241 -15.527 1.00 0.96 H new ATOM 0 HA GLU A 65 -8.178 -6.498 -13.901 1.00 0.94 H new ATOM 0 HB2 GLU A 65 -10.070 -7.371 -15.027 1.00 1.02 H new ATOM 0 HB3 GLU A 65 -10.312 -5.636 -15.034 1.00 1.02 H new ATOM 0 HG2 GLU A 65 -9.387 -5.567 -17.391 1.00 1.10 H new ATOM 0 HG3 GLU A 65 -9.298 -7.317 -17.369 1.00 1.10 H new ATOM 1113 N ALA A 66 -6.597 -6.693 -16.740 1.00 0.98 N ATOM 1114 CA ALA A 66 -5.572 -7.442 -17.465 1.00 0.99 C ATOM 1115 C ALA A 66 -4.339 -7.728 -16.589 1.00 0.88 C ATOM 1116 O ALA A 66 -3.816 -8.841 -16.611 1.00 0.88 O ATOM 1117 CB ALA A 66 -5.211 -6.639 -18.722 1.00 1.07 C ATOM 0 H ALA A 66 -6.756 -5.759 -17.118 1.00 0.98 H new ATOM 0 HA ALA A 66 -5.958 -8.421 -17.748 1.00 0.99 H new ATOM 0 HB1 ALA A 66 -4.446 -7.172 -19.287 1.00 1.07 H new ATOM 0 HB2 ALA A 66 -6.099 -6.514 -19.342 1.00 1.07 H new ATOM 0 HB3 ALA A 66 -4.831 -5.660 -18.431 1.00 1.07 H new ATOM 1123 N TRP A 67 -3.930 -6.761 -15.759 1.00 0.82 N ATOM 1124 CA TRP A 67 -2.842 -6.918 -14.790 1.00 0.73 C ATOM 1125 C TRP A 67 -3.298 -7.754 -13.594 1.00 0.67 C ATOM 1126 O TRP A 67 -2.583 -8.650 -13.153 1.00 0.63 O ATOM 1127 CB TRP A 67 -2.366 -5.532 -14.325 1.00 0.71 C ATOM 1128 CG TRP A 67 -1.235 -5.481 -13.336 1.00 0.66 C ATOM 1129 CD1 TRP A 67 -1.173 -4.601 -12.309 1.00 0.74 C ATOM 1130 CD2 TRP A 67 -0.010 -6.290 -13.232 1.00 0.62 C ATOM 1131 NE1 TRP A 67 -0.031 -4.810 -11.568 1.00 0.77 N ATOM 1132 CE2 TRP A 67 0.728 -5.825 -12.096 1.00 0.70 C ATOM 1133 CE3 TRP A 67 0.567 -7.365 -13.953 1.00 0.61 C ATOM 1134 CZ2 TRP A 67 1.960 -6.371 -11.717 1.00 0.77 C ATOM 1135 CZ3 TRP A 67 1.777 -7.948 -13.540 1.00 0.67 C ATOM 1136 CH2 TRP A 67 2.494 -7.430 -12.456 1.00 0.75 C ATOM 0 H TRP A 67 -4.353 -5.833 -15.743 1.00 0.82 H new ATOM 0 HA TRP A 67 -2.014 -7.441 -15.269 1.00 0.73 H new ATOM 0 HB2 TRP A 67 -2.067 -4.966 -15.207 1.00 0.71 H new ATOM 0 HB3 TRP A 67 -3.219 -5.013 -13.887 1.00 0.71 H new ATOM 0 HD1 TRP A 67 -1.914 -3.843 -12.100 1.00 0.74 H new ATOM 0 HE1 TRP A 67 0.219 -4.279 -10.734 1.00 0.77 H new ATOM 0 HE3 TRP A 67 0.069 -7.742 -14.834 1.00 0.61 H new ATOM 0 HZ2 TRP A 67 2.492 -5.978 -10.863 1.00 0.77 H new ATOM 0 HZ3 TRP A 67 2.159 -8.809 -14.068 1.00 0.67 H new ATOM 0 HH2 TRP A 67 3.455 -7.846 -12.192 1.00 0.75 H new ATOM 1147 N VAL A 68 -4.509 -7.483 -13.102 1.00 0.69 N ATOM 1148 CA VAL A 68 -5.079 -8.138 -11.917 1.00 0.67 C ATOM 1149 C VAL A 68 -5.364 -9.619 -12.186 1.00 0.73 C ATOM 1150 O VAL A 68 -5.079 -10.459 -11.334 1.00 0.71 O ATOM 1151 CB VAL A 68 -6.353 -7.400 -11.443 1.00 0.73 C ATOM 1152 CG1 VAL A 68 -7.072 -8.092 -10.282 1.00 0.75 C ATOM 1153 CG2 VAL A 68 -6.014 -5.981 -10.966 1.00 0.71 C ATOM 0 H VAL A 68 -5.132 -6.792 -13.520 1.00 0.69 H new ATOM 0 HA VAL A 68 -4.342 -8.086 -11.116 1.00 0.67 H new ATOM 0 HB VAL A 68 -7.009 -7.395 -12.313 1.00 0.73 H new ATOM 0 HG11 VAL A 68 -7.955 -7.516 -10.006 1.00 0.75 H new ATOM 0 HG12 VAL A 68 -7.373 -9.094 -10.586 1.00 0.75 H new ATOM 0 HG13 VAL A 68 -6.400 -8.159 -9.426 1.00 0.75 H new ATOM 0 HG21 VAL A 68 -6.925 -5.480 -10.637 1.00 0.71 H new ATOM 0 HG22 VAL A 68 -5.310 -6.035 -10.136 1.00 0.71 H new ATOM 0 HG23 VAL A 68 -5.567 -5.419 -11.786 1.00 0.71 H new ATOM 1163 N SER A 69 -5.894 -9.955 -13.366 1.00 0.81 N ATOM 1164 CA SER A 69 -6.065 -11.351 -13.781 1.00 0.88 C ATOM 1165 C SER A 69 -4.717 -12.036 -14.007 1.00 0.87 C ATOM 1166 O SER A 69 -4.487 -13.096 -13.441 1.00 0.89 O ATOM 1167 CB SER A 69 -6.938 -11.443 -15.042 1.00 0.99 C ATOM 1168 OG SER A 69 -7.321 -12.785 -15.308 1.00 1.05 O ATOM 0 H SER A 69 -6.214 -9.274 -14.055 1.00 0.81 H new ATOM 0 HA SER A 69 -6.573 -11.875 -12.972 1.00 0.88 H new ATOM 0 HB2 SER A 69 -7.828 -10.827 -14.916 1.00 0.99 H new ATOM 0 HB3 SER A 69 -6.391 -11.043 -15.896 1.00 0.99 H new ATOM 0 HG SER A 69 -7.877 -12.813 -16.115 1.00 1.05 H new ATOM 1174 N TYR A 70 -3.785 -11.435 -14.755 1.00 0.86 N ATOM 1175 CA TYR A 70 -2.475 -12.037 -15.043 1.00 0.86 C ATOM 1176 C TYR A 70 -1.679 -12.339 -13.767 1.00 0.78 C ATOM 1177 O TYR A 70 -1.141 -13.437 -13.622 1.00 0.83 O ATOM 1178 CB TYR A 70 -1.708 -11.094 -15.972 1.00 0.84 C ATOM 1179 CG TYR A 70 -0.300 -11.554 -16.253 1.00 0.82 C ATOM 1180 CD1 TYR A 70 -0.073 -12.614 -17.146 1.00 1.78 C ATOM 1181 CD2 TYR A 70 0.773 -10.961 -15.571 1.00 1.85 C ATOM 1182 CE1 TYR A 70 1.241 -13.069 -17.377 1.00 1.77 C ATOM 1183 CE2 TYR A 70 2.088 -11.398 -15.805 1.00 1.85 C ATOM 1184 CZ TYR A 70 2.329 -12.452 -16.718 1.00 0.78 C ATOM 1185 OH TYR A 70 3.599 -12.881 -16.955 1.00 0.81 O ATOM 0 H TYR A 70 -3.916 -10.517 -15.179 1.00 0.86 H new ATOM 0 HA TYR A 70 -2.625 -13.000 -15.531 1.00 0.86 H new ATOM 0 HB2 TYR A 70 -2.249 -11.003 -16.914 1.00 0.84 H new ATOM 0 HB3 TYR A 70 -1.677 -10.100 -15.525 1.00 0.84 H new ATOM 0 HD1 TYR A 70 -0.904 -13.080 -17.655 1.00 1.78 H new ATOM 0 HD2 TYR A 70 0.588 -10.166 -14.864 1.00 1.85 H new ATOM 0 HE1 TYR A 70 1.417 -13.889 -18.057 1.00 1.77 H new ATOM 0 HE2 TYR A 70 2.913 -10.930 -15.289 1.00 1.85 H new ATOM 0 HH TYR A 70 4.228 -12.350 -16.423 1.00 0.81 H new ATOM 1195 N TYR A 71 -1.671 -11.407 -12.810 1.00 0.69 N ATOM 1196 CA TYR A 71 -1.028 -11.581 -11.510 1.00 0.64 C ATOM 1197 C TYR A 71 -1.612 -12.776 -10.734 1.00 0.68 C ATOM 1198 O TYR A 71 -0.870 -13.605 -10.205 1.00 0.71 O ATOM 1199 CB TYR A 71 -1.150 -10.265 -10.726 1.00 0.60 C ATOM 1200 CG TYR A 71 -0.466 -10.298 -9.376 1.00 0.79 C ATOM 1201 CD1 TYR A 71 -1.130 -10.856 -8.267 1.00 1.43 C ATOM 1202 CD2 TYR A 71 0.843 -9.800 -9.233 1.00 2.24 C ATOM 1203 CE1 TYR A 71 -0.482 -10.934 -7.023 1.00 1.66 C ATOM 1204 CE2 TYR A 71 1.491 -9.873 -7.985 1.00 2.66 C ATOM 1205 CZ TYR A 71 0.831 -10.441 -6.876 1.00 1.84 C ATOM 1206 OH TYR A 71 1.445 -10.474 -5.662 1.00 2.42 O ATOM 0 H TYR A 71 -2.119 -10.497 -12.921 1.00 0.69 H new ATOM 0 HA TYR A 71 0.027 -11.815 -11.656 1.00 0.64 H new ATOM 0 HB2 TYR A 71 -0.724 -9.457 -11.320 1.00 0.60 H new ATOM 0 HB3 TYR A 71 -2.206 -10.033 -10.584 1.00 0.60 H new ATOM 0 HD1 TYR A 71 -2.140 -11.225 -8.373 1.00 1.43 H new ATOM 0 HD2 TYR A 71 1.350 -9.362 -10.080 1.00 2.24 H new ATOM 0 HE1 TYR A 71 -0.991 -11.373 -6.177 1.00 1.66 H new ATOM 0 HE2 TYR A 71 2.496 -9.493 -7.877 1.00 2.66 H new ATOM 0 HH TYR A 71 0.773 -10.397 -4.953 1.00 2.42 H new ATOM 1216 N GLN A 72 -2.941 -12.883 -10.683 1.00 0.72 N ATOM 1217 CA GLN A 72 -3.648 -13.967 -9.997 1.00 0.80 C ATOM 1218 C GLN A 72 -3.564 -15.314 -10.738 1.00 0.90 C ATOM 1219 O GLN A 72 -3.424 -16.355 -10.099 1.00 0.95 O ATOM 1220 CB GLN A 72 -5.108 -13.531 -9.774 1.00 0.90 C ATOM 1221 CG GLN A 72 -5.219 -12.559 -8.585 1.00 1.00 C ATOM 1222 CD GLN A 72 -6.675 -12.255 -8.235 1.00 1.62 C ATOM 1223 OE1 GLN A 72 -7.265 -12.842 -7.336 1.00 1.60 O ATOM 1224 NE2 GLN A 72 -7.316 -11.348 -8.941 1.00 2.95 N ATOM 0 H GLN A 72 -3.566 -12.209 -11.124 1.00 0.72 H new ATOM 0 HA GLN A 72 -3.159 -14.144 -9.039 1.00 0.80 H new ATOM 0 HB2 GLN A 72 -5.490 -13.053 -10.676 1.00 0.90 H new ATOM 0 HB3 GLN A 72 -5.729 -14.408 -9.591 1.00 0.90 H new ATOM 0 HG2 GLN A 72 -4.718 -12.988 -7.717 1.00 1.00 H new ATOM 0 HG3 GLN A 72 -4.701 -11.630 -8.825 1.00 1.00 H new ATOM 0 HE21 GLN A 72 -6.835 -10.853 -9.692 1.00 2.95 H new ATOM 0 HE22 GLN A 72 -8.294 -11.140 -8.737 1.00 2.95 H new ATOM 1233 N ALA A 73 -3.616 -15.309 -12.073 1.00 0.94 N ATOM 1234 CA ALA A 73 -3.689 -16.502 -12.923 1.00 1.05 C ATOM 1235 C ALA A 73 -2.359 -17.273 -12.987 1.00 1.09 C ATOM 1236 O ALA A 73 -2.348 -18.503 -13.060 1.00 1.18 O ATOM 1237 CB ALA A 73 -4.137 -16.042 -14.322 1.00 1.14 C ATOM 0 H ALA A 73 -3.608 -14.443 -12.612 1.00 0.94 H new ATOM 0 HA ALA A 73 -4.405 -17.204 -12.497 1.00 1.05 H new ATOM 0 HB1 ALA A 73 -4.203 -16.905 -14.985 1.00 1.14 H new ATOM 0 HB2 ALA A 73 -5.113 -15.563 -14.252 1.00 1.14 H new ATOM 0 HB3 ALA A 73 -3.412 -15.332 -14.721 1.00 1.14 H new ATOM 1243 N LYS A 74 -1.237 -16.549 -12.942 1.00 1.03 N ATOM 1244 CA LYS A 74 0.123 -17.092 -12.808 1.00 1.08 C ATOM 1245 C LYS A 74 0.575 -17.235 -11.337 1.00 1.00 C ATOM 1246 O LYS A 74 1.676 -17.721 -11.071 1.00 1.04 O ATOM 1247 CB LYS A 74 1.057 -16.171 -13.615 1.00 1.14 C ATOM 1248 CG LYS A 74 1.276 -16.569 -15.082 1.00 1.05 C ATOM 1249 CD LYS A 74 0.063 -16.993 -15.923 1.00 1.31 C ATOM 1250 CE LYS A 74 -0.804 -15.790 -16.304 1.00 1.80 C ATOM 1251 NZ LYS A 74 -1.955 -16.196 -17.156 1.00 2.19 N ATOM 0 H LYS A 74 -1.248 -15.531 -13.000 1.00 1.03 H new ATOM 0 HA LYS A 74 0.153 -18.109 -13.199 1.00 1.08 H new ATOM 0 HB2 LYS A 74 0.652 -15.159 -13.588 1.00 1.14 H new ATOM 0 HB3 LYS A 74 2.026 -16.140 -13.117 1.00 1.14 H new ATOM 0 HG2 LYS A 74 1.748 -15.726 -15.586 1.00 1.05 H new ATOM 0 HG3 LYS A 74 1.992 -17.391 -15.098 1.00 1.05 H new ATOM 0 HD2 LYS A 74 0.404 -17.498 -16.827 1.00 1.31 H new ATOM 0 HD3 LYS A 74 -0.536 -17.712 -15.363 1.00 1.31 H new ATOM 0 HE2 LYS A 74 -1.172 -15.305 -15.400 1.00 1.80 H new ATOM 0 HE3 LYS A 74 -0.197 -15.057 -16.835 1.00 1.80 H new ATOM 0 HZ1 LYS A 74 -2.522 -15.358 -17.396 1.00 2.19 H new ATOM 0 HZ2 LYS A 74 -1.602 -16.637 -18.029 1.00 2.19 H new ATOM 0 HZ3 LYS A 74 -2.547 -16.877 -16.639 1.00 2.19 H new ATOM 1265 N ASN A 75 -0.262 -16.812 -10.384 1.00 0.91 N ATOM 1266 CA ASN A 75 -0.064 -16.918 -8.932 1.00 0.86 C ATOM 1267 C ASN A 75 1.201 -16.178 -8.443 1.00 0.72 C ATOM 1268 O ASN A 75 1.980 -16.693 -7.637 1.00 0.75 O ATOM 1269 CB ASN A 75 -0.138 -18.384 -8.471 1.00 1.07 C ATOM 1270 CG ASN A 75 -1.464 -19.052 -8.826 1.00 1.31 C ATOM 1271 OD1 ASN A 75 -1.566 -19.798 -9.793 1.00 2.07 O ATOM 1272 ND2 ASN A 75 -2.512 -18.806 -8.058 1.00 1.72 N ATOM 0 H ASN A 75 -1.147 -16.361 -10.617 1.00 0.91 H new ATOM 0 HA ASN A 75 -0.890 -16.396 -8.449 1.00 0.86 H new ATOM 0 HB2 ASN A 75 0.679 -18.944 -8.926 1.00 1.07 H new ATOM 0 HB3 ASN A 75 0.008 -18.428 -7.392 1.00 1.07 H new ATOM 0 HD21 ASN A 75 -3.412 -19.238 -8.269 1.00 1.72 H new ATOM 0 HD22 ASN A 75 -2.421 -18.184 -7.255 1.00 1.72 H new ATOM 1279 N PHE A 76 1.398 -14.939 -8.912 1.00 0.61 N ATOM 1280 CA PHE A 76 2.531 -14.077 -8.548 1.00 0.52 C ATOM 1281 C PHE A 76 2.605 -13.729 -7.046 1.00 0.53 C ATOM 1282 O PHE A 76 3.667 -13.303 -6.589 1.00 0.53 O ATOM 1283 CB PHE A 76 2.495 -12.813 -9.415 1.00 0.44 C ATOM 1284 CG PHE A 76 3.112 -12.967 -10.795 1.00 0.49 C ATOM 1285 CD1 PHE A 76 4.487 -12.728 -10.969 1.00 1.92 C ATOM 1286 CD2 PHE A 76 2.325 -13.310 -11.908 1.00 2.22 C ATOM 1287 CE1 PHE A 76 5.067 -12.795 -12.247 1.00 1.95 C ATOM 1288 CE2 PHE A 76 2.903 -13.369 -13.188 1.00 2.23 C ATOM 1289 CZ PHE A 76 4.272 -13.110 -13.360 1.00 0.63 C ATOM 0 H PHE A 76 0.758 -14.497 -9.572 1.00 0.61 H new ATOM 0 HA PHE A 76 3.442 -14.642 -8.743 1.00 0.52 H new ATOM 0 HB2 PHE A 76 1.458 -12.498 -9.530 1.00 0.44 H new ATOM 0 HB3 PHE A 76 3.015 -12.013 -8.888 1.00 0.44 H new ATOM 0 HD1 PHE A 76 5.102 -12.491 -10.113 1.00 1.92 H new ATOM 0 HD2 PHE A 76 1.275 -13.528 -11.780 1.00 2.22 H new ATOM 0 HE1 PHE A 76 6.123 -12.604 -12.373 1.00 1.95 H new ATOM 0 HE2 PHE A 76 2.291 -13.615 -14.043 1.00 2.23 H new ATOM 0 HZ PHE A 76 4.712 -13.153 -14.345 1.00 0.63 H new ATOM 1299 N LEU A 77 1.558 -14.009 -6.249 1.00 0.57 N ATOM 1300 CA LEU A 77 1.630 -14.015 -4.777 1.00 0.64 C ATOM 1301 C LEU A 77 2.731 -14.943 -4.217 1.00 0.76 C ATOM 1302 O LEU A 77 3.127 -14.787 -3.065 1.00 0.92 O ATOM 1303 CB LEU A 77 0.255 -14.364 -4.160 1.00 0.70 C ATOM 1304 CG LEU A 77 -0.741 -13.186 -4.127 1.00 0.72 C ATOM 1305 CD1 LEU A 77 -1.968 -13.456 -5.002 1.00 1.50 C ATOM 1306 CD2 LEU A 77 -1.237 -12.859 -2.715 1.00 0.97 C ATOM 0 H LEU A 77 0.632 -14.239 -6.611 1.00 0.57 H new ATOM 0 HA LEU A 77 1.907 -13.002 -4.484 1.00 0.64 H new ATOM 0 HB2 LEU A 77 -0.187 -15.183 -4.727 1.00 0.70 H new ATOM 0 HB3 LEU A 77 0.407 -14.725 -3.143 1.00 0.70 H new ATOM 0 HG LEU A 77 -0.179 -12.335 -4.512 1.00 0.72 H new ATOM 0 HD11 LEU A 77 -2.645 -12.603 -4.952 1.00 1.50 H new ATOM 0 HD12 LEU A 77 -1.652 -13.609 -6.034 1.00 1.50 H new ATOM 0 HD13 LEU A 77 -2.481 -14.348 -4.644 1.00 1.50 H new ATOM 0 HD21 LEU A 77 -1.934 -12.022 -2.759 1.00 0.97 H new ATOM 0 HD22 LEU A 77 -1.741 -13.730 -2.296 1.00 0.97 H new ATOM 0 HD23 LEU A 77 -0.389 -12.592 -2.084 1.00 0.97 H new ATOM 1318 N ALA A 78 3.258 -15.880 -5.013 1.00 0.71 N ATOM 1319 CA ALA A 78 4.409 -16.708 -4.652 1.00 0.77 C ATOM 1320 C ALA A 78 5.779 -16.005 -4.804 1.00 0.74 C ATOM 1321 O ALA A 78 6.741 -16.446 -4.171 1.00 0.81 O ATOM 1322 CB ALA A 78 4.346 -17.971 -5.519 1.00 0.83 C ATOM 0 H ALA A 78 2.889 -16.086 -5.941 1.00 0.71 H new ATOM 0 HA ALA A 78 4.342 -16.938 -3.589 1.00 0.77 H new ATOM 0 HB1 ALA A 78 5.190 -18.618 -5.281 1.00 0.83 H new ATOM 0 HB2 ALA A 78 3.414 -18.502 -5.322 1.00 0.83 H new ATOM 0 HB3 ALA A 78 4.389 -17.692 -6.572 1.00 0.83 H new ATOM 1328 N ILE A 79 5.900 -14.959 -5.640 1.00 0.65 N ATOM 1329 CA ILE A 79 7.206 -14.358 -6.016 1.00 0.65 C ATOM 1330 C ILE A 79 7.320 -12.843 -5.786 1.00 0.61 C ATOM 1331 O ILE A 79 8.438 -12.333 -5.719 1.00 0.66 O ATOM 1332 CB ILE A 79 7.622 -14.740 -7.464 1.00 0.66 C ATOM 1333 CG1 ILE A 79 6.888 -13.990 -8.602 1.00 0.61 C ATOM 1334 CG2 ILE A 79 7.473 -16.252 -7.706 1.00 0.72 C ATOM 1335 CD1 ILE A 79 7.697 -12.804 -9.145 1.00 0.66 C ATOM 0 H ILE A 79 5.100 -14.502 -6.077 1.00 0.65 H new ATOM 0 HA ILE A 79 7.915 -14.801 -5.317 1.00 0.65 H new ATOM 0 HB ILE A 79 8.665 -14.426 -7.513 1.00 0.66 H new ATOM 0 HG12 ILE A 79 6.679 -14.685 -9.415 1.00 0.61 H new ATOM 0 HG13 ILE A 79 5.926 -13.631 -8.235 1.00 0.61 H new ATOM 0 HG21 ILE A 79 7.771 -16.488 -8.727 1.00 0.72 H new ATOM 0 HG22 ILE A 79 8.108 -16.797 -7.007 1.00 0.72 H new ATOM 0 HG23 ILE A 79 6.434 -16.544 -7.555 1.00 0.72 H new ATOM 0 HD11 ILE A 79 7.135 -12.314 -9.941 1.00 0.66 H new ATOM 0 HD12 ILE A 79 7.883 -12.092 -8.341 1.00 0.66 H new ATOM 0 HD13 ILE A 79 8.648 -13.162 -9.540 1.00 0.66 H new ATOM 1347 N ASP A 80 6.210 -12.117 -5.627 1.00 0.58 N ATOM 1348 CA ASP A 80 6.215 -10.682 -5.329 1.00 0.60 C ATOM 1349 C ASP A 80 6.690 -10.434 -3.875 1.00 0.60 C ATOM 1350 O ASP A 80 6.092 -10.986 -2.947 1.00 0.66 O ATOM 1351 CB ASP A 80 4.805 -10.114 -5.573 1.00 0.73 C ATOM 1352 CG ASP A 80 4.704 -8.585 -5.422 1.00 1.07 C ATOM 1353 OD1 ASP A 80 5.556 -7.985 -4.724 1.00 2.10 O ATOM 1354 OD2 ASP A 80 3.758 -7.998 -5.996 1.00 1.89 O ATOM 0 H ASP A 80 5.273 -12.513 -5.702 1.00 0.58 H new ATOM 0 HA ASP A 80 6.915 -10.168 -5.988 1.00 0.60 H new ATOM 0 HB2 ASP A 80 4.483 -10.390 -6.577 1.00 0.73 H new ATOM 0 HB3 ASP A 80 4.111 -10.583 -4.875 1.00 0.73 H new ATOM 1359 N PRO A 81 7.728 -9.606 -3.642 1.00 0.66 N ATOM 1360 CA PRO A 81 8.231 -9.317 -2.302 1.00 0.72 C ATOM 1361 C PRO A 81 7.352 -8.364 -1.473 1.00 0.72 C ATOM 1362 O PRO A 81 7.559 -8.325 -0.262 1.00 0.80 O ATOM 1363 CB PRO A 81 9.638 -8.748 -2.513 1.00 0.79 C ATOM 1364 CG PRO A 81 9.559 -8.102 -3.893 1.00 0.84 C ATOM 1365 CD PRO A 81 8.589 -9.000 -4.649 1.00 0.82 C ATOM 0 HA PRO A 81 8.228 -10.230 -1.707 1.00 0.72 H new ATOM 0 HB2 PRO A 81 9.896 -8.020 -1.744 1.00 0.79 H new ATOM 0 HB3 PRO A 81 10.396 -9.530 -2.479 1.00 0.79 H new ATOM 0 HG2 PRO A 81 9.195 -7.076 -3.836 1.00 0.84 H new ATOM 0 HG3 PRO A 81 10.535 -8.068 -4.377 1.00 0.84 H new ATOM 0 HD2 PRO A 81 8.004 -8.424 -5.366 1.00 0.82 H new ATOM 0 HD3 PRO A 81 9.124 -9.763 -5.214 1.00 0.82 H new ATOM 1373 N VAL A 82 6.381 -7.618 -2.037 1.00 0.65 N ATOM 1374 CA VAL A 82 5.600 -6.646 -1.227 1.00 0.69 C ATOM 1375 C VAL A 82 4.701 -7.310 -0.166 1.00 0.78 C ATOM 1376 O VAL A 82 4.304 -6.659 0.798 1.00 0.96 O ATOM 1377 CB VAL A 82 4.762 -5.640 -2.056 1.00 0.69 C ATOM 1378 CG1 VAL A 82 5.599 -4.895 -3.113 1.00 1.94 C ATOM 1379 CG2 VAL A 82 3.501 -6.238 -2.698 1.00 1.93 C ATOM 0 H VAL A 82 6.119 -7.662 -3.022 1.00 0.65 H new ATOM 0 HA VAL A 82 6.379 -6.079 -0.718 1.00 0.69 H new ATOM 0 HB VAL A 82 4.419 -4.918 -1.315 1.00 0.69 H new ATOM 0 HG11 VAL A 82 4.960 -4.204 -3.663 1.00 1.94 H new ATOM 0 HG12 VAL A 82 6.395 -4.338 -2.620 1.00 1.94 H new ATOM 0 HG13 VAL A 82 6.035 -5.615 -3.805 1.00 1.94 H new ATOM 0 HG21 VAL A 82 2.976 -5.464 -3.258 1.00 1.93 H new ATOM 0 HG22 VAL A 82 3.784 -7.046 -3.373 1.00 1.93 H new ATOM 0 HG23 VAL A 82 2.846 -6.629 -1.919 1.00 1.93 H new ATOM 1389 N LEU A 83 4.399 -8.608 -0.321 1.00 0.78 N ATOM 1390 CA LEU A 83 3.592 -9.403 0.618 1.00 0.91 C ATOM 1391 C LEU A 83 4.423 -10.203 1.637 1.00 0.95 C ATOM 1392 O LEU A 83 3.861 -10.774 2.572 1.00 0.99 O ATOM 1393 CB LEU A 83 2.624 -10.281 -0.201 1.00 0.98 C ATOM 1394 CG LEU A 83 3.321 -11.351 -1.073 1.00 0.92 C ATOM 1395 CD1 LEU A 83 3.280 -12.746 -0.434 1.00 1.15 C ATOM 1396 CD2 LEU A 83 2.702 -11.399 -2.474 1.00 1.32 C ATOM 0 H LEU A 83 4.718 -9.149 -1.125 1.00 0.78 H new ATOM 0 HA LEU A 83 3.020 -8.722 1.248 1.00 0.91 H new ATOM 0 HB2 LEU A 83 1.936 -10.778 0.483 1.00 0.98 H new ATOM 0 HB3 LEU A 83 2.025 -9.638 -0.845 1.00 0.98 H new ATOM 0 HG LEU A 83 4.367 -11.056 -1.151 1.00 0.92 H new ATOM 0 HD11 LEU A 83 3.783 -13.460 -1.086 1.00 1.15 H new ATOM 0 HD12 LEU A 83 3.785 -12.719 0.532 1.00 1.15 H new ATOM 0 HD13 LEU A 83 2.243 -13.051 -0.293 1.00 1.15 H new ATOM 0 HD21 LEU A 83 3.208 -12.159 -3.070 1.00 1.32 H new ATOM 0 HD22 LEU A 83 1.643 -11.645 -2.396 1.00 1.32 H new ATOM 0 HD23 LEU A 83 2.814 -10.427 -2.955 1.00 1.32 H new ATOM 1408 N ASN A 84 5.748 -10.233 1.478 1.00 0.94 N ATOM 1409 CA ASN A 84 6.684 -10.957 2.340 1.00 0.88 C ATOM 1410 C ASN A 84 7.328 -10.010 3.380 1.00 0.78 C ATOM 1411 O ASN A 84 8.103 -9.138 2.982 1.00 0.75 O ATOM 1412 CB ASN A 84 7.769 -11.589 1.450 1.00 0.91 C ATOM 1413 CG ASN A 84 7.441 -12.998 0.957 1.00 1.87 C ATOM 1414 OD1 ASN A 84 6.323 -13.490 1.048 1.00 2.89 O ATOM 1415 ND2 ASN A 84 8.429 -13.702 0.431 1.00 2.14 N ATOM 0 H ASN A 84 6.215 -9.736 0.719 1.00 0.94 H new ATOM 0 HA ASN A 84 6.148 -11.731 2.890 1.00 0.88 H new ATOM 0 HB2 ASN A 84 7.934 -10.945 0.587 1.00 0.91 H new ATOM 0 HB3 ASN A 84 8.705 -11.621 2.007 1.00 0.91 H new ATOM 0 HD21 ASN A 84 8.259 -14.652 0.102 1.00 2.14 H new ATOM 0 HD22 ASN A 84 9.361 -13.295 0.354 1.00 2.14 H new ATOM 1422 N PRO A 85 7.086 -10.181 4.699 1.00 0.79 N ATOM 1423 CA PRO A 85 7.527 -9.230 5.726 1.00 0.76 C ATOM 1424 C PRO A 85 9.046 -9.235 5.968 1.00 0.75 C ATOM 1425 O PRO A 85 9.580 -8.256 6.483 1.00 0.77 O ATOM 1426 CB PRO A 85 6.757 -9.625 6.990 1.00 0.81 C ATOM 1427 CG PRO A 85 6.542 -11.127 6.819 1.00 0.84 C ATOM 1428 CD PRO A 85 6.318 -11.258 5.313 1.00 0.89 C ATOM 0 HA PRO A 85 7.320 -8.208 5.408 1.00 0.76 H new ATOM 0 HB2 PRO A 85 7.325 -9.401 7.893 1.00 0.81 H new ATOM 0 HB3 PRO A 85 5.811 -9.090 7.068 1.00 0.81 H new ATOM 0 HG2 PRO A 85 7.406 -11.701 7.152 1.00 0.84 H new ATOM 0 HG3 PRO A 85 5.684 -11.482 7.390 1.00 0.84 H new ATOM 0 HD2 PRO A 85 6.652 -12.231 4.952 1.00 0.89 H new ATOM 0 HD3 PRO A 85 5.260 -11.172 5.067 1.00 0.89 H new ATOM 1436 N GLU A 86 9.758 -10.299 5.580 1.00 0.78 N ATOM 1437 CA GLU A 86 11.215 -10.420 5.740 1.00 0.85 C ATOM 1438 C GLU A 86 12.005 -9.460 4.826 1.00 0.86 C ATOM 1439 O GLU A 86 13.149 -9.118 5.132 1.00 0.95 O ATOM 1440 CB GLU A 86 11.634 -11.875 5.469 1.00 0.98 C ATOM 1441 CG GLU A 86 11.128 -12.839 6.552 1.00 1.12 C ATOM 1442 CD GLU A 86 11.315 -14.301 6.123 1.00 1.90 C ATOM 1443 OE1 GLU A 86 12.388 -14.888 6.398 1.00 2.77 O ATOM 1444 OE2 GLU A 86 10.382 -14.876 5.512 1.00 2.72 O ATOM 0 H GLU A 86 9.333 -11.114 5.139 1.00 0.78 H new ATOM 0 HA GLU A 86 11.456 -10.138 6.765 1.00 0.85 H new ATOM 0 HB2 GLU A 86 11.248 -12.187 4.499 1.00 0.98 H new ATOM 0 HB3 GLU A 86 12.721 -11.933 5.413 1.00 0.98 H new ATOM 0 HG2 GLU A 86 11.665 -12.659 7.483 1.00 1.12 H new ATOM 0 HG3 GLU A 86 10.073 -12.647 6.750 1.00 1.12 H new ATOM 1451 N ASN A 87 11.400 -8.988 3.728 1.00 0.77 N ATOM 1452 CA ASN A 87 11.988 -7.984 2.830 1.00 0.73 C ATOM 1453 C ASN A 87 11.977 -6.560 3.430 1.00 0.71 C ATOM 1454 O ASN A 87 12.722 -5.689 2.974 1.00 0.73 O ATOM 1455 CB ASN A 87 11.228 -8.015 1.492 1.00 0.70 C ATOM 1456 CG ASN A 87 11.439 -9.325 0.736 1.00 2.00 C ATOM 1457 OD1 ASN A 87 10.727 -10.303 0.925 1.00 3.68 O ATOM 1458 ND2 ASN A 87 12.436 -9.393 -0.128 1.00 2.03 N ATOM 0 H ASN A 87 10.474 -9.298 3.434 1.00 0.77 H new ATOM 0 HA ASN A 87 13.037 -8.238 2.679 1.00 0.73 H new ATOM 0 HB2 ASN A 87 10.163 -7.873 1.678 1.00 0.70 H new ATOM 0 HB3 ASN A 87 11.557 -7.182 0.870 1.00 0.70 H new ATOM 0 HD21 ASN A 87 12.612 -10.259 -0.637 1.00 2.03 H new ATOM 0 HD22 ASN A 87 13.030 -8.579 -0.286 1.00 2.03 H new ATOM 1465 N PHE A 88 11.144 -6.311 4.449 1.00 0.73 N ATOM 1466 CA PHE A 88 10.932 -5.004 5.074 1.00 0.76 C ATOM 1467 C PHE A 88 11.942 -4.782 6.211 1.00 0.85 C ATOM 1468 O PHE A 88 11.595 -4.777 7.392 1.00 0.95 O ATOM 1469 CB PHE A 88 9.477 -4.889 5.558 1.00 0.73 C ATOM 1470 CG PHE A 88 8.450 -4.872 4.447 1.00 0.63 C ATOM 1471 CD1 PHE A 88 8.114 -6.055 3.769 1.00 2.19 C ATOM 1472 CD2 PHE A 88 7.830 -3.665 4.088 1.00 1.66 C ATOM 1473 CE1 PHE A 88 7.164 -6.042 2.734 1.00 2.13 C ATOM 1474 CE2 PHE A 88 6.860 -3.649 3.077 1.00 1.71 C ATOM 1475 CZ PHE A 88 6.531 -4.833 2.392 1.00 0.50 C ATOM 0 H PHE A 88 10.578 -7.045 4.875 1.00 0.73 H new ATOM 0 HA PHE A 88 11.101 -4.216 4.340 1.00 0.76 H new ATOM 0 HB2 PHE A 88 9.261 -5.725 6.224 1.00 0.73 H new ATOM 0 HB3 PHE A 88 9.373 -3.977 6.147 1.00 0.73 H new ATOM 0 HD1 PHE A 88 8.590 -6.984 4.046 1.00 2.19 H new ATOM 0 HD2 PHE A 88 8.101 -2.748 4.591 1.00 1.66 H new ATOM 0 HE1 PHE A 88 6.922 -6.952 2.206 1.00 2.13 H new ATOM 0 HE2 PHE A 88 6.363 -2.724 2.823 1.00 1.71 H new ATOM 0 HZ PHE A 88 5.793 -4.814 1.604 1.00 0.50 H new ATOM 1485 N SER A 89 13.215 -4.609 5.862 1.00 0.84 N ATOM 1486 CA SER A 89 14.334 -4.704 6.822 1.00 0.94 C ATOM 1487 C SER A 89 14.409 -3.526 7.814 1.00 1.06 C ATOM 1488 O SER A 89 15.025 -3.645 8.876 1.00 1.18 O ATOM 1489 CB SER A 89 15.659 -4.813 6.052 1.00 0.91 C ATOM 1490 OG SER A 89 15.635 -5.875 5.102 1.00 0.85 O ATOM 0 H SER A 89 13.509 -4.399 4.908 1.00 0.84 H new ATOM 0 HA SER A 89 14.153 -5.597 7.420 1.00 0.94 H new ATOM 0 HB2 SER A 89 15.860 -3.872 5.540 1.00 0.91 H new ATOM 0 HB3 SER A 89 16.476 -4.974 6.756 1.00 0.91 H new ATOM 0 HG SER A 89 16.494 -5.912 4.631 1.00 0.85 H new ATOM 1496 N GLN A 90 13.748 -2.406 7.501 1.00 1.05 N ATOM 1497 CA GLN A 90 13.507 -1.273 8.406 1.00 1.20 C ATOM 1498 C GLN A 90 12.001 -0.922 8.472 1.00 1.17 C ATOM 1499 O GLN A 90 11.628 0.232 8.690 1.00 1.22 O ATOM 1500 CB GLN A 90 14.382 -0.075 7.977 1.00 1.30 C ATOM 1501 CG GLN A 90 15.890 -0.371 8.095 1.00 1.36 C ATOM 1502 CD GLN A 90 16.783 0.851 7.854 1.00 1.40 C ATOM 1503 OE1 GLN A 90 16.391 1.870 7.296 1.00 2.08 O ATOM 1504 NE2 GLN A 90 18.035 0.800 8.267 1.00 2.33 N ATOM 0 H GLN A 90 13.350 -2.257 6.574 1.00 1.05 H new ATOM 0 HA GLN A 90 13.796 -1.549 9.420 1.00 1.20 H new ATOM 0 HB2 GLN A 90 14.147 0.191 6.946 1.00 1.30 H new ATOM 0 HB3 GLN A 90 14.136 0.789 8.594 1.00 1.30 H new ATOM 0 HG2 GLN A 90 16.096 -0.769 9.089 1.00 1.36 H new ATOM 0 HG3 GLN A 90 16.155 -1.149 7.379 1.00 1.36 H new ATOM 0 HE21 GLN A 90 18.384 -0.037 8.734 1.00 2.33 H new ATOM 0 HE22 GLN A 90 18.654 1.597 8.119 1.00 2.33 H new ATOM 1513 N GLY A 91 11.119 -1.908 8.239 1.00 1.10 N ATOM 1514 CA GLY A 91 9.655 -1.737 8.218 1.00 1.08 C ATOM 1515 C GLY A 91 9.109 -1.132 6.919 1.00 1.01 C ATOM 1516 O GLY A 91 7.932 -0.790 6.855 1.00 1.06 O ATOM 0 H GLY A 91 11.410 -2.868 8.056 1.00 1.10 H new ATOM 0 HA2 GLY A 91 9.185 -2.707 8.379 1.00 1.08 H new ATOM 0 HA3 GLY A 91 9.363 -1.100 9.053 1.00 1.08 H new ATOM 1520 N HIS A 92 9.950 -1.001 5.891 1.00 0.93 N ATOM 1521 CA HIS A 92 9.668 -0.298 4.637 1.00 0.91 C ATOM 1522 C HIS A 92 10.253 -1.049 3.421 1.00 0.89 C ATOM 1523 O HIS A 92 11.208 -1.818 3.571 1.00 0.93 O ATOM 1524 CB HIS A 92 10.257 1.120 4.749 1.00 0.97 C ATOM 1525 CG HIS A 92 10.099 1.926 3.487 1.00 0.95 C ATOM 1526 ND1 HIS A 92 8.908 2.206 2.865 1.00 0.98 N ATOM 1527 CD2 HIS A 92 11.098 2.341 2.649 1.00 0.97 C ATOM 1528 CE1 HIS A 92 9.176 2.758 1.673 1.00 1.00 C ATOM 1529 NE2 HIS A 92 10.504 2.881 1.502 1.00 0.98 N ATOM 0 H HIS A 92 10.889 -1.400 5.911 1.00 0.93 H new ATOM 0 HA HIS A 92 8.591 -0.247 4.477 1.00 0.91 H new ATOM 0 HB2 HIS A 92 9.771 1.645 5.572 1.00 0.97 H new ATOM 0 HB3 HIS A 92 11.316 1.049 4.997 1.00 0.97 H new ATOM 0 HD1 HIS A 92 7.979 2.025 3.244 1.00 0.98 H new ATOM 0 HD2 HIS A 92 12.158 2.265 2.839 1.00 0.97 H new ATOM 0 HE1 HIS A 92 8.431 3.061 0.952 1.00 1.00 H new ATOM 1537 N LEU A 93 9.701 -0.808 2.221 1.00 0.84 N ATOM 1538 CA LEU A 93 10.141 -1.415 0.964 1.00 0.83 C ATOM 1539 C LEU A 93 10.037 -0.422 -0.214 1.00 0.81 C ATOM 1540 O LEU A 93 9.042 0.288 -0.358 1.00 0.81 O ATOM 1541 CB LEU A 93 9.291 -2.680 0.729 1.00 0.85 C ATOM 1542 CG LEU A 93 9.818 -3.651 -0.343 1.00 0.60 C ATOM 1543 CD1 LEU A 93 11.125 -4.296 0.114 1.00 1.07 C ATOM 1544 CD2 LEU A 93 8.808 -4.780 -0.558 1.00 1.58 C ATOM 0 H LEU A 93 8.916 -0.168 2.100 1.00 0.84 H new ATOM 0 HA LEU A 93 11.194 -1.687 1.029 1.00 0.83 H new ATOM 0 HB2 LEU A 93 9.208 -3.220 1.672 1.00 0.85 H new ATOM 0 HB3 LEU A 93 8.284 -2.371 0.449 1.00 0.85 H new ATOM 0 HG LEU A 93 9.975 -3.083 -1.260 1.00 0.60 H new ATOM 0 HD11 LEU A 93 11.482 -4.979 -0.656 1.00 1.07 H new ATOM 0 HD12 LEU A 93 11.872 -3.521 0.287 1.00 1.07 H new ATOM 0 HD13 LEU A 93 10.954 -4.848 1.038 1.00 1.07 H new ATOM 0 HD21 LEU A 93 9.184 -5.465 -1.317 1.00 1.58 H new ATOM 0 HD22 LEU A 93 8.661 -5.320 0.377 1.00 1.58 H new ATOM 0 HD23 LEU A 93 7.858 -4.360 -0.887 1.00 1.58 H new ATOM 1556 N MET A 94 11.041 -0.425 -1.097 1.00 0.80 N ATOM 1557 CA MET A 94 11.095 0.386 -2.325 1.00 0.78 C ATOM 1558 C MET A 94 11.205 -0.514 -3.552 1.00 0.85 C ATOM 1559 O MET A 94 11.929 -1.509 -3.522 1.00 0.92 O ATOM 1560 CB MET A 94 12.345 1.278 -2.332 1.00 0.78 C ATOM 1561 CG MET A 94 12.248 2.478 -1.398 1.00 0.99 C ATOM 1562 SD MET A 94 13.705 3.542 -1.529 1.00 0.89 S ATOM 1563 CE MET A 94 12.964 5.091 -0.981 1.00 0.69 C ATOM 0 H MET A 94 11.867 -1.010 -0.976 1.00 0.80 H new ATOM 0 HA MET A 94 10.185 0.986 -2.352 1.00 0.78 H new ATOM 0 HB2 MET A 94 13.210 0.678 -2.049 1.00 0.78 H new ATOM 0 HB3 MET A 94 12.521 1.633 -3.347 1.00 0.78 H new ATOM 0 HG2 MET A 94 11.354 3.054 -1.636 1.00 0.99 H new ATOM 0 HG3 MET A 94 12.140 2.132 -0.370 1.00 0.99 H new ATOM 0 HE1 MET A 94 13.637 5.917 -1.209 1.00 0.69 H new ATOM 0 HE2 MET A 94 12.016 5.243 -1.496 1.00 0.69 H new ATOM 0 HE3 MET A 94 12.790 5.051 0.094 1.00 0.69 H new ATOM 1573 N TRP A 95 10.557 -0.132 -4.654 1.00 0.85 N ATOM 1574 CA TRP A 95 10.744 -0.813 -5.934 1.00 0.81 C ATOM 1575 C TRP A 95 11.997 -0.255 -6.630 1.00 0.82 C ATOM 1576 O TRP A 95 12.063 0.935 -6.948 1.00 0.92 O ATOM 1577 CB TRP A 95 9.512 -0.642 -6.847 1.00 0.79 C ATOM 1578 CG TRP A 95 8.134 -1.023 -6.375 1.00 0.72 C ATOM 1579 CD1 TRP A 95 7.730 -1.316 -5.115 1.00 0.83 C ATOM 1580 CD2 TRP A 95 6.915 -1.047 -7.185 1.00 0.56 C ATOM 1581 NE1 TRP A 95 6.357 -1.450 -5.082 1.00 0.71 N ATOM 1582 CE2 TRP A 95 5.796 -1.262 -6.326 1.00 0.57 C ATOM 1583 CE3 TRP A 95 6.640 -0.832 -8.553 1.00 0.53 C ATOM 1584 CZ2 TRP A 95 4.473 -1.206 -6.790 1.00 0.58 C ATOM 1585 CZ3 TRP A 95 5.317 -0.774 -9.030 1.00 0.64 C ATOM 1586 CH2 TRP A 95 4.232 -0.954 -8.152 1.00 0.67 C ATOM 0 H TRP A 95 9.898 0.646 -4.685 1.00 0.85 H new ATOM 0 HA TRP A 95 10.871 -1.879 -5.743 1.00 0.81 H new ATOM 0 HB2 TRP A 95 9.471 0.409 -7.134 1.00 0.79 H new ATOM 0 HB3 TRP A 95 9.707 -1.213 -7.755 1.00 0.79 H new ATOM 0 HD1 TRP A 95 8.385 -1.428 -4.264 1.00 0.83 H new ATOM 0 HE1 TRP A 95 5.823 -1.662 -4.239 1.00 0.71 H new ATOM 0 HE3 TRP A 95 7.459 -0.710 -9.246 1.00 0.53 H new ATOM 0 HZ2 TRP A 95 3.649 -1.355 -6.108 1.00 0.58 H new ATOM 0 HZ3 TRP A 95 5.133 -0.590 -10.078 1.00 0.64 H new ATOM 0 HH2 TRP A 95 3.219 -0.899 -8.523 1.00 0.67 H new ATOM 1597 N ASN A 96 12.968 -1.124 -6.907 1.00 0.77 N ATOM 1598 CA ASN A 96 14.106 -0.838 -7.785 1.00 0.67 C ATOM 1599 C ASN A 96 14.397 -2.048 -8.683 1.00 0.61 C ATOM 1600 O ASN A 96 13.979 -3.165 -8.381 1.00 0.60 O ATOM 1601 CB ASN A 96 15.333 -0.386 -6.966 1.00 0.71 C ATOM 1602 CG ASN A 96 16.073 0.746 -7.678 1.00 1.32 C ATOM 1603 OD1 ASN A 96 15.593 1.873 -7.739 1.00 1.86 O ATOM 1604 ND2 ASN A 96 17.226 0.501 -8.273 1.00 2.40 N ATOM 0 H ASN A 96 12.988 -2.067 -6.520 1.00 0.77 H new ATOM 0 HA ASN A 96 13.855 -0.005 -8.442 1.00 0.67 H new ATOM 0 HB2 ASN A 96 15.014 -0.053 -5.978 1.00 0.71 H new ATOM 0 HB3 ASN A 96 16.007 -1.230 -6.816 1.00 0.71 H new ATOM 0 HD21 ASN A 96 17.708 1.245 -8.777 1.00 2.40 H new ATOM 0 HD22 ASN A 96 17.634 -0.433 -8.229 1.00 2.40 H new ATOM 1611 N ASP A 97 15.124 -1.840 -9.778 1.00 0.61 N ATOM 1612 CA ASP A 97 15.436 -2.878 -10.773 1.00 0.52 C ATOM 1613 C ASP A 97 16.199 -4.064 -10.143 1.00 0.46 C ATOM 1614 O ASP A 97 16.032 -5.217 -10.537 1.00 0.45 O ATOM 1615 CB ASP A 97 16.253 -2.231 -11.904 1.00 0.57 C ATOM 1616 CG ASP A 97 15.586 -0.960 -12.454 1.00 1.25 C ATOM 1617 OD1 ASP A 97 15.702 0.109 -11.804 1.00 2.45 O ATOM 1618 OD2 ASP A 97 14.908 -1.029 -13.504 1.00 1.82 O ATOM 0 H ASP A 97 15.523 -0.930 -10.008 1.00 0.61 H new ATOM 0 HA ASP A 97 14.507 -3.287 -11.171 1.00 0.52 H new ATOM 0 HB2 ASP A 97 17.249 -1.985 -11.535 1.00 0.57 H new ATOM 0 HB3 ASP A 97 16.382 -2.950 -12.713 1.00 0.57 H new ATOM 1623 N ASP A 98 16.991 -3.758 -9.114 1.00 0.51 N ATOM 1624 CA ASP A 98 17.709 -4.671 -8.222 1.00 0.55 C ATOM 1625 C ASP A 98 16.771 -5.540 -7.362 1.00 0.55 C ATOM 1626 O ASP A 98 16.980 -6.746 -7.227 1.00 0.60 O ATOM 1627 CB ASP A 98 18.558 -3.805 -7.280 1.00 0.67 C ATOM 1628 CG ASP A 98 19.498 -2.850 -8.025 1.00 1.42 C ATOM 1629 OD1 ASP A 98 19.053 -1.714 -8.320 1.00 2.71 O ATOM 1630 OD2 ASP A 98 20.661 -3.229 -8.300 1.00 2.05 O ATOM 0 H ASP A 98 17.161 -2.784 -8.862 1.00 0.51 H new ATOM 0 HA ASP A 98 18.303 -5.349 -8.834 1.00 0.55 H new ATOM 0 HB2 ASP A 98 17.898 -3.226 -6.635 1.00 0.67 H new ATOM 0 HB3 ASP A 98 19.148 -4.454 -6.632 1.00 0.67 H new ATOM 1635 N LEU A 99 15.726 -4.930 -6.791 1.00 0.55 N ATOM 1636 CA LEU A 99 14.721 -5.578 -5.938 1.00 0.59 C ATOM 1637 C LEU A 99 13.936 -6.620 -6.755 1.00 0.58 C ATOM 1638 O LEU A 99 13.707 -7.743 -6.307 1.00 0.71 O ATOM 1639 CB LEU A 99 13.832 -4.459 -5.341 1.00 0.65 C ATOM 1640 CG LEU A 99 13.091 -4.742 -4.019 1.00 0.68 C ATOM 1641 CD1 LEU A 99 12.224 -6.000 -4.040 1.00 1.95 C ATOM 1642 CD2 LEU A 99 14.060 -4.777 -2.834 1.00 1.62 C ATOM 0 H LEU A 99 15.550 -3.933 -6.915 1.00 0.55 H new ATOM 0 HA LEU A 99 15.174 -6.130 -5.115 1.00 0.59 H new ATOM 0 HB2 LEU A 99 14.460 -3.581 -5.189 1.00 0.65 H new ATOM 0 HB3 LEU A 99 13.086 -4.192 -6.090 1.00 0.65 H new ATOM 0 HG LEU A 99 12.402 -3.906 -3.896 1.00 0.68 H new ATOM 0 HD11 LEU A 99 11.739 -6.124 -3.072 1.00 1.95 H new ATOM 0 HD12 LEU A 99 11.465 -5.906 -4.816 1.00 1.95 H new ATOM 0 HD13 LEU A 99 12.849 -6.869 -4.247 1.00 1.95 H new ATOM 0 HD21 LEU A 99 13.506 -4.979 -1.917 1.00 1.62 H new ATOM 0 HD22 LEU A 99 14.799 -5.562 -2.992 1.00 1.62 H new ATOM 0 HD23 LEU A 99 14.565 -3.815 -2.749 1.00 1.62 H new ATOM 1654 N PHE A 100 13.613 -6.267 -8.001 1.00 0.51 N ATOM 1655 CA PHE A 100 12.919 -7.110 -8.974 1.00 0.52 C ATOM 1656 C PHE A 100 13.880 -7.968 -9.826 1.00 0.52 C ATOM 1657 O PHE A 100 13.474 -8.525 -10.844 1.00 0.54 O ATOM 1658 CB PHE A 100 12.002 -6.216 -9.820 1.00 0.56 C ATOM 1659 CG PHE A 100 10.767 -5.721 -9.082 1.00 0.62 C ATOM 1660 CD1 PHE A 100 10.878 -4.748 -8.071 1.00 1.28 C ATOM 1661 CD2 PHE A 100 9.499 -6.251 -9.386 1.00 1.63 C ATOM 1662 CE1 PHE A 100 9.742 -4.320 -7.364 1.00 1.27 C ATOM 1663 CE2 PHE A 100 8.359 -5.788 -8.711 1.00 1.72 C ATOM 1664 CZ PHE A 100 8.477 -4.829 -7.692 1.00 0.85 C ATOM 0 H PHE A 100 13.838 -5.345 -8.375 1.00 0.51 H new ATOM 0 HA PHE A 100 12.312 -7.843 -8.442 1.00 0.52 H new ATOM 0 HB2 PHE A 100 12.573 -5.356 -10.170 1.00 0.56 H new ATOM 0 HB3 PHE A 100 11.687 -6.770 -10.704 1.00 0.56 H new ATOM 0 HD1 PHE A 100 11.845 -4.327 -7.837 1.00 1.28 H new ATOM 0 HD2 PHE A 100 9.403 -7.017 -10.141 1.00 1.63 H new ATOM 0 HE1 PHE A 100 9.843 -3.598 -6.567 1.00 1.27 H new ATOM 0 HE2 PHE A 100 7.385 -6.172 -8.977 1.00 1.72 H new ATOM 0 HZ PHE A 100 7.599 -4.486 -7.164 1.00 0.85 H new ATOM 1674 N SER A 101 15.150 -8.115 -9.432 1.00 0.54 N ATOM 1675 CA SER A 101 16.137 -8.905 -10.190 1.00 0.59 C ATOM 1676 C SER A 101 15.842 -10.422 -10.175 1.00 0.62 C ATOM 1677 O SER A 101 16.249 -11.133 -11.097 1.00 0.73 O ATOM 1678 CB SER A 101 17.554 -8.588 -9.682 1.00 0.66 C ATOM 1679 OG SER A 101 18.568 -9.160 -10.501 1.00 0.74 O ATOM 0 H SER A 101 15.525 -7.693 -8.583 1.00 0.54 H new ATOM 0 HA SER A 101 16.063 -8.611 -11.237 1.00 0.59 H new ATOM 0 HB2 SER A 101 17.689 -7.507 -9.644 1.00 0.66 H new ATOM 0 HB3 SER A 101 17.662 -8.959 -8.663 1.00 0.66 H new ATOM 0 HG SER A 101 19.449 -8.930 -10.139 1.00 0.74 H new ATOM 1685 N GLU A 102 15.081 -10.922 -9.191 1.00 0.57 N ATOM 1686 CA GLU A 102 14.401 -12.227 -9.271 1.00 0.60 C ATOM 1687 C GLU A 102 13.018 -12.087 -9.927 1.00 0.57 C ATOM 1688 O GLU A 102 12.696 -12.815 -10.868 1.00 0.66 O ATOM 1689 CB GLU A 102 14.249 -12.856 -7.875 1.00 0.67 C ATOM 1690 CG GLU A 102 15.575 -13.418 -7.349 1.00 1.68 C ATOM 1691 CD GLU A 102 15.393 -14.097 -5.981 1.00 1.82 C ATOM 1692 OE1 GLU A 102 14.782 -15.190 -5.918 1.00 2.53 O ATOM 1693 OE2 GLU A 102 15.876 -13.550 -4.960 1.00 2.60 O ATOM 0 H GLU A 102 14.918 -10.431 -8.312 1.00 0.57 H new ATOM 0 HA GLU A 102 15.019 -12.881 -9.886 1.00 0.60 H new ATOM 0 HB2 GLU A 102 13.872 -12.107 -7.179 1.00 0.67 H new ATOM 0 HB3 GLU A 102 13.508 -13.654 -7.916 1.00 0.67 H new ATOM 0 HG2 GLU A 102 15.976 -14.137 -8.063 1.00 1.68 H new ATOM 0 HG3 GLU A 102 16.305 -12.613 -7.263 1.00 1.68 H new ATOM 1700 N ALA A 103 12.204 -11.126 -9.471 1.00 0.52 N ATOM 1701 CA ALA A 103 10.841 -10.867 -9.948 1.00 0.50 C ATOM 1702 C ALA A 103 10.789 -10.136 -11.312 1.00 0.43 C ATOM 1703 O ALA A 103 10.002 -9.215 -11.519 1.00 0.41 O ATOM 1704 CB ALA A 103 10.071 -10.169 -8.816 1.00 0.56 C ATOM 0 H ALA A 103 12.489 -10.484 -8.732 1.00 0.52 H new ATOM 0 HA ALA A 103 10.345 -11.810 -10.176 1.00 0.50 H new ATOM 0 HB1 ALA A 103 9.052 -9.963 -9.142 1.00 0.56 H new ATOM 0 HB2 ALA A 103 10.048 -10.816 -7.939 1.00 0.56 H new ATOM 0 HB3 ALA A 103 10.567 -9.232 -8.563 1.00 0.56 H new ATOM 1710 N GLN A 104 11.615 -10.560 -12.267 1.00 0.44 N ATOM 1711 CA GLN A 104 11.638 -10.039 -13.637 1.00 0.42 C ATOM 1712 C GLN A 104 10.313 -10.234 -14.412 1.00 0.40 C ATOM 1713 O GLN A 104 9.906 -9.275 -15.076 1.00 0.39 O ATOM 1714 CB GLN A 104 12.832 -10.622 -14.411 1.00 0.48 C ATOM 1715 CG GLN A 104 14.180 -10.262 -13.760 1.00 0.64 C ATOM 1716 CD GLN A 104 15.397 -10.699 -14.586 1.00 0.67 C ATOM 1717 OE1 GLN A 104 15.410 -10.674 -15.811 1.00 0.74 O ATOM 1718 NE2 GLN A 104 16.472 -11.113 -13.949 1.00 1.05 N ATOM 0 H GLN A 104 12.305 -11.294 -12.108 1.00 0.44 H new ATOM 0 HA GLN A 104 11.758 -8.959 -13.550 1.00 0.42 H new ATOM 0 HB2 GLN A 104 12.734 -11.706 -14.463 1.00 0.48 H new ATOM 0 HB3 GLN A 104 12.815 -10.250 -15.436 1.00 0.48 H new ATOM 0 HG2 GLN A 104 14.224 -9.184 -13.607 1.00 0.64 H new ATOM 0 HG3 GLN A 104 14.234 -10.726 -12.775 1.00 0.64 H new ATOM 0 HE21 GLN A 104 16.481 -11.141 -12.929 1.00 1.05 H new ATOM 0 HE22 GLN A 104 17.296 -11.405 -14.475 1.00 1.05 H new ATOM 1727 N PRO A 105 9.597 -11.386 -14.338 1.00 0.43 N ATOM 1728 CA PRO A 105 8.313 -11.544 -15.029 1.00 0.43 C ATOM 1729 C PRO A 105 7.179 -10.739 -14.379 1.00 0.38 C ATOM 1730 O PRO A 105 6.171 -10.476 -15.035 1.00 0.37 O ATOM 1731 CB PRO A 105 8.040 -13.050 -15.060 1.00 0.50 C ATOM 1732 CG PRO A 105 8.767 -13.580 -13.829 1.00 0.52 C ATOM 1733 CD PRO A 105 9.962 -12.642 -13.684 1.00 0.50 C ATOM 0 HA PRO A 105 8.361 -11.138 -16.039 1.00 0.43 H new ATOM 0 HB2 PRO A 105 6.972 -13.263 -15.016 1.00 0.50 H new ATOM 0 HB3 PRO A 105 8.419 -13.506 -15.975 1.00 0.50 H new ATOM 0 HG2 PRO A 105 8.129 -13.556 -12.946 1.00 0.52 H new ATOM 0 HG3 PRO A 105 9.084 -14.614 -13.965 1.00 0.52 H new ATOM 0 HD2 PRO A 105 10.197 -12.476 -12.633 1.00 0.50 H new ATOM 0 HD3 PRO A 105 10.850 -13.074 -14.145 1.00 0.50 H new ATOM 1741 N LEU A 106 7.355 -10.295 -13.127 1.00 0.38 N ATOM 1742 CA LEU A 106 6.476 -9.335 -12.461 1.00 0.36 C ATOM 1743 C LEU A 106 6.773 -7.917 -12.954 1.00 0.32 C ATOM 1744 O LEU A 106 5.861 -7.207 -13.362 1.00 0.31 O ATOM 1745 CB LEU A 106 6.686 -9.491 -10.945 1.00 0.43 C ATOM 1746 CG LEU A 106 5.739 -8.690 -10.040 1.00 0.50 C ATOM 1747 CD1 LEU A 106 4.324 -9.280 -10.029 1.00 1.53 C ATOM 1748 CD2 LEU A 106 6.284 -8.731 -8.605 1.00 1.36 C ATOM 0 H LEU A 106 8.130 -10.602 -12.540 1.00 0.38 H new ATOM 0 HA LEU A 106 5.428 -9.525 -12.695 1.00 0.36 H new ATOM 0 HB2 LEU A 106 6.588 -10.547 -10.693 1.00 0.43 H new ATOM 0 HB3 LEU A 106 7.710 -9.201 -10.710 1.00 0.43 H new ATOM 0 HG LEU A 106 5.686 -7.671 -10.424 1.00 0.50 H new ATOM 0 HD11 LEU A 106 3.686 -8.684 -9.377 1.00 1.53 H new ATOM 0 HD12 LEU A 106 3.918 -9.271 -11.041 1.00 1.53 H new ATOM 0 HD13 LEU A 106 4.360 -10.306 -9.662 1.00 1.53 H new ATOM 0 HD21 LEU A 106 5.622 -8.166 -7.948 1.00 1.36 H new ATOM 0 HD22 LEU A 106 6.336 -9.765 -8.265 1.00 1.36 H new ATOM 0 HD23 LEU A 106 7.281 -8.291 -8.582 1.00 1.36 H new ATOM 1760 N TRP A 107 8.049 -7.525 -12.981 1.00 0.34 N ATOM 1761 CA TRP A 107 8.502 -6.204 -13.416 1.00 0.36 C ATOM 1762 C TRP A 107 8.172 -5.940 -14.891 1.00 0.36 C ATOM 1763 O TRP A 107 7.670 -4.868 -15.210 1.00 0.37 O ATOM 1764 CB TRP A 107 10.007 -6.091 -13.134 1.00 0.45 C ATOM 1765 CG TRP A 107 10.750 -4.882 -13.627 1.00 0.54 C ATOM 1766 CD1 TRP A 107 12.047 -4.902 -14.014 1.00 0.75 C ATOM 1767 CD2 TRP A 107 10.317 -3.488 -13.785 1.00 0.91 C ATOM 1768 NE1 TRP A 107 12.439 -3.644 -14.421 1.00 1.08 N ATOM 1769 CE2 TRP A 107 11.405 -2.740 -14.332 1.00 1.15 C ATOM 1770 CE3 TRP A 107 9.123 -2.770 -13.537 1.00 1.30 C ATOM 1771 CZ2 TRP A 107 11.303 -1.381 -14.662 1.00 1.58 C ATOM 1772 CZ3 TRP A 107 9.003 -1.411 -13.877 1.00 1.71 C ATOM 1773 CH2 TRP A 107 10.085 -0.718 -14.449 1.00 1.80 C ATOM 0 H TRP A 107 8.815 -8.134 -12.693 1.00 0.34 H new ATOM 0 HA TRP A 107 7.970 -5.436 -12.855 1.00 0.36 H new ATOM 0 HB2 TRP A 107 10.145 -6.144 -12.054 1.00 0.45 H new ATOM 0 HB3 TRP A 107 10.489 -6.971 -13.561 1.00 0.45 H new ATOM 0 HD1 TRP A 107 12.682 -5.776 -14.005 1.00 0.75 H new ATOM 0 HE1 TRP A 107 13.377 -3.413 -14.747 1.00 1.08 H new ATOM 0 HE3 TRP A 107 8.287 -3.276 -13.077 1.00 1.30 H new ATOM 0 HZ2 TRP A 107 12.150 -0.852 -15.074 1.00 1.58 H new ATOM 0 HZ3 TRP A 107 8.072 -0.895 -13.697 1.00 1.71 H new ATOM 0 HH2 TRP A 107 9.979 0.321 -14.723 1.00 1.80 H new ATOM 1784 N GLU A 108 8.373 -6.916 -15.781 1.00 0.38 N ATOM 1785 CA GLU A 108 8.053 -6.767 -17.207 1.00 0.42 C ATOM 1786 C GLU A 108 6.545 -6.553 -17.414 1.00 0.40 C ATOM 1787 O GLU A 108 6.125 -5.616 -18.094 1.00 0.45 O ATOM 1788 CB GLU A 108 8.548 -8.007 -17.973 1.00 0.52 C ATOM 1789 CG GLU A 108 8.337 -7.938 -19.494 1.00 0.70 C ATOM 1790 CD GLU A 108 9.280 -6.929 -20.162 1.00 1.69 C ATOM 1791 OE1 GLU A 108 10.402 -7.322 -20.563 1.00 2.77 O ATOM 1792 OE2 GLU A 108 8.900 -5.745 -20.306 1.00 2.88 O ATOM 0 H GLU A 108 8.760 -7.828 -15.537 1.00 0.38 H new ATOM 0 HA GLU A 108 8.561 -5.884 -17.596 1.00 0.42 H new ATOM 0 HB2 GLU A 108 9.610 -8.144 -17.771 1.00 0.52 H new ATOM 0 HB3 GLU A 108 8.034 -8.887 -17.586 1.00 0.52 H new ATOM 0 HG2 GLU A 108 8.498 -8.925 -19.927 1.00 0.70 H new ATOM 0 HG3 GLU A 108 7.304 -7.662 -19.704 1.00 0.70 H new ATOM 1799 N ALA A 109 5.721 -7.401 -16.795 1.00 0.38 N ATOM 1800 CA ALA A 109 4.265 -7.302 -16.863 1.00 0.39 C ATOM 1801 C ALA A 109 3.731 -6.001 -16.244 1.00 0.36 C ATOM 1802 O ALA A 109 2.857 -5.351 -16.817 1.00 0.40 O ATOM 1803 CB ALA A 109 3.703 -8.558 -16.222 1.00 0.40 C ATOM 0 H ALA A 109 6.050 -8.182 -16.228 1.00 0.38 H new ATOM 0 HA ALA A 109 3.933 -7.244 -17.900 1.00 0.39 H new ATOM 0 HB1 ALA A 109 2.614 -8.525 -16.251 1.00 0.40 H new ATOM 0 HB2 ALA A 109 4.055 -9.434 -16.768 1.00 0.40 H new ATOM 0 HB3 ALA A 109 4.036 -8.618 -15.186 1.00 0.40 H new ATOM 1809 N ALA A 110 4.275 -5.582 -15.103 1.00 0.33 N ATOM 1810 CA ALA A 110 3.947 -4.314 -14.458 1.00 0.36 C ATOM 1811 C ALA A 110 4.322 -3.108 -15.341 1.00 0.40 C ATOM 1812 O ALA A 110 3.502 -2.215 -15.560 1.00 0.49 O ATOM 1813 CB ALA A 110 4.663 -4.308 -13.102 1.00 0.37 C ATOM 0 H ALA A 110 4.970 -6.126 -14.592 1.00 0.33 H new ATOM 0 HA ALA A 110 2.872 -4.220 -14.308 1.00 0.36 H new ATOM 0 HB1 ALA A 110 4.447 -3.376 -12.581 1.00 0.37 H new ATOM 0 HB2 ALA A 110 4.314 -5.149 -12.502 1.00 0.37 H new ATOM 0 HB3 ALA A 110 5.738 -4.396 -13.258 1.00 0.37 H new ATOM 1819 N ARG A 111 5.530 -3.112 -15.914 1.00 0.40 N ATOM 1820 CA ARG A 111 6.010 -2.099 -16.863 1.00 0.46 C ATOM 1821 C ARG A 111 5.088 -2.011 -18.090 1.00 0.47 C ATOM 1822 O ARG A 111 4.732 -0.910 -18.511 1.00 0.53 O ATOM 1823 CB ARG A 111 7.451 -2.457 -17.270 1.00 0.53 C ATOM 1824 CG ARG A 111 8.143 -1.384 -18.126 1.00 0.88 C ATOM 1825 CD ARG A 111 9.326 -1.970 -18.915 1.00 1.31 C ATOM 1826 NE ARG A 111 8.884 -2.909 -19.965 1.00 2.46 N ATOM 1827 CZ ARG A 111 8.284 -2.628 -21.113 1.00 3.42 C ATOM 1828 NH1 ARG A 111 8.009 -1.400 -21.503 1.00 4.08 N ATOM 1829 NH2 ARG A 111 7.949 -3.632 -21.888 1.00 4.90 N ATOM 0 H ARG A 111 6.220 -3.839 -15.726 1.00 0.40 H new ATOM 0 HA ARG A 111 5.999 -1.117 -16.390 1.00 0.46 H new ATOM 0 HB2 ARG A 111 8.041 -2.625 -16.369 1.00 0.53 H new ATOM 0 HB3 ARG A 111 7.439 -3.396 -17.823 1.00 0.53 H new ATOM 0 HG2 ARG A 111 7.422 -0.949 -18.818 1.00 0.88 H new ATOM 0 HG3 ARG A 111 8.496 -0.577 -17.484 1.00 0.88 H new ATOM 0 HD2 ARG A 111 9.894 -1.159 -19.371 1.00 1.31 H new ATOM 0 HD3 ARG A 111 9.999 -2.485 -18.229 1.00 1.31 H new ATOM 0 HE ARG A 111 9.063 -3.897 -19.785 1.00 2.46 H new ATOM 0 HH11 ARG A 111 8.260 -0.609 -20.911 1.00 4.08 H new ATOM 0 HH12 ARG A 111 7.545 -1.241 -22.397 1.00 4.08 H new ATOM 0 HH21 ARG A 111 8.152 -4.589 -21.599 1.00 4.90 H new ATOM 0 HH22 ARG A 111 7.486 -3.456 -22.779 1.00 4.90 H new ATOM 1843 N ALA A 112 4.644 -3.157 -18.617 1.00 0.45 N ATOM 1844 CA ALA A 112 3.719 -3.245 -19.751 1.00 0.48 C ATOM 1845 C ALA A 112 2.326 -2.672 -19.425 1.00 0.49 C ATOM 1846 O ALA A 112 1.740 -1.957 -20.237 1.00 0.53 O ATOM 1847 CB ALA A 112 3.626 -4.719 -20.169 1.00 0.49 C ATOM 0 H ALA A 112 4.924 -4.070 -18.258 1.00 0.45 H new ATOM 0 HA ALA A 112 4.103 -2.637 -20.571 1.00 0.48 H new ATOM 0 HB1 ALA A 112 2.943 -4.815 -21.013 1.00 0.49 H new ATOM 0 HB2 ALA A 112 4.614 -5.078 -20.459 1.00 0.49 H new ATOM 0 HB3 ALA A 112 3.255 -5.312 -19.333 1.00 0.49 H new ATOM 1853 N HIS A 113 1.804 -2.962 -18.232 1.00 0.48 N ATOM 1854 CA HIS A 113 0.531 -2.430 -17.729 1.00 0.53 C ATOM 1855 C HIS A 113 0.577 -0.939 -17.321 1.00 0.58 C ATOM 1856 O HIS A 113 -0.475 -0.334 -17.092 1.00 0.65 O ATOM 1857 CB HIS A 113 -0.003 -3.363 -16.633 1.00 0.52 C ATOM 1858 CG HIS A 113 -0.517 -4.653 -17.227 1.00 0.52 C ATOM 1859 ND1 HIS A 113 0.131 -5.866 -17.229 1.00 0.51 N ATOM 1860 CD2 HIS A 113 -1.686 -4.826 -17.922 1.00 0.58 C ATOM 1861 CE1 HIS A 113 -0.624 -6.746 -17.907 1.00 0.54 C ATOM 1862 NE2 HIS A 113 -1.746 -6.158 -18.355 1.00 0.59 N ATOM 0 H HIS A 113 2.264 -3.588 -17.571 1.00 0.48 H new ATOM 0 HA HIS A 113 -0.182 -2.422 -18.554 1.00 0.53 H new ATOM 0 HB2 HIS A 113 0.789 -3.578 -15.916 1.00 0.52 H new ATOM 0 HB3 HIS A 113 -0.803 -2.866 -16.085 1.00 0.52 H new ATOM 0 HD1 HIS A 113 1.031 -6.064 -16.791 1.00 0.51 H new ATOM 0 HD2 HIS A 113 -2.432 -4.067 -18.104 1.00 0.58 H new ATOM 0 HE1 HIS A 113 -0.365 -7.782 -18.069 1.00 0.54 H new ATOM 1870 N GLY A 114 1.773 -0.339 -17.239 1.00 0.55 N ATOM 1871 CA GLY A 114 1.979 1.100 -17.016 1.00 0.61 C ATOM 1872 C GLY A 114 2.300 1.477 -15.568 1.00 0.54 C ATOM 1873 O GLY A 114 2.254 2.659 -15.231 1.00 0.62 O ATOM 0 H GLY A 114 2.648 -0.855 -17.328 1.00 0.55 H new ATOM 0 HA2 GLY A 114 2.792 1.441 -17.656 1.00 0.61 H new ATOM 0 HA3 GLY A 114 1.082 1.635 -17.327 1.00 0.61 H new ATOM 1877 N LEU A 115 2.642 0.495 -14.725 1.00 0.54 N ATOM 1878 CA LEU A 115 2.936 0.690 -13.304 1.00 0.59 C ATOM 1879 C LEU A 115 4.228 1.507 -13.114 1.00 1.18 C ATOM 1880 O LEU A 115 4.268 2.427 -12.306 1.00 3.15 O ATOM 1881 CB LEU A 115 3.009 -0.679 -12.612 1.00 0.59 C ATOM 1882 CG LEU A 115 1.664 -1.407 -12.394 1.00 0.75 C ATOM 1883 CD1 LEU A 115 0.847 -0.791 -11.269 1.00 2.53 C ATOM 1884 CD2 LEU A 115 0.711 -1.529 -13.593 1.00 2.28 C ATOM 0 H LEU A 115 2.723 -0.478 -15.020 1.00 0.54 H new ATOM 0 HA LEU A 115 2.136 1.267 -12.841 1.00 0.59 H new ATOM 0 HB2 LEU A 115 3.657 -1.327 -13.202 1.00 0.59 H new ATOM 0 HB3 LEU A 115 3.488 -0.547 -11.642 1.00 0.59 H new ATOM 0 HG LEU A 115 2.025 -2.410 -12.165 1.00 0.75 H new ATOM 0 HD11 LEU A 115 -0.088 -1.339 -11.156 1.00 2.53 H new ATOM 0 HD12 LEU A 115 1.412 -0.843 -10.338 1.00 2.53 H new ATOM 0 HD13 LEU A 115 0.631 0.251 -11.505 1.00 2.53 H new ATOM 0 HD21 LEU A 115 -0.190 -2.062 -13.289 1.00 2.28 H new ATOM 0 HD22 LEU A 115 0.441 -0.534 -13.946 1.00 2.28 H new ATOM 0 HD23 LEU A 115 1.204 -2.078 -14.395 1.00 2.28 H new ATOM 1896 N ARG A 116 5.267 1.199 -13.903 1.00 0.80 N ATOM 1897 CA ARG A 116 6.488 1.996 -14.146 1.00 0.58 C ATOM 1898 C ARG A 116 7.429 2.137 -12.934 1.00 0.56 C ATOM 1899 O ARG A 116 8.543 1.635 -13.032 1.00 0.67 O ATOM 1900 CB ARG A 116 6.162 3.343 -14.822 1.00 0.84 C ATOM 1901 CG ARG A 116 5.496 3.138 -16.200 1.00 0.97 C ATOM 1902 CD ARG A 116 6.223 3.826 -17.362 1.00 1.54 C ATOM 1903 NE ARG A 116 5.728 5.198 -17.553 1.00 2.50 N ATOM 1904 CZ ARG A 116 4.752 5.596 -18.361 1.00 3.04 C ATOM 1905 NH1 ARG A 116 4.115 4.771 -19.166 1.00 3.31 N ATOM 1906 NH2 ARG A 116 4.398 6.860 -18.351 1.00 4.03 N ATOM 0 H ARG A 116 5.282 0.325 -14.428 1.00 0.80 H new ATOM 0 HA ARG A 116 7.076 1.409 -14.852 1.00 0.58 H new ATOM 0 HB2 ARG A 116 5.500 3.923 -14.179 1.00 0.84 H new ATOM 0 HB3 ARG A 116 7.078 3.922 -14.942 1.00 0.84 H new ATOM 0 HG2 ARG A 116 5.436 2.069 -16.406 1.00 0.97 H new ATOM 0 HG3 ARG A 116 4.473 3.511 -16.155 1.00 0.97 H new ATOM 0 HD2 ARG A 116 7.295 3.846 -17.165 1.00 1.54 H new ATOM 0 HD3 ARG A 116 6.078 3.252 -18.277 1.00 1.54 H new ATOM 0 HE ARG A 116 6.186 5.925 -17.003 1.00 2.50 H new ATOM 0 HH11 ARG A 116 4.366 3.782 -19.185 1.00 3.31 H new ATOM 0 HH12 ARG A 116 3.371 5.121 -19.770 1.00 3.31 H new ATOM 0 HH21 ARG A 116 4.870 7.517 -17.730 1.00 4.03 H new ATOM 0 HH22 ARG A 116 3.651 7.185 -18.964 1.00 4.03 H new ATOM 1920 N ARG A 117 7.033 2.751 -11.810 1.00 0.55 N ATOM 1921 CA ARG A 117 7.715 2.681 -10.494 1.00 0.49 C ATOM 1922 C ARG A 117 6.663 2.721 -9.369 1.00 0.54 C ATOM 1923 O ARG A 117 5.534 3.159 -9.585 1.00 0.78 O ATOM 1924 CB ARG A 117 8.740 3.823 -10.264 1.00 0.63 C ATOM 1925 CG ARG A 117 9.843 4.041 -11.318 1.00 0.56 C ATOM 1926 CD ARG A 117 10.779 2.856 -11.606 1.00 0.48 C ATOM 1927 NE ARG A 117 12.016 2.817 -10.804 1.00 0.88 N ATOM 1928 CZ ARG A 117 13.082 2.085 -11.127 1.00 1.24 C ATOM 1929 NH1 ARG A 117 13.111 1.312 -12.191 1.00 1.92 N ATOM 1930 NH2 ARG A 117 14.171 2.091 -10.395 1.00 1.66 N ATOM 0 H ARG A 117 6.197 3.335 -11.783 1.00 0.55 H new ATOM 0 HA ARG A 117 8.273 1.745 -10.484 1.00 0.49 H new ATOM 0 HB2 ARG A 117 8.183 4.755 -10.169 1.00 0.63 H new ATOM 0 HB3 ARG A 117 9.227 3.644 -9.306 1.00 0.63 H new ATOM 0 HG2 ARG A 117 9.365 4.330 -12.254 1.00 0.56 H new ATOM 0 HG3 ARG A 117 10.454 4.885 -10.999 1.00 0.56 H new ATOM 0 HD2 ARG A 117 10.228 1.931 -11.438 1.00 0.48 H new ATOM 0 HD3 ARG A 117 11.051 2.878 -12.661 1.00 0.48 H new ATOM 0 HE ARG A 117 12.058 3.381 -9.955 1.00 0.88 H new ATOM 0 HH11 ARG A 117 12.298 1.257 -12.804 1.00 1.92 H new ATOM 0 HH12 ARG A 117 13.947 0.767 -12.403 1.00 1.92 H new ATOM 0 HH21 ARG A 117 14.217 2.666 -9.554 1.00 1.66 H new ATOM 0 HH22 ARG A 117 14.971 1.520 -10.667 1.00 1.66 H new ATOM 1944 N GLY A 118 7.022 2.299 -8.150 1.00 0.50 N ATOM 1945 CA GLY A 118 6.093 2.253 -7.010 1.00 0.56 C ATOM 1946 C GLY A 118 6.729 2.530 -5.654 1.00 0.53 C ATOM 1947 O GLY A 118 7.937 2.739 -5.558 1.00 0.53 O ATOM 0 H GLY A 118 7.964 1.980 -7.925 1.00 0.50 H new ATOM 0 HA2 GLY A 118 5.298 2.980 -7.178 1.00 0.56 H new ATOM 0 HA3 GLY A 118 5.624 1.269 -6.981 1.00 0.56 H new ATOM 1951 N VAL A 119 5.888 2.617 -4.625 1.00 0.53 N ATOM 1952 CA VAL A 119 6.259 2.850 -3.217 1.00 0.59 C ATOM 1953 C VAL A 119 5.378 1.979 -2.323 1.00 0.55 C ATOM 1954 O VAL A 119 4.172 1.936 -2.540 1.00 0.55 O ATOM 1955 CB VAL A 119 6.121 4.336 -2.789 1.00 0.72 C ATOM 1956 CG1 VAL A 119 7.123 5.224 -3.534 1.00 0.96 C ATOM 1957 CG2 VAL A 119 4.726 4.950 -2.997 1.00 0.71 C ATOM 0 H VAL A 119 4.880 2.523 -4.749 1.00 0.53 H new ATOM 0 HA VAL A 119 7.311 2.587 -3.109 1.00 0.59 H new ATOM 0 HB VAL A 119 6.317 4.310 -1.717 1.00 0.72 H new ATOM 0 HG11 VAL A 119 7.002 6.258 -3.213 1.00 0.96 H new ATOM 0 HG12 VAL A 119 8.138 4.892 -3.313 1.00 0.96 H new ATOM 0 HG13 VAL A 119 6.944 5.154 -4.607 1.00 0.96 H new ATOM 0 HG21 VAL A 119 4.733 5.989 -2.668 1.00 0.71 H new ATOM 0 HG22 VAL A 119 4.463 4.906 -4.054 1.00 0.71 H new ATOM 0 HG23 VAL A 119 3.992 4.391 -2.417 1.00 0.71 H new ATOM 1967 N THR A 120 5.963 1.290 -1.340 1.00 0.60 N ATOM 1968 CA THR A 120 5.286 0.258 -0.535 1.00 0.55 C ATOM 1969 C THR A 120 5.484 0.551 0.948 1.00 0.53 C ATOM 1970 O THR A 120 6.593 0.860 1.381 1.00 0.69 O ATOM 1971 CB THR A 120 5.844 -1.109 -0.957 1.00 0.59 C ATOM 1972 OG1 THR A 120 5.311 -1.411 -2.228 1.00 0.68 O ATOM 1973 CG2 THR A 120 5.494 -2.279 -0.046 1.00 0.66 C ATOM 0 H THR A 120 6.937 1.433 -1.073 1.00 0.60 H new ATOM 0 HA THR A 120 4.210 0.255 -0.706 1.00 0.55 H new ATOM 0 HB THR A 120 6.929 -1.006 -0.926 1.00 0.59 H new ATOM 0 HG1 THR A 120 5.080 -2.363 -2.268 1.00 0.68 H new ATOM 0 HG21 THR A 120 5.940 -3.193 -0.440 1.00 0.66 H new ATOM 0 HG22 THR A 120 5.881 -2.089 0.955 1.00 0.66 H new ATOM 0 HG23 THR A 120 4.411 -2.394 -0.001 1.00 0.66 H new ATOM 1981 N GLN A 121 4.419 0.449 1.748 1.00 0.43 N ATOM 1982 CA GLN A 121 4.496 0.620 3.200 1.00 0.43 C ATOM 1983 C GLN A 121 3.695 -0.427 3.969 1.00 0.53 C ATOM 1984 O GLN A 121 2.582 -0.795 3.605 1.00 0.84 O ATOM 1985 CB GLN A 121 4.071 2.035 3.643 1.00 0.42 C ATOM 1986 CG GLN A 121 5.249 3.003 3.849 1.00 1.22 C ATOM 1987 CD GLN A 121 6.167 2.580 4.996 1.00 2.07 C ATOM 1988 OE1 GLN A 121 6.983 1.683 4.853 1.00 2.92 O ATOM 1989 NE2 GLN A 121 6.081 3.182 6.162 1.00 2.85 N ATOM 0 H GLN A 121 3.480 0.246 1.407 1.00 0.43 H new ATOM 0 HA GLN A 121 5.548 0.479 3.448 1.00 0.43 H new ATOM 0 HB2 GLN A 121 3.397 2.452 2.895 1.00 0.42 H new ATOM 0 HB3 GLN A 121 3.508 1.960 4.573 1.00 0.42 H new ATOM 0 HG2 GLN A 121 5.829 3.064 2.928 1.00 1.22 H new ATOM 0 HG3 GLN A 121 4.862 4.002 4.048 1.00 1.22 H new ATOM 0 HE21 GLN A 121 5.405 3.933 6.299 1.00 2.85 H new ATOM 0 HE22 GLN A 121 6.690 2.898 6.929 1.00 2.85 H new ATOM 1998 N TYR A 122 4.295 -0.843 5.083 1.00 0.49 N ATOM 1999 CA TYR A 122 3.896 -1.914 5.996 1.00 0.50 C ATOM 2000 C TYR A 122 3.882 -1.384 7.444 1.00 0.52 C ATOM 2001 O TYR A 122 4.551 -0.394 7.759 1.00 0.62 O ATOM 2002 CB TYR A 122 4.938 -3.032 5.791 1.00 0.58 C ATOM 2003 CG TYR A 122 5.073 -4.127 6.833 1.00 0.76 C ATOM 2004 CD1 TYR A 122 5.838 -3.895 7.997 1.00 1.59 C ATOM 2005 CD2 TYR A 122 4.549 -5.410 6.591 1.00 2.58 C ATOM 2006 CE1 TYR A 122 6.063 -4.932 8.922 1.00 1.56 C ATOM 2007 CE2 TYR A 122 4.772 -6.451 7.510 1.00 2.86 C ATOM 2008 CZ TYR A 122 5.534 -6.220 8.676 1.00 1.40 C ATOM 2009 OH TYR A 122 5.773 -7.244 9.541 1.00 1.76 O ATOM 0 H TYR A 122 5.155 -0.396 5.400 1.00 0.49 H new ATOM 0 HA TYR A 122 2.891 -2.289 5.801 1.00 0.50 H new ATOM 0 HB2 TYR A 122 4.718 -3.513 4.838 1.00 0.58 H new ATOM 0 HB3 TYR A 122 5.913 -2.555 5.690 1.00 0.58 H new ATOM 0 HD1 TYR A 122 6.253 -2.915 8.179 1.00 1.59 H new ATOM 0 HD2 TYR A 122 3.973 -5.596 5.696 1.00 2.58 H new ATOM 0 HE1 TYR A 122 6.638 -4.744 9.817 1.00 1.56 H new ATOM 0 HE2 TYR A 122 4.359 -7.431 7.323 1.00 2.86 H new ATOM 0 HH TYR A 122 5.332 -8.057 9.216 1.00 1.76 H new ATOM 2019 N LEU A 123 3.145 -2.048 8.339 1.00 0.54 N ATOM 2020 CA LEU A 123 3.112 -1.720 9.769 1.00 0.57 C ATOM 2021 C LEU A 123 2.923 -2.988 10.611 1.00 0.76 C ATOM 2022 O LEU A 123 2.250 -3.925 10.179 1.00 1.01 O ATOM 2023 CB LEU A 123 1.983 -0.700 10.027 1.00 0.80 C ATOM 2024 CG LEU A 123 2.202 0.173 11.280 1.00 0.99 C ATOM 2025 CD1 LEU A 123 3.222 1.290 11.007 1.00 1.39 C ATOM 2026 CD2 LEU A 123 0.865 0.783 11.714 1.00 2.42 C ATOM 0 H LEU A 123 2.548 -2.837 8.090 1.00 0.54 H new ATOM 0 HA LEU A 123 4.063 -1.275 10.064 1.00 0.57 H new ATOM 0 HB2 LEU A 123 1.887 -0.051 9.156 1.00 0.80 H new ATOM 0 HB3 LEU A 123 1.039 -1.236 10.130 1.00 0.80 H new ATOM 0 HG LEU A 123 2.598 -0.457 12.077 1.00 0.99 H new ATOM 0 HD11 LEU A 123 3.356 1.889 11.908 1.00 1.39 H new ATOM 0 HD12 LEU A 123 4.176 0.849 10.719 1.00 1.39 H new ATOM 0 HD13 LEU A 123 2.858 1.926 10.200 1.00 1.39 H new ATOM 0 HD21 LEU A 123 1.017 1.400 12.599 1.00 2.42 H new ATOM 0 HD22 LEU A 123 0.467 1.398 10.907 1.00 2.42 H new ATOM 0 HD23 LEU A 123 0.159 -0.015 11.945 1.00 2.42 H new ATOM 2038 N MET A 124 3.487 -3.001 11.822 1.00 0.81 N ATOM 2039 CA MET A 124 3.329 -4.082 12.802 1.00 0.98 C ATOM 2040 C MET A 124 2.643 -3.582 14.083 1.00 0.98 C ATOM 2041 O MET A 124 2.942 -2.486 14.564 1.00 0.91 O ATOM 2042 CB MET A 124 4.702 -4.710 13.124 1.00 1.10 C ATOM 2043 CG MET A 124 4.730 -6.205 12.791 1.00 1.32 C ATOM 2044 SD MET A 124 3.524 -7.211 13.698 1.00 1.41 S ATOM 2045 CE MET A 124 2.479 -7.713 12.310 1.00 1.84 C ATOM 0 H MET A 124 4.081 -2.242 12.157 1.00 0.81 H new ATOM 0 HA MET A 124 2.686 -4.846 12.365 1.00 0.98 H new ATOM 0 HB2 MET A 124 5.479 -4.196 12.559 1.00 1.10 H new ATOM 0 HB3 MET A 124 4.929 -4.568 14.181 1.00 1.10 H new ATOM 0 HG2 MET A 124 4.554 -6.328 11.722 1.00 1.32 H new ATOM 0 HG3 MET A 124 5.729 -6.589 12.995 1.00 1.32 H new ATOM 0 HE1 MET A 124 1.469 -7.911 12.668 1.00 1.84 H new ATOM 0 HE2 MET A 124 2.451 -6.915 11.568 1.00 1.84 H new ATOM 0 HE3 MET A 124 2.886 -8.616 11.856 1.00 1.84 H new ATOM 2055 N LEU A 125 1.742 -4.398 14.638 1.00 1.20 N ATOM 2056 CA LEU A 125 0.982 -4.148 15.873 1.00 1.31 C ATOM 2057 C LEU A 125 1.373 -5.166 16.970 1.00 1.57 C ATOM 2058 O LEU A 125 1.764 -6.291 16.638 1.00 2.08 O ATOM 2059 CB LEU A 125 -0.532 -4.234 15.552 1.00 1.68 C ATOM 2060 CG LEU A 125 -1.238 -2.886 15.296 1.00 1.40 C ATOM 2061 CD1 LEU A 125 -0.530 -1.996 14.265 1.00 2.22 C ATOM 2062 CD2 LEU A 125 -2.681 -3.155 14.843 1.00 2.29 C ATOM 0 H LEU A 125 1.509 -5.298 14.219 1.00 1.20 H new ATOM 0 HA LEU A 125 1.216 -3.153 16.253 1.00 1.31 H new ATOM 0 HB2 LEU A 125 -0.663 -4.865 14.673 1.00 1.68 H new ATOM 0 HB3 LEU A 125 -1.033 -4.734 16.381 1.00 1.68 H new ATOM 0 HG LEU A 125 -1.214 -2.335 16.236 1.00 1.40 H new ATOM 0 HD11 LEU A 125 -1.088 -1.068 14.141 1.00 2.22 H new ATOM 0 HD12 LEU A 125 0.479 -1.770 14.611 1.00 2.22 H new ATOM 0 HD13 LEU A 125 -0.477 -2.518 13.309 1.00 2.22 H new ATOM 0 HD21 LEU A 125 -3.187 -2.207 14.660 1.00 2.29 H new ATOM 0 HD22 LEU A 125 -2.671 -3.744 13.926 1.00 2.29 H new ATOM 0 HD23 LEU A 125 -3.210 -3.705 15.621 1.00 2.29 H new ATOM 2074 N PRO A 126 1.232 -4.817 18.267 1.00 1.39 N ATOM 2075 CA PRO A 126 1.566 -5.707 19.381 1.00 1.66 C ATOM 2076 C PRO A 126 0.529 -6.822 19.606 1.00 2.00 C ATOM 2077 O PRO A 126 0.853 -7.829 20.235 1.00 2.36 O ATOM 2078 CB PRO A 126 1.656 -4.786 20.604 1.00 1.50 C ATOM 2079 CG PRO A 126 0.657 -3.674 20.285 1.00 1.30 C ATOM 2080 CD PRO A 126 0.801 -3.517 18.771 1.00 1.18 C ATOM 0 HA PRO A 126 2.495 -6.240 19.179 1.00 1.66 H new ATOM 0 HB2 PRO A 126 1.393 -5.311 21.522 1.00 1.50 H new ATOM 0 HB3 PRO A 126 2.664 -4.394 20.738 1.00 1.50 H new ATOM 0 HG2 PRO A 126 -0.359 -3.949 20.569 1.00 1.30 H new ATOM 0 HG3 PRO A 126 0.897 -2.751 20.812 1.00 1.30 H new ATOM 0 HD2 PRO A 126 -0.145 -3.218 18.319 1.00 1.18 H new ATOM 0 HD3 PRO A 126 1.530 -2.744 18.527 1.00 1.18 H new ATOM 2088 N GLU A 127 -0.708 -6.650 19.117 1.00 2.08 N ATOM 2089 CA GLU A 127 -1.834 -7.566 19.344 1.00 2.57 C ATOM 2090 C GLU A 127 -1.892 -8.665 18.267 1.00 2.86 C ATOM 2091 O GLU A 127 -1.389 -9.766 18.504 1.00 4.31 O ATOM 2092 CB GLU A 127 -3.139 -6.753 19.470 1.00 2.75 C ATOM 2093 CG GLU A 127 -3.195 -6.016 20.821 1.00 3.23 C ATOM 2094 CD GLU A 127 -4.353 -5.007 20.943 1.00 3.01 C ATOM 2095 OE1 GLU A 127 -5.356 -5.100 20.196 1.00 3.48 O ATOM 2096 OE2 GLU A 127 -4.268 -4.110 21.816 1.00 3.59 O ATOM 0 H GLU A 127 -0.959 -5.849 18.538 1.00 2.08 H new ATOM 0 HA GLU A 127 -1.691 -8.098 20.285 1.00 2.57 H new ATOM 0 HB2 GLU A 127 -3.204 -6.033 18.655 1.00 2.75 H new ATOM 0 HB3 GLU A 127 -3.998 -7.418 19.377 1.00 2.75 H new ATOM 0 HG2 GLU A 127 -3.284 -6.752 21.620 1.00 3.23 H new ATOM 0 HG3 GLU A 127 -2.252 -5.491 20.975 1.00 3.23 H new ATOM 2103 N ARG A 128 -2.487 -8.402 17.092 1.00 1.88 N ATOM 2104 CA ARG A 128 -2.637 -9.376 15.994 1.00 2.11 C ATOM 2105 C ARG A 128 -2.872 -8.690 14.636 1.00 1.37 C ATOM 2106 O ARG A 128 -3.406 -7.582 14.594 1.00 2.00 O ATOM 2107 CB ARG A 128 -3.802 -10.351 16.292 1.00 2.98 C ATOM 2108 CG ARG A 128 -3.600 -11.750 15.666 1.00 4.11 C ATOM 2109 CD ARG A 128 -3.032 -12.801 16.632 1.00 5.14 C ATOM 2110 NE ARG A 128 -1.857 -12.305 17.370 1.00 6.01 N ATOM 2111 CZ ARG A 128 -0.839 -12.992 17.866 1.00 7.12 C ATOM 2112 NH1 ARG A 128 -0.689 -14.287 17.680 1.00 7.73 N ATOM 2113 NH2 ARG A 128 0.050 -12.340 18.581 1.00 8.06 N ATOM 0 H ARG A 128 -2.886 -7.489 16.873 1.00 1.88 H new ATOM 0 HA ARG A 128 -1.701 -9.931 15.930 1.00 2.11 H new ATOM 0 HB2 ARG A 128 -3.913 -10.456 17.371 1.00 2.98 H new ATOM 0 HB3 ARG A 128 -4.731 -9.923 15.916 1.00 2.98 H new ATOM 0 HG2 ARG A 128 -4.557 -12.105 15.283 1.00 4.11 H new ATOM 0 HG3 ARG A 128 -2.929 -11.659 14.812 1.00 4.11 H new ATOM 0 HD2 ARG A 128 -3.806 -13.095 17.341 1.00 5.14 H new ATOM 0 HD3 ARG A 128 -2.756 -13.694 16.072 1.00 5.14 H new ATOM 0 HE ARG A 128 -1.823 -11.297 17.519 1.00 6.01 H new ATOM 0 HH11 ARG A 128 -1.375 -14.806 17.132 1.00 7.73 H new ATOM 0 HH12 ARG A 128 0.113 -14.771 18.083 1.00 7.73 H new ATOM 0 HH21 ARG A 128 -0.057 -11.338 18.738 1.00 8.06 H new ATOM 0 HH22 ARG A 128 0.847 -12.836 18.979 1.00 8.06 H new ATOM 2127 N ALA A 129 -2.510 -9.391 13.552 1.00 2.18 N ATOM 2128 CA ALA A 129 -2.786 -9.084 12.139 1.00 1.78 C ATOM 2129 C ALA A 129 -2.039 -7.856 11.588 1.00 1.16 C ATOM 2130 O ALA A 129 -1.468 -7.060 12.341 1.00 1.29 O ATOM 2131 CB ALA A 129 -4.290 -9.026 11.879 1.00 2.31 C ATOM 0 H ALA A 129 -1.975 -10.254 13.647 1.00 2.18 H new ATOM 0 HA ALA A 129 -2.373 -9.915 11.567 1.00 1.78 H new ATOM 0 HB1 ALA A 129 -4.469 -8.798 10.828 1.00 2.31 H new ATOM 0 HB2 ALA A 129 -4.739 -9.989 12.123 1.00 2.31 H new ATOM 0 HB3 ALA A 129 -4.737 -8.250 12.500 1.00 2.31 H new ATOM 2137 N LEU A 130 -2.025 -7.723 10.255 1.00 0.83 N ATOM 2138 CA LEU A 130 -1.330 -6.645 9.552 1.00 0.67 C ATOM 2139 C LEU A 130 -1.886 -6.407 8.144 1.00 0.60 C ATOM 2140 O LEU A 130 -2.467 -7.296 7.524 1.00 0.79 O ATOM 2141 CB LEU A 130 0.195 -6.902 9.587 1.00 1.15 C ATOM 2142 CG LEU A 130 0.799 -7.766 8.455 1.00 1.14 C ATOM 2143 CD1 LEU A 130 1.383 -6.864 7.360 1.00 2.43 C ATOM 2144 CD2 LEU A 130 1.941 -8.647 8.984 1.00 1.58 C ATOM 0 H LEU A 130 -2.503 -8.371 9.630 1.00 0.83 H new ATOM 0 HA LEU A 130 -1.516 -5.706 10.074 1.00 0.67 H new ATOM 0 HB2 LEU A 130 0.699 -5.936 9.578 1.00 1.15 H new ATOM 0 HB3 LEU A 130 0.434 -7.378 10.538 1.00 1.15 H new ATOM 0 HG LEU A 130 -0.001 -8.391 8.060 1.00 1.14 H new ATOM 0 HD11 LEU A 130 1.806 -7.481 6.567 1.00 2.43 H new ATOM 0 HD12 LEU A 130 0.594 -6.235 6.948 1.00 2.43 H new ATOM 0 HD13 LEU A 130 2.164 -6.234 7.786 1.00 2.43 H new ATOM 0 HD21 LEU A 130 2.348 -9.244 8.168 1.00 1.58 H new ATOM 0 HD22 LEU A 130 2.727 -8.015 9.398 1.00 1.58 H new ATOM 0 HD23 LEU A 130 1.560 -9.308 9.762 1.00 1.58 H new ATOM 2156 N GLY A 131 -1.667 -5.201 7.630 1.00 0.74 N ATOM 2157 CA GLY A 131 -1.923 -4.816 6.245 1.00 0.65 C ATOM 2158 C GLY A 131 -0.803 -3.929 5.717 1.00 0.61 C ATOM 2159 O GLY A 131 -0.109 -3.259 6.488 1.00 0.90 O ATOM 0 H GLY A 131 -1.292 -4.434 8.188 1.00 0.74 H new ATOM 0 HA2 GLY A 131 -2.010 -5.708 5.625 1.00 0.65 H new ATOM 0 HA3 GLY A 131 -2.874 -4.287 6.179 1.00 0.65 H new ATOM 2163 N PHE A 132 -0.645 -3.919 4.397 1.00 0.53 N ATOM 2164 CA PHE A 132 0.295 -3.060 3.687 1.00 0.50 C ATOM 2165 C PHE A 132 -0.394 -2.389 2.492 1.00 0.45 C ATOM 2166 O PHE A 132 -1.328 -2.942 1.901 1.00 0.70 O ATOM 2167 CB PHE A 132 1.547 -3.864 3.285 1.00 0.91 C ATOM 2168 CG PHE A 132 1.346 -4.891 2.189 1.00 1.41 C ATOM 2169 CD1 PHE A 132 1.385 -4.488 0.840 1.00 3.23 C ATOM 2170 CD2 PHE A 132 1.143 -6.245 2.513 1.00 2.32 C ATOM 2171 CE1 PHE A 132 1.206 -5.434 -0.182 1.00 4.72 C ATOM 2172 CE2 PHE A 132 0.988 -7.194 1.489 1.00 3.73 C ATOM 2173 CZ PHE A 132 1.027 -6.790 0.141 1.00 4.73 C ATOM 0 H PHE A 132 -1.182 -4.524 3.776 1.00 0.53 H new ATOM 0 HA PHE A 132 0.630 -2.258 4.345 1.00 0.50 H new ATOM 0 HB2 PHE A 132 2.318 -3.164 2.964 1.00 0.91 H new ATOM 0 HB3 PHE A 132 1.928 -4.374 4.170 1.00 0.91 H new ATOM 0 HD1 PHE A 132 1.553 -3.450 0.591 1.00 3.23 H new ATOM 0 HD2 PHE A 132 1.106 -6.554 3.547 1.00 2.32 H new ATOM 0 HE1 PHE A 132 1.206 -5.120 -1.215 1.00 4.72 H new ATOM 0 HE2 PHE A 132 0.839 -8.235 1.736 1.00 3.73 H new ATOM 0 HZ PHE A 132 0.919 -7.522 -0.645 1.00 4.73 H new ATOM 2183 N LEU A 133 0.089 -1.199 2.136 1.00 0.45 N ATOM 2184 CA LEU A 133 -0.371 -0.418 0.989 1.00 0.40 C ATOM 2185 C LEU A 133 0.775 -0.184 0.008 1.00 0.39 C ATOM 2186 O LEU A 133 1.952 -0.224 0.371 1.00 0.49 O ATOM 2187 CB LEU A 133 -1.064 0.885 1.455 1.00 0.48 C ATOM 2188 CG LEU A 133 -0.204 1.964 2.157 1.00 0.68 C ATOM 2189 CD1 LEU A 133 0.613 2.834 1.189 1.00 1.58 C ATOM 2190 CD2 LEU A 133 -1.131 2.908 2.939 1.00 1.32 C ATOM 0 H LEU A 133 0.836 -0.737 2.655 1.00 0.45 H new ATOM 0 HA LEU A 133 -1.128 -0.983 0.446 1.00 0.40 H new ATOM 0 HB2 LEU A 133 -1.527 1.345 0.582 1.00 0.48 H new ATOM 0 HB3 LEU A 133 -1.870 0.608 2.135 1.00 0.48 H new ATOM 0 HG LEU A 133 0.495 1.425 2.797 1.00 0.68 H new ATOM 0 HD11 LEU A 133 1.189 3.566 1.755 1.00 1.58 H new ATOM 0 HD12 LEU A 133 1.292 2.202 0.617 1.00 1.58 H new ATOM 0 HD13 LEU A 133 -0.062 3.352 0.508 1.00 1.58 H new ATOM 0 HD21 LEU A 133 -0.535 3.672 3.438 1.00 1.32 H new ATOM 0 HD22 LEU A 133 -1.830 3.384 2.251 1.00 1.32 H new ATOM 0 HD23 LEU A 133 -1.687 2.338 3.684 1.00 1.32 H new ATOM 2202 N SER A 134 0.427 0.084 -1.241 1.00 0.37 N ATOM 2203 CA SER A 134 1.377 0.464 -2.276 1.00 0.39 C ATOM 2204 C SER A 134 0.745 1.458 -3.259 1.00 0.42 C ATOM 2205 O SER A 134 -0.390 1.271 -3.711 1.00 0.45 O ATOM 2206 CB SER A 134 1.904 -0.787 -2.997 1.00 0.45 C ATOM 2207 OG SER A 134 3.059 -0.494 -3.760 1.00 1.62 O ATOM 0 H SER A 134 -0.538 0.043 -1.569 1.00 0.37 H new ATOM 0 HA SER A 134 2.224 0.965 -1.808 1.00 0.39 H new ATOM 0 HB2 SER A 134 2.136 -1.560 -2.265 1.00 0.45 H new ATOM 0 HB3 SER A 134 1.127 -1.188 -3.649 1.00 0.45 H new ATOM 0 HG SER A 134 3.857 -0.775 -3.266 1.00 1.62 H new ATOM 2213 N PHE A 135 1.478 2.523 -3.597 1.00 0.50 N ATOM 2214 CA PHE A 135 1.135 3.418 -4.697 1.00 0.59 C ATOM 2215 C PHE A 135 2.082 3.186 -5.873 1.00 0.60 C ATOM 2216 O PHE A 135 3.296 3.034 -5.713 1.00 0.53 O ATOM 2217 CB PHE A 135 1.152 4.893 -4.262 1.00 0.74 C ATOM 2218 CG PHE A 135 0.215 5.267 -3.126 1.00 0.68 C ATOM 2219 CD1 PHE A 135 -1.114 4.799 -3.103 1.00 1.79 C ATOM 2220 CD2 PHE A 135 0.666 6.133 -2.110 1.00 1.75 C ATOM 2221 CE1 PHE A 135 -1.980 5.178 -2.064 1.00 2.05 C ATOM 2222 CE2 PHE A 135 -0.200 6.505 -1.066 1.00 1.67 C ATOM 2223 CZ PHE A 135 -1.522 6.026 -1.045 1.00 1.08 C ATOM 0 H PHE A 135 2.333 2.787 -3.108 1.00 0.50 H new ATOM 0 HA PHE A 135 0.116 3.190 -5.011 1.00 0.59 H new ATOM 0 HB2 PHE A 135 2.169 5.152 -3.967 1.00 0.74 H new ATOM 0 HB3 PHE A 135 0.905 5.508 -5.127 1.00 0.74 H new ATOM 0 HD1 PHE A 135 -1.468 4.146 -3.887 1.00 1.79 H new ATOM 0 HD2 PHE A 135 1.677 6.511 -2.133 1.00 1.75 H new ATOM 0 HE1 PHE A 135 -2.998 4.817 -2.050 1.00 2.05 H new ATOM 0 HE2 PHE A 135 0.150 7.158 -0.281 1.00 1.67 H new ATOM 0 HZ PHE A 135 -2.186 6.312 -0.243 1.00 1.08 H new ATOM 2233 N SER A 136 1.501 3.198 -7.063 1.00 0.73 N ATOM 2234 CA SER A 136 2.185 3.239 -8.354 1.00 0.76 C ATOM 2235 C SER A 136 2.509 4.692 -8.754 1.00 1.04 C ATOM 2236 O SER A 136 2.095 5.631 -8.071 1.00 1.59 O ATOM 2237 CB SER A 136 1.226 2.618 -9.373 1.00 1.13 C ATOM 2238 OG SER A 136 1.873 2.350 -10.588 1.00 1.82 O ATOM 0 H SER A 136 0.486 3.178 -7.163 1.00 0.73 H new ATOM 0 HA SER A 136 3.129 2.696 -8.309 1.00 0.76 H new ATOM 0 HB2 SER A 136 0.811 1.695 -8.969 1.00 1.13 H new ATOM 0 HB3 SER A 136 0.389 3.294 -9.546 1.00 1.13 H new ATOM 0 HG SER A 136 1.393 2.793 -11.319 1.00 1.82 H new ATOM 2244 N ARG A 137 3.200 4.890 -9.883 1.00 0.82 N ATOM 2245 CA ARG A 137 3.238 6.152 -10.634 1.00 0.90 C ATOM 2246 C ARG A 137 3.784 5.948 -12.047 1.00 0.94 C ATOM 2247 O ARG A 137 4.805 5.292 -12.249 1.00 1.05 O ATOM 2248 CB ARG A 137 3.998 7.283 -9.913 1.00 0.96 C ATOM 2249 CG ARG A 137 5.495 6.981 -9.767 1.00 1.82 C ATOM 2250 CD ARG A 137 6.171 7.833 -8.685 1.00 2.28 C ATOM 2251 NE ARG A 137 7.278 7.080 -8.076 1.00 3.93 N ATOM 2252 CZ ARG A 137 7.127 6.017 -7.293 1.00 5.25 C ATOM 2253 NH1 ARG A 137 5.929 5.631 -6.894 1.00 5.44 N ATOM 2254 NH2 ARG A 137 8.183 5.328 -6.924 1.00 7.11 N ATOM 0 H ARG A 137 3.764 4.156 -10.312 1.00 0.82 H new ATOM 0 HA ARG A 137 2.200 6.478 -10.703 1.00 0.90 H new ATOM 0 HB2 ARG A 137 3.870 8.213 -10.466 1.00 0.96 H new ATOM 0 HB3 ARG A 137 3.563 7.437 -8.925 1.00 0.96 H new ATOM 0 HG2 ARG A 137 5.626 5.926 -9.527 1.00 1.82 H new ATOM 0 HG3 ARG A 137 5.991 7.155 -10.722 1.00 1.82 H new ATOM 0 HD2 ARG A 137 6.546 8.759 -9.120 1.00 2.28 H new ATOM 0 HD3 ARG A 137 5.444 8.110 -7.921 1.00 2.28 H new ATOM 0 HE ARG A 137 8.229 7.396 -8.268 1.00 3.93 H new ATOM 0 HH11 ARG A 137 5.102 6.151 -7.187 1.00 5.44 H new ATOM 0 HH12 ARG A 137 5.831 4.813 -6.293 1.00 5.44 H new ATOM 0 HH21 ARG A 137 9.111 5.610 -7.238 1.00 7.11 H new ATOM 0 HH22 ARG A 137 8.074 4.511 -6.323 1.00 7.11 H new ATOM 2268 N CYS A 138 3.148 6.598 -13.021 1.00 0.93 N ATOM 2269 CA CYS A 138 3.587 6.644 -14.420 1.00 1.01 C ATOM 2270 C CYS A 138 4.935 7.375 -14.601 1.00 1.02 C ATOM 2271 O CYS A 138 5.576 7.249 -15.644 1.00 1.08 O ATOM 2272 CB CYS A 138 2.451 7.273 -15.243 1.00 1.18 C ATOM 2273 SG CYS A 138 2.190 9.020 -14.802 1.00 2.94 S ATOM 0 H CYS A 138 2.289 7.123 -12.857 1.00 0.93 H new ATOM 0 HA CYS A 138 3.783 5.633 -14.778 1.00 1.01 H new ATOM 0 HB2 CYS A 138 2.685 7.196 -16.305 1.00 1.18 H new ATOM 0 HB3 CYS A 138 1.530 6.714 -15.079 1.00 1.18 H new ATOM 0 HG CYS A 138 1.663 9.094 -13.616 1.00 2.94 H new ATOM 2279 N SER A 139 5.403 8.105 -13.592 1.00 1.01 N ATOM 2280 CA SER A 139 6.771 8.613 -13.505 1.00 1.03 C ATOM 2281 C SER A 139 7.791 7.460 -13.479 1.00 0.79 C ATOM 2282 O SER A 139 7.892 6.721 -12.499 1.00 0.77 O ATOM 2283 CB SER A 139 6.961 9.514 -12.264 1.00 1.22 C ATOM 2284 OG SER A 139 5.759 9.752 -11.534 1.00 1.85 O ATOM 0 H SER A 139 4.828 8.367 -12.792 1.00 1.01 H new ATOM 0 HA SER A 139 6.947 9.215 -14.397 1.00 1.03 H new ATOM 0 HB2 SER A 139 7.692 9.052 -11.600 1.00 1.22 H new ATOM 0 HB3 SER A 139 7.377 10.470 -12.581 1.00 1.22 H new ATOM 0 HG SER A 139 5.952 10.326 -10.764 1.00 1.85 H new ATOM 2290 N ALA A 140 8.603 7.327 -14.533 1.00 0.77 N ATOM 2291 CA ALA A 140 9.669 6.321 -14.600 1.00 0.70 C ATOM 2292 C ALA A 140 10.959 6.756 -13.873 1.00 0.67 C ATOM 2293 O ALA A 140 11.976 6.061 -13.938 1.00 0.72 O ATOM 2294 CB ALA A 140 9.902 5.978 -16.079 1.00 0.76 C ATOM 0 H ALA A 140 8.540 7.914 -15.365 1.00 0.77 H new ATOM 0 HA ALA A 140 9.355 5.426 -14.063 1.00 0.70 H new ATOM 0 HB1 ALA A 140 10.691 5.231 -16.159 1.00 0.76 H new ATOM 0 HB2 ALA A 140 8.982 5.582 -16.510 1.00 0.76 H new ATOM 0 HB3 ALA A 140 10.198 6.877 -16.619 1.00 0.76 H new ATOM 2300 N ARG A 141 10.925 7.922 -13.213 1.00 0.73 N ATOM 2301 CA ARG A 141 12.087 8.579 -12.621 1.00 0.79 C ATOM 2302 C ARG A 141 12.527 7.994 -11.268 1.00 0.77 C ATOM 2303 O ARG A 141 11.784 7.275 -10.594 1.00 0.81 O ATOM 2304 CB ARG A 141 11.947 10.108 -12.622 1.00 1.27 C ATOM 2305 CG ARG A 141 10.628 10.751 -12.186 1.00 1.39 C ATOM 2306 CD ARG A 141 9.846 11.185 -13.434 1.00 1.86 C ATOM 2307 NE ARG A 141 8.866 12.236 -13.100 1.00 3.23 N ATOM 2308 CZ ARG A 141 7.916 12.731 -13.887 1.00 3.99 C ATOM 2309 NH1 ARG A 141 7.798 12.374 -15.149 1.00 3.96 N ATOM 2310 NH2 ARG A 141 7.051 13.590 -13.396 1.00 5.30 N ATOM 0 H ARG A 141 10.060 8.445 -13.075 1.00 0.73 H new ATOM 0 HA ARG A 141 12.924 8.348 -13.280 1.00 0.79 H new ATOM 0 HB2 ARG A 141 12.731 10.507 -11.979 1.00 1.27 H new ATOM 0 HB3 ARG A 141 12.158 10.453 -13.634 1.00 1.27 H new ATOM 0 HG2 ARG A 141 10.040 10.044 -11.601 1.00 1.39 H new ATOM 0 HG3 ARG A 141 10.822 11.611 -11.546 1.00 1.39 H new ATOM 0 HD2 ARG A 141 10.537 11.554 -14.192 1.00 1.86 H new ATOM 0 HD3 ARG A 141 9.332 10.325 -13.863 1.00 1.86 H new ATOM 0 HE ARG A 141 8.924 12.627 -12.160 1.00 3.23 H new ATOM 0 HH11 ARG A 141 8.448 11.698 -15.551 1.00 3.96 H new ATOM 0 HH12 ARG A 141 7.057 12.774 -15.725 1.00 3.96 H new ATOM 0 HH21 ARG A 141 7.112 13.872 -12.418 1.00 5.30 H new ATOM 0 HH22 ARG A 141 6.319 13.975 -13.993 1.00 5.30 H new ATOM 2324 N GLU A 142 13.772 8.301 -10.906 1.00 0.78 N ATOM 2325 CA GLU A 142 14.510 7.772 -9.754 1.00 0.77 C ATOM 2326 C GLU A 142 13.890 8.168 -8.398 1.00 0.69 C ATOM 2327 O GLU A 142 13.183 9.171 -8.275 1.00 0.65 O ATOM 2328 CB GLU A 142 15.968 8.265 -9.833 1.00 0.89 C ATOM 2329 CG GLU A 142 16.738 7.677 -11.028 1.00 1.84 C ATOM 2330 CD GLU A 142 17.843 8.632 -11.503 1.00 2.69 C ATOM 2331 OE1 GLU A 142 17.556 9.510 -12.353 1.00 3.79 O ATOM 2332 OE2 GLU A 142 19.002 8.512 -11.039 1.00 2.97 O ATOM 0 H GLU A 142 14.329 8.967 -11.441 1.00 0.78 H new ATOM 0 HA GLU A 142 14.462 6.684 -9.803 1.00 0.77 H new ATOM 0 HB2 GLU A 142 15.975 9.353 -9.903 1.00 0.89 H new ATOM 0 HB3 GLU A 142 16.485 8.002 -8.910 1.00 0.89 H new ATOM 0 HG2 GLU A 142 17.178 6.720 -10.745 1.00 1.84 H new ATOM 0 HG3 GLU A 142 16.047 7.480 -11.848 1.00 1.84 H new ATOM 2339 N ILE A 143 14.190 7.377 -7.363 1.00 0.76 N ATOM 2340 CA ILE A 143 13.701 7.533 -5.981 1.00 0.67 C ATOM 2341 C ILE A 143 14.900 7.739 -5.021 1.00 0.74 C ATOM 2342 O ILE A 143 15.770 6.861 -4.969 1.00 0.80 O ATOM 2343 CB ILE A 143 12.849 6.281 -5.630 1.00 0.67 C ATOM 2344 CG1 ILE A 143 11.404 6.429 -6.161 1.00 0.76 C ATOM 2345 CG2 ILE A 143 12.831 5.924 -4.137 1.00 1.13 C ATOM 2346 CD1 ILE A 143 10.479 7.264 -5.261 1.00 1.63 C ATOM 0 H ILE A 143 14.808 6.572 -7.466 1.00 0.76 H new ATOM 0 HA ILE A 143 13.069 8.415 -5.877 1.00 0.67 H new ATOM 0 HB ILE A 143 13.344 5.450 -6.132 1.00 0.67 H new ATOM 0 HG12 ILE A 143 11.438 6.886 -7.150 1.00 0.76 H new ATOM 0 HG13 ILE A 143 10.972 5.436 -6.284 1.00 0.76 H new ATOM 0 HG21 ILE A 143 12.214 5.039 -3.982 1.00 1.13 H new ATOM 0 HG22 ILE A 143 13.847 5.721 -3.799 1.00 1.13 H new ATOM 0 HG23 ILE A 143 12.419 6.758 -3.568 1.00 1.13 H new ATOM 0 HD11 ILE A 143 9.486 7.316 -5.708 1.00 1.63 H new ATOM 0 HD12 ILE A 143 10.410 6.798 -4.278 1.00 1.63 H new ATOM 0 HD13 ILE A 143 10.884 8.271 -5.157 1.00 1.63 H new ATOM 2358 N PRO A 144 14.967 8.864 -4.269 1.00 0.85 N ATOM 2359 CA PRO A 144 16.010 9.109 -3.269 1.00 0.95 C ATOM 2360 C PRO A 144 15.616 8.564 -1.884 1.00 1.01 C ATOM 2361 O PRO A 144 16.267 7.668 -1.355 1.00 1.79 O ATOM 2362 CB PRO A 144 16.204 10.631 -3.280 1.00 1.17 C ATOM 2363 CG PRO A 144 14.836 11.195 -3.675 1.00 1.13 C ATOM 2364 CD PRO A 144 14.205 10.086 -4.519 1.00 0.95 C ATOM 0 HA PRO A 144 16.939 8.589 -3.501 1.00 0.95 H new ATOM 0 HB2 PRO A 144 16.516 10.997 -2.302 1.00 1.17 H new ATOM 0 HB3 PRO A 144 16.975 10.927 -3.992 1.00 1.17 H new ATOM 0 HG2 PRO A 144 14.230 11.422 -2.798 1.00 1.13 H new ATOM 0 HG3 PRO A 144 14.935 12.120 -4.242 1.00 1.13 H new ATOM 0 HD2 PRO A 144 13.158 9.948 -4.251 1.00 0.95 H new ATOM 0 HD3 PRO A 144 14.231 10.346 -5.577 1.00 0.95 H new ATOM 2372 N ILE A 145 14.534 9.097 -1.306 1.00 0.90 N ATOM 2373 CA ILE A 145 13.981 8.778 0.027 1.00 0.90 C ATOM 2374 C ILE A 145 12.448 8.854 -0.062 1.00 0.82 C ATOM 2375 O ILE A 145 11.779 9.484 0.747 1.00 1.36 O ATOM 2376 CB ILE A 145 14.653 9.692 1.091 1.00 1.06 C ATOM 2377 CG1 ILE A 145 14.504 9.251 2.573 1.00 1.23 C ATOM 2378 CG2 ILE A 145 14.364 11.193 0.887 1.00 1.20 C ATOM 2379 CD1 ILE A 145 13.181 9.501 3.323 1.00 1.48 C ATOM 0 H ILE A 145 13.981 9.809 -1.783 1.00 0.90 H new ATOM 0 HA ILE A 145 14.208 7.764 0.355 1.00 0.90 H new ATOM 0 HB ILE A 145 15.713 9.541 0.887 1.00 1.06 H new ATOM 0 HG12 ILE A 145 14.702 8.180 2.614 1.00 1.23 H new ATOM 0 HG13 ILE A 145 15.295 9.743 3.139 1.00 1.23 H new ATOM 0 HG21 ILE A 145 14.864 11.769 1.665 1.00 1.20 H new ATOM 0 HG22 ILE A 145 14.734 11.505 -0.090 1.00 1.20 H new ATOM 0 HG23 ILE A 145 13.289 11.367 0.941 1.00 1.20 H new ATOM 0 HD11 ILE A 145 13.265 9.127 4.343 1.00 1.48 H new ATOM 0 HD12 ILE A 145 12.972 10.570 3.345 1.00 1.48 H new ATOM 0 HD13 ILE A 145 12.370 8.983 2.812 1.00 1.48 H new ATOM 2391 N LEU A 146 11.912 8.363 -1.188 1.00 0.94 N ATOM 2392 CA LEU A 146 10.511 8.462 -1.665 1.00 0.82 C ATOM 2393 C LEU A 146 10.206 9.873 -2.207 1.00 0.76 C ATOM 2394 O LEU A 146 9.528 10.019 -3.220 1.00 0.95 O ATOM 2395 CB LEU A 146 9.504 8.055 -0.559 1.00 0.93 C ATOM 2396 CG LEU A 146 9.747 6.634 0.001 1.00 1.65 C ATOM 2397 CD1 LEU A 146 9.460 6.506 1.494 1.00 2.74 C ATOM 2398 CD2 LEU A 146 8.882 5.640 -0.753 1.00 2.36 C ATOM 0 H LEU A 146 12.489 7.842 -1.849 1.00 0.94 H new ATOM 0 HA LEU A 146 10.394 7.757 -2.488 1.00 0.82 H new ATOM 0 HB2 LEU A 146 9.563 8.774 0.258 1.00 0.93 H new ATOM 0 HB3 LEU A 146 8.492 8.111 -0.961 1.00 0.93 H new ATOM 0 HG LEU A 146 10.808 6.425 -0.138 1.00 1.65 H new ATOM 0 HD11 LEU A 146 9.653 5.482 1.815 1.00 2.74 H new ATOM 0 HD12 LEU A 146 10.105 7.188 2.048 1.00 2.74 H new ATOM 0 HD13 LEU A 146 8.417 6.756 1.687 1.00 2.74 H new ATOM 0 HD21 LEU A 146 9.052 4.638 -0.360 1.00 2.36 H new ATOM 0 HD22 LEU A 146 7.832 5.905 -0.630 1.00 2.36 H new ATOM 0 HD23 LEU A 146 9.140 5.663 -1.812 1.00 2.36 H new ATOM 2410 N SER A 147 10.755 10.868 -1.516 1.00 0.69 N ATOM 2411 CA SER A 147 10.488 12.315 -1.452 1.00 0.71 C ATOM 2412 C SER A 147 9.963 12.559 -0.033 1.00 0.69 C ATOM 2413 O SER A 147 9.067 11.842 0.412 1.00 0.69 O ATOM 2414 CB SER A 147 9.492 12.862 -2.489 1.00 0.73 C ATOM 2415 OG SER A 147 10.014 12.771 -3.805 1.00 1.34 O ATOM 0 H SER A 147 11.524 10.645 -0.883 1.00 0.69 H new ATOM 0 HA SER A 147 11.409 12.848 -1.689 1.00 0.71 H new ATOM 0 HB2 SER A 147 8.557 12.305 -2.427 1.00 0.73 H new ATOM 0 HB3 SER A 147 9.259 13.902 -2.259 1.00 0.73 H new ATOM 0 HG SER A 147 10.042 11.831 -4.082 1.00 1.34 H new ATOM 2421 N ASP A 148 10.501 13.525 0.716 1.00 0.70 N ATOM 2422 CA ASP A 148 10.201 13.654 2.152 1.00 0.70 C ATOM 2423 C ASP A 148 8.714 13.935 2.445 1.00 0.69 C ATOM 2424 O ASP A 148 8.187 13.466 3.451 1.00 0.70 O ATOM 2425 CB ASP A 148 11.119 14.705 2.794 1.00 0.80 C ATOM 2426 CG ASP A 148 10.770 16.154 2.410 1.00 1.99 C ATOM 2427 OD1 ASP A 148 10.922 16.516 1.219 1.00 3.24 O ATOM 2428 OD2 ASP A 148 10.364 16.931 3.307 1.00 2.80 O ATOM 0 H ASP A 148 11.145 14.229 0.357 1.00 0.70 H new ATOM 0 HA ASP A 148 10.404 12.685 2.609 1.00 0.70 H new ATOM 0 HB2 ASP A 148 11.068 14.604 3.878 1.00 0.80 H new ATOM 0 HB3 ASP A 148 12.149 14.500 2.503 1.00 0.80 H new ATOM 2433 N GLU A 149 8.020 14.614 1.525 1.00 0.75 N ATOM 2434 CA GLU A 149 6.563 14.768 1.565 1.00 0.86 C ATOM 2435 C GLU A 149 5.856 13.423 1.388 1.00 0.82 C ATOM 2436 O GLU A 149 4.950 13.112 2.159 1.00 0.89 O ATOM 2437 CB GLU A 149 6.071 15.730 0.470 1.00 1.20 C ATOM 2438 CG GLU A 149 6.036 17.194 0.926 1.00 1.51 C ATOM 2439 CD GLU A 149 5.072 18.002 0.046 1.00 2.44 C ATOM 2440 OE1 GLU A 149 3.841 17.819 0.204 1.00 2.56 O ATOM 2441 OE2 GLU A 149 5.533 18.810 -0.795 1.00 3.95 O ATOM 0 H GLU A 149 8.457 15.075 0.727 1.00 0.75 H new ATOM 0 HA GLU A 149 6.320 15.179 2.545 1.00 0.86 H new ATOM 0 HB2 GLU A 149 6.721 15.642 -0.401 1.00 1.20 H new ATOM 0 HB3 GLU A 149 5.072 15.430 0.154 1.00 1.20 H new ATOM 0 HG2 GLU A 149 5.722 17.250 1.968 1.00 1.51 H new ATOM 0 HG3 GLU A 149 7.036 17.623 0.871 1.00 1.51 H new ATOM 2448 N LEU A 150 6.261 12.613 0.402 1.00 0.78 N ATOM 2449 CA LEU A 150 5.657 11.306 0.159 1.00 0.74 C ATOM 2450 C LEU A 150 5.975 10.337 1.296 1.00 0.60 C ATOM 2451 O LEU A 150 5.084 9.596 1.683 1.00 0.57 O ATOM 2452 CB LEU A 150 6.070 10.764 -1.228 1.00 0.85 C ATOM 2453 CG LEU A 150 5.502 9.367 -1.581 1.00 1.15 C ATOM 2454 CD1 LEU A 150 3.969 9.287 -1.527 1.00 1.60 C ATOM 2455 CD2 LEU A 150 5.955 8.961 -2.991 1.00 1.94 C ATOM 0 H LEU A 150 7.014 12.848 -0.245 1.00 0.78 H new ATOM 0 HA LEU A 150 4.573 11.416 0.143 1.00 0.74 H new ATOM 0 HB2 LEU A 150 5.747 11.474 -1.990 1.00 0.85 H new ATOM 0 HB3 LEU A 150 7.158 10.720 -1.275 1.00 0.85 H new ATOM 0 HG LEU A 150 5.892 8.689 -0.822 1.00 1.15 H new ATOM 0 HD11 LEU A 150 3.648 8.278 -1.786 1.00 1.60 H new ATOM 0 HD12 LEU A 150 3.627 9.529 -0.521 1.00 1.60 H new ATOM 0 HD13 LEU A 150 3.542 9.997 -2.236 1.00 1.60 H new ATOM 0 HD21 LEU A 150 5.552 7.978 -3.233 1.00 1.94 H new ATOM 0 HD22 LEU A 150 5.591 9.691 -3.714 1.00 1.94 H new ATOM 0 HD23 LEU A 150 7.044 8.926 -3.027 1.00 1.94 H new ATOM 2467 N GLN A 151 7.184 10.325 1.863 1.00 0.56 N ATOM 2468 CA GLN A 151 7.504 9.421 2.977 1.00 0.53 C ATOM 2469 C GLN A 151 6.654 9.710 4.220 1.00 0.49 C ATOM 2470 O GLN A 151 6.082 8.792 4.813 1.00 0.53 O ATOM 2471 CB GLN A 151 9.024 9.342 3.230 1.00 0.70 C ATOM 2472 CG GLN A 151 9.654 10.200 4.342 1.00 0.74 C ATOM 2473 CD GLN A 151 9.603 9.573 5.746 1.00 1.36 C ATOM 2474 OE1 GLN A 151 8.993 8.544 6.006 1.00 1.90 O ATOM 2475 NE2 GLN A 151 10.279 10.150 6.718 1.00 2.09 N ATOM 0 H GLN A 151 7.955 10.926 1.573 1.00 0.56 H new ATOM 0 HA GLN A 151 7.218 8.410 2.686 1.00 0.53 H new ATOM 0 HB2 GLN A 151 9.265 8.301 3.445 1.00 0.70 H new ATOM 0 HB3 GLN A 151 9.524 9.599 2.296 1.00 0.70 H new ATOM 0 HG2 GLN A 151 10.695 10.397 4.085 1.00 0.74 H new ATOM 0 HG3 GLN A 151 9.145 11.164 4.371 1.00 0.74 H new ATOM 0 HE21 GLN A 151 10.799 11.009 6.538 1.00 2.09 H new ATOM 0 HE22 GLN A 151 10.283 9.738 7.651 1.00 2.09 H new ATOM 2484 N LEU A 152 6.508 10.989 4.579 1.00 0.50 N ATOM 2485 CA LEU A 152 5.735 11.397 5.750 1.00 0.57 C ATOM 2486 C LEU A 152 4.232 11.205 5.505 1.00 0.56 C ATOM 2487 O LEU A 152 3.544 10.660 6.369 1.00 0.62 O ATOM 2488 CB LEU A 152 6.119 12.840 6.129 1.00 0.65 C ATOM 2489 CG LEU A 152 7.577 12.989 6.634 1.00 0.69 C ATOM 2490 CD1 LEU A 152 7.917 14.479 6.784 1.00 0.81 C ATOM 2491 CD2 LEU A 152 7.800 12.284 7.982 1.00 0.78 C ATOM 0 H LEU A 152 6.922 11.767 4.066 1.00 0.50 H new ATOM 0 HA LEU A 152 5.975 10.762 6.603 1.00 0.57 H new ATOM 0 HB2 LEU A 152 5.978 13.483 5.260 1.00 0.65 H new ATOM 0 HB3 LEU A 152 5.439 13.196 6.903 1.00 0.65 H new ATOM 0 HG LEU A 152 8.228 12.517 5.898 1.00 0.69 H new ATOM 0 HD11 LEU A 152 8.942 14.584 7.139 1.00 0.81 H new ATOM 0 HD12 LEU A 152 7.815 14.975 5.819 1.00 0.81 H new ATOM 0 HD13 LEU A 152 7.236 14.937 7.501 1.00 0.81 H new ATOM 0 HD21 LEU A 152 8.836 12.416 8.295 1.00 0.78 H new ATOM 0 HD22 LEU A 152 7.137 12.715 8.732 1.00 0.78 H new ATOM 0 HD23 LEU A 152 7.586 11.220 7.876 1.00 0.78 H new ATOM 2503 N LYS A 153 3.720 11.559 4.319 1.00 0.53 N ATOM 2504 CA LYS A 153 2.344 11.227 3.922 1.00 0.54 C ATOM 2505 C LYS A 153 2.093 9.708 3.848 1.00 0.45 C ATOM 2506 O LYS A 153 1.033 9.257 4.265 1.00 0.48 O ATOM 2507 CB LYS A 153 1.955 11.951 2.619 1.00 0.66 C ATOM 2508 CG LYS A 153 1.743 13.461 2.846 1.00 1.71 C ATOM 2509 CD LYS A 153 1.322 14.178 1.551 1.00 1.89 C ATOM 2510 CE LYS A 153 0.943 15.649 1.795 1.00 2.40 C ATOM 2511 NZ LYS A 153 2.115 16.532 2.029 1.00 3.03 N ATOM 0 H LYS A 153 4.242 12.079 3.613 1.00 0.53 H new ATOM 0 HA LYS A 153 1.686 11.593 4.710 1.00 0.54 H new ATOM 0 HB2 LYS A 153 2.735 11.801 1.873 1.00 0.66 H new ATOM 0 HB3 LYS A 153 1.042 11.512 2.218 1.00 0.66 H new ATOM 0 HG2 LYS A 153 0.979 13.610 3.609 1.00 1.71 H new ATOM 0 HG3 LYS A 153 2.664 13.905 3.225 1.00 1.71 H new ATOM 0 HD2 LYS A 153 2.138 14.130 0.830 1.00 1.89 H new ATOM 0 HD3 LYS A 153 0.474 13.655 1.108 1.00 1.89 H new ATOM 0 HE2 LYS A 153 0.385 16.020 0.935 1.00 2.40 H new ATOM 0 HE3 LYS A 153 0.277 15.706 2.656 1.00 2.40 H new ATOM 0 HZ1 LYS A 153 1.820 17.361 2.583 1.00 3.03 H new ATOM 0 HZ2 LYS A 153 2.846 16.008 2.552 1.00 3.03 H new ATOM 0 HZ3 LYS A 153 2.501 16.846 1.116 1.00 3.03 H new ATOM 2525 N MET A 154 3.052 8.889 3.402 1.00 0.39 N ATOM 2526 CA MET A 154 2.951 7.419 3.428 1.00 0.38 C ATOM 2527 C MET A 154 2.892 6.876 4.855 1.00 0.41 C ATOM 2528 O MET A 154 2.068 6.004 5.126 1.00 0.43 O ATOM 2529 CB MET A 154 4.118 6.772 2.662 1.00 0.47 C ATOM 2530 CG MET A 154 3.940 6.847 1.141 1.00 1.25 C ATOM 2531 SD MET A 154 2.900 5.561 0.408 1.00 2.02 S ATOM 2532 CE MET A 154 4.043 4.160 0.469 1.00 0.85 C ATOM 0 H MET A 154 3.930 9.228 3.008 1.00 0.39 H new ATOM 0 HA MET A 154 2.017 7.156 2.932 1.00 0.38 H new ATOM 0 HB2 MET A 154 5.049 7.267 2.940 1.00 0.47 H new ATOM 0 HB3 MET A 154 4.210 5.728 2.962 1.00 0.47 H new ATOM 0 HG2 MET A 154 3.514 7.819 0.891 1.00 1.25 H new ATOM 0 HG3 MET A 154 4.925 6.801 0.676 1.00 1.25 H new ATOM 0 HE1 MET A 154 3.578 3.291 0.004 1.00 0.85 H new ATOM 0 HE2 MET A 154 4.957 4.413 -0.068 1.00 0.85 H new ATOM 0 HE3 MET A 154 4.283 3.931 1.507 1.00 0.85 H new ATOM 2542 N GLN A 155 3.708 7.395 5.779 1.00 0.49 N ATOM 2543 CA GLN A 155 3.667 6.980 7.185 1.00 0.62 C ATOM 2544 C GLN A 155 2.323 7.346 7.832 1.00 0.63 C ATOM 2545 O GLN A 155 1.731 6.512 8.514 1.00 0.71 O ATOM 2546 CB GLN A 155 4.849 7.588 7.966 1.00 0.79 C ATOM 2547 CG GLN A 155 4.994 6.938 9.356 1.00 1.38 C ATOM 2548 CD GLN A 155 5.975 7.684 10.263 1.00 1.78 C ATOM 2549 OE1 GLN A 155 5.715 8.787 10.730 1.00 2.41 O ATOM 2550 NE2 GLN A 155 7.129 7.122 10.566 1.00 2.55 N ATOM 0 H GLN A 155 4.409 8.108 5.576 1.00 0.49 H new ATOM 0 HA GLN A 155 3.762 5.895 7.222 1.00 0.62 H new ATOM 0 HB2 GLN A 155 5.771 7.451 7.400 1.00 0.79 H new ATOM 0 HB3 GLN A 155 4.700 8.662 8.078 1.00 0.79 H new ATOM 0 HG2 GLN A 155 4.017 6.902 9.838 1.00 1.38 H new ATOM 0 HG3 GLN A 155 5.329 5.908 9.237 1.00 1.38 H new ATOM 0 HE21 GLN A 155 7.364 6.204 10.188 1.00 2.55 H new ATOM 0 HE22 GLN A 155 7.786 7.605 11.179 1.00 2.55 H new ATOM 2559 N LEU A 156 1.809 8.552 7.564 1.00 0.61 N ATOM 2560 CA LEU A 156 0.473 8.999 7.975 1.00 0.69 C ATOM 2561 C LEU A 156 -0.590 8.027 7.441 1.00 0.58 C ATOM 2562 O LEU A 156 -1.321 7.387 8.203 1.00 0.59 O ATOM 2563 CB LEU A 156 0.306 10.449 7.448 1.00 0.81 C ATOM 2564 CG LEU A 156 -1.054 11.133 7.693 1.00 0.97 C ATOM 2565 CD1 LEU A 156 -1.156 11.696 9.113 1.00 2.12 C ATOM 2566 CD2 LEU A 156 -1.259 12.306 6.720 1.00 3.23 C ATOM 0 H LEU A 156 2.323 9.262 7.042 1.00 0.61 H new ATOM 0 HA LEU A 156 0.349 9.002 9.058 1.00 0.69 H new ATOM 0 HB2 LEU A 156 1.081 11.066 7.903 1.00 0.81 H new ATOM 0 HB3 LEU A 156 0.493 10.442 6.374 1.00 0.81 H new ATOM 0 HG LEU A 156 -1.815 10.367 7.541 1.00 0.97 H new ATOM 0 HD11 LEU A 156 -2.128 12.170 9.247 1.00 2.12 H new ATOM 0 HD12 LEU A 156 -1.044 10.886 9.834 1.00 2.12 H new ATOM 0 HD13 LEU A 156 -0.368 12.433 9.270 1.00 2.12 H new ATOM 0 HD21 LEU A 156 -2.225 12.773 6.912 1.00 3.23 H new ATOM 0 HD22 LEU A 156 -0.466 13.040 6.863 1.00 3.23 H new ATOM 0 HD23 LEU A 156 -1.231 11.937 5.695 1.00 3.23 H new ATOM 2578 N LEU A 157 -0.612 7.845 6.119 1.00 0.48 N ATOM 2579 CA LEU A 157 -1.607 7.034 5.428 1.00 0.45 C ATOM 2580 C LEU A 157 -1.559 5.586 5.910 1.00 0.46 C ATOM 2581 O LEU A 157 -2.597 5.058 6.296 1.00 0.49 O ATOM 2582 CB LEU A 157 -1.398 7.136 3.902 1.00 0.44 C ATOM 2583 CG LEU A 157 -1.804 8.456 3.186 1.00 0.75 C ATOM 2584 CD1 LEU A 157 -2.955 8.190 2.217 1.00 1.90 C ATOM 2585 CD2 LEU A 157 -2.239 9.633 4.074 1.00 2.22 C ATOM 0 H LEU A 157 0.074 8.265 5.492 1.00 0.48 H new ATOM 0 HA LEU A 157 -2.601 7.416 5.661 1.00 0.45 H new ATOM 0 HB2 LEU A 157 -0.342 6.960 3.699 1.00 0.44 H new ATOM 0 HB3 LEU A 157 -1.952 6.321 3.436 1.00 0.44 H new ATOM 0 HG LEU A 157 -0.876 8.763 2.703 1.00 0.75 H new ATOM 0 HD11 LEU A 157 -3.234 9.119 1.719 1.00 1.90 H new ATOM 0 HD12 LEU A 157 -2.642 7.459 1.472 1.00 1.90 H new ATOM 0 HD13 LEU A 157 -3.812 7.802 2.768 1.00 1.90 H new ATOM 0 HD21 LEU A 157 -2.494 10.487 3.447 1.00 2.22 H new ATOM 0 HD22 LEU A 157 -3.109 9.343 4.663 1.00 2.22 H new ATOM 0 HD23 LEU A 157 -1.423 9.905 4.743 1.00 2.22 H new ATOM 2597 N VAL A 158 -0.381 4.960 5.947 1.00 0.46 N ATOM 2598 CA VAL A 158 -0.246 3.568 6.402 1.00 0.48 C ATOM 2599 C VAL A 158 -0.652 3.400 7.861 1.00 0.50 C ATOM 2600 O VAL A 158 -1.351 2.439 8.170 1.00 0.53 O ATOM 2601 CB VAL A 158 1.125 2.915 6.099 1.00 0.52 C ATOM 2602 CG1 VAL A 158 2.230 3.247 7.113 1.00 0.53 C ATOM 2603 CG2 VAL A 158 0.968 1.385 6.034 1.00 0.56 C ATOM 0 H VAL A 158 0.498 5.394 5.667 1.00 0.46 H new ATOM 0 HA VAL A 158 -0.956 3.009 5.792 1.00 0.48 H new ATOM 0 HB VAL A 158 1.440 3.333 5.143 1.00 0.52 H new ATOM 0 HG11 VAL A 158 3.154 2.747 6.821 1.00 0.53 H new ATOM 0 HG12 VAL A 158 2.392 4.325 7.135 1.00 0.53 H new ATOM 0 HG13 VAL A 158 1.930 2.905 8.103 1.00 0.53 H new ATOM 0 HG21 VAL A 158 1.935 0.929 5.821 1.00 0.56 H new ATOM 0 HG22 VAL A 158 0.596 1.016 6.990 1.00 0.56 H new ATOM 0 HG23 VAL A 158 0.262 1.125 5.245 1.00 0.56 H new ATOM 2613 N ARG A 159 -0.262 4.325 8.752 1.00 0.52 N ATOM 2614 CA ARG A 159 -0.587 4.198 10.171 1.00 0.56 C ATOM 2615 C ARG A 159 -2.093 4.212 10.374 1.00 0.55 C ATOM 2616 O ARG A 159 -2.650 3.311 11.009 1.00 0.63 O ATOM 2617 CB ARG A 159 0.079 5.338 10.967 1.00 0.62 C ATOM 2618 CG ARG A 159 -0.281 5.312 12.463 1.00 0.88 C ATOM 2619 CD ARG A 159 0.244 6.547 13.214 1.00 1.58 C ATOM 2620 NE ARG A 159 0.823 6.186 14.521 1.00 1.94 N ATOM 2621 CZ ARG A 159 0.176 5.732 15.589 1.00 2.45 C ATOM 2622 NH1 ARG A 159 -1.133 5.582 15.607 1.00 2.87 N ATOM 2623 NH2 ARG A 159 0.853 5.411 16.670 1.00 3.36 N ATOM 0 H ARG A 159 0.274 5.160 8.513 1.00 0.52 H new ATOM 0 HA ARG A 159 -0.203 3.246 10.537 1.00 0.56 H new ATOM 0 HB2 ARG A 159 1.161 5.267 10.857 1.00 0.62 H new ATOM 0 HB3 ARG A 159 -0.222 6.296 10.542 1.00 0.62 H new ATOM 0 HG2 ARG A 159 -1.364 5.257 12.572 1.00 0.88 H new ATOM 0 HG3 ARG A 159 0.131 4.411 12.918 1.00 0.88 H new ATOM 0 HD2 ARG A 159 0.999 7.048 12.608 1.00 1.58 H new ATOM 0 HD3 ARG A 159 -0.570 7.257 13.360 1.00 1.58 H new ATOM 0 HE ARG A 159 1.832 6.297 14.616 1.00 1.94 H new ATOM 0 HH11 ARG A 159 -1.685 5.817 14.782 1.00 2.87 H new ATOM 0 HH12 ARG A 159 -1.595 5.230 16.446 1.00 2.87 H new ATOM 0 HH21 ARG A 159 1.868 5.511 16.685 1.00 3.36 H new ATOM 0 HH22 ARG A 159 0.363 5.062 17.494 1.00 3.36 H new ATOM 2637 N GLU A 160 -2.747 5.231 9.828 1.00 0.54 N ATOM 2638 CA GLU A 160 -4.153 5.448 10.132 1.00 0.61 C ATOM 2639 C GLU A 160 -5.086 4.598 9.271 1.00 0.62 C ATOM 2640 O GLU A 160 -6.124 4.165 9.765 1.00 0.68 O ATOM 2641 CB GLU A 160 -4.496 6.923 10.086 1.00 0.86 C ATOM 2642 CG GLU A 160 -3.823 7.723 11.212 1.00 1.55 C ATOM 2643 CD GLU A 160 -2.716 8.641 10.696 1.00 2.20 C ATOM 2644 OE1 GLU A 160 -3.009 9.428 9.770 1.00 3.05 O ATOM 2645 OE2 GLU A 160 -1.598 8.604 11.263 1.00 3.36 O ATOM 0 H GLU A 160 -2.335 5.907 9.185 1.00 0.54 H new ATOM 0 HA GLU A 160 -4.318 5.107 11.154 1.00 0.61 H new ATOM 0 HB2 GLU A 160 -4.192 7.333 9.123 1.00 0.86 H new ATOM 0 HB3 GLU A 160 -5.577 7.043 10.157 1.00 0.86 H new ATOM 0 HG2 GLU A 160 -4.575 8.320 11.728 1.00 1.55 H new ATOM 0 HG3 GLU A 160 -3.406 7.032 11.945 1.00 1.55 H new ATOM 2652 N SER A 161 -4.708 4.276 8.031 1.00 0.61 N ATOM 2653 CA SER A 161 -5.441 3.284 7.240 1.00 0.64 C ATOM 2654 C SER A 161 -5.405 1.920 7.928 1.00 0.64 C ATOM 2655 O SER A 161 -6.458 1.309 8.121 1.00 0.70 O ATOM 2656 CB SER A 161 -4.864 3.155 5.825 1.00 0.65 C ATOM 2657 OG SER A 161 -5.573 2.165 5.096 1.00 1.07 O ATOM 0 H SER A 161 -3.904 4.685 7.555 1.00 0.61 H new ATOM 0 HA SER A 161 -6.473 3.628 7.163 1.00 0.64 H new ATOM 0 HB2 SER A 161 -4.929 4.113 5.309 1.00 0.65 H new ATOM 0 HB3 SER A 161 -3.808 2.892 5.878 1.00 0.65 H new ATOM 0 HG SER A 161 -4.974 1.749 4.441 1.00 1.07 H new ATOM 2663 N LEU A 162 -4.221 1.461 8.365 1.00 0.63 N ATOM 2664 CA LEU A 162 -4.090 0.158 9.005 1.00 0.67 C ATOM 2665 C LEU A 162 -4.944 0.102 10.270 1.00 0.69 C ATOM 2666 O LEU A 162 -5.755 -0.811 10.399 1.00 0.75 O ATOM 2667 CB LEU A 162 -2.598 -0.155 9.241 1.00 0.74 C ATOM 2668 CG LEU A 162 -2.250 -1.547 9.810 1.00 1.25 C ATOM 2669 CD1 LEU A 162 -2.453 -1.651 11.326 1.00 2.73 C ATOM 2670 CD2 LEU A 162 -3.002 -2.680 9.101 1.00 2.58 C ATOM 0 H LEU A 162 -3.346 1.979 8.283 1.00 0.63 H new ATOM 0 HA LEU A 162 -4.472 -0.628 8.354 1.00 0.67 H new ATOM 0 HB2 LEU A 162 -2.074 -0.037 8.292 1.00 0.74 H new ATOM 0 HB3 LEU A 162 -2.199 0.597 9.921 1.00 0.74 H new ATOM 0 HG LEU A 162 -1.185 -1.667 9.612 1.00 1.25 H new ATOM 0 HD11 LEU A 162 -2.190 -2.655 11.660 1.00 2.73 H new ATOM 0 HD12 LEU A 162 -1.817 -0.923 11.829 1.00 2.73 H new ATOM 0 HD13 LEU A 162 -3.497 -1.450 11.568 1.00 2.73 H new ATOM 0 HD21 LEU A 162 -2.719 -3.636 9.542 1.00 2.58 H new ATOM 0 HD22 LEU A 162 -4.076 -2.531 9.215 1.00 2.58 H new ATOM 0 HD23 LEU A 162 -2.746 -2.679 8.041 1.00 2.58 H new ATOM 2682 N MET A 163 -4.829 1.078 11.177 1.00 0.69 N ATOM 2683 CA MET A 163 -5.588 1.054 12.434 1.00 0.78 C ATOM 2684 C MET A 163 -7.102 1.178 12.213 1.00 0.79 C ATOM 2685 O MET A 163 -7.866 0.458 12.857 1.00 0.86 O ATOM 2686 CB MET A 163 -5.032 2.066 13.449 1.00 0.91 C ATOM 2687 CG MET A 163 -5.475 3.505 13.195 1.00 0.91 C ATOM 2688 SD MET A 163 -4.532 4.756 14.097 1.00 1.78 S ATOM 2689 CE MET A 163 -5.615 6.162 13.753 1.00 1.03 C ATOM 0 H MET A 163 -4.222 1.890 11.066 1.00 0.69 H new ATOM 0 HA MET A 163 -5.447 0.068 12.877 1.00 0.78 H new ATOM 0 HB2 MET A 163 -5.346 1.771 14.450 1.00 0.91 H new ATOM 0 HB3 MET A 163 -3.943 2.023 13.431 1.00 0.91 H new ATOM 0 HG2 MET A 163 -5.398 3.711 12.127 1.00 0.91 H new ATOM 0 HG3 MET A 163 -6.527 3.600 13.463 1.00 0.91 H new ATOM 0 HE1 MET A 163 -5.142 7.080 14.103 1.00 1.03 H new ATOM 0 HE2 MET A 163 -5.791 6.231 12.680 1.00 1.03 H new ATOM 0 HE3 MET A 163 -6.565 6.024 14.269 1.00 1.03 H new ATOM 2699 N ALA A 164 -7.551 2.047 11.299 1.00 0.75 N ATOM 2700 CA ALA A 164 -8.973 2.241 11.018 1.00 0.78 C ATOM 2701 C ALA A 164 -9.591 0.995 10.369 1.00 0.83 C ATOM 2702 O ALA A 164 -10.669 0.560 10.774 1.00 0.91 O ATOM 2703 CB ALA A 164 -9.155 3.491 10.141 1.00 0.74 C ATOM 0 H ALA A 164 -6.936 2.634 10.735 1.00 0.75 H new ATOM 0 HA ALA A 164 -9.503 2.395 11.958 1.00 0.78 H new ATOM 0 HB1 ALA A 164 -10.215 3.637 9.931 1.00 0.74 H new ATOM 0 HB2 ALA A 164 -8.766 4.363 10.666 1.00 0.74 H new ATOM 0 HB3 ALA A 164 -8.614 3.360 9.204 1.00 0.74 H new ATOM 2709 N LEU A 165 -8.882 0.383 9.415 1.00 0.81 N ATOM 2710 CA LEU A 165 -9.297 -0.847 8.737 1.00 0.86 C ATOM 2711 C LEU A 165 -9.278 -2.037 9.704 1.00 0.92 C ATOM 2712 O LEU A 165 -10.218 -2.829 9.714 1.00 0.99 O ATOM 2713 CB LEU A 165 -8.442 -1.025 7.467 1.00 0.76 C ATOM 2714 CG LEU A 165 -8.978 -2.097 6.496 1.00 0.99 C ATOM 2715 CD1 LEU A 165 -8.760 -1.659 5.037 1.00 1.83 C ATOM 2716 CD2 LEU A 165 -8.307 -3.453 6.736 1.00 3.13 C ATOM 0 H LEU A 165 -7.984 0.738 9.086 1.00 0.81 H new ATOM 0 HA LEU A 165 -10.334 -0.784 8.408 1.00 0.86 H new ATOM 0 HB2 LEU A 165 -8.385 -0.071 6.943 1.00 0.76 H new ATOM 0 HB3 LEU A 165 -7.426 -1.290 7.759 1.00 0.76 H new ATOM 0 HG LEU A 165 -10.046 -2.206 6.683 1.00 0.99 H new ATOM 0 HD11 LEU A 165 -9.144 -2.427 4.365 1.00 1.83 H new ATOM 0 HD12 LEU A 165 -9.287 -0.722 4.856 1.00 1.83 H new ATOM 0 HD13 LEU A 165 -7.695 -1.517 4.855 1.00 1.83 H new ATOM 0 HD21 LEU A 165 -8.707 -4.186 6.036 1.00 3.13 H new ATOM 0 HD22 LEU A 165 -7.231 -3.358 6.587 1.00 3.13 H new ATOM 0 HD23 LEU A 165 -8.504 -3.781 7.757 1.00 3.13 H new ATOM 2728 N MET A 166 -8.257 -2.135 10.564 1.00 0.91 N ATOM 2729 CA MET A 166 -8.192 -3.138 11.639 1.00 1.01 C ATOM 2730 C MET A 166 -9.402 -3.056 12.569 1.00 1.02 C ATOM 2731 O MET A 166 -10.048 -4.075 12.812 1.00 1.08 O ATOM 2732 CB MET A 166 -6.900 -2.973 12.457 1.00 1.04 C ATOM 2733 CG MET A 166 -5.706 -3.668 11.794 1.00 1.89 C ATOM 2734 SD MET A 166 -5.807 -5.475 11.683 1.00 2.49 S ATOM 2735 CE MET A 166 -5.808 -5.893 13.446 1.00 2.53 C ATOM 0 H MET A 166 -7.446 -1.517 10.535 1.00 0.91 H new ATOM 0 HA MET A 166 -8.197 -4.118 11.162 1.00 1.01 H new ATOM 0 HB2 MET A 166 -6.681 -1.912 12.577 1.00 1.04 H new ATOM 0 HB3 MET A 166 -7.049 -3.383 13.456 1.00 1.04 H new ATOM 0 HG2 MET A 166 -5.589 -3.267 10.787 1.00 1.89 H new ATOM 0 HG3 MET A 166 -4.804 -3.407 12.348 1.00 1.89 H new ATOM 0 HE1 MET A 166 -5.902 -6.973 13.564 1.00 2.53 H new ATOM 0 HE2 MET A 166 -4.875 -5.558 13.900 1.00 2.53 H new ATOM 0 HE3 MET A 166 -6.647 -5.400 13.936 1.00 2.53 H new ATOM 2745 N ARG A 167 -9.740 -1.860 13.070 1.00 1.03 N ATOM 2746 CA ARG A 167 -10.914 -1.665 13.936 1.00 1.11 C ATOM 2747 C ARG A 167 -12.259 -1.942 13.236 1.00 1.11 C ATOM 2748 O ARG A 167 -13.280 -2.173 13.887 1.00 1.17 O ATOM 2749 CB ARG A 167 -10.895 -0.268 14.587 1.00 1.25 C ATOM 2750 CG ARG A 167 -11.059 -0.359 16.113 1.00 1.55 C ATOM 2751 CD ARG A 167 -12.380 -1.008 16.551 1.00 2.08 C ATOM 2752 NE ARG A 167 -12.481 -1.196 18.008 1.00 2.62 N ATOM 2753 CZ ARG A 167 -13.205 -2.138 18.608 1.00 3.80 C ATOM 2754 NH1 ARG A 167 -13.859 -3.062 17.934 1.00 4.73 N ATOM 2755 NH2 ARG A 167 -13.280 -2.175 19.921 1.00 4.46 N ATOM 0 H ARG A 167 -9.213 -1.006 12.889 1.00 1.03 H new ATOM 0 HA ARG A 167 -10.835 -2.417 14.721 1.00 1.11 H new ATOM 0 HB2 ARG A 167 -9.957 0.233 14.349 1.00 1.25 H new ATOM 0 HB3 ARG A 167 -11.696 0.341 14.169 1.00 1.25 H new ATOM 0 HG2 ARG A 167 -10.228 -0.931 16.526 1.00 1.55 H new ATOM 0 HG3 ARG A 167 -10.998 0.643 16.537 1.00 1.55 H new ATOM 0 HD2 ARG A 167 -13.211 -0.389 16.213 1.00 2.08 H new ATOM 0 HD3 ARG A 167 -12.483 -1.975 16.059 1.00 2.08 H new ATOM 0 HE ARG A 167 -11.956 -0.555 18.603 1.00 2.62 H new ATOM 0 HH11 ARG A 167 -13.821 -3.072 16.915 1.00 4.73 H new ATOM 0 HH12 ARG A 167 -14.403 -3.767 18.431 1.00 4.73 H new ATOM 0 HH21 ARG A 167 -12.783 -1.481 20.480 1.00 4.46 H new ATOM 0 HH22 ARG A 167 -13.835 -2.897 20.380 1.00 4.46 H new ATOM 2769 N LEU A 168 -12.278 -1.904 11.907 1.00 1.06 N ATOM 2770 CA LEU A 168 -13.438 -2.279 11.096 1.00 1.11 C ATOM 2771 C LEU A 168 -13.543 -3.806 10.929 1.00 1.25 C ATOM 2772 O LEU A 168 -14.643 -4.355 11.002 1.00 1.54 O ATOM 2773 CB LEU A 168 -13.366 -1.524 9.754 1.00 1.10 C ATOM 2774 CG LEU A 168 -14.690 -0.913 9.271 1.00 1.13 C ATOM 2775 CD1 LEU A 168 -15.737 -1.976 8.912 1.00 2.96 C ATOM 2776 CD2 LEU A 168 -15.284 0.123 10.232 1.00 1.87 C ATOM 0 H LEU A 168 -11.476 -1.607 11.352 1.00 1.06 H new ATOM 0 HA LEU A 168 -14.357 -1.986 11.603 1.00 1.11 H new ATOM 0 HB2 LEU A 168 -12.629 -0.726 9.844 1.00 1.10 H new ATOM 0 HB3 LEU A 168 -13.002 -2.210 8.989 1.00 1.10 H new ATOM 0 HG LEU A 168 -14.422 -0.379 8.359 1.00 1.13 H new ATOM 0 HD11 LEU A 168 -16.652 -1.487 8.577 1.00 2.96 H new ATOM 0 HD12 LEU A 168 -15.352 -2.611 8.114 1.00 2.96 H new ATOM 0 HD13 LEU A 168 -15.952 -2.586 9.789 1.00 2.96 H new ATOM 0 HD21 LEU A 168 -16.217 0.508 9.821 1.00 1.87 H new ATOM 0 HD22 LEU A 168 -15.479 -0.345 11.197 1.00 1.87 H new ATOM 0 HD23 LEU A 168 -14.579 0.944 10.363 1.00 1.87 H new ATOM 2788 N ASN A 169 -12.416 -4.506 10.772 1.00 1.14 N ATOM 2789 CA ASN A 169 -12.392 -5.971 10.691 1.00 1.29 C ATOM 2790 C ASN A 169 -12.661 -6.650 12.049 1.00 1.24 C ATOM 2791 O ASN A 169 -13.386 -7.643 12.104 1.00 1.32 O ATOM 2792 CB ASN A 169 -11.005 -6.452 10.227 1.00 1.62 C ATOM 2793 CG ASN A 169 -10.583 -6.072 8.815 1.00 1.90 C ATOM 2794 OD1 ASN A 169 -11.345 -5.564 7.999 1.00 2.23 O ATOM 2795 ND2 ASN A 169 -9.337 -6.360 8.488 1.00 2.99 N ATOM 0 H ASN A 169 -11.495 -4.074 10.697 1.00 1.14 H new ATOM 0 HA ASN A 169 -13.179 -6.243 9.988 1.00 1.29 H new ATOM 0 HB2 ASN A 169 -10.261 -6.061 10.921 1.00 1.62 H new ATOM 0 HB3 ASN A 169 -10.978 -7.539 10.309 1.00 1.62 H new ATOM 0 HD21 ASN A 169 -8.997 -6.160 7.547 1.00 2.99 H new ATOM 0 HD22 ASN A 169 -8.714 -6.782 9.176 1.00 2.99 H new ATOM 2802 N ASP A 170 -11.983 -6.183 13.106 1.00 1.25 N ATOM 2803 CA ASP A 170 -11.676 -6.882 14.374 1.00 1.35 C ATOM 2804 C ASP A 170 -10.849 -8.186 14.206 1.00 1.88 C ATOM 2805 O ASP A 170 -10.305 -8.700 15.184 1.00 2.22 O ATOM 2806 CB ASP A 170 -12.935 -7.099 15.241 1.00 1.66 C ATOM 2807 CG ASP A 170 -13.422 -5.847 15.998 1.00 2.12 C ATOM 2808 OD1 ASP A 170 -12.948 -4.716 15.735 1.00 2.58 O ATOM 2809 OD2 ASP A 170 -14.287 -6.008 16.890 1.00 3.14 O ATOM 0 H ASP A 170 -11.604 -5.236 13.103 1.00 1.25 H new ATOM 0 HA ASP A 170 -11.019 -6.201 14.915 1.00 1.35 H new ATOM 0 HB2 ASP A 170 -13.742 -7.457 14.602 1.00 1.66 H new ATOM 0 HB3 ASP A 170 -12.729 -7.887 15.965 1.00 1.66 H new ATOM 2814 N GLU A 171 -10.709 -8.691 12.974 1.00 2.42 N ATOM 2815 CA GLU A 171 -9.832 -9.798 12.563 1.00 3.52 C ATOM 2816 C GLU A 171 -8.481 -9.296 12.025 1.00 4.20 C ATOM 2817 O GLU A 171 -8.467 -8.589 10.986 1.00 4.76 O ATOM 2818 CB GLU A 171 -10.533 -10.660 11.499 1.00 3.93 C ATOM 2819 CG GLU A 171 -11.795 -11.371 12.007 1.00 3.92 C ATOM 2820 CD GLU A 171 -12.416 -12.211 10.873 1.00 4.60 C ATOM 2821 OE1 GLU A 171 -11.963 -13.358 10.644 1.00 5.60 O ATOM 2822 OE2 GLU A 171 -13.322 -11.721 10.158 1.00 4.69 O ATOM 2823 OXT GLU A 171 -7.454 -9.642 12.647 1.00 4.90 O ATOM 0 H GLU A 171 -11.238 -8.315 12.187 1.00 2.42 H new ATOM 0 HA GLU A 171 -9.630 -10.401 13.448 1.00 3.52 H new ATOM 0 HB2 GLU A 171 -10.800 -10.028 10.652 1.00 3.93 H new ATOM 0 HB3 GLU A 171 -9.830 -11.407 11.130 1.00 3.93 H new ATOM 0 HG2 GLU A 171 -11.546 -12.013 12.852 1.00 3.92 H new ATOM 0 HG3 GLU A 171 -12.517 -10.637 12.365 1.00 3.92 H new TER 2830 GLU A 171 HETATM 2831 C8 HTF A 172 -4.064 -8.373 -7.796 1.00 0.94 C HETATM 2832 C7 HTF A 172 -4.019 -8.992 -6.394 1.00 1.45 C HETATM 2833 C6 HTF A 172 -3.716 -7.979 -5.272 1.00 1.36 C HETATM 2834 C5 HTF A 172 -2.483 -7.081 -5.467 1.00 1.21 C HETATM 2835 C4 HTF A 172 -1.195 -7.888 -5.693 1.00 2.02 C HETATM 2836 C3 HTF A 172 -0.014 -7.020 -6.129 1.00 2.34 C HETATM 2837 C2 HTF A 172 0.645 -6.240 -4.986 1.00 1.81 C HETATM 2838 C1 HTF A 172 1.481 -5.101 -5.550 1.00 1.79 C HETATM 2839 O1 HTF A 172 1.150 -3.939 -5.320 1.00 2.85 O HETATM 2840 N HTF A 172 2.515 -5.423 -6.326 1.00 1.41 N HETATM 2841 CA HTF A 172 3.229 -4.472 -7.187 1.00 1.50 C HETATM 2842 C HTF A 172 2.725 -4.347 -8.628 1.00 2.01 C HETATM 2843 O HTF A 172 1.540 -4.395 -8.959 1.00 3.13 O HETATM 2844 OD HTF A 172 3.745 -4.266 -9.465 1.00 2.15 O HETATM 2845 CG HTF A 172 4.984 -4.345 -8.785 1.00 2.24 C HETATM 2846 CB HTF A 172 4.671 -4.922 -7.399 1.00 2.30 C HETATM 0 HN HTF A 172 2.831 -6.393 -6.322 1.00 1.41 H new HETATM 0 HG3 HTF A 172 5.685 -4.983 -9.324 1.00 2.24 H new HETATM 0 HG2 HTF A 172 5.447 -3.362 -8.703 1.00 2.24 H new HETATM 0 HB3 HTF A 172 5.338 -4.528 -6.633 1.00 2.30 H new HETATM 0 HB2 HTF A 172 4.767 -6.008 -7.378 1.00 2.30 H new HETATM 0 HA HTF A 172 3.087 -3.534 -6.650 1.00 1.50 H new HETATM 0 H83 HTF A 172 -4.842 -7.610 -7.832 1.00 0.94 H new HETATM 0 H82 HTF A 172 -3.100 -7.919 -8.024 1.00 0.94 H new HETATM 0 H81 HTF A 172 -4.282 -9.149 -8.530 1.00 0.94 H new HETATM 0 H73 HTF A 172 -4.976 -9.471 -6.188 1.00 1.45 H new HETATM 0 H72 HTF A 172 -3.261 -9.775 -6.378 1.00 1.45 H new HETATM 0 H63 HTF A 172 -4.588 -7.337 -5.148 1.00 1.36 H new HETATM 0 H62 HTF A 172 -3.591 -8.531 -4.340 1.00 1.36 H new HETATM 0 H53 HTF A 172 -2.649 -6.422 -6.319 1.00 1.21 H new HETATM 0 H52 HTF A 172 -2.360 -6.444 -4.591 1.00 1.21 H new HETATM 0 H43 HTF A 172 -0.934 -8.411 -4.773 1.00 2.02 H new HETATM 0 H42 HTF A 172 -1.378 -8.649 -6.451 1.00 2.02 H new HETATM 0 H33 HTF A 172 0.736 -7.656 -6.600 1.00 2.34 H new HETATM 0 H32 HTF A 172 -0.356 -6.314 -6.886 1.00 2.34 H new HETATM 0 H23 HTF A 172 -0.119 -5.845 -4.316 1.00 1.81 H new HETATM 0 H22 HTF A 172 1.274 -6.906 -4.395 1.00 1.81 H new