USER MOD reduce.3.24.130724 H: found=0, std=0, add=1123, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1123 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 111 LYS NZ :NH3+ 155:sc= 0.89 (180deg=0) USER MOD Set 1.2: A 124 CYS SG : rot -33:sc= 0.734 USER MOD Set 2.1: A 41 GLN : amide:sc= 0.0427 K(o=0.56,f=2) USER MOD Set 2.2: A 42 THR OG1 : rot 180:sc= 0.52 USER MOD Set 3.1: A 30 THR OG1 : rot 174:sc= -5.82! USER MOD Set 3.2: A 63 ASN : amide:sc= -0.203 X(o=-6,f=-5.8) 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 8 GLN : amide:sc= -1.8 K(o=-1.8,f=-3.5!) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 ASN : amide:sc= -0.0237 K(o=-0.024,f=-1.6!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 102:sc= 1.58 USER MOD Single : A 25 CYS SG : rot 75:sc= -4.13! USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 TYR OH : rot 178:sc= 0.398 USER MOD Single : A 37 HIS : no HE2:sc= -15.5! C(o=-16!,f=-14!) USER MOD Single : A 45 GLN : amide:sc= -3.93! K(o=-3.9!,f=-1.7) USER MOD Single : A 46 ASN : amide:sc= -7.83! C(o=-7.8!,f=-9.7!) USER MOD Single : A 48 CYS SG : rot 68:sc= -2.86! USER MOD Single : A 53 SER OG : rot 120:sc= -0.127 USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= -0.0954 USER MOD Single : A 67 GLN : amide:sc= -0.332 K(o=-0.33,f=-2.4) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 74 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc=1.76e-06 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ -155:sc= 0.0949 (180deg=-0.0514) USER MOD Single : A 96 TYR OH : rot 180:sc= -0.781 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 MET CE :methyl -136:sc= 0 (180deg=-0.536) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 CYS SG : rot 130:sc= -1.47 USER MOD Single : A 117 HIS : no HD1:sc= -0.876 K(o=-0.88,f=-0.24) USER MOD Single : A 122 MET CE :methyl -143:sc= -1.69 (180deg=-2.67!) USER MOD Single : A 133 GLN : amide:sc= 0 X(o=0,f=-0.082) USER MOD Single : A 134 GLN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 140 GLN : amide:sc= -0.0597 K(o=-0.06,f=-3.2!) USER MOD Single : A 141 GLN : amide:sc= 0 X(o=0,f=-0.034) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.604 -2.136 -26.316 1.00 0.00 N ATOM 2 CA MET A 1 -1.262 -1.011 -25.602 1.00 0.00 C ATOM 3 C MET A 1 -0.679 -0.830 -24.202 1.00 0.00 C ATOM 4 O MET A 1 -1.167 -1.419 -23.238 1.00 0.00 O ATOM 5 CB MET A 1 -2.761 -1.299 -25.517 1.00 0.00 C ATOM 6 CG MET A 1 -3.492 -1.117 -26.838 1.00 0.00 C ATOM 7 SD MET A 1 -5.285 -1.150 -26.649 1.00 0.00 S ATOM 8 CE MET A 1 -5.808 -0.989 -28.354 1.00 0.00 C ATOM 0 H1 MET A 1 -1.020 -2.236 -27.264 1.00 0.00 H new ATOM 0 H2 MET A 1 0.414 -1.944 -26.403 1.00 0.00 H new ATOM 0 H3 MET A 1 -0.746 -3.017 -25.781 1.00 0.00 H new ATOM 0 HA MET A 1 -1.088 -0.086 -26.152 1.00 0.00 H new ATOM 0 HB2 MET A 1 -2.907 -2.321 -25.169 1.00 0.00 H new ATOM 0 HB3 MET A 1 -3.207 -0.641 -24.771 1.00 0.00 H new ATOM 0 HG2 MET A 1 -3.195 -0.169 -27.286 1.00 0.00 H new ATOM 0 HG3 MET A 1 -3.189 -1.904 -27.528 1.00 0.00 H new ATOM 0 HE1 MET A 1 -6.897 -0.993 -28.403 1.00 0.00 H new ATOM 0 HE2 MET A 1 -5.430 -0.052 -28.764 1.00 0.00 H new ATOM 0 HE3 MET A 1 -5.416 -1.823 -28.935 1.00 0.00 H new ATOM 20 N PRO A 2 0.376 -0.006 -24.071 1.00 0.00 N ATOM 21 CA PRO A 2 1.021 0.250 -22.779 1.00 0.00 C ATOM 22 C PRO A 2 0.110 1.006 -21.819 1.00 0.00 C ATOM 23 O PRO A 2 -0.901 1.576 -22.227 1.00 0.00 O ATOM 24 CB PRO A 2 2.236 1.108 -23.144 1.00 0.00 C ATOM 25 CG PRO A 2 1.884 1.735 -24.447 1.00 0.00 C ATOM 26 CD PRO A 2 1.020 0.739 -25.167 1.00 0.00 C ATOM 0 HA PRO A 2 1.278 -0.676 -22.265 1.00 0.00 H new ATOM 0 HB2 PRO A 2 2.430 1.863 -22.382 1.00 0.00 H new ATOM 0 HB3 PRO A 2 3.137 0.501 -23.228 1.00 0.00 H new ATOM 0 HG2 PRO A 2 1.353 2.675 -24.297 1.00 0.00 H new ATOM 0 HG3 PRO A 2 2.780 1.964 -25.024 1.00 0.00 H new ATOM 0 HD2 PRO A 2 0.286 1.231 -25.805 1.00 0.00 H new ATOM 0 HD3 PRO A 2 1.610 0.083 -25.807 1.00 0.00 H new ATOM 34 N ARG A 3 0.478 1.009 -20.541 1.00 0.00 N ATOM 35 CA ARG A 3 -0.306 1.699 -19.523 1.00 0.00 C ATOM 36 C ARG A 3 0.445 2.912 -18.978 1.00 0.00 C ATOM 37 O ARG A 3 -0.143 3.769 -18.319 1.00 0.00 O ATOM 38 CB ARG A 3 -0.667 0.744 -18.378 1.00 0.00 C ATOM 39 CG ARG A 3 0.333 -0.383 -18.170 1.00 0.00 C ATOM 40 CD ARG A 3 1.648 0.137 -17.615 1.00 0.00 C ATOM 41 NE ARG A 3 2.801 -0.485 -18.260 1.00 0.00 N ATOM 42 CZ ARG A 3 3.262 -1.695 -17.948 1.00 0.00 C ATOM 43 NH1 ARG A 3 2.671 -2.415 -17.003 1.00 0.00 N ATOM 44 NH2 ARG A 3 4.318 -2.185 -18.583 1.00 0.00 N ATOM 0 H ARG A 3 1.313 0.542 -20.187 1.00 0.00 H new ATOM 0 HA ARG A 3 -1.226 2.048 -19.992 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -0.750 1.317 -17.454 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -1.648 0.313 -18.575 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -0.086 -1.121 -17.486 1.00 0.00 H new ATOM 0 HG3 ARG A 3 0.512 -0.892 -19.117 1.00 0.00 H new ATOM 0 HD2 ARG A 3 1.696 1.217 -17.751 1.00 0.00 H new ATOM 0 HD3 ARG A 3 1.688 -0.051 -16.542 1.00 0.00 H new ATOM 0 HE ARG A 3 3.281 0.038 -18.992 1.00 0.00 H new ATOM 0 HH11 ARG A 3 1.859 -2.042 -16.511 1.00 0.00 H new ATOM 0 HH12 ARG A 3 3.029 -3.341 -16.769 1.00 0.00 H new ATOM 0 HH21 ARG A 3 4.777 -1.635 -19.310 1.00 0.00 H new ATOM 0 HH22 ARG A 3 4.672 -3.112 -18.345 1.00 0.00 H new ATOM 58 N VAL A 4 1.745 2.981 -19.254 1.00 0.00 N ATOM 59 CA VAL A 4 2.564 4.092 -18.785 1.00 0.00 C ATOM 60 C VAL A 4 2.432 5.306 -19.700 1.00 0.00 C ATOM 61 O VAL A 4 2.713 5.231 -20.896 1.00 0.00 O ATOM 62 CB VAL A 4 4.051 3.700 -18.680 1.00 0.00 C ATOM 63 CG1 VAL A 4 4.294 2.859 -17.437 1.00 0.00 C ATOM 64 CG2 VAL A 4 4.502 2.960 -19.931 1.00 0.00 C ATOM 0 H VAL A 4 2.251 2.282 -19.798 1.00 0.00 H new ATOM 0 HA VAL A 4 2.196 4.349 -17.792 1.00 0.00 H new ATOM 0 HB VAL A 4 4.642 4.612 -18.596 1.00 0.00 H new ATOM 0 HG11 VAL A 4 5.349 2.591 -17.379 1.00 0.00 H new ATOM 0 HG12 VAL A 4 4.015 3.430 -16.551 1.00 0.00 H new ATOM 0 HG13 VAL A 4 3.692 1.952 -17.488 1.00 0.00 H new ATOM 0 HG21 VAL A 4 5.554 2.693 -19.836 1.00 0.00 H new ATOM 0 HG22 VAL A 4 3.907 2.055 -20.053 1.00 0.00 H new ATOM 0 HG23 VAL A 4 4.368 3.602 -20.802 1.00 0.00 H new ATOM 74 N VAL A 5 2.004 6.421 -19.122 1.00 0.00 N ATOM 75 CA VAL A 5 1.830 7.663 -19.868 1.00 0.00 C ATOM 76 C VAL A 5 3.148 8.424 -19.982 1.00 0.00 C ATOM 77 O VAL A 5 4.008 8.316 -19.107 1.00 0.00 O ATOM 78 CB VAL A 5 0.782 8.574 -19.204 1.00 0.00 C ATOM 79 CG1 VAL A 5 -0.602 7.949 -19.291 1.00 0.00 C ATOM 80 CG2 VAL A 5 1.159 8.857 -17.757 1.00 0.00 C ATOM 0 H VAL A 5 1.769 6.492 -18.132 1.00 0.00 H new ATOM 0 HA VAL A 5 1.483 7.388 -20.864 1.00 0.00 H new ATOM 0 HB VAL A 5 0.760 9.522 -19.741 1.00 0.00 H new ATOM 0 HG11 VAL A 5 -1.329 8.608 -18.816 1.00 0.00 H new ATOM 0 HG12 VAL A 5 -0.871 7.805 -20.337 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -0.599 6.985 -18.782 1.00 0.00 H new ATOM 0 HG21 VAL A 5 0.406 9.503 -17.304 1.00 0.00 H new ATOM 0 HG22 VAL A 5 1.212 7.919 -17.205 1.00 0.00 H new ATOM 0 HG23 VAL A 5 2.129 9.353 -17.724 1.00 0.00 H new ATOM 90 N PRO A 6 3.325 9.205 -21.068 1.00 0.00 N ATOM 91 CA PRO A 6 4.532 9.990 -21.313 1.00 0.00 C ATOM 92 C PRO A 6 5.187 10.482 -20.025 1.00 0.00 C ATOM 93 O PRO A 6 6.396 10.346 -19.841 1.00 0.00 O ATOM 94 CB PRO A 6 4.018 11.173 -22.146 1.00 0.00 C ATOM 95 CG PRO A 6 2.631 10.807 -22.600 1.00 0.00 C ATOM 96 CD PRO A 6 2.361 9.393 -22.151 1.00 0.00 C ATOM 0 HA PRO A 6 5.305 9.403 -21.809 1.00 0.00 H new ATOM 0 HB2 PRO A 6 4.003 12.087 -21.553 1.00 0.00 H new ATOM 0 HB3 PRO A 6 4.669 11.358 -23.000 1.00 0.00 H new ATOM 0 HG2 PRO A 6 1.896 11.490 -22.174 1.00 0.00 H new ATOM 0 HG3 PRO A 6 2.550 10.886 -23.684 1.00 0.00 H new ATOM 0 HD2 PRO A 6 1.335 9.268 -21.805 1.00 0.00 H new ATOM 0 HD3 PRO A 6 2.515 8.676 -22.958 1.00 0.00 H new ATOM 104 N ASP A 7 4.377 11.037 -19.128 1.00 0.00 N ATOM 105 CA ASP A 7 4.869 11.526 -17.855 1.00 0.00 C ATOM 106 C ASP A 7 4.016 10.961 -16.728 1.00 0.00 C ATOM 107 O ASP A 7 3.038 11.569 -16.300 1.00 0.00 O ATOM 108 CB ASP A 7 4.860 13.053 -17.828 1.00 0.00 C ATOM 109 CG ASP A 7 5.819 13.656 -18.836 1.00 0.00 C ATOM 110 OD1 ASP A 7 7.013 13.290 -18.813 1.00 0.00 O ATOM 111 OD2 ASP A 7 5.375 14.492 -19.650 1.00 0.00 O ATOM 0 H ASP A 7 3.373 11.157 -19.265 1.00 0.00 H new ATOM 0 HA ASP A 7 5.898 11.195 -17.719 1.00 0.00 H new ATOM 0 HB2 ASP A 7 3.851 13.411 -18.032 1.00 0.00 H new ATOM 0 HB3 ASP A 7 5.125 13.397 -16.828 1.00 0.00 H new ATOM 116 N GLN A 8 4.396 9.784 -16.258 1.00 0.00 N ATOM 117 CA GLN A 8 3.676 9.116 -15.184 1.00 0.00 C ATOM 118 C GLN A 8 3.676 9.996 -13.947 1.00 0.00 C ATOM 119 O GLN A 8 2.650 10.177 -13.292 1.00 0.00 O ATOM 120 CB GLN A 8 4.315 7.761 -14.875 1.00 0.00 C ATOM 121 CG GLN A 8 4.218 6.768 -16.021 1.00 0.00 C ATOM 122 CD GLN A 8 5.222 5.639 -15.899 1.00 0.00 C ATOM 123 OE1 GLN A 8 5.913 5.300 -16.860 1.00 0.00 O ATOM 124 NE2 GLN A 8 5.307 5.048 -14.713 1.00 0.00 N ATOM 0 H GLN A 8 5.204 9.268 -16.606 1.00 0.00 H new ATOM 0 HA GLN A 8 2.647 8.944 -15.499 1.00 0.00 H new ATOM 0 HB2 GLN A 8 5.365 7.912 -14.624 1.00 0.00 H new ATOM 0 HB3 GLN A 8 3.835 7.335 -13.994 1.00 0.00 H new ATOM 0 HG2 GLN A 8 3.211 6.352 -16.053 1.00 0.00 H new ATOM 0 HG3 GLN A 8 4.377 7.290 -16.964 1.00 0.00 H new ATOM 0 HE21 GLN A 8 4.715 5.361 -13.944 1.00 0.00 H new ATOM 0 HE22 GLN A 8 5.964 4.281 -14.571 1.00 0.00 H new ATOM 133 N ARG A 9 4.835 10.567 -13.657 1.00 0.00 N ATOM 134 CA ARG A 9 4.978 11.462 -12.525 1.00 0.00 C ATOM 135 C ARG A 9 4.171 12.724 -12.768 1.00 0.00 C ATOM 136 O ARG A 9 3.779 13.404 -11.828 1.00 0.00 O ATOM 137 CB ARG A 9 6.450 11.816 -12.289 1.00 0.00 C ATOM 138 CG ARG A 9 7.408 10.658 -12.525 1.00 0.00 C ATOM 139 CD ARG A 9 8.410 10.974 -13.624 1.00 0.00 C ATOM 140 NE ARG A 9 9.570 11.701 -13.116 1.00 0.00 N ATOM 141 CZ ARG A 9 10.709 11.845 -13.792 1.00 0.00 C ATOM 142 NH1 ARG A 9 10.844 11.312 -15.000 1.00 0.00 N ATOM 143 NH2 ARG A 9 11.716 12.523 -13.256 1.00 0.00 N ATOM 0 H ARG A 9 5.691 10.424 -14.193 1.00 0.00 H new ATOM 0 HA ARG A 9 4.604 10.958 -11.634 1.00 0.00 H new ATOM 0 HB2 ARG A 9 6.725 12.642 -12.946 1.00 0.00 H new ATOM 0 HB3 ARG A 9 6.569 12.170 -11.265 1.00 0.00 H new ATOM 0 HG2 ARG A 9 7.940 10.432 -11.601 1.00 0.00 H new ATOM 0 HG3 ARG A 9 6.842 9.766 -12.794 1.00 0.00 H new ATOM 0 HD2 ARG A 9 8.740 10.046 -14.091 1.00 0.00 H new ATOM 0 HD3 ARG A 9 7.923 11.565 -14.399 1.00 0.00 H new ATOM 0 HE ARG A 9 9.504 12.123 -12.190 1.00 0.00 H new ATOM 0 HH11 ARG A 9 10.073 10.789 -15.416 1.00 0.00 H new ATOM 0 HH12 ARG A 9 11.718 11.426 -15.513 1.00 0.00 H new ATOM 0 HH21 ARG A 9 11.618 12.933 -12.327 1.00 0.00 H new ATOM 0 HH22 ARG A 9 12.588 12.634 -13.773 1.00 0.00 H new ATOM 157 N SER A 10 3.924 13.037 -14.038 1.00 0.00 N ATOM 158 CA SER A 10 3.155 14.229 -14.371 1.00 0.00 C ATOM 159 C SER A 10 1.740 14.124 -13.821 1.00 0.00 C ATOM 160 O SER A 10 1.168 15.113 -13.361 1.00 0.00 O ATOM 161 CB SER A 10 3.114 14.460 -15.886 1.00 0.00 C ATOM 162 OG SER A 10 2.114 15.403 -16.230 1.00 0.00 O ATOM 0 H SER A 10 4.240 12.491 -14.840 1.00 0.00 H new ATOM 0 HA SER A 10 3.652 15.082 -13.909 1.00 0.00 H new ATOM 0 HB2 SER A 10 4.086 14.814 -16.230 1.00 0.00 H new ATOM 0 HB3 SER A 10 2.920 13.516 -16.396 1.00 0.00 H new ATOM 0 HG SER A 10 2.109 15.534 -17.201 1.00 0.00 H new ATOM 168 N LYS A 11 1.181 12.921 -13.860 1.00 0.00 N ATOM 169 CA LYS A 11 -0.164 12.700 -13.353 1.00 0.00 C ATOM 170 C LYS A 11 -0.141 12.466 -11.858 1.00 0.00 C ATOM 171 O LYS A 11 -0.968 13.000 -11.129 1.00 0.00 O ATOM 172 CB LYS A 11 -0.828 11.523 -14.068 1.00 0.00 C ATOM 173 CG LYS A 11 -1.436 11.893 -15.411 1.00 0.00 C ATOM 174 CD LYS A 11 -0.466 11.634 -16.554 1.00 0.00 C ATOM 175 CE LYS A 11 -0.398 12.815 -17.509 1.00 0.00 C ATOM 176 NZ LYS A 11 -1.237 12.600 -18.720 1.00 0.00 N ATOM 0 H LYS A 11 1.636 12.089 -14.235 1.00 0.00 H new ATOM 0 HA LYS A 11 -0.751 13.597 -13.552 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -0.089 10.736 -14.217 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -1.607 11.111 -13.427 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -2.348 11.318 -15.569 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -1.720 12.945 -15.405 1.00 0.00 H new ATOM 0 HD2 LYS A 11 0.527 11.434 -16.151 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -0.775 10.742 -17.099 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -0.728 13.717 -16.994 1.00 0.00 H new ATOM 0 HE3 LYS A 11 0.637 12.980 -17.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -1.163 13.428 -19.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -0.906 11.754 -19.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -2.229 12.468 -18.436 1.00 0.00 H new ATOM 190 N PHE A 12 0.820 11.693 -11.394 1.00 0.00 N ATOM 191 CA PHE A 12 0.938 11.435 -9.983 1.00 0.00 C ATOM 192 C PHE A 12 1.316 12.727 -9.258 1.00 0.00 C ATOM 193 O PHE A 12 1.108 12.858 -8.052 1.00 0.00 O ATOM 194 CB PHE A 12 1.956 10.309 -9.746 1.00 0.00 C ATOM 195 CG PHE A 12 2.754 10.432 -8.482 1.00 0.00 C ATOM 196 CD1 PHE A 12 3.884 11.221 -8.452 1.00 0.00 C ATOM 197 CD2 PHE A 12 2.377 9.751 -7.335 1.00 0.00 C ATOM 198 CE1 PHE A 12 4.635 11.335 -7.296 1.00 0.00 C ATOM 199 CE2 PHE A 12 3.121 9.858 -6.174 1.00 0.00 C ATOM 200 CZ PHE A 12 4.252 10.652 -6.154 1.00 0.00 C ATOM 0 H PHE A 12 1.524 11.237 -11.974 1.00 0.00 H new ATOM 0 HA PHE A 12 -0.016 11.099 -9.577 1.00 0.00 H new ATOM 0 HB2 PHE A 12 1.425 9.357 -9.732 1.00 0.00 H new ATOM 0 HB3 PHE A 12 2.644 10.278 -10.591 1.00 0.00 H new ATOM 0 HD1 PHE A 12 4.186 11.756 -9.340 1.00 0.00 H new ATOM 0 HD2 PHE A 12 1.493 9.130 -7.348 1.00 0.00 H new ATOM 0 HE1 PHE A 12 5.519 11.956 -7.284 1.00 0.00 H new ATOM 0 HE2 PHE A 12 2.819 9.323 -5.286 1.00 0.00 H new ATOM 0 HZ PHE A 12 4.836 10.740 -5.250 1.00 0.00 H new ATOM 210 N GLU A 13 1.876 13.682 -10.009 1.00 0.00 N ATOM 211 CA GLU A 13 2.281 14.965 -9.434 1.00 0.00 C ATOM 212 C GLU A 13 1.264 16.075 -9.700 1.00 0.00 C ATOM 213 O GLU A 13 1.161 17.024 -8.925 1.00 0.00 O ATOM 214 CB GLU A 13 3.649 15.389 -9.971 1.00 0.00 C ATOM 215 CG GLU A 13 4.789 14.492 -9.516 1.00 0.00 C ATOM 216 CD GLU A 13 5.783 15.217 -8.628 1.00 0.00 C ATOM 217 OE1 GLU A 13 5.450 15.477 -7.453 1.00 0.00 O ATOM 218 OE2 GLU A 13 6.894 15.524 -9.109 1.00 0.00 O ATOM 0 H GLU A 13 2.057 13.590 -11.009 1.00 0.00 H new ATOM 0 HA GLU A 13 2.337 14.817 -8.356 1.00 0.00 H new ATOM 0 HB2 GLU A 13 3.616 15.395 -11.060 1.00 0.00 H new ATOM 0 HB3 GLU A 13 3.854 16.411 -9.653 1.00 0.00 H new ATOM 0 HG2 GLU A 13 4.381 13.638 -8.976 1.00 0.00 H new ATOM 0 HG3 GLU A 13 5.308 14.098 -10.390 1.00 0.00 H new ATOM 225 N ASN A 14 0.550 15.984 -10.819 1.00 0.00 N ATOM 226 CA ASN A 14 -0.411 17.022 -11.191 1.00 0.00 C ATOM 227 C ASN A 14 -1.854 16.651 -10.856 1.00 0.00 C ATOM 228 O ASN A 14 -2.678 17.532 -10.604 1.00 0.00 O ATOM 229 CB ASN A 14 -0.295 17.329 -12.684 1.00 0.00 C ATOM 230 CG ASN A 14 -0.822 18.707 -13.034 1.00 0.00 C ATOM 231 OD1 ASN A 14 -0.895 19.592 -12.180 1.00 0.00 O ATOM 232 ND2 ASN A 14 -1.193 18.896 -14.294 1.00 0.00 N ATOM 0 H ASN A 14 0.616 15.210 -11.480 1.00 0.00 H new ATOM 0 HA ASN A 14 -0.162 17.904 -10.601 1.00 0.00 H new ATOM 0 HB2 ASN A 14 0.749 17.255 -12.987 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -0.846 16.578 -13.250 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -1.556 19.803 -14.588 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -1.115 18.135 -14.968 1.00 0.00 H new ATOM 239 N GLU A 15 -2.173 15.363 -10.867 1.00 0.00 N ATOM 240 CA GLU A 15 -3.539 14.929 -10.573 1.00 0.00 C ATOM 241 C GLU A 15 -3.932 15.290 -9.140 1.00 0.00 C ATOM 242 O GLU A 15 -3.143 15.128 -8.212 1.00 0.00 O ATOM 243 CB GLU A 15 -3.690 13.429 -10.817 1.00 0.00 C ATOM 244 CG GLU A 15 -3.996 13.084 -12.264 1.00 0.00 C ATOM 245 CD GLU A 15 -4.401 11.634 -12.445 1.00 0.00 C ATOM 246 OE1 GLU A 15 -3.524 10.753 -12.325 1.00 0.00 O ATOM 247 OE2 GLU A 15 -5.595 11.381 -12.708 1.00 0.00 O ATOM 0 H GLU A 15 -1.518 14.608 -11.073 1.00 0.00 H new ATOM 0 HA GLU A 15 -4.215 15.455 -11.247 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -2.771 12.925 -10.517 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -4.488 13.043 -10.182 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -4.797 13.729 -12.626 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -3.118 13.291 -12.876 1.00 0.00 H new ATOM 254 N GLU A 16 -5.152 15.808 -8.981 1.00 0.00 N ATOM 255 CA GLU A 16 -5.658 16.233 -7.671 1.00 0.00 C ATOM 256 C GLU A 16 -5.779 15.074 -6.686 1.00 0.00 C ATOM 257 O GLU A 16 -4.963 14.953 -5.774 1.00 0.00 O ATOM 258 CB GLU A 16 -7.006 16.947 -7.815 1.00 0.00 C ATOM 259 CG GLU A 16 -7.970 16.270 -8.776 1.00 0.00 C ATOM 260 CD GLU A 16 -8.441 17.194 -9.883 1.00 0.00 C ATOM 261 OE1 GLU A 16 -7.592 17.650 -10.677 1.00 0.00 O ATOM 262 OE2 GLU A 16 -9.659 17.460 -9.956 1.00 0.00 O ATOM 0 H GLU A 16 -5.812 15.944 -9.747 1.00 0.00 H new ATOM 0 HA GLU A 16 -4.925 16.929 -7.264 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -7.476 17.014 -6.834 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -6.829 17.968 -8.154 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -7.485 15.399 -9.217 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -8.834 15.906 -8.220 1.00 0.00 H new ATOM 269 N PHE A 17 -6.787 14.218 -6.858 1.00 0.00 N ATOM 270 CA PHE A 17 -6.967 13.081 -5.964 1.00 0.00 C ATOM 271 C PHE A 17 -5.663 12.315 -5.861 1.00 0.00 C ATOM 272 O PHE A 17 -5.264 11.870 -4.787 1.00 0.00 O ATOM 273 CB PHE A 17 -8.109 12.181 -6.472 1.00 0.00 C ATOM 274 CG PHE A 17 -7.815 10.707 -6.417 1.00 0.00 C ATOM 275 CD1 PHE A 17 -6.950 10.130 -7.330 1.00 0.00 C ATOM 276 CD2 PHE A 17 -8.399 9.904 -5.450 1.00 0.00 C ATOM 277 CE1 PHE A 17 -6.671 8.775 -7.283 1.00 0.00 C ATOM 278 CE2 PHE A 17 -8.125 8.549 -5.397 1.00 0.00 C ATOM 279 CZ PHE A 17 -7.260 7.985 -6.315 1.00 0.00 C ATOM 0 H PHE A 17 -7.483 14.291 -7.600 1.00 0.00 H new ATOM 0 HA PHE A 17 -7.242 13.433 -4.970 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -9.003 12.382 -5.882 1.00 0.00 H new ATOM 0 HB3 PHE A 17 -8.339 12.454 -7.502 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -6.487 10.744 -8.088 1.00 0.00 H new ATOM 0 HD2 PHE A 17 -9.075 10.341 -4.730 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -5.994 8.336 -8.002 1.00 0.00 H new ATOM 0 HE2 PHE A 17 -8.586 7.933 -4.639 1.00 0.00 H new ATOM 0 HZ PHE A 17 -7.045 6.927 -6.276 1.00 0.00 H new ATOM 289 N PHE A 18 -5.007 12.175 -6.998 1.00 0.00 N ATOM 290 CA PHE A 18 -3.752 11.475 -7.083 1.00 0.00 C ATOM 291 C PHE A 18 -2.707 12.209 -6.252 1.00 0.00 C ATOM 292 O PHE A 18 -1.778 11.597 -5.738 1.00 0.00 O ATOM 293 CB PHE A 18 -3.350 11.443 -8.545 1.00 0.00 C ATOM 294 CG PHE A 18 -2.658 10.198 -8.969 1.00 0.00 C ATOM 295 CD1 PHE A 18 -1.459 9.792 -8.421 1.00 0.00 C ATOM 296 CD2 PHE A 18 -3.249 9.427 -9.941 1.00 0.00 C ATOM 297 CE1 PHE A 18 -0.856 8.621 -8.849 1.00 0.00 C ATOM 298 CE2 PHE A 18 -2.662 8.260 -10.376 1.00 0.00 C ATOM 299 CZ PHE A 18 -1.462 7.854 -9.831 1.00 0.00 C ATOM 0 H PHE A 18 -5.336 12.547 -7.889 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.837 10.459 -6.697 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -4.243 11.573 -9.157 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -2.698 12.293 -8.748 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -0.988 10.390 -7.655 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -4.189 9.741 -10.370 1.00 0.00 H new ATOM 0 HE1 PHE A 18 0.083 8.307 -8.419 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -3.139 7.665 -11.141 1.00 0.00 H new ATOM 0 HZ PHE A 18 -0.996 6.940 -10.169 1.00 0.00 H new ATOM 309 N ARG A 19 -2.884 13.525 -6.111 1.00 0.00 N ATOM 310 CA ARG A 19 -1.972 14.343 -5.321 1.00 0.00 C ATOM 311 C ARG A 19 -2.348 14.260 -3.847 1.00 0.00 C ATOM 312 O ARG A 19 -1.576 13.758 -3.025 1.00 0.00 O ATOM 313 CB ARG A 19 -2.021 15.804 -5.779 1.00 0.00 C ATOM 314 CG ARG A 19 -0.879 16.195 -6.703 1.00 0.00 C ATOM 315 CD ARG A 19 -0.404 17.613 -6.424 1.00 0.00 C ATOM 316 NE ARG A 19 -1.426 18.606 -6.749 1.00 0.00 N ATOM 317 CZ ARG A 19 -1.423 19.853 -6.282 1.00 0.00 C ATOM 318 NH1 ARG A 19 -0.456 20.263 -5.469 1.00 0.00 N ATOM 319 NH2 ARG A 19 -2.390 20.691 -6.626 1.00 0.00 N ATOM 0 H ARG A 19 -3.653 14.044 -6.536 1.00 0.00 H new ATOM 0 HA ARG A 19 -0.960 13.965 -5.463 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -2.967 15.984 -6.290 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -2.004 16.451 -4.902 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -0.050 15.499 -6.574 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -1.204 16.115 -7.740 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -0.131 17.704 -5.373 1.00 0.00 H new ATOM 0 HD3 ARG A 19 0.496 17.815 -7.005 1.00 0.00 H new ATOM 0 HE ARG A 19 -2.186 18.328 -7.370 1.00 0.00 H new ATOM 0 HH11 ARG A 19 0.290 19.621 -5.199 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -0.459 21.219 -5.115 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -3.136 20.381 -7.248 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -2.388 21.646 -6.269 1.00 0.00 H new ATOM 333 N LYS A 20 -3.553 14.735 -3.517 1.00 0.00 N ATOM 334 CA LYS A 20 -4.027 14.691 -2.136 1.00 0.00 C ATOM 335 C LYS A 20 -3.822 13.294 -1.566 1.00 0.00 C ATOM 336 O LYS A 20 -3.595 13.127 -0.368 1.00 0.00 O ATOM 337 CB LYS A 20 -5.498 15.105 -2.034 1.00 0.00 C ATOM 338 CG LYS A 20 -6.389 14.484 -3.092 1.00 0.00 C ATOM 339 CD LYS A 20 -7.366 15.501 -3.670 1.00 0.00 C ATOM 340 CE LYS A 20 -8.795 14.978 -3.653 1.00 0.00 C ATOM 341 NZ LYS A 20 -9.760 16.016 -3.195 1.00 0.00 N ATOM 0 H LYS A 20 -4.209 15.149 -4.180 1.00 0.00 H new ATOM 0 HA LYS A 20 -3.447 15.405 -1.552 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -5.875 14.829 -1.049 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -5.565 16.190 -2.109 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -5.773 14.075 -3.893 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.943 13.651 -2.659 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -7.310 16.427 -3.097 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.078 15.742 -4.693 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -9.071 14.642 -4.653 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.856 14.110 -2.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.722 15.621 -3.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -9.513 16.319 -2.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -9.720 16.834 -3.836 1.00 0.00 H new ATOM 355 N LEU A 21 -3.864 12.293 -2.445 1.00 0.00 N ATOM 356 CA LEU A 21 -3.640 10.917 -2.029 1.00 0.00 C ATOM 357 C LEU A 21 -2.148 10.606 -2.109 1.00 0.00 C ATOM 358 O LEU A 21 -1.609 9.902 -1.254 1.00 0.00 O ATOM 359 CB LEU A 21 -4.435 9.935 -2.898 1.00 0.00 C ATOM 360 CG LEU A 21 -5.958 9.935 -2.693 1.00 0.00 C ATOM 361 CD1 LEU A 21 -6.519 8.537 -2.904 1.00 0.00 C ATOM 362 CD2 LEU A 21 -6.334 10.448 -1.308 1.00 0.00 C ATOM 0 H LEU A 21 -4.050 12.412 -3.441 1.00 0.00 H new ATOM 0 HA LEU A 21 -3.986 10.802 -1.002 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -4.229 10.158 -3.945 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.063 8.928 -2.708 1.00 0.00 H new ATOM 0 HG LEU A 21 -6.393 10.610 -3.430 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -7.599 8.552 -2.756 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -6.297 8.205 -3.918 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -6.064 7.851 -2.190 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -7.418 10.435 -1.197 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -5.884 9.809 -0.549 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -5.969 11.468 -1.186 1.00 0.00 H new ATOM 374 N SER A 22 -1.476 11.169 -3.121 1.00 0.00 N ATOM 375 CA SER A 22 -0.031 10.981 -3.286 1.00 0.00 C ATOM 376 C SER A 22 0.713 11.391 -2.018 1.00 0.00 C ATOM 377 O SER A 22 1.885 11.065 -1.840 1.00 0.00 O ATOM 378 CB SER A 22 0.496 11.797 -4.469 1.00 0.00 C ATOM 379 OG SER A 22 1.893 12.023 -4.356 1.00 0.00 O ATOM 0 H SER A 22 -1.908 11.756 -3.835 1.00 0.00 H new ATOM 0 HA SER A 22 0.144 9.923 -3.480 1.00 0.00 H new ATOM 0 HB2 SER A 22 0.284 11.271 -5.400 1.00 0.00 H new ATOM 0 HB3 SER A 22 -0.027 12.752 -4.517 1.00 0.00 H new ATOM 0 HG SER A 22 2.373 11.410 -4.952 1.00 0.00 H new ATOM 385 N ARG A 23 0.026 12.115 -1.140 1.00 0.00 N ATOM 386 CA ARG A 23 0.621 12.572 0.106 1.00 0.00 C ATOM 387 C ARG A 23 0.223 11.648 1.250 1.00 0.00 C ATOM 388 O ARG A 23 -0.266 10.540 1.023 1.00 0.00 O ATOM 389 CB ARG A 23 0.173 14.004 0.403 1.00 0.00 C ATOM 390 CG ARG A 23 0.131 14.896 -0.829 1.00 0.00 C ATOM 391 CD ARG A 23 1.455 15.614 -1.040 1.00 0.00 C ATOM 392 NE ARG A 23 2.502 14.707 -1.504 1.00 0.00 N ATOM 393 CZ ARG A 23 3.797 15.013 -1.512 1.00 0.00 C ATOM 394 NH1 ARG A 23 4.209 16.200 -1.085 1.00 0.00 N ATOM 395 NH2 ARG A 23 4.684 14.129 -1.949 1.00 0.00 N ATOM 0 H ARG A 23 -0.945 12.397 -1.271 1.00 0.00 H new ATOM 0 HA ARG A 23 1.706 12.555 0.006 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -0.817 13.979 0.858 1.00 0.00 H new ATOM 0 HB3 ARG A 23 0.849 14.443 1.136 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -0.102 14.295 -1.708 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -0.669 15.629 -0.722 1.00 0.00 H new ATOM 0 HD2 ARG A 23 1.321 16.415 -1.767 1.00 0.00 H new ATOM 0 HD3 ARG A 23 1.767 16.080 -0.106 1.00 0.00 H new ATOM 0 HE ARG A 23 2.224 13.785 -1.842 1.00 0.00 H new ATOM 0 HH11 ARG A 23 3.532 16.884 -0.748 1.00 0.00 H new ATOM 0 HH12 ARG A 23 5.203 16.428 -1.094 1.00 0.00 H new ATOM 0 HH21 ARG A 23 4.373 13.215 -2.279 1.00 0.00 H new ATOM 0 HH22 ARG A 23 5.677 14.363 -1.955 1.00 0.00 H new ATOM 409 N GLU A 24 0.454 12.102 2.477 1.00 0.00 N ATOM 410 CA GLU A 24 0.134 11.306 3.660 1.00 0.00 C ATOM 411 C GLU A 24 -0.998 11.933 4.469 1.00 0.00 C ATOM 412 O GLU A 24 -0.935 13.104 4.843 1.00 0.00 O ATOM 413 CB GLU A 24 1.375 11.153 4.541 1.00 0.00 C ATOM 414 CG GLU A 24 1.968 12.479 4.989 1.00 0.00 C ATOM 415 CD GLU A 24 3.235 12.305 5.803 1.00 0.00 C ATOM 416 OE1 GLU A 24 4.033 11.402 5.474 1.00 0.00 O ATOM 417 OE2 GLU A 24 3.432 13.074 6.767 1.00 0.00 O ATOM 0 H GLU A 24 0.861 13.015 2.680 1.00 0.00 H new ATOM 0 HA GLU A 24 -0.197 10.325 3.320 1.00 0.00 H new ATOM 0 HB2 GLU A 24 1.116 10.564 5.421 1.00 0.00 H new ATOM 0 HB3 GLU A 24 2.132 10.592 3.994 1.00 0.00 H new ATOM 0 HG2 GLU A 24 2.184 13.091 4.113 1.00 0.00 H new ATOM 0 HG3 GLU A 24 1.231 13.021 5.582 1.00 0.00 H new ATOM 424 N CYS A 25 -2.029 11.137 4.743 1.00 0.00 N ATOM 425 CA CYS A 25 -3.172 11.604 5.520 1.00 0.00 C ATOM 426 C CYS A 25 -3.816 10.466 6.303 1.00 0.00 C ATOM 427 O CYS A 25 -3.618 9.290 5.998 1.00 0.00 O ATOM 428 CB CYS A 25 -4.204 12.300 4.622 1.00 0.00 C ATOM 429 SG CYS A 25 -4.255 11.696 2.918 1.00 0.00 S ATOM 0 H CYS A 25 -2.095 10.166 4.438 1.00 0.00 H new ATOM 0 HA CYS A 25 -2.801 12.334 6.239 1.00 0.00 H new ATOM 0 HB2 CYS A 25 -5.192 12.178 5.066 1.00 0.00 H new ATOM 0 HB3 CYS A 25 -3.991 13.369 4.608 1.00 0.00 H new ATOM 0 HG CYS A 25 -4.849 10.540 2.885 1.00 0.00 H new ATOM 435 N GLU A 26 -4.567 10.838 7.334 1.00 0.00 N ATOM 436 CA GLU A 26 -5.235 9.877 8.209 1.00 0.00 C ATOM 437 C GLU A 26 -5.891 8.732 7.440 1.00 0.00 C ATOM 438 O GLU A 26 -6.470 8.926 6.371 1.00 0.00 O ATOM 439 CB GLU A 26 -6.290 10.585 9.061 1.00 0.00 C ATOM 440 CG GLU A 26 -5.798 11.873 9.700 1.00 0.00 C ATOM 441 CD GLU A 26 -6.258 12.024 11.137 1.00 0.00 C ATOM 442 OE1 GLU A 26 -7.242 11.357 11.518 1.00 0.00 O ATOM 443 OE2 GLU A 26 -5.633 12.809 11.881 1.00 0.00 O ATOM 0 H GLU A 26 -4.731 11.812 7.588 1.00 0.00 H new ATOM 0 HA GLU A 26 -4.463 9.444 8.845 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -7.157 10.807 8.439 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -6.626 9.906 9.845 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -4.709 11.898 9.667 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -6.154 12.722 9.117 1.00 0.00 H new ATOM 450 N ILE A 27 -5.804 7.541 8.021 1.00 0.00 N ATOM 451 CA ILE A 27 -6.397 6.340 7.439 1.00 0.00 C ATOM 452 C ILE A 27 -7.057 5.492 8.526 1.00 0.00 C ATOM 453 O ILE A 27 -6.806 5.693 9.714 1.00 0.00 O ATOM 454 CB ILE A 27 -5.356 5.483 6.695 1.00 0.00 C ATOM 455 CG1 ILE A 27 -4.205 5.110 7.626 1.00 0.00 C ATOM 456 CG2 ILE A 27 -4.839 6.222 5.472 1.00 0.00 C ATOM 457 CD1 ILE A 27 -3.279 4.064 7.043 1.00 0.00 C ATOM 0 H ILE A 27 -5.323 7.380 8.906 1.00 0.00 H new ATOM 0 HA ILE A 27 -7.145 6.672 6.719 1.00 0.00 H new ATOM 0 HB ILE A 27 -5.838 4.563 6.363 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -3.629 6.006 7.858 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -4.613 4.741 8.567 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -4.104 5.603 4.957 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -5.669 6.436 4.799 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -4.373 7.157 5.782 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -2.484 3.845 7.755 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -3.842 3.154 6.837 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -2.844 4.439 6.117 1.00 0.00 H new ATOM 469 N LYS A 28 -7.904 4.550 8.118 1.00 0.00 N ATOM 470 CA LYS A 28 -8.594 3.683 9.077 1.00 0.00 C ATOM 471 C LYS A 28 -9.050 2.386 8.418 1.00 0.00 C ATOM 472 O LYS A 28 -9.059 2.278 7.195 1.00 0.00 O ATOM 473 CB LYS A 28 -9.799 4.411 9.677 1.00 0.00 C ATOM 474 CG LYS A 28 -10.872 4.758 8.657 1.00 0.00 C ATOM 475 CD LYS A 28 -12.246 4.288 9.109 1.00 0.00 C ATOM 476 CE LYS A 28 -12.690 5.003 10.375 1.00 0.00 C ATOM 477 NZ LYS A 28 -14.155 5.272 10.375 1.00 0.00 N ATOM 0 H LYS A 28 -8.129 4.366 7.140 1.00 0.00 H new ATOM 0 HA LYS A 28 -7.890 3.435 9.871 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -10.238 3.788 10.456 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -9.457 5.328 10.157 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -10.889 5.836 8.499 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -10.627 4.299 7.699 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -12.972 4.466 8.316 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -12.224 3.213 9.286 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -12.432 4.397 11.244 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -12.148 5.944 10.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -14.418 5.760 11.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -14.398 5.871 9.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -14.673 4.373 10.310 1.00 0.00 H new ATOM 491 N TYR A 29 -9.425 1.399 9.232 1.00 0.00 N ATOM 492 CA TYR A 29 -9.874 0.114 8.700 1.00 0.00 C ATOM 493 C TYR A 29 -11.342 0.147 8.269 1.00 0.00 C ATOM 494 O TYR A 29 -12.195 0.700 8.963 1.00 0.00 O ATOM 495 CB TYR A 29 -9.663 -0.989 9.729 1.00 0.00 C ATOM 496 CG TYR A 29 -9.298 -2.311 9.099 1.00 0.00 C ATOM 497 CD1 TYR A 29 -7.972 -2.643 8.851 1.00 0.00 C ATOM 498 CD2 TYR A 29 -10.281 -3.224 8.748 1.00 0.00 C ATOM 499 CE1 TYR A 29 -7.637 -3.850 8.270 1.00 0.00 C ATOM 500 CE2 TYR A 29 -9.954 -4.434 8.167 1.00 0.00 C ATOM 501 CZ TYR A 29 -8.630 -4.743 7.931 1.00 0.00 C ATOM 502 OH TYR A 29 -8.300 -5.946 7.353 1.00 0.00 O ATOM 0 H TYR A 29 -9.427 1.463 10.250 1.00 0.00 H new ATOM 0 HA TYR A 29 -9.274 -0.093 7.814 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -8.874 -0.690 10.419 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -10.573 -1.110 10.317 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -7.191 -1.946 9.117 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -11.318 -2.985 8.932 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -6.602 -4.093 8.082 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -10.731 -5.135 7.899 1.00 0.00 H new ATOM 0 HH TYR A 29 -9.113 -6.473 7.206 1.00 0.00 H new ATOM 512 N THR A 30 -11.622 -0.463 7.114 1.00 0.00 N ATOM 513 CA THR A 30 -12.979 -0.528 6.568 1.00 0.00 C ATOM 514 C THR A 30 -13.106 -1.684 5.575 1.00 0.00 C ATOM 515 O THR A 30 -13.702 -1.537 4.509 1.00 0.00 O ATOM 516 CB THR A 30 -13.354 0.785 5.876 1.00 0.00 C ATOM 517 OG1 THR A 30 -12.597 0.963 4.694 1.00 0.00 O ATOM 518 CG2 THR A 30 -13.153 2.007 6.749 1.00 0.00 C ATOM 0 H THR A 30 -10.919 -0.923 6.535 1.00 0.00 H new ATOM 0 HA THR A 30 -13.663 -0.695 7.400 1.00 0.00 H new ATOM 0 HB THR A 30 -14.417 0.698 5.651 1.00 0.00 H new ATOM 0 HG1 THR A 30 -12.918 1.756 4.216 1.00 0.00 H new ATOM 0 HG21 THR A 30 -13.438 2.901 6.195 1.00 0.00 H new ATOM 0 HG22 THR A 30 -13.771 1.921 7.643 1.00 0.00 H new ATOM 0 HG23 THR A 30 -12.105 2.079 7.038 1.00 0.00 H new ATOM 526 N GLY A 31 -12.534 -2.834 5.930 1.00 0.00 N ATOM 527 CA GLY A 31 -12.589 -3.993 5.054 1.00 0.00 C ATOM 528 C GLY A 31 -13.567 -5.051 5.532 1.00 0.00 C ATOM 529 O GLY A 31 -14.756 -4.993 5.219 1.00 0.00 O ATOM 0 H GLY A 31 -12.035 -2.983 6.807 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -12.872 -3.671 4.052 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -11.594 -4.433 4.979 1.00 0.00 H new ATOM 533 N PHE A 32 -13.067 -6.017 6.299 1.00 0.00 N ATOM 534 CA PHE A 32 -13.908 -7.089 6.829 1.00 0.00 C ATOM 535 C PHE A 32 -14.150 -6.888 8.320 1.00 0.00 C ATOM 536 O PHE A 32 -14.565 -7.805 9.026 1.00 0.00 O ATOM 537 CB PHE A 32 -13.267 -8.460 6.589 1.00 0.00 C ATOM 538 CG PHE A 32 -11.767 -8.428 6.497 1.00 0.00 C ATOM 539 CD1 PHE A 32 -10.989 -8.359 7.641 1.00 0.00 C ATOM 540 CD2 PHE A 32 -11.140 -8.472 5.265 1.00 0.00 C ATOM 541 CE1 PHE A 32 -9.608 -8.333 7.556 1.00 0.00 C ATOM 542 CE2 PHE A 32 -9.762 -8.447 5.171 1.00 0.00 C ATOM 543 CZ PHE A 32 -8.995 -8.378 6.318 1.00 0.00 C ATOM 0 H PHE A 32 -12.085 -6.080 6.568 1.00 0.00 H new ATOM 0 HA PHE A 32 -14.863 -7.055 6.304 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -13.557 -9.131 7.398 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -13.668 -8.880 5.667 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -11.465 -8.325 8.610 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -11.735 -8.527 4.365 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -9.011 -8.278 8.454 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -9.285 -8.481 4.203 1.00 0.00 H new ATOM 0 HZ PHE A 32 -7.917 -8.359 6.247 1.00 0.00 H new ATOM 553 N ARG A 33 -13.869 -5.679 8.786 1.00 0.00 N ATOM 554 CA ARG A 33 -14.029 -5.322 10.187 1.00 0.00 C ATOM 555 C ARG A 33 -15.435 -4.817 10.487 1.00 0.00 C ATOM 556 O ARG A 33 -15.803 -4.637 11.647 1.00 0.00 O ATOM 557 CB ARG A 33 -12.984 -4.274 10.563 1.00 0.00 C ATOM 558 CG ARG A 33 -13.492 -2.836 10.546 1.00 0.00 C ATOM 559 CD ARG A 33 -13.883 -2.395 9.149 1.00 0.00 C ATOM 560 NE ARG A 33 -15.217 -1.797 9.113 1.00 0.00 N ATOM 561 CZ ARG A 33 -15.484 -0.554 9.507 1.00 0.00 C ATOM 562 NH1 ARG A 33 -14.516 0.225 9.974 1.00 0.00 N ATOM 563 NH2 ARG A 33 -16.724 -0.089 9.435 1.00 0.00 N ATOM 0 H ARG A 33 -13.523 -4.918 8.202 1.00 0.00 H new ATOM 0 HA ARG A 33 -13.880 -6.218 10.790 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -12.605 -4.500 11.560 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -12.142 -4.356 9.875 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -14.352 -2.746 11.210 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -12.719 -2.173 10.934 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -13.153 -1.674 8.779 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -13.853 -3.253 8.477 1.00 0.00 H new ATOM 0 HE ARG A 33 -15.989 -2.366 8.765 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -13.561 -0.128 10.033 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -14.727 1.177 10.274 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -17.472 -0.684 9.078 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -16.930 0.863 9.737 1.00 0.00 H new ATOM 577 N ASP A 34 -16.214 -4.583 9.440 1.00 0.00 N ATOM 578 CA ASP A 34 -17.579 -4.090 9.599 1.00 0.00 C ATOM 579 C ASP A 34 -18.374 -4.942 10.593 1.00 0.00 C ATOM 580 O ASP A 34 -19.462 -4.554 11.019 1.00 0.00 O ATOM 581 CB ASP A 34 -18.294 -4.072 8.246 1.00 0.00 C ATOM 582 CG ASP A 34 -18.018 -2.804 7.462 1.00 0.00 C ATOM 583 OD1 ASP A 34 -16.871 -2.630 6.999 1.00 0.00 O ATOM 584 OD2 ASP A 34 -18.949 -1.985 7.310 1.00 0.00 O ATOM 0 H ASP A 34 -15.927 -4.726 8.472 1.00 0.00 H new ATOM 0 HA ASP A 34 -17.520 -3.076 9.994 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -17.977 -4.934 7.660 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -19.368 -4.171 8.404 1.00 0.00 H new ATOM 589 N ARG A 35 -17.823 -6.095 10.974 1.00 0.00 N ATOM 590 CA ARG A 35 -18.483 -6.975 11.928 1.00 0.00 C ATOM 591 C ARG A 35 -17.559 -7.276 13.117 1.00 0.00 C ATOM 592 O ARG A 35 -17.874 -6.912 14.250 1.00 0.00 O ATOM 593 CB ARG A 35 -18.957 -8.270 11.248 1.00 0.00 C ATOM 594 CG ARG A 35 -19.196 -8.130 9.747 1.00 0.00 C ATOM 595 CD ARG A 35 -17.896 -8.129 8.948 1.00 0.00 C ATOM 596 NE ARG A 35 -17.582 -9.450 8.408 1.00 0.00 N ATOM 597 CZ ARG A 35 -18.007 -9.893 7.226 1.00 0.00 C ATOM 598 NH1 ARG A 35 -18.781 -9.133 6.461 1.00 0.00 N ATOM 599 NH2 ARG A 35 -17.659 -11.104 6.810 1.00 0.00 N ATOM 0 H ARG A 35 -16.924 -6.437 10.635 1.00 0.00 H new ATOM 0 HA ARG A 35 -19.366 -6.462 12.310 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -18.214 -9.050 11.416 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -19.880 -8.601 11.723 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -19.829 -8.949 9.405 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -19.739 -7.205 9.553 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -17.974 -7.413 8.130 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -17.078 -7.795 9.587 1.00 0.00 H new ATOM 0 HE ARG A 35 -17.001 -10.071 8.971 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -19.054 -8.203 6.777 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -19.102 -9.479 5.557 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -17.067 -11.694 7.395 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -17.983 -11.445 5.905 1.00 0.00 H new ATOM 613 N PRO A 36 -16.403 -7.938 12.888 1.00 0.00 N ATOM 614 CA PRO A 36 -15.452 -8.270 13.938 1.00 0.00 C ATOM 615 C PRO A 36 -14.253 -7.322 13.950 1.00 0.00 C ATOM 616 O PRO A 36 -13.137 -7.724 13.630 1.00 0.00 O ATOM 617 CB PRO A 36 -15.019 -9.659 13.495 1.00 0.00 C ATOM 618 CG PRO A 36 -14.963 -9.560 12.000 1.00 0.00 C ATOM 619 CD PRO A 36 -15.901 -8.437 11.598 1.00 0.00 C ATOM 0 HA PRO A 36 -15.868 -8.205 14.944 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -14.049 -9.928 13.914 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -15.728 -10.421 13.819 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -13.947 -9.353 11.664 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -15.266 -10.500 11.539 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -15.381 -7.658 11.040 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -16.711 -8.797 10.963 1.00 0.00 H new ATOM 627 N HIS A 37 -14.489 -6.062 14.303 1.00 0.00 N ATOM 628 CA HIS A 37 -13.424 -5.058 14.334 1.00 0.00 C ATOM 629 C HIS A 37 -12.319 -5.432 15.327 1.00 0.00 C ATOM 630 O HIS A 37 -11.163 -5.638 14.940 1.00 0.00 O ATOM 631 CB HIS A 37 -14.016 -3.693 14.688 1.00 0.00 C ATOM 632 CG HIS A 37 -13.080 -2.541 14.475 1.00 0.00 C ATOM 633 ND1 HIS A 37 -12.892 -1.556 15.420 1.00 0.00 N ATOM 634 CD2 HIS A 37 -12.286 -2.205 13.423 1.00 0.00 C ATOM 635 CE1 HIS A 37 -12.030 -0.667 14.964 1.00 0.00 C ATOM 636 NE2 HIS A 37 -11.649 -1.037 13.755 1.00 0.00 N ATOM 0 H HIS A 37 -15.407 -5.709 14.572 1.00 0.00 H new ATOM 0 HA HIS A 37 -12.970 -5.015 13.344 1.00 0.00 H new ATOM 0 HB2 HIS A 37 -14.913 -3.533 14.090 1.00 0.00 H new ATOM 0 HB3 HIS A 37 -14.327 -3.705 15.733 1.00 0.00 H new ATOM 0 HD1 HIS A 37 -13.349 -1.520 16.331 1.00 0.00 H new ATOM 0 HD2 HIS A 37 -12.178 -2.755 12.500 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -11.693 0.214 15.490 1.00 0.00 H new ATOM 645 N GLU A 38 -12.674 -5.517 16.606 1.00 0.00 N ATOM 646 CA GLU A 38 -11.709 -5.862 17.650 1.00 0.00 C ATOM 647 C GLU A 38 -10.938 -7.129 17.296 1.00 0.00 C ATOM 648 O GLU A 38 -9.783 -7.296 17.691 1.00 0.00 O ATOM 649 CB GLU A 38 -12.417 -6.038 18.994 1.00 0.00 C ATOM 650 CG GLU A 38 -13.662 -6.908 18.916 1.00 0.00 C ATOM 651 CD GLU A 38 -14.900 -6.205 19.436 1.00 0.00 C ATOM 652 OE1 GLU A 38 -15.093 -6.179 20.670 1.00 0.00 O ATOM 653 OE2 GLU A 38 -15.676 -5.679 18.611 1.00 0.00 O ATOM 0 H GLU A 38 -13.621 -5.352 16.946 1.00 0.00 H new ATOM 0 HA GLU A 38 -10.996 -5.041 17.727 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -11.720 -6.478 19.707 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -12.693 -5.057 19.381 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -13.827 -7.207 17.881 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -13.499 -7.820 19.490 1.00 0.00 H new ATOM 660 N GLU A 39 -11.564 -7.999 16.516 1.00 0.00 N ATOM 661 CA GLU A 39 -10.919 -9.223 16.068 1.00 0.00 C ATOM 662 C GLU A 39 -10.118 -8.895 14.833 1.00 0.00 C ATOM 663 O GLU A 39 -9.025 -9.416 14.612 1.00 0.00 O ATOM 664 CB GLU A 39 -11.945 -10.311 15.761 1.00 0.00 C ATOM 665 CG GLU A 39 -11.325 -11.677 15.511 1.00 0.00 C ATOM 666 CD GLU A 39 -12.011 -12.782 16.291 1.00 0.00 C ATOM 667 OE1 GLU A 39 -11.687 -12.955 17.484 1.00 0.00 O ATOM 668 OE2 GLU A 39 -12.870 -13.476 15.707 1.00 0.00 O ATOM 0 H GLU A 39 -12.520 -7.879 16.180 1.00 0.00 H new ATOM 0 HA GLU A 39 -10.272 -9.607 16.857 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -12.644 -10.385 16.594 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -12.523 -10.017 14.885 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -11.375 -11.905 14.446 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -10.270 -11.648 15.782 1.00 0.00 H new ATOM 675 N ARG A 40 -10.678 -7.981 14.048 1.00 0.00 N ATOM 676 CA ARG A 40 -10.045 -7.506 12.843 1.00 0.00 C ATOM 677 C ARG A 40 -8.608 -7.121 13.149 1.00 0.00 C ATOM 678 O ARG A 40 -7.731 -7.208 12.293 1.00 0.00 O ATOM 679 CB ARG A 40 -10.824 -6.307 12.297 1.00 0.00 C ATOM 680 CG ARG A 40 -10.118 -4.965 12.463 1.00 0.00 C ATOM 681 CD ARG A 40 -9.021 -4.772 11.426 1.00 0.00 C ATOM 682 NE ARG A 40 -7.699 -4.632 12.038 1.00 0.00 N ATOM 683 CZ ARG A 40 -7.068 -3.471 12.208 1.00 0.00 C ATOM 684 NH1 ARG A 40 -7.642 -2.333 11.850 1.00 0.00 N ATOM 685 NH2 ARG A 40 -5.860 -3.452 12.753 1.00 0.00 N ATOM 0 H ARG A 40 -11.585 -7.554 14.238 1.00 0.00 H new ATOM 0 HA ARG A 40 -10.043 -8.291 12.087 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -11.022 -6.470 11.238 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -11.791 -6.259 12.798 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -10.846 -4.158 12.377 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -9.688 -4.901 13.463 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -9.015 -5.622 10.744 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -9.239 -3.886 10.830 1.00 0.00 H new ATOM 0 HE ARG A 40 -7.229 -5.480 12.356 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -8.576 -2.340 11.440 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -7.150 -1.449 11.984 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -5.417 -4.324 13.041 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -5.374 -2.565 12.885 1.00 0.00 H new ATOM 699 N GLN A 41 -8.378 -6.694 14.390 1.00 0.00 N ATOM 700 CA GLN A 41 -7.038 -6.299 14.812 1.00 0.00 C ATOM 701 C GLN A 41 -6.071 -7.450 14.565 1.00 0.00 C ATOM 702 O GLN A 41 -4.938 -7.252 14.120 1.00 0.00 O ATOM 703 CB GLN A 41 -7.030 -5.863 16.286 1.00 0.00 C ATOM 704 CG GLN A 41 -6.980 -7.005 17.289 1.00 0.00 C ATOM 705 CD GLN A 41 -5.577 -7.272 17.796 1.00 0.00 C ATOM 706 OE1 GLN A 41 -4.981 -6.436 18.476 1.00 0.00 O ATOM 707 NE2 GLN A 41 -5.040 -8.441 17.468 1.00 0.00 N ATOM 0 H GLN A 41 -9.094 -6.614 15.112 1.00 0.00 H new ATOM 0 HA GLN A 41 -6.716 -5.439 14.224 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -6.171 -5.213 16.453 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -7.922 -5.268 16.479 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -7.629 -6.772 18.133 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -7.373 -7.909 16.825 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -5.569 -9.105 16.903 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -4.098 -8.675 17.781 1.00 0.00 H new ATOM 716 N THR A 42 -6.555 -8.661 14.813 1.00 0.00 N ATOM 717 CA THR A 42 -5.773 -9.861 14.580 1.00 0.00 C ATOM 718 C THR A 42 -5.916 -10.279 13.130 1.00 0.00 C ATOM 719 O THR A 42 -4.990 -10.834 12.540 1.00 0.00 O ATOM 720 CB THR A 42 -6.229 -10.995 15.500 1.00 0.00 C ATOM 721 OG1 THR A 42 -6.389 -10.531 16.828 1.00 0.00 O ATOM 722 CG2 THR A 42 -5.268 -12.163 15.533 1.00 0.00 C ATOM 0 H THR A 42 -7.492 -8.835 15.178 1.00 0.00 H new ATOM 0 HA THR A 42 -4.727 -9.647 14.799 1.00 0.00 H new ATOM 0 HB THR A 42 -7.177 -11.338 15.086 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.682 -11.271 17.400 1.00 0.00 H new ATOM 0 HG21 THR A 42 -5.652 -12.931 16.204 1.00 0.00 H new ATOM 0 HG22 THR A 42 -5.164 -12.577 14.530 1.00 0.00 H new ATOM 0 HG23 THR A 42 -4.295 -11.824 15.889 1.00 0.00 H new ATOM 730 N ARG A 43 -7.077 -9.987 12.546 1.00 0.00 N ATOM 731 CA ARG A 43 -7.309 -10.324 11.148 1.00 0.00 C ATOM 732 C ARG A 43 -6.387 -9.497 10.261 1.00 0.00 C ATOM 733 O ARG A 43 -5.926 -9.963 9.222 1.00 0.00 O ATOM 734 CB ARG A 43 -8.766 -10.081 10.758 1.00 0.00 C ATOM 735 CG ARG A 43 -9.671 -11.279 10.996 1.00 0.00 C ATOM 736 CD ARG A 43 -9.899 -11.522 12.479 1.00 0.00 C ATOM 737 NE ARG A 43 -10.143 -12.933 12.772 1.00 0.00 N ATOM 738 CZ ARG A 43 -9.179 -13.846 12.880 1.00 0.00 C ATOM 739 NH1 ARG A 43 -7.908 -13.502 12.714 1.00 0.00 N ATOM 740 NH2 ARG A 43 -9.489 -15.105 13.154 1.00 0.00 N ATOM 0 H ARG A 43 -7.858 -9.525 13.012 1.00 0.00 H new ATOM 0 HA ARG A 43 -7.094 -11.384 11.009 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -9.147 -9.231 11.324 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -8.810 -9.808 9.704 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -10.629 -11.116 10.502 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -9.227 -12.167 10.545 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -9.029 -11.180 13.040 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -10.749 -10.929 12.817 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.108 -13.236 12.901 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -7.665 -12.534 12.503 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -7.174 -14.205 12.798 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -10.465 -15.374 13.282 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -8.752 -15.805 13.237 1.00 0.00 H new ATOM 754 N PHE A 44 -6.106 -8.273 10.700 1.00 0.00 N ATOM 755 CA PHE A 44 -5.223 -7.380 9.974 1.00 0.00 C ATOM 756 C PHE A 44 -3.780 -7.835 10.166 1.00 0.00 C ATOM 757 O PHE A 44 -3.046 -8.038 9.198 1.00 0.00 O ATOM 758 CB PHE A 44 -5.418 -5.946 10.472 1.00 0.00 C ATOM 759 CG PHE A 44 -4.162 -5.136 10.499 1.00 0.00 C ATOM 760 CD1 PHE A 44 -3.694 -4.521 9.353 1.00 0.00 C ATOM 761 CD2 PHE A 44 -3.452 -5.000 11.673 1.00 0.00 C ATOM 762 CE1 PHE A 44 -2.533 -3.779 9.378 1.00 0.00 C ATOM 763 CE2 PHE A 44 -2.288 -4.260 11.710 1.00 0.00 C ATOM 764 CZ PHE A 44 -1.827 -3.648 10.560 1.00 0.00 C ATOM 0 H PHE A 44 -6.483 -7.880 11.562 1.00 0.00 H new ATOM 0 HA PHE A 44 -5.458 -7.406 8.910 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -6.147 -5.446 9.834 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -5.841 -5.975 11.476 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -4.244 -4.623 8.429 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -3.811 -5.478 12.573 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -2.176 -3.301 8.478 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -1.739 -4.159 12.635 1.00 0.00 H new ATOM 0 HZ PHE A 44 -0.916 -3.068 10.584 1.00 0.00 H new ATOM 774 N GLN A 45 -3.387 -8.014 11.427 1.00 0.00 N ATOM 775 CA GLN A 45 -2.042 -8.470 11.749 1.00 0.00 C ATOM 776 C GLN A 45 -1.800 -9.849 11.144 1.00 0.00 C ATOM 777 O GLN A 45 -0.672 -10.202 10.798 1.00 0.00 O ATOM 778 CB GLN A 45 -1.842 -8.519 13.265 1.00 0.00 C ATOM 779 CG GLN A 45 -1.498 -7.170 13.877 1.00 0.00 C ATOM 780 CD GLN A 45 -0.102 -7.136 14.469 1.00 0.00 C ATOM 781 OE1 GLN A 45 0.211 -7.884 15.395 1.00 0.00 O ATOM 782 NE2 GLN A 45 0.745 -6.263 13.936 1.00 0.00 N ATOM 0 H GLN A 45 -3.983 -7.850 12.239 1.00 0.00 H new ATOM 0 HA GLN A 45 -1.325 -7.766 11.327 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -2.751 -8.899 13.731 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -1.046 -9.227 13.495 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -1.584 -6.397 13.114 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -2.224 -6.932 14.654 1.00 0.00 H new ATOM 0 HE21 GLN A 45 0.443 -5.662 13.169 1.00 0.00 H new ATOM 0 HE22 GLN A 45 1.698 -6.193 14.293 1.00 0.00 H new ATOM 791 N ASN A 46 -2.878 -10.615 11.004 1.00 0.00 N ATOM 792 CA ASN A 46 -2.806 -11.951 10.422 1.00 0.00 C ATOM 793 C ASN A 46 -2.745 -11.853 8.904 1.00 0.00 C ATOM 794 O ASN A 46 -2.165 -12.707 8.234 1.00 0.00 O ATOM 795 CB ASN A 46 -4.013 -12.794 10.841 1.00 0.00 C ATOM 796 CG ASN A 46 -3.858 -13.382 12.229 1.00 0.00 C ATOM 797 OD1 ASN A 46 -4.735 -13.234 13.080 1.00 0.00 O ATOM 798 ND2 ASN A 46 -2.738 -14.056 12.465 1.00 0.00 N ATOM 0 H ASN A 46 -3.816 -10.331 11.287 1.00 0.00 H new ATOM 0 HA ASN A 46 -1.902 -12.437 10.790 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -4.911 -12.177 10.810 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.155 -13.601 10.122 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -2.579 -14.475 13.381 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -2.037 -14.154 11.730 1.00 0.00 H new ATOM 805 N ALA A 47 -3.324 -10.781 8.373 1.00 0.00 N ATOM 806 CA ALA A 47 -3.313 -10.535 6.943 1.00 0.00 C ATOM 807 C ALA A 47 -1.936 -10.043 6.547 1.00 0.00 C ATOM 808 O ALA A 47 -1.455 -10.307 5.444 1.00 0.00 O ATOM 809 CB ALA A 47 -4.381 -9.521 6.557 1.00 0.00 C ATOM 0 H ALA A 47 -3.808 -10.068 8.918 1.00 0.00 H new ATOM 0 HA ALA A 47 -3.538 -11.460 6.413 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -4.352 -9.354 5.480 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -5.363 -9.901 6.839 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -4.194 -8.580 7.075 1.00 0.00 H new ATOM 815 N CYS A 48 -1.288 -9.355 7.485 1.00 0.00 N ATOM 816 CA CYS A 48 0.061 -8.859 7.263 1.00 0.00 C ATOM 817 C CYS A 48 0.997 -10.042 7.068 1.00 0.00 C ATOM 818 O CYS A 48 2.074 -9.908 6.486 1.00 0.00 O ATOM 819 CB CYS A 48 0.524 -8.009 8.446 1.00 0.00 C ATOM 820 SG CYS A 48 -0.287 -6.396 8.558 1.00 0.00 S ATOM 0 H CYS A 48 -1.677 -9.131 8.401 1.00 0.00 H new ATOM 0 HA CYS A 48 0.071 -8.231 6.372 1.00 0.00 H new ATOM 0 HB2 CYS A 48 0.342 -8.560 9.369 1.00 0.00 H new ATOM 0 HB3 CYS A 48 1.601 -7.858 8.372 1.00 0.00 H new ATOM 0 HG CYS A 48 -1.541 -6.561 8.860 1.00 0.00 H new ATOM 826 N ARG A 49 0.564 -11.209 7.546 1.00 0.00 N ATOM 827 CA ARG A 49 1.355 -12.426 7.412 1.00 0.00 C ATOM 828 C ARG A 49 1.349 -12.902 5.961 1.00 0.00 C ATOM 829 O ARG A 49 2.322 -13.484 5.481 1.00 0.00 O ATOM 830 CB ARG A 49 0.819 -13.521 8.346 1.00 0.00 C ATOM 831 CG ARG A 49 -0.157 -14.489 7.688 1.00 0.00 C ATOM 832 CD ARG A 49 -1.012 -15.205 8.721 1.00 0.00 C ATOM 833 NE ARG A 49 -0.464 -16.513 9.071 1.00 0.00 N ATOM 834 CZ ARG A 49 -1.055 -17.366 9.905 1.00 0.00 C ATOM 835 NH1 ARG A 49 -2.213 -17.053 10.475 1.00 0.00 N ATOM 836 NH2 ARG A 49 -0.488 -18.535 10.168 1.00 0.00 N ATOM 0 H ARG A 49 -0.327 -11.334 8.027 1.00 0.00 H new ATOM 0 HA ARG A 49 2.384 -12.208 7.699 1.00 0.00 H new ATOM 0 HB2 ARG A 49 1.662 -14.088 8.743 1.00 0.00 H new ATOM 0 HB3 ARG A 49 0.325 -13.048 9.195 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -0.800 -13.945 6.996 1.00 0.00 H new ATOM 0 HG3 ARG A 49 0.396 -15.222 7.101 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -1.087 -14.591 9.619 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -2.023 -15.327 8.333 1.00 0.00 H new ATOM 0 HE ARG A 49 0.424 -16.789 8.652 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -2.654 -16.155 10.275 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -2.661 -17.710 11.113 1.00 0.00 H new ATOM 0 HH21 ARG A 49 0.401 -18.781 9.732 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -0.940 -19.189 10.807 1.00 0.00 H new ATOM 850 N ASP A 50 0.244 -12.641 5.268 1.00 0.00 N ATOM 851 CA ASP A 50 0.103 -13.034 3.871 1.00 0.00 C ATOM 852 C ASP A 50 0.423 -11.868 2.935 1.00 0.00 C ATOM 853 O ASP A 50 0.207 -11.957 1.728 1.00 0.00 O ATOM 854 CB ASP A 50 -1.315 -13.542 3.602 1.00 0.00 C ATOM 855 CG ASP A 50 -1.500 -14.988 4.018 1.00 0.00 C ATOM 856 OD1 ASP A 50 -0.485 -15.702 4.151 1.00 0.00 O ATOM 857 OD2 ASP A 50 -2.661 -15.405 4.210 1.00 0.00 O ATOM 0 H ASP A 50 -0.568 -12.158 5.653 1.00 0.00 H new ATOM 0 HA ASP A 50 0.814 -13.836 3.676 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -2.029 -12.918 4.139 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -1.539 -13.441 2.540 1.00 0.00 H new ATOM 862 N GLY A 51 0.944 -10.778 3.496 1.00 0.00 N ATOM 863 CA GLY A 51 1.291 -9.619 2.693 1.00 0.00 C ATOM 864 C GLY A 51 0.093 -8.999 1.999 1.00 0.00 C ATOM 865 O GLY A 51 0.206 -8.506 0.880 1.00 0.00 O ATOM 0 H GLY A 51 1.132 -10.678 4.494 1.00 0.00 H new ATOM 0 HA2 GLY A 51 1.763 -8.871 3.330 1.00 0.00 H new ATOM 0 HA3 GLY A 51 2.027 -9.910 1.944 1.00 0.00 H new ATOM 869 N ARG A 52 -1.056 -9.022 2.665 1.00 0.00 N ATOM 870 CA ARG A 52 -2.275 -8.453 2.107 1.00 0.00 C ATOM 871 C ARG A 52 -3.204 -7.935 3.190 1.00 0.00 C ATOM 872 O ARG A 52 -3.550 -8.650 4.128 1.00 0.00 O ATOM 873 CB ARG A 52 -3.005 -9.493 1.271 1.00 0.00 C ATOM 874 CG ARG A 52 -2.470 -9.578 -0.135 1.00 0.00 C ATOM 875 CD ARG A 52 -1.995 -10.981 -0.467 1.00 0.00 C ATOM 876 NE ARG A 52 -1.411 -11.062 -1.805 1.00 0.00 N ATOM 877 CZ ARG A 52 -0.794 -12.140 -2.280 1.00 0.00 C ATOM 878 NH1 ARG A 52 -0.677 -13.231 -1.532 1.00 0.00 N ATOM 879 NH2 ARG A 52 -0.291 -12.130 -3.507 1.00 0.00 N ATOM 0 H ARG A 52 -1.168 -9.429 3.593 1.00 0.00 H new ATOM 0 HA ARG A 52 -1.982 -7.611 1.479 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -2.916 -10.468 1.750 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -4.067 -9.249 1.239 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -3.247 -9.280 -0.839 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -1.645 -8.876 -0.254 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -1.257 -11.297 0.270 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -2.834 -11.674 -0.395 1.00 0.00 H new ATOM 0 HE ARG A 52 -1.481 -10.244 -2.410 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -1.062 -13.245 -0.587 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -0.203 -14.055 -1.902 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -0.377 -11.295 -4.087 1.00 0.00 H new ATOM 0 HH22 ARG A 52 0.182 -12.957 -3.871 1.00 0.00 H new ATOM 893 N SER A 53 -3.622 -6.689 3.034 1.00 0.00 N ATOM 894 CA SER A 53 -4.540 -6.064 3.979 1.00 0.00 C ATOM 895 C SER A 53 -5.500 -5.116 3.268 1.00 0.00 C ATOM 896 O SER A 53 -5.220 -4.632 2.166 1.00 0.00 O ATOM 897 CB SER A 53 -3.775 -5.319 5.072 1.00 0.00 C ATOM 898 OG SER A 53 -4.387 -5.503 6.337 1.00 0.00 O ATOM 0 H SER A 53 -3.340 -6.087 2.260 1.00 0.00 H new ATOM 0 HA SER A 53 -5.124 -6.858 4.444 1.00 0.00 H new ATOM 0 HB2 SER A 53 -2.745 -5.675 5.107 1.00 0.00 H new ATOM 0 HB3 SER A 53 -3.737 -4.256 4.834 1.00 0.00 H new ATOM 0 HG SER A 53 -3.752 -5.930 6.949 1.00 0.00 H new ATOM 904 N GLU A 54 -6.623 -4.836 3.920 1.00 0.00 N ATOM 905 CA GLU A 54 -7.623 -3.927 3.378 1.00 0.00 C ATOM 906 C GLU A 54 -7.692 -2.672 4.240 1.00 0.00 C ATOM 907 O GLU A 54 -8.262 -2.690 5.331 1.00 0.00 O ATOM 908 CB GLU A 54 -8.992 -4.606 3.322 1.00 0.00 C ATOM 909 CG GLU A 54 -9.793 -4.260 2.077 1.00 0.00 C ATOM 910 CD GLU A 54 -10.976 -5.186 1.868 1.00 0.00 C ATOM 911 OE1 GLU A 54 -10.974 -6.292 2.450 1.00 0.00 O ATOM 912 OE2 GLU A 54 -11.903 -4.806 1.123 1.00 0.00 O ATOM 0 H GLU A 54 -6.863 -5.229 4.830 1.00 0.00 H new ATOM 0 HA GLU A 54 -7.337 -3.651 2.363 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -8.854 -5.686 3.367 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -9.566 -4.321 4.204 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -10.149 -3.233 2.153 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -9.141 -4.308 1.205 1.00 0.00 H new ATOM 919 N ILE A 55 -7.089 -1.591 3.759 1.00 0.00 N ATOM 920 CA ILE A 55 -7.068 -0.339 4.508 1.00 0.00 C ATOM 921 C ILE A 55 -7.923 0.733 3.844 1.00 0.00 C ATOM 922 O ILE A 55 -7.995 0.822 2.619 1.00 0.00 O ATOM 923 CB ILE A 55 -5.630 0.214 4.686 1.00 0.00 C ATOM 924 CG1 ILE A 55 -4.636 -0.507 3.767 1.00 0.00 C ATOM 925 CG2 ILE A 55 -5.193 0.098 6.140 1.00 0.00 C ATOM 926 CD1 ILE A 55 -4.338 -1.933 4.182 1.00 0.00 C ATOM 0 H ILE A 55 -6.610 -1.555 2.859 1.00 0.00 H new ATOM 0 HA ILE A 55 -7.481 -0.576 5.488 1.00 0.00 H new ATOM 0 HB ILE A 55 -5.639 1.267 4.405 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -5.032 -0.510 2.751 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -3.703 0.057 3.744 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -4.182 0.490 6.248 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -5.874 0.670 6.771 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -5.210 -0.949 6.443 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -3.628 -2.374 3.483 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -3.911 -1.938 5.185 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -5.260 -2.514 4.177 1.00 0.00 H new ATOM 938 N ALA A 56 -8.555 1.552 4.675 1.00 0.00 N ATOM 939 CA ALA A 56 -9.396 2.639 4.198 1.00 0.00 C ATOM 940 C ALA A 56 -8.627 3.950 4.230 1.00 0.00 C ATOM 941 O ALA A 56 -7.684 4.106 5.006 1.00 0.00 O ATOM 942 CB ALA A 56 -10.654 2.744 5.043 1.00 0.00 C ATOM 0 H ALA A 56 -8.499 1.482 5.691 1.00 0.00 H new ATOM 0 HA ALA A 56 -9.687 2.429 3.169 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -11.273 3.562 4.674 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -11.212 1.810 4.982 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -10.380 2.936 6.081 1.00 0.00 H new ATOM 948 N PHE A 57 -9.021 4.888 3.381 1.00 0.00 N ATOM 949 CA PHE A 57 -8.344 6.174 3.320 1.00 0.00 C ATOM 950 C PHE A 57 -9.289 7.293 3.756 1.00 0.00 C ATOM 951 O PHE A 57 -10.372 7.454 3.195 1.00 0.00 O ATOM 952 CB PHE A 57 -7.852 6.419 1.891 1.00 0.00 C ATOM 953 CG PHE A 57 -6.583 7.220 1.794 1.00 0.00 C ATOM 954 CD1 PHE A 57 -6.091 7.923 2.882 1.00 0.00 C ATOM 955 CD2 PHE A 57 -5.871 7.250 0.606 1.00 0.00 C ATOM 956 CE1 PHE A 57 -4.915 8.639 2.786 1.00 0.00 C ATOM 957 CE2 PHE A 57 -4.697 7.967 0.503 1.00 0.00 C ATOM 958 CZ PHE A 57 -4.217 8.663 1.594 1.00 0.00 C ATOM 0 H PHE A 57 -9.799 4.784 2.730 1.00 0.00 H new ATOM 0 HA PHE A 57 -7.491 6.165 3.998 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -7.696 5.456 1.404 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -8.635 6.934 1.335 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -6.634 7.911 3.816 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -6.240 6.705 -0.250 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -4.541 9.180 3.642 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -4.154 7.984 -0.430 1.00 0.00 H new ATOM 0 HZ PHE A 57 -3.298 9.225 1.516 1.00 0.00 H new ATOM 968 N VAL A 58 -8.880 8.058 4.765 1.00 0.00 N ATOM 969 CA VAL A 58 -9.701 9.152 5.274 1.00 0.00 C ATOM 970 C VAL A 58 -9.652 10.367 4.353 1.00 0.00 C ATOM 971 O VAL A 58 -10.568 11.189 4.349 1.00 0.00 O ATOM 972 CB VAL A 58 -9.266 9.580 6.689 1.00 0.00 C ATOM 973 CG1 VAL A 58 -10.264 10.564 7.280 1.00 0.00 C ATOM 974 CG2 VAL A 58 -9.105 8.367 7.594 1.00 0.00 C ATOM 0 H VAL A 58 -7.988 7.941 5.245 1.00 0.00 H new ATOM 0 HA VAL A 58 -10.723 8.774 5.314 1.00 0.00 H new ATOM 0 HB VAL A 58 -8.299 10.077 6.614 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -9.940 10.855 8.279 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -10.322 11.448 6.646 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -11.246 10.095 7.339 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -8.798 8.693 8.588 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -10.055 7.836 7.664 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -8.347 7.702 7.180 1.00 0.00 H new ATOM 984 N ALA A 59 -8.577 10.477 3.574 1.00 0.00 N ATOM 985 CA ALA A 59 -8.411 11.596 2.649 1.00 0.00 C ATOM 986 C ALA A 59 -9.691 11.858 1.859 1.00 0.00 C ATOM 987 O ALA A 59 -10.168 12.991 1.788 1.00 0.00 O ATOM 988 CB ALA A 59 -7.251 11.324 1.701 1.00 0.00 C ATOM 0 H ALA A 59 -7.809 9.806 3.565 1.00 0.00 H new ATOM 0 HA ALA A 59 -8.191 12.489 3.235 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -7.136 12.164 1.016 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -6.334 11.196 2.276 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -7.452 10.416 1.132 1.00 0.00 H new ATOM 994 N THR A 60 -10.241 10.804 1.268 1.00 0.00 N ATOM 995 CA THR A 60 -11.466 10.917 0.486 1.00 0.00 C ATOM 996 C THR A 60 -12.391 9.727 0.731 1.00 0.00 C ATOM 997 O THR A 60 -13.318 9.482 -0.041 1.00 0.00 O ATOM 998 CB THR A 60 -11.135 11.021 -1.004 1.00 0.00 C ATOM 999 OG1 THR A 60 -10.314 9.941 -1.412 1.00 0.00 O ATOM 1000 CG2 THR A 60 -10.421 12.304 -1.370 1.00 0.00 C ATOM 0 H THR A 60 -9.857 9.860 1.316 1.00 0.00 H new ATOM 0 HA THR A 60 -11.983 11.822 0.804 1.00 0.00 H new ATOM 0 HB THR A 60 -12.097 11.001 -1.516 1.00 0.00 H new ATOM 0 HG1 THR A 60 -10.115 10.024 -2.368 1.00 0.00 H new ATOM 0 HG21 THR A 60 -10.216 12.314 -2.440 1.00 0.00 H new ATOM 0 HG22 THR A 60 -11.050 13.156 -1.113 1.00 0.00 H new ATOM 0 HG23 THR A 60 -9.482 12.367 -0.820 1.00 0.00 H new ATOM 1008 N GLY A 61 -12.134 8.984 1.806 1.00 0.00 N ATOM 1009 CA GLY A 61 -12.955 7.829 2.119 1.00 0.00 C ATOM 1010 C GLY A 61 -12.914 6.783 1.024 1.00 0.00 C ATOM 1011 O GLY A 61 -13.955 6.316 0.561 1.00 0.00 O ATOM 0 H GLY A 61 -11.374 9.162 2.463 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -12.614 7.386 3.055 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -13.985 8.149 2.275 1.00 0.00 H new ATOM 1015 N THR A 62 -11.707 6.418 0.605 1.00 0.00 N ATOM 1016 CA THR A 62 -11.530 5.425 -0.448 1.00 0.00 C ATOM 1017 C THR A 62 -10.964 4.123 0.111 1.00 0.00 C ATOM 1018 O THR A 62 -9.958 4.127 0.820 1.00 0.00 O ATOM 1019 CB THR A 62 -10.598 5.969 -1.535 1.00 0.00 C ATOM 1020 OG1 THR A 62 -10.343 4.981 -2.516 1.00 0.00 O ATOM 1021 CG2 THR A 62 -9.263 6.444 -1.000 1.00 0.00 C ATOM 0 H THR A 62 -10.836 6.795 0.979 1.00 0.00 H new ATOM 0 HA THR A 62 -12.509 5.216 -0.880 1.00 0.00 H new ATOM 0 HB THR A 62 -11.122 6.824 -1.963 1.00 0.00 H new ATOM 0 HG1 THR A 62 -9.747 5.348 -3.202 1.00 0.00 H new ATOM 0 HG21 THR A 62 -8.653 6.816 -1.823 1.00 0.00 H new ATOM 0 HG22 THR A 62 -9.424 7.244 -0.277 1.00 0.00 H new ATOM 0 HG23 THR A 62 -8.750 5.614 -0.514 1.00 0.00 H new ATOM 1029 N ASN A 63 -11.608 3.009 -0.226 1.00 0.00 N ATOM 1030 CA ASN A 63 -11.156 1.700 0.231 1.00 0.00 C ATOM 1031 C ASN A 63 -9.993 1.227 -0.631 1.00 0.00 C ATOM 1032 O ASN A 63 -9.970 1.474 -1.837 1.00 0.00 O ATOM 1033 CB ASN A 63 -12.301 0.687 0.173 1.00 0.00 C ATOM 1034 CG ASN A 63 -11.947 -0.625 0.844 1.00 0.00 C ATOM 1035 OD1 ASN A 63 -12.062 -1.694 0.243 1.00 0.00 O ATOM 1036 ND2 ASN A 63 -11.515 -0.552 2.097 1.00 0.00 N ATOM 0 H ASN A 63 -12.442 2.987 -0.812 1.00 0.00 H new ATOM 0 HA ASN A 63 -10.824 1.785 1.266 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -13.182 1.111 0.654 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -12.564 0.500 -0.868 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -11.263 -1.403 2.600 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -11.435 0.355 2.557 1.00 0.00 H new ATOM 1043 N LEU A 64 -9.016 0.569 -0.016 1.00 0.00 N ATOM 1044 CA LEU A 64 -7.852 0.102 -0.758 1.00 0.00 C ATOM 1045 C LEU A 64 -7.371 -1.270 -0.296 1.00 0.00 C ATOM 1046 O LEU A 64 -7.000 -1.456 0.864 1.00 0.00 O ATOM 1047 CB LEU A 64 -6.709 1.110 -0.622 1.00 0.00 C ATOM 1048 CG LEU A 64 -7.023 2.522 -1.126 1.00 0.00 C ATOM 1049 CD1 LEU A 64 -6.789 3.548 -0.028 1.00 0.00 C ATOM 1050 CD2 LEU A 64 -6.181 2.851 -2.351 1.00 0.00 C ATOM 0 H LEU A 64 -9.006 0.350 0.980 1.00 0.00 H new ATOM 0 HA LEU A 64 -8.157 0.010 -1.800 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -6.423 1.171 0.428 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -5.844 0.731 -1.167 1.00 0.00 H new ATOM 0 HG LEU A 64 -8.075 2.558 -1.410 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -7.018 4.544 -0.406 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -7.435 3.325 0.822 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -5.747 3.511 0.289 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -6.417 3.858 -2.695 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -5.124 2.795 -2.092 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -6.398 2.136 -3.144 1.00 0.00 H new ATOM 1062 N SER A 65 -7.336 -2.210 -1.232 1.00 0.00 N ATOM 1063 CA SER A 65 -6.851 -3.558 -0.962 1.00 0.00 C ATOM 1064 C SER A 65 -5.481 -3.703 -1.607 1.00 0.00 C ATOM 1065 O SER A 65 -5.364 -3.697 -2.832 1.00 0.00 O ATOM 1066 CB SER A 65 -7.819 -4.605 -1.519 1.00 0.00 C ATOM 1067 OG SER A 65 -9.165 -4.239 -1.274 1.00 0.00 O ATOM 0 H SER A 65 -7.641 -2.061 -2.194 1.00 0.00 H new ATOM 0 HA SER A 65 -6.780 -3.719 0.114 1.00 0.00 H new ATOM 0 HB2 SER A 65 -7.659 -4.718 -2.591 1.00 0.00 H new ATOM 0 HB3 SER A 65 -7.614 -5.573 -1.063 1.00 0.00 H new ATOM 0 HG SER A 65 -9.762 -4.924 -1.641 1.00 0.00 H new ATOM 1073 N LEU A 66 -4.437 -3.781 -0.789 1.00 0.00 N ATOM 1074 CA LEU A 66 -3.081 -3.861 -1.323 1.00 0.00 C ATOM 1075 C LEU A 66 -2.339 -5.120 -0.901 1.00 0.00 C ATOM 1076 O LEU A 66 -2.569 -5.671 0.176 1.00 0.00 O ATOM 1077 CB LEU A 66 -2.278 -2.637 -0.884 1.00 0.00 C ATOM 1078 CG LEU A 66 -2.947 -1.291 -1.162 1.00 0.00 C ATOM 1079 CD1 LEU A 66 -3.625 -0.762 0.093 1.00 0.00 C ATOM 1080 CD2 LEU A 66 -1.924 -0.294 -1.678 1.00 0.00 C ATOM 0 H LEU A 66 -4.500 -3.791 0.229 1.00 0.00 H new ATOM 0 HA LEU A 66 -3.179 -3.894 -2.408 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.082 -2.714 0.185 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -1.311 -2.656 -1.387 1.00 0.00 H new ATOM 0 HG LEU A 66 -3.710 -1.433 -1.927 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -4.096 0.197 -0.124 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -4.383 -1.472 0.424 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -2.882 -0.631 0.880 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.412 0.661 -1.872 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.142 -0.156 -0.932 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.483 -0.670 -2.601 1.00 0.00 H new ATOM 1092 N GLN A 67 -1.418 -5.540 -1.762 1.00 0.00 N ATOM 1093 CA GLN A 67 -0.588 -6.707 -1.507 1.00 0.00 C ATOM 1094 C GLN A 67 0.857 -6.262 -1.311 1.00 0.00 C ATOM 1095 O GLN A 67 1.547 -5.912 -2.267 1.00 0.00 O ATOM 1096 CB GLN A 67 -0.680 -7.701 -2.666 1.00 0.00 C ATOM 1097 CG GLN A 67 -2.089 -7.879 -3.207 1.00 0.00 C ATOM 1098 CD GLN A 67 -2.154 -8.880 -4.345 1.00 0.00 C ATOM 1099 OE1 GLN A 67 -1.128 -9.363 -4.822 1.00 0.00 O ATOM 1100 NE2 GLN A 67 -3.367 -9.196 -4.785 1.00 0.00 N ATOM 0 H GLN A 67 -1.228 -5.081 -2.653 1.00 0.00 H new ATOM 0 HA GLN A 67 -0.943 -7.205 -0.605 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -0.030 -7.365 -3.474 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -0.303 -8.668 -2.334 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -2.745 -8.208 -2.401 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -2.466 -6.916 -3.553 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -4.191 -8.771 -4.360 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -3.475 -9.864 -5.548 1.00 0.00 H new ATOM 1109 N PHE A 68 1.299 -6.265 -0.060 1.00 0.00 N ATOM 1110 CA PHE A 68 2.655 -5.847 0.276 1.00 0.00 C ATOM 1111 C PHE A 68 3.580 -7.004 0.630 1.00 0.00 C ATOM 1112 O PHE A 68 3.354 -7.757 1.577 1.00 0.00 O ATOM 1113 CB PHE A 68 2.652 -4.781 1.379 1.00 0.00 C ATOM 1114 CG PHE A 68 1.359 -4.661 2.136 1.00 0.00 C ATOM 1115 CD1 PHE A 68 0.788 -5.742 2.797 1.00 0.00 C ATOM 1116 CD2 PHE A 68 0.709 -3.440 2.169 1.00 0.00 C ATOM 1117 CE1 PHE A 68 -0.408 -5.594 3.476 1.00 0.00 C ATOM 1118 CE2 PHE A 68 -0.481 -3.289 2.841 1.00 0.00 C ATOM 1119 CZ PHE A 68 -1.041 -4.364 3.496 1.00 0.00 C ATOM 0 H PHE A 68 0.737 -6.553 0.741 1.00 0.00 H new ATOM 0 HA PHE A 68 3.064 -5.404 -0.632 1.00 0.00 H new ATOM 0 HB2 PHE A 68 3.451 -5.007 2.085 1.00 0.00 H new ATOM 0 HB3 PHE A 68 2.886 -3.815 0.932 1.00 0.00 H new ATOM 0 HD1 PHE A 68 1.281 -6.703 2.780 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.143 -2.593 1.659 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -0.847 -6.437 3.989 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.976 -2.329 2.855 1.00 0.00 H new ATOM 0 HZ PHE A 68 -1.975 -4.246 4.026 1.00 0.00 H new ATOM 1129 N PHE A 69 4.640 -7.100 -0.164 1.00 0.00 N ATOM 1130 CA PHE A 69 5.677 -8.113 -0.014 1.00 0.00 C ATOM 1131 C PHE A 69 6.951 -7.641 -0.707 1.00 0.00 C ATOM 1132 O PHE A 69 6.891 -6.836 -1.637 1.00 0.00 O ATOM 1133 CB PHE A 69 5.235 -9.449 -0.615 1.00 0.00 C ATOM 1134 CG PHE A 69 4.541 -10.361 0.357 1.00 0.00 C ATOM 1135 CD1 PHE A 69 4.989 -10.481 1.665 1.00 0.00 C ATOM 1136 CD2 PHE A 69 3.446 -11.107 -0.044 1.00 0.00 C ATOM 1137 CE1 PHE A 69 4.352 -11.328 2.552 1.00 0.00 C ATOM 1138 CE2 PHE A 69 2.808 -11.956 0.838 1.00 0.00 C ATOM 1139 CZ PHE A 69 3.262 -12.066 2.139 1.00 0.00 C ATOM 0 H PHE A 69 4.806 -6.464 -0.944 1.00 0.00 H new ATOM 0 HA PHE A 69 5.862 -8.260 1.050 1.00 0.00 H new ATOM 0 HB2 PHE A 69 4.567 -9.254 -1.454 1.00 0.00 H new ATOM 0 HB3 PHE A 69 6.109 -9.961 -1.016 1.00 0.00 H new ATOM 0 HD1 PHE A 69 5.843 -9.907 1.993 1.00 0.00 H new ATOM 0 HD2 PHE A 69 3.087 -11.024 -1.059 1.00 0.00 H new ATOM 0 HE1 PHE A 69 4.707 -11.412 3.568 1.00 0.00 H new ATOM 0 HE2 PHE A 69 1.955 -12.533 0.512 1.00 0.00 H new ATOM 0 HZ PHE A 69 2.764 -12.729 2.831 1.00 0.00 H new ATOM 1149 N PRO A 70 8.122 -8.135 -0.283 1.00 0.00 N ATOM 1150 CA PRO A 70 9.396 -7.747 -0.893 1.00 0.00 C ATOM 1151 C PRO A 70 9.437 -8.073 -2.382 1.00 0.00 C ATOM 1152 O PRO A 70 9.468 -9.241 -2.773 1.00 0.00 O ATOM 1153 CB PRO A 70 10.439 -8.572 -0.127 1.00 0.00 C ATOM 1154 CG PRO A 70 9.668 -9.668 0.530 1.00 0.00 C ATOM 1155 CD PRO A 70 8.302 -9.108 0.805 1.00 0.00 C ATOM 0 HA PRO A 70 9.569 -6.673 -0.829 1.00 0.00 H new ATOM 0 HB2 PRO A 70 11.196 -8.973 -0.801 1.00 0.00 H new ATOM 0 HB3 PRO A 70 10.960 -7.961 0.610 1.00 0.00 H new ATOM 0 HG2 PRO A 70 9.608 -10.544 -0.116 1.00 0.00 H new ATOM 0 HG3 PRO A 70 10.152 -9.986 1.453 1.00 0.00 H new ATOM 0 HD2 PRO A 70 7.536 -9.883 0.785 1.00 0.00 H new ATOM 0 HD3 PRO A 70 8.250 -8.633 1.785 1.00 0.00 H new ATOM 1163 N ALA A 71 9.434 -7.031 -3.207 1.00 0.00 N ATOM 1164 CA ALA A 71 9.465 -7.194 -4.656 1.00 0.00 C ATOM 1165 C ALA A 71 10.756 -7.864 -5.123 1.00 0.00 C ATOM 1166 O ALA A 71 10.845 -8.324 -6.261 1.00 0.00 O ATOM 1167 CB ALA A 71 9.293 -5.845 -5.339 1.00 0.00 C ATOM 0 H ALA A 71 9.410 -6.060 -2.895 1.00 0.00 H new ATOM 0 HA ALA A 71 8.637 -7.846 -4.934 1.00 0.00 H new ATOM 0 HB1 ALA A 71 9.318 -5.979 -6.420 1.00 0.00 H new ATOM 0 HB2 ALA A 71 8.337 -5.410 -5.049 1.00 0.00 H new ATOM 0 HB3 ALA A 71 10.101 -5.179 -5.037 1.00 0.00 H new ATOM 1173 N SER A 72 11.755 -7.914 -4.245 1.00 0.00 N ATOM 1174 CA SER A 72 13.036 -8.527 -4.584 1.00 0.00 C ATOM 1175 C SER A 72 13.050 -10.016 -4.245 1.00 0.00 C ATOM 1176 O SER A 72 14.111 -10.598 -4.023 1.00 0.00 O ATOM 1177 CB SER A 72 14.171 -7.816 -3.847 1.00 0.00 C ATOM 1178 OG SER A 72 14.170 -6.427 -4.125 1.00 0.00 O ATOM 0 H SER A 72 11.703 -7.539 -3.298 1.00 0.00 H new ATOM 0 HA SER A 72 13.180 -8.424 -5.659 1.00 0.00 H new ATOM 0 HB2 SER A 72 14.067 -7.975 -2.774 1.00 0.00 H new ATOM 0 HB3 SER A 72 15.127 -8.248 -4.142 1.00 0.00 H new ATOM 0 HG SER A 72 14.904 -5.996 -3.640 1.00 0.00 H new ATOM 1184 N TRP A 73 11.871 -10.632 -4.210 1.00 0.00 N ATOM 1185 CA TRP A 73 11.764 -12.054 -3.902 1.00 0.00 C ATOM 1186 C TRP A 73 11.459 -12.861 -5.160 1.00 0.00 C ATOM 1187 O TRP A 73 10.348 -12.810 -5.688 1.00 0.00 O ATOM 1188 CB TRP A 73 10.675 -12.290 -2.854 1.00 0.00 C ATOM 1189 CG TRP A 73 11.189 -12.263 -1.447 1.00 0.00 C ATOM 1190 CD1 TRP A 73 12.142 -11.427 -0.939 1.00 0.00 C ATOM 1191 CD2 TRP A 73 10.782 -13.111 -0.368 1.00 0.00 C ATOM 1192 NE1 TRP A 73 12.351 -11.703 0.391 1.00 0.00 N ATOM 1193 CE2 TRP A 73 11.528 -12.732 0.764 1.00 0.00 C ATOM 1194 CE3 TRP A 73 9.858 -14.153 -0.248 1.00 0.00 C ATOM 1195 CZ2 TRP A 73 11.378 -13.360 1.998 1.00 0.00 C ATOM 1196 CZ3 TRP A 73 9.710 -14.775 0.977 1.00 0.00 C ATOM 1197 CH2 TRP A 73 10.467 -14.377 2.086 1.00 0.00 C ATOM 0 H TRP A 73 10.980 -10.170 -4.391 1.00 0.00 H new ATOM 0 HA TRP A 73 12.722 -12.387 -3.501 1.00 0.00 H new ATOM 0 HB2 TRP A 73 9.902 -11.529 -2.966 1.00 0.00 H new ATOM 0 HB3 TRP A 73 10.203 -13.254 -3.042 1.00 0.00 H new ATOM 0 HD1 TRP A 73 12.656 -10.661 -1.500 1.00 0.00 H new ATOM 0 HE1 TRP A 73 13.011 -11.220 1.001 1.00 0.00 H new ATOM 0 HE3 TRP A 73 9.270 -14.466 -1.098 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 11.960 -13.055 2.855 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 8.999 -15.581 1.081 1.00 0.00 H new ATOM 0 HH2 TRP A 73 10.329 -14.883 3.030 1.00 0.00 H new ATOM 1208 N GLN A 74 12.453 -13.606 -5.634 1.00 0.00 N ATOM 1209 CA GLN A 74 12.293 -14.425 -6.830 1.00 0.00 C ATOM 1210 C GLN A 74 12.440 -15.907 -6.499 1.00 0.00 C ATOM 1211 O GLN A 74 13.496 -16.350 -6.050 1.00 0.00 O ATOM 1212 CB GLN A 74 13.321 -14.023 -7.890 1.00 0.00 C ATOM 1213 CG GLN A 74 12.901 -12.822 -8.722 1.00 0.00 C ATOM 1214 CD GLN A 74 12.903 -13.113 -10.210 1.00 0.00 C ATOM 1215 OE1 GLN A 74 13.923 -12.963 -10.882 1.00 0.00 O ATOM 1216 NE2 GLN A 74 11.756 -13.532 -10.733 1.00 0.00 N ATOM 0 H GLN A 74 13.378 -13.659 -5.208 1.00 0.00 H new ATOM 0 HA GLN A 74 11.290 -14.257 -7.223 1.00 0.00 H new ATOM 0 HB2 GLN A 74 14.268 -13.801 -7.399 1.00 0.00 H new ATOM 0 HB3 GLN A 74 13.497 -14.870 -8.553 1.00 0.00 H new ATOM 0 HG2 GLN A 74 11.903 -12.506 -8.419 1.00 0.00 H new ATOM 0 HG3 GLN A 74 13.575 -11.990 -8.518 1.00 0.00 H new ATOM 0 HE21 GLN A 74 10.935 -13.642 -10.138 1.00 0.00 H new ATOM 0 HE22 GLN A 74 11.697 -13.743 -11.729 1.00 0.00 H new ATOM 1225 N GLY A 75 11.372 -16.666 -6.720 1.00 0.00 N ATOM 1226 CA GLY A 75 11.404 -18.089 -6.435 1.00 0.00 C ATOM 1227 C GLY A 75 10.899 -18.416 -5.046 1.00 0.00 C ATOM 1228 O GLY A 75 10.501 -19.549 -4.775 1.00 0.00 O ATOM 0 H GLY A 75 10.486 -16.322 -7.091 1.00 0.00 H new ATOM 0 HA2 GLY A 75 10.798 -18.617 -7.171 1.00 0.00 H new ATOM 0 HA3 GLY A 75 12.425 -18.454 -6.542 1.00 0.00 H new ATOM 1232 N GLU A 76 10.911 -17.425 -4.161 1.00 0.00 N ATOM 1233 CA GLU A 76 10.446 -17.618 -2.795 1.00 0.00 C ATOM 1234 C GLU A 76 8.929 -17.778 -2.761 1.00 0.00 C ATOM 1235 O GLU A 76 8.220 -16.947 -2.195 1.00 0.00 O ATOM 1236 CB GLU A 76 10.870 -16.439 -1.917 1.00 0.00 C ATOM 1237 CG GLU A 76 12.377 -16.303 -1.766 1.00 0.00 C ATOM 1238 CD GLU A 76 12.866 -16.724 -0.394 1.00 0.00 C ATOM 1239 OE1 GLU A 76 12.479 -16.074 0.600 1.00 0.00 O ATOM 1240 OE2 GLU A 76 13.637 -17.704 -0.313 1.00 0.00 O ATOM 0 H GLU A 76 11.238 -16.481 -4.366 1.00 0.00 H new ATOM 0 HA GLU A 76 10.900 -18.529 -2.405 1.00 0.00 H new ATOM 0 HB2 GLU A 76 10.471 -15.518 -2.343 1.00 0.00 H new ATOM 0 HB3 GLU A 76 10.423 -16.553 -0.929 1.00 0.00 H new ATOM 0 HG2 GLU A 76 12.871 -16.909 -2.525 1.00 0.00 H new ATOM 0 HG3 GLU A 76 12.665 -15.268 -1.948 1.00 0.00 H new ATOM 1247 N GLN A 77 8.438 -18.854 -3.377 1.00 0.00 N ATOM 1248 CA GLN A 77 7.003 -19.131 -3.426 1.00 0.00 C ATOM 1249 C GLN A 77 6.340 -18.862 -2.077 1.00 0.00 C ATOM 1250 O GLN A 77 5.313 -18.186 -2.003 1.00 0.00 O ATOM 1251 CB GLN A 77 6.757 -20.581 -3.849 1.00 0.00 C ATOM 1252 CG GLN A 77 7.403 -21.602 -2.926 1.00 0.00 C ATOM 1253 CD GLN A 77 7.267 -23.022 -3.442 1.00 0.00 C ATOM 1254 OE1 GLN A 77 6.235 -23.394 -3.999 1.00 0.00 O ATOM 1255 NE2 GLN A 77 8.311 -23.821 -3.257 1.00 0.00 N ATOM 0 H GLN A 77 9.015 -19.549 -3.850 1.00 0.00 H new ATOM 0 HA GLN A 77 6.559 -18.462 -4.163 1.00 0.00 H new ATOM 0 HB2 GLN A 77 5.683 -20.763 -3.884 1.00 0.00 H new ATOM 0 HB3 GLN A 77 7.138 -20.725 -4.860 1.00 0.00 H new ATOM 0 HG2 GLN A 77 8.460 -21.362 -2.807 1.00 0.00 H new ATOM 0 HG3 GLN A 77 6.948 -21.533 -1.938 1.00 0.00 H new ATOM 0 HE21 GLN A 77 9.146 -23.469 -2.790 1.00 0.00 H new ATOM 0 HE22 GLN A 77 8.278 -24.787 -3.582 1.00 0.00 H new ATOM 1264 N ARG A 78 6.936 -19.390 -1.013 1.00 0.00 N ATOM 1265 CA ARG A 78 6.408 -19.201 0.329 1.00 0.00 C ATOM 1266 C ARG A 78 6.276 -17.719 0.663 1.00 0.00 C ATOM 1267 O ARG A 78 7.179 -16.930 0.387 1.00 0.00 O ATOM 1268 CB ARG A 78 7.300 -19.893 1.353 1.00 0.00 C ATOM 1269 CG ARG A 78 6.886 -21.322 1.630 1.00 0.00 C ATOM 1270 CD ARG A 78 8.082 -22.238 1.581 1.00 0.00 C ATOM 1271 NE ARG A 78 7.915 -23.416 2.428 1.00 0.00 N ATOM 1272 CZ ARG A 78 7.096 -24.425 2.142 1.00 0.00 C ATOM 1273 NH1 ARG A 78 6.367 -24.404 1.033 1.00 0.00 N ATOM 1274 NH2 ARG A 78 7.004 -25.459 2.968 1.00 0.00 N ATOM 0 H ARG A 78 7.786 -19.952 -1.056 1.00 0.00 H new ATOM 0 HA ARG A 78 5.415 -19.648 0.366 1.00 0.00 H new ATOM 0 HB2 ARG A 78 8.330 -19.882 0.996 1.00 0.00 H new ATOM 0 HB3 ARG A 78 7.280 -19.328 2.285 1.00 0.00 H new ATOM 0 HG2 ARG A 78 6.412 -21.386 2.609 1.00 0.00 H new ATOM 0 HG3 ARG A 78 6.146 -21.641 0.896 1.00 0.00 H new ATOM 0 HD2 ARG A 78 8.252 -22.555 0.552 1.00 0.00 H new ATOM 0 HD3 ARG A 78 8.970 -21.690 1.897 1.00 0.00 H new ATOM 0 HE ARG A 78 8.458 -23.468 3.290 1.00 0.00 H new ATOM 0 HH11 ARG A 78 6.433 -23.611 0.394 1.00 0.00 H new ATOM 0 HH12 ARG A 78 5.741 -25.181 0.819 1.00 0.00 H new ATOM 0 HH21 ARG A 78 7.561 -25.480 3.822 1.00 0.00 H new ATOM 0 HH22 ARG A 78 6.376 -26.232 2.749 1.00 0.00 H new ATOM 1288 N GLN A 79 5.148 -17.347 1.255 1.00 0.00 N ATOM 1289 CA GLN A 79 4.907 -15.956 1.621 1.00 0.00 C ATOM 1290 C GLN A 79 5.295 -15.698 3.072 1.00 0.00 C ATOM 1291 O GLN A 79 4.743 -16.303 3.991 1.00 0.00 O ATOM 1292 CB GLN A 79 3.436 -15.597 1.402 1.00 0.00 C ATOM 1293 CG GLN A 79 3.100 -15.264 -0.043 1.00 0.00 C ATOM 1294 CD GLN A 79 1.686 -15.662 -0.419 1.00 0.00 C ATOM 1295 OE1 GLN A 79 0.776 -15.622 0.408 1.00 0.00 O ATOM 1296 NE2 GLN A 79 1.496 -16.052 -1.674 1.00 0.00 N ATOM 0 H GLN A 79 4.388 -17.985 1.491 1.00 0.00 H new ATOM 0 HA GLN A 79 5.527 -15.327 0.982 1.00 0.00 H new ATOM 0 HB2 GLN A 79 2.815 -16.431 1.728 1.00 0.00 H new ATOM 0 HB3 GLN A 79 3.181 -14.744 2.031 1.00 0.00 H new ATOM 0 HG2 GLN A 79 3.227 -14.194 -0.204 1.00 0.00 H new ATOM 0 HG3 GLN A 79 3.804 -15.772 -0.702 1.00 0.00 H new ATOM 0 HE21 GLN A 79 2.280 -16.070 -2.327 1.00 0.00 H new ATOM 0 HE22 GLN A 79 0.566 -16.334 -1.985 1.00 0.00 H new ATOM 1305 N THR A 80 6.245 -14.789 3.270 1.00 0.00 N ATOM 1306 CA THR A 80 6.706 -14.440 4.595 1.00 0.00 C ATOM 1307 C THR A 80 6.577 -12.937 4.837 1.00 0.00 C ATOM 1308 O THR A 80 6.971 -12.132 3.993 1.00 0.00 O ATOM 1309 CB THR A 80 8.156 -14.882 4.793 1.00 0.00 C ATOM 1310 OG1 THR A 80 8.314 -16.248 4.456 1.00 0.00 O ATOM 1311 CG2 THR A 80 8.650 -14.699 6.212 1.00 0.00 C ATOM 0 H THR A 80 6.709 -14.281 2.517 1.00 0.00 H new ATOM 0 HA THR A 80 6.079 -14.961 5.318 1.00 0.00 H new ATOM 0 HB THR A 80 8.745 -14.242 4.136 1.00 0.00 H new ATOM 0 HG1 THR A 80 9.249 -16.511 4.588 1.00 0.00 H new ATOM 0 HG21 THR A 80 9.685 -15.032 6.283 1.00 0.00 H new ATOM 0 HG22 THR A 80 8.588 -13.646 6.486 1.00 0.00 H new ATOM 0 HG23 THR A 80 8.033 -15.287 6.891 1.00 0.00 H new ATOM 1319 N PRO A 81 6.023 -12.534 5.994 1.00 0.00 N ATOM 1320 CA PRO A 81 5.849 -11.123 6.331 1.00 0.00 C ATOM 1321 C PRO A 81 7.113 -10.511 6.920 1.00 0.00 C ATOM 1322 O PRO A 81 7.441 -10.743 8.083 1.00 0.00 O ATOM 1323 CB PRO A 81 4.745 -11.170 7.379 1.00 0.00 C ATOM 1324 CG PRO A 81 4.977 -12.454 8.095 1.00 0.00 C ATOM 1325 CD PRO A 81 5.520 -13.417 7.066 1.00 0.00 C ATOM 0 HA PRO A 81 5.618 -10.510 5.460 1.00 0.00 H new ATOM 0 HB2 PRO A 81 4.803 -10.319 8.058 1.00 0.00 H new ATOM 0 HB3 PRO A 81 3.757 -11.143 6.919 1.00 0.00 H new ATOM 0 HG2 PRO A 81 5.683 -12.321 8.915 1.00 0.00 H new ATOM 0 HG3 PRO A 81 4.051 -12.830 8.530 1.00 0.00 H new ATOM 0 HD2 PRO A 81 6.314 -14.039 7.479 1.00 0.00 H new ATOM 0 HD3 PRO A 81 4.746 -14.091 6.700 1.00 0.00 H new ATOM 1333 N SER A 82 7.819 -9.726 6.116 1.00 0.00 N ATOM 1334 CA SER A 82 9.044 -9.084 6.573 1.00 0.00 C ATOM 1335 C SER A 82 8.822 -7.592 6.774 1.00 0.00 C ATOM 1336 O SER A 82 8.092 -6.957 6.013 1.00 0.00 O ATOM 1337 CB SER A 82 10.172 -9.314 5.566 1.00 0.00 C ATOM 1338 OG SER A 82 9.715 -9.131 4.237 1.00 0.00 O ATOM 0 H SER A 82 7.566 -9.520 5.150 1.00 0.00 H new ATOM 0 HA SER A 82 9.327 -9.527 7.528 1.00 0.00 H new ATOM 0 HB2 SER A 82 10.992 -8.625 5.770 1.00 0.00 H new ATOM 0 HB3 SER A 82 10.567 -10.323 5.682 1.00 0.00 H new ATOM 0 HG SER A 82 10.455 -9.282 3.613 1.00 0.00 H new ATOM 1344 N ARG A 83 9.461 -7.030 7.797 1.00 0.00 N ATOM 1345 CA ARG A 83 9.326 -5.603 8.081 1.00 0.00 C ATOM 1346 C ARG A 83 9.874 -4.749 6.934 1.00 0.00 C ATOM 1347 O ARG A 83 9.823 -3.521 6.992 1.00 0.00 O ATOM 1348 CB ARG A 83 10.016 -5.217 9.399 1.00 0.00 C ATOM 1349 CG ARG A 83 11.242 -6.052 9.746 1.00 0.00 C ATOM 1350 CD ARG A 83 10.984 -6.937 10.958 1.00 0.00 C ATOM 1351 NE ARG A 83 11.972 -8.007 11.077 1.00 0.00 N ATOM 1352 CZ ARG A 83 11.806 -9.237 10.592 1.00 0.00 C ATOM 1353 NH1 ARG A 83 10.691 -9.565 9.948 1.00 0.00 N ATOM 1354 NH2 ARG A 83 12.760 -10.144 10.749 1.00 0.00 N ATOM 0 H ARG A 83 10.072 -7.535 8.438 1.00 0.00 H new ATOM 0 HA ARG A 83 8.259 -5.404 8.183 1.00 0.00 H new ATOM 0 HB2 ARG A 83 10.311 -4.169 9.345 1.00 0.00 H new ATOM 0 HB3 ARG A 83 9.293 -5.304 10.210 1.00 0.00 H new ATOM 0 HG2 ARG A 83 11.516 -6.672 8.892 1.00 0.00 H new ATOM 0 HG3 ARG A 83 12.088 -5.394 9.947 1.00 0.00 H new ATOM 0 HD2 ARG A 83 11.000 -6.327 11.861 1.00 0.00 H new ATOM 0 HD3 ARG A 83 9.987 -7.371 10.884 1.00 0.00 H new ATOM 0 HE ARG A 83 12.845 -7.799 11.562 1.00 0.00 H new ATOM 0 HH11 ARG A 83 9.953 -8.873 9.821 1.00 0.00 H new ATOM 0 HH12 ARG A 83 10.573 -10.509 9.580 1.00 0.00 H new ATOM 0 HH21 ARG A 83 13.620 -9.900 11.241 1.00 0.00 H new ATOM 0 HH22 ARG A 83 12.634 -11.086 10.378 1.00 0.00 H new ATOM 1368 N GLU A 84 10.374 -5.401 5.884 1.00 0.00 N ATOM 1369 CA GLU A 84 10.899 -4.690 4.729 1.00 0.00 C ATOM 1370 C GLU A 84 9.752 -4.050 3.971 1.00 0.00 C ATOM 1371 O GLU A 84 9.836 -2.899 3.542 1.00 0.00 O ATOM 1372 CB GLU A 84 11.676 -5.649 3.822 1.00 0.00 C ATOM 1373 CG GLU A 84 13.149 -5.299 3.689 1.00 0.00 C ATOM 1374 CD GLU A 84 13.758 -5.817 2.402 1.00 0.00 C ATOM 1375 OE1 GLU A 84 13.702 -7.043 2.170 1.00 0.00 O ATOM 1376 OE2 GLU A 84 14.293 -4.998 1.626 1.00 0.00 O ATOM 0 H GLU A 84 10.424 -6.417 5.814 1.00 0.00 H new ATOM 0 HA GLU A 84 11.584 -3.911 5.064 1.00 0.00 H new ATOM 0 HB2 GLU A 84 11.586 -6.662 4.215 1.00 0.00 H new ATOM 0 HB3 GLU A 84 11.220 -5.650 2.832 1.00 0.00 H new ATOM 0 HG2 GLU A 84 13.266 -4.216 3.732 1.00 0.00 H new ATOM 0 HG3 GLU A 84 13.695 -5.713 4.537 1.00 0.00 H new ATOM 1383 N TYR A 85 8.670 -4.805 3.824 1.00 0.00 N ATOM 1384 CA TYR A 85 7.490 -4.318 3.134 1.00 0.00 C ATOM 1385 C TYR A 85 6.285 -4.348 4.065 1.00 0.00 C ATOM 1386 O TYR A 85 5.479 -3.425 4.076 1.00 0.00 O ATOM 1387 CB TYR A 85 7.224 -5.138 1.878 1.00 0.00 C ATOM 1388 CG TYR A 85 8.104 -4.728 0.723 1.00 0.00 C ATOM 1389 CD1 TYR A 85 9.473 -4.589 0.894 1.00 0.00 C ATOM 1390 CD2 TYR A 85 7.570 -4.474 -0.532 1.00 0.00 C ATOM 1391 CE1 TYR A 85 10.290 -4.211 -0.154 1.00 0.00 C ATOM 1392 CE2 TYR A 85 8.378 -4.096 -1.587 1.00 0.00 C ATOM 1393 CZ TYR A 85 9.737 -3.966 -1.393 1.00 0.00 C ATOM 1394 OH TYR A 85 10.545 -3.590 -2.441 1.00 0.00 O ATOM 0 H TYR A 85 8.589 -5.759 4.176 1.00 0.00 H new ATOM 0 HA TYR A 85 7.666 -3.286 2.831 1.00 0.00 H new ATOM 0 HB2 TYR A 85 7.385 -6.194 2.096 1.00 0.00 H new ATOM 0 HB3 TYR A 85 6.178 -5.028 1.591 1.00 0.00 H new ATOM 0 HD1 TYR A 85 9.908 -4.780 1.864 1.00 0.00 H new ATOM 0 HD2 TYR A 85 6.506 -4.573 -0.687 1.00 0.00 H new ATOM 0 HE1 TYR A 85 11.355 -4.108 -0.004 1.00 0.00 H new ATOM 0 HE2 TYR A 85 7.947 -3.903 -2.559 1.00 0.00 H new ATOM 0 HH TYR A 85 9.999 -3.457 -3.244 1.00 0.00 H new ATOM 1404 N VAL A 86 6.182 -5.403 4.868 1.00 0.00 N ATOM 1405 CA VAL A 86 5.092 -5.523 5.819 1.00 0.00 C ATOM 1406 C VAL A 86 5.643 -5.702 7.225 1.00 0.00 C ATOM 1407 O VAL A 86 6.202 -6.747 7.557 1.00 0.00 O ATOM 1408 CB VAL A 86 4.160 -6.699 5.496 1.00 0.00 C ATOM 1409 CG1 VAL A 86 3.198 -6.329 4.381 1.00 0.00 C ATOM 1410 CG2 VAL A 86 4.949 -7.946 5.137 1.00 0.00 C ATOM 0 H VAL A 86 6.840 -6.182 4.876 1.00 0.00 H new ATOM 0 HA VAL A 86 4.511 -4.603 5.751 1.00 0.00 H new ATOM 0 HB VAL A 86 3.579 -6.921 6.391 1.00 0.00 H new ATOM 0 HG11 VAL A 86 2.546 -7.176 4.167 1.00 0.00 H new ATOM 0 HG12 VAL A 86 2.595 -5.475 4.689 1.00 0.00 H new ATOM 0 HG13 VAL A 86 3.762 -6.070 3.485 1.00 0.00 H new ATOM 0 HG21 VAL A 86 4.260 -8.761 4.914 1.00 0.00 H new ATOM 0 HG22 VAL A 86 5.569 -7.745 4.263 1.00 0.00 H new ATOM 0 HG23 VAL A 86 5.585 -8.228 5.976 1.00 0.00 H new ATOM 1420 N ASP A 87 5.495 -4.673 8.041 1.00 0.00 N ATOM 1421 CA ASP A 87 5.995 -4.712 9.406 1.00 0.00 C ATOM 1422 C ASP A 87 4.899 -5.087 10.392 1.00 0.00 C ATOM 1423 O ASP A 87 3.736 -4.721 10.222 1.00 0.00 O ATOM 1424 CB ASP A 87 6.600 -3.359 9.787 1.00 0.00 C ATOM 1425 CG ASP A 87 7.663 -3.482 10.863 1.00 0.00 C ATOM 1426 OD1 ASP A 87 7.343 -3.988 11.959 1.00 0.00 O ATOM 1427 OD2 ASP A 87 8.814 -3.070 10.608 1.00 0.00 O ATOM 0 H ASP A 87 5.033 -3.801 7.783 1.00 0.00 H new ATOM 0 HA ASP A 87 6.768 -5.479 9.454 1.00 0.00 H new ATOM 0 HB2 ASP A 87 7.036 -2.897 8.901 1.00 0.00 H new ATOM 0 HB3 ASP A 87 5.809 -2.696 10.136 1.00 0.00 H new ATOM 1432 N LEU A 88 5.294 -5.804 11.433 1.00 0.00 N ATOM 1433 CA LEU A 88 4.381 -6.231 12.481 1.00 0.00 C ATOM 1434 C LEU A 88 5.104 -6.160 13.820 1.00 0.00 C ATOM 1435 O LEU A 88 4.671 -6.743 14.813 1.00 0.00 O ATOM 1436 CB LEU A 88 3.887 -7.659 12.228 1.00 0.00 C ATOM 1437 CG LEU A 88 3.012 -7.849 10.984 1.00 0.00 C ATOM 1438 CD1 LEU A 88 1.887 -6.822 10.947 1.00 0.00 C ATOM 1439 CD2 LEU A 88 3.855 -7.772 9.719 1.00 0.00 C ATOM 0 H LEU A 88 6.258 -6.106 11.575 1.00 0.00 H new ATOM 0 HA LEU A 88 3.513 -5.572 12.489 1.00 0.00 H new ATOM 0 HB2 LEU A 88 4.754 -8.314 12.143 1.00 0.00 H new ATOM 0 HB3 LEU A 88 3.323 -7.988 13.100 1.00 0.00 H new ATOM 0 HG LEU A 88 2.561 -8.840 11.035 1.00 0.00 H new ATOM 0 HD11 LEU A 88 1.281 -6.978 10.055 1.00 0.00 H new ATOM 0 HD12 LEU A 88 1.263 -6.934 11.834 1.00 0.00 H new ATOM 0 HD13 LEU A 88 2.311 -5.818 10.926 1.00 0.00 H new ATOM 0 HD21 LEU A 88 3.216 -7.909 8.847 1.00 0.00 H new ATOM 0 HD22 LEU A 88 4.340 -6.797 9.664 1.00 0.00 H new ATOM 0 HD23 LEU A 88 4.614 -8.554 9.739 1.00 0.00 H new ATOM 1451 N GLU A 89 6.224 -5.440 13.820 1.00 0.00 N ATOM 1452 CA GLU A 89 7.041 -5.277 15.001 1.00 0.00 C ATOM 1453 C GLU A 89 6.767 -3.936 15.659 1.00 0.00 C ATOM 1454 O GLU A 89 6.042 -3.098 15.122 1.00 0.00 O ATOM 1455 CB GLU A 89 8.520 -5.390 14.631 1.00 0.00 C ATOM 1456 CG GLU A 89 9.415 -5.786 15.794 1.00 0.00 C ATOM 1457 CD GLU A 89 10.626 -6.584 15.352 1.00 0.00 C ATOM 1458 OE1 GLU A 89 10.497 -7.815 15.183 1.00 0.00 O ATOM 1459 OE2 GLU A 89 11.703 -5.978 15.173 1.00 0.00 O ATOM 0 H GLU A 89 6.583 -4.957 12.997 1.00 0.00 H new ATOM 0 HA GLU A 89 6.790 -6.066 15.710 1.00 0.00 H new ATOM 0 HB2 GLU A 89 8.630 -6.125 13.833 1.00 0.00 H new ATOM 0 HB3 GLU A 89 8.859 -4.434 14.233 1.00 0.00 H new ATOM 0 HG2 GLU A 89 9.747 -4.888 16.315 1.00 0.00 H new ATOM 0 HG3 GLU A 89 8.838 -6.374 16.508 1.00 0.00 H new ATOM 1466 N ARG A 90 7.351 -3.746 16.825 1.00 0.00 N ATOM 1467 CA ARG A 90 7.183 -2.512 17.581 1.00 0.00 C ATOM 1468 C ARG A 90 8.248 -1.488 17.203 1.00 0.00 C ATOM 1469 O ARG A 90 9.098 -1.129 18.018 1.00 0.00 O ATOM 1470 CB ARG A 90 7.228 -2.785 19.090 1.00 0.00 C ATOM 1471 CG ARG A 90 8.203 -3.881 19.498 1.00 0.00 C ATOM 1472 CD ARG A 90 9.595 -3.633 18.937 1.00 0.00 C ATOM 1473 NE ARG A 90 10.518 -4.715 19.265 1.00 0.00 N ATOM 1474 CZ ARG A 90 11.105 -4.854 20.451 1.00 0.00 C ATOM 1475 NH1 ARG A 90 10.870 -3.981 21.423 1.00 0.00 N ATOM 1476 NH2 ARG A 90 11.931 -5.869 20.667 1.00 0.00 N ATOM 0 H ARG A 90 7.952 -4.435 17.277 1.00 0.00 H new ATOM 0 HA ARG A 90 6.205 -2.102 17.329 1.00 0.00 H new ATOM 0 HB2 ARG A 90 7.498 -1.864 19.606 1.00 0.00 H new ATOM 0 HB3 ARG A 90 6.229 -3.059 19.428 1.00 0.00 H new ATOM 0 HG2 ARG A 90 8.254 -3.937 20.585 1.00 0.00 H new ATOM 0 HG3 ARG A 90 7.835 -4.845 19.146 1.00 0.00 H new ATOM 0 HD2 ARG A 90 9.535 -3.523 17.854 1.00 0.00 H new ATOM 0 HD3 ARG A 90 9.983 -2.694 19.331 1.00 0.00 H new ATOM 0 HE ARG A 90 10.725 -5.405 18.543 1.00 0.00 H new ATOM 0 HH11 ARG A 90 10.236 -3.198 21.263 1.00 0.00 H new ATOM 0 HH12 ARG A 90 11.323 -4.093 22.330 1.00 0.00 H new ATOM 0 HH21 ARG A 90 12.116 -6.543 19.924 1.00 0.00 H new ATOM 0 HH22 ARG A 90 12.381 -5.976 21.576 1.00 0.00 H new ATOM 1490 N GLU A 91 8.192 -1.015 15.963 1.00 0.00 N ATOM 1491 CA GLU A 91 9.150 -0.025 15.482 1.00 0.00 C ATOM 1492 C GLU A 91 8.655 1.396 15.751 1.00 0.00 C ATOM 1493 O GLU A 91 9.390 2.364 15.560 1.00 0.00 O ATOM 1494 CB GLU A 91 9.400 -0.213 13.985 1.00 0.00 C ATOM 1495 CG GLU A 91 9.814 -1.627 13.607 1.00 0.00 C ATOM 1496 CD GLU A 91 11.134 -1.671 12.864 1.00 0.00 C ATOM 1497 OE1 GLU A 91 11.192 -1.160 11.726 1.00 0.00 O ATOM 1498 OE2 GLU A 91 12.111 -2.216 13.421 1.00 0.00 O ATOM 0 H GLU A 91 7.496 -1.300 15.274 1.00 0.00 H new ATOM 0 HA GLU A 91 10.085 -0.172 16.023 1.00 0.00 H new ATOM 0 HB2 GLU A 91 8.494 0.049 13.439 1.00 0.00 H new ATOM 0 HB3 GLU A 91 10.177 0.481 13.665 1.00 0.00 H new ATOM 0 HG2 GLU A 91 9.890 -2.233 14.510 1.00 0.00 H new ATOM 0 HG3 GLU A 91 9.038 -2.075 12.987 1.00 0.00 H new ATOM 1505 N ALA A 92 7.407 1.513 16.203 1.00 0.00 N ATOM 1506 CA ALA A 92 6.818 2.808 16.506 1.00 0.00 C ATOM 1507 C ALA A 92 5.383 2.648 16.997 1.00 0.00 C ATOM 1508 O ALA A 92 4.503 3.430 16.641 1.00 0.00 O ATOM 1509 CB ALA A 92 6.864 3.716 15.284 1.00 0.00 C ATOM 0 H ALA A 92 6.786 0.721 16.367 1.00 0.00 H new ATOM 0 HA ALA A 92 7.403 3.269 17.302 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.419 4.680 15.530 1.00 0.00 H new ATOM 0 HB2 ALA A 92 7.900 3.862 14.978 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.306 3.257 14.468 1.00 0.00 H new ATOM 1515 N GLY A 93 5.155 1.621 17.811 1.00 0.00 N ATOM 1516 CA GLY A 93 3.824 1.368 18.333 1.00 0.00 C ATOM 1517 C GLY A 93 2.939 0.677 17.318 1.00 0.00 C ATOM 1518 O GLY A 93 2.474 -0.438 17.547 1.00 0.00 O ATOM 0 H GLY A 93 5.868 0.960 18.118 1.00 0.00 H new ATOM 0 HA2 GLY A 93 3.897 0.752 19.229 1.00 0.00 H new ATOM 0 HA3 GLY A 93 3.366 2.311 18.631 1.00 0.00 H new ATOM 1522 N LYS A 94 2.715 1.344 16.192 1.00 0.00 N ATOM 1523 CA LYS A 94 1.887 0.797 15.123 1.00 0.00 C ATOM 1524 C LYS A 94 2.760 0.066 14.108 1.00 0.00 C ATOM 1525 O LYS A 94 3.985 0.047 14.231 1.00 0.00 O ATOM 1526 CB LYS A 94 1.094 1.911 14.425 1.00 0.00 C ATOM 1527 CG LYS A 94 0.961 3.188 15.246 1.00 0.00 C ATOM 1528 CD LYS A 94 2.068 4.178 14.927 1.00 0.00 C ATOM 1529 CE LYS A 94 2.294 5.146 16.077 1.00 0.00 C ATOM 1530 NZ LYS A 94 1.054 5.895 16.422 1.00 0.00 N ATOM 0 H LYS A 94 3.097 2.269 15.995 1.00 0.00 H new ATOM 0 HA LYS A 94 1.180 0.093 15.562 1.00 0.00 H new ATOM 0 HB2 LYS A 94 1.579 2.149 13.478 1.00 0.00 H new ATOM 0 HB3 LYS A 94 0.097 1.539 14.188 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -0.007 3.648 15.049 1.00 0.00 H new ATOM 0 HG3 LYS A 94 0.987 2.943 16.308 1.00 0.00 H new ATOM 0 HD2 LYS A 94 2.991 3.638 14.717 1.00 0.00 H new ATOM 0 HD3 LYS A 94 1.812 4.735 14.026 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.642 4.596 16.952 1.00 0.00 H new ATOM 0 HE3 LYS A 94 3.082 5.851 15.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.307 6.797 16.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 0.510 6.083 15.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 0.478 5.329 17.077 1.00 0.00 H new ATOM 1544 N VAL A 95 2.129 -0.535 13.105 1.00 0.00 N ATOM 1545 CA VAL A 95 2.864 -1.263 12.075 1.00 0.00 C ATOM 1546 C VAL A 95 2.627 -0.644 10.699 1.00 0.00 C ATOM 1547 O VAL A 95 1.488 -0.376 10.323 1.00 0.00 O ATOM 1548 CB VAL A 95 2.486 -2.770 12.052 1.00 0.00 C ATOM 1549 CG1 VAL A 95 1.869 -3.196 13.378 1.00 0.00 C ATOM 1550 CG2 VAL A 95 1.541 -3.092 10.900 1.00 0.00 C ATOM 0 H VAL A 95 1.116 -0.533 12.983 1.00 0.00 H new ATOM 0 HA VAL A 95 3.923 -1.186 12.322 1.00 0.00 H new ATOM 0 HB VAL A 95 3.406 -3.334 11.899 1.00 0.00 H new ATOM 0 HG11 VAL A 95 1.613 -4.255 13.337 1.00 0.00 H new ATOM 0 HG12 VAL A 95 2.584 -3.027 14.183 1.00 0.00 H new ATOM 0 HG13 VAL A 95 0.968 -2.612 13.564 1.00 0.00 H new ATOM 0 HG21 VAL A 95 1.298 -4.154 10.915 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.626 -2.509 11.006 1.00 0.00 H new ATOM 0 HG23 VAL A 95 2.022 -2.843 9.954 1.00 0.00 H new ATOM 1560 N TYR A 96 3.707 -0.423 9.954 1.00 0.00 N ATOM 1561 CA TYR A 96 3.609 0.164 8.618 1.00 0.00 C ATOM 1562 C TYR A 96 3.983 -0.820 7.521 1.00 0.00 C ATOM 1563 O TYR A 96 4.765 -1.748 7.732 1.00 0.00 O ATOM 1564 CB TYR A 96 4.450 1.442 8.496 1.00 0.00 C ATOM 1565 CG TYR A 96 5.514 1.608 9.559 1.00 0.00 C ATOM 1566 CD1 TYR A 96 6.483 0.639 9.783 1.00 0.00 C ATOM 1567 CD2 TYR A 96 5.541 2.754 10.339 1.00 0.00 C ATOM 1568 CE1 TYR A 96 7.448 0.810 10.758 1.00 0.00 C ATOM 1569 CE2 TYR A 96 6.499 2.935 11.311 1.00 0.00 C ATOM 1570 CZ TYR A 96 7.452 1.962 11.519 1.00 0.00 C ATOM 1571 OH TYR A 96 8.412 2.137 12.490 1.00 0.00 O ATOM 0 H TYR A 96 4.658 -0.640 10.251 1.00 0.00 H new ATOM 0 HA TYR A 96 2.560 0.427 8.481 1.00 0.00 H new ATOM 0 HB2 TYR A 96 4.930 1.452 7.517 1.00 0.00 H new ATOM 0 HB3 TYR A 96 3.783 2.303 8.532 1.00 0.00 H new ATOM 0 HD1 TYR A 96 6.483 -0.261 9.187 1.00 0.00 H new ATOM 0 HD2 TYR A 96 4.796 3.520 10.181 1.00 0.00 H new ATOM 0 HE1 TYR A 96 8.194 0.047 10.923 1.00 0.00 H new ATOM 0 HE2 TYR A 96 6.503 3.835 11.908 1.00 0.00 H new ATOM 0 HH TYR A 96 8.275 3.000 12.934 1.00 0.00 H new ATOM 1581 N LEU A 97 3.401 -0.606 6.343 1.00 0.00 N ATOM 1582 CA LEU A 97 3.643 -1.463 5.191 1.00 0.00 C ATOM 1583 C LEU A 97 3.873 -0.647 3.928 1.00 0.00 C ATOM 1584 O LEU A 97 3.592 0.553 3.882 1.00 0.00 O ATOM 1585 CB LEU A 97 2.476 -2.420 4.953 1.00 0.00 C ATOM 1586 CG LEU A 97 1.709 -2.852 6.202 1.00 0.00 C ATOM 1587 CD1 LEU A 97 0.876 -1.701 6.751 1.00 0.00 C ATOM 1588 CD2 LEU A 97 0.825 -4.038 5.875 1.00 0.00 C ATOM 0 H LEU A 97 2.753 0.161 6.163 1.00 0.00 H new ATOM 0 HA LEU A 97 4.541 -2.038 5.416 1.00 0.00 H new ATOM 0 HB2 LEU A 97 1.776 -1.946 4.265 1.00 0.00 H new ATOM 0 HB3 LEU A 97 2.857 -3.312 4.456 1.00 0.00 H new ATOM 0 HG LEU A 97 2.426 -3.143 6.970 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.339 -2.032 7.640 1.00 0.00 H new ATOM 0 HD12 LEU A 97 1.531 -0.870 7.012 1.00 0.00 H new ATOM 0 HD13 LEU A 97 0.161 -1.376 5.995 1.00 0.00 H new ATOM 0 HD21 LEU A 97 0.280 -4.343 6.768 1.00 0.00 H new ATOM 0 HD22 LEU A 97 0.116 -3.760 5.095 1.00 0.00 H new ATOM 0 HD23 LEU A 97 1.442 -4.866 5.526 1.00 0.00 H new ATOM 1600 N LYS A 98 4.376 -1.328 2.908 1.00 0.00 N ATOM 1601 CA LYS A 98 4.650 -0.719 1.614 1.00 0.00 C ATOM 1602 C LYS A 98 4.289 -1.694 0.500 1.00 0.00 C ATOM 1603 O LYS A 98 4.774 -2.825 0.479 1.00 0.00 O ATOM 1604 CB LYS A 98 6.127 -0.340 1.506 1.00 0.00 C ATOM 1605 CG LYS A 98 6.413 0.709 0.443 1.00 0.00 C ATOM 1606 CD LYS A 98 7.798 1.315 0.614 1.00 0.00 C ATOM 1607 CE LYS A 98 8.885 0.252 0.556 1.00 0.00 C ATOM 1608 NZ LYS A 98 9.459 -0.029 1.901 1.00 0.00 N ATOM 0 H LYS A 98 4.606 -2.321 2.955 1.00 0.00 H new ATOM 0 HA LYS A 98 4.047 0.184 1.517 1.00 0.00 H new ATOM 0 HB2 LYS A 98 6.469 0.032 2.472 1.00 0.00 H new ATOM 0 HB3 LYS A 98 6.708 -1.236 1.285 1.00 0.00 H new ATOM 0 HG2 LYS A 98 6.332 0.258 -0.546 1.00 0.00 H new ATOM 0 HG3 LYS A 98 5.661 1.497 0.496 1.00 0.00 H new ATOM 0 HD2 LYS A 98 7.971 2.056 -0.167 1.00 0.00 H new ATOM 0 HD3 LYS A 98 7.851 1.839 1.568 1.00 0.00 H new ATOM 0 HE2 LYS A 98 8.473 -0.666 0.138 1.00 0.00 H new ATOM 0 HE3 LYS A 98 9.678 0.580 -0.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 10.196 -0.758 1.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 9.875 0.841 2.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 8.707 -0.366 2.536 1.00 0.00 H new ATOM 1622 N ALA A 99 3.433 -1.265 -0.418 1.00 0.00 N ATOM 1623 CA ALA A 99 3.017 -2.128 -1.515 1.00 0.00 C ATOM 1624 C ALA A 99 3.009 -1.388 -2.851 1.00 0.00 C ATOM 1625 O ALA A 99 2.587 -0.234 -2.928 1.00 0.00 O ATOM 1626 CB ALA A 99 1.642 -2.713 -1.227 1.00 0.00 C ATOM 0 H ALA A 99 3.017 -0.334 -0.426 1.00 0.00 H new ATOM 0 HA ALA A 99 3.744 -2.936 -1.594 1.00 0.00 H new ATOM 0 HB1 ALA A 99 1.340 -3.357 -2.053 1.00 0.00 H new ATOM 0 HB2 ALA A 99 1.680 -3.297 -0.307 1.00 0.00 H new ATOM 0 HB3 ALA A 99 0.919 -1.905 -1.114 1.00 0.00 H new ATOM 1632 N PRO A 100 3.465 -2.052 -3.929 1.00 0.00 N ATOM 1633 CA PRO A 100 3.499 -1.473 -5.261 1.00 0.00 C ATOM 1634 C PRO A 100 2.221 -1.777 -6.037 1.00 0.00 C ATOM 1635 O PRO A 100 1.896 -2.939 -6.281 1.00 0.00 O ATOM 1636 CB PRO A 100 4.702 -2.172 -5.897 1.00 0.00 C ATOM 1637 CG PRO A 100 4.836 -3.487 -5.184 1.00 0.00 C ATOM 1638 CD PRO A 100 3.976 -3.430 -3.942 1.00 0.00 C ATOM 0 HA PRO A 100 3.576 -0.386 -5.253 1.00 0.00 H new ATOM 0 HB2 PRO A 100 4.548 -2.321 -6.966 1.00 0.00 H new ATOM 0 HB3 PRO A 100 5.606 -1.573 -5.786 1.00 0.00 H new ATOM 0 HG2 PRO A 100 4.520 -4.306 -5.830 1.00 0.00 H new ATOM 0 HG3 PRO A 100 5.877 -3.674 -4.920 1.00 0.00 H new ATOM 0 HD2 PRO A 100 3.165 -4.157 -3.984 1.00 0.00 H new ATOM 0 HD3 PRO A 100 4.555 -3.650 -3.045 1.00 0.00 H new ATOM 1646 N MET A 101 1.491 -0.729 -6.409 1.00 0.00 N ATOM 1647 CA MET A 101 0.240 -0.896 -7.141 1.00 0.00 C ATOM 1648 C MET A 101 0.263 -0.135 -8.462 1.00 0.00 C ATOM 1649 O MET A 101 1.183 0.637 -8.732 1.00 0.00 O ATOM 1650 CB MET A 101 -0.937 -0.414 -6.288 1.00 0.00 C ATOM 1651 CG MET A 101 -1.669 -1.535 -5.568 1.00 0.00 C ATOM 1652 SD MET A 101 -3.463 -1.397 -5.701 1.00 0.00 S ATOM 1653 CE MET A 101 -3.749 0.166 -4.873 1.00 0.00 C ATOM 0 H MET A 101 1.743 0.240 -6.217 1.00 0.00 H new ATOM 0 HA MET A 101 0.121 -1.957 -7.361 1.00 0.00 H new ATOM 0 HB2 MET A 101 -0.571 0.301 -5.551 1.00 0.00 H new ATOM 0 HB3 MET A 101 -1.643 0.118 -6.926 1.00 0.00 H new ATOM 0 HG2 MET A 101 -1.351 -2.493 -5.979 1.00 0.00 H new ATOM 0 HG3 MET A 101 -1.386 -1.530 -4.515 1.00 0.00 H new ATOM 0 HE1 MET A 101 -4.605 0.073 -4.205 1.00 0.00 H new ATOM 0 HE2 MET A 101 -2.866 0.439 -4.295 1.00 0.00 H new ATOM 0 HE3 MET A 101 -3.950 0.939 -5.615 1.00 0.00 H new ATOM 1663 N ILE A 102 -0.762 -0.358 -9.277 1.00 0.00 N ATOM 1664 CA ILE A 102 -0.873 0.307 -10.566 1.00 0.00 C ATOM 1665 C ILE A 102 -2.013 1.320 -10.553 1.00 0.00 C ATOM 1666 O ILE A 102 -3.187 0.951 -10.594 1.00 0.00 O ATOM 1667 CB ILE A 102 -1.105 -0.710 -11.706 1.00 0.00 C ATOM 1668 CG1 ILE A 102 0.086 -1.666 -11.812 1.00 0.00 C ATOM 1669 CG2 ILE A 102 -1.335 0.007 -13.031 1.00 0.00 C ATOM 1670 CD1 ILE A 102 1.346 -1.011 -12.336 1.00 0.00 C ATOM 0 H ILE A 102 -1.529 -0.996 -9.065 1.00 0.00 H new ATOM 0 HA ILE A 102 0.069 0.825 -10.746 1.00 0.00 H new ATOM 0 HB ILE A 102 -1.999 -1.290 -11.475 1.00 0.00 H new ATOM 0 HG12 ILE A 102 0.289 -2.090 -10.829 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -0.182 -2.495 -12.467 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -1.496 -0.728 -13.819 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -2.212 0.650 -12.950 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -0.462 0.613 -13.273 1.00 0.00 H new ATOM 0 HD11 ILE A 102 2.147 -1.749 -12.384 1.00 0.00 H new ATOM 0 HD12 ILE A 102 1.161 -0.611 -13.333 1.00 0.00 H new ATOM 0 HD13 ILE A 102 1.639 -0.200 -11.669 1.00 0.00 H new ATOM 1682 N LEU A 103 -1.656 2.597 -10.502 1.00 0.00 N ATOM 1683 CA LEU A 103 -2.644 3.671 -10.492 1.00 0.00 C ATOM 1684 C LEU A 103 -2.637 4.400 -11.825 1.00 0.00 C ATOM 1685 O LEU A 103 -1.613 4.457 -12.484 1.00 0.00 O ATOM 1686 CB LEU A 103 -2.367 4.651 -9.352 1.00 0.00 C ATOM 1687 CG LEU A 103 -3.060 4.316 -8.029 1.00 0.00 C ATOM 1688 CD1 LEU A 103 -2.666 5.314 -6.952 1.00 0.00 C ATOM 1689 CD2 LEU A 103 -4.570 4.293 -8.212 1.00 0.00 C ATOM 0 H LEU A 103 -0.688 2.916 -10.467 1.00 0.00 H new ATOM 0 HA LEU A 103 -3.629 3.232 -10.334 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.291 4.692 -9.181 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -2.678 5.647 -9.666 1.00 0.00 H new ATOM 0 HG LEU A 103 -2.737 3.325 -7.711 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -3.169 5.060 -6.019 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.587 5.282 -6.803 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -2.960 6.317 -7.261 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -5.048 4.053 -7.262 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -4.910 5.271 -8.553 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -4.835 3.538 -8.952 1.00 0.00 H new ATOM 1701 N ASN A 104 -3.788 4.941 -12.214 1.00 0.00 N ATOM 1702 CA ASN A 104 -3.949 5.665 -13.485 1.00 0.00 C ATOM 1703 C ASN A 104 -2.672 5.696 -14.337 1.00 0.00 C ATOM 1704 O ASN A 104 -1.918 6.670 -14.309 1.00 0.00 O ATOM 1705 CB ASN A 104 -4.392 7.099 -13.198 1.00 0.00 C ATOM 1706 CG ASN A 104 -5.170 7.708 -14.348 1.00 0.00 C ATOM 1707 OD1 ASN A 104 -6.341 7.393 -14.556 1.00 0.00 O ATOM 1708 ND2 ASN A 104 -4.520 8.584 -15.105 1.00 0.00 N ATOM 0 H ASN A 104 -4.642 4.893 -11.659 1.00 0.00 H new ATOM 0 HA ASN A 104 -4.702 5.125 -14.059 1.00 0.00 H new ATOM 0 HB2 ASN A 104 -5.009 7.112 -12.299 1.00 0.00 H new ATOM 0 HB3 ASN A 104 -3.515 7.712 -12.992 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -4.992 9.025 -15.895 1.00 0.00 H new ATOM 0 HD22 ASN A 104 -3.549 8.816 -14.897 1.00 0.00 H new ATOM 1715 N GLY A 105 -2.458 4.626 -15.105 1.00 0.00 N ATOM 1716 CA GLY A 105 -1.294 4.528 -15.982 1.00 0.00 C ATOM 1717 C GLY A 105 -0.006 5.044 -15.361 1.00 0.00 C ATOM 1718 O GLY A 105 0.685 5.870 -15.954 1.00 0.00 O ATOM 0 H GLY A 105 -3.077 3.816 -15.136 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -1.155 3.486 -16.269 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -1.493 5.086 -16.897 1.00 0.00 H new ATOM 1722 N VAL A 106 0.311 4.551 -14.169 1.00 0.00 N ATOM 1723 CA VAL A 106 1.512 4.956 -13.454 1.00 0.00 C ATOM 1724 C VAL A 106 1.827 3.961 -12.343 1.00 0.00 C ATOM 1725 O VAL A 106 0.920 3.398 -11.730 1.00 0.00 O ATOM 1726 CB VAL A 106 1.347 6.360 -12.827 1.00 0.00 C ATOM 1727 CG1 VAL A 106 2.518 6.688 -11.912 1.00 0.00 C ATOM 1728 CG2 VAL A 106 1.195 7.421 -13.905 1.00 0.00 C ATOM 0 H VAL A 106 -0.256 3.862 -13.674 1.00 0.00 H new ATOM 0 HA VAL A 106 2.327 4.982 -14.177 1.00 0.00 H new ATOM 0 HB VAL A 106 0.438 6.353 -12.226 1.00 0.00 H new ATOM 0 HG11 VAL A 106 2.378 7.680 -11.484 1.00 0.00 H new ATOM 0 HG12 VAL A 106 2.571 5.951 -11.111 1.00 0.00 H new ATOM 0 HG13 VAL A 106 3.445 6.668 -12.486 1.00 0.00 H new ATOM 0 HG21 VAL A 106 1.080 8.400 -13.439 1.00 0.00 H new ATOM 0 HG22 VAL A 106 2.080 7.423 -14.541 1.00 0.00 H new ATOM 0 HG23 VAL A 106 0.315 7.202 -14.510 1.00 0.00 H new ATOM 1738 N CYS A 107 3.110 3.760 -12.073 1.00 0.00 N ATOM 1739 CA CYS A 107 3.522 2.848 -11.015 1.00 0.00 C ATOM 1740 C CYS A 107 3.487 3.572 -9.677 1.00 0.00 C ATOM 1741 O CYS A 107 4.243 4.518 -9.455 1.00 0.00 O ATOM 1742 CB CYS A 107 4.923 2.300 -11.291 1.00 0.00 C ATOM 1743 SG CYS A 107 5.454 1.016 -10.134 1.00 0.00 S ATOM 0 H CYS A 107 3.878 4.213 -12.568 1.00 0.00 H new ATOM 0 HA CYS A 107 2.831 2.006 -10.984 1.00 0.00 H new ATOM 0 HB2 CYS A 107 4.951 1.896 -12.303 1.00 0.00 H new ATOM 0 HB3 CYS A 107 5.637 3.123 -11.256 1.00 0.00 H new ATOM 0 HG CYS A 107 5.899 -0.009 -10.798 1.00 0.00 H new ATOM 1749 N VAL A 108 2.586 3.148 -8.798 1.00 0.00 N ATOM 1750 CA VAL A 108 2.440 3.789 -7.499 1.00 0.00 C ATOM 1751 C VAL A 108 2.805 2.855 -6.352 1.00 0.00 C ATOM 1752 O VAL A 108 3.030 1.660 -6.546 1.00 0.00 O ATOM 1753 CB VAL A 108 1.005 4.301 -7.300 1.00 0.00 C ATOM 1754 CG1 VAL A 108 0.732 5.479 -8.224 1.00 0.00 C ATOM 1755 CG2 VAL A 108 0.002 3.182 -7.541 1.00 0.00 C ATOM 0 H VAL A 108 1.950 2.368 -8.961 1.00 0.00 H new ATOM 0 HA VAL A 108 3.134 4.630 -7.487 1.00 0.00 H new ATOM 0 HB VAL A 108 0.895 4.640 -6.270 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -0.288 5.832 -8.072 1.00 0.00 H new ATOM 0 HG12 VAL A 108 1.431 6.285 -8.002 1.00 0.00 H new ATOM 0 HG13 VAL A 108 0.857 5.165 -9.260 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -1.009 3.562 -7.396 1.00 0.00 H new ATOM 0 HG22 VAL A 108 0.108 2.812 -8.561 1.00 0.00 H new ATOM 0 HG23 VAL A 108 0.188 2.369 -6.839 1.00 0.00 H new ATOM 1765 N ILE A 109 2.873 3.426 -5.156 1.00 0.00 N ATOM 1766 CA ILE A 109 3.221 2.683 -3.955 1.00 0.00 C ATOM 1767 C ILE A 109 2.550 3.291 -2.728 1.00 0.00 C ATOM 1768 O ILE A 109 2.820 4.437 -2.371 1.00 0.00 O ATOM 1769 CB ILE A 109 4.744 2.686 -3.725 1.00 0.00 C ATOM 1770 CG1 ILE A 109 5.487 2.372 -5.027 1.00 0.00 C ATOM 1771 CG2 ILE A 109 5.115 1.688 -2.637 1.00 0.00 C ATOM 1772 CD1 ILE A 109 6.985 2.238 -4.855 1.00 0.00 C ATOM 0 H ILE A 109 2.688 4.416 -4.993 1.00 0.00 H new ATOM 0 HA ILE A 109 2.874 1.660 -4.099 1.00 0.00 H new ATOM 0 HB ILE A 109 5.044 3.681 -3.397 1.00 0.00 H new ATOM 0 HG12 ILE A 109 5.094 1.445 -5.445 1.00 0.00 H new ATOM 0 HG13 ILE A 109 5.282 3.161 -5.751 1.00 0.00 H new ATOM 0 HG21 ILE A 109 6.194 1.700 -2.485 1.00 0.00 H new ATOM 0 HG22 ILE A 109 4.614 1.960 -1.708 1.00 0.00 H new ATOM 0 HG23 ILE A 109 4.803 0.688 -2.938 1.00 0.00 H new ATOM 0 HD11 ILE A 109 7.443 2.016 -5.819 1.00 0.00 H new ATOM 0 HD12 ILE A 109 7.392 3.172 -4.467 1.00 0.00 H new ATOM 0 HD13 ILE A 109 7.200 1.430 -4.156 1.00 0.00 H new ATOM 1784 N TRP A 110 1.684 2.522 -2.082 1.00 0.00 N ATOM 1785 CA TRP A 110 0.993 3.001 -0.891 1.00 0.00 C ATOM 1786 C TRP A 110 1.694 2.513 0.369 1.00 0.00 C ATOM 1787 O TRP A 110 1.917 1.314 0.544 1.00 0.00 O ATOM 1788 CB TRP A 110 -0.463 2.536 -0.889 1.00 0.00 C ATOM 1789 CG TRP A 110 -1.255 3.071 0.267 1.00 0.00 C ATOM 1790 CD1 TRP A 110 -1.985 4.224 0.297 1.00 0.00 C ATOM 1791 CD2 TRP A 110 -1.394 2.472 1.560 1.00 0.00 C ATOM 1792 NE1 TRP A 110 -2.570 4.380 1.531 1.00 0.00 N ATOM 1793 CE2 TRP A 110 -2.223 3.317 2.323 1.00 0.00 C ATOM 1794 CE3 TRP A 110 -0.900 1.304 2.148 1.00 0.00 C ATOM 1795 CZ2 TRP A 110 -2.566 3.030 3.642 1.00 0.00 C ATOM 1796 CZ3 TRP A 110 -1.242 1.020 3.456 1.00 0.00 C ATOM 1797 CH2 TRP A 110 -2.069 1.879 4.191 1.00 0.00 C ATOM 0 H TRP A 110 1.444 1.570 -2.359 1.00 0.00 H new ATOM 0 HA TRP A 110 1.014 4.091 -0.905 1.00 0.00 H new ATOM 0 HB2 TRP A 110 -0.937 2.846 -1.820 1.00 0.00 H new ATOM 0 HB3 TRP A 110 -0.489 1.447 -0.865 1.00 0.00 H new ATOM 0 HD1 TRP A 110 -2.088 4.913 -0.528 1.00 0.00 H new ATOM 0 HE1 TRP A 110 -3.165 5.160 1.811 1.00 0.00 H new ATOM 0 HE3 TRP A 110 -0.262 0.635 1.589 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 -3.202 3.692 4.211 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 -0.865 0.120 3.920 1.00 0.00 H new ATOM 0 HH2 TRP A 110 -2.319 1.628 5.211 1.00 0.00 H new ATOM 1808 N LYS A 111 2.041 3.449 1.246 1.00 0.00 N ATOM 1809 CA LYS A 111 2.715 3.115 2.490 1.00 0.00 C ATOM 1810 C LYS A 111 2.017 3.784 3.670 1.00 0.00 C ATOM 1811 O LYS A 111 1.562 4.923 3.570 1.00 0.00 O ATOM 1812 CB LYS A 111 4.186 3.541 2.422 1.00 0.00 C ATOM 1813 CG LYS A 111 4.888 3.559 3.772 1.00 0.00 C ATOM 1814 CD LYS A 111 4.651 4.873 4.499 1.00 0.00 C ATOM 1815 CE LYS A 111 5.915 5.717 4.554 1.00 0.00 C ATOM 1816 NZ LYS A 111 6.022 6.632 3.384 1.00 0.00 N ATOM 0 H LYS A 111 1.865 4.445 1.116 1.00 0.00 H new ATOM 0 HA LYS A 111 2.671 2.035 2.634 1.00 0.00 H new ATOM 0 HB2 LYS A 111 4.719 2.863 1.756 1.00 0.00 H new ATOM 0 HB3 LYS A 111 4.246 4.535 1.980 1.00 0.00 H new ATOM 0 HG2 LYS A 111 4.527 2.732 4.383 1.00 0.00 H new ATOM 0 HG3 LYS A 111 5.958 3.407 3.630 1.00 0.00 H new ATOM 0 HD2 LYS A 111 3.862 5.431 3.996 1.00 0.00 H new ATOM 0 HD3 LYS A 111 4.303 4.672 5.512 1.00 0.00 H new ATOM 0 HE2 LYS A 111 5.922 6.302 5.474 1.00 0.00 H new ATOM 0 HE3 LYS A 111 6.787 5.064 4.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 6.612 7.450 3.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 6.455 6.125 2.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 5.073 6.960 3.112 1.00 0.00 H new ATOM 1830 N GLY A 112 1.933 3.069 4.786 1.00 0.00 N ATOM 1831 CA GLY A 112 1.285 3.615 5.966 1.00 0.00 C ATOM 1832 C GLY A 112 1.251 2.628 7.113 1.00 0.00 C ATOM 1833 O GLY A 112 1.488 1.438 6.914 1.00 0.00 O ATOM 0 H GLY A 112 2.300 2.124 4.896 1.00 0.00 H new ATOM 0 HA2 GLY A 112 1.810 4.517 6.281 1.00 0.00 H new ATOM 0 HA3 GLY A 112 0.267 3.911 5.714 1.00 0.00 H new ATOM 1837 N TRP A 113 0.955 3.116 8.315 1.00 0.00 N ATOM 1838 CA TRP A 113 0.899 2.242 9.484 1.00 0.00 C ATOM 1839 C TRP A 113 -0.494 2.201 10.101 1.00 0.00 C ATOM 1840 O TRP A 113 -1.265 3.160 10.007 1.00 0.00 O ATOM 1841 CB TRP A 113 1.932 2.660 10.539 1.00 0.00 C ATOM 1842 CG TRP A 113 1.850 4.101 10.941 1.00 0.00 C ATOM 1843 CD1 TRP A 113 2.717 5.100 10.597 1.00 0.00 C ATOM 1844 CD2 TRP A 113 0.859 4.699 11.782 1.00 0.00 C ATOM 1845 NE1 TRP A 113 2.315 6.286 11.162 1.00 0.00 N ATOM 1846 CE2 TRP A 113 1.178 6.066 11.896 1.00 0.00 C ATOM 1847 CE3 TRP A 113 -0.269 4.213 12.447 1.00 0.00 C ATOM 1848 CZ2 TRP A 113 0.410 6.949 12.648 1.00 0.00 C ATOM 1849 CZ3 TRP A 113 -1.030 5.092 13.194 1.00 0.00 C ATOM 1850 CH2 TRP A 113 -0.689 6.446 13.288 1.00 0.00 C ATOM 0 H TRP A 113 0.753 4.098 8.504 1.00 0.00 H new ATOM 0 HA TRP A 113 1.140 1.237 9.136 1.00 0.00 H new ATOM 0 HB2 TRP A 113 1.801 2.039 11.425 1.00 0.00 H new ATOM 0 HB3 TRP A 113 2.931 2.458 10.153 1.00 0.00 H new ATOM 0 HD1 TRP A 113 3.590 4.975 9.973 1.00 0.00 H new ATOM 0 HE1 TRP A 113 2.786 7.184 11.053 1.00 0.00 H new ATOM 0 HE3 TRP A 113 -0.541 3.170 12.379 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 0.672 7.994 12.724 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 -1.903 4.728 13.714 1.00 0.00 H new ATOM 0 HH2 TRP A 113 -1.306 7.107 13.878 1.00 0.00 H new ATOM 1861 N ILE A 114 -0.793 1.073 10.744 1.00 0.00 N ATOM 1862 CA ILE A 114 -2.077 0.863 11.402 1.00 0.00 C ATOM 1863 C ILE A 114 -1.888 0.771 12.905 1.00 0.00 C ATOM 1864 O ILE A 114 -0.959 0.115 13.378 1.00 0.00 O ATOM 1865 CB ILE A 114 -2.764 -0.439 10.934 1.00 0.00 C ATOM 1866 CG1 ILE A 114 -2.830 -0.518 9.409 1.00 0.00 C ATOM 1867 CG2 ILE A 114 -4.157 -0.546 11.532 1.00 0.00 C ATOM 1868 CD1 ILE A 114 -3.592 0.625 8.775 1.00 0.00 C ATOM 0 H ILE A 114 -0.153 0.283 10.822 1.00 0.00 H new ATOM 0 HA ILE A 114 -2.705 1.714 11.138 1.00 0.00 H new ATOM 0 HB ILE A 114 -2.164 -1.279 11.285 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -1.816 -0.533 9.010 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -3.299 -1.459 9.122 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -4.629 -1.468 11.193 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -4.086 -0.553 12.620 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -4.757 0.306 11.213 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -3.597 0.502 7.692 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -4.617 0.628 9.145 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -3.111 1.569 9.031 1.00 0.00 H new ATOM 1880 N ASP A 115 -2.778 1.405 13.658 1.00 0.00 N ATOM 1881 CA ASP A 115 -2.689 1.361 15.106 1.00 0.00 C ATOM 1882 C ASP A 115 -3.403 0.115 15.628 1.00 0.00 C ATOM 1883 O ASP A 115 -4.542 -0.172 15.250 1.00 0.00 O ATOM 1884 CB ASP A 115 -3.246 2.655 15.727 1.00 0.00 C ATOM 1885 CG ASP A 115 -4.742 2.622 15.976 1.00 0.00 C ATOM 1886 OD1 ASP A 115 -5.219 1.648 16.581 1.00 0.00 O ATOM 1887 OD2 ASP A 115 -5.434 3.581 15.575 1.00 0.00 O ATOM 0 H ASP A 115 -3.560 1.949 13.293 1.00 0.00 H new ATOM 0 HA ASP A 115 -1.642 1.296 15.403 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -2.734 2.843 16.671 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -3.016 3.492 15.067 1.00 0.00 H new ATOM 1892 N LEU A 116 -2.702 -0.642 16.463 1.00 0.00 N ATOM 1893 CA LEU A 116 -3.223 -1.892 17.010 1.00 0.00 C ATOM 1894 C LEU A 116 -4.177 -1.681 18.188 1.00 0.00 C ATOM 1895 O LEU A 116 -4.485 -2.625 18.914 1.00 0.00 O ATOM 1896 CB LEU A 116 -2.055 -2.776 17.439 1.00 0.00 C ATOM 1897 CG LEU A 116 -0.849 -2.748 16.488 1.00 0.00 C ATOM 1898 CD1 LEU A 116 0.405 -2.286 17.215 1.00 0.00 C ATOM 1899 CD2 LEU A 116 -0.630 -4.115 15.850 1.00 0.00 C ATOM 0 H LEU A 116 -1.761 -0.410 16.780 1.00 0.00 H new ATOM 0 HA LEU A 116 -3.803 -2.374 16.223 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -1.726 -2.465 18.431 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -2.408 -3.804 17.528 1.00 0.00 H new ATOM 0 HG LEU A 116 -1.063 -2.033 15.694 1.00 0.00 H new ATOM 0 HD11 LEU A 116 1.245 -2.275 16.520 1.00 0.00 H new ATOM 0 HD12 LEU A 116 0.247 -1.283 17.610 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.622 -2.969 18.036 1.00 0.00 H new ATOM 0 HD21 LEU A 116 0.229 -4.071 15.181 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -0.445 -4.855 16.629 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -1.517 -4.398 15.283 1.00 0.00 H new ATOM 1911 N HIS A 117 -4.651 -0.454 18.374 1.00 0.00 N ATOM 1912 CA HIS A 117 -5.575 -0.157 19.466 1.00 0.00 C ATOM 1913 C HIS A 117 -6.912 0.334 18.919 1.00 0.00 C ATOM 1914 O HIS A 117 -7.963 -0.245 19.193 1.00 0.00 O ATOM 1915 CB HIS A 117 -4.976 0.895 20.402 1.00 0.00 C ATOM 1916 CG HIS A 117 -3.504 0.731 20.628 1.00 0.00 C ATOM 1917 ND1 HIS A 117 -2.961 0.413 21.855 1.00 0.00 N ATOM 1918 CD2 HIS A 117 -2.459 0.842 19.772 1.00 0.00 C ATOM 1919 CE1 HIS A 117 -1.646 0.335 21.745 1.00 0.00 C ATOM 1920 NE2 HIS A 117 -1.317 0.591 20.493 1.00 0.00 N ATOM 0 H HIS A 117 -4.414 0.347 17.788 1.00 0.00 H new ATOM 0 HA HIS A 117 -5.743 -1.075 20.029 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -5.163 1.886 19.988 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -5.490 0.849 21.362 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -2.514 1.083 18.721 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -0.958 0.101 22.544 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -0.367 0.601 20.121 1.00 0.00 H new ATOM 1929 N ARG A 118 -6.854 1.408 18.143 1.00 0.00 N ATOM 1930 CA ARG A 118 -8.042 2.001 17.541 1.00 0.00 C ATOM 1931 C ARG A 118 -8.364 1.364 16.186 1.00 0.00 C ATOM 1932 O ARG A 118 -9.487 1.480 15.699 1.00 0.00 O ATOM 1933 CB ARG A 118 -7.856 3.514 17.371 1.00 0.00 C ATOM 1934 CG ARG A 118 -6.809 4.116 18.297 1.00 0.00 C ATOM 1935 CD ARG A 118 -6.808 5.634 18.230 1.00 0.00 C ATOM 1936 NE ARG A 118 -5.630 6.208 18.877 1.00 0.00 N ATOM 1937 CZ ARG A 118 -5.512 7.496 19.196 1.00 0.00 C ATOM 1938 NH1 ARG A 118 -6.498 8.345 18.931 1.00 0.00 N ATOM 1939 NH2 ARG A 118 -4.407 7.933 19.783 1.00 0.00 N ATOM 0 H ARG A 118 -5.986 1.892 17.913 1.00 0.00 H new ATOM 0 HA ARG A 118 -8.879 1.812 18.213 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -7.576 3.722 16.338 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -8.811 4.009 17.548 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -7.002 3.797 19.321 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -5.823 3.739 18.026 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -6.840 5.951 17.188 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -7.709 6.019 18.708 1.00 0.00 H new ATOM 0 HE ARG A 118 -4.852 5.586 19.097 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -7.351 8.012 18.481 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -6.403 9.330 19.177 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -3.648 7.283 19.990 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -4.315 8.919 20.028 1.00 0.00 H new ATOM 1953 N LEU A 119 -7.376 0.691 15.583 1.00 0.00 N ATOM 1954 CA LEU A 119 -7.563 0.034 14.285 1.00 0.00 C ATOM 1955 C LEU A 119 -7.587 1.049 13.142 1.00 0.00 C ATOM 1956 O LEU A 119 -8.299 0.893 12.141 1.00 0.00 O ATOM 1957 CB LEU A 119 -8.837 -0.796 14.292 1.00 0.00 C ATOM 1958 CG LEU A 119 -8.886 -1.903 15.357 1.00 0.00 C ATOM 1959 CD1 LEU A 119 -9.889 -2.976 14.970 1.00 0.00 C ATOM 1960 CD2 LEU A 119 -7.508 -2.522 15.562 1.00 0.00 C ATOM 0 H LEU A 119 -6.440 0.588 15.974 1.00 0.00 H new ATOM 0 HA LEU A 119 -6.713 -0.628 14.119 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -9.686 -0.129 14.443 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -8.961 -1.252 13.310 1.00 0.00 H new ATOM 0 HG LEU A 119 -9.204 -1.450 16.296 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -9.908 -3.750 15.737 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -10.880 -2.532 14.878 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -9.600 -3.418 14.016 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -7.569 -3.303 16.320 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -7.160 -2.954 14.624 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -6.808 -1.753 15.889 1.00 0.00 H new ATOM 1972 N ASP A 120 -6.778 2.077 13.311 1.00 0.00 N ATOM 1973 CA ASP A 120 -6.633 3.144 12.328 1.00 0.00 C ATOM 1974 C ASP A 120 -5.221 3.710 12.411 1.00 0.00 C ATOM 1975 O ASP A 120 -4.504 3.444 13.374 1.00 0.00 O ATOM 1976 CB ASP A 120 -7.664 4.249 12.574 1.00 0.00 C ATOM 1977 CG ASP A 120 -7.493 4.913 13.927 1.00 0.00 C ATOM 1978 OD1 ASP A 120 -6.386 5.419 14.205 1.00 0.00 O ATOM 1979 OD2 ASP A 120 -8.468 4.927 14.708 1.00 0.00 O ATOM 0 H ASP A 120 -6.196 2.200 14.140 1.00 0.00 H new ATOM 0 HA ASP A 120 -6.806 2.739 11.331 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -7.579 5.002 11.790 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -8.667 3.828 12.504 1.00 0.00 H new ATOM 1984 N GLY A 121 -4.808 4.482 11.412 1.00 0.00 N ATOM 1985 CA GLY A 121 -3.468 5.038 11.448 1.00 0.00 C ATOM 1986 C GLY A 121 -3.225 6.109 10.409 1.00 0.00 C ATOM 1987 O GLY A 121 -4.090 6.944 10.145 1.00 0.00 O ATOM 0 H GLY A 121 -5.364 4.729 10.593 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -3.285 5.456 12.438 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -2.747 4.234 11.303 1.00 0.00 H new ATOM 1991 N MET A 122 -2.028 6.091 9.828 1.00 0.00 N ATOM 1992 CA MET A 122 -1.652 7.073 8.819 1.00 0.00 C ATOM 1993 C MET A 122 -1.187 6.394 7.536 1.00 0.00 C ATOM 1994 O MET A 122 -0.321 5.519 7.562 1.00 0.00 O ATOM 1995 CB MET A 122 -0.543 7.982 9.352 1.00 0.00 C ATOM 1996 CG MET A 122 -1.026 9.001 10.373 1.00 0.00 C ATOM 1997 SD MET A 122 -0.760 10.704 9.839 1.00 0.00 S ATOM 1998 CE MET A 122 -2.336 11.442 10.259 1.00 0.00 C ATOM 0 H MET A 122 -1.303 5.406 10.040 1.00 0.00 H new ATOM 0 HA MET A 122 -2.533 7.673 8.592 1.00 0.00 H new ATOM 0 HB2 MET A 122 0.233 7.366 9.806 1.00 0.00 H new ATOM 0 HB3 MET A 122 -0.083 8.509 8.516 1.00 0.00 H new ATOM 0 HG2 MET A 122 -2.088 8.845 10.561 1.00 0.00 H new ATOM 0 HG3 MET A 122 -0.508 8.836 11.318 1.00 0.00 H new ATOM 0 HE1 MET A 122 -2.610 12.173 9.498 1.00 0.00 H new ATOM 0 HE2 MET A 122 -3.100 10.666 10.308 1.00 0.00 H new ATOM 0 HE3 MET A 122 -2.259 11.937 11.227 1.00 0.00 H new ATOM 2008 N GLY A 123 -1.763 6.810 6.415 1.00 0.00 N ATOM 2009 CA GLY A 123 -1.392 6.242 5.134 1.00 0.00 C ATOM 2010 C GLY A 123 -0.904 7.299 4.165 1.00 0.00 C ATOM 2011 O GLY A 123 -1.019 8.495 4.435 1.00 0.00 O ATOM 0 H GLY A 123 -2.482 7.532 6.371 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -0.611 5.496 5.281 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -2.250 5.725 4.705 1.00 0.00 H new ATOM 2015 N CYS A 124 -0.357 6.866 3.036 1.00 0.00 N ATOM 2016 CA CYS A 124 0.148 7.799 2.036 1.00 0.00 C ATOM 2017 C CYS A 124 0.500 7.083 0.736 1.00 0.00 C ATOM 2018 O CYS A 124 0.762 5.881 0.728 1.00 0.00 O ATOM 2019 CB CYS A 124 1.375 8.539 2.576 1.00 0.00 C ATOM 2020 SG CYS A 124 2.869 7.523 2.696 1.00 0.00 S ATOM 0 H CYS A 124 -0.252 5.882 2.791 1.00 0.00 H new ATOM 0 HA CYS A 124 -0.641 8.520 1.822 1.00 0.00 H new ATOM 0 HB2 CYS A 124 1.582 9.393 1.931 1.00 0.00 H new ATOM 0 HB3 CYS A 124 1.140 8.935 3.564 1.00 0.00 H new ATOM 0 HG CYS A 124 2.540 6.300 2.989 1.00 0.00 H new ATOM 2026 N LEU A 125 0.511 7.836 -0.357 1.00 0.00 N ATOM 2027 CA LEU A 125 0.842 7.276 -1.664 1.00 0.00 C ATOM 2028 C LEU A 125 2.197 7.793 -2.143 1.00 0.00 C ATOM 2029 O LEU A 125 2.664 8.841 -1.700 1.00 0.00 O ATOM 2030 CB LEU A 125 -0.245 7.621 -2.688 1.00 0.00 C ATOM 2031 CG LEU A 125 -1.504 6.753 -2.623 1.00 0.00 C ATOM 2032 CD1 LEU A 125 -2.530 7.223 -3.646 1.00 0.00 C ATOM 2033 CD2 LEU A 125 -1.156 5.291 -2.846 1.00 0.00 C ATOM 0 H LEU A 125 0.295 8.833 -0.366 1.00 0.00 H new ATOM 0 HA LEU A 125 0.898 6.192 -1.565 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -0.534 8.663 -2.549 1.00 0.00 H new ATOM 0 HB3 LEU A 125 0.182 7.539 -3.688 1.00 0.00 H new ATOM 0 HG LEU A 125 -1.940 6.853 -1.629 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -3.418 6.594 -3.585 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -2.803 8.258 -3.439 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -2.104 7.154 -4.647 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -2.064 4.689 -2.796 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -0.695 5.172 -3.827 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -0.459 4.961 -2.075 1.00 0.00 H new ATOM 2045 N GLU A 126 2.825 7.049 -3.045 1.00 0.00 N ATOM 2046 CA GLU A 126 4.123 7.426 -3.586 1.00 0.00 C ATOM 2047 C GLU A 126 4.265 6.893 -5.003 1.00 0.00 C ATOM 2048 O GLU A 126 3.585 5.946 -5.380 1.00 0.00 O ATOM 2049 CB GLU A 126 5.249 6.882 -2.703 1.00 0.00 C ATOM 2050 CG GLU A 126 5.678 7.842 -1.604 1.00 0.00 C ATOM 2051 CD GLU A 126 6.668 7.219 -0.640 1.00 0.00 C ATOM 2052 OE1 GLU A 126 6.390 6.110 -0.137 1.00 0.00 O ATOM 2053 OE2 GLU A 126 7.721 7.840 -0.389 1.00 0.00 O ATOM 0 H GLU A 126 2.453 6.176 -3.419 1.00 0.00 H new ATOM 0 HA GLU A 126 4.194 8.514 -3.605 1.00 0.00 H new ATOM 0 HB2 GLU A 126 4.924 5.946 -2.250 1.00 0.00 H new ATOM 0 HB3 GLU A 126 6.111 6.651 -3.329 1.00 0.00 H new ATOM 0 HG2 GLU A 126 6.124 8.729 -2.055 1.00 0.00 H new ATOM 0 HG3 GLU A 126 4.798 8.173 -1.052 1.00 0.00 H new ATOM 2060 N PHE A 127 5.141 7.496 -5.792 1.00 0.00 N ATOM 2061 CA PHE A 127 5.343 7.054 -7.154 1.00 0.00 C ATOM 2062 C PHE A 127 6.661 6.289 -7.257 1.00 0.00 C ATOM 2063 O PHE A 127 7.643 6.639 -6.601 1.00 0.00 O ATOM 2064 CB PHE A 127 5.307 8.260 -8.096 1.00 0.00 C ATOM 2065 CG PHE A 127 5.994 8.034 -9.402 1.00 0.00 C ATOM 2066 CD1 PHE A 127 7.368 7.981 -9.459 1.00 0.00 C ATOM 2067 CD2 PHE A 127 5.265 7.872 -10.568 1.00 0.00 C ATOM 2068 CE1 PHE A 127 8.015 7.769 -10.659 1.00 0.00 C ATOM 2069 CE2 PHE A 127 5.905 7.662 -11.772 1.00 0.00 C ATOM 2070 CZ PHE A 127 7.284 7.610 -11.818 1.00 0.00 C ATOM 0 H PHE A 127 5.718 8.288 -5.510 1.00 0.00 H new ATOM 0 HA PHE A 127 4.543 6.376 -7.450 1.00 0.00 H new ATOM 0 HB2 PHE A 127 4.268 8.528 -8.286 1.00 0.00 H new ATOM 0 HB3 PHE A 127 5.770 9.111 -7.597 1.00 0.00 H new ATOM 0 HD1 PHE A 127 7.946 8.107 -8.555 1.00 0.00 H new ATOM 0 HD2 PHE A 127 4.186 7.910 -10.535 1.00 0.00 H new ATOM 0 HE1 PHE A 127 9.094 7.728 -10.691 1.00 0.00 H new ATOM 0 HE2 PHE A 127 5.328 7.539 -12.677 1.00 0.00 H new ATOM 0 HZ PHE A 127 7.789 7.445 -12.758 1.00 0.00 H new ATOM 2080 N ASP A 128 6.675 5.239 -8.069 1.00 0.00 N ATOM 2081 CA ASP A 128 7.872 4.422 -8.237 1.00 0.00 C ATOM 2082 C ASP A 128 8.751 4.949 -9.366 1.00 0.00 C ATOM 2083 O ASP A 128 8.384 4.876 -10.536 1.00 0.00 O ATOM 2084 CB ASP A 128 7.487 2.969 -8.515 1.00 0.00 C ATOM 2085 CG ASP A 128 8.560 1.992 -8.078 1.00 0.00 C ATOM 2086 OD1 ASP A 128 9.757 2.318 -8.228 1.00 0.00 O ATOM 2087 OD2 ASP A 128 8.205 0.901 -7.586 1.00 0.00 O ATOM 0 H ASP A 128 5.873 4.933 -8.621 1.00 0.00 H new ATOM 0 HA ASP A 128 8.442 4.474 -7.309 1.00 0.00 H new ATOM 0 HB2 ASP A 128 6.556 2.737 -7.997 1.00 0.00 H new ATOM 0 HB3 ASP A 128 7.298 2.844 -9.581 1.00 0.00 H new ATOM 2092 N GLU A 129 9.918 5.476 -9.004 1.00 0.00 N ATOM 2093 CA GLU A 129 10.858 6.011 -9.985 1.00 0.00 C ATOM 2094 C GLU A 129 11.829 4.933 -10.467 1.00 0.00 C ATOM 2095 O GLU A 129 12.519 5.113 -11.468 1.00 0.00 O ATOM 2096 CB GLU A 129 11.639 7.186 -9.387 1.00 0.00 C ATOM 2097 CG GLU A 129 10.982 8.540 -9.617 1.00 0.00 C ATOM 2098 CD GLU A 129 11.836 9.692 -9.123 1.00 0.00 C ATOM 2099 OE1 GLU A 129 13.052 9.695 -9.408 1.00 0.00 O ATOM 2100 OE2 GLU A 129 11.289 10.590 -8.450 1.00 0.00 O ATOM 0 H GLU A 129 10.236 5.544 -8.037 1.00 0.00 H new ATOM 0 HA GLU A 129 10.283 6.361 -10.842 1.00 0.00 H new ATOM 0 HB2 GLU A 129 11.754 7.026 -8.315 1.00 0.00 H new ATOM 0 HB3 GLU A 129 12.641 7.201 -9.817 1.00 0.00 H new ATOM 0 HG2 GLU A 129 10.785 8.668 -10.681 1.00 0.00 H new ATOM 0 HG3 GLU A 129 10.018 8.563 -9.109 1.00 0.00 H new ATOM 2107 N GLU A 130 11.876 3.812 -9.751 1.00 0.00 N ATOM 2108 CA GLU A 130 12.762 2.713 -10.114 1.00 0.00 C ATOM 2109 C GLU A 130 12.135 1.846 -11.200 1.00 0.00 C ATOM 2110 O GLU A 130 12.782 1.508 -12.191 1.00 0.00 O ATOM 2111 CB GLU A 130 13.082 1.858 -8.885 1.00 0.00 C ATOM 2112 CG GLU A 130 13.437 2.674 -7.652 1.00 0.00 C ATOM 2113 CD GLU A 130 13.292 1.882 -6.368 1.00 0.00 C ATOM 2114 OE1 GLU A 130 12.246 1.223 -6.193 1.00 0.00 O ATOM 2115 OE2 GLU A 130 14.224 1.921 -5.538 1.00 0.00 O ATOM 0 H GLU A 130 11.312 3.643 -8.918 1.00 0.00 H new ATOM 0 HA GLU A 130 13.687 3.139 -10.502 1.00 0.00 H new ATOM 0 HB2 GLU A 130 12.223 1.227 -8.658 1.00 0.00 H new ATOM 0 HB3 GLU A 130 13.912 1.193 -9.122 1.00 0.00 H new ATOM 0 HG2 GLU A 130 14.463 3.031 -7.740 1.00 0.00 H new ATOM 0 HG3 GLU A 130 12.796 3.554 -7.606 1.00 0.00 H new ATOM 2122 N ARG A 131 10.869 1.491 -11.006 1.00 0.00 N ATOM 2123 CA ARG A 131 10.149 0.665 -11.967 1.00 0.00 C ATOM 2124 C ARG A 131 9.635 1.510 -13.126 1.00 0.00 C ATOM 2125 O ARG A 131 9.590 1.057 -14.269 1.00 0.00 O ATOM 2126 CB ARG A 131 8.978 -0.038 -11.284 1.00 0.00 C ATOM 2127 CG ARG A 131 8.631 -1.385 -11.902 1.00 0.00 C ATOM 2128 CD ARG A 131 9.210 -2.536 -11.095 1.00 0.00 C ATOM 2129 NE ARG A 131 8.202 -3.176 -10.253 1.00 0.00 N ATOM 2130 CZ ARG A 131 8.333 -4.396 -9.738 1.00 0.00 C ATOM 2131 NH1 ARG A 131 9.427 -5.111 -9.973 1.00 0.00 N ATOM 2132 NH2 ARG A 131 7.369 -4.904 -8.984 1.00 0.00 N ATOM 0 H ARG A 131 10.320 1.763 -10.190 1.00 0.00 H new ATOM 0 HA ARG A 131 10.839 -0.083 -12.358 1.00 0.00 H new ATOM 0 HB2 ARG A 131 9.216 -0.182 -10.230 1.00 0.00 H new ATOM 0 HB3 ARG A 131 8.102 0.609 -11.327 1.00 0.00 H new ATOM 0 HG2 ARG A 131 7.548 -1.490 -11.962 1.00 0.00 H new ATOM 0 HG3 ARG A 131 9.012 -1.427 -12.922 1.00 0.00 H new ATOM 0 HD2 ARG A 131 9.638 -3.275 -11.773 1.00 0.00 H new ATOM 0 HD3 ARG A 131 10.023 -2.167 -10.470 1.00 0.00 H new ATOM 0 HE ARG A 131 7.348 -2.657 -10.048 1.00 0.00 H new ATOM 0 HH11 ARG A 131 10.174 -4.726 -10.551 1.00 0.00 H new ATOM 0 HH12 ARG A 131 9.521 -6.045 -9.575 1.00 0.00 H new ATOM 0 HH21 ARG A 131 6.526 -4.360 -8.798 1.00 0.00 H new ATOM 0 HH22 ARG A 131 7.469 -5.839 -8.589 1.00 0.00 H new ATOM 2146 N ALA A 132 9.247 2.744 -12.818 1.00 0.00 N ATOM 2147 CA ALA A 132 8.731 3.664 -13.828 1.00 0.00 C ATOM 2148 C ALA A 132 9.654 3.739 -15.040 1.00 0.00 C ATOM 2149 O ALA A 132 9.195 3.773 -16.182 1.00 0.00 O ATOM 2150 CB ALA A 132 8.542 5.049 -13.227 1.00 0.00 C ATOM 0 H ALA A 132 9.280 3.131 -11.875 1.00 0.00 H new ATOM 0 HA ALA A 132 7.767 3.283 -14.165 1.00 0.00 H new ATOM 0 HB1 ALA A 132 8.157 5.727 -13.989 1.00 0.00 H new ATOM 0 HB2 ALA A 132 7.834 4.993 -12.400 1.00 0.00 H new ATOM 0 HB3 ALA A 132 9.499 5.421 -12.861 1.00 0.00 H new ATOM 2156 N GLN A 133 10.957 3.769 -14.784 1.00 0.00 N ATOM 2157 CA GLN A 133 11.946 3.845 -15.853 1.00 0.00 C ATOM 2158 C GLN A 133 11.919 2.590 -16.720 1.00 0.00 C ATOM 2159 O GLN A 133 11.955 2.673 -17.947 1.00 0.00 O ATOM 2160 CB GLN A 133 13.345 4.045 -15.269 1.00 0.00 C ATOM 2161 CG GLN A 133 13.484 5.313 -14.443 1.00 0.00 C ATOM 2162 CD GLN A 133 14.301 6.381 -15.145 1.00 0.00 C ATOM 2163 OE1 GLN A 133 14.159 6.596 -16.349 1.00 0.00 O ATOM 2164 NE2 GLN A 133 15.164 7.054 -14.394 1.00 0.00 N ATOM 0 H GLN A 133 11.353 3.742 -13.845 1.00 0.00 H new ATOM 0 HA GLN A 133 11.694 4.700 -16.481 1.00 0.00 H new ATOM 0 HB2 GLN A 133 13.596 3.186 -14.646 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.069 4.071 -16.083 1.00 0.00 H new ATOM 0 HG2 GLN A 133 12.493 5.707 -14.220 1.00 0.00 H new ATOM 0 HG3 GLN A 133 13.953 5.071 -13.489 1.00 0.00 H new ATOM 0 HE21 GLN A 133 15.248 6.842 -13.400 1.00 0.00 H new ATOM 0 HE22 GLN A 133 15.743 7.783 -14.811 1.00 0.00 H new ATOM 2173 N GLN A 134 11.859 1.429 -16.076 1.00 0.00 N ATOM 2174 CA GLN A 134 11.833 0.162 -16.797 1.00 0.00 C ATOM 2175 C GLN A 134 10.626 0.087 -17.722 1.00 0.00 C ATOM 2176 O GLN A 134 10.708 -0.485 -18.809 1.00 0.00 O ATOM 2177 CB GLN A 134 11.827 -1.015 -15.818 1.00 0.00 C ATOM 2178 CG GLN A 134 12.984 -1.979 -16.022 1.00 0.00 C ATOM 2179 CD GLN A 134 13.128 -2.968 -14.881 1.00 0.00 C ATOM 2180 OE1 GLN A 134 13.247 -2.579 -13.719 1.00 0.00 O ATOM 2181 NE2 GLN A 134 13.118 -4.255 -15.209 1.00 0.00 N ATOM 0 H GLN A 134 11.828 1.339 -15.060 1.00 0.00 H new ATOM 0 HA GLN A 134 12.735 0.103 -17.407 1.00 0.00 H new ATOM 0 HB2 GLN A 134 11.861 -0.630 -14.799 1.00 0.00 H new ATOM 0 HB3 GLN A 134 10.888 -1.559 -15.922 1.00 0.00 H new ATOM 0 HG2 GLN A 134 12.837 -2.524 -16.954 1.00 0.00 H new ATOM 0 HG3 GLN A 134 13.910 -1.413 -16.126 1.00 0.00 H new ATOM 0 HE21 GLN A 134 13.017 -4.532 -16.186 1.00 0.00 H new ATOM 0 HE22 GLN A 134 13.211 -4.967 -14.484 1.00 0.00 H new ATOM 2190 N GLU A 135 9.512 0.681 -17.303 1.00 0.00 N ATOM 2191 CA GLU A 135 8.312 0.684 -18.130 1.00 0.00 C ATOM 2192 C GLU A 135 8.670 1.178 -19.520 1.00 0.00 C ATOM 2193 O GLU A 135 8.168 0.677 -20.526 1.00 0.00 O ATOM 2194 CB GLU A 135 7.224 1.573 -17.520 1.00 0.00 C ATOM 2195 CG GLU A 135 7.125 1.477 -16.005 1.00 0.00 C ATOM 2196 CD GLU A 135 7.033 0.045 -15.514 1.00 0.00 C ATOM 2197 OE1 GLU A 135 7.975 -0.733 -15.774 1.00 0.00 O ATOM 2198 OE2 GLU A 135 6.021 -0.298 -14.868 1.00 0.00 O ATOM 0 H GLU A 135 9.416 1.160 -16.408 1.00 0.00 H new ATOM 0 HA GLU A 135 7.920 -0.331 -18.186 1.00 0.00 H new ATOM 0 HB2 GLU A 135 7.419 2.609 -17.796 1.00 0.00 H new ATOM 0 HB3 GLU A 135 6.262 1.302 -17.955 1.00 0.00 H new ATOM 0 HG2 GLU A 135 7.996 1.955 -15.557 1.00 0.00 H new ATOM 0 HG3 GLU A 135 6.249 2.030 -15.666 1.00 0.00 H new ATOM 2205 N ASP A 136 9.569 2.154 -19.560 1.00 0.00 N ATOM 2206 CA ASP A 136 10.035 2.711 -20.809 1.00 0.00 C ATOM 2207 C ASP A 136 10.909 1.696 -21.536 1.00 0.00 C ATOM 2208 O ASP A 136 10.834 1.558 -22.756 1.00 0.00 O ATOM 2209 CB ASP A 136 10.820 4.002 -20.562 1.00 0.00 C ATOM 2210 CG ASP A 136 10.001 5.042 -19.823 1.00 0.00 C ATOM 2211 OD1 ASP A 136 8.875 5.340 -20.272 1.00 0.00 O ATOM 2212 OD2 ASP A 136 10.487 5.558 -18.794 1.00 0.00 O ATOM 0 H ASP A 136 9.988 2.574 -18.731 1.00 0.00 H new ATOM 0 HA ASP A 136 9.171 2.947 -21.430 1.00 0.00 H new ATOM 0 HB2 ASP A 136 11.718 3.774 -19.987 1.00 0.00 H new ATOM 0 HB3 ASP A 136 11.149 4.413 -21.517 1.00 0.00 H new ATOM 2217 N ALA A 137 11.735 0.978 -20.773 1.00 0.00 N ATOM 2218 CA ALA A 137 12.612 -0.025 -21.343 1.00 0.00 C ATOM 2219 C ALA A 137 11.809 -1.177 -21.935 1.00 0.00 C ATOM 2220 O ALA A 137 12.038 -1.589 -23.072 1.00 0.00 O ATOM 2221 CB ALA A 137 13.583 -0.540 -20.291 1.00 0.00 C ATOM 0 H ALA A 137 11.809 1.078 -19.761 1.00 0.00 H new ATOM 0 HA ALA A 137 13.182 0.440 -22.147 1.00 0.00 H new ATOM 0 HB1 ALA A 137 14.235 -1.293 -20.735 1.00 0.00 H new ATOM 0 HB2 ALA A 137 14.186 0.287 -19.917 1.00 0.00 H new ATOM 0 HB3 ALA A 137 13.025 -0.984 -19.467 1.00 0.00 H new ATOM 2227 N LEU A 138 10.868 -1.696 -21.152 1.00 0.00 N ATOM 2228 CA LEU A 138 10.032 -2.798 -21.589 1.00 0.00 C ATOM 2229 C LEU A 138 9.063 -2.354 -22.671 1.00 0.00 C ATOM 2230 O LEU A 138 8.831 -3.071 -23.644 1.00 0.00 O ATOM 2231 CB LEU A 138 9.267 -3.386 -20.399 1.00 0.00 C ATOM 2232 CG LEU A 138 10.140 -3.838 -19.224 1.00 0.00 C ATOM 2233 CD1 LEU A 138 9.561 -5.087 -18.577 1.00 0.00 C ATOM 2234 CD2 LEU A 138 11.571 -4.085 -19.683 1.00 0.00 C ATOM 0 H LEU A 138 10.668 -1.366 -20.208 1.00 0.00 H new ATOM 0 HA LEU A 138 10.678 -3.568 -22.010 1.00 0.00 H new ATOM 0 HB2 LEU A 138 8.558 -2.641 -20.039 1.00 0.00 H new ATOM 0 HB3 LEU A 138 8.684 -4.239 -20.747 1.00 0.00 H new ATOM 0 HG LEU A 138 10.153 -3.042 -18.480 1.00 0.00 H new ATOM 0 HD11 LEU A 138 10.195 -5.393 -17.745 1.00 0.00 H new ATOM 0 HD12 LEU A 138 8.557 -4.874 -18.210 1.00 0.00 H new ATOM 0 HD13 LEU A 138 9.516 -5.890 -19.313 1.00 0.00 H new ATOM 0 HD21 LEU A 138 12.175 -4.405 -18.834 1.00 0.00 H new ATOM 0 HD22 LEU A 138 11.579 -4.862 -20.448 1.00 0.00 H new ATOM 0 HD23 LEU A 138 11.984 -3.165 -20.096 1.00 0.00 H new ATOM 2246 N ALA A 139 8.507 -1.161 -22.504 1.00 0.00 N ATOM 2247 CA ALA A 139 7.579 -0.621 -23.472 1.00 0.00 C ATOM 2248 C ALA A 139 8.320 -0.193 -24.729 1.00 0.00 C ATOM 2249 O ALA A 139 7.735 -0.089 -25.808 1.00 0.00 O ATOM 2250 CB ALA A 139 6.808 0.548 -22.881 1.00 0.00 C ATOM 0 H ALA A 139 8.687 -0.553 -21.705 1.00 0.00 H new ATOM 0 HA ALA A 139 6.864 -1.399 -23.738 1.00 0.00 H new ATOM 0 HB1 ALA A 139 6.115 0.940 -23.625 1.00 0.00 H new ATOM 0 HB2 ALA A 139 6.250 0.211 -22.007 1.00 0.00 H new ATOM 0 HB3 ALA A 139 7.505 1.332 -22.586 1.00 0.00 H new ATOM 2256 N GLN A 140 9.616 0.070 -24.576 1.00 0.00 N ATOM 2257 CA GLN A 140 10.444 0.498 -25.669 1.00 0.00 C ATOM 2258 C GLN A 140 11.727 -0.328 -25.732 1.00 0.00 C ATOM 2259 O GLN A 140 12.653 -0.115 -24.950 1.00 0.00 O ATOM 2260 CB GLN A 140 10.781 1.971 -25.478 1.00 0.00 C ATOM 2261 CG GLN A 140 9.625 2.790 -24.920 1.00 0.00 C ATOM 2262 CD GLN A 140 8.542 3.047 -25.950 1.00 0.00 C ATOM 2263 OE1 GLN A 140 8.504 2.407 -27.000 1.00 0.00 O ATOM 2264 NE2 GLN A 140 7.654 3.987 -25.652 1.00 0.00 N ATOM 0 H GLN A 140 10.108 -0.012 -23.686 1.00 0.00 H new ATOM 0 HA GLN A 140 9.906 0.356 -26.606 1.00 0.00 H new ATOM 0 HB2 GLN A 140 11.634 2.056 -24.805 1.00 0.00 H new ATOM 0 HB3 GLN A 140 11.086 2.393 -26.435 1.00 0.00 H new ATOM 0 HG2 GLN A 140 9.193 2.267 -24.067 1.00 0.00 H new ATOM 0 HG3 GLN A 140 10.004 3.743 -24.551 1.00 0.00 H new ATOM 0 HE21 GLN A 140 7.724 4.493 -24.769 1.00 0.00 H new ATOM 0 HE22 GLN A 140 6.902 4.203 -26.306 1.00 0.00 H new ATOM 2273 N GLN A 141 11.777 -1.266 -26.671 1.00 0.00 N ATOM 2274 CA GLN A 141 12.947 -2.120 -26.838 1.00 0.00 C ATOM 2275 C GLN A 141 13.533 -1.974 -28.238 1.00 0.00 C ATOM 2276 O GLN A 141 14.727 -2.294 -28.416 1.00 0.00 O ATOM 2277 CB GLN A 141 12.580 -3.582 -26.576 1.00 0.00 C ATOM 2278 CG GLN A 141 12.014 -3.827 -25.187 1.00 0.00 C ATOM 2279 CD GLN A 141 12.018 -5.295 -24.807 1.00 0.00 C ATOM 2280 OE1 GLN A 141 13.067 -5.940 -24.789 1.00 0.00 O ATOM 2281 NE2 GLN A 141 10.842 -5.831 -24.501 1.00 0.00 N ATOM 2282 OXT GLN A 141 12.792 -1.542 -29.146 1.00 0.00 O ATOM 0 H GLN A 141 11.020 -1.454 -27.329 1.00 0.00 H new ATOM 0 HA GLN A 141 13.700 -1.806 -26.115 1.00 0.00 H new ATOM 0 HB2 GLN A 141 11.850 -3.903 -27.319 1.00 0.00 H new ATOM 0 HB3 GLN A 141 13.467 -4.201 -26.712 1.00 0.00 H new ATOM 0 HG2 GLN A 141 12.596 -3.265 -24.457 1.00 0.00 H new ATOM 0 HG3 GLN A 141 10.994 -3.446 -25.142 1.00 0.00 H new ATOM 0 HE21 GLN A 141 9.998 -5.259 -24.529 1.00 0.00 H new ATOM 0 HE22 GLN A 141 10.783 -6.815 -24.238 1.00 0.00 H new TER 2291 GLN A 141