USER MOD reduce.3.24.130724 H: found=0, std=0, add=660, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 658 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 119 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0555) USER MOD Set 1.2: A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 101 THR OG1 : rot 77:sc= 0.244 USER MOD Set 2.2: A 108 TYR OH : rot 163:sc= 0.169 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 SER OG : rot 180:sc= -0.0744 USER MOD Single : A 85 HIS :FLIP no HD1:sc= -1.11 F(o=-1.7,f=-1.1) USER MOD Single : A 86 TYR OH : rot 150:sc= -0.383 USER MOD Single : A 89 HIS : no HD1:sc= -1.11 X(o=-1.1,f=-1) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 MET CE :methyl 152:sc= -0.662 (180deg=-1.6!) USER MOD Single : A 105 LYS NZ :NH3+ -123:sc=-0.00565 (180deg=-0.872) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 SER OG : rot -58:sc= 0.117 USER MOD Single : A 116 LYS NZ :NH3+ -164:sc=-0.00217 (180deg=-0.115) USER MOD Single : A 118 GLN : amide:sc= -0.622 X(o=-0.62,f=-0.5) USER MOD Single : A 121 ASN : amide:sc= 0 X(o=0,f=-0.056) USER MOD Single : A 123 ASN : amide:sc= -0.888 K(o=-0.89,f=-4.5!) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 GLN : amide:sc= -0.156 X(o=-0.16,f=-0.16) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 CYS SG : rot -105:sc= 0.159 USER MOD Single : A 138 MET CE :methyl -166:sc= -0.0984 (180deg=-0.831) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HD1:sc= -0.382 K(o=-0.38,f=-0.99) USER MOD Single : A 141 ASN : amide:sc= -0.471 X(o=-0.47,f=-0.66) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 65 15.883 9.040 -17.953 1.00 0.00 N ATOM 2 CA GLY A 65 14.862 9.118 -18.982 1.00 0.00 C ATOM 3 C GLY A 65 13.717 10.033 -18.595 1.00 0.00 C ATOM 4 O GLY A 65 12.584 9.584 -18.429 1.00 0.00 O ATOM 0 HA2 GLY A 65 15.311 9.475 -19.909 1.00 0.00 H new ATOM 0 HA3 GLY A 65 14.474 8.119 -19.180 1.00 0.00 H new ATOM 8 N SER A 66 14.014 11.320 -18.448 1.00 0.00 N ATOM 9 CA SER A 66 13.002 12.300 -18.072 1.00 0.00 C ATOM 10 C SER A 66 13.153 13.579 -18.890 1.00 0.00 C ATOM 11 O SER A 66 14.240 13.896 -19.371 1.00 0.00 O ATOM 12 CB SER A 66 13.103 12.621 -16.579 1.00 0.00 C ATOM 13 OG SER A 66 12.986 11.447 -15.796 1.00 0.00 O ATOM 0 H SER A 66 14.947 11.708 -18.584 1.00 0.00 H new ATOM 0 HA SER A 66 12.022 11.871 -18.279 1.00 0.00 H new ATOM 0 HB2 SER A 66 14.057 13.106 -16.372 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.320 13.326 -16.302 1.00 0.00 H new ATOM 0 HG SER A 66 13.055 11.679 -14.846 1.00 0.00 H new ATOM 19 N SER A 67 12.053 14.309 -19.043 1.00 0.00 N ATOM 20 CA SER A 67 12.060 15.552 -19.807 1.00 0.00 C ATOM 21 C SER A 67 12.104 16.760 -18.876 1.00 0.00 C ATOM 22 O SER A 67 11.414 17.754 -19.099 1.00 0.00 O ATOM 23 CB SER A 67 10.825 15.630 -20.706 1.00 0.00 C ATOM 24 OG SER A 67 11.008 14.873 -21.890 1.00 0.00 O ATOM 0 H SER A 67 11.146 14.062 -18.648 1.00 0.00 H new ATOM 0 HA SER A 67 12.954 15.563 -20.430 1.00 0.00 H new ATOM 0 HB2 SER A 67 9.954 15.260 -20.165 1.00 0.00 H new ATOM 0 HB3 SER A 67 10.623 16.670 -20.963 1.00 0.00 H new ATOM 0 HG SER A 67 10.204 14.937 -22.447 1.00 0.00 H new ATOM 30 N GLY A 68 12.920 16.666 -17.831 1.00 0.00 N ATOM 31 CA GLY A 68 13.039 17.757 -16.882 1.00 0.00 C ATOM 32 C GLY A 68 13.255 17.270 -15.463 1.00 0.00 C ATOM 33 O GLY A 68 13.712 16.148 -15.247 1.00 0.00 O ATOM 0 H GLY A 68 13.501 15.853 -17.625 1.00 0.00 H new ATOM 0 HA2 GLY A 68 13.871 18.399 -17.173 1.00 0.00 H new ATOM 0 HA3 GLY A 68 12.137 18.368 -16.920 1.00 0.00 H new ATOM 37 N SER A 69 12.927 18.117 -14.492 1.00 0.00 N ATOM 38 CA SER A 69 13.092 17.769 -13.086 1.00 0.00 C ATOM 39 C SER A 69 12.138 16.646 -12.688 1.00 0.00 C ATOM 40 O SER A 69 11.157 16.377 -13.381 1.00 0.00 O ATOM 41 CB SER A 69 12.851 18.995 -12.203 1.00 0.00 C ATOM 42 OG SER A 69 11.563 19.541 -12.430 1.00 0.00 O ATOM 0 H SER A 69 12.545 19.049 -14.654 1.00 0.00 H new ATOM 0 HA SER A 69 14.115 17.422 -12.941 1.00 0.00 H new ATOM 0 HB2 SER A 69 12.952 18.717 -11.154 1.00 0.00 H new ATOM 0 HB3 SER A 69 13.611 19.749 -12.407 1.00 0.00 H new ATOM 0 HG SER A 69 11.432 20.322 -11.853 1.00 0.00 H new ATOM 48 N SER A 70 12.435 15.996 -11.568 1.00 0.00 N ATOM 49 CA SER A 70 11.607 14.899 -11.079 1.00 0.00 C ATOM 50 C SER A 70 10.494 15.421 -10.175 1.00 0.00 C ATOM 51 O SER A 70 10.692 16.361 -9.407 1.00 0.00 O ATOM 52 CB SER A 70 12.463 13.885 -10.319 1.00 0.00 C ATOM 53 OG SER A 70 11.685 12.784 -9.885 1.00 0.00 O ATOM 0 H SER A 70 13.242 16.209 -10.982 1.00 0.00 H new ATOM 0 HA SER A 70 11.153 14.407 -11.939 1.00 0.00 H new ATOM 0 HB2 SER A 70 13.271 13.533 -10.961 1.00 0.00 H new ATOM 0 HB3 SER A 70 12.927 14.368 -9.459 1.00 0.00 H new ATOM 0 HG SER A 70 12.256 12.150 -9.403 1.00 0.00 H new ATOM 59 N GLY A 71 9.321 14.802 -10.273 1.00 0.00 N ATOM 60 CA GLY A 71 8.193 15.216 -9.459 1.00 0.00 C ATOM 61 C GLY A 71 7.410 14.040 -8.912 1.00 0.00 C ATOM 62 O GLY A 71 7.992 13.045 -8.480 1.00 0.00 O ATOM 0 H GLY A 71 9.132 14.021 -10.902 1.00 0.00 H new ATOM 0 HA2 GLY A 71 8.552 15.827 -8.630 1.00 0.00 H new ATOM 0 HA3 GLY A 71 7.530 15.844 -10.054 1.00 0.00 H new ATOM 66 N MET A 72 6.086 14.153 -8.927 1.00 0.00 N ATOM 67 CA MET A 72 5.222 13.090 -8.427 1.00 0.00 C ATOM 68 C MET A 72 5.738 11.722 -8.860 1.00 0.00 C ATOM 69 O MET A 72 5.994 11.491 -10.042 1.00 0.00 O ATOM 70 CB MET A 72 3.790 13.290 -8.927 1.00 0.00 C ATOM 71 CG MET A 72 2.947 14.170 -8.018 1.00 0.00 C ATOM 72 SD MET A 72 3.208 15.929 -8.317 1.00 0.00 S ATOM 73 CE MET A 72 2.095 16.207 -9.692 1.00 0.00 C ATOM 0 H MET A 72 5.588 14.970 -9.280 1.00 0.00 H new ATOM 0 HA MET A 72 5.228 13.133 -7.338 1.00 0.00 H new ATOM 0 HB2 MET A 72 3.820 13.733 -9.922 1.00 0.00 H new ATOM 0 HB3 MET A 72 3.309 12.317 -9.025 1.00 0.00 H new ATOM 0 HG2 MET A 72 1.893 13.933 -8.165 1.00 0.00 H new ATOM 0 HG3 MET A 72 3.183 13.943 -6.978 1.00 0.00 H new ATOM 0 HE1 MET A 72 2.143 17.253 -9.993 1.00 0.00 H new ATOM 0 HE2 MET A 72 2.387 15.574 -10.530 1.00 0.00 H new ATOM 0 HE3 MET A 72 1.076 15.963 -9.391 1.00 0.00 H new ATOM 83 N GLU A 73 5.888 10.818 -7.897 1.00 0.00 N ATOM 84 CA GLU A 73 6.375 9.473 -8.180 1.00 0.00 C ATOM 85 C GLU A 73 5.691 8.446 -7.282 1.00 0.00 C ATOM 86 O GLU A 73 5.689 8.579 -6.058 1.00 0.00 O ATOM 87 CB GLU A 73 7.892 9.405 -7.989 1.00 0.00 C ATOM 88 CG GLU A 73 8.317 9.292 -6.535 1.00 0.00 C ATOM 89 CD GLU A 73 9.677 9.910 -6.275 1.00 0.00 C ATOM 90 OE1 GLU A 73 9.754 11.153 -6.179 1.00 0.00 O ATOM 91 OE2 GLU A 73 10.664 9.153 -6.169 1.00 0.00 O ATOM 0 H GLU A 73 5.679 10.993 -6.914 1.00 0.00 H new ATOM 0 HA GLU A 73 6.136 9.239 -9.217 1.00 0.00 H new ATOM 0 HB2 GLU A 73 8.281 8.549 -8.540 1.00 0.00 H new ATOM 0 HB3 GLU A 73 8.345 10.296 -8.423 1.00 0.00 H new ATOM 0 HG2 GLU A 73 7.574 9.780 -5.904 1.00 0.00 H new ATOM 0 HG3 GLU A 73 8.339 8.241 -6.247 1.00 0.00 H new ATOM 98 N CYS A 74 5.111 7.423 -7.900 1.00 0.00 N ATOM 99 CA CYS A 74 4.422 6.373 -7.159 1.00 0.00 C ATOM 100 C CYS A 74 5.250 5.921 -5.959 1.00 0.00 C ATOM 101 O CYS A 74 6.480 5.960 -5.991 1.00 0.00 O ATOM 102 CB CYS A 74 4.134 5.180 -8.072 1.00 0.00 C ATOM 103 SG CYS A 74 2.990 3.956 -7.357 1.00 0.00 S ATOM 0 H CYS A 74 5.104 7.299 -8.912 1.00 0.00 H new ATOM 0 HA CYS A 74 3.478 6.779 -6.795 1.00 0.00 H new ATOM 0 HB2 CYS A 74 3.717 5.546 -9.010 1.00 0.00 H new ATOM 0 HB3 CYS A 74 5.075 4.685 -8.313 1.00 0.00 H new ATOM 108 N ARG A 75 4.567 5.493 -4.903 1.00 0.00 N ATOM 109 CA ARG A 75 5.239 5.034 -3.693 1.00 0.00 C ATOM 110 C ARG A 75 5.302 3.510 -3.651 1.00 0.00 C ATOM 111 O ARG A 75 6.223 2.932 -3.074 1.00 0.00 O ATOM 112 CB ARG A 75 4.515 5.560 -2.452 1.00 0.00 C ATOM 113 CG ARG A 75 4.535 7.075 -2.331 1.00 0.00 C ATOM 114 CD ARG A 75 5.840 7.568 -1.727 1.00 0.00 C ATOM 115 NE ARG A 75 5.676 8.844 -1.036 1.00 0.00 N ATOM 116 CZ ARG A 75 5.586 10.013 -1.661 1.00 0.00 C ATOM 117 NH1 ARG A 75 5.644 10.066 -2.985 1.00 0.00 N ATOM 118 NH2 ARG A 75 5.437 11.131 -0.963 1.00 0.00 N ATOM 0 H ARG A 75 3.549 5.454 -4.860 1.00 0.00 H new ATOM 0 HA ARG A 75 6.258 5.422 -3.703 1.00 0.00 H new ATOM 0 HB2 ARG A 75 3.480 5.219 -2.474 1.00 0.00 H new ATOM 0 HB3 ARG A 75 4.974 5.127 -1.563 1.00 0.00 H new ATOM 0 HG2 ARG A 75 4.397 7.522 -3.316 1.00 0.00 H new ATOM 0 HG3 ARG A 75 3.700 7.403 -1.712 1.00 0.00 H new ATOM 0 HD2 ARG A 75 6.220 6.823 -1.028 1.00 0.00 H new ATOM 0 HD3 ARG A 75 6.586 7.675 -2.514 1.00 0.00 H new ATOM 0 HE ARG A 75 5.628 8.837 -0.017 1.00 0.00 H new ATOM 0 HH11 ARG A 75 5.758 9.208 -3.525 1.00 0.00 H new ATOM 0 HH12 ARG A 75 5.575 10.964 -3.463 1.00 0.00 H new ATOM 0 HH21 ARG A 75 5.391 11.094 0.055 1.00 0.00 H new ATOM 0 HH22 ARG A 75 5.368 12.028 -1.445 1.00 0.00 H new ATOM 132 N VAL A 76 4.316 2.865 -4.265 1.00 0.00 N ATOM 133 CA VAL A 76 4.259 1.408 -4.298 1.00 0.00 C ATOM 134 C VAL A 76 5.381 0.834 -5.157 1.00 0.00 C ATOM 135 O VAL A 76 6.114 -0.057 -4.726 1.00 0.00 O ATOM 136 CB VAL A 76 2.906 0.911 -4.841 1.00 0.00 C ATOM 137 CG1 VAL A 76 2.864 -0.609 -4.860 1.00 0.00 C ATOM 138 CG2 VAL A 76 1.761 1.475 -4.013 1.00 0.00 C ATOM 0 H VAL A 76 3.545 3.328 -4.747 1.00 0.00 H new ATOM 0 HA VAL A 76 4.378 1.063 -3.271 1.00 0.00 H new ATOM 0 HB VAL A 76 2.792 1.266 -5.865 1.00 0.00 H new ATOM 0 HG11 VAL A 76 1.901 -0.942 -5.247 1.00 0.00 H new ATOM 0 HG12 VAL A 76 3.662 -0.987 -5.499 1.00 0.00 H new ATOM 0 HG13 VAL A 76 3.000 -0.989 -3.848 1.00 0.00 H new ATOM 0 HG21 VAL A 76 0.812 1.114 -4.410 1.00 0.00 H new ATOM 0 HG22 VAL A 76 1.867 1.152 -2.977 1.00 0.00 H new ATOM 0 HG23 VAL A 76 1.782 2.564 -4.057 1.00 0.00 H new ATOM 148 N CYS A 77 5.510 1.351 -6.374 1.00 0.00 N ATOM 149 CA CYS A 77 6.542 0.890 -7.295 1.00 0.00 C ATOM 150 C CYS A 77 7.683 1.900 -7.381 1.00 0.00 C ATOM 151 O CYS A 77 8.856 1.534 -7.308 1.00 0.00 O ATOM 152 CB CYS A 77 5.947 0.657 -8.686 1.00 0.00 C ATOM 153 SG CYS A 77 5.351 2.172 -9.503 1.00 0.00 S ATOM 0 H CYS A 77 4.913 2.090 -6.746 1.00 0.00 H new ATOM 0 HA CYS A 77 6.940 -0.051 -6.915 1.00 0.00 H new ATOM 0 HB2 CYS A 77 6.701 0.189 -9.318 1.00 0.00 H new ATOM 0 HB3 CYS A 77 5.119 -0.047 -8.602 1.00 0.00 H new ATOM 158 N GLY A 78 7.331 3.172 -7.536 1.00 0.00 N ATOM 159 CA GLY A 78 8.336 4.215 -7.629 1.00 0.00 C ATOM 160 C GLY A 78 8.219 5.021 -8.907 1.00 0.00 C ATOM 161 O GLY A 78 8.499 6.220 -8.921 1.00 0.00 O ATOM 0 H GLY A 78 6.367 3.499 -7.599 1.00 0.00 H new ATOM 0 HA2 GLY A 78 8.243 4.883 -6.772 1.00 0.00 H new ATOM 0 HA3 GLY A 78 9.328 3.765 -7.576 1.00 0.00 H new ATOM 165 N ASP A 79 7.805 4.363 -9.984 1.00 0.00 N ATOM 166 CA ASP A 79 7.652 5.026 -11.274 1.00 0.00 C ATOM 167 C ASP A 79 6.848 6.314 -11.130 1.00 0.00 C ATOM 168 O ASP A 79 6.318 6.613 -10.060 1.00 0.00 O ATOM 169 CB ASP A 79 6.967 4.092 -12.273 1.00 0.00 C ATOM 170 CG ASP A 79 7.202 4.511 -13.711 1.00 0.00 C ATOM 171 OD1 ASP A 79 8.327 4.952 -14.024 1.00 0.00 O ATOM 172 OD2 ASP A 79 6.259 4.399 -14.524 1.00 0.00 O ATOM 0 H ASP A 79 7.569 3.371 -9.990 1.00 0.00 H new ATOM 0 HA ASP A 79 8.645 5.278 -11.646 1.00 0.00 H new ATOM 0 HB2 ASP A 79 7.336 3.076 -12.128 1.00 0.00 H new ATOM 0 HB3 ASP A 79 5.896 4.074 -12.073 1.00 0.00 H new ATOM 177 N LYS A 80 6.763 7.077 -12.215 1.00 0.00 N ATOM 178 CA LYS A 80 6.024 8.334 -12.212 1.00 0.00 C ATOM 179 C LYS A 80 4.529 8.086 -12.036 1.00 0.00 C ATOM 180 O LYS A 80 3.875 7.530 -12.917 1.00 0.00 O ATOM 181 CB LYS A 80 6.275 9.100 -13.512 1.00 0.00 C ATOM 182 CG LYS A 80 5.240 10.176 -13.794 1.00 0.00 C ATOM 183 CD LYS A 80 5.837 11.331 -14.580 1.00 0.00 C ATOM 184 CE LYS A 80 6.729 12.199 -13.705 1.00 0.00 C ATOM 185 NZ LYS A 80 7.656 13.036 -14.516 1.00 0.00 N ATOM 0 H LYS A 80 7.197 6.846 -13.109 1.00 0.00 H new ATOM 0 HA LYS A 80 6.377 8.932 -11.371 1.00 0.00 H new ATOM 0 HB2 LYS A 80 7.262 9.560 -13.468 1.00 0.00 H new ATOM 0 HB3 LYS A 80 6.289 8.394 -14.343 1.00 0.00 H new ATOM 0 HG2 LYS A 80 4.409 9.745 -14.353 1.00 0.00 H new ATOM 0 HG3 LYS A 80 4.833 10.547 -12.853 1.00 0.00 H new ATOM 0 HD2 LYS A 80 6.415 10.942 -15.418 1.00 0.00 H new ATOM 0 HD3 LYS A 80 5.036 11.939 -15.001 1.00 0.00 H new ATOM 0 HE2 LYS A 80 6.109 12.843 -13.081 1.00 0.00 H new ATOM 0 HE3 LYS A 80 7.307 11.564 -13.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 8.247 13.613 -13.883 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 8.265 12.421 -15.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 7.105 13.660 -15.139 1.00 0.00 H new ATOM 199 N ALA A 81 3.995 8.503 -10.893 1.00 0.00 N ATOM 200 CA ALA A 81 2.577 8.330 -10.604 1.00 0.00 C ATOM 201 C ALA A 81 1.714 9.044 -11.639 1.00 0.00 C ATOM 202 O ALA A 81 2.228 9.723 -12.527 1.00 0.00 O ATOM 203 CB ALA A 81 2.257 8.838 -9.206 1.00 0.00 C ATOM 0 H ALA A 81 4.523 8.963 -10.152 1.00 0.00 H new ATOM 0 HA ALA A 81 2.349 7.265 -10.652 1.00 0.00 H new ATOM 0 HB1 ALA A 81 1.194 8.702 -9.004 1.00 0.00 H new ATOM 0 HB2 ALA A 81 2.840 8.279 -8.474 1.00 0.00 H new ATOM 0 HB3 ALA A 81 2.507 9.897 -9.137 1.00 0.00 H new ATOM 209 N SER A 82 0.400 8.885 -11.518 1.00 0.00 N ATOM 210 CA SER A 82 -0.534 9.511 -12.447 1.00 0.00 C ATOM 211 C SER A 82 -1.535 10.387 -11.701 1.00 0.00 C ATOM 212 O SER A 82 -1.861 11.490 -12.140 1.00 0.00 O ATOM 213 CB SER A 82 -1.275 8.444 -13.254 1.00 0.00 C ATOM 214 OG SER A 82 -2.255 7.794 -12.463 1.00 0.00 O ATOM 0 H SER A 82 -0.042 8.328 -10.786 1.00 0.00 H new ATOM 0 HA SER A 82 0.037 10.141 -13.129 1.00 0.00 H new ATOM 0 HB2 SER A 82 -1.750 8.904 -14.121 1.00 0.00 H new ATOM 0 HB3 SER A 82 -0.563 7.710 -13.632 1.00 0.00 H new ATOM 0 HG SER A 82 -2.715 7.118 -13.003 1.00 0.00 H new ATOM 220 N GLY A 83 -2.021 9.888 -10.568 1.00 0.00 N ATOM 221 CA GLY A 83 -2.981 10.638 -9.779 1.00 0.00 C ATOM 222 C GLY A 83 -2.870 10.341 -8.297 1.00 0.00 C ATOM 223 O GLY A 83 -2.156 9.424 -7.891 1.00 0.00 O ATOM 0 H GLY A 83 -1.767 8.978 -10.183 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -2.829 11.705 -9.945 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -3.989 10.403 -10.119 1.00 0.00 H new ATOM 227 N PHE A 84 -3.578 11.119 -7.484 1.00 0.00 N ATOM 228 CA PHE A 84 -3.554 10.936 -6.038 1.00 0.00 C ATOM 229 C PHE A 84 -4.784 10.167 -5.566 1.00 0.00 C ATOM 230 O PHE A 84 -5.811 10.759 -5.232 1.00 0.00 O ATOM 231 CB PHE A 84 -3.485 12.292 -5.332 1.00 0.00 C ATOM 232 CG PHE A 84 -3.045 12.201 -3.899 1.00 0.00 C ATOM 233 CD1 PHE A 84 -1.874 11.542 -3.562 1.00 0.00 C ATOM 234 CD2 PHE A 84 -3.801 12.775 -2.890 1.00 0.00 C ATOM 235 CE1 PHE A 84 -1.466 11.456 -2.244 1.00 0.00 C ATOM 236 CE2 PHE A 84 -3.398 12.693 -1.570 1.00 0.00 C ATOM 237 CZ PHE A 84 -2.229 12.033 -1.247 1.00 0.00 C ATOM 0 H PHE A 84 -4.175 11.882 -7.803 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.666 10.357 -5.785 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -2.797 12.940 -5.874 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -4.467 12.764 -5.373 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -1.273 11.090 -4.338 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -4.716 13.293 -3.137 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -0.552 10.938 -1.994 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -3.997 13.144 -0.793 1.00 0.00 H new ATOM 0 HZ PHE A 84 -1.912 11.968 -0.217 1.00 0.00 H new ATOM 247 N HIS A 85 -4.673 8.842 -5.542 1.00 0.00 N ATOM 248 CA HIS A 85 -5.776 7.990 -5.112 1.00 0.00 C ATOM 249 C HIS A 85 -5.510 7.417 -3.723 1.00 0.00 C ATOM 250 O HIS A 85 -4.371 7.098 -3.380 1.00 0.00 O ATOM 251 CB HIS A 85 -5.992 6.855 -6.112 1.00 0.00 C ATOM 252 CG HIS A 85 -6.030 7.312 -7.538 1.00 0.00 C ATOM 253 ND1 HIS A 85 -5.029 7.619 -8.396 1.00 0.00 N flip ATOM 254 CD2 HIS A 85 -7.204 7.502 -8.236 1.00 0.00 C flip ATOM 255 CE1 HIS A 85 -5.611 7.984 -9.586 1.00 0.00 C flip ATOM 256 NE2 HIS A 85 -6.923 7.904 -9.463 1.00 0.00 N flip ATOM 0 H HIS A 85 -3.831 8.336 -5.815 1.00 0.00 H new ATOM 0 HA HIS A 85 -6.678 8.600 -5.067 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -5.194 6.122 -5.995 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -6.928 6.348 -5.877 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -8.197 7.347 -7.842 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -5.081 8.287 -10.477 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -7.604 8.117 -10.192 1.00 0.00 H new ATOM 264 N TYR A 86 -6.566 7.290 -2.928 1.00 0.00 N ATOM 265 CA TYR A 86 -6.446 6.758 -1.576 1.00 0.00 C ATOM 266 C TYR A 86 -5.520 7.626 -0.730 1.00 0.00 C ATOM 267 O TYR A 86 -4.903 7.151 0.223 1.00 0.00 O ATOM 268 CB TYR A 86 -5.922 5.322 -1.615 1.00 0.00 C ATOM 269 CG TYR A 86 -6.670 4.430 -2.581 1.00 0.00 C ATOM 270 CD1 TYR A 86 -6.348 4.412 -3.932 1.00 0.00 C ATOM 271 CD2 TYR A 86 -7.699 3.606 -2.141 1.00 0.00 C ATOM 272 CE1 TYR A 86 -7.030 3.600 -4.818 1.00 0.00 C ATOM 273 CE2 TYR A 86 -8.384 2.789 -3.020 1.00 0.00 C ATOM 274 CZ TYR A 86 -8.047 2.791 -4.357 1.00 0.00 C ATOM 275 OH TYR A 86 -8.727 1.979 -5.236 1.00 0.00 O ATOM 0 H TYR A 86 -7.515 7.548 -3.197 1.00 0.00 H new ATOM 0 HA TYR A 86 -7.437 6.764 -1.121 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -4.867 5.336 -1.889 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -5.985 4.894 -0.615 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -5.551 5.043 -4.296 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -7.968 3.604 -1.095 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -6.768 3.599 -5.866 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -9.179 2.152 -2.662 1.00 0.00 H new ATOM 0 HH TYR A 86 -9.037 1.176 -4.767 1.00 0.00 H new ATOM 285 N GLY A 87 -5.427 8.904 -1.086 1.00 0.00 N ATOM 286 CA GLY A 87 -4.575 9.820 -0.350 1.00 0.00 C ATOM 287 C GLY A 87 -3.111 9.436 -0.425 1.00 0.00 C ATOM 288 O GLY A 87 -2.315 9.822 0.432 1.00 0.00 O ATOM 0 H GLY A 87 -5.927 9.321 -1.871 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -4.704 10.828 -0.745 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -4.888 9.844 0.694 1.00 0.00 H new ATOM 292 N VAL A 88 -2.752 8.672 -1.452 1.00 0.00 N ATOM 293 CA VAL A 88 -1.374 8.235 -1.636 1.00 0.00 C ATOM 294 C VAL A 88 -0.965 8.306 -3.103 1.00 0.00 C ATOM 295 O VAL A 88 -1.627 7.736 -3.971 1.00 0.00 O ATOM 296 CB VAL A 88 -1.168 6.796 -1.126 1.00 0.00 C ATOM 297 CG1 VAL A 88 -2.033 5.822 -1.912 1.00 0.00 C ATOM 298 CG2 VAL A 88 0.299 6.406 -1.210 1.00 0.00 C ATOM 0 H VAL A 88 -3.398 8.343 -2.170 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.748 8.912 -1.055 1.00 0.00 H new ATOM 0 HB VAL A 88 -1.472 6.753 -0.080 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -1.874 4.811 -1.538 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -3.083 6.092 -1.795 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -1.763 5.865 -2.967 1.00 0.00 H new ATOM 0 HG21 VAL A 88 0.426 5.387 -0.846 1.00 0.00 H new ATOM 0 HG22 VAL A 88 0.632 6.465 -2.246 1.00 0.00 H new ATOM 0 HG23 VAL A 88 0.892 7.086 -0.599 1.00 0.00 H new ATOM 308 N HIS A 89 0.130 9.009 -3.373 1.00 0.00 N ATOM 309 CA HIS A 89 0.628 9.154 -4.736 1.00 0.00 C ATOM 310 C HIS A 89 0.883 7.790 -5.370 1.00 0.00 C ATOM 311 O HIS A 89 1.938 7.190 -5.171 1.00 0.00 O ATOM 312 CB HIS A 89 1.914 9.982 -4.747 1.00 0.00 C ATOM 313 CG HIS A 89 1.674 11.460 -4.724 1.00 0.00 C ATOM 314 ND1 HIS A 89 1.504 12.177 -3.558 1.00 0.00 N ATOM 315 CD2 HIS A 89 1.578 12.357 -5.733 1.00 0.00 C ATOM 316 CE1 HIS A 89 1.313 13.451 -3.851 1.00 0.00 C ATOM 317 NE2 HIS A 89 1.353 13.587 -5.164 1.00 0.00 N ATOM 0 H HIS A 89 0.689 9.487 -2.666 1.00 0.00 H new ATOM 0 HA HIS A 89 -0.133 9.670 -5.321 1.00 0.00 H new ATOM 0 HB2 HIS A 89 2.521 9.707 -3.884 1.00 0.00 H new ATOM 0 HB3 HIS A 89 2.491 9.730 -5.636 1.00 0.00 H new ATOM 0 HD2 HIS A 89 1.663 12.145 -6.789 1.00 0.00 H new ATOM 0 HE1 HIS A 89 1.152 14.246 -3.138 1.00 0.00 H new ATOM 0 HE2 HIS A 89 1.236 14.463 -5.673 1.00 0.00 H new ATOM 325 N ALA A 90 -0.092 7.306 -6.133 1.00 0.00 N ATOM 326 CA ALA A 90 0.027 6.013 -6.796 1.00 0.00 C ATOM 327 C ALA A 90 -0.129 6.155 -8.306 1.00 0.00 C ATOM 328 O ALA A 90 -0.728 7.115 -8.792 1.00 0.00 O ATOM 329 CB ALA A 90 -1.005 5.040 -6.245 1.00 0.00 C ATOM 0 H ALA A 90 -0.973 7.790 -6.307 1.00 0.00 H new ATOM 0 HA ALA A 90 1.023 5.619 -6.595 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -0.904 4.079 -6.749 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -0.845 4.907 -5.175 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -2.006 5.436 -6.416 1.00 0.00 H new ATOM 335 N CYS A 91 0.414 5.193 -9.045 1.00 0.00 N ATOM 336 CA CYS A 91 0.336 5.210 -10.501 1.00 0.00 C ATOM 337 C CYS A 91 -0.819 4.344 -10.994 1.00 0.00 C ATOM 338 O CYS A 91 -1.262 3.429 -10.300 1.00 0.00 O ATOM 339 CB CYS A 91 1.652 4.719 -11.108 1.00 0.00 C ATOM 340 SG CYS A 91 1.942 2.931 -10.907 1.00 0.00 S ATOM 0 H CYS A 91 0.913 4.391 -8.659 1.00 0.00 H new ATOM 0 HA CYS A 91 0.158 6.237 -10.819 1.00 0.00 H new ATOM 0 HB2 CYS A 91 1.662 4.961 -12.171 1.00 0.00 H new ATOM 0 HB3 CYS A 91 2.477 5.264 -10.649 1.00 0.00 H new ATOM 345 N GLU A 92 -1.302 4.640 -12.197 1.00 0.00 N ATOM 346 CA GLU A 92 -2.406 3.889 -12.782 1.00 0.00 C ATOM 347 C GLU A 92 -2.240 2.393 -12.532 1.00 0.00 C ATOM 348 O GLU A 92 -3.190 1.705 -12.161 1.00 0.00 O ATOM 349 CB GLU A 92 -2.495 4.159 -14.286 1.00 0.00 C ATOM 350 CG GLU A 92 -1.266 3.711 -15.058 1.00 0.00 C ATOM 351 CD GLU A 92 -1.422 3.888 -16.556 1.00 0.00 C ATOM 352 OE1 GLU A 92 -1.487 5.049 -17.013 1.00 0.00 O ATOM 353 OE2 GLU A 92 -1.479 2.866 -17.272 1.00 0.00 O ATOM 0 H GLU A 92 -0.946 5.394 -12.785 1.00 0.00 H new ATOM 0 HA GLU A 92 -3.329 4.219 -12.305 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -3.371 3.650 -14.687 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -2.646 5.227 -14.447 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -0.400 4.279 -14.717 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -1.066 2.662 -14.839 1.00 0.00 H new ATOM 360 N GLY A 93 -1.024 1.896 -12.739 1.00 0.00 N ATOM 361 CA GLY A 93 -0.754 0.485 -12.531 1.00 0.00 C ATOM 362 C GLY A 93 -1.117 0.024 -11.134 1.00 0.00 C ATOM 363 O GLY A 93 -2.105 -0.687 -10.944 1.00 0.00 O ATOM 0 H GLY A 93 -0.221 2.445 -13.047 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -1.314 -0.100 -13.260 1.00 0.00 H new ATOM 0 HA3 GLY A 93 0.303 0.290 -12.711 1.00 0.00 H new ATOM 367 N CYS A 94 -0.318 0.428 -10.153 1.00 0.00 N ATOM 368 CA CYS A 94 -0.558 0.051 -8.765 1.00 0.00 C ATOM 369 C CYS A 94 -1.986 0.394 -8.348 1.00 0.00 C ATOM 370 O CYS A 94 -2.739 -0.472 -7.902 1.00 0.00 O ATOM 371 CB CYS A 94 0.438 0.757 -7.843 1.00 0.00 C ATOM 372 SG CYS A 94 2.184 0.413 -8.232 1.00 0.00 S ATOM 0 H CYS A 94 0.503 1.017 -10.293 1.00 0.00 H new ATOM 0 HA CYS A 94 -0.421 -1.027 -8.678 1.00 0.00 H new ATOM 0 HB2 CYS A 94 0.269 1.832 -7.899 1.00 0.00 H new ATOM 0 HB3 CYS A 94 0.240 0.457 -6.814 1.00 0.00 H new ATOM 377 N LYS A 95 -2.351 1.663 -8.496 1.00 0.00 N ATOM 378 CA LYS A 95 -3.687 2.122 -8.137 1.00 0.00 C ATOM 379 C LYS A 95 -4.730 1.051 -8.440 1.00 0.00 C ATOM 380 O LYS A 95 -5.534 0.692 -7.581 1.00 0.00 O ATOM 381 CB LYS A 95 -4.027 3.409 -8.892 1.00 0.00 C ATOM 382 CG LYS A 95 -5.365 4.009 -8.499 1.00 0.00 C ATOM 383 CD LYS A 95 -6.493 3.473 -9.364 1.00 0.00 C ATOM 384 CE LYS A 95 -6.709 4.335 -10.598 1.00 0.00 C ATOM 385 NZ LYS A 95 -7.222 3.540 -11.748 1.00 0.00 N ATOM 0 H LYS A 95 -1.739 2.392 -8.863 1.00 0.00 H new ATOM 0 HA LYS A 95 -3.699 2.323 -7.066 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -3.242 4.144 -8.713 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -4.031 3.202 -9.962 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -5.571 3.786 -7.452 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -5.319 5.094 -8.591 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -6.265 2.451 -9.668 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -7.413 3.434 -8.781 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -7.414 5.133 -10.365 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -5.769 4.812 -10.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -7.356 4.164 -12.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -6.538 2.795 -11.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -8.131 3.105 -11.491 1.00 0.00 H new ATOM 399 N GLY A 96 -4.710 0.543 -9.669 1.00 0.00 N ATOM 400 CA GLY A 96 -5.658 -0.482 -10.063 1.00 0.00 C ATOM 401 C GLY A 96 -5.528 -1.743 -9.231 1.00 0.00 C ATOM 402 O GLY A 96 -6.523 -2.277 -8.741 1.00 0.00 O ATOM 0 H GLY A 96 -4.054 0.823 -10.398 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -6.671 -0.091 -9.969 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -5.507 -0.727 -11.114 1.00 0.00 H new ATOM 406 N PHE A 97 -4.298 -2.220 -9.072 1.00 0.00 N ATOM 407 CA PHE A 97 -4.042 -3.428 -8.295 1.00 0.00 C ATOM 408 C PHE A 97 -4.828 -3.411 -6.988 1.00 0.00 C ATOM 409 O PHE A 97 -5.726 -4.227 -6.779 1.00 0.00 O ATOM 410 CB PHE A 97 -2.546 -3.563 -8.003 1.00 0.00 C ATOM 411 CG PHE A 97 -2.210 -4.738 -7.129 1.00 0.00 C ATOM 412 CD1 PHE A 97 -2.194 -4.610 -5.750 1.00 0.00 C ATOM 413 CD2 PHE A 97 -1.910 -5.970 -7.688 1.00 0.00 C ATOM 414 CE1 PHE A 97 -1.886 -5.689 -4.943 1.00 0.00 C ATOM 415 CE2 PHE A 97 -1.601 -7.053 -6.886 1.00 0.00 C ATOM 416 CZ PHE A 97 -1.588 -6.912 -5.512 1.00 0.00 C ATOM 0 H PHE A 97 -3.463 -1.789 -9.470 1.00 0.00 H new ATOM 0 HA PHE A 97 -4.369 -4.285 -8.883 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -2.007 -3.655 -8.946 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -2.194 -2.650 -7.522 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -2.425 -3.656 -5.300 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -1.918 -6.085 -8.762 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -1.878 -5.576 -3.869 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -1.370 -8.008 -7.333 1.00 0.00 H new ATOM 0 HZ PHE A 97 -1.345 -7.756 -4.884 1.00 0.00 H new ATOM 426 N PHE A 98 -4.483 -2.475 -6.109 1.00 0.00 N ATOM 427 CA PHE A 98 -5.154 -2.352 -4.820 1.00 0.00 C ATOM 428 C PHE A 98 -6.659 -2.554 -4.970 1.00 0.00 C ATOM 429 O PHE A 98 -7.218 -3.527 -4.463 1.00 0.00 O ATOM 430 CB PHE A 98 -4.872 -0.980 -4.204 1.00 0.00 C ATOM 431 CG PHE A 98 -5.366 -0.845 -2.792 1.00 0.00 C ATOM 432 CD1 PHE A 98 -4.760 -1.546 -1.762 1.00 0.00 C ATOM 433 CD2 PHE A 98 -6.436 -0.016 -2.495 1.00 0.00 C ATOM 434 CE1 PHE A 98 -5.212 -1.424 -0.461 1.00 0.00 C ATOM 435 CE2 PHE A 98 -6.892 0.111 -1.196 1.00 0.00 C ATOM 436 CZ PHE A 98 -6.280 -0.595 -0.178 1.00 0.00 C ATOM 0 H PHE A 98 -3.743 -1.791 -6.266 1.00 0.00 H new ATOM 0 HA PHE A 98 -4.764 -3.127 -4.160 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -3.798 -0.795 -4.224 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -5.339 -0.211 -4.819 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -3.925 -2.196 -1.978 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -6.919 0.537 -3.287 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -4.731 -1.976 0.333 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -7.726 0.761 -0.977 1.00 0.00 H new ATOM 0 HZ PHE A 98 -6.636 -0.499 0.837 1.00 0.00 H new ATOM 446 N ARG A 99 -7.309 -1.629 -5.668 1.00 0.00 N ATOM 447 CA ARG A 99 -8.749 -1.704 -5.883 1.00 0.00 C ATOM 448 C ARG A 99 -9.162 -3.110 -6.306 1.00 0.00 C ATOM 449 O ARG A 99 -9.951 -3.767 -5.626 1.00 0.00 O ATOM 450 CB ARG A 99 -9.181 -0.692 -6.945 1.00 0.00 C ATOM 451 CG ARG A 99 -10.683 -0.466 -6.996 1.00 0.00 C ATOM 452 CD ARG A 99 -11.029 0.817 -7.734 1.00 0.00 C ATOM 453 NE ARG A 99 -10.956 1.987 -6.863 1.00 0.00 N ATOM 454 CZ ARG A 99 -11.319 3.208 -7.240 1.00 0.00 C ATOM 455 NH1 ARG A 99 -11.777 3.418 -8.466 1.00 0.00 N ATOM 456 NH2 ARG A 99 -11.223 4.222 -6.389 1.00 0.00 N ATOM 0 H ARG A 99 -6.861 -0.818 -6.095 1.00 0.00 H new ATOM 0 HA ARG A 99 -9.245 -1.466 -4.942 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -8.685 0.259 -6.751 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -8.840 -1.035 -7.922 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -11.163 -1.311 -7.489 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -11.080 -0.422 -5.982 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -10.346 0.947 -8.574 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -12.034 0.737 -8.149 1.00 0.00 H new ATOM 0 HE ARG A 99 -10.607 1.860 -5.913 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -11.851 2.641 -9.123 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -12.055 4.357 -8.753 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -10.870 4.064 -5.445 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -11.502 5.159 -6.679 1.00 0.00 H new ATOM 470 N ARG A 100 -8.625 -3.565 -7.434 1.00 0.00 N ATOM 471 CA ARG A 100 -8.940 -4.892 -7.949 1.00 0.00 C ATOM 472 C ARG A 100 -9.022 -5.910 -6.815 1.00 0.00 C ATOM 473 O ARG A 100 -10.003 -6.646 -6.696 1.00 0.00 O ATOM 474 CB ARG A 100 -7.886 -5.331 -8.967 1.00 0.00 C ATOM 475 CG ARG A 100 -8.114 -6.729 -9.517 1.00 0.00 C ATOM 476 CD ARG A 100 -7.441 -6.913 -10.867 1.00 0.00 C ATOM 477 NE ARG A 100 -8.123 -6.173 -11.925 1.00 0.00 N ATOM 478 CZ ARG A 100 -9.169 -6.643 -12.595 1.00 0.00 C ATOM 479 NH1 ARG A 100 -9.651 -7.847 -12.317 1.00 0.00 N ATOM 480 NH2 ARG A 100 -9.736 -5.909 -13.544 1.00 0.00 N ATOM 0 H ARG A 100 -7.970 -3.034 -8.008 1.00 0.00 H new ATOM 0 HA ARG A 100 -9.912 -4.842 -8.441 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -7.875 -4.622 -9.795 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -6.902 -5.290 -8.499 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -7.727 -7.466 -8.813 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -9.184 -6.913 -9.615 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -6.405 -6.582 -10.803 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -7.422 -7.973 -11.121 1.00 0.00 H new ATOM 0 HE ARG A 100 -7.777 -5.243 -12.163 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -9.218 -8.414 -11.588 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -10.454 -8.206 -12.833 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -9.369 -4.982 -13.760 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -10.539 -6.272 -14.058 1.00 0.00 H new ATOM 494 N THR A 101 -7.985 -5.947 -5.984 1.00 0.00 N ATOM 495 CA THR A 101 -7.939 -6.875 -4.861 1.00 0.00 C ATOM 496 C THR A 101 -9.145 -6.693 -3.947 1.00 0.00 C ATOM 497 O THR A 101 -9.704 -7.666 -3.440 1.00 0.00 O ATOM 498 CB THR A 101 -6.651 -6.695 -4.035 1.00 0.00 C ATOM 499 OG1 THR A 101 -5.505 -6.797 -4.887 1.00 0.00 O ATOM 500 CG2 THR A 101 -6.564 -7.738 -2.932 1.00 0.00 C ATOM 0 H THR A 101 -7.166 -5.345 -6.068 1.00 0.00 H new ATOM 0 HA THR A 101 -7.954 -7.880 -5.282 1.00 0.00 H new ATOM 0 HB THR A 101 -6.676 -5.707 -3.576 1.00 0.00 H new ATOM 0 HG1 THR A 101 -5.402 -5.967 -5.398 1.00 0.00 H new ATOM 0 HG21 THR A 101 -5.646 -7.590 -2.363 1.00 0.00 H new ATOM 0 HG22 THR A 101 -7.423 -7.638 -2.268 1.00 0.00 H new ATOM 0 HG23 THR A 101 -6.561 -8.735 -3.373 1.00 0.00 H new ATOM 508 N ILE A 102 -9.541 -5.442 -3.740 1.00 0.00 N ATOM 509 CA ILE A 102 -10.682 -5.133 -2.888 1.00 0.00 C ATOM 510 C ILE A 102 -11.992 -5.541 -3.554 1.00 0.00 C ATOM 511 O ILE A 102 -12.752 -6.343 -3.012 1.00 0.00 O ATOM 512 CB ILE A 102 -10.739 -3.633 -2.545 1.00 0.00 C ATOM 513 CG1 ILE A 102 -9.392 -3.162 -1.992 1.00 0.00 C ATOM 514 CG2 ILE A 102 -11.853 -3.360 -1.545 1.00 0.00 C ATOM 515 CD1 ILE A 102 -9.069 -3.728 -0.626 1.00 0.00 C ATOM 0 H ILE A 102 -9.088 -4.626 -4.151 1.00 0.00 H new ATOM 0 HA ILE A 102 -10.552 -5.703 -1.968 1.00 0.00 H new ATOM 0 HB ILE A 102 -10.951 -3.075 -3.457 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -8.603 -3.444 -2.689 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -9.392 -2.074 -1.935 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -11.880 -2.295 -1.313 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -12.809 -3.663 -1.973 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -11.669 -3.926 -0.632 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -8.101 -3.352 -0.296 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -9.837 -3.424 0.085 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -9.036 -4.816 -0.682 1.00 0.00 H new ATOM 527 N ARG A 103 -12.248 -4.983 -4.733 1.00 0.00 N ATOM 528 CA ARG A 103 -13.466 -5.289 -5.474 1.00 0.00 C ATOM 529 C ARG A 103 -13.575 -6.787 -5.746 1.00 0.00 C ATOM 530 O ARG A 103 -14.675 -7.332 -5.836 1.00 0.00 O ATOM 531 CB ARG A 103 -13.493 -4.517 -6.794 1.00 0.00 C ATOM 532 CG ARG A 103 -12.248 -4.718 -7.643 1.00 0.00 C ATOM 533 CD ARG A 103 -12.488 -4.316 -9.090 1.00 0.00 C ATOM 534 NE ARG A 103 -12.210 -2.901 -9.318 1.00 0.00 N ATOM 535 CZ ARG A 103 -11.761 -2.417 -10.471 1.00 0.00 C ATOM 536 NH1 ARG A 103 -11.542 -3.230 -11.495 1.00 0.00 N ATOM 537 NH2 ARG A 103 -11.532 -1.117 -10.601 1.00 0.00 N ATOM 0 H ARG A 103 -11.629 -4.317 -5.195 1.00 0.00 H new ATOM 0 HA ARG A 103 -14.318 -4.985 -4.866 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -14.367 -4.825 -7.368 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -13.610 -3.454 -6.581 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -11.428 -4.129 -7.232 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -11.943 -5.764 -7.601 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -11.857 -4.919 -9.743 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -13.522 -4.530 -9.359 1.00 0.00 H new ATOM 0 HE ARG A 103 -12.369 -2.248 -8.550 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -11.718 -4.230 -11.399 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -11.197 -2.855 -12.379 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -11.701 -0.488 -9.816 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -11.187 -0.746 -11.486 1.00 0.00 H new ATOM 551 N MET A 104 -12.428 -7.444 -5.877 1.00 0.00 N ATOM 552 CA MET A 104 -12.395 -8.879 -6.138 1.00 0.00 C ATOM 553 C MET A 104 -12.023 -9.652 -4.877 1.00 0.00 C ATOM 554 O MET A 104 -11.927 -10.880 -4.894 1.00 0.00 O ATOM 555 CB MET A 104 -11.398 -9.193 -7.255 1.00 0.00 C ATOM 556 CG MET A 104 -11.739 -8.526 -8.578 1.00 0.00 C ATOM 557 SD MET A 104 -10.915 -9.305 -9.980 1.00 0.00 S ATOM 558 CE MET A 104 -11.506 -10.989 -9.827 1.00 0.00 C ATOM 0 H MET A 104 -11.509 -7.007 -5.807 1.00 0.00 H new ATOM 0 HA MET A 104 -13.392 -9.189 -6.453 1.00 0.00 H new ATOM 0 HB2 MET A 104 -10.403 -8.875 -6.943 1.00 0.00 H new ATOM 0 HB3 MET A 104 -11.357 -10.272 -7.401 1.00 0.00 H new ATOM 0 HG2 MET A 104 -12.818 -8.560 -8.730 1.00 0.00 H new ATOM 0 HG3 MET A 104 -11.456 -7.474 -8.534 1.00 0.00 H new ATOM 0 HE1 MET A 104 -11.523 -11.459 -10.810 1.00 0.00 H new ATOM 0 HE2 MET A 104 -10.842 -11.549 -9.169 1.00 0.00 H new ATOM 0 HE3 MET A 104 -12.513 -10.985 -9.409 1.00 0.00 H new ATOM 568 N LYS A 105 -11.815 -8.927 -3.783 1.00 0.00 N ATOM 569 CA LYS A 105 -11.454 -9.545 -2.512 1.00 0.00 C ATOM 570 C LYS A 105 -10.436 -10.661 -2.719 1.00 0.00 C ATOM 571 O LYS A 105 -10.459 -11.674 -2.018 1.00 0.00 O ATOM 572 CB LYS A 105 -12.701 -10.100 -1.819 1.00 0.00 C ATOM 573 CG LYS A 105 -13.432 -11.152 -2.635 1.00 0.00 C ATOM 574 CD LYS A 105 -14.682 -11.641 -1.921 1.00 0.00 C ATOM 575 CE LYS A 105 -14.369 -12.787 -0.971 1.00 0.00 C ATOM 576 NZ LYS A 105 -14.017 -12.298 0.390 1.00 0.00 N ATOM 0 H LYS A 105 -11.890 -7.910 -3.751 1.00 0.00 H new ATOM 0 HA LYS A 105 -11.004 -8.780 -1.880 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -12.412 -10.531 -0.861 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -13.384 -9.278 -1.606 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -13.705 -10.737 -3.605 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -12.767 -11.994 -2.824 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -15.130 -10.818 -1.365 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -15.418 -11.967 -2.656 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -15.231 -13.451 -0.907 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -13.543 -13.375 -1.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -13.075 -12.652 0.653 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -14.010 -11.258 0.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -14.720 -12.642 1.075 1.00 0.00 H new ATOM 590 N LEU A 106 -9.543 -10.470 -3.684 1.00 0.00 N ATOM 591 CA LEU A 106 -8.514 -11.460 -3.982 1.00 0.00 C ATOM 592 C LEU A 106 -7.662 -11.748 -2.750 1.00 0.00 C ATOM 593 O LEU A 106 -7.118 -10.832 -2.134 1.00 0.00 O ATOM 594 CB LEU A 106 -7.627 -10.973 -5.128 1.00 0.00 C ATOM 595 CG LEU A 106 -8.313 -10.808 -6.485 1.00 0.00 C ATOM 596 CD1 LEU A 106 -7.528 -9.849 -7.367 1.00 0.00 C ATOM 597 CD2 LEU A 106 -8.470 -12.158 -7.171 1.00 0.00 C ATOM 0 H LEU A 106 -9.511 -9.638 -4.274 1.00 0.00 H new ATOM 0 HA LEU A 106 -9.009 -12.384 -4.282 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -7.194 -10.014 -4.843 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -6.800 -11.674 -5.244 1.00 0.00 H new ATOM 0 HG LEU A 106 -9.305 -10.388 -6.320 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -8.031 -9.744 -8.328 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -7.467 -8.875 -6.881 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -6.523 -10.240 -7.524 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -8.960 -12.021 -8.135 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -7.488 -12.605 -7.323 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -9.075 -12.815 -6.546 1.00 0.00 H new ATOM 609 N GLU A 107 -7.549 -13.025 -2.400 1.00 0.00 N ATOM 610 CA GLU A 107 -6.761 -13.432 -1.242 1.00 0.00 C ATOM 611 C GLU A 107 -5.380 -13.923 -1.669 1.00 0.00 C ATOM 612 O GLU A 107 -5.251 -14.693 -2.621 1.00 0.00 O ATOM 613 CB GLU A 107 -7.487 -14.531 -0.464 1.00 0.00 C ATOM 614 CG GLU A 107 -6.886 -14.807 0.904 1.00 0.00 C ATOM 615 CD GLU A 107 -7.224 -16.192 1.421 1.00 0.00 C ATOM 616 OE1 GLU A 107 -7.279 -17.134 0.604 1.00 0.00 O ATOM 617 OE2 GLU A 107 -7.434 -16.332 2.645 1.00 0.00 O ATOM 0 H GLU A 107 -7.992 -13.795 -2.901 1.00 0.00 H new ATOM 0 HA GLU A 107 -6.635 -12.563 -0.597 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -8.532 -14.248 -0.342 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -7.472 -15.450 -1.050 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -5.803 -14.698 0.850 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -7.246 -14.061 1.612 1.00 0.00 H new ATOM 624 N TYR A 108 -4.353 -13.471 -0.959 1.00 0.00 N ATOM 625 CA TYR A 108 -2.982 -13.862 -1.266 1.00 0.00 C ATOM 626 C TYR A 108 -2.372 -14.658 -0.116 1.00 0.00 C ATOM 627 O TYR A 108 -2.937 -14.724 0.975 1.00 0.00 O ATOM 628 CB TYR A 108 -2.129 -12.625 -1.553 1.00 0.00 C ATOM 629 CG TYR A 108 -2.653 -11.779 -2.692 1.00 0.00 C ATOM 630 CD1 TYR A 108 -2.853 -12.325 -3.954 1.00 0.00 C ATOM 631 CD2 TYR A 108 -2.948 -10.434 -2.506 1.00 0.00 C ATOM 632 CE1 TYR A 108 -3.331 -11.556 -4.997 1.00 0.00 C ATOM 633 CE2 TYR A 108 -3.428 -9.658 -3.543 1.00 0.00 C ATOM 634 CZ TYR A 108 -3.617 -10.223 -4.787 1.00 0.00 C ATOM 635 OH TYR A 108 -4.094 -9.454 -5.823 1.00 0.00 O ATOM 0 H TYR A 108 -4.443 -12.834 -0.167 1.00 0.00 H new ATOM 0 HA TYR A 108 -3.002 -14.496 -2.153 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -2.076 -12.014 -0.652 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -1.112 -12.941 -1.784 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -2.631 -13.368 -4.122 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -2.799 -9.988 -1.534 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -3.480 -11.996 -5.972 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -3.654 -8.614 -3.381 1.00 0.00 H new ATOM 0 HH TYR A 108 -4.497 -8.636 -5.464 1.00 0.00 H new ATOM 645 N GLU A 109 -1.215 -15.260 -0.370 1.00 0.00 N ATOM 646 CA GLU A 109 -0.527 -16.052 0.643 1.00 0.00 C ATOM 647 C GLU A 109 0.430 -15.184 1.455 1.00 0.00 C ATOM 648 O GLU A 109 1.237 -14.440 0.898 1.00 0.00 O ATOM 649 CB GLU A 109 0.240 -17.203 -0.011 1.00 0.00 C ATOM 650 CG GLU A 109 1.138 -17.961 0.953 1.00 0.00 C ATOM 651 CD GLU A 109 1.895 -19.090 0.280 1.00 0.00 C ATOM 652 OE1 GLU A 109 2.929 -18.809 -0.363 1.00 0.00 O ATOM 653 OE2 GLU A 109 1.453 -20.252 0.394 1.00 0.00 O ATOM 0 H GLU A 109 -0.734 -15.215 -1.268 1.00 0.00 H new ATOM 0 HA GLU A 109 -1.278 -16.463 1.318 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -0.473 -17.899 -0.454 1.00 0.00 H new ATOM 0 HB3 GLU A 109 0.847 -16.808 -0.825 1.00 0.00 H new ATOM 0 HG2 GLU A 109 1.850 -17.268 1.402 1.00 0.00 H new ATOM 0 HG3 GLU A 109 0.533 -18.367 1.764 1.00 0.00 H new ATOM 660 N LYS A 110 0.333 -15.285 2.777 1.00 0.00 N ATOM 661 CA LYS A 110 1.189 -14.511 3.668 1.00 0.00 C ATOM 662 C LYS A 110 2.652 -14.621 3.248 1.00 0.00 C ATOM 663 O LYS A 110 3.197 -15.720 3.141 1.00 0.00 O ATOM 664 CB LYS A 110 1.024 -14.992 5.111 1.00 0.00 C ATOM 665 CG LYS A 110 1.472 -13.974 6.146 1.00 0.00 C ATOM 666 CD LYS A 110 1.670 -14.614 7.510 1.00 0.00 C ATOM 667 CE LYS A 110 2.210 -13.616 8.522 1.00 0.00 C ATOM 668 NZ LYS A 110 1.128 -12.771 9.099 1.00 0.00 N ATOM 0 H LYS A 110 -0.330 -15.895 3.255 1.00 0.00 H new ATOM 0 HA LYS A 110 0.888 -13.465 3.603 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -0.023 -15.238 5.286 1.00 0.00 H new ATOM 0 HB3 LYS A 110 1.595 -15.911 5.246 1.00 0.00 H new ATOM 0 HG2 LYS A 110 2.404 -13.511 5.822 1.00 0.00 H new ATOM 0 HG3 LYS A 110 0.730 -13.179 6.221 1.00 0.00 H new ATOM 0 HD2 LYS A 110 0.721 -15.016 7.865 1.00 0.00 H new ATOM 0 HD3 LYS A 110 2.359 -15.454 7.422 1.00 0.00 H new ATOM 0 HE2 LYS A 110 2.719 -14.151 9.323 1.00 0.00 H new ATOM 0 HE3 LYS A 110 2.952 -12.978 8.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 1.537 -12.104 9.784 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 0.658 -12.241 8.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 0.433 -13.377 9.579 1.00 0.00 H new ATOM 682 N CYS A 111 3.282 -13.475 3.013 1.00 0.00 N ATOM 683 CA CYS A 111 4.682 -13.441 2.607 1.00 0.00 C ATOM 684 C CYS A 111 5.531 -12.707 3.640 1.00 0.00 C ATOM 685 O CYS A 111 5.589 -11.478 3.649 1.00 0.00 O ATOM 686 CB CYS A 111 4.822 -12.765 1.241 1.00 0.00 C ATOM 687 SG CYS A 111 6.480 -12.918 0.503 1.00 0.00 S ATOM 0 H CYS A 111 2.845 -12.557 3.097 1.00 0.00 H new ATOM 0 HA CYS A 111 5.038 -14.469 2.535 1.00 0.00 H new ATOM 0 HB2 CYS A 111 4.090 -13.196 0.557 1.00 0.00 H new ATOM 0 HB3 CYS A 111 4.578 -11.708 1.344 1.00 0.00 H new ATOM 692 N GLU A 112 6.188 -13.469 4.508 1.00 0.00 N ATOM 693 CA GLU A 112 7.034 -12.890 5.546 1.00 0.00 C ATOM 694 C GLU A 112 8.222 -12.156 4.932 1.00 0.00 C ATOM 695 O GLU A 112 8.587 -11.066 5.374 1.00 0.00 O ATOM 696 CB GLU A 112 7.531 -13.981 6.497 1.00 0.00 C ATOM 697 CG GLU A 112 6.411 -14.761 7.166 1.00 0.00 C ATOM 698 CD GLU A 112 6.812 -16.185 7.501 1.00 0.00 C ATOM 699 OE1 GLU A 112 7.262 -16.906 6.586 1.00 0.00 O ATOM 700 OE2 GLU A 112 6.677 -16.577 8.679 1.00 0.00 O ATOM 0 H GLU A 112 6.151 -14.488 4.514 1.00 0.00 H new ATOM 0 HA GLU A 112 6.436 -12.172 6.108 1.00 0.00 H new ATOM 0 HB2 GLU A 112 8.164 -14.674 5.943 1.00 0.00 H new ATOM 0 HB3 GLU A 112 8.154 -13.525 7.266 1.00 0.00 H new ATOM 0 HG2 GLU A 112 6.111 -14.247 8.079 1.00 0.00 H new ATOM 0 HG3 GLU A 112 5.542 -14.777 6.509 1.00 0.00 H new ATOM 707 N ARG A 113 8.821 -12.760 3.912 1.00 0.00 N ATOM 708 CA ARG A 113 9.969 -12.165 3.238 1.00 0.00 C ATOM 709 C ARG A 113 9.847 -10.645 3.196 1.00 0.00 C ATOM 710 O ARG A 113 10.818 -9.927 3.434 1.00 0.00 O ATOM 711 CB ARG A 113 10.096 -12.717 1.817 1.00 0.00 C ATOM 712 CG ARG A 113 10.570 -14.160 1.764 1.00 0.00 C ATOM 713 CD ARG A 113 10.679 -14.659 0.331 1.00 0.00 C ATOM 714 NE ARG A 113 9.369 -14.808 -0.298 1.00 0.00 N ATOM 715 CZ ARG A 113 8.575 -15.854 -0.101 1.00 0.00 C ATOM 716 NH1 ARG A 113 8.954 -16.837 0.704 1.00 0.00 N ATOM 717 NH2 ARG A 113 7.397 -15.918 -0.709 1.00 0.00 N ATOM 0 H ARG A 113 8.531 -13.662 3.534 1.00 0.00 H new ATOM 0 HA ARG A 113 10.865 -12.425 3.802 1.00 0.00 H new ATOM 0 HB2 ARG A 113 9.129 -12.643 1.320 1.00 0.00 H new ATOM 0 HB3 ARG A 113 10.792 -12.094 1.255 1.00 0.00 H new ATOM 0 HG2 ARG A 113 11.540 -14.244 2.254 1.00 0.00 H new ATOM 0 HG3 ARG A 113 9.877 -14.792 2.319 1.00 0.00 H new ATOM 0 HD2 ARG A 113 11.283 -13.963 -0.250 1.00 0.00 H new ATOM 0 HD3 ARG A 113 11.198 -15.618 0.319 1.00 0.00 H new ATOM 0 HE ARG A 113 9.047 -14.069 -0.922 1.00 0.00 H new ATOM 0 HH11 ARG A 113 9.858 -16.791 1.174 1.00 0.00 H new ATOM 0 HH12 ARG A 113 8.342 -17.639 0.853 1.00 0.00 H new ATOM 0 HH21 ARG A 113 7.101 -15.163 -1.328 1.00 0.00 H new ATOM 0 HH22 ARG A 113 6.788 -16.722 -0.557 1.00 0.00 H new ATOM 731 N SER A 114 8.647 -10.161 2.890 1.00 0.00 N ATOM 732 CA SER A 114 8.398 -8.726 2.812 1.00 0.00 C ATOM 733 C SER A 114 9.039 -8.131 1.562 1.00 0.00 C ATOM 734 O SER A 114 9.595 -7.033 1.598 1.00 0.00 O ATOM 735 CB SER A 114 8.939 -8.025 4.060 1.00 0.00 C ATOM 736 OG SER A 114 8.398 -6.721 4.186 1.00 0.00 O ATOM 0 H SER A 114 7.832 -10.742 2.692 1.00 0.00 H new ATOM 0 HA SER A 114 7.321 -8.571 2.755 1.00 0.00 H new ATOM 0 HB2 SER A 114 8.694 -8.611 4.946 1.00 0.00 H new ATOM 0 HB3 SER A 114 10.026 -7.968 4.007 1.00 0.00 H new ATOM 0 HG SER A 114 8.612 -6.199 3.385 1.00 0.00 H new ATOM 742 N CYS A 115 8.958 -8.864 0.457 1.00 0.00 N ATOM 743 CA CYS A 115 9.530 -8.411 -0.806 1.00 0.00 C ATOM 744 C CYS A 115 9.357 -6.904 -0.971 1.00 0.00 C ATOM 745 O CYS A 115 8.388 -6.321 -0.485 1.00 0.00 O ATOM 746 CB CYS A 115 8.874 -9.143 -1.978 1.00 0.00 C ATOM 747 SG CYS A 115 8.651 -10.931 -1.709 1.00 0.00 S ATOM 0 H CYS A 115 8.502 -9.775 0.410 1.00 0.00 H new ATOM 0 HA CYS A 115 10.596 -8.638 -0.796 1.00 0.00 H new ATOM 0 HB2 CYS A 115 7.901 -8.692 -2.175 1.00 0.00 H new ATOM 0 HB3 CYS A 115 9.481 -8.994 -2.871 1.00 0.00 H new ATOM 752 N LYS A 116 10.304 -6.278 -1.662 1.00 0.00 N ATOM 753 CA LYS A 116 10.258 -4.840 -1.894 1.00 0.00 C ATOM 754 C LYS A 116 9.808 -4.533 -3.319 1.00 0.00 C ATOM 755 O LYS A 116 10.535 -4.792 -4.279 1.00 0.00 O ATOM 756 CB LYS A 116 11.632 -4.216 -1.636 1.00 0.00 C ATOM 757 CG LYS A 116 11.872 -3.854 -0.181 1.00 0.00 C ATOM 758 CD LYS A 116 11.202 -2.540 0.184 1.00 0.00 C ATOM 759 CE LYS A 116 12.088 -1.350 -0.151 1.00 0.00 C ATOM 760 NZ LYS A 116 13.229 -1.224 0.798 1.00 0.00 N ATOM 0 H LYS A 116 11.113 -6.745 -2.071 1.00 0.00 H new ATOM 0 HA LYS A 116 9.534 -4.409 -1.202 1.00 0.00 H new ATOM 0 HB2 LYS A 116 12.405 -4.913 -1.961 1.00 0.00 H new ATOM 0 HB3 LYS A 116 11.735 -3.319 -2.247 1.00 0.00 H new ATOM 0 HG2 LYS A 116 11.491 -4.649 0.460 1.00 0.00 H new ATOM 0 HG3 LYS A 116 12.944 -3.781 0.005 1.00 0.00 H new ATOM 0 HD2 LYS A 116 10.256 -2.452 -0.350 1.00 0.00 H new ATOM 0 HD3 LYS A 116 10.969 -2.533 1.249 1.00 0.00 H new ATOM 0 HE2 LYS A 116 12.470 -1.456 -1.166 1.00 0.00 H new ATOM 0 HE3 LYS A 116 11.494 -0.437 -0.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 13.646 -0.275 0.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 12.890 -1.369 1.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 13.949 -1.940 0.572 1.00 0.00 H new ATOM 774 N ILE A 117 8.608 -3.979 -3.449 1.00 0.00 N ATOM 775 CA ILE A 117 8.063 -3.635 -4.757 1.00 0.00 C ATOM 776 C ILE A 117 8.901 -2.556 -5.434 1.00 0.00 C ATOM 777 O ILE A 117 8.870 -1.392 -5.038 1.00 0.00 O ATOM 778 CB ILE A 117 6.607 -3.146 -4.649 1.00 0.00 C ATOM 779 CG1 ILE A 117 5.764 -4.152 -3.863 1.00 0.00 C ATOM 780 CG2 ILE A 117 6.019 -2.923 -6.035 1.00 0.00 C ATOM 781 CD1 ILE A 117 5.398 -5.386 -4.658 1.00 0.00 C ATOM 0 H ILE A 117 7.994 -3.758 -2.665 1.00 0.00 H new ATOM 0 HA ILE A 117 8.089 -4.543 -5.359 1.00 0.00 H new ATOM 0 HB ILE A 117 6.598 -2.196 -4.114 1.00 0.00 H new ATOM 0 HG12 ILE A 117 6.312 -4.454 -2.971 1.00 0.00 H new ATOM 0 HG13 ILE A 117 4.850 -3.663 -3.526 1.00 0.00 H new ATOM 0 HG21 ILE A 117 4.989 -2.578 -5.942 1.00 0.00 H new ATOM 0 HG22 ILE A 117 6.607 -2.173 -6.563 1.00 0.00 H new ATOM 0 HG23 ILE A 117 6.039 -3.859 -6.593 1.00 0.00 H new ATOM 0 HD11 ILE A 117 4.801 -6.054 -4.038 1.00 0.00 H new ATOM 0 HD12 ILE A 117 4.822 -5.095 -5.537 1.00 0.00 H new ATOM 0 HD13 ILE A 117 6.307 -5.899 -4.973 1.00 0.00 H new ATOM 793 N GLN A 118 9.649 -2.953 -6.460 1.00 0.00 N ATOM 794 CA GLN A 118 10.494 -2.019 -7.194 1.00 0.00 C ATOM 795 C GLN A 118 9.960 -1.793 -8.604 1.00 0.00 C ATOM 796 O GLN A 118 9.106 -2.539 -9.083 1.00 0.00 O ATOM 797 CB GLN A 118 11.931 -2.541 -7.258 1.00 0.00 C ATOM 798 CG GLN A 118 12.781 -2.130 -6.067 1.00 0.00 C ATOM 799 CD GLN A 118 12.695 -0.645 -5.772 1.00 0.00 C ATOM 800 OE1 GLN A 118 13.305 0.172 -6.461 1.00 0.00 O ATOM 801 NE2 GLN A 118 11.934 -0.289 -4.744 1.00 0.00 N ATOM 0 H GLN A 118 9.686 -3.914 -6.801 1.00 0.00 H new ATOM 0 HA GLN A 118 10.484 -1.066 -6.665 1.00 0.00 H new ATOM 0 HB2 GLN A 118 11.911 -3.629 -7.321 1.00 0.00 H new ATOM 0 HB3 GLN A 118 12.401 -2.177 -8.172 1.00 0.00 H new ATOM 0 HG2 GLN A 118 12.462 -2.690 -5.188 1.00 0.00 H new ATOM 0 HG3 GLN A 118 13.820 -2.399 -6.257 1.00 0.00 H new ATOM 0 HE21 GLN A 118 11.446 -1.001 -4.200 1.00 0.00 H new ATOM 0 HE22 GLN A 118 11.837 0.696 -4.498 1.00 0.00 H new ATOM 810 N LYS A 119 10.467 -0.758 -9.265 1.00 0.00 N ATOM 811 CA LYS A 119 10.042 -0.433 -10.621 1.00 0.00 C ATOM 812 C LYS A 119 10.340 -1.585 -11.576 1.00 0.00 C ATOM 813 O LYS A 119 9.470 -2.022 -12.329 1.00 0.00 O ATOM 814 CB LYS A 119 10.741 0.839 -11.106 1.00 0.00 C ATOM 815 CG LYS A 119 10.438 1.186 -12.553 1.00 0.00 C ATOM 816 CD LYS A 119 10.963 2.565 -12.918 1.00 0.00 C ATOM 817 CE LYS A 119 12.450 2.528 -13.236 1.00 0.00 C ATOM 818 NZ LYS A 119 12.717 1.931 -14.574 1.00 0.00 N ATOM 0 H LYS A 119 11.174 -0.129 -8.883 1.00 0.00 H new ATOM 0 HA LYS A 119 8.965 -0.265 -10.607 1.00 0.00 H new ATOM 0 HB2 LYS A 119 10.441 1.673 -10.471 1.00 0.00 H new ATOM 0 HB3 LYS A 119 11.818 0.719 -10.988 1.00 0.00 H new ATOM 0 HG2 LYS A 119 10.887 0.440 -13.209 1.00 0.00 H new ATOM 0 HG3 LYS A 119 9.361 1.150 -12.719 1.00 0.00 H new ATOM 0 HD2 LYS A 119 10.415 2.948 -13.779 1.00 0.00 H new ATOM 0 HD3 LYS A 119 10.783 3.254 -12.093 1.00 0.00 H new ATOM 0 HE2 LYS A 119 12.854 3.540 -13.203 1.00 0.00 H new ATOM 0 HE3 LYS A 119 12.971 1.952 -12.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 13.711 2.091 -14.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 12.528 0.909 -14.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 12.099 2.376 -15.282 1.00 0.00 H new ATOM 832 N LYS A 120 11.575 -2.074 -11.538 1.00 0.00 N ATOM 833 CA LYS A 120 11.988 -3.177 -12.397 1.00 0.00 C ATOM 834 C LYS A 120 11.123 -4.409 -12.154 1.00 0.00 C ATOM 835 O LYS A 120 10.598 -5.006 -13.093 1.00 0.00 O ATOM 836 CB LYS A 120 13.460 -3.517 -12.153 1.00 0.00 C ATOM 837 CG LYS A 120 14.419 -2.431 -12.607 1.00 0.00 C ATOM 838 CD LYS A 120 14.588 -2.432 -14.117 1.00 0.00 C ATOM 839 CE LYS A 120 15.849 -1.693 -14.537 1.00 0.00 C ATOM 840 NZ LYS A 120 15.629 -0.222 -14.617 1.00 0.00 N ATOM 0 H LYS A 120 12.308 -1.723 -10.921 1.00 0.00 H new ATOM 0 HA LYS A 120 11.861 -2.865 -13.434 1.00 0.00 H new ATOM 0 HB2 LYS A 120 13.610 -3.701 -11.089 1.00 0.00 H new ATOM 0 HB3 LYS A 120 13.701 -4.444 -12.674 1.00 0.00 H new ATOM 0 HG2 LYS A 120 14.049 -1.459 -12.282 1.00 0.00 H new ATOM 0 HG3 LYS A 120 15.389 -2.578 -12.131 1.00 0.00 H new ATOM 0 HD2 LYS A 120 14.629 -3.459 -14.479 1.00 0.00 H new ATOM 0 HD3 LYS A 120 13.720 -1.965 -14.582 1.00 0.00 H new ATOM 0 HE2 LYS A 120 16.647 -1.903 -13.825 1.00 0.00 H new ATOM 0 HE3 LYS A 120 16.181 -2.064 -15.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 16.512 0.246 -14.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 14.885 -0.020 -15.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 15.336 0.136 -13.686 1.00 0.00 H new ATOM 854 N ASN A 121 10.979 -4.785 -10.887 1.00 0.00 N ATOM 855 CA ASN A 121 10.177 -5.946 -10.520 1.00 0.00 C ATOM 856 C ASN A 121 8.995 -5.537 -9.646 1.00 0.00 C ATOM 857 O ASN A 121 9.038 -5.676 -8.423 1.00 0.00 O ATOM 858 CB ASN A 121 11.038 -6.976 -9.786 1.00 0.00 C ATOM 859 CG ASN A 121 11.994 -7.698 -10.715 1.00 0.00 C ATOM 860 OD1 ASN A 121 11.581 -8.284 -11.715 1.00 0.00 O ATOM 861 ND2 ASN A 121 13.280 -7.659 -10.386 1.00 0.00 N ATOM 0 H ASN A 121 11.408 -4.302 -10.097 1.00 0.00 H new ATOM 0 HA ASN A 121 9.790 -6.393 -11.436 1.00 0.00 H new ATOM 0 HB2 ASN A 121 11.606 -6.477 -9.001 1.00 0.00 H new ATOM 0 HB3 ASN A 121 10.391 -7.704 -9.297 1.00 0.00 H new ATOM 0 HD21 ASN A 121 13.971 -8.127 -10.972 1.00 0.00 H new ATOM 0 HD22 ASN A 121 13.577 -7.161 -9.547 1.00 0.00 H new ATOM 868 N ARG A 122 7.943 -5.033 -10.281 1.00 0.00 N ATOM 869 CA ARG A 122 6.750 -4.603 -9.561 1.00 0.00 C ATOM 870 C ARG A 122 5.769 -5.760 -9.394 1.00 0.00 C ATOM 871 O ARG A 122 5.167 -5.929 -8.334 1.00 0.00 O ATOM 872 CB ARG A 122 6.072 -3.447 -10.298 1.00 0.00 C ATOM 873 CG ARG A 122 5.817 -3.730 -11.770 1.00 0.00 C ATOM 874 CD ARG A 122 5.074 -2.583 -12.437 1.00 0.00 C ATOM 875 NE ARG A 122 4.673 -2.912 -13.803 1.00 0.00 N ATOM 876 CZ ARG A 122 4.193 -2.020 -14.662 1.00 0.00 C ATOM 877 NH1 ARG A 122 4.055 -0.752 -14.300 1.00 0.00 N ATOM 878 NH2 ARG A 122 3.850 -2.396 -15.888 1.00 0.00 N ATOM 0 H ARG A 122 7.892 -4.912 -11.293 1.00 0.00 H new ATOM 0 HA ARG A 122 7.056 -4.263 -8.572 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.123 -3.223 -9.810 1.00 0.00 H new ATOM 0 HB3 ARG A 122 6.694 -2.556 -10.210 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.766 -3.895 -12.280 1.00 0.00 H new ATOM 0 HG3 ARG A 122 5.237 -4.648 -11.870 1.00 0.00 H new ATOM 0 HD2 ARG A 122 4.190 -2.333 -11.850 1.00 0.00 H new ATOM 0 HD3 ARG A 122 5.709 -1.697 -12.449 1.00 0.00 H new ATOM 0 HE ARG A 122 4.767 -3.879 -14.114 1.00 0.00 H new ATOM 0 HH11 ARG A 122 4.318 -0.459 -13.359 1.00 0.00 H new ATOM 0 HH12 ARG A 122 3.686 -0.070 -14.962 1.00 0.00 H new ATOM 0 HH21 ARG A 122 3.955 -3.370 -16.171 1.00 0.00 H new ATOM 0 HH22 ARG A 122 3.481 -1.711 -16.547 1.00 0.00 H new ATOM 892 N ASN A 123 5.613 -6.554 -10.449 1.00 0.00 N ATOM 893 CA ASN A 123 4.705 -7.694 -10.420 1.00 0.00 C ATOM 894 C ASN A 123 5.418 -8.945 -9.914 1.00 0.00 C ATOM 895 O ASN A 123 5.203 -10.045 -10.423 1.00 0.00 O ATOM 896 CB ASN A 123 4.130 -7.950 -11.814 1.00 0.00 C ATOM 897 CG ASN A 123 3.439 -6.728 -12.388 1.00 0.00 C ATOM 898 OD1 ASN A 123 3.109 -5.790 -11.662 1.00 0.00 O ATOM 899 ND2 ASN A 123 3.215 -6.735 -13.697 1.00 0.00 N ATOM 0 H ASN A 123 6.104 -6.428 -11.334 1.00 0.00 H new ATOM 0 HA ASN A 123 3.890 -7.460 -9.735 1.00 0.00 H new ATOM 0 HB2 ASN A 123 4.933 -8.258 -12.484 1.00 0.00 H new ATOM 0 HB3 ASN A 123 3.420 -8.776 -11.765 1.00 0.00 H new ATOM 0 HD21 ASN A 123 2.752 -5.941 -14.139 1.00 0.00 H new ATOM 0 HD22 ASN A 123 3.506 -7.534 -14.260 1.00 0.00 H new ATOM 906 N LYS A 124 6.267 -8.769 -8.907 1.00 0.00 N ATOM 907 CA LYS A 124 7.011 -9.882 -8.329 1.00 0.00 C ATOM 908 C LYS A 124 6.158 -10.639 -7.316 1.00 0.00 C ATOM 909 O LYS A 124 5.812 -11.801 -7.526 1.00 0.00 O ATOM 910 CB LYS A 124 8.289 -9.374 -7.658 1.00 0.00 C ATOM 911 CG LYS A 124 9.256 -10.481 -7.275 1.00 0.00 C ATOM 912 CD LYS A 124 9.802 -11.193 -8.501 1.00 0.00 C ATOM 913 CE LYS A 124 11.042 -12.008 -8.166 1.00 0.00 C ATOM 914 NZ LYS A 124 11.412 -12.935 -9.271 1.00 0.00 N ATOM 0 H LYS A 124 6.457 -7.865 -8.474 1.00 0.00 H new ATOM 0 HA LYS A 124 7.278 -10.566 -9.135 1.00 0.00 H new ATOM 0 HB2 LYS A 124 8.792 -8.680 -8.332 1.00 0.00 H new ATOM 0 HB3 LYS A 124 8.021 -8.812 -6.764 1.00 0.00 H new ATOM 0 HG2 LYS A 124 10.081 -10.062 -6.699 1.00 0.00 H new ATOM 0 HG3 LYS A 124 8.750 -11.200 -6.630 1.00 0.00 H new ATOM 0 HD2 LYS A 124 9.035 -11.848 -8.914 1.00 0.00 H new ATOM 0 HD3 LYS A 124 10.044 -10.460 -9.271 1.00 0.00 H new ATOM 0 HE2 LYS A 124 11.875 -11.335 -7.963 1.00 0.00 H new ATOM 0 HE3 LYS A 124 10.865 -12.581 -7.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 12.262 -13.472 -9.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 10.627 -13.594 -9.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 11.606 -12.387 -10.134 1.00 0.00 H new ATOM 928 N CYS A 125 5.821 -9.971 -6.217 1.00 0.00 N ATOM 929 CA CYS A 125 5.008 -10.580 -5.172 1.00 0.00 C ATOM 930 C CYS A 125 3.638 -9.913 -5.091 1.00 0.00 C ATOM 931 O CYS A 125 3.534 -8.687 -5.064 1.00 0.00 O ATOM 932 CB CYS A 125 5.718 -10.477 -3.820 1.00 0.00 C ATOM 933 SG CYS A 125 4.961 -11.485 -2.505 1.00 0.00 S ATOM 0 H CYS A 125 6.099 -9.008 -6.028 1.00 0.00 H new ATOM 0 HA CYS A 125 4.867 -11.631 -5.422 1.00 0.00 H new ATOM 0 HB2 CYS A 125 6.757 -10.781 -3.943 1.00 0.00 H new ATOM 0 HB3 CYS A 125 5.726 -9.434 -3.504 1.00 0.00 H new ATOM 938 N GLN A 126 2.590 -10.730 -5.052 1.00 0.00 N ATOM 939 CA GLN A 126 1.227 -10.219 -4.975 1.00 0.00 C ATOM 940 C GLN A 126 0.893 -9.770 -3.556 1.00 0.00 C ATOM 941 O GLN A 126 0.484 -8.630 -3.334 1.00 0.00 O ATOM 942 CB GLN A 126 0.232 -11.288 -5.431 1.00 0.00 C ATOM 943 CG GLN A 126 0.134 -11.421 -6.943 1.00 0.00 C ATOM 944 CD GLN A 126 -0.891 -12.453 -7.372 1.00 0.00 C ATOM 945 OE1 GLN A 126 -1.973 -12.109 -7.848 1.00 0.00 O ATOM 946 NE2 GLN A 126 -0.555 -13.726 -7.206 1.00 0.00 N ATOM 0 H GLN A 126 2.659 -11.747 -5.072 1.00 0.00 H new ATOM 0 HA GLN A 126 1.152 -9.356 -5.637 1.00 0.00 H new ATOM 0 HB2 GLN A 126 0.524 -12.249 -5.008 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -0.753 -11.050 -5.031 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -0.127 -10.454 -7.373 1.00 0.00 H new ATOM 0 HG3 GLN A 126 1.110 -11.695 -7.344 1.00 0.00 H new ATOM 0 HE21 GLN A 126 0.353 -13.966 -6.807 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -1.204 -14.464 -7.477 1.00 0.00 H new ATOM 955 N TYR A 127 1.069 -10.674 -2.598 1.00 0.00 N ATOM 956 CA TYR A 127 0.784 -10.372 -1.201 1.00 0.00 C ATOM 957 C TYR A 127 1.458 -9.071 -0.776 1.00 0.00 C ATOM 958 O TYR A 127 0.790 -8.085 -0.464 1.00 0.00 O ATOM 959 CB TYR A 127 1.253 -11.519 -0.303 1.00 0.00 C ATOM 960 CG TYR A 127 0.766 -11.409 1.124 1.00 0.00 C ATOM 961 CD1 TYR A 127 1.458 -10.649 2.058 1.00 0.00 C ATOM 962 CD2 TYR A 127 -0.385 -12.067 1.538 1.00 0.00 C ATOM 963 CE1 TYR A 127 1.018 -10.546 3.363 1.00 0.00 C ATOM 964 CE2 TYR A 127 -0.834 -11.969 2.841 1.00 0.00 C ATOM 965 CZ TYR A 127 -0.129 -11.207 3.750 1.00 0.00 C ATOM 966 OH TYR A 127 -0.572 -11.108 5.049 1.00 0.00 O ATOM 0 H TYR A 127 1.408 -11.622 -2.764 1.00 0.00 H new ATOM 0 HA TYR A 127 -0.294 -10.253 -1.095 1.00 0.00 H new ATOM 0 HB2 TYR A 127 0.908 -12.463 -0.724 1.00 0.00 H new ATOM 0 HB3 TYR A 127 2.343 -11.549 -0.305 1.00 0.00 H new ATOM 0 HD1 TYR A 127 2.356 -10.129 1.758 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -0.938 -12.665 0.829 1.00 0.00 H new ATOM 0 HE1 TYR A 127 1.569 -9.951 4.076 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -1.732 -12.486 3.146 1.00 0.00 H new ATOM 0 HH TYR A 127 -1.393 -11.632 5.156 1.00 0.00 H new ATOM 976 N CYS A 128 2.787 -9.077 -0.766 1.00 0.00 N ATOM 977 CA CYS A 128 3.554 -7.898 -0.380 1.00 0.00 C ATOM 978 C CYS A 128 3.015 -6.648 -1.069 1.00 0.00 C ATOM 979 O CYS A 128 2.781 -5.625 -0.426 1.00 0.00 O ATOM 980 CB CYS A 128 5.032 -8.089 -0.730 1.00 0.00 C ATOM 981 SG CYS A 128 5.916 -9.232 0.378 1.00 0.00 S ATOM 0 H CYS A 128 3.355 -9.885 -1.021 1.00 0.00 H new ATOM 0 HA CYS A 128 3.456 -7.768 0.698 1.00 0.00 H new ATOM 0 HB2 CYS A 128 5.107 -8.460 -1.752 1.00 0.00 H new ATOM 0 HB3 CYS A 128 5.529 -7.119 -0.705 1.00 0.00 H new ATOM 986 N ARG A 129 2.819 -6.740 -2.380 1.00 0.00 N ATOM 987 CA ARG A 129 2.308 -5.617 -3.157 1.00 0.00 C ATOM 988 C ARG A 129 1.114 -4.972 -2.459 1.00 0.00 C ATOM 989 O ARG A 129 1.019 -3.747 -2.372 1.00 0.00 O ATOM 990 CB ARG A 129 1.904 -6.079 -4.558 1.00 0.00 C ATOM 991 CG ARG A 129 1.502 -4.942 -5.483 1.00 0.00 C ATOM 992 CD ARG A 129 1.623 -5.343 -6.945 1.00 0.00 C ATOM 993 NE ARG A 129 0.975 -4.381 -7.832 1.00 0.00 N ATOM 994 CZ ARG A 129 0.838 -4.565 -9.140 1.00 0.00 C ATOM 995 NH1 ARG A 129 1.301 -5.668 -9.710 1.00 0.00 N ATOM 996 NH2 ARG A 129 0.235 -3.643 -9.881 1.00 0.00 N ATOM 0 H ARG A 129 3.006 -7.581 -2.927 1.00 0.00 H new ATOM 0 HA ARG A 129 3.102 -4.876 -3.242 1.00 0.00 H new ATOM 0 HB2 ARG A 129 2.736 -6.623 -5.006 1.00 0.00 H new ATOM 0 HB3 ARG A 129 1.073 -6.779 -4.475 1.00 0.00 H new ATOM 0 HG2 ARG A 129 0.475 -4.644 -5.270 1.00 0.00 H new ATOM 0 HG3 ARG A 129 2.132 -4.074 -5.289 1.00 0.00 H new ATOM 0 HD2 ARG A 129 2.676 -5.429 -7.211 1.00 0.00 H new ATOM 0 HD3 ARG A 129 1.176 -6.327 -7.089 1.00 0.00 H new ATOM 0 HE ARG A 129 0.608 -3.521 -7.425 1.00 0.00 H new ATOM 0 HH11 ARG A 129 1.764 -6.379 -9.144 1.00 0.00 H new ATOM 0 HH12 ARG A 129 1.194 -5.806 -10.715 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -0.123 -2.793 -9.446 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.130 -3.785 -10.886 1.00 0.00 H new ATOM 1010 N PHE A 130 0.204 -5.805 -1.963 1.00 0.00 N ATOM 1011 CA PHE A 130 -0.985 -5.316 -1.274 1.00 0.00 C ATOM 1012 C PHE A 130 -0.623 -4.738 0.091 1.00 0.00 C ATOM 1013 O PHE A 130 -0.989 -3.608 0.414 1.00 0.00 O ATOM 1014 CB PHE A 130 -2.004 -6.445 -1.109 1.00 0.00 C ATOM 1015 CG PHE A 130 -3.302 -5.996 -0.502 1.00 0.00 C ATOM 1016 CD1 PHE A 130 -3.397 -5.748 0.858 1.00 0.00 C ATOM 1017 CD2 PHE A 130 -4.428 -5.822 -1.290 1.00 0.00 C ATOM 1018 CE1 PHE A 130 -4.590 -5.335 1.420 1.00 0.00 C ATOM 1019 CE2 PHE A 130 -5.625 -5.410 -0.734 1.00 0.00 C ATOM 1020 CZ PHE A 130 -5.705 -5.165 0.623 1.00 0.00 C ATOM 0 H PHE A 130 0.267 -6.821 -2.025 1.00 0.00 H new ATOM 0 HA PHE A 130 -1.426 -4.524 -1.879 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -2.203 -6.890 -2.084 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -1.571 -7.226 -0.484 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -2.528 -5.879 1.486 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -4.370 -6.011 -2.352 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -4.650 -5.145 2.482 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -6.496 -5.280 -1.360 1.00 0.00 H new ATOM 0 HZ PHE A 130 -6.638 -4.841 1.060 1.00 0.00 H new ATOM 1030 N GLN A 131 0.096 -5.523 0.887 1.00 0.00 N ATOM 1031 CA GLN A 131 0.506 -5.089 2.218 1.00 0.00 C ATOM 1032 C GLN A 131 1.068 -3.672 2.180 1.00 0.00 C ATOM 1033 O GLN A 131 0.639 -2.802 2.939 1.00 0.00 O ATOM 1034 CB GLN A 131 1.549 -6.050 2.791 1.00 0.00 C ATOM 1035 CG GLN A 131 0.988 -7.417 3.145 1.00 0.00 C ATOM 1036 CD GLN A 131 -0.080 -7.350 4.219 1.00 0.00 C ATOM 1037 OE1 GLN A 131 -1.275 -7.398 3.927 1.00 0.00 O ATOM 1038 NE2 GLN A 131 0.346 -7.237 5.472 1.00 0.00 N ATOM 0 H GLN A 131 0.406 -6.461 0.634 1.00 0.00 H new ATOM 0 HA GLN A 131 -0.374 -5.093 2.861 1.00 0.00 H new ATOM 0 HB2 GLN A 131 2.354 -6.173 2.066 1.00 0.00 H new ATOM 0 HB3 GLN A 131 1.989 -5.605 3.683 1.00 0.00 H new ATOM 0 HG2 GLN A 131 0.569 -7.876 2.250 1.00 0.00 H new ATOM 0 HG3 GLN A 131 1.799 -8.061 3.484 1.00 0.00 H new ATOM 0 HE21 GLN A 131 1.346 -7.201 5.669 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -0.327 -7.186 6.237 1.00 0.00 H new ATOM 1047 N LYS A 132 2.030 -3.446 1.292 1.00 0.00 N ATOM 1048 CA LYS A 132 2.652 -2.135 1.154 1.00 0.00 C ATOM 1049 C LYS A 132 1.599 -1.031 1.156 1.00 0.00 C ATOM 1050 O LYS A 132 1.708 -0.058 1.903 1.00 0.00 O ATOM 1051 CB LYS A 132 3.472 -2.070 -0.137 1.00 0.00 C ATOM 1052 CG LYS A 132 4.265 -0.783 -0.289 1.00 0.00 C ATOM 1053 CD LYS A 132 5.490 -0.984 -1.165 1.00 0.00 C ATOM 1054 CE LYS A 132 6.201 0.332 -1.440 1.00 0.00 C ATOM 1055 NZ LYS A 132 7.115 0.712 -0.328 1.00 0.00 N ATOM 0 H LYS A 132 2.396 -4.155 0.656 1.00 0.00 H new ATOM 0 HA LYS A 132 3.315 -1.983 2.006 1.00 0.00 H new ATOM 0 HB2 LYS A 132 4.159 -2.916 -0.164 1.00 0.00 H new ATOM 0 HB3 LYS A 132 2.801 -2.177 -0.990 1.00 0.00 H new ATOM 0 HG2 LYS A 132 3.629 -0.011 -0.723 1.00 0.00 H new ATOM 0 HG3 LYS A 132 4.574 -0.426 0.694 1.00 0.00 H new ATOM 0 HD2 LYS A 132 6.178 -1.675 -0.678 1.00 0.00 H new ATOM 0 HD3 LYS A 132 5.193 -1.442 -2.108 1.00 0.00 H new ATOM 0 HE2 LYS A 132 6.770 0.251 -2.366 1.00 0.00 H new ATOM 0 HE3 LYS A 132 5.462 1.120 -1.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 7.580 1.614 -0.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 6.568 0.815 0.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 7.836 -0.027 -0.203 1.00 0.00 H new ATOM 1069 N CYS A 133 0.581 -1.189 0.317 1.00 0.00 N ATOM 1070 CA CYS A 133 -0.492 -0.206 0.223 1.00 0.00 C ATOM 1071 C CYS A 133 -1.019 0.158 1.607 1.00 0.00 C ATOM 1072 O CYS A 133 -1.063 1.332 1.978 1.00 0.00 O ATOM 1073 CB CYS A 133 -1.631 -0.745 -0.644 1.00 0.00 C ATOM 1074 SG CYS A 133 -1.219 -0.887 -2.399 1.00 0.00 S ATOM 0 H CYS A 133 0.476 -1.988 -0.308 1.00 0.00 H new ATOM 0 HA CYS A 133 -0.087 0.694 -0.240 1.00 0.00 H new ATOM 0 HB2 CYS A 133 -1.925 -1.726 -0.270 1.00 0.00 H new ATOM 0 HB3 CYS A 133 -2.496 -0.091 -0.537 1.00 0.00 H new ATOM 0 HG CYS A 133 -1.790 0.077 -3.058 1.00 0.00 H new ATOM 1080 N LEU A 134 -1.420 -0.855 2.367 1.00 0.00 N ATOM 1081 CA LEU A 134 -1.946 -0.643 3.711 1.00 0.00 C ATOM 1082 C LEU A 134 -1.024 0.265 4.519 1.00 0.00 C ATOM 1083 O LEU A 134 -1.463 1.265 5.087 1.00 0.00 O ATOM 1084 CB LEU A 134 -2.121 -1.982 4.429 1.00 0.00 C ATOM 1085 CG LEU A 134 -3.216 -2.898 3.883 1.00 0.00 C ATOM 1086 CD1 LEU A 134 -3.182 -4.247 4.585 1.00 0.00 C ATOM 1087 CD2 LEU A 134 -4.583 -2.248 4.040 1.00 0.00 C ATOM 0 H LEU A 134 -1.391 -1.832 2.075 1.00 0.00 H new ATOM 0 HA LEU A 134 -2.918 -0.157 3.622 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -1.173 -2.519 4.390 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -2.332 -1.783 5.480 1.00 0.00 H new ATOM 0 HG LEU A 134 -3.032 -3.059 2.821 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -3.968 -4.886 4.183 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -2.213 -4.718 4.421 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -3.340 -4.105 5.654 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -5.350 -2.914 3.646 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -4.776 -2.057 5.096 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -4.603 -1.307 3.491 1.00 0.00 H new ATOM 1099 N ALA A 135 0.256 -0.091 4.565 1.00 0.00 N ATOM 1100 CA ALA A 135 1.240 0.694 5.300 1.00 0.00 C ATOM 1101 C ALA A 135 1.284 2.132 4.796 1.00 0.00 C ATOM 1102 O ALA A 135 1.367 3.075 5.584 1.00 0.00 O ATOM 1103 CB ALA A 135 2.615 0.052 5.190 1.00 0.00 C ATOM 0 H ALA A 135 0.635 -0.917 4.102 1.00 0.00 H new ATOM 0 HA ALA A 135 0.942 0.714 6.348 1.00 0.00 H new ATOM 0 HB1 ALA A 135 3.340 0.648 5.743 1.00 0.00 H new ATOM 0 HB2 ALA A 135 2.581 -0.955 5.606 1.00 0.00 H new ATOM 0 HB3 ALA A 135 2.910 0.002 4.142 1.00 0.00 H new ATOM 1109 N LEU A 136 1.228 2.294 3.479 1.00 0.00 N ATOM 1110 CA LEU A 136 1.262 3.619 2.869 1.00 0.00 C ATOM 1111 C LEU A 136 0.113 4.482 3.379 1.00 0.00 C ATOM 1112 O LEU A 136 0.213 5.708 3.417 1.00 0.00 O ATOM 1113 CB LEU A 136 1.190 3.502 1.345 1.00 0.00 C ATOM 1114 CG LEU A 136 2.451 2.986 0.651 1.00 0.00 C ATOM 1115 CD1 LEU A 136 2.179 2.717 -0.820 1.00 0.00 C ATOM 1116 CD2 LEU A 136 3.592 3.980 0.812 1.00 0.00 C ATOM 0 H LEU A 136 1.159 1.525 2.813 1.00 0.00 H new ATOM 0 HA LEU A 136 2.202 4.096 3.147 1.00 0.00 H new ATOM 0 HB2 LEU A 136 0.362 2.840 1.090 1.00 0.00 H new ATOM 0 HB3 LEU A 136 0.950 4.484 0.936 1.00 0.00 H new ATOM 0 HG LEU A 136 2.744 2.048 1.122 1.00 0.00 H new ATOM 0 HD11 LEU A 136 3.088 2.351 -1.297 1.00 0.00 H new ATOM 0 HD12 LEU A 136 1.393 1.968 -0.914 1.00 0.00 H new ATOM 0 HD13 LEU A 136 1.861 3.639 -1.306 1.00 0.00 H new ATOM 0 HD21 LEU A 136 4.482 3.597 0.312 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.309 4.934 0.368 1.00 0.00 H new ATOM 0 HD23 LEU A 136 3.804 4.122 1.872 1.00 0.00 H new ATOM 1128 N GLY A 137 -0.980 3.834 3.771 1.00 0.00 N ATOM 1129 CA GLY A 137 -2.131 4.558 4.276 1.00 0.00 C ATOM 1130 C GLY A 137 -3.287 4.567 3.294 1.00 0.00 C ATOM 1131 O GLY A 137 -4.082 5.506 3.270 1.00 0.00 O ATOM 0 H GLY A 137 -1.088 2.820 3.748 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -2.458 4.107 5.213 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -1.841 5.584 4.500 1.00 0.00 H new ATOM 1135 N MET A 138 -3.378 3.519 2.482 1.00 0.00 N ATOM 1136 CA MET A 138 -4.445 3.411 1.493 1.00 0.00 C ATOM 1137 C MET A 138 -5.765 3.033 2.157 1.00 0.00 C ATOM 1138 O MET A 138 -5.894 1.953 2.733 1.00 0.00 O ATOM 1139 CB MET A 138 -4.080 2.373 0.430 1.00 0.00 C ATOM 1140 CG MET A 138 -3.328 2.957 -0.756 1.00 0.00 C ATOM 1141 SD MET A 138 -3.368 1.880 -2.202 1.00 0.00 S ATOM 1142 CE MET A 138 -2.985 3.048 -3.505 1.00 0.00 C ATOM 0 H MET A 138 -2.727 2.734 2.489 1.00 0.00 H new ATOM 0 HA MET A 138 -4.564 4.384 1.015 1.00 0.00 H new ATOM 0 HB2 MET A 138 -3.471 1.594 0.888 1.00 0.00 H new ATOM 0 HB3 MET A 138 -4.992 1.895 0.072 1.00 0.00 H new ATOM 0 HG2 MET A 138 -3.760 3.923 -1.015 1.00 0.00 H new ATOM 0 HG3 MET A 138 -2.292 3.138 -0.471 1.00 0.00 H new ATOM 0 HE1 MET A 138 -3.213 2.601 -4.473 1.00 0.00 H new ATOM 0 HE2 MET A 138 -3.582 3.950 -3.372 1.00 0.00 H new ATOM 0 HE3 MET A 138 -1.926 3.304 -3.464 1.00 0.00 H new ATOM 1152 N SER A 139 -6.743 3.929 2.072 1.00 0.00 N ATOM 1153 CA SER A 139 -8.052 3.691 2.668 1.00 0.00 C ATOM 1154 C SER A 139 -8.840 2.667 1.857 1.00 0.00 C ATOM 1155 O SER A 139 -9.336 2.967 0.770 1.00 0.00 O ATOM 1156 CB SER A 139 -8.839 4.999 2.762 1.00 0.00 C ATOM 1157 OG SER A 139 -8.368 5.803 3.830 1.00 0.00 O ATOM 0 H SER A 139 -6.653 4.827 1.596 1.00 0.00 H new ATOM 0 HA SER A 139 -7.900 3.294 3.672 1.00 0.00 H new ATOM 0 HB2 SER A 139 -8.752 5.548 1.824 1.00 0.00 H new ATOM 0 HB3 SER A 139 -9.897 4.781 2.906 1.00 0.00 H new ATOM 0 HG SER A 139 -8.886 6.634 3.867 1.00 0.00 H new ATOM 1163 N HIS A 140 -8.952 1.456 2.393 1.00 0.00 N ATOM 1164 CA HIS A 140 -9.681 0.386 1.720 1.00 0.00 C ATOM 1165 C HIS A 140 -11.184 0.648 1.754 1.00 0.00 C ATOM 1166 O HIS A 140 -11.885 0.422 0.769 1.00 0.00 O ATOM 1167 CB HIS A 140 -9.371 -0.960 2.374 1.00 0.00 C ATOM 1168 CG HIS A 140 -9.648 -0.990 3.845 1.00 0.00 C ATOM 1169 ND1 HIS A 140 -8.716 -0.626 4.794 1.00 0.00 N ATOM 1170 CD2 HIS A 140 -10.762 -1.341 4.529 1.00 0.00 C ATOM 1171 CE1 HIS A 140 -9.244 -0.754 5.998 1.00 0.00 C ATOM 1172 NE2 HIS A 140 -10.486 -1.186 5.865 1.00 0.00 N ATOM 0 H HIS A 140 -8.548 1.191 3.291 1.00 0.00 H new ATOM 0 HA HIS A 140 -9.358 0.358 0.679 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -9.961 -1.736 1.886 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -8.322 -1.203 2.205 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -11.695 -1.680 4.103 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -8.746 -0.542 6.932 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -11.134 -1.374 6.630 1.00 0.00 H new ATOM 1180 N ASN A 141 -11.671 1.124 2.895 1.00 0.00 N ATOM 1181 CA ASN A 141 -13.091 1.415 3.058 1.00 0.00 C ATOM 1182 C ASN A 141 -13.448 2.755 2.423 1.00 0.00 C ATOM 1183 O ASN A 141 -14.169 3.560 3.012 1.00 0.00 O ATOM 1184 CB ASN A 141 -13.464 1.424 4.541 1.00 0.00 C ATOM 1185 CG ASN A 141 -14.962 1.521 4.760 1.00 0.00 C ATOM 1186 OD1 ASN A 141 -15.464 2.532 5.252 1.00 0.00 O ATOM 1187 ND2 ASN A 141 -15.683 0.467 4.395 1.00 0.00 N ATOM 0 H ASN A 141 -11.104 1.316 3.720 1.00 0.00 H new ATOM 0 HA ASN A 141 -13.657 0.632 2.553 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -13.089 0.516 5.013 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -12.973 2.264 5.031 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -16.695 0.474 4.518 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -15.224 -0.350 3.991 1.00 0.00 H new ATOM 1194 N ALA A 142 -12.938 2.988 1.218 1.00 0.00 N ATOM 1195 CA ALA A 142 -13.205 4.229 0.502 1.00 0.00 C ATOM 1196 C ALA A 142 -13.803 3.953 -0.873 1.00 0.00 C ATOM 1197 O ALA A 142 -14.619 4.727 -1.372 1.00 0.00 O ATOM 1198 CB ALA A 142 -11.929 5.047 0.370 1.00 0.00 C ATOM 0 H ALA A 142 -12.337 2.333 0.717 1.00 0.00 H new ATOM 0 HA ALA A 142 -13.933 4.801 1.077 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -12.143 5.971 -0.167 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -11.545 5.284 1.362 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -11.184 4.472 -0.180 1.00 0.00 H new ATOM 1204 N ILE A 143 -13.391 2.845 -1.480 1.00 0.00 N ATOM 1205 CA ILE A 143 -13.886 2.466 -2.797 1.00 0.00 C ATOM 1206 C ILE A 143 -15.407 2.345 -2.799 1.00 0.00 C ATOM 1207 O ILE A 143 -15.972 1.489 -2.117 1.00 0.00 O ATOM 1208 CB ILE A 143 -13.276 1.133 -3.267 1.00 0.00 C ATOM 1209 CG1 ILE A 143 -11.749 1.228 -3.293 1.00 0.00 C ATOM 1210 CG2 ILE A 143 -13.812 0.760 -4.641 1.00 0.00 C ATOM 1211 CD1 ILE A 143 -11.058 -0.104 -3.098 1.00 0.00 C ATOM 0 H ILE A 143 -12.715 2.194 -1.080 1.00 0.00 H new ATOM 0 HA ILE A 143 -13.585 3.256 -3.485 1.00 0.00 H new ATOM 0 HB ILE A 143 -13.561 0.351 -2.563 1.00 0.00 H new ATOM 0 HG12 ILE A 143 -11.436 1.655 -4.246 1.00 0.00 H new ATOM 0 HG13 ILE A 143 -11.422 1.916 -2.513 1.00 0.00 H new ATOM 0 HG21 ILE A 143 -13.371 -0.185 -4.959 1.00 0.00 H new ATOM 0 HG22 ILE A 143 -14.896 0.657 -4.593 1.00 0.00 H new ATOM 0 HG23 ILE A 143 -13.553 1.540 -5.357 1.00 0.00 H new ATOM 0 HD11 ILE A 143 -9.978 0.039 -3.128 1.00 0.00 H new ATOM 0 HD12 ILE A 143 -11.342 -0.523 -2.133 1.00 0.00 H new ATOM 0 HD13 ILE A 143 -11.356 -0.788 -3.893 1.00 0.00 H new ATOM 1223 N ARG A 144 -16.063 3.206 -3.570 1.00 0.00 N ATOM 1224 CA ARG A 144 -17.518 3.195 -3.660 1.00 0.00 C ATOM 1225 C ARG A 144 -18.012 1.905 -4.308 1.00 0.00 C ATOM 1226 O ARG A 144 -17.428 1.422 -5.279 1.00 0.00 O ATOM 1227 CB ARG A 144 -18.009 4.402 -4.462 1.00 0.00 C ATOM 1228 CG ARG A 144 -19.458 4.767 -4.186 1.00 0.00 C ATOM 1229 CD ARG A 144 -19.621 5.399 -2.812 1.00 0.00 C ATOM 1230 NE ARG A 144 -19.451 6.849 -2.853 1.00 0.00 N ATOM 1231 CZ ARG A 144 -19.212 7.591 -1.777 1.00 0.00 C ATOM 1232 NH1 ARG A 144 -19.116 7.022 -0.583 1.00 0.00 N ATOM 1233 NH2 ARG A 144 -19.069 8.905 -1.895 1.00 0.00 N ATOM 0 H ARG A 144 -15.610 3.920 -4.141 1.00 0.00 H new ATOM 0 HA ARG A 144 -17.921 3.251 -2.649 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -17.377 5.260 -4.234 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -17.892 4.193 -5.525 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -19.812 5.459 -4.950 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -20.079 3.873 -4.253 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -20.609 5.161 -2.418 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -18.892 4.968 -2.126 1.00 0.00 H new ATOM 0 HE ARG A 144 -19.519 7.317 -3.757 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -19.226 6.012 -0.489 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -18.932 7.594 0.241 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -19.143 9.346 -2.812 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -18.886 9.474 -1.069 1.00 0.00 H new ATOM 1247 N PHE A 145 -19.091 1.352 -3.765 1.00 0.00 N ATOM 1248 CA PHE A 145 -19.663 0.117 -4.289 1.00 0.00 C ATOM 1249 C PHE A 145 -20.250 0.336 -5.680 1.00 0.00 C ATOM 1250 O PHE A 145 -21.084 1.218 -5.882 1.00 0.00 O ATOM 1251 CB PHE A 145 -20.746 -0.410 -3.344 1.00 0.00 C ATOM 1252 CG PHE A 145 -20.196 -1.103 -2.130 1.00 0.00 C ATOM 1253 CD1 PHE A 145 -19.520 -0.388 -1.154 1.00 0.00 C ATOM 1254 CD2 PHE A 145 -20.356 -2.469 -1.964 1.00 0.00 C ATOM 1255 CE1 PHE A 145 -19.013 -1.023 -0.036 1.00 0.00 C ATOM 1256 CE2 PHE A 145 -19.852 -3.109 -0.848 1.00 0.00 C ATOM 1257 CZ PHE A 145 -19.179 -2.386 0.117 1.00 0.00 C ATOM 0 H PHE A 145 -19.587 1.739 -2.962 1.00 0.00 H new ATOM 0 HA PHE A 145 -18.864 -0.621 -4.363 1.00 0.00 H new ATOM 0 HB2 PHE A 145 -21.374 0.421 -3.025 1.00 0.00 H new ATOM 0 HB3 PHE A 145 -21.387 -1.103 -3.889 1.00 0.00 H new ATOM 0 HD1 PHE A 145 -19.388 0.678 -1.268 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -20.881 -3.040 -2.716 1.00 0.00 H new ATOM 0 HE1 PHE A 145 -18.488 -0.454 0.717 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -19.984 -4.174 -0.730 1.00 0.00 H new ATOM 0 HZ PHE A 145 -18.783 -2.885 0.989 1.00 0.00 H new ATOM 1267 N GLY A 146 -19.807 -0.473 -6.637 1.00 0.00 N ATOM 1268 CA GLY A 146 -20.298 -0.351 -7.998 1.00 0.00 C ATOM 1269 C GLY A 146 -21.473 -1.268 -8.274 1.00 0.00 C ATOM 1270 O GLY A 146 -21.385 -2.164 -9.114 1.00 0.00 O ATOM 0 H GLY A 146 -19.117 -1.211 -6.495 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -20.595 0.681 -8.183 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -19.491 -0.580 -8.694 1.00 0.00 H new ATOM 1274 N SER A 147 -22.575 -1.046 -7.566 1.00 0.00 N ATOM 1275 CA SER A 147 -23.771 -1.863 -7.736 1.00 0.00 C ATOM 1276 C SER A 147 -24.434 -1.582 -9.081 1.00 0.00 C ATOM 1277 O SER A 147 -24.868 -0.463 -9.350 1.00 0.00 O ATOM 1278 CB SER A 147 -24.761 -1.596 -6.601 1.00 0.00 C ATOM 1279 OG SER A 147 -25.970 -2.308 -6.801 1.00 0.00 O ATOM 0 H SER A 147 -22.665 -0.307 -6.869 1.00 0.00 H new ATOM 0 HA SER A 147 -23.473 -2.911 -7.710 1.00 0.00 H new ATOM 0 HB2 SER A 147 -24.316 -1.888 -5.650 1.00 0.00 H new ATOM 0 HB3 SER A 147 -24.970 -0.528 -6.540 1.00 0.00 H new ATOM 0 HG SER A 147 -26.585 -2.122 -6.061 1.00 0.00 H new ATOM 1285 N GLY A 148 -24.507 -2.609 -9.922 1.00 0.00 N ATOM 1286 CA GLY A 148 -25.118 -2.454 -11.230 1.00 0.00 C ATOM 1287 C GLY A 148 -26.514 -1.868 -11.152 1.00 0.00 C ATOM 1288 O GLY A 148 -27.127 -1.811 -10.086 1.00 0.00 O ATOM 0 H GLY A 148 -24.154 -3.545 -9.722 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -24.491 -1.810 -11.847 1.00 0.00 H new ATOM 0 HA3 GLY A 148 -25.162 -3.424 -11.725 1.00 0.00 H new ATOM 1292 N PRO A 149 -27.037 -1.419 -12.303 1.00 0.00 N ATOM 1293 CA PRO A 149 -28.374 -0.826 -12.386 1.00 0.00 C ATOM 1294 C PRO A 149 -29.479 -1.855 -12.173 1.00 0.00 C ATOM 1295 O PRO A 149 -29.975 -2.455 -13.127 1.00 0.00 O ATOM 1296 CB PRO A 149 -28.428 -0.271 -13.812 1.00 0.00 C ATOM 1297 CG PRO A 149 -27.457 -1.102 -14.578 1.00 0.00 C ATOM 1298 CD PRO A 149 -26.362 -1.456 -13.611 1.00 0.00 C ATOM 0 HA PRO A 149 -28.534 -0.073 -11.614 1.00 0.00 H new ATOM 0 HB2 PRO A 149 -29.432 -0.349 -14.230 1.00 0.00 H new ATOM 0 HB3 PRO A 149 -28.153 0.783 -13.837 1.00 0.00 H new ATOM 0 HG2 PRO A 149 -27.936 -1.999 -14.971 1.00 0.00 H new ATOM 0 HG3 PRO A 149 -27.061 -0.552 -15.432 1.00 0.00 H new ATOM 0 HD2 PRO A 149 -25.944 -2.441 -13.820 1.00 0.00 H new ATOM 0 HD3 PRO A 149 -25.538 -0.744 -13.658 1.00 0.00 H new ATOM 1306 N SER A 150 -29.861 -2.053 -10.915 1.00 0.00 N ATOM 1307 CA SER A 150 -30.906 -3.013 -10.576 1.00 0.00 C ATOM 1308 C SER A 150 -30.525 -4.416 -11.037 1.00 0.00 C ATOM 1309 O SER A 150 -31.358 -5.158 -11.558 1.00 0.00 O ATOM 1310 CB SER A 150 -32.234 -2.598 -11.212 1.00 0.00 C ATOM 1311 OG SER A 150 -32.646 -1.324 -10.748 1.00 0.00 O ATOM 0 H SER A 150 -29.463 -1.562 -10.114 1.00 0.00 H new ATOM 0 HA SER A 150 -31.018 -3.024 -9.492 1.00 0.00 H new ATOM 0 HB2 SER A 150 -32.130 -2.577 -12.297 1.00 0.00 H new ATOM 0 HB3 SER A 150 -32.999 -3.338 -10.979 1.00 0.00 H new ATOM 0 HG SER A 150 -33.496 -1.081 -11.171 1.00 0.00 H new ATOM 1317 N SER A 151 -29.260 -4.773 -10.841 1.00 0.00 N ATOM 1318 CA SER A 151 -28.766 -6.086 -11.240 1.00 0.00 C ATOM 1319 C SER A 151 -28.694 -7.026 -10.040 1.00 0.00 C ATOM 1320 O SER A 151 -28.586 -6.585 -8.897 1.00 0.00 O ATOM 1321 CB SER A 151 -27.385 -5.960 -11.887 1.00 0.00 C ATOM 1322 OG SER A 151 -27.485 -5.456 -13.207 1.00 0.00 O ATOM 0 H SER A 151 -28.559 -4.172 -10.409 1.00 0.00 H new ATOM 0 HA SER A 151 -29.463 -6.504 -11.967 1.00 0.00 H new ATOM 0 HB2 SER A 151 -26.758 -5.299 -11.288 1.00 0.00 H new ATOM 0 HB3 SER A 151 -26.897 -6.934 -11.902 1.00 0.00 H new ATOM 0 HG SER A 151 -26.589 -5.383 -13.598 1.00 0.00 H new ATOM 1328 N GLY A 152 -28.754 -8.327 -10.311 1.00 0.00 N ATOM 1329 CA GLY A 152 -28.694 -9.310 -9.246 1.00 0.00 C ATOM 1330 C GLY A 152 -27.389 -10.081 -9.241 1.00 0.00 C ATOM 1331 O GLY A 152 -27.239 -11.066 -9.964 1.00 0.00 O ATOM 0 H GLY A 152 -28.843 -8.717 -11.249 1.00 0.00 H new ATOM 0 HA2 GLY A 152 -28.820 -8.809 -8.286 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -29.524 -10.008 -9.353 1.00 0.00 H new TER 1335 GLY A 152 HETATM 1336 ZN ZN A 200 3.067 2.432 -9.027 1.00 0.00 ZN HETATM 1337 ZN ZN A 300 6.545 -11.076 -0.867 1.00 0.00 ZN