USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1136 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 80 TYR OH : rot -159:sc= 0.158 USER MOD Set 1.2: A 137 HIS : no HD1:sc= 0.686 K(o=0.84,f=-4.7!) USER MOD Set 2.1: A 75 THR OG1 : rot 10:sc= 0.833 USER MOD Set 2.2: A 78 THR OG1 : rot 63:sc= 2.47 USER MOD Single : A 4 SER OG : rot -39:sc= 0.103 USER MOD Single : A 5 ASN : amide:sc= 0.953 K(o=0.95,f=-5.3!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 TYR OH : rot 180:sc= 0.2 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0.00445 USER MOD Single : A 26 GLN : amide:sc= -0.0933 X(o=-0.093,f=-0.068) USER MOD Single : A 43 SER OG : rot -152:sc= 1.22 USER MOD Single : A 47 LYS NZ :NH3+ 176:sc= 0.598 (180deg=0.398) USER MOD Single : A 48 GLN : amide:sc= -0.0241 X(o=-0.024,f=-0.077) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot -140:sc= -0.0273 USER MOD Single : A 69 THR OG1 : rot 180:sc=-0.00549 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= 0.0313 X(o=0.031,f=-0.12) USER MOD Single : A 73 HIS : no HD1:sc= -0.302 X(o=-0.3,f=-0.23) USER MOD Single : A 81 GLN : amide:sc= -5.96! K(o=-6!,f=-1.2) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= -0.321 X(o=-0.32,f=-0.25) USER MOD Single : A 88 ASN : amide:sc= -0.0883 K(o=-0.088,f=-3.5!) USER MOD Single : A 96 ASN : amide:sc= -1.41! K(o=-1.4!,f=-0.016) USER MOD Single : A 105 SER OG : rot 10:sc= -0.0367 USER MOD Single : A 111 CYS SG : rot 67:sc= -5.21! USER MOD Single : A 114 SER OG : rot 60:sc= -1.08 USER MOD Single : A 117 LYS NZ :NH3+ 133:sc= 2.44 (180deg=1.16) USER MOD Single : A 119 MET CE :methyl -135:sc= -5.74! (180deg=-8.14!) USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 124 SER OG : rot 180:sc= 0.00165 USER MOD Single : A 130 MET CE :methyl -107:sc= -3.37! (180deg=-5.25!) USER MOD Single : A 132 THR OG1 : rot 87:sc= 1.26 USER MOD Single : A 133 TYR OH : rot 98:sc= -0.846 USER MOD Single : A 135 ASN : amide:sc= 0.52 K(o=0.52,f=0) USER MOD Single : A 143 GLN : amide:sc= 0.186 X(o=0.19,f=-0.065) USER MOD Single : A 145 ASN : amide:sc= 0.983 K(o=0.98,f=-0.0015) USER MOD Single : A 150 THR OG1 : rot -177:sc= 1.23 USER MOD Single : A 157 ASN : amide:sc= 0.328 X(o=0.33,f=-0.11) USER MOD Single : A 158 ASN : amide:sc= -0.0533 K(o=-0.053,f=-1.9!) USER MOD Single : A 163 SER OG : rot 69:sc= 0.704 USER MOD Single : A 165 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 GLN : amide:sc= 0 K(o=0,f=-0.61) USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 4 5.255 -0.348 13.526 1.00 0.88 N ATOM 49 CA SER A 4 3.931 -0.550 12.953 1.00 0.77 C ATOM 50 C SER A 4 3.928 -0.179 11.472 1.00 0.62 C ATOM 51 O SER A 4 3.107 -0.666 10.696 1.00 0.64 O ATOM 52 CB SER A 4 2.886 0.258 13.722 1.00 1.02 C ATOM 53 OG SER A 4 3.232 1.631 13.766 1.00 1.34 O ATOM 0 HA SER A 4 3.672 -1.605 13.038 1.00 0.77 H new ATOM 0 HB2 SER A 4 1.911 0.141 13.249 1.00 1.02 H new ATOM 0 HB3 SER A 4 2.797 -0.130 14.737 1.00 1.02 H new ATOM 0 HG SER A 4 4.199 1.721 13.897 1.00 1.34 H new ATOM 59 N ASN A 5 4.857 0.686 11.076 1.00 0.59 N ATOM 60 CA ASN A 5 5.049 0.990 9.662 1.00 0.55 C ATOM 61 C ASN A 5 5.668 -0.205 8.951 1.00 0.43 C ATOM 62 O ASN A 5 5.451 -0.417 7.758 1.00 0.44 O ATOM 63 CB ASN A 5 5.929 2.233 9.474 1.00 0.65 C ATOM 64 CG ASN A 5 5.153 3.525 9.680 1.00 0.94 C ATOM 65 OD1 ASN A 5 3.945 3.576 9.447 1.00 1.71 O ATOM 66 ND2 ASN A 5 5.838 4.578 10.104 1.00 0.67 N ATOM 0 H ASN A 5 5.483 1.185 11.708 1.00 0.59 H new ATOM 0 HA ASN A 5 4.073 1.201 9.225 1.00 0.55 H new ATOM 0 HB2 ASN A 5 6.762 2.196 10.176 1.00 0.65 H new ATOM 0 HB3 ASN A 5 6.357 2.224 8.472 1.00 0.65 H new ATOM 0 HD21 ASN A 5 5.365 5.470 10.248 1.00 0.67 H new ATOM 0 HD22 ASN A 5 6.838 4.496 10.286 1.00 0.67 H new ATOM 73 N ARG A 6 6.425 -0.998 9.702 1.00 0.41 N ATOM 74 CA ARG A 6 7.035 -2.207 9.172 1.00 0.41 C ATOM 75 C ARG A 6 5.965 -3.256 8.868 1.00 0.37 C ATOM 76 O ARG A 6 6.142 -4.087 7.975 1.00 0.38 O ATOM 77 CB ARG A 6 8.066 -2.753 10.165 1.00 0.54 C ATOM 78 CG ARG A 6 8.765 -4.021 9.700 1.00 0.65 C ATOM 79 CD ARG A 6 9.984 -4.335 10.556 1.00 0.83 C ATOM 80 NE ARG A 6 11.023 -3.313 10.417 1.00 1.50 N ATOM 81 CZ ARG A 6 12.314 -3.586 10.223 1.00 2.14 C ATOM 82 NH1 ARG A 6 12.736 -4.847 10.226 1.00 2.16 N ATOM 83 NH2 ARG A 6 13.189 -2.599 10.048 1.00 3.18 N ATOM 0 H ARG A 6 6.630 -0.821 10.685 1.00 0.41 H new ATOM 0 HA ARG A 6 7.546 -1.965 8.240 1.00 0.41 H new ATOM 0 HB2 ARG A 6 8.816 -1.985 10.352 1.00 0.54 H new ATOM 0 HB3 ARG A 6 7.570 -2.952 11.115 1.00 0.54 H new ATOM 0 HG2 ARG A 6 8.067 -4.857 9.739 1.00 0.65 H new ATOM 0 HG3 ARG A 6 9.070 -3.909 8.659 1.00 0.65 H new ATOM 0 HD2 ARG A 6 9.685 -4.409 11.601 1.00 0.83 H new ATOM 0 HD3 ARG A 6 10.389 -5.306 10.270 1.00 0.83 H new ATOM 0 HE ARG A 6 10.743 -2.334 10.472 1.00 1.50 H new ATOM 0 HH11 ARG A 6 12.072 -5.607 10.377 1.00 2.16 H new ATOM 0 HH12 ARG A 6 13.724 -5.055 10.078 1.00 2.16 H new ATOM 0 HH21 ARG A 6 12.873 -1.629 10.062 1.00 3.18 H new ATOM 0 HH22 ARG A 6 14.175 -2.812 9.900 1.00 3.18 H new ATOM 97 N GLU A 7 4.849 -3.199 9.598 1.00 0.36 N ATOM 98 CA GLU A 7 3.724 -4.103 9.354 1.00 0.37 C ATOM 99 C GLU A 7 3.225 -3.935 7.930 1.00 0.29 C ATOM 100 O GLU A 7 3.020 -4.907 7.206 1.00 0.29 O ATOM 101 CB GLU A 7 2.558 -3.813 10.303 1.00 0.46 C ATOM 102 CG GLU A 7 2.850 -4.033 11.775 1.00 0.60 C ATOM 103 CD GLU A 7 1.634 -3.740 12.628 1.00 1.39 C ATOM 104 OE1 GLU A 7 0.746 -4.611 12.732 1.00 1.58 O ATOM 105 OE2 GLU A 7 1.569 -2.639 13.216 1.00 2.00 O ATOM 0 H GLU A 7 4.701 -2.538 10.361 1.00 0.36 H new ATOM 0 HA GLU A 7 4.080 -5.119 9.522 1.00 0.37 H new ATOM 0 HB2 GLU A 7 2.245 -2.778 10.162 1.00 0.46 H new ATOM 0 HB3 GLU A 7 1.715 -4.442 10.019 1.00 0.46 H new ATOM 0 HG2 GLU A 7 3.169 -5.063 11.934 1.00 0.60 H new ATOM 0 HG3 GLU A 7 3.676 -3.392 12.084 1.00 0.60 H new ATOM 112 N LEU A 8 3.064 -2.681 7.538 1.00 0.27 N ATOM 113 CA LEU A 8 2.492 -2.336 6.248 1.00 0.28 C ATOM 114 C LEU A 8 3.393 -2.811 5.124 1.00 0.28 C ATOM 115 O LEU A 8 2.928 -3.149 4.042 1.00 0.39 O ATOM 116 CB LEU A 8 2.292 -0.827 6.165 1.00 0.31 C ATOM 117 CG LEU A 8 1.505 -0.230 7.325 1.00 0.33 C ATOM 118 CD1 LEU A 8 1.437 1.278 7.197 1.00 0.36 C ATOM 119 CD2 LEU A 8 0.112 -0.833 7.376 1.00 0.35 C ATOM 0 H LEU A 8 3.326 -1.875 8.105 1.00 0.27 H new ATOM 0 HA LEU A 8 1.527 -2.831 6.144 1.00 0.28 H new ATOM 0 HB2 LEU A 8 3.269 -0.346 6.119 1.00 0.31 H new ATOM 0 HB3 LEU A 8 1.777 -0.592 5.234 1.00 0.31 H new ATOM 0 HG LEU A 8 2.017 -0.467 8.258 1.00 0.33 H new ATOM 0 HD11 LEU A 8 0.871 1.689 8.033 1.00 0.36 H new ATOM 0 HD12 LEU A 8 2.446 1.690 7.204 1.00 0.36 H new ATOM 0 HD13 LEU A 8 0.944 1.542 6.261 1.00 0.36 H new ATOM 0 HD21 LEU A 8 -0.442 -0.399 8.209 1.00 0.35 H new ATOM 0 HD22 LEU A 8 -0.411 -0.621 6.443 1.00 0.35 H new ATOM 0 HD23 LEU A 8 0.187 -1.912 7.513 1.00 0.35 H new ATOM 131 N VAL A 9 4.684 -2.829 5.397 1.00 0.26 N ATOM 132 CA VAL A 9 5.653 -3.348 4.454 1.00 0.28 C ATOM 133 C VAL A 9 5.553 -4.867 4.383 1.00 0.29 C ATOM 134 O VAL A 9 5.120 -5.418 3.375 1.00 0.31 O ATOM 135 CB VAL A 9 7.081 -2.947 4.858 1.00 0.32 C ATOM 136 CG1 VAL A 9 8.095 -3.552 3.902 1.00 0.38 C ATOM 137 CG2 VAL A 9 7.215 -1.435 4.899 1.00 0.31 C ATOM 0 H VAL A 9 5.086 -2.488 6.270 1.00 0.26 H new ATOM 0 HA VAL A 9 5.434 -2.922 3.475 1.00 0.28 H new ATOM 0 HB VAL A 9 7.281 -3.336 5.857 1.00 0.32 H new ATOM 0 HG11 VAL A 9 9.100 -3.257 4.204 1.00 0.38 H new ATOM 0 HG12 VAL A 9 8.013 -4.639 3.925 1.00 0.38 H new ATOM 0 HG13 VAL A 9 7.900 -3.195 2.891 1.00 0.38 H new ATOM 0 HG21 VAL A 9 8.232 -1.168 5.187 1.00 0.31 H new ATOM 0 HG22 VAL A 9 6.997 -1.024 3.914 1.00 0.31 H new ATOM 0 HG23 VAL A 9 6.513 -1.027 5.626 1.00 0.31 H new ATOM 147 N VAL A 10 5.929 -5.527 5.475 1.00 0.30 N ATOM 148 CA VAL A 10 5.992 -6.984 5.532 1.00 0.32 C ATOM 149 C VAL A 10 4.685 -7.632 5.089 1.00 0.35 C ATOM 150 O VAL A 10 4.685 -8.523 4.238 1.00 0.36 O ATOM 151 CB VAL A 10 6.338 -7.459 6.958 1.00 0.37 C ATOM 152 CG1 VAL A 10 6.231 -8.973 7.073 1.00 0.42 C ATOM 153 CG2 VAL A 10 7.733 -6.993 7.343 1.00 0.38 C ATOM 0 H VAL A 10 6.198 -5.067 6.345 1.00 0.30 H new ATOM 0 HA VAL A 10 6.777 -7.292 4.841 1.00 0.32 H new ATOM 0 HB VAL A 10 5.617 -7.019 7.647 1.00 0.37 H new ATOM 0 HG11 VAL A 10 6.480 -9.279 8.089 1.00 0.42 H new ATOM 0 HG12 VAL A 10 5.213 -9.285 6.840 1.00 0.42 H new ATOM 0 HG13 VAL A 10 6.923 -9.441 6.373 1.00 0.42 H new ATOM 0 HG21 VAL A 10 7.965 -7.335 8.352 1.00 0.38 H new ATOM 0 HG22 VAL A 10 8.460 -7.405 6.644 1.00 0.38 H new ATOM 0 HG23 VAL A 10 7.775 -5.904 7.310 1.00 0.38 H new ATOM 163 N ASP A 11 3.576 -7.175 5.655 1.00 0.39 N ATOM 164 CA ASP A 11 2.282 -7.790 5.386 1.00 0.46 C ATOM 165 C ASP A 11 1.894 -7.608 3.923 1.00 0.44 C ATOM 166 O ASP A 11 1.236 -8.466 3.335 1.00 0.50 O ATOM 167 CB ASP A 11 1.199 -7.196 6.290 1.00 0.55 C ATOM 168 CG ASP A 11 0.095 -8.188 6.581 1.00 0.71 C ATOM 169 OD1 ASP A 11 -0.769 -8.404 5.712 1.00 0.84 O ATOM 170 OD2 ASP A 11 0.087 -8.761 7.690 1.00 0.92 O ATOM 0 H ASP A 11 3.545 -6.385 6.300 1.00 0.39 H new ATOM 0 HA ASP A 11 2.367 -8.856 5.598 1.00 0.46 H new ATOM 0 HB2 ASP A 11 1.649 -6.869 7.228 1.00 0.55 H new ATOM 0 HB3 ASP A 11 0.775 -6.311 5.814 1.00 0.55 H new ATOM 175 N PHE A 12 2.326 -6.499 3.332 1.00 0.41 N ATOM 176 CA PHE A 12 2.015 -6.208 1.938 1.00 0.42 C ATOM 177 C PHE A 12 2.918 -7.023 1.020 1.00 0.37 C ATOM 178 O PHE A 12 2.480 -7.507 -0.024 1.00 0.41 O ATOM 179 CB PHE A 12 2.173 -4.710 1.638 1.00 0.44 C ATOM 180 CG PHE A 12 1.470 -4.260 0.387 1.00 0.48 C ATOM 181 CD1 PHE A 12 2.110 -4.327 -0.841 1.00 0.46 C ATOM 182 CD2 PHE A 12 0.173 -3.768 0.435 1.00 0.62 C ATOM 183 CE1 PHE A 12 1.473 -3.915 -1.995 1.00 0.51 C ATOM 184 CE2 PHE A 12 -0.469 -3.354 -0.718 1.00 0.68 C ATOM 185 CZ PHE A 12 0.156 -3.427 -1.919 1.00 0.60 C ATOM 0 H PHE A 12 2.892 -5.788 3.796 1.00 0.41 H new ATOM 0 HA PHE A 12 0.976 -6.483 1.757 1.00 0.42 H new ATOM 0 HB2 PHE A 12 1.790 -4.138 2.483 1.00 0.44 H new ATOM 0 HB3 PHE A 12 3.234 -4.477 1.550 1.00 0.44 H new ATOM 0 HD1 PHE A 12 3.120 -4.706 -0.896 1.00 0.46 H new ATOM 0 HD2 PHE A 12 -0.341 -3.708 1.383 1.00 0.62 H new ATOM 0 HE1 PHE A 12 1.981 -3.967 -2.947 1.00 0.51 H new ATOM 0 HE2 PHE A 12 -1.477 -2.969 -0.661 1.00 0.68 H new ATOM 0 HZ PHE A 12 -0.356 -3.111 -2.816 1.00 0.60 H new ATOM 195 N LEU A 13 4.180 -7.181 1.415 1.00 0.33 N ATOM 196 CA LEU A 13 5.117 -7.988 0.648 1.00 0.32 C ATOM 197 C LEU A 13 4.644 -9.435 0.638 1.00 0.33 C ATOM 198 O LEU A 13 4.623 -10.091 -0.405 1.00 0.35 O ATOM 199 CB LEU A 13 6.527 -7.901 1.239 1.00 0.32 C ATOM 200 CG LEU A 13 7.054 -6.484 1.474 1.00 0.34 C ATOM 201 CD1 LEU A 13 8.506 -6.520 1.912 1.00 0.40 C ATOM 202 CD2 LEU A 13 6.894 -5.626 0.229 1.00 0.38 C ATOM 0 H LEU A 13 4.572 -6.762 2.258 1.00 0.33 H new ATOM 0 HA LEU A 13 5.155 -7.606 -0.372 1.00 0.32 H new ATOM 0 HB2 LEU A 13 6.538 -8.437 2.188 1.00 0.32 H new ATOM 0 HB3 LEU A 13 7.215 -8.420 0.572 1.00 0.32 H new ATOM 0 HG LEU A 13 6.462 -6.034 2.271 1.00 0.34 H new ATOM 0 HD11 LEU A 13 8.862 -5.503 2.074 1.00 0.40 H new ATOM 0 HD12 LEU A 13 8.592 -7.087 2.839 1.00 0.40 H new ATOM 0 HD13 LEU A 13 9.108 -6.996 1.138 1.00 0.40 H new ATOM 0 HD21 LEU A 13 7.277 -4.625 0.426 1.00 0.38 H new ATOM 0 HD22 LEU A 13 7.451 -6.072 -0.595 1.00 0.38 H new ATOM 0 HD23 LEU A 13 5.839 -5.565 -0.038 1.00 0.38 H new ATOM 214 N SER A 14 4.236 -9.906 1.811 1.00 0.34 N ATOM 215 CA SER A 14 3.666 -11.238 1.954 1.00 0.38 C ATOM 216 C SER A 14 2.391 -11.357 1.120 1.00 0.39 C ATOM 217 O SER A 14 2.131 -12.388 0.502 1.00 0.41 O ATOM 218 CB SER A 14 3.370 -11.523 3.435 1.00 0.45 C ATOM 219 OG SER A 14 2.709 -12.763 3.609 1.00 1.14 O ATOM 0 H SER A 14 4.291 -9.379 2.683 1.00 0.34 H new ATOM 0 HA SER A 14 4.384 -11.974 1.593 1.00 0.38 H new ATOM 0 HB2 SER A 14 4.303 -11.526 3.998 1.00 0.45 H new ATOM 0 HB3 SER A 14 2.754 -10.722 3.843 1.00 0.45 H new ATOM 0 HG SER A 14 2.538 -12.912 4.562 1.00 1.14 H new ATOM 225 N TYR A 15 1.626 -10.274 1.083 1.00 0.42 N ATOM 226 CA TYR A 15 0.360 -10.232 0.362 1.00 0.47 C ATOM 227 C TYR A 15 0.587 -10.353 -1.144 1.00 0.45 C ATOM 228 O TYR A 15 -0.174 -11.021 -1.845 1.00 0.52 O ATOM 229 CB TYR A 15 -0.374 -8.927 0.703 1.00 0.55 C ATOM 230 CG TYR A 15 -1.674 -8.709 -0.037 1.00 0.66 C ATOM 231 CD1 TYR A 15 -2.719 -9.617 0.087 1.00 0.79 C ATOM 232 CD2 TYR A 15 -1.858 -7.608 -0.865 1.00 0.78 C ATOM 233 CE1 TYR A 15 -3.904 -9.437 -0.592 1.00 0.96 C ATOM 234 CE2 TYR A 15 -3.046 -7.420 -1.545 1.00 0.94 C ATOM 235 CZ TYR A 15 -4.065 -8.276 -1.386 1.00 1.02 C ATOM 236 OH TYR A 15 -5.247 -8.163 -2.088 1.00 1.20 O ATOM 0 H TYR A 15 1.865 -9.400 1.552 1.00 0.42 H new ATOM 0 HA TYR A 15 -0.255 -11.078 0.669 1.00 0.47 H new ATOM 0 HB2 TYR A 15 -0.577 -8.912 1.774 1.00 0.55 H new ATOM 0 HB3 TYR A 15 0.291 -8.089 0.493 1.00 0.55 H new ATOM 0 HD1 TYR A 15 -2.600 -10.479 0.727 1.00 0.79 H new ATOM 0 HD2 TYR A 15 -1.060 -6.889 -0.979 1.00 0.78 H new ATOM 0 HE1 TYR A 15 -4.696 -10.168 -0.520 1.00 0.96 H new ATOM 0 HE2 TYR A 15 -3.154 -6.576 -2.210 1.00 0.94 H new ATOM 0 HH TYR A 15 -5.246 -7.325 -2.597 1.00 1.20 H new ATOM 246 N LYS A 16 1.650 -9.725 -1.634 1.00 0.40 N ATOM 247 CA LYS A 16 1.955 -9.751 -3.057 1.00 0.41 C ATOM 248 C LYS A 16 2.530 -11.107 -3.458 1.00 0.35 C ATOM 249 O LYS A 16 2.142 -11.677 -4.478 1.00 0.39 O ATOM 250 CB LYS A 16 2.930 -8.627 -3.418 1.00 0.49 C ATOM 251 CG LYS A 16 3.200 -8.509 -4.911 1.00 0.90 C ATOM 252 CD LYS A 16 1.931 -8.200 -5.695 1.00 0.83 C ATOM 253 CE LYS A 16 1.375 -6.825 -5.356 1.00 1.35 C ATOM 254 NZ LYS A 16 0.137 -6.524 -6.122 1.00 1.39 N ATOM 0 H LYS A 16 2.312 -9.194 -1.068 1.00 0.40 H new ATOM 0 HA LYS A 16 1.028 -9.594 -3.609 1.00 0.41 H new ATOM 0 HB2 LYS A 16 2.531 -7.680 -3.054 1.00 0.49 H new ATOM 0 HB3 LYS A 16 3.874 -8.796 -2.899 1.00 0.49 H new ATOM 0 HG2 LYS A 16 3.935 -7.724 -5.086 1.00 0.90 H new ATOM 0 HG3 LYS A 16 3.635 -9.440 -5.276 1.00 0.90 H new ATOM 0 HD2 LYS A 16 2.142 -8.253 -6.763 1.00 0.83 H new ATOM 0 HD3 LYS A 16 1.178 -8.959 -5.481 1.00 0.83 H new ATOM 0 HE2 LYS A 16 1.163 -6.772 -4.288 1.00 1.35 H new ATOM 0 HE3 LYS A 16 2.128 -6.066 -5.570 1.00 1.35 H new ATOM 0 HZ1 LYS A 16 -0.210 -5.579 -5.863 1.00 1.39 H new ATOM 0 HZ2 LYS A 16 0.344 -6.549 -7.141 1.00 1.39 H new ATOM 0 HZ3 LYS A 16 -0.590 -7.233 -5.899 1.00 1.39 H new ATOM 268 N LEU A 17 3.447 -11.622 -2.650 1.00 0.30 N ATOM 269 CA LEU A 17 4.018 -12.941 -2.885 1.00 0.27 C ATOM 270 C LEU A 17 2.941 -14.019 -2.801 1.00 0.31 C ATOM 271 O LEU A 17 2.973 -15.003 -3.541 1.00 0.32 O ATOM 272 CB LEU A 17 5.135 -13.218 -1.877 1.00 0.25 C ATOM 273 CG LEU A 17 6.355 -12.310 -2.015 1.00 0.24 C ATOM 274 CD1 LEU A 17 7.288 -12.497 -0.835 1.00 0.29 C ATOM 275 CD2 LEU A 17 7.082 -12.595 -3.316 1.00 0.25 C ATOM 0 H LEU A 17 3.812 -11.146 -1.825 1.00 0.30 H new ATOM 0 HA LEU A 17 4.440 -12.962 -3.890 1.00 0.27 H new ATOM 0 HB2 LEU A 17 4.732 -13.113 -0.870 1.00 0.25 H new ATOM 0 HB3 LEU A 17 5.455 -14.254 -1.985 1.00 0.25 H new ATOM 0 HG LEU A 17 6.017 -11.274 -2.028 1.00 0.24 H new ATOM 0 HD11 LEU A 17 8.153 -11.843 -0.948 1.00 0.29 H new ATOM 0 HD12 LEU A 17 6.763 -12.248 0.087 1.00 0.29 H new ATOM 0 HD13 LEU A 17 7.620 -13.534 -0.795 1.00 0.29 H new ATOM 0 HD21 LEU A 17 7.949 -11.940 -3.399 1.00 0.25 H new ATOM 0 HD22 LEU A 17 7.410 -13.634 -3.329 1.00 0.25 H new ATOM 0 HD23 LEU A 17 6.410 -12.416 -4.155 1.00 0.25 H new ATOM 287 N SER A 18 1.980 -13.813 -1.908 1.00 0.37 N ATOM 288 CA SER A 18 0.839 -14.714 -1.770 1.00 0.44 C ATOM 289 C SER A 18 0.033 -14.754 -3.069 1.00 0.47 C ATOM 290 O SER A 18 -0.500 -15.796 -3.451 1.00 0.51 O ATOM 291 CB SER A 18 -0.053 -14.266 -0.600 1.00 0.54 C ATOM 292 OG SER A 18 -1.238 -15.042 -0.518 1.00 1.26 O ATOM 0 H SER A 18 1.968 -13.023 -1.263 1.00 0.37 H new ATOM 0 HA SER A 18 1.210 -15.718 -1.562 1.00 0.44 H new ATOM 0 HB2 SER A 18 0.502 -14.350 0.334 1.00 0.54 H new ATOM 0 HB3 SER A 18 -0.314 -13.215 -0.723 1.00 0.54 H new ATOM 0 HG SER A 18 -1.781 -14.732 0.237 1.00 1.26 H new ATOM 298 N GLN A 19 -0.030 -13.619 -3.760 1.00 0.48 N ATOM 299 CA GLN A 19 -0.751 -13.533 -5.021 1.00 0.53 C ATOM 300 C GLN A 19 0.026 -14.266 -6.110 1.00 0.48 C ATOM 301 O GLN A 19 -0.548 -14.802 -7.055 1.00 0.55 O ATOM 302 CB GLN A 19 -0.959 -12.063 -5.407 1.00 0.59 C ATOM 303 CG GLN A 19 -1.874 -11.854 -6.603 1.00 0.71 C ATOM 304 CD GLN A 19 -2.115 -10.384 -6.895 1.00 1.06 C ATOM 305 OE1 GLN A 19 -3.033 -9.777 -6.343 1.00 1.72 O ATOM 306 NE2 GLN A 19 -1.309 -9.800 -7.768 1.00 1.65 N ATOM 0 H GLN A 19 0.411 -12.747 -3.466 1.00 0.48 H new ATOM 0 HA GLN A 19 -1.728 -14.004 -4.910 1.00 0.53 H new ATOM 0 HB2 GLN A 19 -1.372 -11.530 -4.551 1.00 0.59 H new ATOM 0 HB3 GLN A 19 0.011 -11.616 -5.624 1.00 0.59 H new ATOM 0 HG2 GLN A 19 -1.435 -12.329 -7.480 1.00 0.71 H new ATOM 0 HG3 GLN A 19 -2.829 -12.346 -6.418 1.00 0.71 H new ATOM 0 HE21 GLN A 19 -0.559 -10.334 -8.206 1.00 1.65 H new ATOM 0 HE22 GLN A 19 -1.438 -8.816 -8.003 1.00 1.65 H new ATOM 315 N LYS A 20 1.341 -14.301 -5.945 1.00 0.41 N ATOM 316 CA LYS A 20 2.228 -14.967 -6.890 1.00 0.40 C ATOM 317 C LYS A 20 2.373 -16.451 -6.566 1.00 0.44 C ATOM 318 O LYS A 20 3.176 -17.152 -7.182 1.00 0.48 O ATOM 319 CB LYS A 20 3.597 -14.290 -6.876 1.00 0.36 C ATOM 320 CG LYS A 20 3.578 -12.873 -7.421 1.00 0.68 C ATOM 321 CD LYS A 20 3.447 -12.866 -8.937 1.00 0.61 C ATOM 322 CE LYS A 20 3.211 -11.466 -9.478 1.00 1.06 C ATOM 323 NZ LYS A 20 3.174 -11.450 -10.964 1.00 1.87 N ATOM 0 H LYS A 20 1.822 -13.870 -5.155 1.00 0.41 H new ATOM 0 HA LYS A 20 1.790 -14.884 -7.885 1.00 0.40 H new ATOM 0 HB2 LYS A 20 3.974 -14.272 -5.854 1.00 0.36 H new ATOM 0 HB3 LYS A 20 4.295 -14.887 -7.463 1.00 0.36 H new ATOM 0 HG2 LYS A 20 2.747 -12.322 -6.979 1.00 0.68 H new ATOM 0 HG3 LYS A 20 4.493 -12.357 -7.130 1.00 0.68 H new ATOM 0 HD2 LYS A 20 4.352 -13.279 -9.382 1.00 0.61 H new ATOM 0 HD3 LYS A 20 2.622 -13.514 -9.233 1.00 0.61 H new ATOM 0 HE2 LYS A 20 2.271 -11.078 -9.086 1.00 1.06 H new ATOM 0 HE3 LYS A 20 4.001 -10.802 -9.126 1.00 1.06 H new ATOM 0 HZ1 LYS A 20 3.011 -10.478 -11.297 1.00 1.87 H new ATOM 0 HZ2 LYS A 20 4.081 -11.797 -11.338 1.00 1.87 H new ATOM 0 HZ3 LYS A 20 2.404 -12.064 -11.299 1.00 1.87 H new ATOM 337 N GLY A 21 1.604 -16.922 -5.592 1.00 0.48 N ATOM 338 CA GLY A 21 1.617 -18.332 -5.251 1.00 0.54 C ATOM 339 C GLY A 21 2.832 -18.735 -4.436 1.00 0.53 C ATOM 340 O GLY A 21 3.209 -19.909 -4.418 1.00 0.67 O ATOM 0 H GLY A 21 0.971 -16.352 -5.031 1.00 0.48 H new ATOM 0 HA2 GLY A 21 0.714 -18.572 -4.690 1.00 0.54 H new ATOM 0 HA3 GLY A 21 1.589 -18.922 -6.167 1.00 0.54 H new ATOM 344 N TYR A 22 3.455 -17.772 -3.768 1.00 0.43 N ATOM 345 CA TYR A 22 4.603 -18.061 -2.916 1.00 0.42 C ATOM 346 C TYR A 22 4.226 -17.858 -1.453 1.00 0.43 C ATOM 347 O TYR A 22 3.275 -17.138 -1.147 1.00 0.46 O ATOM 348 CB TYR A 22 5.798 -17.165 -3.275 1.00 0.40 C ATOM 349 CG TYR A 22 6.246 -17.278 -4.717 1.00 0.48 C ATOM 350 CD1 TYR A 22 6.181 -18.487 -5.404 1.00 0.65 C ATOM 351 CD2 TYR A 22 6.725 -16.167 -5.394 1.00 0.47 C ATOM 352 CE1 TYR A 22 6.586 -18.578 -6.721 1.00 0.75 C ATOM 353 CE2 TYR A 22 7.128 -16.253 -6.711 1.00 0.57 C ATOM 354 CZ TYR A 22 7.057 -17.459 -7.370 1.00 0.69 C ATOM 355 OH TYR A 22 7.451 -17.543 -8.685 1.00 0.81 O ATOM 0 H TYR A 22 3.187 -16.788 -3.799 1.00 0.43 H new ATOM 0 HA TYR A 22 4.894 -19.099 -3.077 1.00 0.42 H new ATOM 0 HB2 TYR A 22 5.535 -16.128 -3.068 1.00 0.40 H new ATOM 0 HB3 TYR A 22 6.636 -17.418 -2.625 1.00 0.40 H new ATOM 0 HD1 TYR A 22 5.808 -19.366 -4.900 1.00 0.65 H new ATOM 0 HD2 TYR A 22 6.784 -15.218 -4.882 1.00 0.47 H new ATOM 0 HE1 TYR A 22 6.533 -19.524 -7.240 1.00 0.75 H new ATOM 0 HE2 TYR A 22 7.498 -15.377 -7.223 1.00 0.57 H new ATOM 0 HH TYR A 22 7.756 -16.664 -8.992 1.00 0.81 H new ATOM 365 N SER A 23 4.962 -18.496 -0.555 1.00 0.45 N ATOM 366 CA SER A 23 4.686 -18.397 0.868 1.00 0.49 C ATOM 367 C SER A 23 5.751 -17.553 1.565 1.00 0.43 C ATOM 368 O SER A 23 6.947 -17.837 1.458 1.00 0.44 O ATOM 369 CB SER A 23 4.637 -19.797 1.484 1.00 0.59 C ATOM 370 OG SER A 23 3.758 -20.638 0.753 1.00 1.41 O ATOM 0 H SER A 23 5.758 -19.090 -0.789 1.00 0.45 H new ATOM 0 HA SER A 23 3.720 -17.911 1.004 1.00 0.49 H new ATOM 0 HB2 SER A 23 5.637 -20.230 1.494 1.00 0.59 H new ATOM 0 HB3 SER A 23 4.307 -19.732 2.521 1.00 0.59 H new ATOM 0 HG SER A 23 3.742 -21.529 1.162 1.00 1.41 H new ATOM 376 N TRP A 24 5.312 -16.525 2.282 1.00 0.43 N ATOM 377 CA TRP A 24 6.227 -15.640 2.997 1.00 0.41 C ATOM 378 C TRP A 24 7.030 -16.421 4.033 1.00 0.47 C ATOM 379 O TRP A 24 8.225 -16.183 4.216 1.00 0.53 O ATOM 380 CB TRP A 24 5.446 -14.501 3.675 1.00 0.44 C ATOM 381 CG TRP A 24 6.300 -13.606 4.527 1.00 0.46 C ATOM 382 CD1 TRP A 24 6.429 -13.653 5.887 1.00 0.55 C ATOM 383 CD2 TRP A 24 7.143 -12.532 4.083 1.00 0.43 C ATOM 384 NE1 TRP A 24 7.304 -12.686 6.312 1.00 0.57 N ATOM 385 CE2 TRP A 24 7.755 -11.983 5.225 1.00 0.50 C ATOM 386 CE3 TRP A 24 7.445 -11.984 2.831 1.00 0.39 C ATOM 387 CZ2 TRP A 24 8.648 -10.914 5.155 1.00 0.51 C ATOM 388 CZ3 TRP A 24 8.329 -10.922 2.763 1.00 0.43 C ATOM 389 CH2 TRP A 24 8.923 -10.398 3.919 1.00 0.48 C ATOM 0 H TRP A 24 4.327 -16.283 2.384 1.00 0.43 H new ATOM 0 HA TRP A 24 6.922 -15.208 2.277 1.00 0.41 H new ATOM 0 HB2 TRP A 24 4.958 -13.900 2.908 1.00 0.44 H new ATOM 0 HB3 TRP A 24 4.657 -14.931 4.292 1.00 0.44 H new ATOM 0 HD1 TRP A 24 5.916 -14.350 6.533 1.00 0.55 H new ATOM 0 HE1 TRP A 24 7.575 -12.517 7.281 1.00 0.57 H new ATOM 0 HE3 TRP A 24 6.996 -12.383 1.934 1.00 0.39 H new ATOM 0 HZ2 TRP A 24 9.106 -10.508 6.045 1.00 0.51 H new ATOM 0 HZ3 TRP A 24 8.565 -10.489 1.802 1.00 0.43 H new ATOM 0 HH2 TRP A 24 9.611 -9.570 3.832 1.00 0.48 H new ATOM 400 N SER A 25 6.375 -17.377 4.679 1.00 0.54 N ATOM 401 CA SER A 25 7.010 -18.184 5.714 1.00 0.63 C ATOM 402 C SER A 25 8.189 -18.991 5.163 1.00 0.63 C ATOM 403 O SER A 25 9.119 -19.323 5.898 1.00 0.75 O ATOM 404 CB SER A 25 5.975 -19.118 6.343 1.00 0.75 C ATOM 405 OG SER A 25 5.224 -19.787 5.339 1.00 1.20 O ATOM 0 H SER A 25 5.399 -17.614 4.503 1.00 0.54 H new ATOM 0 HA SER A 25 7.405 -17.510 6.474 1.00 0.63 H new ATOM 0 HB2 SER A 25 6.476 -19.850 6.977 1.00 0.75 H new ATOM 0 HB3 SER A 25 5.305 -18.546 6.985 1.00 0.75 H new ATOM 0 HG SER A 25 4.569 -20.381 5.762 1.00 1.20 H new ATOM 411 N GLN A 26 8.159 -19.286 3.869 1.00 0.61 N ATOM 412 CA GLN A 26 9.187 -20.113 3.255 1.00 0.73 C ATOM 413 C GLN A 26 10.458 -19.306 2.995 1.00 0.79 C ATOM 414 O GLN A 26 11.567 -19.831 3.102 1.00 0.93 O ATOM 415 CB GLN A 26 8.669 -20.726 1.945 1.00 0.80 C ATOM 416 CG GLN A 26 9.630 -21.727 1.311 1.00 1.25 C ATOM 417 CD GLN A 26 9.919 -22.905 2.221 1.00 1.53 C ATOM 418 OE1 GLN A 26 10.855 -22.874 3.020 1.00 1.91 O ATOM 419 NE2 GLN A 26 9.119 -23.951 2.106 1.00 2.26 N ATOM 0 H GLN A 26 7.435 -18.965 3.227 1.00 0.61 H new ATOM 0 HA GLN A 26 9.431 -20.918 3.948 1.00 0.73 H new ATOM 0 HB2 GLN A 26 7.718 -21.222 2.138 1.00 0.80 H new ATOM 0 HB3 GLN A 26 8.472 -19.925 1.233 1.00 0.80 H new ATOM 0 HG2 GLN A 26 9.207 -22.090 0.374 1.00 1.25 H new ATOM 0 HG3 GLN A 26 10.565 -21.223 1.065 1.00 1.25 H new ATOM 0 HE21 GLN A 26 8.354 -23.936 1.431 1.00 2.26 H new ATOM 0 HE22 GLN A 26 9.266 -24.773 2.692 1.00 2.26 H new ATOM 644 N GLU A 42 -4.449 0.708 14.031 1.00 1.02 N ATOM 645 CA GLU A 42 -4.554 1.566 12.857 1.00 0.87 C ATOM 646 C GLU A 42 -3.847 0.936 11.660 1.00 0.73 C ATOM 647 O GLU A 42 -4.117 1.289 10.512 1.00 0.63 O ATOM 648 CB GLU A 42 -3.959 2.951 13.138 1.00 1.05 C ATOM 649 CG GLU A 42 -2.437 2.981 13.129 1.00 1.53 C ATOM 650 CD GLU A 42 -1.879 4.372 13.322 1.00 2.12 C ATOM 651 OE1 GLU A 42 -2.169 5.258 12.490 1.00 2.42 O ATOM 652 OE2 GLU A 42 -1.141 4.589 14.305 1.00 2.82 O ATOM 0 HA GLU A 42 -5.613 1.678 12.623 1.00 0.87 H new ATOM 0 HB2 GLU A 42 -4.331 3.654 12.392 1.00 1.05 H new ATOM 0 HB3 GLU A 42 -4.314 3.298 14.108 1.00 1.05 H new ATOM 0 HG2 GLU A 42 -2.060 2.330 13.918 1.00 1.53 H new ATOM 0 HG3 GLU A 42 -2.075 2.577 12.183 1.00 1.53 H new ATOM 659 N SER A 43 -2.948 -0.005 11.934 1.00 0.79 N ATOM 660 CA SER A 43 -2.153 -0.639 10.888 1.00 0.75 C ATOM 661 C SER A 43 -3.041 -1.397 9.907 1.00 0.67 C ATOM 662 O SER A 43 -2.771 -1.421 8.709 1.00 0.62 O ATOM 663 CB SER A 43 -1.124 -1.587 11.501 1.00 0.94 C ATOM 664 OG SER A 43 -0.369 -0.938 12.514 1.00 1.14 O ATOM 0 H SER A 43 -2.752 -0.346 12.875 1.00 0.79 H new ATOM 0 HA SER A 43 -1.631 0.147 10.342 1.00 0.75 H new ATOM 0 HB2 SER A 43 -1.631 -2.456 11.921 1.00 0.94 H new ATOM 0 HB3 SER A 43 -0.454 -1.954 10.723 1.00 0.94 H new ATOM 0 HG SER A 43 0.520 -1.347 12.572 1.00 1.14 H new ATOM 670 N GLU A 44 -4.113 -1.989 10.414 1.00 0.72 N ATOM 671 CA GLU A 44 -5.023 -2.759 9.574 1.00 0.73 C ATOM 672 C GLU A 44 -5.849 -1.835 8.680 1.00 0.61 C ATOM 673 O GLU A 44 -6.339 -2.248 7.628 1.00 0.66 O ATOM 674 CB GLU A 44 -5.942 -3.628 10.433 1.00 0.85 C ATOM 675 CG GLU A 44 -5.210 -4.694 11.237 1.00 1.32 C ATOM 676 CD GLU A 44 -4.471 -5.686 10.362 1.00 1.96 C ATOM 677 OE1 GLU A 44 -5.138 -6.512 9.702 1.00 1.90 O ATOM 678 OE2 GLU A 44 -3.223 -5.654 10.334 1.00 2.98 O ATOM 0 H GLU A 44 -4.375 -1.952 11.399 1.00 0.72 H new ATOM 0 HA GLU A 44 -4.426 -3.410 8.936 1.00 0.73 H new ATOM 0 HB2 GLU A 44 -6.496 -2.987 11.118 1.00 0.85 H new ATOM 0 HB3 GLU A 44 -6.675 -4.113 9.788 1.00 0.85 H new ATOM 0 HG2 GLU A 44 -4.501 -4.212 11.910 1.00 1.32 H new ATOM 0 HG3 GLU A 44 -5.927 -5.229 11.859 1.00 1.32 H new ATOM 685 N ALA A 45 -5.975 -0.579 9.090 1.00 0.53 N ATOM 686 CA ALA A 45 -6.738 0.398 8.332 1.00 0.45 C ATOM 687 C ALA A 45 -5.946 0.856 7.119 1.00 0.39 C ATOM 688 O ALA A 45 -6.435 0.811 5.991 1.00 0.39 O ATOM 689 CB ALA A 45 -7.097 1.583 9.210 1.00 0.48 C ATOM 0 H ALA A 45 -5.556 -0.215 9.946 1.00 0.53 H new ATOM 0 HA ALA A 45 -7.661 -0.069 7.988 1.00 0.45 H new ATOM 0 HB1 ALA A 45 -7.668 2.307 8.629 1.00 0.48 H new ATOM 0 HB2 ALA A 45 -7.696 1.242 10.054 1.00 0.48 H new ATOM 0 HB3 ALA A 45 -6.185 2.053 9.578 1.00 0.48 H new ATOM 695 N VAL A 46 -4.715 1.287 7.357 1.00 0.36 N ATOM 696 CA VAL A 46 -3.828 1.687 6.277 1.00 0.32 C ATOM 697 C VAL A 46 -3.514 0.496 5.378 1.00 0.34 C ATOM 698 O VAL A 46 -3.378 0.638 4.163 1.00 0.35 O ATOM 699 CB VAL A 46 -2.528 2.331 6.811 1.00 0.33 C ATOM 700 CG1 VAL A 46 -2.100 1.703 8.123 1.00 0.34 C ATOM 701 CG2 VAL A 46 -1.417 2.213 5.786 1.00 0.34 C ATOM 0 H VAL A 46 -4.309 1.368 8.289 1.00 0.36 H new ATOM 0 HA VAL A 46 -4.345 2.444 5.687 1.00 0.32 H new ATOM 0 HB VAL A 46 -2.730 3.387 6.992 1.00 0.33 H new ATOM 0 HG11 VAL A 46 -1.183 2.178 8.472 1.00 0.34 H new ATOM 0 HG12 VAL A 46 -2.885 1.841 8.866 1.00 0.34 H new ATOM 0 HG13 VAL A 46 -1.923 0.638 7.976 1.00 0.34 H new ATOM 0 HG21 VAL A 46 -0.509 2.672 6.179 1.00 0.34 H new ATOM 0 HG22 VAL A 46 -1.229 1.161 5.573 1.00 0.34 H new ATOM 0 HG23 VAL A 46 -1.713 2.722 4.869 1.00 0.34 H new ATOM 711 N LYS A 47 -3.416 -0.677 5.987 1.00 0.41 N ATOM 712 CA LYS A 47 -3.279 -1.926 5.248 1.00 0.50 C ATOM 713 C LYS A 47 -4.351 -2.030 4.164 1.00 0.51 C ATOM 714 O LYS A 47 -4.052 -2.328 3.008 1.00 0.59 O ATOM 715 CB LYS A 47 -3.389 -3.116 6.209 1.00 0.63 C ATOM 716 CG LYS A 47 -3.512 -4.460 5.516 1.00 0.84 C ATOM 717 CD LYS A 47 -2.248 -4.828 4.763 1.00 1.45 C ATOM 718 CE LYS A 47 -2.449 -6.110 3.980 1.00 1.93 C ATOM 719 NZ LYS A 47 -2.884 -7.231 4.854 1.00 2.14 N ATOM 0 H LYS A 47 -3.429 -0.791 7.001 1.00 0.41 H new ATOM 0 HA LYS A 47 -2.300 -1.940 4.769 1.00 0.50 H new ATOM 0 HB2 LYS A 47 -2.511 -3.131 6.855 1.00 0.63 H new ATOM 0 HB3 LYS A 47 -4.256 -2.970 6.853 1.00 0.63 H new ATOM 0 HG2 LYS A 47 -3.731 -5.230 6.255 1.00 0.84 H new ATOM 0 HG3 LYS A 47 -4.353 -4.435 4.823 1.00 0.84 H new ATOM 0 HD2 LYS A 47 -1.974 -4.020 4.085 1.00 1.45 H new ATOM 0 HD3 LYS A 47 -1.422 -4.949 5.464 1.00 1.45 H new ATOM 0 HE2 LYS A 47 -3.194 -5.947 3.201 1.00 1.93 H new ATOM 0 HE3 LYS A 47 -1.519 -6.380 3.480 1.00 1.93 H new ATOM 0 HZ1 LYS A 47 -3.076 -8.071 4.272 1.00 2.14 H new ATOM 0 HZ2 LYS A 47 -2.132 -7.449 5.539 1.00 2.14 H new ATOM 0 HZ3 LYS A 47 -3.749 -6.958 5.364 1.00 2.14 H new ATOM 733 N GLN A 48 -5.595 -1.761 4.544 1.00 0.47 N ATOM 734 CA GLN A 48 -6.706 -1.809 3.603 1.00 0.52 C ATOM 735 C GLN A 48 -6.619 -0.631 2.642 1.00 0.48 C ATOM 736 O GLN A 48 -6.879 -0.767 1.445 1.00 0.54 O ATOM 737 CB GLN A 48 -8.044 -1.784 4.349 1.00 0.55 C ATOM 738 CG GLN A 48 -9.260 -1.879 3.436 1.00 0.85 C ATOM 739 CD GLN A 48 -9.353 -3.205 2.703 1.00 1.50 C ATOM 740 OE1 GLN A 48 -8.807 -3.369 1.609 1.00 2.23 O ATOM 741 NE2 GLN A 48 -10.056 -4.158 3.293 1.00 2.02 N ATOM 0 H GLN A 48 -5.859 -1.508 5.496 1.00 0.47 H new ATOM 0 HA GLN A 48 -6.646 -2.738 3.036 1.00 0.52 H new ATOM 0 HB2 GLN A 48 -8.069 -2.611 5.059 1.00 0.55 H new ATOM 0 HB3 GLN A 48 -8.108 -0.864 4.929 1.00 0.55 H new ATOM 0 HG2 GLN A 48 -10.164 -1.734 4.028 1.00 0.85 H new ATOM 0 HG3 GLN A 48 -9.223 -1.070 2.707 1.00 0.85 H new ATOM 0 HE21 GLN A 48 -10.493 -3.984 4.198 1.00 2.02 H new ATOM 0 HE22 GLN A 48 -10.161 -5.067 2.843 1.00 2.02 H new ATOM 750 N ALA A 49 -6.221 0.519 3.180 1.00 0.42 N ATOM 751 CA ALA A 49 -6.080 1.734 2.399 1.00 0.40 C ATOM 752 C ALA A 49 -5.145 1.518 1.215 1.00 0.39 C ATOM 753 O ALA A 49 -5.476 1.870 0.086 1.00 0.42 O ATOM 754 CB ALA A 49 -5.569 2.861 3.280 1.00 0.36 C ATOM 0 H ALA A 49 -5.989 0.630 4.167 1.00 0.42 H new ATOM 0 HA ALA A 49 -7.060 2.006 2.007 1.00 0.40 H new ATOM 0 HB1 ALA A 49 -5.466 3.769 2.686 1.00 0.36 H new ATOM 0 HB2 ALA A 49 -6.275 3.037 4.092 1.00 0.36 H new ATOM 0 HB3 ALA A 49 -4.599 2.587 3.695 1.00 0.36 H new ATOM 760 N LEU A 50 -3.987 0.917 1.477 1.00 0.38 N ATOM 761 CA LEU A 50 -3.004 0.659 0.425 1.00 0.39 C ATOM 762 C LEU A 50 -3.514 -0.368 -0.579 1.00 0.46 C ATOM 763 O LEU A 50 -3.225 -0.276 -1.769 1.00 0.49 O ATOM 764 CB LEU A 50 -1.665 0.186 1.006 1.00 0.39 C ATOM 765 CG LEU A 50 -0.642 1.290 1.298 1.00 0.33 C ATOM 766 CD1 LEU A 50 -0.347 2.099 0.044 1.00 0.31 C ATOM 767 CD2 LEU A 50 -1.123 2.197 2.414 1.00 0.29 C ATOM 0 H LEU A 50 -3.706 0.600 2.405 1.00 0.38 H new ATOM 0 HA LEU A 50 -2.847 1.606 -0.091 1.00 0.39 H new ATOM 0 HB2 LEU A 50 -1.862 -0.356 1.931 1.00 0.39 H new ATOM 0 HB3 LEU A 50 -1.218 -0.524 0.310 1.00 0.39 H new ATOM 0 HG LEU A 50 0.281 0.811 1.624 1.00 0.33 H new ATOM 0 HD11 LEU A 50 0.381 2.876 0.275 1.00 0.31 H new ATOM 0 HD12 LEU A 50 0.056 1.442 -0.726 1.00 0.31 H new ATOM 0 HD13 LEU A 50 -1.267 2.559 -0.317 1.00 0.31 H new ATOM 0 HD21 LEU A 50 -0.378 2.971 2.600 1.00 0.29 H new ATOM 0 HD22 LEU A 50 -2.065 2.662 2.124 1.00 0.29 H new ATOM 0 HD23 LEU A 50 -1.272 1.611 3.321 1.00 0.29 H new ATOM 779 N ARG A 51 -4.283 -1.338 -0.102 1.00 0.52 N ATOM 780 CA ARG A 51 -4.803 -2.387 -0.973 1.00 0.61 C ATOM 781 C ARG A 51 -5.765 -1.810 -2.001 1.00 0.62 C ATOM 782 O ARG A 51 -5.685 -2.130 -3.191 1.00 0.69 O ATOM 783 CB ARG A 51 -5.498 -3.479 -0.162 1.00 0.67 C ATOM 784 CG ARG A 51 -4.548 -4.312 0.683 1.00 0.98 C ATOM 785 CD ARG A 51 -5.283 -5.429 1.404 1.00 1.49 C ATOM 786 NE ARG A 51 -5.936 -6.340 0.467 1.00 2.00 N ATOM 787 CZ ARG A 51 -7.170 -6.814 0.625 1.00 2.89 C ATOM 788 NH1 ARG A 51 -7.874 -6.505 1.709 1.00 3.39 N ATOM 789 NH2 ARG A 51 -7.692 -7.608 -0.298 1.00 3.74 N ATOM 0 H ARG A 51 -4.560 -1.422 0.876 1.00 0.52 H new ATOM 0 HA ARG A 51 -3.956 -2.831 -1.497 1.00 0.61 H new ATOM 0 HB2 ARG A 51 -6.240 -3.018 0.490 1.00 0.67 H new ATOM 0 HB3 ARG A 51 -6.037 -4.138 -0.843 1.00 0.67 H new ATOM 0 HG2 ARG A 51 -3.771 -4.737 0.048 1.00 0.98 H new ATOM 0 HG3 ARG A 51 -4.050 -3.672 1.412 1.00 0.98 H new ATOM 0 HD2 ARG A 51 -4.580 -5.986 2.023 1.00 1.49 H new ATOM 0 HD3 ARG A 51 -6.028 -5.001 2.074 1.00 1.49 H new ATOM 0 HE ARG A 51 -5.414 -6.631 -0.360 1.00 2.00 H new ATOM 0 HH11 ARG A 51 -7.469 -5.902 2.425 1.00 3.39 H new ATOM 0 HH12 ARG A 51 -8.819 -6.871 1.825 1.00 3.39 H new ATOM 0 HH21 ARG A 51 -7.149 -7.854 -1.126 1.00 3.74 H new ATOM 0 HH22 ARG A 51 -8.637 -7.973 -0.181 1.00 3.74 H new ATOM 803 N GLU A 52 -6.666 -0.949 -1.546 1.00 0.59 N ATOM 804 CA GLU A 52 -7.621 -0.316 -2.445 1.00 0.62 C ATOM 805 C GLU A 52 -6.958 0.810 -3.230 1.00 0.59 C ATOM 806 O GLU A 52 -7.378 1.135 -4.342 1.00 0.65 O ATOM 807 CB GLU A 52 -8.830 0.208 -1.676 1.00 0.66 C ATOM 808 CG GLU A 52 -9.676 -0.896 -1.063 1.00 0.92 C ATOM 809 CD GLU A 52 -11.034 -0.406 -0.617 1.00 1.23 C ATOM 810 OE1 GLU A 52 -11.866 -0.070 -1.491 1.00 1.45 O ATOM 811 OE2 GLU A 52 -11.284 -0.362 0.601 1.00 1.88 O ATOM 0 H GLU A 52 -6.755 -0.675 -0.568 1.00 0.59 H new ATOM 0 HA GLU A 52 -7.968 -1.070 -3.151 1.00 0.62 H new ATOM 0 HB2 GLU A 52 -8.488 0.876 -0.885 1.00 0.66 H new ATOM 0 HB3 GLU A 52 -9.450 0.801 -2.348 1.00 0.66 H new ATOM 0 HG2 GLU A 52 -9.804 -1.698 -1.791 1.00 0.92 H new ATOM 0 HG3 GLU A 52 -9.149 -1.322 -0.209 1.00 0.92 H new ATOM 818 N ALA A 53 -5.920 1.396 -2.651 1.00 0.52 N ATOM 819 CA ALA A 53 -5.150 2.425 -3.328 1.00 0.49 C ATOM 820 C ALA A 53 -4.396 1.835 -4.510 1.00 0.52 C ATOM 821 O ALA A 53 -4.273 2.469 -5.557 1.00 0.53 O ATOM 822 CB ALA A 53 -4.189 3.082 -2.357 1.00 0.43 C ATOM 0 H ALA A 53 -5.592 1.174 -1.711 1.00 0.52 H new ATOM 0 HA ALA A 53 -5.836 3.183 -3.705 1.00 0.49 H new ATOM 0 HB1 ALA A 53 -3.617 3.852 -2.876 1.00 0.43 H new ATOM 0 HB2 ALA A 53 -4.750 3.536 -1.540 1.00 0.43 H new ATOM 0 HB3 ALA A 53 -3.507 2.332 -1.956 1.00 0.43 H new ATOM 828 N GLY A 54 -3.897 0.617 -4.331 1.00 0.57 N ATOM 829 CA GLY A 54 -3.221 -0.084 -5.407 1.00 0.64 C ATOM 830 C GLY A 54 -4.110 -0.255 -6.621 1.00 0.74 C ATOM 831 O GLY A 54 -3.651 -0.146 -7.757 1.00 0.82 O ATOM 0 H GLY A 54 -3.949 0.100 -3.454 1.00 0.57 H new ATOM 0 HA2 GLY A 54 -2.323 0.466 -5.690 1.00 0.64 H new ATOM 0 HA3 GLY A 54 -2.897 -1.063 -5.054 1.00 0.64 H new ATOM 835 N ASP A 55 -5.394 -0.495 -6.376 1.00 0.79 N ATOM 836 CA ASP A 55 -6.360 -0.659 -7.460 1.00 0.92 C ATOM 837 C ASP A 55 -6.585 0.673 -8.161 1.00 0.88 C ATOM 838 O ASP A 55 -6.751 0.731 -9.380 1.00 0.97 O ATOM 839 CB ASP A 55 -7.693 -1.202 -6.933 1.00 1.04 C ATOM 840 CG ASP A 55 -8.745 -1.312 -8.022 1.00 1.12 C ATOM 841 OD1 ASP A 55 -8.678 -2.260 -8.835 1.00 1.34 O ATOM 842 OD2 ASP A 55 -9.643 -0.444 -8.077 1.00 1.29 O ATOM 0 H ASP A 55 -5.790 -0.580 -5.440 1.00 0.79 H new ATOM 0 HA ASP A 55 -5.955 -1.379 -8.171 1.00 0.92 H new ATOM 0 HB2 ASP A 55 -7.531 -2.184 -6.487 1.00 1.04 H new ATOM 0 HB3 ASP A 55 -8.061 -0.549 -6.141 1.00 1.04 H new ATOM 847 N GLU A 56 -6.569 1.741 -7.375 1.00 0.79 N ATOM 848 CA GLU A 56 -6.738 3.084 -7.902 1.00 0.83 C ATOM 849 C GLU A 56 -5.522 3.487 -8.730 1.00 0.78 C ATOM 850 O GLU A 56 -5.655 3.909 -9.877 1.00 0.85 O ATOM 851 CB GLU A 56 -6.950 4.076 -6.752 1.00 0.83 C ATOM 852 CG GLU A 56 -7.195 5.506 -7.205 1.00 0.94 C ATOM 853 CD GLU A 56 -8.496 5.663 -7.957 1.00 1.27 C ATOM 854 OE1 GLU A 56 -9.563 5.636 -7.315 1.00 1.38 O ATOM 855 OE2 GLU A 56 -8.461 5.824 -9.193 1.00 2.06 O ATOM 0 H GLU A 56 -6.440 1.700 -6.364 1.00 0.79 H new ATOM 0 HA GLU A 56 -7.616 3.099 -8.548 1.00 0.83 H new ATOM 0 HB2 GLU A 56 -7.798 3.745 -6.153 1.00 0.83 H new ATOM 0 HB3 GLU A 56 -6.074 4.056 -6.103 1.00 0.83 H new ATOM 0 HG2 GLU A 56 -7.201 6.163 -6.335 1.00 0.94 H new ATOM 0 HG3 GLU A 56 -6.371 5.828 -7.841 1.00 0.94 H new ATOM 862 N PHE A 57 -4.333 3.313 -8.159 1.00 0.72 N ATOM 863 CA PHE A 57 -3.103 3.731 -8.819 1.00 0.76 C ATOM 864 C PHE A 57 -2.893 2.946 -10.111 1.00 0.82 C ATOM 865 O PHE A 57 -2.553 3.520 -11.144 1.00 0.90 O ATOM 866 CB PHE A 57 -1.891 3.558 -7.892 1.00 0.77 C ATOM 867 CG PHE A 57 -0.632 4.180 -8.435 1.00 0.94 C ATOM 868 CD1 PHE A 57 -0.351 5.517 -8.198 1.00 1.07 C ATOM 869 CD2 PHE A 57 0.263 3.437 -9.192 1.00 1.05 C ATOM 870 CE1 PHE A 57 0.797 6.100 -8.703 1.00 1.26 C ATOM 871 CE2 PHE A 57 1.412 4.014 -9.698 1.00 1.25 C ATOM 872 CZ PHE A 57 1.679 5.346 -9.455 1.00 1.34 C ATOM 0 H PHE A 57 -4.197 2.886 -7.243 1.00 0.72 H new ATOM 0 HA PHE A 57 -3.199 4.789 -9.062 1.00 0.76 H new ATOM 0 HB2 PHE A 57 -2.118 4.001 -6.922 1.00 0.77 H new ATOM 0 HB3 PHE A 57 -1.720 2.495 -7.724 1.00 0.77 H new ATOM 0 HD1 PHE A 57 -1.037 6.110 -7.612 1.00 1.07 H new ATOM 0 HD2 PHE A 57 0.059 2.395 -9.388 1.00 1.05 H new ATOM 0 HE1 PHE A 57 1.004 7.142 -8.510 1.00 1.26 H new ATOM 0 HE2 PHE A 57 2.101 3.423 -10.283 1.00 1.25 H new ATOM 0 HZ PHE A 57 2.576 5.799 -9.852 1.00 1.34 H new ATOM 882 N GLU A 58 -3.132 1.638 -10.064 1.00 0.83 N ATOM 883 CA GLU A 58 -2.922 0.788 -11.233 1.00 0.95 C ATOM 884 C GLU A 58 -3.983 1.071 -12.298 1.00 0.99 C ATOM 885 O GLU A 58 -3.787 0.788 -13.476 1.00 1.08 O ATOM 886 CB GLU A 58 -2.942 -0.698 -10.835 1.00 1.05 C ATOM 887 CG GLU A 58 -2.652 -1.653 -11.989 1.00 1.35 C ATOM 888 CD GLU A 58 -2.572 -3.099 -11.551 1.00 1.27 C ATOM 889 OE1 GLU A 58 -3.630 -3.719 -11.328 1.00 1.61 O ATOM 890 OE2 GLU A 58 -1.449 -3.632 -11.446 1.00 1.45 O ATOM 0 H GLU A 58 -3.469 1.146 -9.236 1.00 0.83 H new ATOM 0 HA GLU A 58 -1.942 1.017 -11.651 1.00 0.95 H new ATOM 0 HB2 GLU A 58 -2.207 -0.863 -10.047 1.00 1.05 H new ATOM 0 HB3 GLU A 58 -3.919 -0.938 -10.415 1.00 1.05 H new ATOM 0 HG2 GLU A 58 -3.432 -1.550 -12.744 1.00 1.35 H new ATOM 0 HG3 GLU A 58 -1.712 -1.369 -12.461 1.00 1.35 H new ATOM 897 N LEU A 59 -5.107 1.630 -11.882 1.00 0.98 N ATOM 898 CA LEU A 59 -6.155 2.011 -12.814 1.00 1.10 C ATOM 899 C LEU A 59 -5.820 3.341 -13.484 1.00 1.10 C ATOM 900 O LEU A 59 -6.288 3.633 -14.586 1.00 1.24 O ATOM 901 CB LEU A 59 -7.496 2.121 -12.087 1.00 1.19 C ATOM 902 CG LEU A 59 -8.699 2.429 -12.978 1.00 1.36 C ATOM 903 CD1 LEU A 59 -8.928 1.300 -13.969 1.00 1.59 C ATOM 904 CD2 LEU A 59 -9.939 2.668 -12.133 1.00 1.56 C ATOM 0 H LEU A 59 -5.317 1.830 -10.904 1.00 0.98 H new ATOM 0 HA LEU A 59 -6.227 1.240 -13.581 1.00 1.10 H new ATOM 0 HB2 LEU A 59 -7.684 1.184 -11.562 1.00 1.19 H new ATOM 0 HB3 LEU A 59 -7.417 2.901 -11.329 1.00 1.19 H new ATOM 0 HG LEU A 59 -8.491 3.339 -13.541 1.00 1.36 H new ATOM 0 HD11 LEU A 59 -9.788 1.535 -14.596 1.00 1.59 H new ATOM 0 HD12 LEU A 59 -8.044 1.181 -14.596 1.00 1.59 H new ATOM 0 HD13 LEU A 59 -9.116 0.373 -13.427 1.00 1.59 H new ATOM 0 HD21 LEU A 59 -10.786 2.886 -12.783 1.00 1.56 H new ATOM 0 HD22 LEU A 59 -10.154 1.777 -11.543 1.00 1.56 H new ATOM 0 HD23 LEU A 59 -9.767 3.513 -11.466 1.00 1.56 H new ATOM 916 N ARG A 60 -4.996 4.139 -12.822 1.00 1.00 N ATOM 917 CA ARG A 60 -4.687 5.479 -13.303 1.00 1.06 C ATOM 918 C ARG A 60 -3.351 5.522 -14.040 1.00 1.00 C ATOM 919 O ARG A 60 -3.256 6.098 -15.121 1.00 1.07 O ATOM 920 CB ARG A 60 -4.685 6.483 -12.140 1.00 1.10 C ATOM 921 CG ARG A 60 -6.018 6.568 -11.405 1.00 1.19 C ATOM 922 CD ARG A 60 -7.160 6.927 -12.344 1.00 1.31 C ATOM 923 NE ARG A 60 -8.467 6.693 -11.737 1.00 1.81 N ATOM 924 CZ ARG A 60 -9.619 7.060 -12.298 1.00 2.26 C ATOM 925 NH1 ARG A 60 -9.612 7.764 -13.423 1.00 2.15 N ATOM 926 NH2 ARG A 60 -10.771 6.738 -11.727 1.00 3.21 N ATOM 0 H ARG A 60 -4.529 3.884 -11.952 1.00 1.00 H new ATOM 0 HA ARG A 60 -5.466 5.758 -14.012 1.00 1.06 H new ATOM 0 HB2 ARG A 60 -3.906 6.203 -11.431 1.00 1.10 H new ATOM 0 HB3 ARG A 60 -4.428 7.470 -12.524 1.00 1.10 H new ATOM 0 HG2 ARG A 60 -6.229 5.613 -10.924 1.00 1.19 H new ATOM 0 HG3 ARG A 60 -5.950 7.315 -10.614 1.00 1.19 H new ATOM 0 HD2 ARG A 60 -7.077 7.975 -12.630 1.00 1.31 H new ATOM 0 HD3 ARG A 60 -7.075 6.339 -13.258 1.00 1.31 H new ATOM 0 HE ARG A 60 -8.500 6.222 -10.833 1.00 1.81 H new ATOM 0 HH11 ARG A 60 -8.726 8.023 -13.857 1.00 2.15 H new ATOM 0 HH12 ARG A 60 -10.493 8.046 -13.854 1.00 2.15 H new ATOM 0 HH21 ARG A 60 -10.778 6.208 -10.856 1.00 3.21 H new ATOM 0 HH22 ARG A 60 -11.651 7.020 -12.159 1.00 3.21 H new ATOM 940 N TYR A 61 -2.323 4.907 -13.467 1.00 0.91 N ATOM 941 CA TYR A 61 -0.985 4.974 -14.041 1.00 0.90 C ATOM 942 C TYR A 61 -0.379 3.579 -14.157 1.00 0.84 C ATOM 943 O TYR A 61 0.715 3.314 -13.655 1.00 0.83 O ATOM 944 CB TYR A 61 -0.082 5.881 -13.192 1.00 0.96 C ATOM 945 CG TYR A 61 -0.655 7.266 -12.972 1.00 1.05 C ATOM 946 CD1 TYR A 61 -0.796 8.158 -14.029 1.00 1.27 C ATOM 947 CD2 TYR A 61 -1.064 7.677 -11.709 1.00 1.04 C ATOM 948 CE1 TYR A 61 -1.332 9.418 -13.833 1.00 1.38 C ATOM 949 CE2 TYR A 61 -1.598 8.936 -11.506 1.00 1.14 C ATOM 950 CZ TYR A 61 -1.731 9.800 -12.571 1.00 1.27 C ATOM 951 OH TYR A 61 -2.273 11.050 -12.376 1.00 1.41 O ATOM 0 H TYR A 61 -2.390 4.359 -12.609 1.00 0.91 H new ATOM 0 HA TYR A 61 -1.062 5.399 -15.042 1.00 0.90 H new ATOM 0 HB2 TYR A 61 0.088 5.409 -12.225 1.00 0.96 H new ATOM 0 HB3 TYR A 61 0.890 5.971 -13.678 1.00 0.96 H new ATOM 0 HD1 TYR A 61 -0.482 7.862 -15.019 1.00 1.27 H new ATOM 0 HD2 TYR A 61 -0.963 7.002 -10.872 1.00 1.04 H new ATOM 0 HE1 TYR A 61 -1.437 10.099 -14.665 1.00 1.38 H new ATOM 0 HE2 TYR A 61 -1.909 9.241 -10.518 1.00 1.14 H new ATOM 0 HH TYR A 61 -2.503 11.163 -11.430 1.00 1.41 H new ATOM 961 N ARG A 62 -1.097 2.692 -14.833 1.00 0.86 N ATOM 962 CA ARG A 62 -0.643 1.320 -15.027 1.00 0.85 C ATOM 963 C ARG A 62 0.585 1.294 -15.927 1.00 0.87 C ATOM 964 O ARG A 62 1.495 0.486 -15.734 1.00 0.85 O ATOM 965 CB ARG A 62 -1.763 0.480 -15.646 1.00 0.95 C ATOM 966 CG ARG A 62 -1.504 -1.020 -15.626 1.00 1.04 C ATOM 967 CD ARG A 62 -2.759 -1.794 -15.999 1.00 1.23 C ATOM 968 NE ARG A 62 -3.899 -1.377 -15.184 1.00 1.73 N ATOM 969 CZ ARG A 62 -5.065 -2.015 -15.132 1.00 2.16 C ATOM 970 NH1 ARG A 62 -5.259 -3.128 -15.826 1.00 2.24 N ATOM 971 NH2 ARG A 62 -6.039 -1.536 -14.369 1.00 3.02 N ATOM 0 H ARG A 62 -2.001 2.899 -15.258 1.00 0.86 H new ATOM 0 HA ARG A 62 -0.377 0.898 -14.058 1.00 0.85 H new ATOM 0 HB2 ARG A 62 -2.692 0.684 -15.113 1.00 0.95 H new ATOM 0 HB3 ARG A 62 -1.912 0.798 -16.678 1.00 0.95 H new ATOM 0 HG2 ARG A 62 -0.702 -1.264 -16.322 1.00 1.04 H new ATOM 0 HG3 ARG A 62 -1.168 -1.322 -14.634 1.00 1.04 H new ATOM 0 HD2 ARG A 62 -2.986 -1.638 -17.054 1.00 1.23 H new ATOM 0 HD3 ARG A 62 -2.584 -2.862 -15.865 1.00 1.23 H new ATOM 0 HE ARG A 62 -3.793 -0.537 -14.615 1.00 1.73 H new ATOM 0 HH11 ARG A 62 -4.510 -3.504 -16.408 1.00 2.24 H new ATOM 0 HH12 ARG A 62 -6.157 -3.609 -15.778 1.00 2.24 H new ATOM 0 HH21 ARG A 62 -5.891 -0.684 -13.828 1.00 3.02 H new ATOM 0 HH22 ARG A 62 -6.936 -2.019 -14.324 1.00 3.02 H new ATOM 985 N ARG A 63 0.609 2.202 -16.893 1.00 0.94 N ATOM 986 CA ARG A 63 1.716 2.297 -17.834 1.00 1.01 C ATOM 987 C ARG A 63 2.982 2.737 -17.105 1.00 0.95 C ATOM 988 O ARG A 63 4.072 2.229 -17.367 1.00 0.99 O ATOM 989 CB ARG A 63 1.367 3.295 -18.945 1.00 1.16 C ATOM 990 CG ARG A 63 2.326 3.291 -20.128 1.00 1.70 C ATOM 991 CD ARG A 63 2.199 2.020 -20.957 1.00 2.14 C ATOM 992 NE ARG A 63 2.986 0.913 -20.416 1.00 2.71 N ATOM 993 CZ ARG A 63 2.547 -0.344 -20.325 1.00 3.58 C ATOM 994 NH1 ARG A 63 1.279 -0.632 -20.592 1.00 3.92 N ATOM 995 NH2 ARG A 63 3.370 -1.307 -19.937 1.00 4.52 N ATOM 0 H ARG A 63 -0.131 2.887 -17.046 1.00 0.94 H new ATOM 0 HA ARG A 63 1.893 1.319 -18.281 1.00 1.01 H new ATOM 0 HB2 ARG A 63 0.363 3.077 -19.308 1.00 1.16 H new ATOM 0 HB3 ARG A 63 1.341 4.298 -18.519 1.00 1.16 H new ATOM 0 HG2 ARG A 63 2.128 4.157 -20.759 1.00 1.70 H new ATOM 0 HG3 ARG A 63 3.350 3.388 -19.766 1.00 1.70 H new ATOM 0 HD2 ARG A 63 1.151 1.726 -21.005 1.00 2.14 H new ATOM 0 HD3 ARG A 63 2.520 2.224 -21.979 1.00 2.14 H new ATOM 0 HE ARG A 63 3.930 1.114 -20.087 1.00 2.71 H new ATOM 0 HH11 ARG A 63 0.635 0.109 -20.868 1.00 3.92 H new ATOM 0 HH12 ARG A 63 0.949 -1.594 -20.521 1.00 3.92 H new ATOM 0 HH21 ARG A 63 4.339 -1.088 -19.708 1.00 4.52 H new ATOM 0 HH22 ARG A 63 3.034 -2.268 -19.868 1.00 4.52 H new ATOM 1009 N ALA A 64 2.819 3.668 -16.170 1.00 0.90 N ATOM 1010 CA ALA A 64 3.937 4.186 -15.399 1.00 0.89 C ATOM 1011 C ALA A 64 4.474 3.132 -14.444 1.00 0.75 C ATOM 1012 O ALA A 64 5.683 2.984 -14.286 1.00 0.73 O ATOM 1013 CB ALA A 64 3.519 5.424 -14.629 1.00 0.94 C ATOM 0 H ALA A 64 1.917 4.079 -15.929 1.00 0.90 H new ATOM 0 HA ALA A 64 4.732 4.454 -16.095 1.00 0.89 H new ATOM 0 HB1 ALA A 64 4.367 5.800 -14.057 1.00 0.94 H new ATOM 0 HB2 ALA A 64 3.184 6.191 -15.327 1.00 0.94 H new ATOM 0 HB3 ALA A 64 2.705 5.172 -13.949 1.00 0.94 H new ATOM 1019 N PHE A 65 3.562 2.396 -13.817 1.00 0.69 N ATOM 1020 CA PHE A 65 3.930 1.361 -12.854 1.00 0.61 C ATOM 1021 C PHE A 65 4.901 0.354 -13.467 1.00 0.59 C ATOM 1022 O PHE A 65 5.960 0.076 -12.904 1.00 0.59 O ATOM 1023 CB PHE A 65 2.676 0.637 -12.339 1.00 0.62 C ATOM 1024 CG PHE A 65 2.973 -0.431 -11.323 1.00 0.59 C ATOM 1025 CD1 PHE A 65 3.382 -0.093 -10.043 1.00 0.60 C ATOM 1026 CD2 PHE A 65 2.853 -1.773 -11.651 1.00 0.64 C ATOM 1027 CE1 PHE A 65 3.661 -1.073 -9.109 1.00 0.64 C ATOM 1028 CE2 PHE A 65 3.133 -2.756 -10.720 1.00 0.68 C ATOM 1029 CZ PHE A 65 3.537 -2.405 -9.448 1.00 0.66 C ATOM 0 H PHE A 65 2.557 2.497 -13.959 1.00 0.69 H new ATOM 0 HA PHE A 65 4.429 1.848 -12.016 1.00 0.61 H new ATOM 0 HB2 PHE A 65 2.000 1.369 -11.898 1.00 0.62 H new ATOM 0 HB3 PHE A 65 2.153 0.188 -13.184 1.00 0.62 H new ATOM 0 HD1 PHE A 65 3.484 0.948 -9.772 1.00 0.60 H new ATOM 0 HD2 PHE A 65 2.537 -2.053 -12.645 1.00 0.64 H new ATOM 0 HE1 PHE A 65 3.976 -0.796 -8.114 1.00 0.64 H new ATOM 0 HE2 PHE A 65 3.036 -3.798 -10.988 1.00 0.68 H new ATOM 0 HZ PHE A 65 3.756 -3.171 -8.719 1.00 0.66 H new ATOM 1039 N SER A 66 4.547 -0.170 -14.633 1.00 0.64 N ATOM 1040 CA SER A 66 5.359 -1.180 -15.294 1.00 0.68 C ATOM 1041 C SER A 66 6.633 -0.575 -15.885 1.00 0.66 C ATOM 1042 O SER A 66 7.615 -1.277 -16.125 1.00 0.68 O ATOM 1043 CB SER A 66 4.533 -1.867 -16.379 1.00 0.83 C ATOM 1044 OG SER A 66 3.800 -0.912 -17.125 1.00 1.20 O ATOM 0 H SER A 66 3.701 0.089 -15.141 1.00 0.64 H new ATOM 0 HA SER A 66 5.666 -1.918 -14.553 1.00 0.68 H new ATOM 0 HB2 SER A 66 5.190 -2.429 -17.043 1.00 0.83 H new ATOM 0 HB3 SER A 66 3.850 -2.584 -15.924 1.00 0.83 H new ATOM 0 HG SER A 66 2.906 -1.263 -17.317 1.00 1.20 H new ATOM 1050 N ASP A 67 6.612 0.730 -16.122 1.00 0.68 N ATOM 1051 CA ASP A 67 7.788 1.426 -16.640 1.00 0.73 C ATOM 1052 C ASP A 67 8.786 1.703 -15.520 1.00 0.65 C ATOM 1053 O ASP A 67 9.993 1.530 -15.693 1.00 0.66 O ATOM 1054 CB ASP A 67 7.394 2.740 -17.321 1.00 0.89 C ATOM 1055 CG ASP A 67 8.595 3.504 -17.843 1.00 1.36 C ATOM 1056 OD1 ASP A 67 9.102 3.157 -18.934 1.00 1.41 O ATOM 1057 OD2 ASP A 67 9.047 4.450 -17.162 1.00 2.06 O ATOM 0 H ASP A 67 5.800 1.327 -15.966 1.00 0.68 H new ATOM 0 HA ASP A 67 8.257 0.778 -17.381 1.00 0.73 H new ATOM 0 HB2 ASP A 67 6.715 2.529 -18.147 1.00 0.89 H new ATOM 0 HB3 ASP A 67 6.850 3.364 -16.612 1.00 0.89 H new ATOM 1062 N LEU A 68 8.278 2.113 -14.366 1.00 0.63 N ATOM 1063 CA LEU A 68 9.127 2.453 -13.235 1.00 0.66 C ATOM 1064 C LEU A 68 9.780 1.209 -12.641 1.00 0.57 C ATOM 1065 O LEU A 68 10.889 1.280 -12.111 1.00 0.63 O ATOM 1066 CB LEU A 68 8.328 3.204 -12.163 1.00 0.75 C ATOM 1067 CG LEU A 68 7.734 4.544 -12.613 1.00 0.81 C ATOM 1068 CD1 LEU A 68 7.087 5.265 -11.441 1.00 1.64 C ATOM 1069 CD2 LEU A 68 8.802 5.417 -13.252 1.00 1.07 C ATOM 0 H LEU A 68 7.279 2.218 -14.189 1.00 0.63 H new ATOM 0 HA LEU A 68 9.919 3.108 -13.599 1.00 0.66 H new ATOM 0 HB2 LEU A 68 7.517 2.562 -11.820 1.00 0.75 H new ATOM 0 HB3 LEU A 68 8.978 3.382 -11.306 1.00 0.75 H new ATOM 0 HG LEU A 68 6.965 4.342 -13.358 1.00 0.81 H new ATOM 0 HD11 LEU A 68 6.672 6.213 -11.782 1.00 1.64 H new ATOM 0 HD12 LEU A 68 6.289 4.647 -11.029 1.00 1.64 H new ATOM 0 HD13 LEU A 68 7.835 5.452 -10.671 1.00 1.64 H new ATOM 0 HD21 LEU A 68 8.360 6.363 -13.564 1.00 1.07 H new ATOM 0 HD22 LEU A 68 9.596 5.608 -12.530 1.00 1.07 H new ATOM 0 HD23 LEU A 68 9.217 4.906 -14.121 1.00 1.07 H new ATOM 1081 N THR A 69 9.110 0.065 -12.750 1.00 0.49 N ATOM 1082 CA THR A 69 9.671 -1.186 -12.255 1.00 0.49 C ATOM 1083 C THR A 69 10.896 -1.596 -13.065 1.00 0.46 C ATOM 1084 O THR A 69 11.734 -2.360 -12.594 1.00 0.51 O ATOM 1085 CB THR A 69 8.640 -2.331 -12.265 1.00 0.51 C ATOM 1086 OG1 THR A 69 7.944 -2.364 -13.518 1.00 0.71 O ATOM 1087 CG2 THR A 69 7.643 -2.174 -11.129 1.00 0.63 C ATOM 0 H THR A 69 8.186 -0.021 -13.173 1.00 0.49 H new ATOM 0 HA THR A 69 9.966 -1.005 -11.221 1.00 0.49 H new ATOM 0 HB THR A 69 9.178 -3.269 -12.128 1.00 0.51 H new ATOM 0 HG1 THR A 69 7.293 -3.097 -13.512 1.00 0.71 H new ATOM 0 HG21 THR A 69 6.926 -2.995 -11.158 1.00 0.63 H new ATOM 0 HG22 THR A 69 8.172 -2.188 -10.176 1.00 0.63 H new ATOM 0 HG23 THR A 69 7.115 -1.227 -11.237 1.00 0.63 H new ATOM 1095 N SER A 70 11.012 -1.064 -14.276 1.00 0.46 N ATOM 1096 CA SER A 70 12.163 -1.343 -15.116 1.00 0.49 C ATOM 1097 C SER A 70 13.391 -0.619 -14.570 1.00 0.48 C ATOM 1098 O SER A 70 14.515 -1.104 -14.684 1.00 0.53 O ATOM 1099 CB SER A 70 11.883 -0.921 -16.560 1.00 0.57 C ATOM 1100 OG SER A 70 10.642 -1.449 -17.006 1.00 1.31 O ATOM 0 H SER A 70 10.323 -0.439 -14.695 1.00 0.46 H new ATOM 0 HA SER A 70 12.358 -2.415 -15.108 1.00 0.49 H new ATOM 0 HB2 SER A 70 11.867 0.167 -16.630 1.00 0.57 H new ATOM 0 HB3 SER A 70 12.687 -1.270 -17.208 1.00 0.57 H new ATOM 0 HG SER A 70 10.480 -1.167 -17.930 1.00 1.31 H new ATOM 1106 N GLN A 71 13.164 0.538 -13.955 1.00 0.49 N ATOM 1107 CA GLN A 71 14.238 1.287 -13.318 1.00 0.53 C ATOM 1108 C GLN A 71 14.512 0.704 -11.937 1.00 0.46 C ATOM 1109 O GLN A 71 15.658 0.617 -11.494 1.00 0.53 O ATOM 1110 CB GLN A 71 13.867 2.771 -13.198 1.00 0.63 C ATOM 1111 CG GLN A 71 14.971 3.628 -12.594 1.00 0.69 C ATOM 1112 CD GLN A 71 14.542 5.059 -12.310 1.00 0.83 C ATOM 1113 OE1 GLN A 71 15.352 5.983 -12.383 1.00 1.22 O ATOM 1114 NE2 GLN A 71 13.275 5.257 -11.969 1.00 0.82 N ATOM 0 H GLN A 71 12.245 0.976 -13.885 1.00 0.49 H new ATOM 0 HA GLN A 71 15.135 1.208 -13.932 1.00 0.53 H new ATOM 0 HB2 GLN A 71 13.619 3.156 -14.187 1.00 0.63 H new ATOM 0 HB3 GLN A 71 12.970 2.864 -12.586 1.00 0.63 H new ATOM 0 HG2 GLN A 71 15.310 3.168 -11.666 1.00 0.69 H new ATOM 0 HG3 GLN A 71 15.823 3.641 -13.274 1.00 0.69 H new ATOM 0 HE21 GLN A 71 12.631 4.468 -11.919 1.00 0.82 H new ATOM 0 HE22 GLN A 71 12.945 6.199 -11.757 1.00 0.82 H new ATOM 1123 N LEU A 72 13.448 0.269 -11.277 1.00 0.39 N ATOM 1124 CA LEU A 72 13.551 -0.297 -9.938 1.00 0.33 C ATOM 1125 C LEU A 72 13.777 -1.805 -10.018 1.00 0.34 C ATOM 1126 O LEU A 72 13.376 -2.557 -9.136 1.00 0.37 O ATOM 1127 CB LEU A 72 12.286 0.021 -9.124 1.00 0.37 C ATOM 1128 CG LEU A 72 12.358 -0.320 -7.632 1.00 0.46 C ATOM 1129 CD1 LEU A 72 13.588 0.299 -6.990 1.00 0.96 C ATOM 1130 CD2 LEU A 72 11.102 0.153 -6.924 1.00 0.92 C ATOM 0 H LEU A 72 12.499 0.297 -11.649 1.00 0.39 H new ATOM 0 HA LEU A 72 14.405 0.153 -9.432 1.00 0.33 H new ATOM 0 HB2 LEU A 72 12.067 1.084 -9.226 1.00 0.37 H new ATOM 0 HB3 LEU A 72 11.448 -0.520 -9.562 1.00 0.37 H new ATOM 0 HG LEU A 72 12.433 -1.403 -7.535 1.00 0.46 H new ATOM 0 HD11 LEU A 72 13.614 0.041 -5.931 1.00 0.96 H new ATOM 0 HD12 LEU A 72 14.484 -0.082 -7.479 1.00 0.96 H new ATOM 0 HD13 LEU A 72 13.549 1.383 -7.099 1.00 0.96 H new ATOM 0 HD21 LEU A 72 11.166 -0.095 -5.865 1.00 0.92 H new ATOM 0 HD22 LEU A 72 11.005 1.233 -7.038 1.00 0.92 H new ATOM 0 HD23 LEU A 72 10.232 -0.338 -7.360 1.00 0.92 H new ATOM 1142 N HIS A 73 14.416 -2.243 -11.091 1.00 0.41 N ATOM 1143 CA HIS A 73 14.803 -3.638 -11.220 1.00 0.46 C ATOM 1144 C HIS A 73 15.811 -3.986 -10.122 1.00 0.41 C ATOM 1145 O HIS A 73 16.857 -3.344 -10.005 1.00 0.45 O ATOM 1146 CB HIS A 73 15.394 -3.918 -12.619 1.00 0.60 C ATOM 1147 CG HIS A 73 16.713 -3.247 -12.889 1.00 1.34 C ATOM 1148 ND1 HIS A 73 17.888 -3.945 -13.054 1.00 2.07 N ATOM 1149 CD2 HIS A 73 17.035 -1.939 -13.012 1.00 2.33 C ATOM 1150 CE1 HIS A 73 18.876 -3.093 -13.262 1.00 2.86 C ATOM 1151 NE2 HIS A 73 18.384 -1.869 -13.242 1.00 3.01 N ATOM 0 H HIS A 73 14.677 -1.655 -11.882 1.00 0.41 H new ATOM 0 HA HIS A 73 13.920 -4.266 -11.106 1.00 0.46 H new ATOM 0 HB2 HIS A 73 15.518 -4.994 -12.737 1.00 0.60 H new ATOM 0 HB3 HIS A 73 14.676 -3.595 -13.373 1.00 0.60 H new ATOM 0 HD2 HIS A 73 16.354 -1.104 -12.942 1.00 2.33 H new ATOM 0 HE1 HIS A 73 19.912 -3.354 -13.421 1.00 2.86 H new ATOM 0 HE2 HIS A 73 18.920 -1.011 -13.376 1.00 3.01 H new ATOM 1160 N ILE A 74 15.485 -4.965 -9.292 1.00 0.37 N ATOM 1161 CA ILE A 74 16.370 -5.337 -8.201 1.00 0.36 C ATOM 1162 C ILE A 74 17.462 -6.280 -8.707 1.00 0.45 C ATOM 1163 O ILE A 74 17.218 -7.120 -9.579 1.00 0.61 O ATOM 1164 CB ILE A 74 15.587 -5.980 -7.028 1.00 0.31 C ATOM 1165 CG1 ILE A 74 16.470 -6.095 -5.786 1.00 0.31 C ATOM 1166 CG2 ILE A 74 15.043 -7.346 -7.417 1.00 0.35 C ATOM 1167 CD1 ILE A 74 15.715 -6.525 -4.551 1.00 0.34 C ATOM 0 H ILE A 74 14.625 -5.510 -9.352 1.00 0.37 H new ATOM 0 HA ILE A 74 16.838 -4.429 -7.821 1.00 0.36 H new ATOM 0 HB ILE A 74 14.743 -5.330 -6.796 1.00 0.31 H new ATOM 0 HG12 ILE A 74 17.269 -6.810 -5.982 1.00 0.31 H new ATOM 0 HG13 ILE A 74 16.944 -5.132 -5.596 1.00 0.31 H new ATOM 0 HG21 ILE A 74 14.498 -7.774 -6.575 1.00 0.35 H new ATOM 0 HG22 ILE A 74 14.371 -7.241 -8.269 1.00 0.35 H new ATOM 0 HG23 ILE A 74 15.870 -8.004 -7.686 1.00 0.35 H new ATOM 0 HD11 ILE A 74 16.402 -6.586 -3.707 1.00 0.34 H new ATOM 0 HD12 ILE A 74 14.934 -5.798 -4.331 1.00 0.34 H new ATOM 0 HD13 ILE A 74 15.263 -7.502 -4.723 1.00 0.34 H new ATOM 1179 N THR A 75 18.670 -6.110 -8.187 1.00 0.61 N ATOM 1180 CA THR A 75 19.814 -6.899 -8.619 1.00 0.73 C ATOM 1181 C THR A 75 20.661 -7.314 -7.419 1.00 0.58 C ATOM 1182 O THR A 75 20.494 -6.767 -6.327 1.00 0.57 O ATOM 1183 CB THR A 75 20.691 -6.100 -9.608 1.00 1.02 C ATOM 1184 OG1 THR A 75 20.945 -4.783 -9.093 1.00 1.38 O ATOM 1185 CG2 THR A 75 20.031 -5.992 -10.972 1.00 1.56 C ATOM 0 H THR A 75 18.883 -5.427 -7.460 1.00 0.61 H new ATOM 0 HA THR A 75 19.433 -7.789 -9.120 1.00 0.73 H new ATOM 0 HB THR A 75 21.633 -6.637 -9.723 1.00 1.02 H new ATOM 0 HG1 THR A 75 20.642 -4.732 -8.162 1.00 1.38 H new ATOM 0 HG21 THR A 75 20.675 -5.424 -11.644 1.00 1.56 H new ATOM 0 HG22 THR A 75 19.872 -6.990 -11.380 1.00 1.56 H new ATOM 0 HG23 THR A 75 19.072 -5.484 -10.873 1.00 1.56 H new ATOM 1193 N PRO A 76 21.570 -8.287 -7.590 1.00 0.66 N ATOM 1194 CA PRO A 76 22.508 -8.671 -6.536 1.00 0.73 C ATOM 1195 C PRO A 76 23.432 -7.513 -6.171 1.00 0.72 C ATOM 1196 O PRO A 76 24.318 -7.145 -6.947 1.00 0.81 O ATOM 1197 CB PRO A 76 23.307 -9.827 -7.150 1.00 0.93 C ATOM 1198 CG PRO A 76 22.493 -10.301 -8.305 1.00 1.06 C ATOM 1199 CD PRO A 76 21.747 -9.099 -8.806 1.00 0.90 C ATOM 0 HA PRO A 76 22.000 -8.951 -5.613 1.00 0.73 H new ATOM 0 HB2 PRO A 76 24.293 -9.494 -7.474 1.00 0.93 H new ATOM 0 HB3 PRO A 76 23.463 -10.626 -6.425 1.00 0.93 H new ATOM 0 HG2 PRO A 76 23.129 -10.719 -9.085 1.00 1.06 H new ATOM 0 HG3 PRO A 76 21.804 -11.089 -8.000 1.00 1.06 H new ATOM 0 HD2 PRO A 76 22.311 -8.564 -9.570 1.00 0.90 H new ATOM 0 HD3 PRO A 76 20.790 -9.374 -9.250 1.00 0.90 H new ATOM 1207 N GLY A 77 23.200 -6.926 -5.007 1.00 0.86 N ATOM 1208 CA GLY A 77 23.989 -5.794 -4.574 1.00 1.10 C ATOM 1209 C GLY A 77 23.293 -4.471 -4.836 1.00 1.00 C ATOM 1210 O GLY A 77 23.886 -3.547 -5.399 1.00 1.32 O ATOM 0 H GLY A 77 22.475 -7.216 -4.351 1.00 0.86 H new ATOM 0 HA2 GLY A 77 24.199 -5.887 -3.508 1.00 1.10 H new ATOM 0 HA3 GLY A 77 24.949 -5.805 -5.090 1.00 1.10 H new ATOM 1214 N THR A 78 22.035 -4.381 -4.438 1.00 0.85 N ATOM 1215 CA THR A 78 21.264 -3.157 -4.585 1.00 0.82 C ATOM 1216 C THR A 78 21.045 -2.516 -3.216 1.00 0.85 C ATOM 1217 O THR A 78 20.058 -2.795 -2.544 1.00 1.52 O ATOM 1218 CB THR A 78 19.898 -3.441 -5.247 1.00 0.90 C ATOM 1219 OG1 THR A 78 20.086 -4.203 -6.448 1.00 1.52 O ATOM 1220 CG2 THR A 78 19.170 -2.146 -5.579 1.00 1.15 C ATOM 0 H THR A 78 21.521 -5.149 -4.006 1.00 0.85 H new ATOM 0 HA THR A 78 21.824 -2.475 -5.225 1.00 0.82 H new ATOM 0 HB THR A 78 19.292 -4.009 -4.541 1.00 0.90 H new ATOM 0 HG1 THR A 78 20.475 -5.075 -6.225 1.00 1.52 H new ATOM 0 HG21 THR A 78 18.211 -2.376 -6.044 1.00 1.15 H new ATOM 0 HG22 THR A 78 19.002 -1.578 -4.664 1.00 1.15 H new ATOM 0 HG23 THR A 78 19.774 -1.555 -6.267 1.00 1.15 H new ATOM 1228 N ALA A 79 21.997 -1.696 -2.791 1.00 0.68 N ATOM 1229 CA ALA A 79 21.937 -1.070 -1.476 1.00 0.73 C ATOM 1230 C ALA A 79 20.821 -0.027 -1.405 1.00 0.62 C ATOM 1231 O ALA A 79 20.208 0.313 -2.425 1.00 0.56 O ATOM 1232 CB ALA A 79 23.279 -0.439 -1.143 1.00 0.85 C ATOM 0 H ALA A 79 22.821 -1.448 -3.338 1.00 0.68 H new ATOM 0 HA ALA A 79 21.712 -1.842 -0.740 1.00 0.73 H new ATOM 0 HB1 ALA A 79 23.228 0.027 -0.159 1.00 0.85 H new ATOM 0 HB2 ALA A 79 24.052 -1.208 -1.141 1.00 0.85 H new ATOM 0 HB3 ALA A 79 23.521 0.317 -1.890 1.00 0.85 H new ATOM 1238 N TYR A 80 20.575 0.494 -0.203 1.00 0.63 N ATOM 1239 CA TYR A 80 19.524 1.488 0.013 1.00 0.58 C ATOM 1240 C TYR A 80 19.741 2.716 -0.869 1.00 0.50 C ATOM 1241 O TYR A 80 18.784 3.365 -1.281 1.00 0.46 O ATOM 1242 CB TYR A 80 19.464 1.902 1.491 1.00 0.67 C ATOM 1243 CG TYR A 80 18.389 2.926 1.805 1.00 0.80 C ATOM 1244 CD1 TYR A 80 17.042 2.590 1.745 1.00 0.89 C ATOM 1245 CD2 TYR A 80 18.724 4.227 2.165 1.00 1.14 C ATOM 1246 CE1 TYR A 80 16.061 3.520 2.033 1.00 1.24 C ATOM 1247 CE2 TYR A 80 17.749 5.161 2.456 1.00 1.55 C ATOM 1248 CZ TYR A 80 16.420 4.803 2.389 1.00 1.58 C ATOM 1249 OH TYR A 80 15.444 5.730 2.686 1.00 2.03 O ATOM 0 H TYR A 80 21.092 0.243 0.640 1.00 0.63 H new ATOM 0 HA TYR A 80 18.573 1.032 -0.261 1.00 0.58 H new ATOM 0 HB2 TYR A 80 19.293 1.014 2.099 1.00 0.67 H new ATOM 0 HB3 TYR A 80 20.433 2.307 1.783 1.00 0.67 H new ATOM 0 HD1 TYR A 80 16.757 1.586 1.469 1.00 0.89 H new ATOM 0 HD2 TYR A 80 19.764 4.512 2.218 1.00 1.14 H new ATOM 0 HE1 TYR A 80 15.018 3.243 1.980 1.00 1.24 H new ATOM 0 HE2 TYR A 80 18.027 6.167 2.735 1.00 1.55 H new ATOM 0 HH TYR A 80 15.810 6.634 2.586 1.00 2.03 H new ATOM 1259 N GLN A 81 20.998 3.025 -1.165 1.00 0.56 N ATOM 1260 CA GLN A 81 21.322 4.152 -2.028 1.00 0.59 C ATOM 1261 C GLN A 81 20.729 3.951 -3.420 1.00 0.54 C ATOM 1262 O GLN A 81 20.097 4.854 -3.969 1.00 0.63 O ATOM 1263 CB GLN A 81 22.839 4.345 -2.120 1.00 0.72 C ATOM 1264 CG GLN A 81 23.261 5.572 -2.924 1.00 0.84 C ATOM 1265 CD GLN A 81 22.991 6.897 -2.217 1.00 1.40 C ATOM 1266 OE1 GLN A 81 23.708 7.877 -2.429 1.00 2.01 O ATOM 1267 NE2 GLN A 81 21.973 6.942 -1.370 1.00 2.18 N ATOM 0 H GLN A 81 21.808 2.511 -0.820 1.00 0.56 H new ATOM 0 HA GLN A 81 20.885 5.050 -1.591 1.00 0.59 H new ATOM 0 HB2 GLN A 81 23.246 4.426 -1.112 1.00 0.72 H new ATOM 0 HB3 GLN A 81 23.281 3.457 -2.572 1.00 0.72 H new ATOM 0 HG2 GLN A 81 24.326 5.500 -3.146 1.00 0.84 H new ATOM 0 HG3 GLN A 81 22.735 5.567 -3.879 1.00 0.84 H new ATOM 0 HE21 GLN A 81 21.399 6.113 -1.218 1.00 2.18 H new ATOM 0 HE22 GLN A 81 21.763 7.806 -0.870 1.00 2.18 H new ATOM 1276 N SER A 82 20.916 2.755 -3.971 1.00 0.48 N ATOM 1277 CA SER A 82 20.374 2.422 -5.283 1.00 0.47 C ATOM 1278 C SER A 82 18.849 2.433 -5.246 1.00 0.40 C ATOM 1279 O SER A 82 18.196 2.929 -6.165 1.00 0.42 O ATOM 1280 CB SER A 82 20.878 1.048 -5.729 1.00 0.55 C ATOM 1281 OG SER A 82 22.296 0.998 -5.731 1.00 1.17 O ATOM 0 H SER A 82 21.440 2.000 -3.528 1.00 0.48 H new ATOM 0 HA SER A 82 20.712 3.172 -5.999 1.00 0.47 H new ATOM 0 HB2 SER A 82 20.485 0.280 -5.063 1.00 0.55 H new ATOM 0 HB3 SER A 82 20.502 0.826 -6.728 1.00 0.55 H new ATOM 0 HG SER A 82 22.592 0.109 -6.018 1.00 1.17 H new ATOM 1287 N PHE A 83 18.293 1.900 -4.163 1.00 0.36 N ATOM 1288 CA PHE A 83 16.849 1.870 -3.973 1.00 0.33 C ATOM 1289 C PHE A 83 16.299 3.293 -3.873 1.00 0.31 C ATOM 1290 O PHE A 83 15.257 3.612 -4.450 1.00 0.32 O ATOM 1291 CB PHE A 83 16.509 1.059 -2.709 1.00 0.35 C ATOM 1292 CG PHE A 83 15.037 0.943 -2.414 1.00 0.33 C ATOM 1293 CD1 PHE A 83 14.234 0.071 -3.135 1.00 0.38 C ATOM 1294 CD2 PHE A 83 14.458 1.698 -1.403 1.00 0.32 C ATOM 1295 CE1 PHE A 83 12.886 -0.041 -2.854 1.00 0.41 C ATOM 1296 CE2 PHE A 83 13.110 1.588 -1.120 1.00 0.34 C ATOM 1297 CZ PHE A 83 12.324 0.717 -1.846 1.00 0.38 C ATOM 0 H PHE A 83 18.825 1.481 -3.400 1.00 0.36 H new ATOM 0 HA PHE A 83 16.382 1.388 -4.832 1.00 0.33 H new ATOM 0 HB2 PHE A 83 16.925 0.057 -2.814 1.00 0.35 H new ATOM 0 HB3 PHE A 83 17.002 1.521 -1.854 1.00 0.35 H new ATOM 0 HD1 PHE A 83 14.667 -0.526 -3.924 1.00 0.38 H new ATOM 0 HD2 PHE A 83 15.069 2.380 -0.830 1.00 0.32 H new ATOM 0 HE1 PHE A 83 12.271 -0.722 -3.423 1.00 0.41 H new ATOM 0 HE2 PHE A 83 12.672 2.183 -0.332 1.00 0.34 H new ATOM 0 HZ PHE A 83 11.270 0.628 -1.626 1.00 0.38 H new ATOM 1307 N GLU A 84 17.030 4.150 -3.165 1.00 0.34 N ATOM 1308 CA GLU A 84 16.623 5.539 -2.980 1.00 0.39 C ATOM 1309 C GLU A 84 16.647 6.290 -4.302 1.00 0.37 C ATOM 1310 O GLU A 84 15.779 7.111 -4.558 1.00 0.40 O ATOM 1311 CB GLU A 84 17.531 6.250 -1.968 1.00 0.51 C ATOM 1312 CG GLU A 84 17.119 7.688 -1.691 1.00 0.64 C ATOM 1313 CD GLU A 84 18.118 8.426 -0.828 1.00 0.90 C ATOM 1314 OE1 GLU A 84 18.059 8.289 0.409 1.00 0.95 O ATOM 1315 OE2 GLU A 84 18.967 9.157 -1.385 1.00 1.58 O ATOM 0 H GLU A 84 17.909 3.906 -2.709 1.00 0.34 H new ATOM 0 HA GLU A 84 15.604 5.533 -2.593 1.00 0.39 H new ATOM 0 HB2 GLU A 84 17.526 5.692 -1.032 1.00 0.51 H new ATOM 0 HB3 GLU A 84 18.555 6.239 -2.340 1.00 0.51 H new ATOM 0 HG2 GLU A 84 17.002 8.217 -2.637 1.00 0.64 H new ATOM 0 HG3 GLU A 84 16.146 7.695 -1.200 1.00 0.64 H new ATOM 1322 N GLN A 85 17.627 5.988 -5.153 1.00 0.37 N ATOM 1323 CA GLN A 85 17.766 6.680 -6.436 1.00 0.42 C ATOM 1324 C GLN A 85 16.496 6.563 -7.265 1.00 0.38 C ATOM 1325 O GLN A 85 16.190 7.432 -8.080 1.00 0.46 O ATOM 1326 CB GLN A 85 18.951 6.133 -7.236 1.00 0.50 C ATOM 1327 CG GLN A 85 20.309 6.417 -6.612 1.00 0.61 C ATOM 1328 CD GLN A 85 20.437 7.844 -6.113 1.00 1.44 C ATOM 1329 OE1 GLN A 85 20.821 8.743 -6.860 1.00 1.90 O ATOM 1330 NE2 GLN A 85 20.135 8.057 -4.840 1.00 2.16 N ATOM 0 H GLN A 85 18.333 5.273 -4.980 1.00 0.37 H new ATOM 0 HA GLN A 85 17.947 7.732 -6.214 1.00 0.42 H new ATOM 0 HB2 GLN A 85 18.833 5.055 -7.347 1.00 0.50 H new ATOM 0 HB3 GLN A 85 18.927 6.561 -8.238 1.00 0.50 H new ATOM 0 HG2 GLN A 85 20.474 5.730 -5.782 1.00 0.61 H new ATOM 0 HG3 GLN A 85 21.090 6.222 -7.347 1.00 0.61 H new ATOM 0 HE21 GLN A 85 19.820 7.284 -4.254 1.00 2.16 H new ATOM 0 HE22 GLN A 85 20.218 8.994 -4.446 1.00 2.16 H new ATOM 1339 N VAL A 86 15.756 5.495 -7.039 1.00 0.31 N ATOM 1340 CA VAL A 86 14.514 5.267 -7.744 1.00 0.31 C ATOM 1341 C VAL A 86 13.362 5.934 -7.012 1.00 0.29 C ATOM 1342 O VAL A 86 12.683 6.808 -7.552 1.00 0.32 O ATOM 1343 CB VAL A 86 14.222 3.766 -7.855 1.00 0.33 C ATOM 1344 CG1 VAL A 86 12.964 3.528 -8.671 1.00 0.38 C ATOM 1345 CG2 VAL A 86 15.415 3.030 -8.445 1.00 0.36 C ATOM 0 H VAL A 86 15.998 4.767 -6.367 1.00 0.31 H new ATOM 0 HA VAL A 86 14.614 5.693 -8.742 1.00 0.31 H new ATOM 0 HB VAL A 86 14.050 3.369 -6.854 1.00 0.33 H new ATOM 0 HG11 VAL A 86 12.772 2.457 -8.740 1.00 0.38 H new ATOM 0 HG12 VAL A 86 12.119 4.018 -8.188 1.00 0.38 H new ATOM 0 HG13 VAL A 86 13.097 3.938 -9.672 1.00 0.38 H new ATOM 0 HG21 VAL A 86 15.188 1.966 -8.515 1.00 0.36 H new ATOM 0 HG22 VAL A 86 15.629 3.422 -9.439 1.00 0.36 H new ATOM 0 HG23 VAL A 86 16.285 3.173 -7.804 1.00 0.36 H new ATOM 1355 N VAL A 87 13.165 5.521 -5.768 1.00 0.28 N ATOM 1356 CA VAL A 87 12.032 5.968 -4.971 1.00 0.32 C ATOM 1357 C VAL A 87 12.108 7.461 -4.651 1.00 0.35 C ATOM 1358 O VAL A 87 11.129 8.064 -4.213 1.00 0.37 O ATOM 1359 CB VAL A 87 11.923 5.157 -3.671 1.00 0.38 C ATOM 1360 CG1 VAL A 87 11.920 3.673 -3.990 1.00 0.38 C ATOM 1361 CG2 VAL A 87 13.048 5.500 -2.710 1.00 0.41 C ATOM 0 H VAL A 87 13.783 4.869 -5.285 1.00 0.28 H new ATOM 0 HA VAL A 87 11.138 5.801 -5.571 1.00 0.32 H new ATOM 0 HB VAL A 87 10.985 5.416 -3.180 1.00 0.38 H new ATOM 0 HG11 VAL A 87 11.843 3.102 -3.065 1.00 0.38 H new ATOM 0 HG12 VAL A 87 11.070 3.441 -4.632 1.00 0.38 H new ATOM 0 HG13 VAL A 87 12.845 3.409 -4.503 1.00 0.38 H new ATOM 0 HG21 VAL A 87 12.942 4.909 -1.800 1.00 0.41 H new ATOM 0 HG22 VAL A 87 14.007 5.277 -3.178 1.00 0.41 H new ATOM 0 HG23 VAL A 87 13.004 6.560 -2.461 1.00 0.41 H new ATOM 1371 N ASN A 88 13.271 8.052 -4.885 1.00 0.38 N ATOM 1372 CA ASN A 88 13.457 9.488 -4.698 1.00 0.47 C ATOM 1373 C ASN A 88 12.583 10.259 -5.679 1.00 0.44 C ATOM 1374 O ASN A 88 12.120 11.360 -5.380 1.00 0.45 O ATOM 1375 CB ASN A 88 14.930 9.878 -4.894 1.00 0.61 C ATOM 1376 CG ASN A 88 15.216 11.320 -4.514 1.00 0.78 C ATOM 1377 OD1 ASN A 88 14.566 11.884 -3.631 1.00 0.87 O ATOM 1378 ND2 ASN A 88 16.196 11.926 -5.169 1.00 0.97 N ATOM 0 H ASN A 88 14.104 7.559 -5.206 1.00 0.38 H new ATOM 0 HA ASN A 88 13.165 9.741 -3.679 1.00 0.47 H new ATOM 0 HB2 ASN A 88 15.558 9.219 -4.295 1.00 0.61 H new ATOM 0 HB3 ASN A 88 15.206 9.721 -5.937 1.00 0.61 H new ATOM 0 HD21 ASN A 88 16.435 12.893 -4.949 1.00 0.97 H new ATOM 0 HD22 ASN A 88 16.711 11.426 -5.893 1.00 0.97 H new ATOM 1385 N GLU A 89 12.321 9.653 -6.837 1.00 0.42 N ATOM 1386 CA GLU A 89 11.503 10.294 -7.860 1.00 0.45 C ATOM 1387 C GLU A 89 10.066 10.426 -7.380 1.00 0.38 C ATOM 1388 O GLU A 89 9.309 11.250 -7.883 1.00 0.43 O ATOM 1389 CB GLU A 89 11.534 9.514 -9.177 1.00 0.54 C ATOM 1390 CG GLU A 89 12.909 9.429 -9.817 1.00 0.65 C ATOM 1391 CD GLU A 89 12.844 8.951 -11.254 1.00 1.23 C ATOM 1392 OE1 GLU A 89 12.459 7.782 -11.477 1.00 2.04 O ATOM 1393 OE2 GLU A 89 13.191 9.728 -12.167 1.00 1.28 O ATOM 0 H GLU A 89 12.662 8.725 -7.087 1.00 0.42 H new ATOM 0 HA GLU A 89 11.921 11.284 -8.040 1.00 0.45 H new ATOM 0 HB2 GLU A 89 11.166 8.504 -8.997 1.00 0.54 H new ATOM 0 HB3 GLU A 89 10.846 9.983 -9.881 1.00 0.54 H new ATOM 0 HG2 GLU A 89 13.385 10.409 -9.783 1.00 0.65 H new ATOM 0 HG3 GLU A 89 13.536 8.750 -9.238 1.00 0.65 H new ATOM 1400 N LEU A 90 9.699 9.615 -6.396 1.00 0.31 N ATOM 1401 CA LEU A 90 8.367 9.665 -5.822 1.00 0.27 C ATOM 1402 C LEU A 90 8.230 10.905 -4.952 1.00 0.25 C ATOM 1403 O LEU A 90 7.210 11.592 -4.979 1.00 0.26 O ATOM 1404 CB LEU A 90 8.098 8.417 -4.982 1.00 0.26 C ATOM 1405 CG LEU A 90 8.368 7.086 -5.677 1.00 0.30 C ATOM 1406 CD1 LEU A 90 8.197 5.941 -4.697 1.00 0.31 C ATOM 1407 CD2 LEU A 90 7.450 6.905 -6.872 1.00 0.37 C ATOM 0 H LEU A 90 10.311 8.913 -5.980 1.00 0.31 H new ATOM 0 HA LEU A 90 7.639 9.705 -6.633 1.00 0.27 H new ATOM 0 HB2 LEU A 90 8.710 8.468 -4.082 1.00 0.26 H new ATOM 0 HB3 LEU A 90 7.057 8.434 -4.661 1.00 0.26 H new ATOM 0 HG LEU A 90 9.396 7.088 -6.038 1.00 0.30 H new ATOM 0 HD11 LEU A 90 8.392 4.996 -5.204 1.00 0.31 H new ATOM 0 HD12 LEU A 90 8.898 6.061 -3.871 1.00 0.31 H new ATOM 0 HD13 LEU A 90 7.178 5.942 -4.311 1.00 0.31 H new ATOM 0 HD21 LEU A 90 7.661 5.949 -7.351 1.00 0.37 H new ATOM 0 HD22 LEU A 90 6.412 6.923 -6.540 1.00 0.37 H new ATOM 0 HD23 LEU A 90 7.617 7.713 -7.585 1.00 0.37 H new ATOM 1419 N PHE A 91 9.280 11.192 -4.196 1.00 0.27 N ATOM 1420 CA PHE A 91 9.283 12.325 -3.285 1.00 0.29 C ATOM 1421 C PHE A 91 9.488 13.622 -4.059 1.00 0.33 C ATOM 1422 O PHE A 91 8.824 14.625 -3.799 1.00 0.33 O ATOM 1423 CB PHE A 91 10.390 12.157 -2.235 1.00 0.35 C ATOM 1424 CG PHE A 91 10.184 12.977 -0.989 1.00 0.37 C ATOM 1425 CD1 PHE A 91 10.563 14.310 -0.942 1.00 0.46 C ATOM 1426 CD2 PHE A 91 9.611 12.407 0.137 1.00 0.37 C ATOM 1427 CE1 PHE A 91 10.371 15.058 0.204 1.00 0.53 C ATOM 1428 CE2 PHE A 91 9.417 13.151 1.285 1.00 0.43 C ATOM 1429 CZ PHE A 91 9.797 14.477 1.318 1.00 0.50 C ATOM 0 H PHE A 91 10.145 10.652 -4.197 1.00 0.27 H new ATOM 0 HA PHE A 91 8.320 12.368 -2.777 1.00 0.29 H new ATOM 0 HB2 PHE A 91 10.457 11.105 -1.958 1.00 0.35 H new ATOM 0 HB3 PHE A 91 11.346 12.430 -2.683 1.00 0.35 H new ATOM 0 HD1 PHE A 91 11.013 14.768 -1.810 1.00 0.46 H new ATOM 0 HD2 PHE A 91 9.313 11.369 0.117 1.00 0.37 H new ATOM 0 HE1 PHE A 91 10.669 16.096 0.229 1.00 0.53 H new ATOM 0 HE2 PHE A 91 8.969 12.695 2.155 1.00 0.43 H new ATOM 0 HZ PHE A 91 9.646 15.060 2.214 1.00 0.50 H new ATOM 1439 N ARG A 92 10.381 13.581 -5.043 1.00 0.39 N ATOM 1440 CA ARG A 92 10.752 14.777 -5.791 1.00 0.49 C ATOM 1441 C ARG A 92 9.725 15.089 -6.874 1.00 0.51 C ATOM 1442 O ARG A 92 9.858 16.063 -7.613 1.00 0.62 O ATOM 1443 CB ARG A 92 12.140 14.612 -6.409 1.00 0.56 C ATOM 1444 CG ARG A 92 13.234 14.333 -5.387 1.00 1.24 C ATOM 1445 CD ARG A 92 13.273 15.395 -4.298 1.00 1.54 C ATOM 1446 NE ARG A 92 14.146 15.007 -3.194 1.00 2.30 N ATOM 1447 CZ ARG A 92 14.092 15.537 -1.975 1.00 2.99 C ATOM 1448 NH1 ARG A 92 13.225 16.508 -1.699 1.00 3.13 N ATOM 1449 NH2 ARG A 92 14.908 15.096 -1.029 1.00 3.95 N ATOM 0 H ARG A 92 10.861 12.732 -5.341 1.00 0.39 H new ATOM 0 HA ARG A 92 10.775 15.615 -5.094 1.00 0.49 H new ATOM 0 HB2 ARG A 92 12.112 13.796 -7.131 1.00 0.56 H new ATOM 0 HB3 ARG A 92 12.393 15.517 -6.961 1.00 0.56 H new ATOM 0 HG2 ARG A 92 13.069 13.355 -4.935 1.00 1.24 H new ATOM 0 HG3 ARG A 92 14.200 14.293 -5.890 1.00 1.24 H new ATOM 0 HD2 ARG A 92 13.620 16.338 -4.722 1.00 1.54 H new ATOM 0 HD3 ARG A 92 12.265 15.567 -3.921 1.00 1.54 H new ATOM 0 HE ARG A 92 14.842 14.283 -3.369 1.00 2.30 H new ATOM 0 HH11 ARG A 92 12.596 16.851 -2.425 1.00 3.13 H new ATOM 0 HH12 ARG A 92 13.190 16.909 -0.762 1.00 3.13 H new ATOM 0 HH21 ARG A 92 15.575 14.353 -1.236 1.00 3.95 H new ATOM 0 HH22 ARG A 92 14.869 15.500 -0.093 1.00 3.95 H new ATOM 1463 N ASP A 93 8.700 14.255 -6.955 1.00 0.46 N ATOM 1464 CA ASP A 93 7.589 14.469 -7.880 1.00 0.53 C ATOM 1465 C ASP A 93 6.557 15.402 -7.250 1.00 0.50 C ATOM 1466 O ASP A 93 5.578 15.796 -7.886 1.00 0.60 O ATOM 1467 CB ASP A 93 6.936 13.119 -8.236 1.00 0.62 C ATOM 1468 CG ASP A 93 5.737 13.250 -9.155 1.00 0.90 C ATOM 1469 OD1 ASP A 93 5.927 13.571 -10.346 1.00 1.14 O ATOM 1470 OD2 ASP A 93 4.596 13.015 -8.694 1.00 1.11 O ATOM 0 H ASP A 93 8.611 13.413 -6.386 1.00 0.46 H new ATOM 0 HA ASP A 93 7.969 14.930 -8.792 1.00 0.53 H new ATOM 0 HB2 ASP A 93 7.680 12.479 -8.711 1.00 0.62 H new ATOM 0 HB3 ASP A 93 6.627 12.621 -7.317 1.00 0.62 H new ATOM 1475 N GLY A 94 6.807 15.798 -6.009 1.00 0.45 N ATOM 1476 CA GLY A 94 5.795 16.503 -5.256 1.00 0.47 C ATOM 1477 C GLY A 94 4.999 15.538 -4.409 1.00 0.39 C ATOM 1478 O GLY A 94 3.795 15.716 -4.242 1.00 0.42 O ATOM 0 H GLY A 94 7.686 15.644 -5.515 1.00 0.45 H new ATOM 0 HA2 GLY A 94 6.264 17.254 -4.620 1.00 0.47 H new ATOM 0 HA3 GLY A 94 5.129 17.033 -5.937 1.00 0.47 H new ATOM 1482 N VAL A 95 5.705 14.504 -3.918 1.00 0.32 N ATOM 1483 CA VAL A 95 5.127 13.333 -3.239 1.00 0.26 C ATOM 1484 C VAL A 95 3.717 13.551 -2.695 1.00 0.25 C ATOM 1485 O VAL A 95 3.493 14.314 -1.760 1.00 0.29 O ATOM 1486 CB VAL A 95 6.047 12.840 -2.093 1.00 0.31 C ATOM 1487 CG1 VAL A 95 6.399 13.971 -1.140 1.00 0.40 C ATOM 1488 CG2 VAL A 95 5.400 11.683 -1.341 1.00 0.33 C ATOM 0 H VAL A 95 6.722 14.460 -3.985 1.00 0.32 H new ATOM 0 HA VAL A 95 5.050 12.573 -4.016 1.00 0.26 H new ATOM 0 HB VAL A 95 6.974 12.483 -2.542 1.00 0.31 H new ATOM 0 HG11 VAL A 95 7.045 13.592 -0.348 1.00 0.40 H new ATOM 0 HG12 VAL A 95 6.918 14.759 -1.686 1.00 0.40 H new ATOM 0 HG13 VAL A 95 5.486 14.375 -0.702 1.00 0.40 H new ATOM 0 HG21 VAL A 95 6.063 11.353 -0.541 1.00 0.33 H new ATOM 0 HG22 VAL A 95 4.452 12.011 -0.914 1.00 0.33 H new ATOM 0 HG23 VAL A 95 5.222 10.856 -2.029 1.00 0.33 H new ATOM 1498 N ASN A 96 2.769 12.897 -3.337 1.00 0.24 N ATOM 1499 CA ASN A 96 1.403 12.840 -2.850 1.00 0.29 C ATOM 1500 C ASN A 96 1.112 11.425 -2.373 1.00 0.23 C ATOM 1501 O ASN A 96 1.990 10.559 -2.435 1.00 0.21 O ATOM 1502 CB ASN A 96 0.401 13.261 -3.935 1.00 0.41 C ATOM 1503 CG ASN A 96 0.518 14.725 -4.318 1.00 1.33 C ATOM 1504 OD1 ASN A 96 0.221 15.106 -5.452 1.00 2.13 O ATOM 1505 ND2 ASN A 96 0.945 15.557 -3.382 1.00 2.00 N ATOM 0 H ASN A 96 2.922 12.391 -4.209 1.00 0.24 H new ATOM 0 HA ASN A 96 1.292 13.541 -2.022 1.00 0.29 H new ATOM 0 HB2 ASN A 96 0.555 12.646 -4.822 1.00 0.41 H new ATOM 0 HB3 ASN A 96 -0.611 13.064 -3.582 1.00 0.41 H new ATOM 0 HD21 ASN A 96 1.038 16.552 -3.588 1.00 2.00 H new ATOM 0 HD22 ASN A 96 1.181 15.204 -2.455 1.00 2.00 H new ATOM 1512 N TRP A 97 -0.104 11.182 -1.905 1.00 0.25 N ATOM 1513 CA TRP A 97 -0.467 9.877 -1.361 1.00 0.24 C ATOM 1514 C TRP A 97 -0.316 8.773 -2.409 1.00 0.25 C ATOM 1515 O TRP A 97 -0.012 7.629 -2.072 1.00 0.25 O ATOM 1516 CB TRP A 97 -1.897 9.903 -0.812 1.00 0.27 C ATOM 1517 CG TRP A 97 -2.087 10.893 0.303 1.00 0.28 C ATOM 1518 CD1 TRP A 97 -2.769 12.076 0.242 1.00 0.32 C ATOM 1519 CD2 TRP A 97 -1.582 10.793 1.643 1.00 0.27 C ATOM 1520 NE1 TRP A 97 -2.725 12.709 1.459 1.00 0.34 N ATOM 1521 CE2 TRP A 97 -2.002 11.945 2.333 1.00 0.30 C ATOM 1522 CE3 TRP A 97 -0.819 9.843 2.329 1.00 0.26 C ATOM 1523 CZ2 TRP A 97 -1.684 12.171 3.669 1.00 0.32 C ATOM 1524 CZ3 TRP A 97 -0.504 10.069 3.655 1.00 0.27 C ATOM 1525 CH2 TRP A 97 -0.936 11.226 4.314 1.00 0.30 C ATOM 0 H TRP A 97 -0.857 11.870 -1.890 1.00 0.25 H new ATOM 0 HA TRP A 97 0.218 9.656 -0.543 1.00 0.24 H new ATOM 0 HB2 TRP A 97 -2.586 10.142 -1.622 1.00 0.27 H new ATOM 0 HB3 TRP A 97 -2.160 8.908 -0.454 1.00 0.27 H new ATOM 0 HD1 TRP A 97 -3.270 12.457 -0.636 1.00 0.32 H new ATOM 0 HE1 TRP A 97 -3.161 13.605 1.677 1.00 0.34 H new ATOM 0 HE3 TRP A 97 -0.481 8.947 1.830 1.00 0.26 H new ATOM 0 HZ2 TRP A 97 -2.017 13.063 4.179 1.00 0.32 H new ATOM 0 HZ3 TRP A 97 0.085 9.341 4.192 1.00 0.27 H new ATOM 0 HH2 TRP A 97 -0.674 11.375 5.351 1.00 0.30 H new ATOM 1536 N GLY A 98 -0.501 9.127 -3.681 1.00 0.27 N ATOM 1537 CA GLY A 98 -0.369 8.157 -4.757 1.00 0.29 C ATOM 1538 C GLY A 98 1.044 7.618 -4.891 1.00 0.26 C ATOM 1539 O GLY A 98 1.244 6.470 -5.290 1.00 0.27 O ATOM 0 H GLY A 98 -0.740 10.071 -3.985 1.00 0.27 H new ATOM 0 HA2 GLY A 98 -1.054 7.328 -4.579 1.00 0.29 H new ATOM 0 HA3 GLY A 98 -0.667 8.621 -5.697 1.00 0.29 H new ATOM 1543 N ARG A 99 2.026 8.439 -4.540 1.00 0.26 N ATOM 1544 CA ARG A 99 3.425 8.030 -4.619 1.00 0.25 C ATOM 1545 C ARG A 99 3.747 7.048 -3.508 1.00 0.21 C ATOM 1546 O ARG A 99 4.591 6.169 -3.668 1.00 0.20 O ATOM 1547 CB ARG A 99 4.366 9.237 -4.543 1.00 0.30 C ATOM 1548 CG ARG A 99 4.334 10.121 -5.781 1.00 0.70 C ATOM 1549 CD ARG A 99 4.694 9.343 -7.038 1.00 1.40 C ATOM 1550 NE ARG A 99 4.638 10.180 -8.235 1.00 1.74 N ATOM 1551 CZ ARG A 99 4.659 9.708 -9.481 1.00 2.46 C ATOM 1552 NH1 ARG A 99 4.741 8.400 -9.702 1.00 3.06 N ATOM 1553 NH2 ARG A 99 4.602 10.550 -10.503 1.00 2.98 N ATOM 0 H ARG A 99 1.882 9.389 -4.199 1.00 0.26 H new ATOM 0 HA ARG A 99 3.577 7.545 -5.583 1.00 0.25 H new ATOM 0 HB2 ARG A 99 4.102 9.837 -3.673 1.00 0.30 H new ATOM 0 HB3 ARG A 99 5.385 8.882 -4.388 1.00 0.30 H new ATOM 0 HG2 ARG A 99 3.340 10.554 -5.893 1.00 0.70 H new ATOM 0 HG3 ARG A 99 5.030 10.950 -5.654 1.00 0.70 H new ATOM 0 HD2 ARG A 99 5.696 8.928 -6.933 1.00 1.40 H new ATOM 0 HD3 ARG A 99 4.011 8.502 -7.152 1.00 1.40 H new ATOM 0 HE ARG A 99 4.579 11.190 -8.108 1.00 1.74 H new ATOM 0 HH11 ARG A 99 4.788 7.752 -8.916 1.00 3.06 H new ATOM 0 HH12 ARG A 99 4.757 8.044 -10.658 1.00 3.06 H new ATOM 0 HH21 ARG A 99 4.542 11.554 -10.334 1.00 2.98 H new ATOM 0 HH22 ARG A 99 4.618 10.194 -11.459 1.00 2.98 H new ATOM 1567 N ILE A 100 3.058 7.198 -2.385 1.00 0.22 N ATOM 1568 CA ILE A 100 3.195 6.268 -1.279 1.00 0.21 C ATOM 1569 C ILE A 100 2.598 4.923 -1.668 1.00 0.20 C ATOM 1570 O ILE A 100 3.156 3.870 -1.365 1.00 0.19 O ATOM 1571 CB ILE A 100 2.511 6.810 -0.005 1.00 0.24 C ATOM 1572 CG1 ILE A 100 3.218 8.086 0.465 1.00 0.26 C ATOM 1573 CG2 ILE A 100 2.501 5.759 1.092 1.00 0.24 C ATOM 1574 CD1 ILE A 100 2.715 8.607 1.790 1.00 0.30 C ATOM 0 H ILE A 100 2.398 7.958 -2.218 1.00 0.22 H new ATOM 0 HA ILE A 100 4.255 6.145 -1.059 1.00 0.21 H new ATOM 0 HB ILE A 100 1.475 7.053 -0.240 1.00 0.24 H new ATOM 0 HG12 ILE A 100 4.287 7.890 0.544 1.00 0.26 H new ATOM 0 HG13 ILE A 100 3.091 8.860 -0.291 1.00 0.26 H new ATOM 0 HG21 ILE A 100 2.014 6.164 1.979 1.00 0.24 H new ATOM 0 HG22 ILE A 100 1.956 4.880 0.748 1.00 0.24 H new ATOM 0 HG23 ILE A 100 3.526 5.478 1.336 1.00 0.24 H new ATOM 0 HD11 ILE A 100 3.262 9.511 2.057 1.00 0.30 H new ATOM 0 HD12 ILE A 100 1.652 8.836 1.711 1.00 0.30 H new ATOM 0 HD13 ILE A 100 2.867 7.850 2.560 1.00 0.30 H new ATOM 1586 N VAL A 101 1.470 4.975 -2.363 1.00 0.21 N ATOM 1587 CA VAL A 101 0.846 3.779 -2.908 1.00 0.21 C ATOM 1588 C VAL A 101 1.825 3.049 -3.811 1.00 0.20 C ATOM 1589 O VAL A 101 2.104 1.863 -3.621 1.00 0.21 O ATOM 1590 CB VAL A 101 -0.404 4.130 -3.725 1.00 0.25 C ATOM 1591 CG1 VAL A 101 -1.055 2.873 -4.263 1.00 0.29 C ATOM 1592 CG2 VAL A 101 -1.380 4.923 -2.882 1.00 0.26 C ATOM 0 H VAL A 101 0.966 5.839 -2.563 1.00 0.21 H new ATOM 0 HA VAL A 101 0.558 3.144 -2.070 1.00 0.21 H new ATOM 0 HB VAL A 101 -0.104 4.747 -4.572 1.00 0.25 H new ATOM 0 HG11 VAL A 101 -1.940 3.140 -4.840 1.00 0.29 H new ATOM 0 HG12 VAL A 101 -0.350 2.344 -4.904 1.00 0.29 H new ATOM 0 HG13 VAL A 101 -1.344 2.229 -3.433 1.00 0.29 H new ATOM 0 HG21 VAL A 101 -2.261 5.164 -3.476 1.00 0.26 H new ATOM 0 HG22 VAL A 101 -1.677 4.332 -2.016 1.00 0.26 H new ATOM 0 HG23 VAL A 101 -0.905 5.845 -2.546 1.00 0.26 H new ATOM 1602 N ALA A 102 2.346 3.783 -4.788 1.00 0.19 N ATOM 1603 CA ALA A 102 3.313 3.244 -5.730 1.00 0.19 C ATOM 1604 C ALA A 102 4.507 2.647 -4.997 1.00 0.17 C ATOM 1605 O ALA A 102 4.978 1.567 -5.345 1.00 0.19 O ATOM 1606 CB ALA A 102 3.766 4.332 -6.690 1.00 0.21 C ATOM 0 H ALA A 102 2.110 4.763 -4.947 1.00 0.19 H new ATOM 0 HA ALA A 102 2.835 2.448 -6.301 1.00 0.19 H new ATOM 0 HB1 ALA A 102 4.490 3.919 -7.392 1.00 0.21 H new ATOM 0 HB2 ALA A 102 2.905 4.714 -7.239 1.00 0.21 H new ATOM 0 HB3 ALA A 102 4.227 5.144 -6.128 1.00 0.21 H new ATOM 1612 N PHE A 103 4.965 3.348 -3.968 1.00 0.16 N ATOM 1613 CA PHE A 103 6.093 2.894 -3.159 1.00 0.17 C ATOM 1614 C PHE A 103 5.842 1.491 -2.609 1.00 0.17 C ATOM 1615 O PHE A 103 6.701 0.614 -2.699 1.00 0.21 O ATOM 1616 CB PHE A 103 6.347 3.885 -2.011 1.00 0.17 C ATOM 1617 CG PHE A 103 7.429 3.459 -1.057 1.00 0.19 C ATOM 1618 CD1 PHE A 103 8.736 3.299 -1.491 1.00 0.29 C ATOM 1619 CD2 PHE A 103 7.137 3.214 0.274 1.00 0.17 C ATOM 1620 CE1 PHE A 103 9.728 2.904 -0.615 1.00 0.32 C ATOM 1621 CE2 PHE A 103 8.125 2.820 1.154 1.00 0.20 C ATOM 1622 CZ PHE A 103 9.431 2.678 0.704 1.00 0.26 C ATOM 0 H PHE A 103 4.570 4.240 -3.671 1.00 0.16 H new ATOM 0 HA PHE A 103 6.978 2.852 -3.793 1.00 0.17 H new ATOM 0 HB2 PHE A 103 6.612 4.854 -2.434 1.00 0.17 H new ATOM 0 HB3 PHE A 103 5.421 4.023 -1.454 1.00 0.17 H new ATOM 0 HD1 PHE A 103 8.981 3.485 -2.526 1.00 0.29 H new ATOM 0 HD2 PHE A 103 6.124 3.333 0.628 1.00 0.17 H new ATOM 0 HE1 PHE A 103 10.740 2.773 -0.970 1.00 0.32 H new ATOM 0 HE2 PHE A 103 7.883 2.623 2.188 1.00 0.20 H new ATOM 0 HZ PHE A 103 10.212 2.390 1.392 1.00 0.26 H new ATOM 1632 N PHE A 104 4.647 1.276 -2.079 1.00 0.16 N ATOM 1633 CA PHE A 104 4.300 -0.011 -1.492 1.00 0.18 C ATOM 1634 C PHE A 104 4.119 -1.076 -2.568 1.00 0.19 C ATOM 1635 O PHE A 104 4.540 -2.222 -2.395 1.00 0.23 O ATOM 1636 CB PHE A 104 3.035 0.108 -0.637 1.00 0.19 C ATOM 1637 CG PHE A 104 3.280 0.672 0.739 1.00 0.21 C ATOM 1638 CD1 PHE A 104 3.708 1.982 0.911 1.00 0.24 C ATOM 1639 CD2 PHE A 104 3.084 -0.114 1.861 1.00 0.29 C ATOM 1640 CE1 PHE A 104 3.931 2.491 2.174 1.00 0.27 C ATOM 1641 CE2 PHE A 104 3.306 0.391 3.126 1.00 0.33 C ATOM 1642 CZ PHE A 104 3.731 1.694 3.283 1.00 0.30 C ATOM 0 H PHE A 104 3.903 1.973 -2.043 1.00 0.16 H new ATOM 0 HA PHE A 104 5.125 -0.318 -0.849 1.00 0.18 H new ATOM 0 HB2 PHE A 104 2.316 0.741 -1.156 1.00 0.19 H new ATOM 0 HB3 PHE A 104 2.580 -0.878 -0.539 1.00 0.19 H new ATOM 0 HD1 PHE A 104 3.868 2.609 0.047 1.00 0.24 H new ATOM 0 HD2 PHE A 104 2.753 -1.136 1.745 1.00 0.29 H new ATOM 0 HE1 PHE A 104 4.262 3.512 2.295 1.00 0.27 H new ATOM 0 HE2 PHE A 104 3.147 -0.234 3.993 1.00 0.33 H new ATOM 0 HZ PHE A 104 3.907 2.090 4.272 1.00 0.30 H new ATOM 1652 N SER A 105 3.510 -0.696 -3.686 1.00 0.18 N ATOM 1653 CA SER A 105 3.301 -1.633 -4.782 1.00 0.21 C ATOM 1654 C SER A 105 4.636 -2.052 -5.407 1.00 0.21 C ATOM 1655 O SER A 105 4.774 -3.177 -5.896 1.00 0.23 O ATOM 1656 CB SER A 105 2.367 -1.025 -5.834 1.00 0.25 C ATOM 1657 OG SER A 105 2.816 0.252 -6.254 1.00 1.04 O ATOM 0 H SER A 105 3.156 0.245 -3.856 1.00 0.18 H new ATOM 0 HA SER A 105 2.827 -2.529 -4.382 1.00 0.21 H new ATOM 0 HB2 SER A 105 2.305 -1.691 -6.695 1.00 0.25 H new ATOM 0 HB3 SER A 105 1.361 -0.941 -5.423 1.00 0.25 H new ATOM 0 HG SER A 105 3.719 0.412 -5.908 1.00 1.04 H new ATOM 1663 N PHE A 106 5.625 -1.158 -5.364 1.00 0.20 N ATOM 1664 CA PHE A 106 6.952 -1.467 -5.884 1.00 0.21 C ATOM 1665 C PHE A 106 7.606 -2.552 -5.045 1.00 0.22 C ATOM 1666 O PHE A 106 8.105 -3.539 -5.582 1.00 0.24 O ATOM 1667 CB PHE A 106 7.854 -0.227 -5.906 1.00 0.23 C ATOM 1668 CG PHE A 106 7.465 0.817 -6.917 1.00 0.24 C ATOM 1669 CD1 PHE A 106 6.845 0.447 -8.099 1.00 0.30 C ATOM 1670 CD2 PHE A 106 7.712 2.162 -6.688 1.00 0.27 C ATOM 1671 CE1 PHE A 106 6.480 1.394 -9.033 1.00 0.35 C ATOM 1672 CE2 PHE A 106 7.349 3.115 -7.621 1.00 0.30 C ATOM 1673 CZ PHE A 106 6.762 2.759 -8.776 1.00 0.33 C ATOM 0 H PHE A 106 5.530 -0.219 -4.976 1.00 0.20 H new ATOM 0 HA PHE A 106 6.828 -1.818 -6.908 1.00 0.21 H new ATOM 0 HB2 PHE A 106 7.848 0.227 -4.915 1.00 0.23 H new ATOM 0 HB3 PHE A 106 8.878 -0.543 -6.106 1.00 0.23 H new ATOM 0 HD1 PHE A 106 6.645 -0.597 -8.292 1.00 0.30 H new ATOM 0 HD2 PHE A 106 8.193 2.468 -5.771 1.00 0.27 H new ATOM 0 HE1 PHE A 106 5.986 1.100 -9.947 1.00 0.35 H new ATOM 0 HE2 PHE A 106 7.540 4.159 -7.419 1.00 0.30 H new ATOM 0 HZ PHE A 106 6.506 3.511 -9.507 1.00 0.33 H new ATOM 1683 N GLY A 107 7.582 -2.369 -3.724 1.00 0.23 N ATOM 1684 CA GLY A 107 8.189 -3.331 -2.821 1.00 0.27 C ATOM 1685 C GLY A 107 7.645 -4.730 -3.018 1.00 0.32 C ATOM 1686 O GLY A 107 8.392 -5.707 -2.970 1.00 0.37 O ATOM 0 H GLY A 107 7.150 -1.567 -3.264 1.00 0.23 H new ATOM 0 HA2 GLY A 107 9.268 -3.339 -2.975 1.00 0.27 H new ATOM 0 HA3 GLY A 107 8.016 -3.018 -1.791 1.00 0.27 H new ATOM 1690 N GLY A 108 6.339 -4.819 -3.241 1.00 0.33 N ATOM 1691 CA GLY A 108 5.715 -6.100 -3.510 1.00 0.41 C ATOM 1692 C GLY A 108 6.268 -6.753 -4.760 1.00 0.42 C ATOM 1693 O GLY A 108 6.591 -7.940 -4.756 1.00 0.63 O ATOM 0 H GLY A 108 5.700 -4.024 -3.240 1.00 0.33 H new ATOM 0 HA2 GLY A 108 5.867 -6.763 -2.658 1.00 0.41 H new ATOM 0 HA3 GLY A 108 4.639 -5.963 -3.619 1.00 0.41 H new ATOM 1697 N ALA A 109 6.392 -5.970 -5.827 1.00 0.27 N ATOM 1698 CA ALA A 109 6.925 -6.467 -7.088 1.00 0.26 C ATOM 1699 C ALA A 109 8.386 -6.857 -6.932 1.00 0.23 C ATOM 1700 O ALA A 109 8.830 -7.875 -7.466 1.00 0.24 O ATOM 1701 CB ALA A 109 6.773 -5.413 -8.169 1.00 0.29 C ATOM 0 H ALA A 109 6.129 -4.985 -5.842 1.00 0.27 H new ATOM 0 HA ALA A 109 6.362 -7.354 -7.379 1.00 0.26 H new ATOM 0 HB1 ALA A 109 7.174 -5.794 -9.108 1.00 0.29 H new ATOM 0 HB2 ALA A 109 5.718 -5.172 -8.297 1.00 0.29 H new ATOM 0 HB3 ALA A 109 7.318 -4.514 -7.880 1.00 0.29 H new ATOM 1707 N LEU A 110 9.115 -6.039 -6.184 1.00 0.22 N ATOM 1708 CA LEU A 110 10.515 -6.288 -5.891 1.00 0.23 C ATOM 1709 C LEU A 110 10.695 -7.657 -5.264 1.00 0.21 C ATOM 1710 O LEU A 110 11.524 -8.451 -5.705 1.00 0.21 O ATOM 1711 CB LEU A 110 11.043 -5.219 -4.940 1.00 0.25 C ATOM 1712 CG LEU A 110 11.090 -3.813 -5.515 1.00 0.28 C ATOM 1713 CD1 LEU A 110 11.466 -2.818 -4.438 1.00 0.32 C ATOM 1714 CD2 LEU A 110 12.075 -3.758 -6.664 1.00 0.36 C ATOM 0 H LEU A 110 8.749 -5.184 -5.764 1.00 0.22 H new ATOM 0 HA LEU A 110 11.074 -6.254 -6.826 1.00 0.23 H new ATOM 0 HB2 LEU A 110 10.419 -5.209 -4.046 1.00 0.25 H new ATOM 0 HB3 LEU A 110 12.048 -5.500 -4.624 1.00 0.25 H new ATOM 0 HG LEU A 110 10.102 -3.549 -5.892 1.00 0.28 H new ATOM 0 HD11 LEU A 110 11.496 -1.815 -4.864 1.00 0.32 H new ATOM 0 HD12 LEU A 110 10.726 -2.851 -3.638 1.00 0.32 H new ATOM 0 HD13 LEU A 110 12.447 -3.071 -4.036 1.00 0.32 H new ATOM 0 HD21 LEU A 110 12.103 -2.747 -7.071 1.00 0.36 H new ATOM 0 HD22 LEU A 110 13.067 -4.033 -6.306 1.00 0.36 H new ATOM 0 HD23 LEU A 110 11.765 -4.454 -7.443 1.00 0.36 H new ATOM 1726 N CYS A 111 9.903 -7.922 -4.235 1.00 0.21 N ATOM 1727 CA CYS A 111 9.971 -9.182 -3.515 1.00 0.21 C ATOM 1728 C CYS A 111 9.747 -10.362 -4.449 1.00 0.21 C ATOM 1729 O CYS A 111 10.388 -11.403 -4.316 1.00 0.25 O ATOM 1730 CB CYS A 111 8.934 -9.194 -2.399 1.00 0.22 C ATOM 1731 SG CYS A 111 9.199 -7.919 -1.152 1.00 1.34 S ATOM 0 H CYS A 111 9.201 -7.274 -3.879 1.00 0.21 H new ATOM 0 HA CYS A 111 10.968 -9.278 -3.085 1.00 0.21 H new ATOM 0 HB2 CYS A 111 7.943 -9.064 -2.834 1.00 0.22 H new ATOM 0 HB3 CYS A 111 8.944 -10.171 -1.915 1.00 0.22 H new ATOM 0 HG CYS A 111 9.002 -6.748 -1.680 1.00 1.34 H new ATOM 1737 N VAL A 112 8.853 -10.178 -5.406 1.00 0.19 N ATOM 1738 CA VAL A 112 8.518 -11.228 -6.349 1.00 0.20 C ATOM 1739 C VAL A 112 9.674 -11.491 -7.299 1.00 0.22 C ATOM 1740 O VAL A 112 10.175 -12.612 -7.381 1.00 0.25 O ATOM 1741 CB VAL A 112 7.271 -10.856 -7.163 1.00 0.23 C ATOM 1742 CG1 VAL A 112 6.981 -11.924 -8.200 1.00 0.27 C ATOM 1743 CG2 VAL A 112 6.079 -10.663 -6.245 1.00 0.25 C ATOM 0 H VAL A 112 8.344 -9.306 -5.549 1.00 0.19 H new ATOM 0 HA VAL A 112 8.314 -12.131 -5.774 1.00 0.20 H new ATOM 0 HB VAL A 112 7.460 -9.916 -7.681 1.00 0.23 H new ATOM 0 HG11 VAL A 112 6.094 -11.647 -8.770 1.00 0.27 H new ATOM 0 HG12 VAL A 112 7.832 -12.016 -8.875 1.00 0.27 H new ATOM 0 HG13 VAL A 112 6.809 -12.878 -7.702 1.00 0.27 H new ATOM 0 HG21 VAL A 112 5.203 -10.400 -6.837 1.00 0.25 H new ATOM 0 HG22 VAL A 112 5.885 -11.588 -5.701 1.00 0.25 H new ATOM 0 HG23 VAL A 112 6.292 -9.863 -5.536 1.00 0.25 H new ATOM 1753 N GLU A 113 10.096 -10.453 -8.013 1.00 0.22 N ATOM 1754 CA GLU A 113 11.165 -10.593 -8.998 1.00 0.25 C ATOM 1755 C GLU A 113 12.455 -11.077 -8.337 1.00 0.25 C ATOM 1756 O GLU A 113 13.277 -11.728 -8.977 1.00 0.30 O ATOM 1757 CB GLU A 113 11.406 -9.280 -9.749 1.00 0.29 C ATOM 1758 CG GLU A 113 11.850 -8.126 -8.868 1.00 0.30 C ATOM 1759 CD GLU A 113 12.171 -6.881 -9.667 1.00 0.39 C ATOM 1760 OE1 GLU A 113 11.235 -6.122 -9.998 1.00 0.51 O ATOM 1761 OE2 GLU A 113 13.361 -6.648 -9.963 1.00 0.50 O ATOM 0 H GLU A 113 9.717 -9.510 -7.930 1.00 0.22 H new ATOM 0 HA GLU A 113 10.848 -11.342 -9.724 1.00 0.25 H new ATOM 0 HB2 GLU A 113 12.162 -9.448 -10.516 1.00 0.29 H new ATOM 0 HB3 GLU A 113 10.488 -8.996 -10.264 1.00 0.29 H new ATOM 0 HG2 GLU A 113 11.064 -7.899 -8.147 1.00 0.30 H new ATOM 0 HG3 GLU A 113 12.729 -8.425 -8.298 1.00 0.30 H new ATOM 1768 N SER A 114 12.617 -10.774 -7.055 1.00 0.23 N ATOM 1769 CA SER A 114 13.772 -11.241 -6.302 1.00 0.28 C ATOM 1770 C SER A 114 13.782 -12.762 -6.232 1.00 0.27 C ATOM 1771 O SER A 114 14.837 -13.389 -6.295 1.00 0.31 O ATOM 1772 CB SER A 114 13.775 -10.650 -4.892 1.00 0.33 C ATOM 1773 OG SER A 114 13.907 -9.242 -4.935 1.00 0.99 O ATOM 0 H SER A 114 11.963 -10.207 -6.516 1.00 0.23 H new ATOM 0 HA SER A 114 14.672 -10.907 -6.819 1.00 0.28 H new ATOM 0 HB2 SER A 114 12.851 -10.917 -4.379 1.00 0.33 H new ATOM 0 HB3 SER A 114 14.595 -11.079 -4.315 1.00 0.33 H new ATOM 0 HG SER A 114 13.158 -8.858 -5.437 1.00 0.99 H new ATOM 1779 N VAL A 115 12.599 -13.350 -6.132 1.00 0.28 N ATOM 1780 CA VAL A 115 12.470 -14.793 -6.070 1.00 0.33 C ATOM 1781 C VAL A 115 12.879 -15.406 -7.401 1.00 0.37 C ATOM 1782 O VAL A 115 13.688 -16.334 -7.449 1.00 0.42 O ATOM 1783 CB VAL A 115 11.026 -15.205 -5.733 1.00 0.40 C ATOM 1784 CG1 VAL A 115 10.900 -16.718 -5.660 1.00 0.45 C ATOM 1785 CG2 VAL A 115 10.586 -14.564 -4.427 1.00 0.41 C ATOM 0 H VAL A 115 11.713 -12.845 -6.092 1.00 0.28 H new ATOM 0 HA VAL A 115 13.126 -15.160 -5.280 1.00 0.33 H new ATOM 0 HB VAL A 115 10.371 -14.851 -6.529 1.00 0.40 H new ATOM 0 HG11 VAL A 115 9.871 -16.986 -5.421 1.00 0.45 H new ATOM 0 HG12 VAL A 115 11.174 -17.153 -6.621 1.00 0.45 H new ATOM 0 HG13 VAL A 115 11.564 -17.102 -4.886 1.00 0.45 H new ATOM 0 HG21 VAL A 115 9.563 -14.864 -4.201 1.00 0.41 H new ATOM 0 HG22 VAL A 115 11.245 -14.889 -3.622 1.00 0.41 H new ATOM 0 HG23 VAL A 115 10.634 -13.479 -4.520 1.00 0.41 H new ATOM 1795 N ASP A 116 12.327 -14.863 -8.477 1.00 0.38 N ATOM 1796 CA ASP A 116 12.634 -15.331 -9.825 1.00 0.46 C ATOM 1797 C ASP A 116 14.121 -15.194 -10.130 1.00 0.47 C ATOM 1798 O ASP A 116 14.703 -16.019 -10.832 1.00 0.56 O ATOM 1799 CB ASP A 116 11.828 -14.544 -10.865 1.00 0.49 C ATOM 1800 CG ASP A 116 10.337 -14.753 -10.734 1.00 1.08 C ATOM 1801 OD1 ASP A 116 9.835 -15.803 -11.190 1.00 1.23 O ATOM 1802 OD2 ASP A 116 9.655 -13.866 -10.186 1.00 1.89 O ATOM 0 H ASP A 116 11.659 -14.093 -8.444 1.00 0.38 H new ATOM 0 HA ASP A 116 12.361 -16.385 -9.876 1.00 0.46 H new ATOM 0 HB2 ASP A 116 12.051 -13.482 -10.763 1.00 0.49 H new ATOM 0 HB3 ASP A 116 12.145 -14.842 -11.864 1.00 0.49 H new ATOM 1807 N LYS A 117 14.735 -14.155 -9.583 1.00 0.43 N ATOM 1808 CA LYS A 117 16.139 -13.863 -9.856 1.00 0.49 C ATOM 1809 C LYS A 117 17.068 -14.597 -8.890 1.00 0.47 C ATOM 1810 O LYS A 117 18.261 -14.295 -8.831 1.00 0.52 O ATOM 1811 CB LYS A 117 16.389 -12.354 -9.776 1.00 0.53 C ATOM 1812 CG LYS A 117 15.676 -11.556 -10.857 1.00 0.61 C ATOM 1813 CD LYS A 117 15.817 -10.060 -10.621 1.00 1.20 C ATOM 1814 CE LYS A 117 15.112 -9.252 -11.700 1.00 1.32 C ATOM 1815 NZ LYS A 117 15.206 -7.790 -11.451 1.00 1.90 N ATOM 0 H LYS A 117 14.284 -13.498 -8.946 1.00 0.43 H new ATOM 0 HA LYS A 117 16.359 -14.215 -10.864 1.00 0.49 H new ATOM 0 HB2 LYS A 117 16.067 -11.993 -8.799 1.00 0.53 H new ATOM 0 HB3 LYS A 117 17.461 -12.168 -9.847 1.00 0.53 H new ATOM 0 HG2 LYS A 117 16.087 -11.813 -11.833 1.00 0.61 H new ATOM 0 HG3 LYS A 117 14.620 -11.826 -10.875 1.00 0.61 H new ATOM 0 HD2 LYS A 117 15.403 -9.805 -9.646 1.00 1.20 H new ATOM 0 HD3 LYS A 117 16.874 -9.793 -10.598 1.00 1.20 H new ATOM 0 HE2 LYS A 117 15.550 -9.483 -12.671 1.00 1.32 H new ATOM 0 HE3 LYS A 117 14.063 -9.545 -11.746 1.00 1.32 H new ATOM 0 HZ1 LYS A 117 15.485 -7.306 -12.328 1.00 1.90 H new ATOM 0 HZ2 LYS A 117 14.282 -7.431 -11.136 1.00 1.90 H new ATOM 0 HZ3 LYS A 117 15.917 -7.608 -10.714 1.00 1.90 H new ATOM 1829 N GLU A 118 16.517 -15.555 -8.137 1.00 0.45 N ATOM 1830 CA GLU A 118 17.310 -16.391 -7.229 1.00 0.49 C ATOM 1831 C GLU A 118 17.929 -15.552 -6.119 1.00 0.45 C ATOM 1832 O GLU A 118 19.021 -15.841 -5.629 1.00 0.55 O ATOM 1833 CB GLU A 118 18.394 -17.132 -8.015 1.00 0.59 C ATOM 1834 CG GLU A 118 17.829 -18.103 -9.035 1.00 1.07 C ATOM 1835 CD GLU A 118 18.845 -18.525 -10.069 1.00 1.72 C ATOM 1836 OE1 GLU A 118 19.769 -19.289 -9.715 1.00 1.89 O ATOM 1837 OE2 GLU A 118 18.729 -18.102 -11.238 1.00 2.54 O ATOM 0 H GLU A 118 15.520 -15.771 -8.139 1.00 0.45 H new ATOM 0 HA GLU A 118 16.649 -17.123 -6.765 1.00 0.49 H new ATOM 0 HB2 GLU A 118 19.026 -16.405 -8.525 1.00 0.59 H new ATOM 0 HB3 GLU A 118 19.032 -17.676 -7.319 1.00 0.59 H new ATOM 0 HG2 GLU A 118 17.454 -18.987 -8.519 1.00 1.07 H new ATOM 0 HG3 GLU A 118 16.978 -17.642 -9.536 1.00 1.07 H new ATOM 1844 N MET A 119 17.212 -14.519 -5.719 1.00 0.35 N ATOM 1845 CA MET A 119 17.663 -13.624 -4.672 1.00 0.33 C ATOM 1846 C MET A 119 16.651 -13.625 -3.536 1.00 0.31 C ATOM 1847 O MET A 119 16.128 -12.582 -3.143 1.00 0.27 O ATOM 1848 CB MET A 119 17.843 -12.210 -5.225 1.00 0.34 C ATOM 1849 CG MET A 119 18.785 -12.135 -6.415 1.00 0.41 C ATOM 1850 SD MET A 119 18.980 -10.459 -7.048 1.00 0.47 S ATOM 1851 CE MET A 119 17.268 -9.960 -7.201 1.00 0.44 C ATOM 0 H MET A 119 16.302 -14.277 -6.111 1.00 0.35 H new ATOM 0 HA MET A 119 18.626 -13.968 -4.294 1.00 0.33 H new ATOM 0 HB2 MET A 119 16.869 -11.817 -5.518 1.00 0.34 H new ATOM 0 HB3 MET A 119 18.221 -11.565 -4.432 1.00 0.34 H new ATOM 0 HG2 MET A 119 19.761 -12.525 -6.125 1.00 0.41 H new ATOM 0 HG3 MET A 119 18.409 -12.778 -7.211 1.00 0.41 H new ATOM 0 HE1 MET A 119 17.118 -9.465 -8.160 1.00 0.44 H new ATOM 0 HE2 MET A 119 16.626 -10.839 -7.142 1.00 0.44 H new ATOM 0 HE3 MET A 119 17.016 -9.272 -6.394 1.00 0.44 H new ATOM 1861 N GLN A 120 16.389 -14.811 -3.003 1.00 0.36 N ATOM 1862 CA GLN A 120 15.365 -14.997 -1.979 1.00 0.39 C ATOM 1863 C GLN A 120 15.796 -14.399 -0.646 1.00 0.41 C ATOM 1864 O GLN A 120 15.019 -14.358 0.303 1.00 0.47 O ATOM 1865 CB GLN A 120 15.058 -16.485 -1.810 1.00 0.49 C ATOM 1866 CG GLN A 120 14.470 -17.137 -3.057 1.00 0.53 C ATOM 1867 CD GLN A 120 14.316 -18.639 -2.916 1.00 0.65 C ATOM 1868 OE1 GLN A 120 14.148 -19.154 -1.808 1.00 0.71 O ATOM 1869 NE2 GLN A 120 14.363 -19.356 -4.031 1.00 0.70 N ATOM 0 H GLN A 120 16.876 -15.668 -3.265 1.00 0.36 H new ATOM 0 HA GLN A 120 14.465 -14.476 -2.306 1.00 0.39 H new ATOM 0 HB2 GLN A 120 15.975 -17.007 -1.536 1.00 0.49 H new ATOM 0 HB3 GLN A 120 14.360 -16.611 -0.982 1.00 0.49 H new ATOM 0 HG2 GLN A 120 13.497 -16.695 -3.268 1.00 0.53 H new ATOM 0 HG3 GLN A 120 15.111 -16.920 -3.912 1.00 0.53 H new ATOM 0 HE21 GLN A 120 14.504 -18.894 -4.929 1.00 0.70 H new ATOM 0 HE22 GLN A 120 14.258 -20.370 -3.990 1.00 0.70 H new ATOM 1878 N VAL A 121 17.041 -13.963 -0.567 1.00 0.39 N ATOM 1879 CA VAL A 121 17.531 -13.284 0.620 1.00 0.44 C ATOM 1880 C VAL A 121 17.335 -11.777 0.502 1.00 0.38 C ATOM 1881 O VAL A 121 17.465 -11.040 1.479 1.00 0.47 O ATOM 1882 CB VAL A 121 19.015 -13.583 0.874 1.00 0.52 C ATOM 1883 CG1 VAL A 121 19.229 -15.075 1.051 1.00 0.98 C ATOM 1884 CG2 VAL A 121 19.870 -13.046 -0.261 1.00 0.92 C ATOM 0 H VAL A 121 17.731 -14.067 -1.311 1.00 0.39 H new ATOM 0 HA VAL A 121 16.952 -13.661 1.463 1.00 0.44 H new ATOM 0 HB VAL A 121 19.318 -13.081 1.793 1.00 0.52 H new ATOM 0 HG11 VAL A 121 20.286 -15.272 1.230 1.00 0.98 H new ATOM 0 HG12 VAL A 121 18.645 -15.428 1.901 1.00 0.98 H new ATOM 0 HG13 VAL A 121 18.910 -15.598 0.149 1.00 0.98 H new ATOM 0 HG21 VAL A 121 20.919 -13.268 -0.063 1.00 0.92 H new ATOM 0 HG22 VAL A 121 19.570 -13.517 -1.197 1.00 0.92 H new ATOM 0 HG23 VAL A 121 19.736 -11.967 -0.339 1.00 0.92 H new ATOM 1894 N LEU A 122 17.011 -11.321 -0.700 1.00 0.30 N ATOM 1895 CA LEU A 122 16.828 -9.901 -0.938 1.00 0.27 C ATOM 1896 C LEU A 122 15.448 -9.445 -0.514 1.00 0.23 C ATOM 1897 O LEU A 122 15.264 -8.285 -0.168 1.00 0.23 O ATOM 1898 CB LEU A 122 17.074 -9.535 -2.398 1.00 0.28 C ATOM 1899 CG LEU A 122 18.522 -9.201 -2.737 1.00 0.37 C ATOM 1900 CD1 LEU A 122 19.410 -10.413 -2.540 1.00 0.39 C ATOM 1901 CD2 LEU A 122 18.622 -8.684 -4.156 1.00 0.41 C ATOM 0 H LEU A 122 16.871 -11.912 -1.520 1.00 0.30 H new ATOM 0 HA LEU A 122 17.568 -9.382 -0.329 1.00 0.27 H new ATOM 0 HB2 LEU A 122 16.751 -10.365 -3.026 1.00 0.28 H new ATOM 0 HB3 LEU A 122 16.449 -8.680 -2.654 1.00 0.28 H new ATOM 0 HG LEU A 122 18.866 -8.418 -2.061 1.00 0.37 H new ATOM 0 HD11 LEU A 122 20.439 -10.154 -2.787 1.00 0.39 H new ATOM 0 HD12 LEU A 122 19.357 -10.738 -1.501 1.00 0.39 H new ATOM 0 HD13 LEU A 122 19.073 -11.220 -3.190 1.00 0.39 H new ATOM 0 HD21 LEU A 122 19.661 -8.449 -4.385 1.00 0.41 H new ATOM 0 HD22 LEU A 122 18.261 -9.446 -4.847 1.00 0.41 H new ATOM 0 HD23 LEU A 122 18.016 -7.784 -4.259 1.00 0.41 H new ATOM 1913 N VAL A 123 14.485 -10.358 -0.521 1.00 0.23 N ATOM 1914 CA VAL A 123 13.129 -10.028 -0.107 1.00 0.25 C ATOM 1915 C VAL A 123 13.116 -9.542 1.343 1.00 0.27 C ATOM 1916 O VAL A 123 12.373 -8.628 1.706 1.00 0.31 O ATOM 1917 CB VAL A 123 12.171 -11.227 -0.289 1.00 0.28 C ATOM 1918 CG1 VAL A 123 12.642 -12.443 0.492 1.00 0.31 C ATOM 1919 CG2 VAL A 123 10.759 -10.846 0.111 1.00 0.31 C ATOM 0 H VAL A 123 14.617 -11.328 -0.807 1.00 0.23 H new ATOM 0 HA VAL A 123 12.772 -9.223 -0.749 1.00 0.25 H new ATOM 0 HB VAL A 123 12.173 -11.495 -1.346 1.00 0.28 H new ATOM 0 HG11 VAL A 123 11.944 -13.266 0.340 1.00 0.31 H new ATOM 0 HG12 VAL A 123 13.632 -12.738 0.144 1.00 0.31 H new ATOM 0 HG13 VAL A 123 12.689 -12.198 1.553 1.00 0.31 H new ATOM 0 HG21 VAL A 123 10.099 -11.703 -0.024 1.00 0.31 H new ATOM 0 HG22 VAL A 123 10.747 -10.540 1.157 1.00 0.31 H new ATOM 0 HG23 VAL A 123 10.414 -10.021 -0.512 1.00 0.31 H new ATOM 1929 N SER A 124 13.985 -10.132 2.149 1.00 0.29 N ATOM 1930 CA SER A 124 14.138 -9.741 3.541 1.00 0.35 C ATOM 1931 C SER A 124 14.737 -8.337 3.637 1.00 0.34 C ATOM 1932 O SER A 124 14.436 -7.576 4.558 1.00 0.44 O ATOM 1933 CB SER A 124 15.039 -10.753 4.253 1.00 0.43 C ATOM 1934 OG SER A 124 14.676 -12.078 3.901 1.00 1.32 O ATOM 0 H SER A 124 14.601 -10.891 1.858 1.00 0.29 H new ATOM 0 HA SER A 124 13.160 -9.727 4.021 1.00 0.35 H new ATOM 0 HB2 SER A 124 16.080 -10.572 3.986 1.00 0.43 H new ATOM 0 HB3 SER A 124 14.960 -10.623 5.332 1.00 0.43 H new ATOM 0 HG SER A 124 15.263 -12.712 4.364 1.00 1.32 H new ATOM 1940 N ARG A 125 15.572 -7.995 2.662 1.00 0.28 N ATOM 1941 CA ARG A 125 16.218 -6.689 2.623 1.00 0.31 C ATOM 1942 C ARG A 125 15.256 -5.644 2.082 1.00 0.24 C ATOM 1943 O ARG A 125 15.275 -4.493 2.505 1.00 0.24 O ATOM 1944 CB ARG A 125 17.469 -6.732 1.742 1.00 0.41 C ATOM 1945 CG ARG A 125 18.522 -7.730 2.201 1.00 0.91 C ATOM 1946 CD ARG A 125 19.710 -7.763 1.247 1.00 0.74 C ATOM 1947 NE ARG A 125 20.449 -6.500 1.235 1.00 1.01 N ATOM 1948 CZ ARG A 125 21.537 -6.284 0.494 1.00 1.24 C ATOM 1949 NH1 ARG A 125 22.050 -7.261 -0.239 1.00 1.28 N ATOM 1950 NH2 ARG A 125 22.123 -5.097 0.493 1.00 1.84 N ATOM 0 H ARG A 125 15.818 -8.608 1.885 1.00 0.28 H new ATOM 0 HA ARG A 125 16.509 -6.423 3.639 1.00 0.31 H new ATOM 0 HB2 ARG A 125 17.173 -6.977 0.722 1.00 0.41 H new ATOM 0 HB3 ARG A 125 17.915 -5.738 1.715 1.00 0.41 H new ATOM 0 HG2 ARG A 125 18.864 -7.466 3.202 1.00 0.91 H new ATOM 0 HG3 ARG A 125 18.079 -8.724 2.268 1.00 0.91 H new ATOM 0 HD2 ARG A 125 20.382 -8.572 1.535 1.00 0.74 H new ATOM 0 HD3 ARG A 125 19.358 -7.985 0.240 1.00 0.74 H new ATOM 0 HE ARG A 125 20.113 -5.741 1.828 1.00 1.01 H new ATOM 0 HH11 ARG A 125 21.613 -8.183 -0.238 1.00 1.28 H new ATOM 0 HH12 ARG A 125 22.882 -7.092 -0.804 1.00 1.28 H new ATOM 0 HH21 ARG A 125 21.743 -4.340 1.061 1.00 1.84 H new ATOM 0 HH22 ARG A 125 22.955 -4.939 -0.076 1.00 1.84 H new ATOM 1964 N ILE A 126 14.415 -6.061 1.146 1.00 0.21 N ATOM 1965 CA ILE A 126 13.414 -5.183 0.561 1.00 0.19 C ATOM 1966 C ILE A 126 12.512 -4.612 1.645 1.00 0.19 C ATOM 1967 O ILE A 126 12.280 -3.404 1.696 1.00 0.19 O ATOM 1968 CB ILE A 126 12.577 -5.937 -0.488 1.00 0.19 C ATOM 1969 CG1 ILE A 126 13.461 -6.303 -1.679 1.00 0.20 C ATOM 1970 CG2 ILE A 126 11.390 -5.101 -0.938 1.00 0.20 C ATOM 1971 CD1 ILE A 126 12.787 -7.203 -2.680 1.00 0.23 C ATOM 0 H ILE A 126 14.408 -7.011 0.774 1.00 0.21 H new ATOM 0 HA ILE A 126 13.928 -4.360 0.064 1.00 0.19 H new ATOM 0 HB ILE A 126 12.187 -6.850 -0.038 1.00 0.19 H new ATOM 0 HG12 ILE A 126 13.776 -5.388 -2.181 1.00 0.20 H new ATOM 0 HG13 ILE A 126 14.363 -6.793 -1.313 1.00 0.20 H new ATOM 0 HG21 ILE A 126 10.814 -5.656 -1.679 1.00 0.20 H new ATOM 0 HG22 ILE A 126 10.756 -4.877 -0.080 1.00 0.20 H new ATOM 0 HG23 ILE A 126 11.747 -4.170 -1.378 1.00 0.20 H new ATOM 0 HD11 ILE A 126 13.476 -7.419 -3.497 1.00 0.23 H new ATOM 0 HD12 ILE A 126 12.496 -8.134 -2.194 1.00 0.23 H new ATOM 0 HD13 ILE A 126 11.900 -6.708 -3.075 1.00 0.23 H new ATOM 1983 N ALA A 127 12.021 -5.484 2.517 1.00 0.22 N ATOM 1984 CA ALA A 127 11.221 -5.060 3.656 1.00 0.25 C ATOM 1985 C ALA A 127 11.968 -4.031 4.496 1.00 0.24 C ATOM 1986 O ALA A 127 11.373 -3.082 5.007 1.00 0.26 O ATOM 1987 CB ALA A 127 10.838 -6.258 4.506 1.00 0.30 C ATOM 0 H ALA A 127 12.164 -6.492 2.455 1.00 0.22 H new ATOM 0 HA ALA A 127 10.312 -4.592 3.277 1.00 0.25 H new ATOM 0 HB1 ALA A 127 10.240 -5.926 5.354 1.00 0.30 H new ATOM 0 HB2 ALA A 127 10.258 -6.960 3.906 1.00 0.30 H new ATOM 0 HB3 ALA A 127 11.740 -6.750 4.869 1.00 0.30 H new ATOM 1993 N ALA A 128 13.277 -4.218 4.618 1.00 0.22 N ATOM 1994 CA ALA A 128 14.112 -3.301 5.375 1.00 0.23 C ATOM 1995 C ALA A 128 14.201 -1.948 4.679 1.00 0.19 C ATOM 1996 O ALA A 128 13.957 -0.914 5.297 1.00 0.19 O ATOM 1997 CB ALA A 128 15.499 -3.887 5.578 1.00 0.27 C ATOM 0 H ALA A 128 13.782 -5.000 4.200 1.00 0.22 H new ATOM 0 HA ALA A 128 13.653 -3.152 6.352 1.00 0.23 H new ATOM 0 HB1 ALA A 128 16.110 -3.186 6.147 1.00 0.27 H new ATOM 0 HB2 ALA A 128 15.421 -4.827 6.125 1.00 0.27 H new ATOM 0 HB3 ALA A 128 15.963 -4.069 4.608 1.00 0.27 H new ATOM 2003 N TRP A 129 14.531 -1.960 3.390 1.00 0.17 N ATOM 2004 CA TRP A 129 14.667 -0.720 2.625 1.00 0.17 C ATOM 2005 C TRP A 129 13.338 0.026 2.584 1.00 0.15 C ATOM 2006 O TRP A 129 13.299 1.253 2.713 1.00 0.18 O ATOM 2007 CB TRP A 129 15.147 -0.991 1.193 1.00 0.20 C ATOM 2008 CG TRP A 129 16.405 -1.804 1.110 1.00 0.24 C ATOM 2009 CD1 TRP A 129 17.481 -1.755 1.953 1.00 0.27 C ATOM 2010 CD2 TRP A 129 16.722 -2.780 0.112 1.00 0.31 C ATOM 2011 NE1 TRP A 129 18.439 -2.654 1.545 1.00 0.33 N ATOM 2012 CE2 TRP A 129 17.997 -3.291 0.416 1.00 0.36 C ATOM 2013 CE3 TRP A 129 16.047 -3.274 -1.008 1.00 0.37 C ATOM 2014 CZ2 TRP A 129 18.609 -4.273 -0.359 1.00 0.45 C ATOM 2015 CZ3 TRP A 129 16.656 -4.246 -1.778 1.00 0.47 C ATOM 2016 CH2 TRP A 129 17.926 -4.739 -1.449 1.00 0.50 C ATOM 0 H TRP A 129 14.709 -2.809 2.854 1.00 0.17 H new ATOM 0 HA TRP A 129 15.415 -0.106 3.127 1.00 0.17 H new ATOM 0 HB2 TRP A 129 14.357 -1.508 0.649 1.00 0.20 H new ATOM 0 HB3 TRP A 129 15.310 -0.038 0.690 1.00 0.20 H new ATOM 0 HD1 TRP A 129 17.566 -1.106 2.812 1.00 0.27 H new ATOM 0 HE1 TRP A 129 19.333 -2.819 2.008 1.00 0.33 H new ATOM 0 HE3 TRP A 129 15.067 -2.902 -1.267 1.00 0.37 H new ATOM 0 HZ2 TRP A 129 19.588 -4.653 -0.108 1.00 0.45 H new ATOM 0 HZ3 TRP A 129 16.145 -4.632 -2.648 1.00 0.47 H new ATOM 0 HH2 TRP A 129 18.374 -5.502 -2.068 1.00 0.50 H new ATOM 2027 N MET A 130 12.256 -0.728 2.421 1.00 0.16 N ATOM 2028 CA MET A 130 10.911 -0.161 2.408 1.00 0.21 C ATOM 2029 C MET A 130 10.619 0.543 3.722 1.00 0.19 C ATOM 2030 O MET A 130 10.255 1.719 3.743 1.00 0.21 O ATOM 2031 CB MET A 130 9.870 -1.257 2.187 1.00 0.29 C ATOM 2032 CG MET A 130 9.743 -1.729 0.749 1.00 0.33 C ATOM 2033 SD MET A 130 8.650 -0.679 -0.222 1.00 0.71 S ATOM 2034 CE MET A 130 7.144 -0.813 0.740 1.00 0.29 C ATOM 0 H MET A 130 12.285 -1.740 2.295 1.00 0.16 H new ATOM 0 HA MET A 130 10.857 0.559 1.591 1.00 0.21 H new ATOM 0 HB2 MET A 130 10.123 -2.111 2.815 1.00 0.29 H new ATOM 0 HB3 MET A 130 8.900 -0.891 2.522 1.00 0.29 H new ATOM 0 HG2 MET A 130 10.730 -1.748 0.287 1.00 0.33 H new ATOM 0 HG3 MET A 130 9.366 -2.752 0.737 1.00 0.33 H new ATOM 0 HE1 MET A 130 6.426 -1.436 0.207 1.00 0.29 H new ATOM 0 HE2 MET A 130 7.369 -1.264 1.707 1.00 0.29 H new ATOM 0 HE3 MET A 130 6.720 0.180 0.892 1.00 0.29 H new ATOM 2044 N ALA A 131 10.803 -0.183 4.818 1.00 0.18 N ATOM 2045 CA ALA A 131 10.525 0.342 6.143 1.00 0.20 C ATOM 2046 C ALA A 131 11.412 1.538 6.449 1.00 0.21 C ATOM 2047 O ALA A 131 10.963 2.518 7.034 1.00 0.23 O ATOM 2048 CB ALA A 131 10.715 -0.744 7.188 1.00 0.23 C ATOM 0 H ALA A 131 11.146 -1.144 4.811 1.00 0.18 H new ATOM 0 HA ALA A 131 9.488 0.676 6.170 1.00 0.20 H new ATOM 0 HB1 ALA A 131 10.504 -0.338 8.177 1.00 0.23 H new ATOM 0 HB2 ALA A 131 10.035 -1.570 6.982 1.00 0.23 H new ATOM 0 HB3 ALA A 131 11.743 -1.104 7.156 1.00 0.23 H new ATOM 2054 N THR A 132 12.666 1.454 6.036 1.00 0.22 N ATOM 2055 CA THR A 132 13.620 2.531 6.252 1.00 0.25 C ATOM 2056 C THR A 132 13.182 3.805 5.527 1.00 0.24 C ATOM 2057 O THR A 132 13.090 4.872 6.136 1.00 0.25 O ATOM 2058 CB THR A 132 15.030 2.125 5.780 1.00 0.31 C ATOM 2059 OG1 THR A 132 15.444 0.926 6.449 1.00 0.33 O ATOM 2060 CG2 THR A 132 16.034 3.234 6.053 1.00 0.37 C ATOM 0 H THR A 132 13.049 0.646 5.546 1.00 0.22 H new ATOM 0 HA THR A 132 13.651 2.728 7.324 1.00 0.25 H new ATOM 0 HB THR A 132 14.991 1.948 4.705 1.00 0.31 H new ATOM 0 HG1 THR A 132 15.119 0.146 5.953 1.00 0.33 H new ATOM 0 HG21 THR A 132 17.021 2.923 5.711 1.00 0.37 H new ATOM 0 HG22 THR A 132 15.733 4.136 5.521 1.00 0.37 H new ATOM 0 HG23 THR A 132 16.068 3.438 7.123 1.00 0.37 H new ATOM 2068 N TYR A 133 12.905 3.701 4.231 1.00 0.23 N ATOM 2069 CA TYR A 133 12.497 4.871 3.462 1.00 0.24 C ATOM 2070 C TYR A 133 11.179 5.421 3.992 1.00 0.21 C ATOM 2071 O TYR A 133 11.026 6.633 4.152 1.00 0.23 O ATOM 2072 CB TYR A 133 12.369 4.546 1.969 1.00 0.27 C ATOM 2073 CG TYR A 133 12.030 5.759 1.125 1.00 0.33 C ATOM 2074 CD1 TYR A 133 13.000 6.702 0.811 1.00 0.42 C ATOM 2075 CD2 TYR A 133 10.738 5.964 0.653 1.00 0.36 C ATOM 2076 CE1 TYR A 133 12.694 7.815 0.051 1.00 0.50 C ATOM 2077 CE2 TYR A 133 10.425 7.075 -0.108 1.00 0.45 C ATOM 2078 CZ TYR A 133 11.407 7.997 -0.406 1.00 0.51 C ATOM 2079 OH TYR A 133 11.100 9.106 -1.161 1.00 0.61 O ATOM 0 H TYR A 133 12.954 2.833 3.698 1.00 0.23 H new ATOM 0 HA TYR A 133 13.273 5.628 3.576 1.00 0.24 H new ATOM 0 HB2 TYR A 133 13.305 4.114 1.615 1.00 0.27 H new ATOM 0 HB3 TYR A 133 11.597 3.788 1.833 1.00 0.27 H new ATOM 0 HD1 TYR A 133 14.010 6.563 1.167 1.00 0.42 H new ATOM 0 HD2 TYR A 133 9.967 5.244 0.885 1.00 0.36 H new ATOM 0 HE1 TYR A 133 13.460 8.539 -0.184 1.00 0.50 H new ATOM 0 HE2 TYR A 133 9.417 7.220 -0.467 1.00 0.45 H new ATOM 0 HH TYR A 133 11.107 8.867 -2.111 1.00 0.61 H new ATOM 2089 N LEU A 134 10.249 4.522 4.284 1.00 0.20 N ATOM 2090 CA LEU A 134 8.936 4.898 4.789 1.00 0.20 C ATOM 2091 C LEU A 134 9.042 5.600 6.141 1.00 0.21 C ATOM 2092 O LEU A 134 8.511 6.690 6.322 1.00 0.24 O ATOM 2093 CB LEU A 134 8.052 3.651 4.899 1.00 0.20 C ATOM 2094 CG LEU A 134 6.751 3.817 5.685 1.00 0.22 C ATOM 2095 CD1 LEU A 134 5.853 4.846 5.026 1.00 0.26 C ATOM 2096 CD2 LEU A 134 6.033 2.481 5.808 1.00 0.26 C ATOM 0 H LEU A 134 10.382 3.516 4.178 1.00 0.20 H new ATOM 0 HA LEU A 134 8.484 5.600 4.089 1.00 0.20 H new ATOM 0 HB2 LEU A 134 7.804 3.316 3.892 1.00 0.20 H new ATOM 0 HB3 LEU A 134 8.635 2.857 5.365 1.00 0.20 H new ATOM 0 HG LEU A 134 6.997 4.172 6.686 1.00 0.22 H new ATOM 0 HD11 LEU A 134 4.933 4.948 5.602 1.00 0.26 H new ATOM 0 HD12 LEU A 134 6.367 5.807 4.989 1.00 0.26 H new ATOM 0 HD13 LEU A 134 5.613 4.524 4.013 1.00 0.26 H new ATOM 0 HD21 LEU A 134 5.109 2.615 6.370 1.00 0.26 H new ATOM 0 HD22 LEU A 134 5.801 2.100 4.814 1.00 0.26 H new ATOM 0 HD23 LEU A 134 6.674 1.770 6.329 1.00 0.26 H new ATOM 2108 N ASN A 135 9.754 4.988 7.072 1.00 0.24 N ATOM 2109 CA ASN A 135 9.812 5.491 8.439 1.00 0.29 C ATOM 2110 C ASN A 135 10.699 6.725 8.566 1.00 0.30 C ATOM 2111 O ASN A 135 10.401 7.634 9.340 1.00 0.33 O ATOM 2112 CB ASN A 135 10.310 4.393 9.384 1.00 0.37 C ATOM 2113 CG ASN A 135 10.502 4.892 10.804 1.00 0.92 C ATOM 2114 OD1 ASN A 135 9.555 4.939 11.584 1.00 1.17 O ATOM 2115 ND2 ASN A 135 11.731 5.245 11.155 1.00 1.46 N ATOM 0 H ASN A 135 10.301 4.142 6.909 1.00 0.24 H new ATOM 0 HA ASN A 135 8.800 5.786 8.716 1.00 0.29 H new ATOM 0 HB2 ASN A 135 9.597 3.568 9.385 1.00 0.37 H new ATOM 0 HB3 ASN A 135 11.254 3.997 9.010 1.00 0.37 H new ATOM 0 HD21 ASN A 135 11.917 5.570 12.104 1.00 1.46 H new ATOM 0 HD22 ASN A 135 12.491 5.191 10.476 1.00 1.46 H new ATOM 2122 N ASP A 136 11.789 6.762 7.823 1.00 0.32 N ATOM 2123 CA ASP A 136 12.752 7.844 7.975 1.00 0.37 C ATOM 2124 C ASP A 136 12.472 9.019 7.044 1.00 0.34 C ATOM 2125 O ASP A 136 12.333 10.150 7.502 1.00 0.36 O ATOM 2126 CB ASP A 136 14.180 7.330 7.778 1.00 0.46 C ATOM 2127 CG ASP A 136 14.730 6.670 9.029 1.00 1.19 C ATOM 2128 OD1 ASP A 136 14.159 5.652 9.480 1.00 1.27 O ATOM 2129 OD2 ASP A 136 15.740 7.167 9.569 1.00 2.07 O ATOM 0 H ASP A 136 12.031 6.067 7.117 1.00 0.32 H new ATOM 0 HA ASP A 136 12.645 8.216 8.994 1.00 0.37 H new ATOM 0 HB2 ASP A 136 14.197 6.615 6.955 1.00 0.46 H new ATOM 0 HB3 ASP A 136 14.827 8.160 7.493 1.00 0.46 H new ATOM 2134 N HIS A 137 12.393 8.764 5.744 1.00 0.33 N ATOM 2135 CA HIS A 137 12.283 9.859 4.771 1.00 0.35 C ATOM 2136 C HIS A 137 10.832 10.205 4.433 1.00 0.29 C ATOM 2137 O HIS A 137 10.507 11.369 4.202 1.00 0.32 O ATOM 2138 CB HIS A 137 13.067 9.542 3.489 1.00 0.45 C ATOM 2139 CG HIS A 137 14.555 9.521 3.690 1.00 0.63 C ATOM 2140 ND1 HIS A 137 15.368 8.492 3.259 1.00 1.07 N ATOM 2141 CD2 HIS A 137 15.377 10.417 4.287 1.00 1.53 C ATOM 2142 CE1 HIS A 137 16.620 8.758 3.584 1.00 0.95 C ATOM 2143 NE2 HIS A 137 16.652 9.918 4.208 1.00 1.34 N ATOM 0 H HIS A 137 12.402 7.828 5.338 1.00 0.33 H new ATOM 0 HA HIS A 137 12.722 10.736 5.246 1.00 0.35 H new ATOM 0 HB2 HIS A 137 12.746 8.573 3.106 1.00 0.45 H new ATOM 0 HB3 HIS A 137 12.821 10.283 2.729 1.00 0.45 H new ATOM 0 HD2 HIS A 137 15.083 11.352 4.741 1.00 1.53 H new ATOM 0 HE1 HIS A 137 17.474 8.131 3.374 1.00 0.95 H new ATOM 0 HE2 HIS A 137 17.489 10.371 4.573 1.00 1.34 H new ATOM 2152 N LEU A 138 9.967 9.200 4.407 1.00 0.26 N ATOM 2153 CA LEU A 138 8.585 9.384 3.964 1.00 0.25 C ATOM 2154 C LEU A 138 7.687 9.866 5.106 1.00 0.24 C ATOM 2155 O LEU A 138 6.811 10.710 4.904 1.00 0.25 O ATOM 2156 CB LEU A 138 8.061 8.066 3.393 1.00 0.23 C ATOM 2157 CG LEU A 138 6.700 8.134 2.703 1.00 0.23 C ATOM 2158 CD1 LEU A 138 6.739 9.112 1.541 1.00 0.26 C ATOM 2159 CD2 LEU A 138 6.291 6.751 2.223 1.00 0.22 C ATOM 0 H LEU A 138 10.195 8.246 4.687 1.00 0.26 H new ATOM 0 HA LEU A 138 8.567 10.153 3.192 1.00 0.25 H new ATOM 0 HB2 LEU A 138 8.791 7.686 2.678 1.00 0.23 H new ATOM 0 HB3 LEU A 138 8.000 7.340 4.203 1.00 0.23 H new ATOM 0 HG LEU A 138 5.961 8.489 3.421 1.00 0.23 H new ATOM 0 HD11 LEU A 138 5.761 9.147 1.062 1.00 0.26 H new ATOM 0 HD12 LEU A 138 6.998 10.105 1.909 1.00 0.26 H new ATOM 0 HD13 LEU A 138 7.486 8.787 0.817 1.00 0.26 H new ATOM 0 HD21 LEU A 138 5.319 6.809 1.732 1.00 0.22 H new ATOM 0 HD22 LEU A 138 7.032 6.377 1.517 1.00 0.22 H new ATOM 0 HD23 LEU A 138 6.227 6.074 3.075 1.00 0.22 H new ATOM 2171 N GLU A 139 7.918 9.317 6.296 1.00 0.26 N ATOM 2172 CA GLU A 139 7.175 9.680 7.511 1.00 0.29 C ATOM 2173 C GLU A 139 7.010 11.202 7.684 1.00 0.30 C ATOM 2174 O GLU A 139 5.899 11.660 7.948 1.00 0.30 O ATOM 2175 CB GLU A 139 7.872 9.074 8.736 1.00 0.36 C ATOM 2176 CG GLU A 139 7.264 9.458 10.076 1.00 0.52 C ATOM 2177 CD GLU A 139 5.885 8.874 10.299 1.00 1.00 C ATOM 2178 OE1 GLU A 139 5.726 7.645 10.151 1.00 1.46 O ATOM 2179 OE2 GLU A 139 4.962 9.637 10.646 1.00 1.74 O ATOM 0 H GLU A 139 8.630 8.603 6.451 1.00 0.26 H new ATOM 0 HA GLU A 139 6.169 9.272 7.412 1.00 0.29 H new ATOM 0 HB2 GLU A 139 7.856 7.988 8.644 1.00 0.36 H new ATOM 0 HB3 GLU A 139 8.918 9.379 8.728 1.00 0.36 H new ATOM 0 HG2 GLU A 139 7.925 9.125 10.876 1.00 0.52 H new ATOM 0 HG3 GLU A 139 7.206 10.544 10.142 1.00 0.52 H new ATOM 2186 N PRO A 140 8.093 12.013 7.554 1.00 0.33 N ATOM 2187 CA PRO A 140 8.002 13.474 7.683 1.00 0.36 C ATOM 2188 C PRO A 140 6.873 14.091 6.854 1.00 0.31 C ATOM 2189 O PRO A 140 6.219 15.034 7.299 1.00 0.36 O ATOM 2190 CB PRO A 140 9.359 13.963 7.179 1.00 0.42 C ATOM 2191 CG PRO A 140 10.290 12.847 7.485 1.00 0.42 C ATOM 2192 CD PRO A 140 9.489 11.583 7.316 1.00 0.35 C ATOM 0 HA PRO A 140 7.775 13.764 8.709 1.00 0.36 H new ATOM 0 HB2 PRO A 140 9.333 14.177 6.111 1.00 0.42 H new ATOM 0 HB3 PRO A 140 9.662 14.882 7.681 1.00 0.42 H new ATOM 0 HG2 PRO A 140 11.148 12.859 6.813 1.00 0.42 H new ATOM 0 HG3 PRO A 140 10.679 12.930 8.500 1.00 0.42 H new ATOM 0 HD2 PRO A 140 9.613 11.162 6.318 1.00 0.35 H new ATOM 0 HD3 PRO A 140 9.798 10.816 8.026 1.00 0.35 H new ATOM 2200 N TRP A 141 6.639 13.567 5.654 1.00 0.28 N ATOM 2201 CA TRP A 141 5.569 14.084 4.812 1.00 0.25 C ATOM 2202 C TRP A 141 4.228 13.524 5.273 1.00 0.22 C ATOM 2203 O TRP A 141 3.229 14.245 5.343 1.00 0.22 O ATOM 2204 CB TRP A 141 5.801 13.743 3.332 1.00 0.29 C ATOM 2205 CG TRP A 141 4.824 14.432 2.425 1.00 0.29 C ATOM 2206 CD1 TRP A 141 4.965 15.664 1.855 1.00 0.32 C ATOM 2207 CD2 TRP A 141 3.548 13.937 2.001 1.00 0.30 C ATOM 2208 NE1 TRP A 141 3.855 15.966 1.107 1.00 0.35 N ATOM 2209 CE2 TRP A 141 2.972 14.923 1.179 1.00 0.33 C ATOM 2210 CE3 TRP A 141 2.837 12.757 2.235 1.00 0.31 C ATOM 2211 CZ2 TRP A 141 1.719 14.767 0.595 1.00 0.36 C ATOM 2212 CZ3 TRP A 141 1.595 12.603 1.652 1.00 0.35 C ATOM 2213 CH2 TRP A 141 1.045 13.603 0.841 1.00 0.36 C ATOM 0 H TRP A 141 7.169 12.795 5.248 1.00 0.28 H new ATOM 0 HA TRP A 141 5.562 15.170 4.907 1.00 0.25 H new ATOM 0 HB2 TRP A 141 6.815 14.027 3.051 1.00 0.29 H new ATOM 0 HB3 TRP A 141 5.722 12.665 3.194 1.00 0.29 H new ATOM 0 HD1 TRP A 141 5.824 16.307 1.975 1.00 0.32 H new ATOM 0 HE1 TRP A 141 3.711 16.829 0.582 1.00 0.35 H new ATOM 0 HE3 TRP A 141 3.251 11.980 2.860 1.00 0.31 H new ATOM 0 HZ2 TRP A 141 1.294 15.538 -0.030 1.00 0.36 H new ATOM 0 HZ3 TRP A 141 1.037 11.694 1.825 1.00 0.35 H new ATOM 0 HH2 TRP A 141 0.070 13.452 0.401 1.00 0.36 H new ATOM 2224 N ILE A 142 4.222 12.239 5.604 1.00 0.20 N ATOM 2225 CA ILE A 142 3.015 11.557 6.052 1.00 0.19 C ATOM 2226 C ILE A 142 2.441 12.234 7.296 1.00 0.20 C ATOM 2227 O ILE A 142 1.295 12.691 7.293 1.00 0.20 O ATOM 2228 CB ILE A 142 3.311 10.069 6.354 1.00 0.21 C ATOM 2229 CG1 ILE A 142 3.712 9.335 5.073 1.00 0.21 C ATOM 2230 CG2 ILE A 142 2.108 9.391 6.993 1.00 0.25 C ATOM 2231 CD1 ILE A 142 4.096 7.895 5.302 1.00 0.23 C ATOM 0 H ILE A 142 5.049 11.643 5.570 1.00 0.20 H new ATOM 0 HA ILE A 142 2.279 11.615 5.250 1.00 0.19 H new ATOM 0 HB ILE A 142 4.140 10.027 7.060 1.00 0.21 H new ATOM 0 HG12 ILE A 142 2.883 9.374 4.366 1.00 0.21 H new ATOM 0 HG13 ILE A 142 4.550 9.857 4.611 1.00 0.21 H new ATOM 0 HG21 ILE A 142 2.344 8.346 7.195 1.00 0.25 H new ATOM 0 HG22 ILE A 142 1.861 9.894 7.928 1.00 0.25 H new ATOM 0 HG23 ILE A 142 1.256 9.446 6.315 1.00 0.25 H new ATOM 0 HD11 ILE A 142 4.369 7.436 4.352 1.00 0.23 H new ATOM 0 HD12 ILE A 142 4.945 7.849 5.984 1.00 0.23 H new ATOM 0 HD13 ILE A 142 3.252 7.358 5.736 1.00 0.23 H new ATOM 2243 N GLN A 143 3.254 12.313 8.344 1.00 0.25 N ATOM 2244 CA GLN A 143 2.829 12.883 9.619 1.00 0.30 C ATOM 2245 C GLN A 143 2.401 14.341 9.460 1.00 0.29 C ATOM 2246 O GLN A 143 1.446 14.786 10.097 1.00 0.31 O ATOM 2247 CB GLN A 143 3.963 12.780 10.643 1.00 0.40 C ATOM 2248 CG GLN A 143 3.587 13.276 12.034 1.00 0.51 C ATOM 2249 CD GLN A 143 2.456 12.477 12.659 1.00 0.95 C ATOM 2250 OE1 GLN A 143 2.692 11.482 13.340 1.00 1.51 O ATOM 2251 NE2 GLN A 143 1.220 12.904 12.436 1.00 1.60 N ATOM 0 H GLN A 143 4.220 11.986 8.335 1.00 0.25 H new ATOM 0 HA GLN A 143 1.969 12.315 9.972 1.00 0.30 H new ATOM 0 HB2 GLN A 143 4.283 11.740 10.713 1.00 0.40 H new ATOM 0 HB3 GLN A 143 4.818 13.353 10.283 1.00 0.40 H new ATOM 0 HG2 GLN A 143 4.462 13.225 12.682 1.00 0.51 H new ATOM 0 HG3 GLN A 143 3.295 14.324 11.974 1.00 0.51 H new ATOM 0 HE21 GLN A 143 1.063 13.735 11.865 1.00 1.60 H new ATOM 0 HE22 GLN A 143 0.427 12.402 12.835 1.00 1.60 H new ATOM 2260 N GLU A 144 3.105 15.071 8.598 1.00 0.29 N ATOM 2261 CA GLU A 144 2.804 16.480 8.345 1.00 0.33 C ATOM 2262 C GLU A 144 1.363 16.655 7.865 1.00 0.29 C ATOM 2263 O GLU A 144 0.682 17.610 8.239 1.00 0.35 O ATOM 2264 CB GLU A 144 3.776 17.046 7.304 1.00 0.41 C ATOM 2265 CG GLU A 144 3.530 18.505 6.954 1.00 0.64 C ATOM 2266 CD GLU A 144 3.718 19.429 8.138 1.00 1.09 C ATOM 2267 OE1 GLU A 144 4.882 19.693 8.512 1.00 1.25 O ATOM 2268 OE2 GLU A 144 2.707 19.892 8.704 1.00 1.75 O ATOM 0 H GLU A 144 3.892 14.709 8.060 1.00 0.29 H new ATOM 0 HA GLU A 144 2.921 17.027 9.281 1.00 0.33 H new ATOM 0 HB2 GLU A 144 4.794 16.940 7.678 1.00 0.41 H new ATOM 0 HB3 GLU A 144 3.706 16.449 6.395 1.00 0.41 H new ATOM 0 HG2 GLU A 144 4.209 18.802 6.155 1.00 0.64 H new ATOM 0 HG3 GLU A 144 2.516 18.616 6.569 1.00 0.64 H new ATOM 2275 N ASN A 145 0.893 15.714 7.060 1.00 0.24 N ATOM 2276 CA ASN A 145 -0.453 15.794 6.502 1.00 0.28 C ATOM 2277 C ASN A 145 -1.469 15.090 7.394 1.00 0.30 C ATOM 2278 O ASN A 145 -2.619 14.889 6.998 1.00 0.42 O ATOM 2279 CB ASN A 145 -0.493 15.203 5.086 1.00 0.32 C ATOM 2280 CG ASN A 145 0.213 16.081 4.064 1.00 0.34 C ATOM 2281 OD1 ASN A 145 -0.397 16.969 3.467 1.00 0.40 O ATOM 2282 ND2 ASN A 145 1.497 15.838 3.842 1.00 0.33 N ATOM 0 H ASN A 145 1.420 14.888 6.778 1.00 0.24 H new ATOM 0 HA ASN A 145 -0.722 16.849 6.449 1.00 0.28 H new ATOM 0 HB2 ASN A 145 -0.028 14.217 5.095 1.00 0.32 H new ATOM 0 HB3 ASN A 145 -1.531 15.063 4.784 1.00 0.32 H new ATOM 0 HD21 ASN A 145 2.011 16.395 3.159 1.00 0.33 H new ATOM 0 HD22 ASN A 145 1.971 15.095 4.354 1.00 0.33 H new ATOM 2289 N GLY A 146 -1.048 14.725 8.598 1.00 0.25 N ATOM 2290 CA GLY A 146 -1.959 14.111 9.549 1.00 0.30 C ATOM 2291 C GLY A 146 -1.571 12.690 9.895 1.00 0.30 C ATOM 2292 O GLY A 146 -1.841 12.211 10.999 1.00 0.41 O ATOM 0 H GLY A 146 -0.092 14.842 8.935 1.00 0.25 H new ATOM 0 HA2 GLY A 146 -1.984 14.709 10.460 1.00 0.30 H new ATOM 0 HA3 GLY A 146 -2.968 14.118 9.136 1.00 0.30 H new ATOM 2296 N GLY A 147 -0.933 12.016 8.956 1.00 0.24 N ATOM 2297 CA GLY A 147 -0.539 10.644 9.167 1.00 0.22 C ATOM 2298 C GLY A 147 -1.324 9.699 8.285 1.00 0.19 C ATOM 2299 O GLY A 147 -2.001 10.136 7.351 1.00 0.20 O ATOM 0 H GLY A 147 -0.679 12.398 8.045 1.00 0.24 H new ATOM 0 HA2 GLY A 147 0.526 10.535 8.962 1.00 0.22 H new ATOM 0 HA3 GLY A 147 -0.691 10.378 10.213 1.00 0.22 H new ATOM 2303 N TRP A 148 -1.239 8.409 8.573 1.00 0.20 N ATOM 2304 CA TRP A 148 -1.968 7.406 7.807 1.00 0.21 C ATOM 2305 C TRP A 148 -3.474 7.631 7.876 1.00 0.23 C ATOM 2306 O TRP A 148 -4.191 7.313 6.931 1.00 0.25 O ATOM 2307 CB TRP A 148 -1.645 5.995 8.296 1.00 0.23 C ATOM 2308 CG TRP A 148 -0.273 5.521 7.931 1.00 0.23 C ATOM 2309 CD1 TRP A 148 0.725 5.150 8.786 1.00 0.28 C ATOM 2310 CD2 TRP A 148 0.255 5.365 6.608 1.00 0.22 C ATOM 2311 NE1 TRP A 148 1.831 4.758 8.077 1.00 0.29 N ATOM 2312 CE2 TRP A 148 1.570 4.885 6.740 1.00 0.25 C ATOM 2313 CE3 TRP A 148 -0.259 5.580 5.325 1.00 0.22 C ATOM 2314 CZ2 TRP A 148 2.377 4.614 5.641 1.00 0.26 C ATOM 2315 CZ3 TRP A 148 0.547 5.313 4.234 1.00 0.23 C ATOM 2316 CH2 TRP A 148 1.852 4.832 4.400 1.00 0.24 C ATOM 0 H TRP A 148 -0.672 8.031 9.332 1.00 0.20 H new ATOM 0 HA TRP A 148 -1.646 7.508 6.771 1.00 0.21 H new ATOM 0 HB2 TRP A 148 -1.752 5.964 9.380 1.00 0.23 H new ATOM 0 HB3 TRP A 148 -2.379 5.302 7.884 1.00 0.23 H new ATOM 0 HD1 TRP A 148 0.653 5.163 9.864 1.00 0.28 H new ATOM 0 HE1 TRP A 148 2.707 4.426 8.481 1.00 0.29 H new ATOM 0 HE3 TRP A 148 -1.266 5.947 5.189 1.00 0.22 H new ATOM 0 HZ2 TRP A 148 3.384 4.244 5.765 1.00 0.26 H new ATOM 0 HZ3 TRP A 148 0.164 5.478 3.238 1.00 0.23 H new ATOM 0 HH2 TRP A 148 2.456 4.629 3.528 1.00 0.24 H new ATOM 2327 N ASP A 149 -3.947 8.192 8.990 1.00 0.26 N ATOM 2328 CA ASP A 149 -5.380 8.442 9.187 1.00 0.31 C ATOM 2329 C ASP A 149 -5.969 9.231 8.025 1.00 0.30 C ATOM 2330 O ASP A 149 -7.104 8.992 7.613 1.00 0.37 O ATOM 2331 CB ASP A 149 -5.636 9.196 10.497 1.00 0.40 C ATOM 2332 CG ASP A 149 -5.383 8.343 11.719 1.00 1.24 C ATOM 2333 OD1 ASP A 149 -6.252 7.513 12.063 1.00 1.96 O ATOM 2334 OD2 ASP A 149 -4.314 8.498 12.346 1.00 1.94 O ATOM 0 H ASP A 149 -3.360 8.483 9.772 1.00 0.26 H new ATOM 0 HA ASP A 149 -5.869 7.469 9.236 1.00 0.31 H new ATOM 0 HB2 ASP A 149 -4.996 10.078 10.535 1.00 0.40 H new ATOM 0 HB3 ASP A 149 -6.667 9.550 10.513 1.00 0.40 H new ATOM 2339 N THR A 150 -5.186 10.156 7.492 1.00 0.27 N ATOM 2340 CA THR A 150 -5.607 10.967 6.363 1.00 0.29 C ATOM 2341 C THR A 150 -5.779 10.092 5.123 1.00 0.28 C ATOM 2342 O THR A 150 -6.816 10.125 4.457 1.00 0.33 O ATOM 2343 CB THR A 150 -4.559 12.055 6.080 1.00 0.33 C ATOM 2344 OG1 THR A 150 -4.218 12.720 7.302 1.00 0.38 O ATOM 2345 CG2 THR A 150 -5.077 13.067 5.072 1.00 0.37 C ATOM 0 H THR A 150 -4.246 10.364 7.828 1.00 0.27 H new ATOM 0 HA THR A 150 -6.560 11.437 6.606 1.00 0.29 H new ATOM 0 HB THR A 150 -3.674 11.579 5.658 1.00 0.33 H new ATOM 0 HG1 THR A 150 -3.590 13.448 7.114 1.00 0.38 H new ATOM 0 HG21 THR A 150 -4.314 13.824 4.892 1.00 0.37 H new ATOM 0 HG22 THR A 150 -5.313 12.560 4.136 1.00 0.37 H new ATOM 0 HG23 THR A 150 -5.976 13.543 5.464 1.00 0.37 H new ATOM 2353 N PHE A 151 -4.759 9.293 4.840 1.00 0.24 N ATOM 2354 CA PHE A 151 -4.751 8.433 3.668 1.00 0.25 C ATOM 2355 C PHE A 151 -5.862 7.385 3.751 1.00 0.26 C ATOM 2356 O PHE A 151 -6.528 7.090 2.755 1.00 0.30 O ATOM 2357 CB PHE A 151 -3.384 7.753 3.537 1.00 0.25 C ATOM 2358 CG PHE A 151 -3.252 6.887 2.320 1.00 0.27 C ATOM 2359 CD1 PHE A 151 -3.273 7.441 1.053 1.00 0.39 C ATOM 2360 CD2 PHE A 151 -3.100 5.518 2.445 1.00 0.26 C ATOM 2361 CE1 PHE A 151 -3.144 6.645 -0.065 1.00 0.43 C ATOM 2362 CE2 PHE A 151 -2.973 4.717 1.331 1.00 0.28 C ATOM 2363 CZ PHE A 151 -3.023 5.292 0.062 1.00 0.34 C ATOM 0 H PHE A 151 -3.919 9.224 5.414 1.00 0.24 H new ATOM 0 HA PHE A 151 -4.934 9.045 2.785 1.00 0.25 H new ATOM 0 HB2 PHE A 151 -2.609 8.519 3.512 1.00 0.25 H new ATOM 0 HB3 PHE A 151 -3.204 7.146 4.424 1.00 0.25 H new ATOM 0 HD1 PHE A 151 -3.392 8.508 0.938 1.00 0.39 H new ATOM 0 HD2 PHE A 151 -3.081 5.071 3.428 1.00 0.26 H new ATOM 0 HE1 PHE A 151 -3.139 7.095 -1.047 1.00 0.43 H new ATOM 0 HE2 PHE A 151 -2.836 3.651 1.440 1.00 0.28 H new ATOM 0 HZ PHE A 151 -2.966 4.668 -0.818 1.00 0.34 H new ATOM 2373 N VAL A 152 -6.073 6.847 4.947 1.00 0.25 N ATOM 2374 CA VAL A 152 -7.091 5.827 5.160 1.00 0.29 C ATOM 2375 C VAL A 152 -8.495 6.411 5.020 1.00 0.35 C ATOM 2376 O VAL A 152 -9.442 5.702 4.690 1.00 0.45 O ATOM 2377 CB VAL A 152 -6.932 5.156 6.539 1.00 0.29 C ATOM 2378 CG1 VAL A 152 -7.982 4.077 6.746 1.00 0.35 C ATOM 2379 CG2 VAL A 152 -5.541 4.567 6.677 1.00 0.28 C ATOM 0 H VAL A 152 -5.551 7.102 5.785 1.00 0.25 H new ATOM 0 HA VAL A 152 -6.953 5.068 4.390 1.00 0.29 H new ATOM 0 HB VAL A 152 -7.073 5.918 7.306 1.00 0.29 H new ATOM 0 HG11 VAL A 152 -7.846 3.621 7.726 1.00 0.35 H new ATOM 0 HG12 VAL A 152 -8.976 4.520 6.687 1.00 0.35 H new ATOM 0 HG13 VAL A 152 -7.878 3.315 5.974 1.00 0.35 H new ATOM 0 HG21 VAL A 152 -5.441 4.096 7.655 1.00 0.28 H new ATOM 0 HG22 VAL A 152 -5.382 3.822 5.897 1.00 0.28 H new ATOM 0 HG23 VAL A 152 -4.799 5.359 6.578 1.00 0.28 H new ATOM 2389 N GLU A 153 -8.630 7.706 5.265 1.00 0.37 N ATOM 2390 CA GLU A 153 -9.906 8.377 5.061 1.00 0.46 C ATOM 2391 C GLU A 153 -10.194 8.512 3.568 1.00 0.51 C ATOM 2392 O GLU A 153 -11.313 8.270 3.114 1.00 0.62 O ATOM 2393 CB GLU A 153 -9.909 9.763 5.708 1.00 0.52 C ATOM 2394 CG GLU A 153 -11.279 10.421 5.696 1.00 0.70 C ATOM 2395 CD GLU A 153 -11.225 11.909 5.958 1.00 1.35 C ATOM 2396 OE1 GLU A 153 -10.942 12.300 7.111 1.00 1.42 O ATOM 2397 OE2 GLU A 153 -11.454 12.695 5.017 1.00 2.17 O ATOM 0 H GLU A 153 -7.879 8.309 5.602 1.00 0.37 H new ATOM 0 HA GLU A 153 -10.682 7.773 5.531 1.00 0.46 H new ATOM 0 HB2 GLU A 153 -9.562 9.678 6.738 1.00 0.52 H new ATOM 0 HB3 GLU A 153 -9.200 10.404 5.184 1.00 0.52 H new ATOM 0 HG2 GLU A 153 -11.751 10.245 4.729 1.00 0.70 H new ATOM 0 HG3 GLU A 153 -11.909 9.948 6.449 1.00 0.70 H new ATOM 2404 N LEU A 154 -9.166 8.880 2.809 1.00 0.50 N ATOM 2405 CA LEU A 154 -9.306 9.122 1.374 1.00 0.59 C ATOM 2406 C LEU A 154 -9.766 7.866 0.635 1.00 0.68 C ATOM 2407 O LEU A 154 -10.580 7.943 -0.285 1.00 0.74 O ATOM 2408 CB LEU A 154 -7.984 9.622 0.783 1.00 0.65 C ATOM 2409 CG LEU A 154 -7.468 10.939 1.367 1.00 0.64 C ATOM 2410 CD1 LEU A 154 -6.098 11.267 0.798 1.00 0.75 C ATOM 2411 CD2 LEU A 154 -8.446 12.070 1.084 1.00 0.67 C ATOM 0 H LEU A 154 -8.220 9.018 3.166 1.00 0.50 H new ATOM 0 HA LEU A 154 -10.069 9.889 1.244 1.00 0.59 H new ATOM 0 HB2 LEU A 154 -7.224 8.855 0.931 1.00 0.65 H new ATOM 0 HB3 LEU A 154 -8.108 9.744 -0.293 1.00 0.65 H new ATOM 0 HG LEU A 154 -7.378 10.826 2.447 1.00 0.64 H new ATOM 0 HD11 LEU A 154 -5.743 12.206 1.222 1.00 0.75 H new ATOM 0 HD12 LEU A 154 -5.399 10.469 1.049 1.00 0.75 H new ATOM 0 HD13 LEU A 154 -6.167 11.361 -0.286 1.00 0.75 H new ATOM 0 HD21 LEU A 154 -8.061 12.998 1.507 1.00 0.67 H new ATOM 0 HD22 LEU A 154 -8.567 12.185 0.007 1.00 0.67 H new ATOM 0 HD23 LEU A 154 -9.411 11.838 1.535 1.00 0.67 H new ATOM 2444 N GLY A 156 -11.081 5.269 2.342 1.00 0.89 N ATOM 2445 CA GLY A 156 -11.928 4.575 3.295 1.00 1.02 C ATOM 2446 C GLY A 156 -13.305 4.283 2.737 1.00 1.11 C ATOM 2447 O GLY A 156 -13.853 5.084 1.980 1.00 1.68 O ATOM 0 HA2 GLY A 156 -11.451 3.639 3.587 1.00 1.02 H new ATOM 0 HA3 GLY A 156 -12.025 5.178 4.198 1.00 1.02 H new ATOM 2451 N ASN A 157 -13.862 3.141 3.117 1.00 1.62 N ATOM 2452 CA ASN A 157 -15.159 2.702 2.605 1.00 2.05 C ATOM 2453 C ASN A 157 -16.291 3.492 3.249 1.00 2.33 C ATOM 2454 O ASN A 157 -17.123 4.084 2.558 1.00 2.52 O ATOM 2455 CB ASN A 157 -15.365 1.206 2.866 1.00 3.21 C ATOM 2456 CG ASN A 157 -14.245 0.347 2.308 1.00 3.90 C ATOM 2457 OD1 ASN A 157 -13.930 -0.711 2.856 1.00 4.30 O ATOM 2458 ND2 ASN A 157 -13.638 0.789 1.219 1.00 4.60 N ATOM 0 H ASN A 157 -13.435 2.496 3.782 1.00 1.62 H new ATOM 0 HA ASN A 157 -15.170 2.881 1.530 1.00 2.05 H new ATOM 0 HB2 ASN A 157 -15.444 1.038 3.940 1.00 3.21 H new ATOM 0 HB3 ASN A 157 -16.311 0.892 2.424 1.00 3.21 H new ATOM 0 HD21 ASN A 157 -12.880 0.249 0.803 1.00 4.60 H new ATOM 0 HD22 ASN A 157 -13.928 1.670 0.795 1.00 4.60 H new ATOM 2465 N ASN A 158 -16.313 3.507 4.578 1.00 2.99 N ATOM 2466 CA ASN A 158 -17.346 4.225 5.322 1.00 4.03 C ATOM 2467 C ASN A 158 -17.238 5.718 5.060 1.00 4.18 C ATOM 2468 O ASN A 158 -18.249 6.419 4.955 1.00 4.81 O ATOM 2469 CB ASN A 158 -17.231 3.953 6.829 1.00 5.08 C ATOM 2470 CG ASN A 158 -17.572 2.521 7.208 1.00 5.98 C ATOM 2471 OD1 ASN A 158 -17.375 1.592 6.428 1.00 6.22 O ATOM 2472 ND2 ASN A 158 -18.092 2.334 8.411 1.00 6.76 N ATOM 0 H ASN A 158 -15.627 3.030 5.164 1.00 2.99 H new ATOM 0 HA ASN A 158 -18.317 3.867 4.980 1.00 4.03 H new ATOM 0 HB2 ASN A 158 -16.215 4.176 7.155 1.00 5.08 H new ATOM 0 HB3 ASN A 158 -17.894 4.632 7.366 1.00 5.08 H new ATOM 0 HD21 ASN A 158 -18.343 1.394 8.717 1.00 6.76 H new ATOM 0 HD22 ASN A 158 -18.241 3.130 9.031 1.00 6.76 H new ATOM 2479 N ALA A 159 -16.004 6.197 4.949 1.00 3.95 N ATOM 2480 CA ALA A 159 -15.748 7.589 4.624 1.00 4.72 C ATOM 2481 C ALA A 159 -16.283 7.921 3.237 1.00 4.66 C ATOM 2482 O ALA A 159 -16.934 8.947 3.047 1.00 5.63 O ATOM 2483 CB ALA A 159 -14.260 7.888 4.705 1.00 4.78 C ATOM 0 H ALA A 159 -15.163 5.635 5.081 1.00 3.95 H new ATOM 0 HA ALA A 159 -16.266 8.214 5.351 1.00 4.72 H new ATOM 0 HB1 ALA A 159 -14.085 8.935 4.459 1.00 4.78 H new ATOM 0 HB2 ALA A 159 -13.903 7.689 5.716 1.00 4.78 H new ATOM 0 HB3 ALA A 159 -13.723 7.255 3.999 1.00 4.78 H new ATOM 2489 N ALA A 160 -16.023 7.034 2.278 1.00 3.75 N ATOM 2490 CA ALA A 160 -16.491 7.220 0.906 1.00 4.08 C ATOM 2491 C ALA A 160 -18.006 7.343 0.859 1.00 4.33 C ATOM 2492 O ALA A 160 -18.545 8.142 0.098 1.00 5.11 O ATOM 2493 CB ALA A 160 -16.034 6.070 0.020 1.00 3.59 C ATOM 0 H ALA A 160 -15.489 6.177 2.427 1.00 3.75 H new ATOM 0 HA ALA A 160 -16.057 8.146 0.530 1.00 4.08 H new ATOM 0 HB1 ALA A 160 -16.393 6.229 -0.997 1.00 3.59 H new ATOM 0 HB2 ALA A 160 -14.945 6.024 0.017 1.00 3.59 H new ATOM 0 HB3 ALA A 160 -16.436 5.133 0.404 1.00 3.59 H new ATOM 2499 N ALA A 161 -18.685 6.555 1.688 1.00 3.93 N ATOM 2500 CA ALA A 161 -20.142 6.589 1.765 1.00 4.43 C ATOM 2501 C ALA A 161 -20.641 7.985 2.136 1.00 5.54 C ATOM 2502 O ALA A 161 -21.680 8.432 1.651 1.00 6.11 O ATOM 2503 CB ALA A 161 -20.641 5.558 2.766 1.00 4.39 C ATOM 0 H ALA A 161 -18.247 5.883 2.318 1.00 3.93 H new ATOM 0 HA ALA A 161 -20.541 6.343 0.781 1.00 4.43 H new ATOM 0 HB1 ALA A 161 -21.729 5.594 2.814 1.00 4.39 H new ATOM 0 HB2 ALA A 161 -20.324 4.563 2.452 1.00 4.39 H new ATOM 0 HB3 ALA A 161 -20.227 5.777 3.750 1.00 4.39 H new ATOM 2509 N GLU A 162 -19.888 8.676 2.981 1.00 5.98 N ATOM 2510 CA GLU A 162 -20.242 10.027 3.393 1.00 7.23 C ATOM 2511 C GLU A 162 -19.747 11.046 2.372 1.00 7.80 C ATOM 2512 O GLU A 162 -20.381 12.077 2.152 1.00 8.75 O ATOM 2513 CB GLU A 162 -19.660 10.330 4.772 1.00 7.72 C ATOM 2514 CG GLU A 162 -20.262 9.482 5.877 1.00 7.99 C ATOM 2515 CD GLU A 162 -21.736 9.763 6.087 1.00 8.68 C ATOM 2516 OE1 GLU A 162 -22.565 9.158 5.372 1.00 9.03 O ATOM 2517 OE2 GLU A 162 -22.075 10.590 6.963 1.00 9.09 O ATOM 0 H GLU A 162 -19.026 8.322 3.395 1.00 5.98 H new ATOM 0 HA GLU A 162 -21.328 10.097 3.450 1.00 7.23 H new ATOM 0 HB2 GLU A 162 -18.582 10.170 4.747 1.00 7.72 H new ATOM 0 HB3 GLU A 162 -19.821 11.383 5.003 1.00 7.72 H new ATOM 0 HG2 GLU A 162 -20.127 8.428 5.636 1.00 7.99 H new ATOM 0 HG3 GLU A 162 -19.724 9.667 6.807 1.00 7.99 H new ATOM 2524 N SER A 163 -18.619 10.742 1.741 1.00 7.39 N ATOM 2525 CA SER A 163 -18.058 11.601 0.710 1.00 8.21 C ATOM 2526 C SER A 163 -18.887 11.533 -0.572 1.00 8.28 C ATOM 2527 O SER A 163 -18.714 12.348 -1.476 1.00 9.15 O ATOM 2528 CB SER A 163 -16.614 11.198 0.418 1.00 8.03 C ATOM 2529 OG SER A 163 -15.835 11.210 1.603 1.00 7.86 O ATOM 0 H SER A 163 -18.073 9.901 1.928 1.00 7.39 H new ATOM 0 HA SER A 163 -18.078 12.627 1.077 1.00 8.21 H new ATOM 0 HB2 SER A 163 -16.593 10.203 -0.026 1.00 8.03 H new ATOM 0 HB3 SER A 163 -16.182 11.882 -0.313 1.00 8.03 H new ATOM 0 HG SER A 163 -16.129 10.486 2.195 1.00 7.86 H new ATOM 2535 N ARG A 164 -19.791 10.558 -0.642 1.00 7.47 N ATOM 2536 CA ARG A 164 -20.680 10.414 -1.789 1.00 7.60 C ATOM 2537 C ARG A 164 -21.540 11.655 -1.972 1.00 8.33 C ATOM 2538 O ARG A 164 -21.987 11.946 -3.078 1.00 8.87 O ATOM 2539 CB ARG A 164 -21.568 9.178 -1.643 1.00 6.69 C ATOM 2540 CG ARG A 164 -20.826 7.868 -1.847 1.00 6.19 C ATOM 2541 CD ARG A 164 -21.737 6.675 -1.626 1.00 5.74 C ATOM 2542 NE ARG A 164 -21.027 5.404 -1.764 1.00 5.66 N ATOM 2543 CZ ARG A 164 -21.340 4.302 -1.083 1.00 5.62 C ATOM 2544 NH1 ARG A 164 -22.347 4.321 -0.217 1.00 5.62 N ATOM 2545 NH2 ARG A 164 -20.650 3.185 -1.268 1.00 6.02 N ATOM 0 H ARG A 164 -19.926 9.855 0.085 1.00 7.47 H new ATOM 0 HA ARG A 164 -20.056 10.290 -2.674 1.00 7.60 H new ATOM 0 HB2 ARG A 164 -22.019 9.180 -0.650 1.00 6.69 H new ATOM 0 HB3 ARG A 164 -22.384 9.240 -2.363 1.00 6.69 H new ATOM 0 HG2 ARG A 164 -20.417 7.833 -2.857 1.00 6.19 H new ATOM 0 HG3 ARG A 164 -19.982 7.815 -1.159 1.00 6.19 H new ATOM 0 HD2 ARG A 164 -22.178 6.736 -0.631 1.00 5.74 H new ATOM 0 HD3 ARG A 164 -22.558 6.710 -2.342 1.00 5.74 H new ATOM 0 HE ARG A 164 -20.247 5.358 -2.420 1.00 5.66 H new ATOM 0 HH11 ARG A 164 -22.880 5.179 -0.074 1.00 5.62 H new ATOM 0 HH12 ARG A 164 -22.587 3.478 0.305 1.00 5.62 H new ATOM 0 HH21 ARG A 164 -19.877 3.167 -1.933 1.00 6.02 H new ATOM 0 HH22 ARG A 164 -20.892 2.343 -0.745 1.00 6.02 H new ATOM 2559 N LYS A 165 -21.754 12.392 -0.887 1.00 8.52 N ATOM 2560 CA LYS A 165 -22.488 13.651 -0.945 1.00 9.41 C ATOM 2561 C LYS A 165 -21.752 14.643 -1.843 1.00 10.47 C ATOM 2562 O LYS A 165 -22.362 15.332 -2.665 1.00 11.24 O ATOM 2563 CB LYS A 165 -22.661 14.230 0.460 1.00 9.61 C ATOM 2564 CG LYS A 165 -23.447 13.324 1.394 1.00 9.69 C ATOM 2565 CD LYS A 165 -23.504 13.887 2.804 1.00 10.12 C ATOM 2566 CE LYS A 165 -24.270 12.964 3.740 1.00 10.34 C ATOM 2567 NZ LYS A 165 -24.277 13.469 5.135 1.00 10.42 N ATOM 0 H LYS A 165 -21.428 12.138 0.046 1.00 8.52 H new ATOM 0 HA LYS A 165 -23.476 13.464 -1.365 1.00 9.41 H new ATOM 0 HB2 LYS A 165 -21.678 14.418 0.891 1.00 9.61 H new ATOM 0 HB3 LYS A 165 -23.167 15.193 0.388 1.00 9.61 H new ATOM 0 HG2 LYS A 165 -24.460 13.197 1.011 1.00 9.69 H new ATOM 0 HG3 LYS A 165 -22.988 12.336 1.415 1.00 9.69 H new ATOM 0 HD2 LYS A 165 -22.491 14.031 3.181 1.00 10.12 H new ATOM 0 HD3 LYS A 165 -23.980 14.867 2.787 1.00 10.12 H new ATOM 0 HE2 LYS A 165 -25.296 12.860 3.387 1.00 10.34 H new ATOM 0 HE3 LYS A 165 -23.822 11.971 3.716 1.00 10.34 H new ATOM 0 HZ1 LYS A 165 -24.809 12.811 5.740 1.00 10.42 H new ATOM 0 HZ2 LYS A 165 -23.299 13.544 5.482 1.00 10.42 H new ATOM 0 HZ3 LYS A 165 -24.727 14.406 5.163 1.00 10.42 H new ATOM 2581 N GLY A 166 -20.433 14.694 -1.691 1.00 10.61 N ATOM 2582 CA GLY A 166 -19.616 15.518 -2.555 1.00 11.72 C ATOM 2583 C GLY A 166 -19.372 14.849 -3.893 1.00 12.02 C ATOM 2584 O GLY A 166 -19.193 15.520 -4.910 1.00 13.02 O ATOM 0 H GLY A 166 -19.916 14.176 -0.981 1.00 10.61 H new ATOM 0 HA2 GLY A 166 -20.105 16.479 -2.712 1.00 11.72 H new ATOM 0 HA3 GLY A 166 -18.662 15.721 -2.069 1.00 11.72 H new ATOM 2588 N GLN A 167 -19.365 13.522 -3.890 1.00 11.25 N ATOM 2589 CA GLN A 167 -19.200 12.744 -5.116 1.00 11.64 C ATOM 2590 C GLN A 167 -20.350 13.023 -6.082 1.00 12.01 C ATOM 2591 O GLN A 167 -20.151 13.081 -7.296 1.00 12.84 O ATOM 2592 CB GLN A 167 -19.118 11.245 -4.800 1.00 10.86 C ATOM 2593 CG GLN A 167 -18.975 10.362 -6.029 1.00 11.50 C ATOM 2594 CD GLN A 167 -18.913 8.889 -5.684 1.00 11.89 C ATOM 2595 OE1 GLN A 167 -18.424 8.504 -4.621 1.00 11.87 O ATOM 2596 NE2 GLN A 167 -19.419 8.055 -6.576 1.00 12.41 N ATOM 0 H GLN A 167 -19.472 12.957 -3.048 1.00 11.25 H new ATOM 0 HA GLN A 167 -18.266 13.045 -5.590 1.00 11.64 H new ATOM 0 HB2 GLN A 167 -18.270 11.069 -4.138 1.00 10.86 H new ATOM 0 HB3 GLN A 167 -20.014 10.949 -4.255 1.00 10.86 H new ATOM 0 HG2 GLN A 167 -19.816 10.539 -6.699 1.00 11.50 H new ATOM 0 HG3 GLN A 167 -18.072 10.643 -6.570 1.00 11.50 H new ATOM 0 HE21 GLN A 167 -19.815 8.415 -7.444 1.00 12.41 H new ATOM 0 HE22 GLN A 167 -19.414 7.051 -6.396 1.00 12.41 H new ATOM 2605 N GLU A 168 -21.549 13.214 -5.533 1.00 11.51 N ATOM 2606 CA GLU A 168 -22.707 13.605 -6.331 1.00 11.94 C ATOM 2607 C GLU A 168 -22.415 14.894 -7.087 1.00 13.03 C ATOM 2608 O GLU A 168 -22.807 15.057 -8.238 1.00 13.73 O ATOM 2609 CB GLU A 168 -23.933 13.805 -5.437 1.00 11.38 C ATOM 2610 CG GLU A 168 -24.446 12.528 -4.793 1.00 10.85 C ATOM 2611 CD GLU A 168 -25.056 11.571 -5.794 1.00 10.80 C ATOM 2612 OE1 GLU A 168 -24.296 10.821 -6.438 1.00 10.74 O ATOM 2613 OE2 GLU A 168 -26.294 11.568 -5.945 1.00 10.98 O ATOM 0 H GLU A 168 -21.742 13.104 -4.538 1.00 11.51 H new ATOM 0 HA GLU A 168 -22.914 12.807 -7.044 1.00 11.94 H new ATOM 0 HB2 GLU A 168 -23.685 14.520 -4.653 1.00 11.38 H new ATOM 0 HB3 GLU A 168 -24.734 14.247 -6.030 1.00 11.38 H new ATOM 0 HG2 GLU A 168 -23.625 12.032 -4.276 1.00 10.85 H new ATOM 0 HG3 GLU A 168 -25.191 12.781 -4.038 1.00 10.85 H new