USER MOD reduce.3.24.130724 H: found=0, std=0, add=902, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 904 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 Single : A 219 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 221 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 222 ASN : amide:sc= -0.406 K(o=-0.41,f=-3.8!) USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD Single : A 227 TYR OH : rot 0:sc= -0.756 USER MOD Single : A 230 SER OG : rot -25:sc= 0.297 USER MOD Single : A 236 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.027) USER MOD Single : A 240 LYS NZ :NH3+ -161:sc= -0.062 (180deg=-0.708) USER MOD Single : A 244 LYS NZ :NH3+ 163:sc= -0.568 (180deg=-1.22) USER MOD Single : A 252 GLN :FLIP amide:sc= 0 F(o=-3.1!,f=0) USER MOD Single : A 254 ASN : amide:sc= -0.745 K(o=-0.75,f=-3.4!) USER MOD Single : A 255 SER OG : rot 180:sc= 0 USER MOD Single : A 258 LYS NZ :NH3+ 158:sc= -0.444 (180deg=-1.17) USER MOD Single : A 264 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 266 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 219 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 221 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 222 ASN : amide:sc= -0.332 K(o=-0.33,f=-3.9!) USER MOD Single : B 226 TYR OH : rot 180:sc= 0 USER MOD Single : B 227 TYR OH : rot 0:sc= -0.748 USER MOD Single : B 230 SER OG : rot -33:sc= 0.373 USER MOD Single : B 236 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0244) USER MOD Single : B 240 LYS NZ :NH3+ -161:sc= -0.0712 (180deg=-0.669) USER MOD Single : B 244 LYS NZ :NH3+ 162:sc= -0.541 (180deg=-1.18) USER MOD Single : B 252 GLN :FLIP amide:sc= 0 F(o=-3.1!,f=0) USER MOD Single : B 254 ASN : amide:sc= -0.668 K(o=-0.67,f=-3.6!) USER MOD Single : B 255 SER OG : rot 180:sc= 0 USER MOD Single : B 258 LYS NZ :NH3+ 159:sc= -0.479 (180deg=-1.16) USER MOD Single : B 264 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 266 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 219 1.082 16.675 -2.476 1.00 1.77 N ATOM 2 CA MET A 219 1.090 17.823 -3.427 1.00 1.15 C ATOM 3 C MET A 219 1.025 17.300 -4.863 1.00 1.04 C ATOM 4 O MET A 219 1.362 17.996 -5.800 1.00 1.10 O ATOM 5 CB MET A 219 2.373 18.637 -3.238 1.00 1.82 C ATOM 6 CG MET A 219 3.590 17.727 -3.415 1.00 2.31 C ATOM 7 SD MET A 219 5.082 18.610 -2.899 1.00 3.45 S ATOM 8 CE MET A 219 6.099 17.153 -2.558 1.00 3.82 C ATOM 0 HA MET A 219 0.226 18.458 -3.233 1.00 1.15 H new ATOM 0 HB2 MET A 219 2.408 19.452 -3.961 1.00 1.82 H new ATOM 0 HB3 MET A 219 2.386 19.089 -2.246 1.00 1.82 H new ATOM 0 HG2 MET A 219 3.468 16.820 -2.823 1.00 2.31 H new ATOM 0 HG3 MET A 219 3.679 17.419 -4.457 1.00 2.31 H new ATOM 0 HE1 MET A 219 7.085 17.469 -2.218 1.00 3.82 H new ATOM 0 HE2 MET A 219 5.624 16.551 -1.783 1.00 3.82 H new ATOM 0 HE3 MET A 219 6.201 16.560 -3.467 1.00 3.82 H new ATOM 18 N ILE A 220 0.594 16.081 -5.046 1.00 0.98 N ATOM 19 CA ILE A 220 0.508 15.520 -6.423 1.00 0.97 C ATOM 20 C ILE A 220 -0.794 15.978 -7.078 1.00 0.94 C ATOM 21 O ILE A 220 -1.827 16.064 -6.445 1.00 1.01 O ATOM 22 CB ILE A 220 0.534 13.991 -6.364 1.00 1.03 C ATOM 23 CG1 ILE A 220 -0.456 13.480 -5.292 1.00 1.35 C ATOM 24 CG2 ILE A 220 1.953 13.527 -6.029 1.00 1.78 C ATOM 25 CD1 ILE A 220 -0.967 12.090 -5.683 1.00 2.08 C ATOM 0 H ILE A 220 0.298 15.450 -4.301 1.00 0.98 H new ATOM 0 HA ILE A 220 1.358 15.873 -7.007 1.00 0.97 H new ATOM 0 HB ILE A 220 0.235 13.587 -7.331 1.00 1.03 H new ATOM 0 HG12 ILE A 220 0.035 13.437 -4.320 1.00 1.35 H new ATOM 0 HG13 ILE A 220 -1.293 14.172 -5.196 1.00 1.35 H new ATOM 0 HG21 ILE A 220 1.979 12.438 -5.985 1.00 1.78 H new ATOM 0 HG22 ILE A 220 2.641 13.876 -6.799 1.00 1.78 H new ATOM 0 HG23 ILE A 220 2.251 13.936 -5.064 1.00 1.78 H new ATOM 0 HD11 ILE A 220 -1.665 11.732 -4.926 1.00 2.08 H new ATOM 0 HD12 ILE A 220 -1.475 12.147 -6.646 1.00 2.08 H new ATOM 0 HD13 ILE A 220 -0.126 11.400 -5.756 1.00 2.08 H new ATOM 37 N GLN A 221 -0.751 16.288 -8.342 1.00 0.90 N ATOM 38 CA GLN A 221 -1.982 16.751 -9.042 1.00 0.92 C ATOM 39 C GLN A 221 -2.769 15.540 -9.544 1.00 0.83 C ATOM 40 O GLN A 221 -2.940 14.563 -8.842 1.00 0.85 O ATOM 41 CB GLN A 221 -1.582 17.633 -10.226 1.00 1.00 C ATOM 42 CG GLN A 221 -0.509 18.625 -9.773 1.00 1.28 C ATOM 43 CD GLN A 221 -0.130 19.537 -10.941 1.00 1.61 C ATOM 44 OE1 GLN A 221 0.895 19.350 -11.566 1.00 2.08 O ATOM 45 NE2 GLN A 221 -0.921 20.523 -11.268 1.00 2.17 N ATOM 0 H GLN A 221 0.086 16.241 -8.923 1.00 0.90 H new ATOM 0 HA GLN A 221 -2.605 17.323 -8.354 1.00 0.92 H new ATOM 0 HB2 GLN A 221 -1.204 17.017 -11.042 1.00 1.00 H new ATOM 0 HB3 GLN A 221 -2.452 18.168 -10.607 1.00 1.00 H new ATOM 0 HG2 GLN A 221 -0.879 19.220 -8.938 1.00 1.28 H new ATOM 0 HG3 GLN A 221 0.370 18.088 -9.417 1.00 1.28 H new ATOM 0 HE21 GLN A 221 -1.782 20.681 -10.744 1.00 2.17 H new ATOM 0 HE22 GLN A 221 -0.678 21.135 -12.047 1.00 2.17 H new ATOM 54 N ASN A 222 -3.244 15.591 -10.762 1.00 0.78 N ATOM 55 CA ASN A 222 -4.016 14.439 -11.319 1.00 0.73 C ATOM 56 C ASN A 222 -3.063 13.526 -12.091 1.00 0.63 C ATOM 57 O ASN A 222 -2.556 13.885 -13.137 1.00 0.65 O ATOM 58 CB ASN A 222 -5.098 14.963 -12.265 1.00 0.80 C ATOM 59 CG ASN A 222 -5.994 15.950 -11.516 1.00 0.93 C ATOM 60 OD1 ASN A 222 -5.807 16.189 -10.340 1.00 1.48 O ATOM 61 ND2 ASN A 222 -6.970 16.538 -12.153 1.00 1.39 N ATOM 0 H ASN A 222 -3.130 16.382 -11.396 1.00 0.78 H new ATOM 0 HA ASN A 222 -4.484 13.881 -10.508 1.00 0.73 H new ATOM 0 HB2 ASN A 222 -4.639 15.452 -13.125 1.00 0.80 H new ATOM 0 HB3 ASN A 222 -5.693 14.134 -12.649 1.00 0.80 H new ATOM 0 HD21 ASN A 222 -7.575 17.197 -11.663 1.00 1.39 H new ATOM 0 HD22 ASN A 222 -7.128 16.338 -13.141 1.00 1.39 H new ATOM 68 N PHE A 223 -2.813 12.350 -11.577 1.00 0.55 N ATOM 69 CA PHE A 223 -1.888 11.393 -12.261 1.00 0.46 C ATOM 70 C PHE A 223 -2.527 10.004 -12.292 1.00 0.39 C ATOM 71 O PHE A 223 -3.110 9.557 -11.323 1.00 0.38 O ATOM 72 CB PHE A 223 -0.564 11.322 -11.481 1.00 0.46 C ATOM 73 CG PHE A 223 0.310 12.501 -11.838 1.00 0.53 C ATOM 74 CD1 PHE A 223 1.119 12.448 -12.989 1.00 0.54 C ATOM 75 CD2 PHE A 223 0.321 13.646 -11.021 1.00 0.64 C ATOM 76 CE1 PHE A 223 1.938 13.543 -13.324 1.00 0.64 C ATOM 77 CE2 PHE A 223 1.142 14.741 -11.355 1.00 0.72 C ATOM 78 CZ PHE A 223 1.950 14.689 -12.506 1.00 0.71 C ATOM 0 H PHE A 223 -3.213 12.007 -10.704 1.00 0.55 H new ATOM 0 HA PHE A 223 -1.699 11.733 -13.279 1.00 0.46 H new ATOM 0 HB2 PHE A 223 -0.764 11.318 -10.409 1.00 0.46 H new ATOM 0 HB3 PHE A 223 -0.046 10.391 -11.712 1.00 0.46 H new ATOM 0 HD1 PHE A 223 1.111 11.568 -13.615 1.00 0.54 H new ATOM 0 HD2 PHE A 223 -0.300 13.686 -10.138 1.00 0.64 H new ATOM 0 HE1 PHE A 223 2.557 13.504 -14.208 1.00 0.64 H new ATOM 0 HE2 PHE A 223 1.151 15.620 -10.728 1.00 0.72 H new ATOM 0 HZ PHE A 223 2.580 15.528 -12.762 1.00 0.71 H new ATOM 88 N ARG A 224 -2.404 9.315 -13.396 1.00 0.36 N ATOM 89 CA ARG A 224 -2.980 7.939 -13.513 1.00 0.31 C ATOM 90 C ARG A 224 -1.822 6.940 -13.497 1.00 0.26 C ATOM 91 O ARG A 224 -0.688 7.296 -13.755 1.00 0.29 O ATOM 92 CB ARG A 224 -3.750 7.819 -14.839 1.00 0.35 C ATOM 93 CG ARG A 224 -5.186 8.315 -14.654 1.00 1.00 C ATOM 94 CD ARG A 224 -5.884 8.370 -16.013 1.00 1.24 C ATOM 95 NE ARG A 224 -5.100 9.230 -16.942 1.00 1.82 N ATOM 96 CZ ARG A 224 -5.325 9.176 -18.226 1.00 2.36 C ATOM 97 NH1 ARG A 224 -6.227 8.356 -18.695 1.00 2.57 N ATOM 98 NH2 ARG A 224 -4.648 9.937 -19.041 1.00 3.26 N ATOM 0 H ARG A 224 -1.924 9.649 -14.232 1.00 0.36 H new ATOM 0 HA ARG A 224 -3.664 7.738 -12.688 1.00 0.31 H new ATOM 0 HB2 ARG A 224 -3.251 8.402 -15.613 1.00 0.35 H new ATOM 0 HB3 ARG A 224 -3.755 6.782 -15.174 1.00 0.35 H new ATOM 0 HG2 ARG A 224 -5.728 7.650 -13.981 1.00 1.00 H new ATOM 0 HG3 ARG A 224 -5.185 9.303 -14.193 1.00 1.00 H new ATOM 0 HD2 ARG A 224 -5.980 7.365 -16.425 1.00 1.24 H new ATOM 0 HD3 ARG A 224 -6.893 8.766 -15.899 1.00 1.24 H new ATOM 0 HE ARG A 224 -4.388 9.861 -16.575 1.00 1.82 H new ATOM 0 HH11 ARG A 224 -6.754 7.759 -18.058 1.00 2.57 H new ATOM 0 HH12 ARG A 224 -6.404 8.313 -19.699 1.00 2.57 H new ATOM 0 HH21 ARG A 224 -3.942 10.575 -18.675 1.00 3.26 H new ATOM 0 HH22 ARG A 224 -4.825 9.894 -20.045 1.00 3.26 H new ATOM 112 N VAL A 225 -2.088 5.697 -13.191 1.00 0.23 N ATOM 113 CA VAL A 225 -0.992 4.682 -13.153 1.00 0.20 C ATOM 114 C VAL A 225 -1.494 3.345 -13.704 1.00 0.20 C ATOM 115 O VAL A 225 -2.593 2.915 -13.412 1.00 0.22 O ATOM 116 CB VAL A 225 -0.533 4.492 -11.704 1.00 0.20 C ATOM 117 CG1 VAL A 225 0.488 3.354 -11.632 1.00 0.20 C ATOM 118 CG2 VAL A 225 0.113 5.784 -11.202 1.00 0.23 C ATOM 0 H VAL A 225 -3.017 5.340 -12.966 1.00 0.23 H new ATOM 0 HA VAL A 225 -0.160 5.030 -13.765 1.00 0.20 H new ATOM 0 HB VAL A 225 -1.394 4.246 -11.082 1.00 0.20 H new ATOM 0 HG11 VAL A 225 0.813 3.221 -10.600 1.00 0.20 H new ATOM 0 HG12 VAL A 225 0.031 2.432 -11.990 1.00 0.20 H new ATOM 0 HG13 VAL A 225 1.349 3.598 -12.255 1.00 0.20 H new ATOM 0 HG21 VAL A 225 0.440 5.650 -10.171 1.00 0.23 H new ATOM 0 HG22 VAL A 225 0.972 6.028 -11.827 1.00 0.23 H new ATOM 0 HG23 VAL A 225 -0.612 6.596 -11.250 1.00 0.23 H new ATOM 128 N TYR A 226 -0.681 2.678 -14.483 1.00 0.22 N ATOM 129 CA TYR A 226 -1.071 1.348 -15.044 1.00 0.25 C ATOM 130 C TYR A 226 -0.243 0.286 -14.328 1.00 0.26 C ATOM 131 O TYR A 226 0.853 0.552 -13.882 1.00 0.26 O ATOM 132 CB TYR A 226 -0.767 1.302 -16.546 1.00 0.32 C ATOM 133 CG TYR A 226 -1.734 2.189 -17.299 1.00 0.35 C ATOM 134 CD1 TYR A 226 -1.593 3.589 -17.243 1.00 0.43 C ATOM 135 CD2 TYR A 226 -2.767 1.617 -18.068 1.00 0.42 C ATOM 136 CE1 TYR A 226 -2.484 4.416 -17.954 1.00 0.50 C ATOM 137 CE2 TYR A 226 -3.659 2.444 -18.777 1.00 0.47 C ATOM 138 CZ TYR A 226 -3.517 3.843 -18.720 1.00 0.49 C ATOM 139 OH TYR A 226 -4.391 4.653 -19.417 1.00 0.58 O ATOM 0 H TYR A 226 0.247 3.001 -14.757 1.00 0.22 H new ATOM 0 HA TYR A 226 -2.137 1.174 -14.900 1.00 0.25 H new ATOM 0 HB2 TYR A 226 0.257 1.630 -16.728 1.00 0.32 H new ATOM 0 HB3 TYR A 226 -0.843 0.277 -16.909 1.00 0.32 H new ATOM 0 HD1 TYR A 226 -0.801 4.029 -16.655 1.00 0.43 H new ATOM 0 HD2 TYR A 226 -2.875 0.543 -18.114 1.00 0.42 H new ATOM 0 HE1 TYR A 226 -2.375 5.490 -17.912 1.00 0.50 H new ATOM 0 HE2 TYR A 226 -4.452 2.005 -19.364 1.00 0.47 H new ATOM 0 HH TYR A 226 -5.042 4.097 -19.894 1.00 0.58 H new ATOM 149 N TYR A 227 -0.741 -0.913 -14.196 1.00 0.28 N ATOM 150 CA TYR A 227 0.051 -1.955 -13.479 1.00 0.32 C ATOM 151 C TYR A 227 -0.369 -3.351 -13.930 1.00 0.37 C ATOM 152 O TYR A 227 -1.491 -3.578 -14.339 1.00 0.39 O ATOM 153 CB TYR A 227 -0.190 -1.819 -11.972 1.00 0.31 C ATOM 154 CG TYR A 227 -1.667 -1.963 -11.674 1.00 0.31 C ATOM 155 CD1 TYR A 227 -2.563 -0.932 -12.022 1.00 0.28 C ATOM 156 CD2 TYR A 227 -2.148 -3.127 -11.041 1.00 0.38 C ATOM 157 CE1 TYR A 227 -3.937 -1.067 -11.739 1.00 0.31 C ATOM 158 CE2 TYR A 227 -3.521 -3.260 -10.757 1.00 0.41 C ATOM 159 CZ TYR A 227 -4.414 -2.230 -11.106 1.00 0.38 C ATOM 160 OH TYR A 227 -5.759 -2.361 -10.827 1.00 0.44 O ATOM 0 H TYR A 227 -1.650 -1.215 -14.548 1.00 0.28 H new ATOM 0 HA TYR A 227 1.108 -1.815 -13.707 1.00 0.32 H new ATOM 0 HB2 TYR A 227 0.375 -2.580 -11.434 1.00 0.31 H new ATOM 0 HB3 TYR A 227 0.168 -0.850 -11.623 1.00 0.31 H new ATOM 0 HD1 TYR A 227 -2.197 -0.039 -12.506 1.00 0.28 H new ATOM 0 HD2 TYR A 227 -1.463 -3.918 -10.773 1.00 0.38 H new ATOM 0 HE1 TYR A 227 -4.624 -0.278 -12.008 1.00 0.31 H new ATOM 0 HE2 TYR A 227 -3.888 -4.152 -10.272 1.00 0.41 H new ATOM 0 HH TYR A 227 -6.236 -1.561 -11.132 1.00 0.44 H new ATOM 170 N ARG A 228 0.534 -4.295 -13.853 1.00 0.43 N ATOM 171 CA ARG A 228 0.203 -5.691 -14.268 1.00 0.49 C ATOM 172 C ARG A 228 -0.211 -6.504 -13.041 1.00 0.54 C ATOM 173 O ARG A 228 0.233 -6.254 -11.937 1.00 0.60 O ATOM 174 CB ARG A 228 1.435 -6.344 -14.914 1.00 0.55 C ATOM 175 CG ARG A 228 2.163 -5.320 -15.792 1.00 0.67 C ATOM 176 CD ARG A 228 3.100 -6.041 -16.770 1.00 0.73 C ATOM 177 NE ARG A 228 3.807 -7.167 -16.072 1.00 1.49 N ATOM 178 CZ ARG A 228 4.516 -6.967 -14.993 1.00 1.74 C ATOM 179 NH1 ARG A 228 4.772 -5.755 -14.584 1.00 1.49 N ATOM 180 NH2 ARG A 228 5.012 -7.987 -14.347 1.00 2.76 N ATOM 0 H ARG A 228 1.488 -4.158 -13.520 1.00 0.43 H new ATOM 0 HA ARG A 228 -0.616 -5.667 -14.987 1.00 0.49 H new ATOM 0 HB2 ARG A 228 2.107 -6.718 -14.142 1.00 0.55 H new ATOM 0 HB3 ARG A 228 1.131 -7.201 -15.515 1.00 0.55 H new ATOM 0 HG2 ARG A 228 1.438 -4.721 -16.344 1.00 0.67 H new ATOM 0 HG3 ARG A 228 2.734 -4.633 -15.167 1.00 0.67 H new ATOM 0 HD2 ARG A 228 2.529 -6.427 -17.614 1.00 0.73 H new ATOM 0 HD3 ARG A 228 3.829 -5.338 -17.173 1.00 0.73 H new ATOM 0 HE ARG A 228 3.732 -8.112 -16.450 1.00 1.49 H new ATOM 0 HH11 ARG A 228 4.418 -4.955 -15.108 1.00 1.49 H new ATOM 0 HH12 ARG A 228 5.326 -5.608 -13.741 1.00 1.49 H new ATOM 0 HH21 ARG A 228 4.845 -8.935 -14.685 1.00 2.76 H new ATOM 0 HH22 ARG A 228 5.566 -7.836 -13.504 1.00 2.76 H new ATOM 194 N ASP A 229 -1.050 -7.486 -13.230 1.00 0.58 N ATOM 195 CA ASP A 229 -1.491 -8.336 -12.083 1.00 0.66 C ATOM 196 C ASP A 229 -0.631 -9.600 -12.044 1.00 0.74 C ATOM 197 O ASP A 229 0.075 -9.909 -12.984 1.00 0.76 O ATOM 198 CB ASP A 229 -2.959 -8.725 -12.271 1.00 0.72 C ATOM 199 CG ASP A 229 -3.783 -7.477 -12.595 1.00 1.41 C ATOM 200 OD1 ASP A 229 -3.185 -6.437 -12.822 1.00 2.07 O ATOM 201 OD2 ASP A 229 -4.998 -7.581 -12.610 1.00 2.23 O ATOM 0 H ASP A 229 -1.452 -7.739 -14.133 1.00 0.58 H new ATOM 0 HA ASP A 229 -1.381 -7.784 -11.150 1.00 0.66 H new ATOM 0 HB2 ASP A 229 -3.052 -9.454 -13.076 1.00 0.72 H new ATOM 0 HB3 ASP A 229 -3.339 -9.199 -11.366 1.00 0.72 H new ATOM 206 N SER A 230 -0.689 -10.341 -10.972 1.00 0.84 N ATOM 207 CA SER A 230 0.122 -11.590 -10.887 1.00 0.97 C ATOM 208 C SER A 230 -0.629 -12.726 -11.585 1.00 1.04 C ATOM 209 O SER A 230 -0.099 -13.800 -11.790 1.00 1.17 O ATOM 210 CB SER A 230 0.347 -11.951 -9.419 1.00 1.07 C ATOM 211 OG SER A 230 1.139 -13.128 -9.340 1.00 1.80 O ATOM 0 H SER A 230 -1.261 -10.137 -10.153 1.00 0.84 H new ATOM 0 HA SER A 230 1.086 -11.437 -11.373 1.00 0.97 H new ATOM 0 HB2 SER A 230 0.844 -11.130 -8.903 1.00 1.07 H new ATOM 0 HB3 SER A 230 -0.610 -12.109 -8.921 1.00 1.07 H new ATOM 0 HG SER A 230 1.024 -13.655 -10.158 1.00 1.80 H new ATOM 217 N ARG A 231 -1.860 -12.494 -11.955 1.00 1.00 N ATOM 218 CA ARG A 231 -2.654 -13.556 -12.643 1.00 1.11 C ATOM 219 C ARG A 231 -2.465 -13.444 -14.158 1.00 1.14 C ATOM 220 O ARG A 231 -2.770 -14.359 -14.896 1.00 1.30 O ATOM 221 CB ARG A 231 -4.136 -13.381 -12.304 1.00 1.14 C ATOM 222 CG ARG A 231 -4.293 -13.155 -10.799 1.00 1.18 C ATOM 223 CD ARG A 231 -5.768 -13.280 -10.417 1.00 1.46 C ATOM 224 NE ARG A 231 -5.930 -12.994 -8.964 1.00 2.09 N ATOM 225 CZ ARG A 231 -7.116 -12.748 -8.479 1.00 2.67 C ATOM 226 NH1 ARG A 231 -8.155 -12.750 -9.267 1.00 2.80 N ATOM 227 NH2 ARG A 231 -7.261 -12.500 -7.206 1.00 3.63 N ATOM 0 H ARG A 231 -2.352 -11.612 -11.810 1.00 1.00 H new ATOM 0 HA ARG A 231 -2.312 -14.535 -12.308 1.00 1.11 H new ATOM 0 HB2 ARG A 231 -4.548 -12.535 -12.854 1.00 1.14 H new ATOM 0 HB3 ARG A 231 -4.697 -14.264 -12.610 1.00 1.14 H new ATOM 0 HG2 ARG A 231 -3.700 -13.884 -10.247 1.00 1.18 H new ATOM 0 HG3 ARG A 231 -3.918 -12.168 -10.527 1.00 1.18 H new ATOM 0 HD2 ARG A 231 -6.367 -12.584 -11.005 1.00 1.46 H new ATOM 0 HD3 ARG A 231 -6.130 -14.283 -10.644 1.00 1.46 H new ATOM 0 HE ARG A 231 -5.116 -12.991 -8.350 1.00 2.09 H new ATOM 0 HH11 ARG A 231 -8.040 -12.944 -10.262 1.00 2.80 H new ATOM 0 HH12 ARG A 231 -9.082 -12.558 -8.889 1.00 2.80 H new ATOM 0 HH21 ARG A 231 -6.447 -12.499 -6.591 1.00 3.63 H new ATOM 0 HH22 ARG A 231 -8.188 -12.308 -6.826 1.00 3.63 H new ATOM 241 N ASP A 232 -1.965 -12.331 -14.631 1.00 1.02 N ATOM 242 CA ASP A 232 -1.763 -12.165 -16.102 1.00 1.07 C ATOM 243 C ASP A 232 -0.746 -11.022 -16.352 1.00 0.94 C ATOM 244 O ASP A 232 -0.916 -9.951 -15.801 1.00 0.82 O ATOM 245 CB ASP A 232 -3.101 -11.793 -16.748 1.00 1.14 C ATOM 246 CG ASP A 232 -4.036 -13.003 -16.729 1.00 1.61 C ATOM 247 OD1 ASP A 232 -3.607 -14.067 -17.148 1.00 2.16 O ATOM 248 OD2 ASP A 232 -5.165 -12.849 -16.292 1.00 2.12 O ATOM 0 H ASP A 232 -1.688 -11.531 -14.063 1.00 1.02 H new ATOM 0 HA ASP A 232 -1.386 -13.093 -16.531 1.00 1.07 H new ATOM 0 HB2 ASP A 232 -3.556 -10.961 -16.211 1.00 1.14 H new ATOM 0 HB3 ASP A 232 -2.941 -11.461 -17.774 1.00 1.14 H new ATOM 253 N PRO A 233 0.283 -11.245 -17.165 1.00 1.01 N ATOM 254 CA PRO A 233 1.278 -10.184 -17.439 1.00 0.97 C ATOM 255 C PRO A 233 0.634 -9.038 -18.240 1.00 0.85 C ATOM 256 O PRO A 233 1.315 -8.169 -18.746 1.00 0.83 O ATOM 257 CB PRO A 233 2.380 -10.881 -18.270 1.00 1.13 C ATOM 258 CG PRO A 233 1.825 -12.270 -18.693 1.00 1.25 C ATOM 259 CD PRO A 233 0.550 -12.527 -17.861 1.00 1.19 C ATOM 0 HA PRO A 233 1.674 -9.741 -16.525 1.00 0.97 H new ATOM 0 HB2 PRO A 233 2.636 -10.286 -19.146 1.00 1.13 H new ATOM 0 HB3 PRO A 233 3.292 -10.993 -17.683 1.00 1.13 H new ATOM 0 HG2 PRO A 233 1.598 -12.285 -19.759 1.00 1.25 H new ATOM 0 HG3 PRO A 233 2.565 -13.050 -18.514 1.00 1.25 H new ATOM 0 HD2 PRO A 233 -0.287 -12.812 -18.499 1.00 1.19 H new ATOM 0 HD3 PRO A 233 0.700 -13.339 -17.149 1.00 1.19 H new ATOM 267 N VAL A 234 -0.665 -9.033 -18.369 1.00 0.84 N ATOM 268 CA VAL A 234 -1.332 -7.948 -19.148 1.00 0.80 C ATOM 269 C VAL A 234 -1.530 -6.711 -18.265 1.00 0.69 C ATOM 270 O VAL A 234 -1.945 -6.806 -17.128 1.00 0.72 O ATOM 271 CB VAL A 234 -2.694 -8.444 -19.645 1.00 0.90 C ATOM 272 CG1 VAL A 234 -2.513 -9.770 -20.388 1.00 1.74 C ATOM 273 CG2 VAL A 234 -3.634 -8.651 -18.452 1.00 1.75 C ATOM 0 H VAL A 234 -1.293 -9.731 -17.970 1.00 0.84 H new ATOM 0 HA VAL A 234 -0.704 -7.681 -19.998 1.00 0.80 H new ATOM 0 HB VAL A 234 -3.124 -7.704 -20.319 1.00 0.90 H new ATOM 0 HG11 VAL A 234 -3.481 -10.124 -20.742 1.00 1.74 H new ATOM 0 HG12 VAL A 234 -1.847 -9.623 -21.239 1.00 1.74 H new ATOM 0 HG13 VAL A 234 -2.081 -10.509 -19.713 1.00 1.74 H new ATOM 0 HG21 VAL A 234 -4.602 -9.004 -18.808 1.00 1.75 H new ATOM 0 HG22 VAL A 234 -3.205 -9.390 -17.775 1.00 1.75 H new ATOM 0 HG23 VAL A 234 -3.764 -7.707 -17.923 1.00 1.75 H new ATOM 283 N TRP A 235 -1.243 -5.545 -18.785 1.00 0.64 N ATOM 284 CA TRP A 235 -1.420 -4.301 -17.980 1.00 0.55 C ATOM 285 C TRP A 235 -2.862 -4.236 -17.467 1.00 0.53 C ATOM 286 O TRP A 235 -3.718 -4.973 -17.916 1.00 0.65 O ATOM 287 CB TRP A 235 -1.151 -3.076 -18.861 1.00 0.56 C ATOM 288 CG TRP A 235 0.308 -2.989 -19.179 1.00 0.58 C ATOM 289 CD1 TRP A 235 0.872 -3.360 -20.352 1.00 0.65 C ATOM 290 CD2 TRP A 235 1.395 -2.506 -18.336 1.00 0.53 C ATOM 291 NE1 TRP A 235 2.237 -3.138 -20.285 1.00 0.66 N ATOM 292 CE2 TRP A 235 2.611 -2.613 -19.065 1.00 0.59 C ATOM 293 CE3 TRP A 235 1.446 -1.990 -17.020 1.00 0.47 C ATOM 294 CZ2 TRP A 235 3.837 -2.221 -18.507 1.00 0.59 C ATOM 295 CZ3 TRP A 235 2.677 -1.595 -16.456 1.00 0.47 C ATOM 296 CH2 TRP A 235 3.870 -1.711 -17.198 1.00 0.53 C ATOM 0 H TRP A 235 -0.894 -5.402 -19.733 1.00 0.64 H new ATOM 0 HA TRP A 235 -0.724 -4.310 -17.141 1.00 0.55 H new ATOM 0 HB2 TRP A 235 -1.729 -3.145 -19.782 1.00 0.56 H new ATOM 0 HB3 TRP A 235 -1.475 -2.170 -18.349 1.00 0.56 H new ATOM 0 HD1 TRP A 235 0.343 -3.764 -21.203 1.00 0.65 H new ATOM 0 HE1 TRP A 235 2.887 -3.338 -21.045 1.00 0.66 H new ATOM 0 HE3 TRP A 235 0.537 -1.898 -16.444 1.00 0.47 H new ATOM 0 HZ2 TRP A 235 4.749 -2.311 -19.079 1.00 0.59 H new ATOM 0 HZ3 TRP A 235 2.706 -1.202 -15.451 1.00 0.47 H new ATOM 0 HH2 TRP A 235 4.810 -1.408 -16.760 1.00 0.53 H new ATOM 307 N LYS A 236 -3.141 -3.349 -16.539 1.00 0.45 N ATOM 308 CA LYS A 236 -4.535 -3.216 -15.997 1.00 0.45 C ATOM 309 C LYS A 236 -4.997 -1.763 -16.137 1.00 0.43 C ATOM 310 O LYS A 236 -4.194 -0.857 -16.250 1.00 0.67 O ATOM 311 CB LYS A 236 -4.555 -3.627 -14.519 1.00 0.46 C ATOM 312 CG LYS A 236 -5.997 -3.551 -13.973 1.00 0.81 C ATOM 313 CD LYS A 236 -6.179 -4.561 -12.833 1.00 0.73 C ATOM 314 CE LYS A 236 -7.523 -4.321 -12.140 1.00 1.09 C ATOM 315 NZ LYS A 236 -8.629 -4.761 -13.035 1.00 1.43 N ATOM 0 H LYS A 236 -2.460 -2.708 -16.131 1.00 0.45 H new ATOM 0 HA LYS A 236 -5.208 -3.866 -16.557 1.00 0.45 H new ATOM 0 HB2 LYS A 236 -4.168 -4.640 -14.409 1.00 0.46 H new ATOM 0 HB3 LYS A 236 -3.903 -2.972 -13.941 1.00 0.46 H new ATOM 0 HG2 LYS A 236 -6.206 -2.543 -13.614 1.00 0.81 H new ATOM 0 HG3 LYS A 236 -6.709 -3.759 -14.772 1.00 0.81 H new ATOM 0 HD2 LYS A 236 -6.137 -5.577 -13.225 1.00 0.73 H new ATOM 0 HD3 LYS A 236 -5.366 -4.463 -12.114 1.00 0.73 H new ATOM 0 HE2 LYS A 236 -7.562 -4.870 -11.199 1.00 1.09 H new ATOM 0 HE3 LYS A 236 -7.636 -3.264 -11.898 1.00 1.09 H new ATOM 0 HZ1 LYS A 236 -9.538 -4.661 -12.539 1.00 1.43 H new ATOM 0 HZ2 LYS A 236 -8.636 -4.173 -13.893 1.00 1.43 H new ATOM 0 HZ3 LYS A 236 -8.486 -5.757 -13.299 1.00 1.43 H new ATOM 329 N GLY A 237 -6.285 -1.539 -16.141 1.00 0.39 N ATOM 330 CA GLY A 237 -6.816 -0.150 -16.289 1.00 0.36 C ATOM 331 C GLY A 237 -6.004 0.829 -15.421 1.00 0.31 C ATOM 332 O GLY A 237 -5.251 0.407 -14.566 1.00 0.31 O ATOM 0 H GLY A 237 -6.997 -2.263 -16.047 1.00 0.39 H new ATOM 0 HA2 GLY A 237 -6.769 0.155 -17.334 1.00 0.36 H new ATOM 0 HA3 GLY A 237 -7.866 -0.122 -15.996 1.00 0.36 H new ATOM 336 N PRO A 238 -6.174 2.117 -15.664 1.00 0.31 N ATOM 337 CA PRO A 238 -5.453 3.152 -14.896 1.00 0.29 C ATOM 338 C PRO A 238 -5.897 3.141 -13.427 1.00 0.24 C ATOM 339 O PRO A 238 -6.950 2.640 -13.085 1.00 0.27 O ATOM 340 CB PRO A 238 -5.839 4.488 -15.578 1.00 0.36 C ATOM 341 CG PRO A 238 -7.000 4.179 -16.565 1.00 0.41 C ATOM 342 CD PRO A 238 -7.079 2.645 -16.712 1.00 0.38 C ATOM 0 HA PRO A 238 -4.375 2.990 -14.893 1.00 0.29 H new ATOM 0 HB2 PRO A 238 -6.150 5.223 -14.836 1.00 0.36 H new ATOM 0 HB3 PRO A 238 -4.985 4.911 -16.108 1.00 0.36 H new ATOM 0 HG2 PRO A 238 -7.942 4.578 -16.188 1.00 0.41 H new ATOM 0 HG3 PRO A 238 -6.819 4.649 -17.532 1.00 0.41 H new ATOM 0 HD2 PRO A 238 -8.099 2.286 -16.572 1.00 0.38 H new ATOM 0 HD3 PRO A 238 -6.763 2.326 -17.705 1.00 0.38 H new ATOM 350 N ALA A 239 -5.097 3.714 -12.565 1.00 0.19 N ATOM 351 CA ALA A 239 -5.446 3.770 -11.114 1.00 0.18 C ATOM 352 C ALA A 239 -5.100 5.161 -10.576 1.00 0.17 C ATOM 353 O ALA A 239 -4.569 5.991 -11.287 1.00 0.19 O ATOM 354 CB ALA A 239 -4.640 2.716 -10.354 1.00 0.21 C ATOM 0 H ALA A 239 -4.207 4.150 -12.808 1.00 0.19 H new ATOM 0 HA ALA A 239 -6.510 3.574 -10.981 1.00 0.18 H new ATOM 0 HB1 ALA A 239 -4.895 2.757 -9.295 1.00 0.21 H new ATOM 0 HB2 ALA A 239 -4.875 1.726 -10.746 1.00 0.21 H new ATOM 0 HB3 ALA A 239 -3.575 2.912 -10.479 1.00 0.21 H new ATOM 360 N LYS A 240 -5.393 5.427 -9.328 1.00 0.19 N ATOM 361 CA LYS A 240 -5.075 6.771 -8.750 1.00 0.21 C ATOM 362 C LYS A 240 -3.730 6.700 -8.018 1.00 0.19 C ATOM 363 O LYS A 240 -3.446 5.750 -7.317 1.00 0.18 O ATOM 364 CB LYS A 240 -6.180 7.174 -7.762 1.00 0.27 C ATOM 365 CG LYS A 240 -6.175 8.693 -7.562 1.00 1.15 C ATOM 366 CD LYS A 240 -7.310 9.085 -6.613 1.00 1.43 C ATOM 367 CE LYS A 240 -7.525 10.598 -6.673 1.00 2.03 C ATOM 368 NZ LYS A 240 -6.205 11.283 -6.736 1.00 2.72 N ATOM 0 H LYS A 240 -5.838 4.773 -8.684 1.00 0.19 H new ATOM 0 HA LYS A 240 -5.016 7.511 -9.548 1.00 0.21 H new ATOM 0 HB2 LYS A 240 -7.151 6.852 -8.138 1.00 0.27 H new ATOM 0 HB3 LYS A 240 -6.026 6.673 -6.807 1.00 0.27 H new ATOM 0 HG2 LYS A 240 -5.217 9.014 -7.153 1.00 1.15 H new ATOM 0 HG3 LYS A 240 -6.297 9.197 -8.521 1.00 1.15 H new ATOM 0 HD2 LYS A 240 -8.227 8.565 -6.891 1.00 1.43 H new ATOM 0 HD3 LYS A 240 -7.068 8.781 -5.594 1.00 1.43 H new ATOM 0 HE2 LYS A 240 -8.123 10.857 -7.546 1.00 2.03 H new ATOM 0 HE3 LYS A 240 -8.079 10.933 -5.796 1.00 2.03 H new ATOM 0 HZ1 LYS A 240 -6.317 12.278 -6.457 1.00 2.72 H new ATOM 0 HZ2 LYS A 240 -5.539 10.814 -6.089 1.00 2.72 H new ATOM 0 HZ3 LYS A 240 -5.835 11.235 -7.707 1.00 2.72 H new ATOM 382 N LEU A 241 -2.906 7.701 -8.180 1.00 0.20 N ATOM 383 CA LEU A 241 -1.566 7.710 -7.509 1.00 0.20 C ATOM 384 C LEU A 241 -1.681 8.373 -6.128 1.00 0.22 C ATOM 385 O LEU A 241 -2.145 9.490 -6.008 1.00 0.29 O ATOM 386 CB LEU A 241 -0.586 8.506 -8.385 1.00 0.22 C ATOM 387 CG LEU A 241 0.742 8.732 -7.652 1.00 0.23 C ATOM 388 CD1 LEU A 241 1.293 7.399 -7.133 1.00 0.29 C ATOM 389 CD2 LEU A 241 1.748 9.354 -8.627 1.00 0.29 C ATOM 0 H LEU A 241 -3.103 8.522 -8.753 1.00 0.20 H new ATOM 0 HA LEU A 241 -1.207 6.689 -7.380 1.00 0.20 H new ATOM 0 HB2 LEU A 241 -0.405 7.969 -9.316 1.00 0.22 H new ATOM 0 HB3 LEU A 241 -1.027 9.466 -8.651 1.00 0.22 H new ATOM 0 HG LEU A 241 0.578 9.399 -6.806 1.00 0.23 H new ATOM 0 HD11 LEU A 241 2.236 7.572 -6.614 1.00 0.29 H new ATOM 0 HD12 LEU A 241 0.576 6.953 -6.443 1.00 0.29 H new ATOM 0 HD13 LEU A 241 1.459 6.723 -7.972 1.00 0.29 H new ATOM 0 HD21 LEU A 241 2.696 9.519 -8.115 1.00 0.29 H new ATOM 0 HD22 LEU A 241 1.903 8.680 -9.470 1.00 0.29 H new ATOM 0 HD23 LEU A 241 1.361 10.306 -8.990 1.00 0.29 H new ATOM 401 N LEU A 242 -1.256 7.690 -5.086 1.00 0.22 N ATOM 402 CA LEU A 242 -1.330 8.265 -3.700 1.00 0.25 C ATOM 403 C LEU A 242 0.082 8.382 -3.106 1.00 0.25 C ATOM 404 O LEU A 242 0.618 9.463 -2.959 1.00 0.27 O ATOM 405 CB LEU A 242 -2.164 7.342 -2.802 1.00 0.26 C ATOM 406 CG LEU A 242 -3.431 6.890 -3.531 1.00 0.32 C ATOM 407 CD1 LEU A 242 -4.212 5.932 -2.628 1.00 0.30 C ATOM 408 CD2 LEU A 242 -4.302 8.108 -3.857 1.00 0.45 C ATOM 0 H LEU A 242 -0.858 6.752 -5.138 1.00 0.22 H new ATOM 0 HA LEU A 242 -1.791 9.251 -3.754 1.00 0.25 H new ATOM 0 HB2 LEU A 242 -1.573 6.473 -2.514 1.00 0.26 H new ATOM 0 HB3 LEU A 242 -2.432 7.863 -1.883 1.00 0.26 H new ATOM 0 HG LEU A 242 -3.159 6.386 -4.458 1.00 0.32 H new ATOM 0 HD11 LEU A 242 -5.117 5.605 -3.140 1.00 0.30 H new ATOM 0 HD12 LEU A 242 -3.593 5.065 -2.396 1.00 0.30 H new ATOM 0 HD13 LEU A 242 -4.483 6.443 -1.704 1.00 0.30 H new ATOM 0 HD21 LEU A 242 -5.203 7.782 -4.376 1.00 0.45 H new ATOM 0 HD22 LEU A 242 -4.579 8.615 -2.933 1.00 0.45 H new ATOM 0 HD23 LEU A 242 -3.744 8.794 -4.494 1.00 0.45 H new ATOM 420 N TRP A 243 0.677 7.273 -2.740 1.00 0.25 N ATOM 421 CA TRP A 243 2.043 7.308 -2.127 1.00 0.26 C ATOM 422 C TRP A 243 3.117 7.135 -3.208 1.00 0.22 C ATOM 423 O TRP A 243 2.969 6.353 -4.127 1.00 0.21 O ATOM 424 CB TRP A 243 2.157 6.163 -1.105 1.00 0.30 C ATOM 425 CG TRP A 243 3.266 6.440 -0.141 1.00 0.29 C ATOM 426 CD1 TRP A 243 3.242 7.392 0.813 1.00 0.31 C ATOM 427 CD2 TRP A 243 4.550 5.766 -0.015 1.00 0.28 C ATOM 428 NE1 TRP A 243 4.433 7.363 1.509 1.00 0.31 N ATOM 429 CE2 TRP A 243 5.276 6.383 1.038 1.00 0.30 C ATOM 430 CE3 TRP A 243 5.158 4.696 -0.710 1.00 0.27 C ATOM 431 CZ2 TRP A 243 6.561 5.953 1.393 1.00 0.31 C ATOM 432 CZ3 TRP A 243 6.453 4.261 -0.356 1.00 0.28 C ATOM 433 CH2 TRP A 243 7.151 4.891 0.694 1.00 0.29 C ATOM 0 H TRP A 243 0.274 6.341 -2.840 1.00 0.25 H new ATOM 0 HA TRP A 243 2.193 8.269 -1.635 1.00 0.26 H new ATOM 0 HB2 TRP A 243 1.216 6.052 -0.566 1.00 0.30 H new ATOM 0 HB3 TRP A 243 2.341 5.221 -1.622 1.00 0.30 H new ATOM 0 HD1 TRP A 243 2.422 8.069 1.002 1.00 0.31 H new ATOM 0 HE1 TRP A 243 4.661 7.992 2.279 1.00 0.31 H new ATOM 0 HE3 TRP A 243 4.629 4.209 -1.516 1.00 0.27 H new ATOM 0 HZ2 TRP A 243 7.093 6.436 2.199 1.00 0.31 H new ATOM 0 HZ3 TRP A 243 6.911 3.442 -0.892 1.00 0.28 H new ATOM 0 HH2 TRP A 243 8.142 4.555 0.960 1.00 0.29 H new ATOM 444 N LYS A 244 4.206 7.849 -3.091 1.00 0.24 N ATOM 445 CA LYS A 244 5.309 7.728 -4.093 1.00 0.23 C ATOM 446 C LYS A 244 6.648 7.966 -3.388 1.00 0.24 C ATOM 447 O LYS A 244 6.888 9.024 -2.841 1.00 0.28 O ATOM 448 CB LYS A 244 5.117 8.774 -5.197 1.00 0.30 C ATOM 449 CG LYS A 244 6.261 8.677 -6.209 1.00 0.71 C ATOM 450 CD LYS A 244 5.985 9.621 -7.382 1.00 0.82 C ATOM 451 CE LYS A 244 7.010 9.372 -8.491 1.00 1.50 C ATOM 452 NZ LYS A 244 6.713 8.074 -9.160 1.00 2.32 N ATOM 0 H LYS A 244 4.381 8.516 -2.339 1.00 0.24 H new ATOM 0 HA LYS A 244 5.297 6.733 -4.537 1.00 0.23 H new ATOM 0 HB2 LYS A 244 4.162 8.616 -5.698 1.00 0.30 H new ATOM 0 HB3 LYS A 244 5.088 9.773 -4.763 1.00 0.30 H new ATOM 0 HG2 LYS A 244 7.206 8.938 -5.732 1.00 0.71 H new ATOM 0 HG3 LYS A 244 6.358 7.652 -6.568 1.00 0.71 H new ATOM 0 HD2 LYS A 244 4.976 9.460 -7.762 1.00 0.82 H new ATOM 0 HD3 LYS A 244 6.039 10.657 -7.049 1.00 0.82 H new ATOM 0 HE2 LYS A 244 6.979 10.183 -9.218 1.00 1.50 H new ATOM 0 HE3 LYS A 244 8.017 9.356 -8.073 1.00 1.50 H new ATOM 0 HZ1 LYS A 244 7.206 8.034 -10.075 1.00 2.32 H new ATOM 0 HZ2 LYS A 244 7.037 7.291 -8.557 1.00 2.32 H new ATOM 0 HZ3 LYS A 244 5.688 7.990 -9.315 1.00 2.32 H new ATOM 466 N GLY A 245 7.523 6.994 -3.388 1.00 0.23 N ATOM 467 CA GLY A 245 8.841 7.181 -2.707 1.00 0.26 C ATOM 468 C GLY A 245 9.888 6.247 -3.319 1.00 0.26 C ATOM 469 O GLY A 245 10.447 6.522 -4.361 1.00 0.27 O ATOM 0 H GLY A 245 7.384 6.084 -3.827 1.00 0.23 H new ATOM 0 HA2 GLY A 245 9.166 8.217 -2.805 1.00 0.26 H new ATOM 0 HA3 GLY A 245 8.740 6.978 -1.641 1.00 0.26 H new ATOM 473 N GLU A 246 10.163 5.148 -2.671 1.00 0.26 N ATOM 474 CA GLU A 246 11.182 4.198 -3.203 1.00 0.27 C ATOM 475 C GLU A 246 10.636 3.509 -4.454 1.00 0.24 C ATOM 476 O GLU A 246 9.778 4.031 -5.138 1.00 0.22 O ATOM 477 CB GLU A 246 11.504 3.144 -2.137 1.00 0.33 C ATOM 478 CG GLU A 246 11.861 3.835 -0.817 1.00 1.00 C ATOM 479 CD GLU A 246 11.996 2.784 0.287 1.00 0.91 C ATOM 480 OE1 GLU A 246 10.977 2.404 0.842 1.00 1.39 O ATOM 481 OE2 GLU A 246 13.113 2.377 0.557 1.00 1.39 O ATOM 0 H GLU A 246 9.725 4.866 -1.794 1.00 0.26 H new ATOM 0 HA GLU A 246 12.089 4.745 -3.458 1.00 0.27 H new ATOM 0 HB2 GLU A 246 10.648 2.485 -1.993 1.00 0.33 H new ATOM 0 HB3 GLU A 246 12.334 2.520 -2.468 1.00 0.33 H new ATOM 0 HG2 GLU A 246 12.794 4.388 -0.924 1.00 1.00 H new ATOM 0 HG3 GLU A 246 11.090 4.559 -0.553 1.00 1.00 H new ATOM 488 N GLY A 247 11.125 2.337 -4.759 1.00 0.26 N ATOM 489 CA GLY A 247 10.635 1.612 -5.967 1.00 0.25 C ATOM 490 C GLY A 247 9.262 1.002 -5.677 1.00 0.25 C ATOM 491 O GLY A 247 9.013 -0.154 -5.955 1.00 0.29 O ATOM 0 H GLY A 247 11.843 1.850 -4.223 1.00 0.26 H new ATOM 0 HA2 GLY A 247 10.569 2.297 -6.813 1.00 0.25 H new ATOM 0 HA3 GLY A 247 11.341 0.829 -6.245 1.00 0.25 H new ATOM 495 N ALA A 248 8.368 1.775 -5.123 1.00 0.22 N ATOM 496 CA ALA A 248 7.005 1.257 -4.811 1.00 0.24 C ATOM 497 C ALA A 248 5.999 2.398 -4.952 1.00 0.21 C ATOM 498 O ALA A 248 6.321 3.549 -4.734 1.00 0.23 O ATOM 499 CB ALA A 248 6.976 0.721 -3.378 1.00 0.29 C ATOM 0 H ALA A 248 8.525 2.751 -4.871 1.00 0.22 H new ATOM 0 HA ALA A 248 6.749 0.451 -5.499 1.00 0.24 H new ATOM 0 HB1 ALA A 248 5.979 0.343 -3.151 1.00 0.29 H new ATOM 0 HB2 ALA A 248 7.702 -0.086 -3.276 1.00 0.29 H new ATOM 0 HB3 ALA A 248 7.226 1.524 -2.684 1.00 0.29 H new ATOM 505 N VAL A 249 4.781 2.092 -5.314 1.00 0.19 N ATOM 506 CA VAL A 249 3.751 3.164 -5.469 1.00 0.18 C ATOM 507 C VAL A 249 2.397 2.642 -4.994 1.00 0.20 C ATOM 508 O VAL A 249 1.921 1.615 -5.437 1.00 0.22 O ATOM 509 CB VAL A 249 3.657 3.585 -6.941 1.00 0.17 C ATOM 510 CG1 VAL A 249 4.945 4.301 -7.348 1.00 0.31 C ATOM 511 CG2 VAL A 249 3.461 2.352 -7.832 1.00 0.30 C ATOM 0 H VAL A 249 4.454 1.146 -5.509 1.00 0.19 H new ATOM 0 HA VAL A 249 4.036 4.028 -4.869 1.00 0.18 H new ATOM 0 HB VAL A 249 2.806 4.254 -7.064 1.00 0.17 H new ATOM 0 HG11 VAL A 249 4.880 4.601 -8.394 1.00 0.31 H new ATOM 0 HG12 VAL A 249 5.082 5.185 -6.725 1.00 0.31 H new ATOM 0 HG13 VAL A 249 5.793 3.629 -7.216 1.00 0.31 H new ATOM 0 HG21 VAL A 249 3.396 2.663 -8.875 1.00 0.30 H new ATOM 0 HG22 VAL A 249 4.306 1.675 -7.708 1.00 0.30 H new ATOM 0 HG23 VAL A 249 2.542 1.840 -7.548 1.00 0.30 H new ATOM 521 N VAL A 250 1.771 3.343 -4.088 1.00 0.20 N ATOM 522 CA VAL A 250 0.441 2.898 -3.583 1.00 0.22 C ATOM 523 C VAL A 250 -0.636 3.458 -4.507 1.00 0.20 C ATOM 524 O VAL A 250 -0.551 4.584 -4.956 1.00 0.21 O ATOM 525 CB VAL A 250 0.222 3.423 -2.162 1.00 0.26 C ATOM 526 CG1 VAL A 250 -1.133 2.944 -1.653 1.00 0.26 C ATOM 527 CG2 VAL A 250 1.330 2.899 -1.237 1.00 0.29 C ATOM 0 H VAL A 250 2.124 4.206 -3.675 1.00 0.20 H new ATOM 0 HA VAL A 250 0.394 1.809 -3.566 1.00 0.22 H new ATOM 0 HB VAL A 250 0.248 4.513 -2.171 1.00 0.26 H new ATOM 0 HG11 VAL A 250 -1.294 3.316 -0.641 1.00 0.26 H new ATOM 0 HG12 VAL A 250 -1.921 3.319 -2.306 1.00 0.26 H new ATOM 0 HG13 VAL A 250 -1.155 1.854 -1.647 1.00 0.26 H new ATOM 0 HG21 VAL A 250 1.169 3.276 -0.227 1.00 0.29 H new ATOM 0 HG22 VAL A 250 1.309 1.809 -1.225 1.00 0.29 H new ATOM 0 HG23 VAL A 250 2.299 3.239 -1.601 1.00 0.29 H new ATOM 537 N ILE A 251 -1.645 2.682 -4.813 1.00 0.19 N ATOM 538 CA ILE A 251 -2.717 3.175 -5.730 1.00 0.18 C ATOM 539 C ILE A 251 -4.084 2.677 -5.262 1.00 0.20 C ATOM 540 O ILE A 251 -4.202 1.951 -4.296 1.00 0.23 O ATOM 541 CB ILE A 251 -2.453 2.650 -7.144 1.00 0.16 C ATOM 542 CG1 ILE A 251 -2.294 1.126 -7.106 1.00 0.18 C ATOM 543 CG2 ILE A 251 -1.173 3.282 -7.694 1.00 0.16 C ATOM 544 CD1 ILE A 251 -2.133 0.582 -8.529 1.00 0.18 C ATOM 0 H ILE A 251 -1.773 1.731 -4.468 1.00 0.19 H new ATOM 0 HA ILE A 251 -2.712 4.265 -5.726 1.00 0.18 H new ATOM 0 HB ILE A 251 -3.293 2.911 -7.788 1.00 0.16 H new ATOM 0 HG12 ILE A 251 -1.426 0.857 -6.504 1.00 0.18 H new ATOM 0 HG13 ILE A 251 -3.164 0.673 -6.630 1.00 0.18 H new ATOM 0 HG21 ILE A 251 -0.986 2.908 -8.700 1.00 0.16 H new ATOM 0 HG22 ILE A 251 -1.287 4.366 -7.725 1.00 0.16 H new ATOM 0 HG23 ILE A 251 -0.333 3.024 -7.049 1.00 0.16 H new ATOM 0 HD11 ILE A 251 -2.021 -0.502 -8.494 1.00 0.18 H new ATOM 0 HD12 ILE A 251 -3.014 0.836 -9.118 1.00 0.18 H new ATOM 0 HD13 ILE A 251 -1.249 1.024 -8.990 1.00 0.18 H new ATOM 556 N GLN A 252 -5.119 3.061 -5.960 1.00 0.20 N ATOM 557 CA GLN A 252 -6.494 2.609 -5.588 1.00 0.23 C ATOM 558 C GLN A 252 -7.304 2.397 -6.867 1.00 0.24 C ATOM 559 O GLN A 252 -7.592 3.331 -7.589 1.00 0.27 O ATOM 560 CB GLN A 252 -7.186 3.669 -4.725 1.00 0.28 C ATOM 561 CG GLN A 252 -8.427 3.062 -4.068 1.00 0.31 C ATOM 562 CD GLN A 252 -9.184 4.153 -3.311 1.00 0.97 C ATOM 563 OE1 GLN A 252 -8.979 4.304 -2.031 1.00 1.68 O flip ATOM 564 NE2 GLN A 252 -9.970 4.876 -3.890 1.00 1.81 N flip ATOM 0 H GLN A 252 -5.072 3.671 -6.776 1.00 0.20 H new ATOM 0 HA GLN A 252 -6.427 1.680 -5.021 1.00 0.23 H new ATOM 0 HB2 GLN A 252 -6.500 4.036 -3.962 1.00 0.28 H new ATOM 0 HB3 GLN A 252 -7.468 4.525 -5.338 1.00 0.28 H new ATOM 0 HG2 GLN A 252 -9.071 2.615 -4.825 1.00 0.31 H new ATOM 0 HG3 GLN A 252 -8.137 2.264 -3.385 1.00 0.31 H new ATOM 0 HE21 GLN A 252 -10.130 4.758 -4.890 1.00 1.81 H new ATOM 0 HE22 GLN A 252 -10.470 5.601 -3.376 1.00 1.81 H new ATOM 573 N ASP A 253 -7.689 1.182 -7.154 1.00 0.25 N ATOM 574 CA ASP A 253 -8.496 0.930 -8.383 1.00 0.30 C ATOM 575 C ASP A 253 -9.968 1.037 -7.994 1.00 0.32 C ATOM 576 O ASP A 253 -10.600 2.054 -8.200 1.00 0.36 O ATOM 577 CB ASP A 253 -8.188 -0.470 -8.928 1.00 0.36 C ATOM 578 CG ASP A 253 -8.733 -0.594 -10.353 1.00 0.49 C ATOM 579 OD1 ASP A 253 -8.470 0.295 -11.145 1.00 1.18 O ATOM 580 OD2 ASP A 253 -9.404 -1.576 -10.625 1.00 1.18 O ATOM 0 H ASP A 253 -7.481 0.356 -6.593 1.00 0.25 H new ATOM 0 HA ASP A 253 -8.257 1.655 -9.161 1.00 0.30 H new ATOM 0 HB2 ASP A 253 -7.112 -0.646 -8.922 1.00 0.36 H new ATOM 0 HB3 ASP A 253 -8.638 -1.228 -8.288 1.00 0.36 H new ATOM 585 N ASN A 254 -10.510 0.017 -7.393 1.00 0.33 N ATOM 586 CA ASN A 254 -11.925 0.092 -6.947 1.00 0.36 C ATOM 587 C ASN A 254 -11.927 0.838 -5.614 1.00 0.34 C ATOM 588 O ASN A 254 -11.327 1.887 -5.490 1.00 0.36 O ATOM 589 CB ASN A 254 -12.475 -1.323 -6.752 1.00 0.42 C ATOM 590 CG ASN A 254 -12.112 -2.181 -7.966 1.00 1.22 C ATOM 591 OD1 ASN A 254 -11.643 -1.670 -8.965 1.00 1.98 O ATOM 592 ND2 ASN A 254 -12.311 -3.469 -7.924 1.00 1.88 N ATOM 0 H ASN A 254 -10.035 -0.863 -7.192 1.00 0.33 H new ATOM 0 HA ASN A 254 -12.547 0.603 -7.682 1.00 0.36 H new ATOM 0 HB2 ASN A 254 -12.062 -1.764 -5.845 1.00 0.42 H new ATOM 0 HB3 ASN A 254 -13.557 -1.290 -6.626 1.00 0.42 H new ATOM 0 HD21 ASN A 254 -12.073 -4.048 -8.729 1.00 1.88 H new ATOM 0 HD22 ASN A 254 -12.704 -3.897 -7.086 1.00 1.88 H new ATOM 599 N SER A 255 -12.556 0.292 -4.607 1.00 0.35 N ATOM 600 CA SER A 255 -12.556 0.956 -3.267 1.00 0.37 C ATOM 601 C SER A 255 -11.605 0.185 -2.352 1.00 0.37 C ATOM 602 O SER A 255 -11.975 -0.267 -1.287 1.00 0.42 O ATOM 603 CB SER A 255 -13.967 0.929 -2.678 1.00 0.42 C ATOM 604 OG SER A 255 -14.880 1.472 -3.622 1.00 1.39 O ATOM 0 H SER A 255 -13.071 -0.587 -4.653 1.00 0.35 H new ATOM 0 HA SER A 255 -12.234 1.993 -3.361 1.00 0.37 H new ATOM 0 HB2 SER A 255 -14.250 -0.094 -2.428 1.00 0.42 H new ATOM 0 HB3 SER A 255 -13.998 1.504 -1.752 1.00 0.42 H new ATOM 0 HG SER A 255 -15.786 1.455 -3.248 1.00 1.39 H new ATOM 610 N ASP A 256 -10.380 0.020 -2.776 1.00 0.34 N ATOM 611 CA ASP A 256 -9.390 -0.733 -1.954 1.00 0.37 C ATOM 612 C ASP A 256 -7.976 -0.291 -2.336 1.00 0.34 C ATOM 613 O ASP A 256 -7.595 -0.315 -3.490 1.00 0.31 O ATOM 614 CB ASP A 256 -9.544 -2.234 -2.212 1.00 0.41 C ATOM 615 CG ASP A 256 -10.834 -2.732 -1.558 1.00 0.47 C ATOM 616 OD1 ASP A 256 -11.079 -2.364 -0.420 1.00 1.12 O ATOM 617 OD2 ASP A 256 -11.555 -3.475 -2.204 1.00 1.12 O ATOM 0 H ASP A 256 -10.021 0.377 -3.662 1.00 0.34 H new ATOM 0 HA ASP A 256 -9.564 -0.530 -0.897 1.00 0.37 H new ATOM 0 HB2 ASP A 256 -9.568 -2.429 -3.284 1.00 0.41 H new ATOM 0 HB3 ASP A 256 -8.687 -2.773 -1.809 1.00 0.41 H new ATOM 622 N ILE A 257 -7.201 0.124 -1.373 1.00 0.35 N ATOM 623 CA ILE A 257 -5.809 0.581 -1.661 1.00 0.33 C ATOM 624 C ILE A 257 -4.843 -0.595 -1.500 1.00 0.34 C ATOM 625 O ILE A 257 -4.932 -1.359 -0.559 1.00 0.38 O ATOM 626 CB ILE A 257 -5.451 1.702 -0.681 1.00 0.36 C ATOM 627 CG1 ILE A 257 -6.522 2.794 -0.776 1.00 0.36 C ATOM 628 CG2 ILE A 257 -4.086 2.289 -1.041 1.00 0.34 C ATOM 629 CD1 ILE A 257 -6.154 3.981 0.122 1.00 0.47 C ATOM 0 H ILE A 257 -7.473 0.167 -0.391 1.00 0.35 H new ATOM 0 HA ILE A 257 -5.736 0.954 -2.683 1.00 0.33 H new ATOM 0 HB ILE A 257 -5.408 1.307 0.334 1.00 0.36 H new ATOM 0 HG12 ILE A 257 -6.620 3.128 -1.809 1.00 0.36 H new ATOM 0 HG13 ILE A 257 -7.490 2.390 -0.478 1.00 0.36 H new ATOM 0 HG21 ILE A 257 -3.836 3.086 -0.341 1.00 0.34 H new ATOM 0 HG22 ILE A 257 -3.328 1.508 -0.987 1.00 0.34 H new ATOM 0 HG23 ILE A 257 -4.119 2.693 -2.053 1.00 0.34 H new ATOM 0 HD11 ILE A 257 -6.924 4.749 0.044 1.00 0.47 H new ATOM 0 HD12 ILE A 257 -6.080 3.645 1.156 1.00 0.47 H new ATOM 0 HD13 ILE A 257 -5.196 4.394 -0.195 1.00 0.47 H new ATOM 641 N LYS A 258 -3.922 -0.749 -2.421 1.00 0.31 N ATOM 642 CA LYS A 258 -2.947 -1.882 -2.343 1.00 0.33 C ATOM 643 C LYS A 258 -1.545 -1.384 -2.700 1.00 0.30 C ATOM 644 O LYS A 258 -1.366 -0.268 -3.150 1.00 0.27 O ATOM 645 CB LYS A 258 -3.365 -2.971 -3.335 1.00 0.34 C ATOM 646 CG LYS A 258 -4.581 -3.722 -2.788 1.00 0.42 C ATOM 647 CD LYS A 258 -5.092 -4.706 -3.842 1.00 0.43 C ATOM 648 CE LYS A 258 -6.217 -5.555 -3.246 1.00 1.41 C ATOM 649 NZ LYS A 258 -7.176 -4.673 -2.523 1.00 2.11 N ATOM 0 H LYS A 258 -3.803 -0.135 -3.227 1.00 0.31 H new ATOM 0 HA LYS A 258 -2.938 -2.285 -1.330 1.00 0.33 H new ATOM 0 HB2 LYS A 258 -3.604 -2.526 -4.301 1.00 0.34 H new ATOM 0 HB3 LYS A 258 -2.540 -3.664 -3.499 1.00 0.34 H new ATOM 0 HG2 LYS A 258 -4.312 -4.256 -1.877 1.00 0.42 H new ATOM 0 HG3 LYS A 258 -5.368 -3.016 -2.523 1.00 0.42 H new ATOM 0 HD2 LYS A 258 -5.455 -4.164 -4.715 1.00 0.43 H new ATOM 0 HD3 LYS A 258 -4.278 -5.347 -4.181 1.00 0.43 H new ATOM 0 HE2 LYS A 258 -6.733 -6.100 -4.036 1.00 1.41 H new ATOM 0 HE3 LYS A 258 -5.804 -6.298 -2.563 1.00 1.41 H new ATOM 0 HZ1 LYS A 258 -8.096 -5.152 -2.444 1.00 2.11 H new ATOM 0 HZ2 LYS A 258 -6.809 -4.468 -1.572 1.00 2.11 H new ATOM 0 HZ3 LYS A 258 -7.293 -3.783 -3.048 1.00 2.11 H new ATOM 663 N VAL A 259 -0.548 -2.211 -2.506 1.00 0.30 N ATOM 664 CA VAL A 259 0.856 -1.808 -2.832 1.00 0.28 C ATOM 665 C VAL A 259 1.267 -2.427 -4.171 1.00 0.28 C ATOM 666 O VAL A 259 0.977 -3.576 -4.447 1.00 0.31 O ATOM 667 CB VAL A 259 1.796 -2.306 -1.726 1.00 0.30 C ATOM 668 CG1 VAL A 259 3.124 -1.548 -1.795 1.00 0.28 C ATOM 669 CG2 VAL A 259 1.145 -2.065 -0.362 1.00 0.33 C ATOM 0 H VAL A 259 -0.647 -3.155 -2.133 1.00 0.30 H new ATOM 0 HA VAL A 259 0.918 -0.722 -2.902 1.00 0.28 H new ATOM 0 HB VAL A 259 1.982 -3.371 -1.863 1.00 0.30 H new ATOM 0 HG11 VAL A 259 3.788 -1.905 -1.008 1.00 0.28 H new ATOM 0 HG12 VAL A 259 3.589 -1.717 -2.766 1.00 0.28 H new ATOM 0 HG13 VAL A 259 2.942 -0.482 -1.660 1.00 0.28 H new ATOM 0 HG21 VAL A 259 1.810 -2.418 0.426 1.00 0.33 H new ATOM 0 HG22 VAL A 259 0.960 -0.999 -0.230 1.00 0.33 H new ATOM 0 HG23 VAL A 259 0.201 -2.606 -0.309 1.00 0.33 H new ATOM 679 N VAL A 260 1.948 -1.673 -5.002 1.00 0.26 N ATOM 680 CA VAL A 260 2.396 -2.201 -6.329 1.00 0.26 C ATOM 681 C VAL A 260 3.873 -1.790 -6.551 1.00 0.24 C ATOM 682 O VAL A 260 4.182 -0.621 -6.437 1.00 0.22 O ATOM 683 CB VAL A 260 1.524 -1.575 -7.428 1.00 0.27 C ATOM 684 CG1 VAL A 260 2.033 -2.007 -8.806 1.00 0.34 C ATOM 685 CG2 VAL A 260 0.076 -2.043 -7.252 1.00 0.29 C ATOM 0 H VAL A 260 2.214 -0.706 -4.815 1.00 0.26 H new ATOM 0 HA VAL A 260 2.304 -3.287 -6.359 1.00 0.26 H new ATOM 0 HB VAL A 260 1.573 -0.489 -7.352 1.00 0.27 H new ATOM 0 HG11 VAL A 260 1.410 -1.560 -9.581 1.00 0.34 H new ATOM 0 HG12 VAL A 260 3.064 -1.676 -8.933 1.00 0.34 H new ATOM 0 HG13 VAL A 260 1.988 -3.093 -8.886 1.00 0.34 H new ATOM 0 HG21 VAL A 260 -0.546 -1.601 -8.030 1.00 0.29 H new ATOM 0 HG22 VAL A 260 0.033 -3.130 -7.327 1.00 0.29 H new ATOM 0 HG23 VAL A 260 -0.291 -1.732 -6.274 1.00 0.29 H new ATOM 695 N PRO A 261 4.764 -2.730 -6.855 1.00 0.29 N ATOM 696 CA PRO A 261 6.182 -2.376 -7.078 1.00 0.30 C ATOM 697 C PRO A 261 6.306 -1.335 -8.204 1.00 0.25 C ATOM 698 O PRO A 261 5.565 -1.352 -9.167 1.00 0.24 O ATOM 699 CB PRO A 261 6.877 -3.703 -7.461 1.00 0.37 C ATOM 700 CG PRO A 261 5.812 -4.832 -7.369 1.00 0.42 C ATOM 701 CD PRO A 261 4.464 -4.175 -6.997 1.00 0.36 C ATOM 0 HA PRO A 261 6.639 -1.928 -6.196 1.00 0.30 H new ATOM 0 HB2 PRO A 261 7.287 -3.644 -8.469 1.00 0.37 H new ATOM 0 HB3 PRO A 261 7.711 -3.907 -6.789 1.00 0.37 H new ATOM 0 HG2 PRO A 261 5.731 -5.360 -8.319 1.00 0.42 H new ATOM 0 HG3 PRO A 261 6.099 -5.568 -6.618 1.00 0.42 H new ATOM 0 HD2 PRO A 261 3.715 -4.348 -7.770 1.00 0.36 H new ATOM 0 HD3 PRO A 261 4.067 -4.588 -6.070 1.00 0.36 H new ATOM 709 N ARG A 262 7.249 -0.439 -8.086 1.00 0.27 N ATOM 710 CA ARG A 262 7.438 0.607 -9.133 1.00 0.28 C ATOM 711 C ARG A 262 7.870 -0.042 -10.455 1.00 0.30 C ATOM 712 O ARG A 262 7.487 0.395 -11.521 1.00 0.35 O ATOM 713 CB ARG A 262 8.519 1.589 -8.665 1.00 0.35 C ATOM 714 CG ARG A 262 8.851 2.579 -9.795 1.00 0.59 C ATOM 715 CD ARG A 262 9.735 3.724 -9.266 1.00 1.04 C ATOM 716 NE ARG A 262 9.452 4.971 -10.047 1.00 1.77 N ATOM 717 CZ ARG A 262 9.458 4.966 -11.353 1.00 2.20 C ATOM 718 NH1 ARG A 262 9.898 3.929 -12.009 1.00 2.31 N ATOM 719 NH2 ARG A 262 9.073 6.029 -12.007 1.00 3.12 N ATOM 0 H ARG A 262 7.901 -0.386 -7.304 1.00 0.27 H new ATOM 0 HA ARG A 262 6.498 1.136 -9.292 1.00 0.28 H new ATOM 0 HB2 ARG A 262 8.174 2.131 -7.785 1.00 0.35 H new ATOM 0 HB3 ARG A 262 9.416 1.044 -8.372 1.00 0.35 H new ATOM 0 HG2 ARG A 262 9.365 2.059 -10.603 1.00 0.59 H new ATOM 0 HG3 ARG A 262 7.930 2.986 -10.213 1.00 0.59 H new ATOM 0 HD2 ARG A 262 9.537 3.892 -8.207 1.00 1.04 H new ATOM 0 HD3 ARG A 262 10.788 3.457 -9.355 1.00 1.04 H new ATOM 0 HE ARG A 262 9.251 5.839 -9.550 1.00 1.77 H new ATOM 0 HH11 ARG A 262 10.241 3.113 -11.502 1.00 2.31 H new ATOM 0 HH12 ARG A 262 9.899 3.934 -13.029 1.00 2.31 H new ATOM 0 HH21 ARG A 262 8.769 6.859 -11.498 1.00 3.12 H new ATOM 0 HH22 ARG A 262 9.076 6.029 -13.027 1.00 3.12 H new ATOM 733 N ARG A 263 8.676 -1.068 -10.396 1.00 0.34 N ATOM 734 CA ARG A 263 9.143 -1.724 -11.654 1.00 0.40 C ATOM 735 C ARG A 263 7.974 -2.442 -12.342 1.00 0.40 C ATOM 736 O ARG A 263 8.120 -2.961 -13.432 1.00 0.49 O ATOM 737 CB ARG A 263 10.244 -2.739 -11.326 1.00 0.48 C ATOM 738 CG ARG A 263 9.828 -3.573 -10.112 1.00 1.31 C ATOM 739 CD ARG A 263 10.682 -4.840 -10.034 1.00 1.59 C ATOM 740 NE ARG A 263 10.264 -5.644 -8.851 1.00 2.29 N ATOM 741 CZ ARG A 263 10.623 -6.893 -8.749 1.00 2.90 C ATOM 742 NH1 ARG A 263 11.348 -7.444 -9.684 1.00 3.07 N ATOM 743 NH2 ARG A 263 10.258 -7.594 -7.710 1.00 3.82 N ATOM 0 H ARG A 263 9.031 -1.480 -9.533 1.00 0.34 H new ATOM 0 HA ARG A 263 9.536 -0.961 -12.326 1.00 0.40 H new ATOM 0 HB2 ARG A 263 10.421 -3.389 -12.183 1.00 0.48 H new ATOM 0 HB3 ARG A 263 11.181 -2.221 -11.120 1.00 0.48 H new ATOM 0 HG2 ARG A 263 9.946 -2.988 -9.200 1.00 1.31 H new ATOM 0 HG3 ARG A 263 8.773 -3.839 -10.186 1.00 1.31 H new ATOM 0 HD2 ARG A 263 10.567 -5.426 -10.946 1.00 1.59 H new ATOM 0 HD3 ARG A 263 11.737 -4.577 -9.955 1.00 1.59 H new ATOM 0 HE ARG A 263 9.696 -5.216 -8.120 1.00 2.29 H new ATOM 0 HH11 ARG A 263 11.635 -6.897 -10.496 1.00 3.07 H new ATOM 0 HH12 ARG A 263 11.628 -8.421 -9.603 1.00 3.07 H new ATOM 0 HH21 ARG A 263 9.692 -7.164 -6.978 1.00 3.82 H new ATOM 0 HH22 ARG A 263 10.539 -8.571 -7.630 1.00 3.82 H new ATOM 757 N LYS A 264 6.817 -2.471 -11.721 1.00 0.36 N ATOM 758 CA LYS A 264 5.629 -3.154 -12.342 1.00 0.42 C ATOM 759 C LYS A 264 4.508 -2.130 -12.543 1.00 0.36 C ATOM 760 O LYS A 264 3.350 -2.482 -12.699 1.00 0.38 O ATOM 761 CB LYS A 264 5.130 -4.273 -11.416 1.00 0.54 C ATOM 762 CG LYS A 264 6.153 -5.421 -11.367 1.00 0.85 C ATOM 763 CD LYS A 264 5.462 -6.718 -10.928 1.00 0.95 C ATOM 764 CE LYS A 264 6.513 -7.733 -10.471 1.00 1.29 C ATOM 765 NZ LYS A 264 5.835 -8.968 -9.986 1.00 2.08 N ATOM 0 H LYS A 264 6.641 -2.051 -10.808 1.00 0.36 H new ATOM 0 HA LYS A 264 5.919 -3.582 -13.302 1.00 0.42 H new ATOM 0 HB2 LYS A 264 4.967 -3.879 -10.413 1.00 0.54 H new ATOM 0 HB3 LYS A 264 4.170 -4.647 -11.771 1.00 0.54 H new ATOM 0 HG2 LYS A 264 6.609 -5.556 -12.348 1.00 0.85 H new ATOM 0 HG3 LYS A 264 6.957 -5.174 -10.673 1.00 0.85 H new ATOM 0 HD2 LYS A 264 4.764 -6.513 -10.117 1.00 0.95 H new ATOM 0 HD3 LYS A 264 4.880 -7.129 -11.753 1.00 0.95 H new ATOM 0 HE2 LYS A 264 7.184 -7.974 -11.296 1.00 1.29 H new ATOM 0 HE3 LYS A 264 7.125 -7.306 -9.677 1.00 1.29 H new ATOM 0 HZ1 LYS A 264 6.549 -9.657 -9.676 1.00 2.08 H new ATOM 0 HZ2 LYS A 264 5.212 -8.731 -9.187 1.00 2.08 H new ATOM 0 HZ3 LYS A 264 5.269 -9.379 -10.756 1.00 2.08 H new ATOM 779 N ALA A 265 4.845 -0.864 -12.547 1.00 0.30 N ATOM 780 CA ALA A 265 3.811 0.199 -12.734 1.00 0.27 C ATOM 781 C ALA A 265 4.372 1.309 -13.627 1.00 0.28 C ATOM 782 O ALA A 265 5.549 1.342 -13.927 1.00 0.32 O ATOM 783 CB ALA A 265 3.444 0.788 -11.367 1.00 0.27 C ATOM 0 H ALA A 265 5.798 -0.520 -12.428 1.00 0.30 H new ATOM 0 HA ALA A 265 2.926 -0.231 -13.203 1.00 0.27 H new ATOM 0 HB1 ALA A 265 2.690 1.564 -11.496 1.00 0.27 H new ATOM 0 HB2 ALA A 265 3.048 0.000 -10.726 1.00 0.27 H new ATOM 0 HB3 ALA A 265 4.333 1.219 -10.906 1.00 0.27 H new ATOM 789 N LYS A 266 3.537 2.227 -14.049 1.00 0.26 N ATOM 790 CA LYS A 266 4.012 3.348 -14.922 1.00 0.30 C ATOM 791 C LYS A 266 3.309 4.644 -14.511 1.00 0.27 C ATOM 792 O LYS A 266 2.106 4.682 -14.339 1.00 0.25 O ATOM 793 CB LYS A 266 3.683 3.032 -16.388 1.00 0.35 C ATOM 794 CG LYS A 266 4.202 1.636 -16.742 1.00 0.43 C ATOM 795 CD LYS A 266 4.237 1.470 -18.265 1.00 0.50 C ATOM 796 CE LYS A 266 2.860 1.792 -18.853 1.00 1.09 C ATOM 797 NZ LYS A 266 2.773 1.245 -20.237 1.00 1.79 N ATOM 0 H LYS A 266 2.542 2.249 -13.826 1.00 0.26 H new ATOM 0 HA LYS A 266 5.090 3.465 -14.809 1.00 0.30 H new ATOM 0 HB2 LYS A 266 2.606 3.082 -16.548 1.00 0.35 H new ATOM 0 HB3 LYS A 266 4.137 3.776 -17.042 1.00 0.35 H new ATOM 0 HG2 LYS A 266 5.200 1.492 -16.328 1.00 0.43 H new ATOM 0 HG3 LYS A 266 3.560 0.875 -16.298 1.00 0.43 H new ATOM 0 HD2 LYS A 266 4.990 2.131 -18.695 1.00 0.50 H new ATOM 0 HD3 LYS A 266 4.523 0.450 -18.523 1.00 0.50 H new ATOM 0 HE2 LYS A 266 2.076 1.361 -18.230 1.00 1.09 H new ATOM 0 HE3 LYS A 266 2.701 2.870 -18.865 1.00 1.09 H new ATOM 0 HZ1 LYS A 266 1.839 1.463 -20.638 1.00 1.79 H new ATOM 0 HZ2 LYS A 266 3.512 1.676 -20.828 1.00 1.79 H new ATOM 0 HZ3 LYS A 266 2.907 0.214 -20.212 1.00 1.79 H new ATOM 811 N ILE A 267 4.053 5.708 -14.345 1.00 0.30 N ATOM 812 CA ILE A 267 3.433 7.008 -13.941 1.00 0.32 C ATOM 813 C ILE A 267 3.010 7.785 -15.190 1.00 0.37 C ATOM 814 O ILE A 267 3.833 8.332 -15.898 1.00 0.41 O ATOM 815 CB ILE A 267 4.457 7.839 -13.152 1.00 0.36 C ATOM 816 CG1 ILE A 267 5.070 6.977 -12.028 1.00 0.36 C ATOM 817 CG2 ILE A 267 3.782 9.097 -12.566 1.00 0.39 C ATOM 818 CD1 ILE A 267 3.970 6.289 -11.210 1.00 0.45 C ATOM 0 H ILE A 267 5.065 5.733 -14.472 1.00 0.30 H new ATOM 0 HA ILE A 267 2.559 6.813 -13.319 1.00 0.32 H new ATOM 0 HB ILE A 267 5.254 8.159 -13.823 1.00 0.36 H new ATOM 0 HG12 ILE A 267 5.733 6.226 -12.459 1.00 0.36 H new ATOM 0 HG13 ILE A 267 5.679 7.602 -11.375 1.00 0.36 H new ATOM 0 HG21 ILE A 267 4.517 9.678 -12.009 1.00 0.39 H new ATOM 0 HG22 ILE A 267 3.378 9.704 -13.376 1.00 0.39 H new ATOM 0 HG23 ILE A 267 2.974 8.799 -11.898 1.00 0.39 H new ATOM 0 HD11 ILE A 267 4.424 5.687 -10.423 1.00 0.45 H new ATOM 0 HD12 ILE A 267 3.324 7.044 -10.762 1.00 0.45 H new ATOM 0 HD13 ILE A 267 3.379 5.647 -11.863 1.00 0.45 H new ATOM 830 N ILE A 268 1.728 7.841 -15.464 1.00 0.39 N ATOM 831 CA ILE A 268 1.232 8.589 -16.667 1.00 0.45 C ATOM 832 C ILE A 268 0.590 9.902 -16.214 1.00 0.48 C ATOM 833 O ILE A 268 0.132 10.027 -15.097 1.00 0.47 O ATOM 834 CB ILE A 268 0.174 7.751 -17.400 1.00 0.48 C ATOM 835 CG1 ILE A 268 0.666 6.300 -17.569 1.00 0.50 C ATOM 836 CG2 ILE A 268 -0.149 8.375 -18.773 1.00 0.56 C ATOM 837 CD1 ILE A 268 1.965 6.246 -18.381 1.00 0.57 C ATOM 0 H ILE A 268 0.999 7.399 -14.904 1.00 0.39 H new ATOM 0 HA ILE A 268 2.070 8.789 -17.335 1.00 0.45 H new ATOM 0 HB ILE A 268 -0.738 7.741 -16.803 1.00 0.48 H new ATOM 0 HG12 ILE A 268 0.828 5.852 -16.589 1.00 0.50 H new ATOM 0 HG13 ILE A 268 -0.102 5.708 -18.067 1.00 0.50 H new ATOM 0 HG21 ILE A 268 -0.900 7.770 -19.280 1.00 0.56 H new ATOM 0 HG22 ILE A 268 -0.532 9.386 -18.632 1.00 0.56 H new ATOM 0 HG23 ILE A 268 0.757 8.411 -19.378 1.00 0.56 H new ATOM 0 HD11 ILE A 268 2.287 5.210 -18.483 1.00 0.57 H new ATOM 0 HD12 ILE A 268 1.794 6.672 -19.370 1.00 0.57 H new ATOM 0 HD13 ILE A 268 2.739 6.818 -17.868 1.00 0.57 H new ATOM 849 N ARG A 269 0.545 10.877 -17.081 1.00 0.56 N ATOM 850 CA ARG A 269 -0.075 12.189 -16.718 1.00 0.62 C ATOM 851 C ARG A 269 -1.559 12.173 -17.093 1.00 0.66 C ATOM 852 O ARG A 269 -1.958 11.548 -18.054 1.00 0.73 O ATOM 853 CB ARG A 269 0.625 13.312 -17.486 1.00 0.73 C ATOM 854 CG ARG A 269 0.221 14.665 -16.896 1.00 1.48 C ATOM 855 CD ARG A 269 0.895 15.788 -17.686 1.00 1.80 C ATOM 856 NE ARG A 269 2.354 15.798 -17.386 1.00 2.23 N ATOM 857 CZ ARG A 269 3.173 16.469 -18.149 1.00 2.82 C ATOM 858 NH1 ARG A 269 2.714 17.136 -19.172 1.00 3.12 N ATOM 859 NH2 ARG A 269 4.452 16.476 -17.888 1.00 3.63 N ATOM 0 H ARG A 269 0.912 10.823 -18.031 1.00 0.56 H new ATOM 0 HA ARG A 269 0.031 12.355 -15.646 1.00 0.62 H new ATOM 0 HB2 ARG A 269 1.706 13.187 -17.428 1.00 0.73 H new ATOM 0 HB3 ARG A 269 0.355 13.268 -18.541 1.00 0.73 H new ATOM 0 HG2 ARG A 269 -0.862 14.780 -16.932 1.00 1.48 H new ATOM 0 HG3 ARG A 269 0.513 14.718 -15.847 1.00 1.48 H new ATOM 0 HD2 ARG A 269 0.733 15.644 -18.754 1.00 1.80 H new ATOM 0 HD3 ARG A 269 0.452 16.749 -17.423 1.00 1.80 H new ATOM 0 HE ARG A 269 2.713 15.280 -16.584 1.00 2.23 H new ATOM 0 HH11 ARG A 269 1.715 17.133 -19.376 1.00 3.12 H new ATOM 0 HH12 ARG A 269 3.355 17.660 -19.768 1.00 3.12 H new ATOM 0 HH21 ARG A 269 4.812 15.957 -17.087 1.00 3.63 H new ATOM 0 HH22 ARG A 269 5.091 17.001 -18.485 1.00 3.63 H new ATOM 873 N ASP A 270 -2.382 12.863 -16.347 1.00 0.67 N ATOM 874 CA ASP A 270 -3.841 12.890 -16.669 1.00 0.75 C ATOM 875 C ASP A 270 -4.126 14.035 -17.643 1.00 1.18 C ATOM 876 O ASP A 270 -4.146 13.782 -18.837 1.00 1.73 O ATOM 877 CB ASP A 270 -4.642 13.104 -15.383 1.00 0.91 C ATOM 878 CG ASP A 270 -4.577 11.839 -14.528 1.00 1.47 C ATOM 879 OD1 ASP A 270 -3.630 11.087 -14.689 1.00 2.05 O ATOM 880 OD2 ASP A 270 -5.475 11.644 -13.726 1.00 2.05 O ATOM 881 OXT ASP A 270 -4.320 15.147 -17.179 1.00 1.84 O ATOM 0 H ASP A 270 -2.108 13.408 -15.530 1.00 0.67 H new ATOM 0 HA ASP A 270 -4.131 11.943 -17.125 1.00 0.75 H new ATOM 0 HB2 ASP A 270 -4.241 13.952 -14.828 1.00 0.91 H new ATOM 0 HB3 ASP A 270 -5.679 13.342 -15.622 1.00 0.91 H new TER 886 ASP A 270 ATOM 887 N MET B 219 3.686 15.973 5.574 1.00 1.76 N ATOM 888 CA MET B 219 3.990 16.996 6.612 1.00 1.15 C ATOM 889 C MET B 219 3.905 16.359 8.001 1.00 1.04 C ATOM 890 O MET B 219 3.770 17.041 8.998 1.00 1.10 O ATOM 891 CB MET B 219 2.980 18.143 6.517 1.00 1.82 C ATOM 892 CG MET B 219 1.561 17.588 6.644 1.00 2.31 C ATOM 893 SD MET B 219 0.368 18.885 6.228 1.00 3.46 S ATOM 894 CE MET B 219 -1.009 17.796 5.791 1.00 3.83 C ATOM 0 HA MET B 219 4.996 17.384 6.450 1.00 1.15 H new ATOM 0 HB2 MET B 219 3.168 18.873 7.305 1.00 1.82 H new ATOM 0 HB3 MET B 219 3.094 18.664 5.566 1.00 1.82 H new ATOM 0 HG2 MET B 219 1.432 16.734 5.980 1.00 2.31 H new ATOM 0 HG3 MET B 219 1.388 17.231 7.659 1.00 2.31 H new ATOM 0 HE1 MET B 219 -1.869 18.397 5.497 1.00 3.83 H new ATOM 0 HE2 MET B 219 -0.715 17.153 4.962 1.00 3.83 H new ATOM 0 HE3 MET B 219 -1.274 17.181 6.651 1.00 3.83 H new ATOM 904 N ILE B 220 3.984 15.057 8.077 1.00 0.98 N ATOM 905 CA ILE B 220 3.909 14.382 9.402 1.00 0.97 C ATOM 906 C ILE B 220 5.285 14.412 10.067 1.00 0.94 C ATOM 907 O ILE B 220 6.303 14.263 9.422 1.00 1.01 O ATOM 908 CB ILE B 220 3.465 12.928 9.221 1.00 1.03 C ATOM 909 CG1 ILE B 220 4.280 12.257 8.092 1.00 1.36 C ATOM 910 CG2 ILE B 220 1.974 12.899 8.878 1.00 1.79 C ATOM 911 CD1 ILE B 220 4.390 10.752 8.360 1.00 2.08 C ATOM 0 H ILE B 220 4.097 14.433 7.278 1.00 0.98 H new ATOM 0 HA ILE B 220 3.186 14.904 10.029 1.00 0.97 H new ATOM 0 HB ILE B 220 3.639 12.379 10.146 1.00 1.03 H new ATOM 0 HG12 ILE B 220 3.798 12.431 7.130 1.00 1.36 H new ATOM 0 HG13 ILE B 220 5.274 12.700 8.035 1.00 1.36 H new ATOM 0 HG21 ILE B 220 1.651 11.866 8.748 1.00 1.79 H new ATOM 0 HG22 ILE B 220 1.406 13.358 9.687 1.00 1.79 H new ATOM 0 HG23 ILE B 220 1.802 13.452 7.955 1.00 1.79 H new ATOM 0 HD11 ILE B 220 4.965 10.281 7.562 1.00 2.08 H new ATOM 0 HD12 ILE B 220 4.891 10.588 9.314 1.00 2.08 H new ATOM 0 HD13 ILE B 220 3.392 10.315 8.394 1.00 2.08 H new ATOM 923 N GLN B 221 5.324 14.615 11.352 1.00 0.90 N ATOM 924 CA GLN B 221 6.633 14.664 12.063 1.00 0.92 C ATOM 925 C GLN B 221 7.056 13.247 12.450 1.00 0.83 C ATOM 926 O GLN B 221 6.954 12.323 11.670 1.00 0.85 O ATOM 927 CB GLN B 221 6.487 15.522 13.321 1.00 1.00 C ATOM 928 CG GLN B 221 5.727 16.803 12.970 1.00 1.28 C ATOM 929 CD GLN B 221 5.610 17.684 14.216 1.00 1.61 C ATOM 930 OE1 GLN B 221 4.570 17.733 14.842 1.00 2.08 O ATOM 931 NE2 GLN B 221 6.640 18.385 14.605 1.00 2.16 N ATOM 0 H GLN B 221 4.504 14.750 11.944 1.00 0.90 H new ATOM 0 HA GLN B 221 7.392 15.098 11.412 1.00 0.92 H new ATOM 0 HB2 GLN B 221 5.953 14.968 14.094 1.00 1.00 H new ATOM 0 HB3 GLN B 221 7.469 15.767 13.725 1.00 1.00 H new ATOM 0 HG2 GLN B 221 6.247 17.342 12.178 1.00 1.28 H new ATOM 0 HG3 GLN B 221 4.735 16.558 12.590 1.00 1.28 H new ATOM 0 HE21 GLN B 221 7.513 18.344 14.079 1.00 2.16 H new ATOM 0 HE22 GLN B 221 6.572 18.974 15.435 1.00 2.16 H new ATOM 940 N ASN B 222 7.523 13.066 13.658 1.00 0.78 N ATOM 941 CA ASN B 222 7.949 11.706 14.106 1.00 0.73 C ATOM 942 C ASN B 222 6.779 11.027 14.821 1.00 0.63 C ATOM 943 O ASN B 222 6.387 11.422 15.903 1.00 0.64 O ATOM 944 CB ASN B 222 9.130 11.833 15.069 1.00 0.80 C ATOM 945 CG ASN B 222 10.266 12.595 14.385 1.00 0.93 C ATOM 946 OD1 ASN B 222 10.154 12.972 13.235 1.00 1.48 O ATOM 947 ND2 ASN B 222 11.362 12.840 15.047 1.00 1.39 N ATOM 0 H ASN B 222 7.628 13.803 14.355 1.00 0.78 H new ATOM 0 HA ASN B 222 8.249 11.111 13.243 1.00 0.73 H new ATOM 0 HB2 ASN B 222 8.820 12.356 15.974 1.00 0.80 H new ATOM 0 HB3 ASN B 222 9.473 10.844 15.373 1.00 0.80 H new ATOM 0 HD21 ASN B 222 12.125 13.348 14.600 1.00 1.39 H new ATOM 0 HD22 ASN B 222 11.456 12.524 16.012 1.00 1.39 H new ATOM 954 N PHE B 223 6.218 10.010 14.218 1.00 0.55 N ATOM 955 CA PHE B 223 5.064 9.290 14.841 1.00 0.46 C ATOM 956 C PHE B 223 5.297 7.781 14.748 1.00 0.38 C ATOM 957 O PHE B 223 5.739 7.273 13.736 1.00 0.38 O ATOM 958 CB PHE B 223 3.775 9.649 14.085 1.00 0.46 C ATOM 959 CG PHE B 223 3.255 10.988 14.553 1.00 0.53 C ATOM 960 CD1 PHE B 223 2.460 11.063 15.712 1.00 0.54 C ATOM 961 CD2 PHE B 223 3.561 12.156 13.830 1.00 0.64 C ATOM 962 CE1 PHE B 223 1.969 12.309 16.149 1.00 0.64 C ATOM 963 CE2 PHE B 223 3.071 13.402 14.266 1.00 0.73 C ATOM 964 CZ PHE B 223 2.275 13.478 15.427 1.00 0.72 C ATOM 0 H PHE B 223 6.512 9.644 13.313 1.00 0.55 H new ATOM 0 HA PHE B 223 4.972 9.583 15.887 1.00 0.46 H new ATOM 0 HB2 PHE B 223 3.970 9.680 13.013 1.00 0.46 H new ATOM 0 HB3 PHE B 223 3.021 8.879 14.250 1.00 0.46 H new ATOM 0 HD1 PHE B 223 2.227 10.166 16.266 1.00 0.54 H new ATOM 0 HD2 PHE B 223 4.171 12.097 12.941 1.00 0.64 H new ATOM 0 HE1 PHE B 223 1.358 12.367 17.038 1.00 0.64 H new ATOM 0 HE2 PHE B 223 3.305 14.299 13.711 1.00 0.73 H new ATOM 0 HZ PHE B 223 1.900 14.433 15.763 1.00 0.72 H new ATOM 974 N ARG B 224 4.987 7.063 15.796 1.00 0.36 N ATOM 975 CA ARG B 224 5.163 5.578 15.790 1.00 0.30 C ATOM 976 C ARG B 224 3.775 4.938 15.717 1.00 0.26 C ATOM 977 O ARG B 224 2.782 5.567 16.025 1.00 0.28 O ATOM 978 CB ARG B 224 5.867 5.144 17.088 1.00 0.34 C ATOM 979 CG ARG B 224 7.384 5.241 16.915 1.00 1.00 C ATOM 980 CD ARG B 224 8.068 4.988 18.259 1.00 1.24 C ATOM 981 NE ARG B 224 7.546 5.952 19.270 1.00 1.82 N ATOM 982 CZ ARG B 224 7.744 5.732 20.540 1.00 2.35 C ATOM 983 NH1 ARG B 224 8.384 4.663 20.925 1.00 2.57 N ATOM 984 NH2 ARG B 224 7.298 6.580 21.427 1.00 3.26 N ATOM 0 H ARG B 224 4.615 7.445 16.666 1.00 0.36 H new ATOM 0 HA ARG B 224 5.767 5.266 14.938 1.00 0.30 H new ATOM 0 HB2 ARG B 224 5.545 5.777 17.915 1.00 0.34 H new ATOM 0 HB3 ARG B 224 5.586 4.122 17.340 1.00 0.34 H new ATOM 0 HG2 ARG B 224 7.724 4.512 16.179 1.00 1.00 H new ATOM 0 HG3 ARG B 224 7.655 6.227 16.537 1.00 1.00 H new ATOM 0 HD2 ARG B 224 7.883 3.965 18.587 1.00 1.24 H new ATOM 0 HD3 ARG B 224 9.147 5.100 18.157 1.00 1.24 H new ATOM 0 HE ARG B 224 7.035 6.782 18.969 1.00 1.82 H new ATOM 0 HH11 ARG B 224 8.730 3.999 20.233 1.00 2.57 H new ATOM 0 HH12 ARG B 224 8.539 4.491 21.918 1.00 2.57 H new ATOM 0 HH21 ARG B 224 6.795 7.415 21.127 1.00 3.26 H new ATOM 0 HH22 ARG B 224 7.453 6.408 22.420 1.00 3.26 H new ATOM 998 N VAL B 225 3.692 3.699 15.309 1.00 0.22 N ATOM 999 CA VAL B 225 2.359 3.029 15.210 1.00 0.20 C ATOM 1000 C VAL B 225 2.476 1.566 15.641 1.00 0.20 C ATOM 1001 O VAL B 225 3.414 0.877 15.294 1.00 0.22 O ATOM 1002 CB VAL B 225 1.871 3.092 13.760 1.00 0.20 C ATOM 1003 CG1 VAL B 225 0.578 2.287 13.616 1.00 0.20 C ATOM 1004 CG2 VAL B 225 1.606 4.549 13.375 1.00 0.23 C ATOM 0 H VAL B 225 4.488 3.121 15.040 1.00 0.22 H new ATOM 0 HA VAL B 225 1.651 3.539 15.863 1.00 0.20 H new ATOM 0 HB VAL B 225 2.634 2.672 13.104 1.00 0.20 H new ATOM 0 HG11 VAL B 225 0.233 2.334 12.583 1.00 0.20 H new ATOM 0 HG12 VAL B 225 0.764 1.248 13.890 1.00 0.20 H new ATOM 0 HG13 VAL B 225 -0.185 2.704 14.272 1.00 0.20 H new ATOM 0 HG21 VAL B 225 1.259 4.595 12.343 1.00 0.23 H new ATOM 0 HG22 VAL B 225 0.844 4.967 14.033 1.00 0.23 H new ATOM 0 HG23 VAL B 225 2.526 5.125 13.474 1.00 0.23 H new ATOM 1014 N TYR B 226 1.507 1.084 16.380 1.00 0.22 N ATOM 1015 CA TYR B 226 1.517 -0.344 16.825 1.00 0.25 C ATOM 1016 C TYR B 226 0.431 -1.076 16.041 1.00 0.26 C ATOM 1017 O TYR B 226 -0.549 -0.484 15.640 1.00 0.26 O ATOM 1018 CB TYR B 226 1.206 -0.429 18.323 1.00 0.32 C ATOM 1019 CG TYR B 226 2.377 0.096 19.126 1.00 0.35 C ATOM 1020 CD1 TYR B 226 2.626 1.479 19.185 1.00 0.42 C ATOM 1021 CD2 TYR B 226 3.212 -0.800 19.826 1.00 0.42 C ATOM 1022 CE1 TYR B 226 3.707 1.969 19.943 1.00 0.50 C ATOM 1023 CE2 TYR B 226 4.294 -0.309 20.581 1.00 0.48 C ATOM 1024 CZ TYR B 226 4.541 1.076 20.640 1.00 0.49 C ATOM 1025 OH TYR B 226 5.601 1.556 21.382 1.00 0.58 O ATOM 0 H TYR B 226 0.702 1.624 16.697 1.00 0.22 H new ATOM 0 HA TYR B 226 2.496 -0.790 16.648 1.00 0.25 H new ATOM 0 HB2 TYR B 226 0.310 0.149 18.550 1.00 0.32 H new ATOM 0 HB3 TYR B 226 0.998 -1.462 18.601 1.00 0.32 H new ATOM 0 HD1 TYR B 226 1.988 2.166 18.649 1.00 0.42 H new ATOM 0 HD2 TYR B 226 3.021 -1.862 19.783 1.00 0.42 H new ATOM 0 HE1 TYR B 226 3.896 3.031 19.989 1.00 0.50 H new ATOM 0 HE2 TYR B 226 4.935 -0.995 21.115 1.00 0.48 H new ATOM 0 HH TYR B 226 6.074 0.806 21.800 1.00 0.58 H new ATOM 1035 N TYR B 227 0.584 -2.349 15.803 1.00 0.29 N ATOM 1036 CA TYR B 227 -0.463 -3.072 15.022 1.00 0.32 C ATOM 1037 C TYR B 227 -0.443 -4.562 15.351 1.00 0.38 C ATOM 1038 O TYR B 227 0.572 -5.121 15.719 1.00 0.39 O ATOM 1039 CB TYR B 227 -0.190 -2.883 13.527 1.00 0.31 C ATOM 1040 CG TYR B 227 1.192 -3.401 13.188 1.00 0.31 C ATOM 1041 CD1 TYR B 227 2.336 -2.687 13.600 1.00 0.28 C ATOM 1042 CD2 TYR B 227 1.338 -4.596 12.454 1.00 0.39 C ATOM 1043 CE1 TYR B 227 3.621 -3.168 13.280 1.00 0.32 C ATOM 1044 CE2 TYR B 227 2.622 -5.074 12.134 1.00 0.42 C ATOM 1045 CZ TYR B 227 3.763 -4.361 12.547 1.00 0.38 C ATOM 1046 OH TYR B 227 5.022 -4.831 12.232 1.00 0.44 O ATOM 0 H TYR B 227 1.376 -2.915 16.109 1.00 0.29 H new ATOM 0 HA TYR B 227 -1.441 -2.668 15.282 1.00 0.32 H new ATOM 0 HB2 TYR B 227 -0.941 -3.413 12.941 1.00 0.31 H new ATOM 0 HB3 TYR B 227 -0.267 -1.828 13.264 1.00 0.31 H new ATOM 0 HD1 TYR B 227 2.227 -1.771 14.161 1.00 0.28 H new ATOM 0 HD2 TYR B 227 0.463 -5.145 12.137 1.00 0.39 H new ATOM 0 HE1 TYR B 227 4.497 -2.621 13.597 1.00 0.32 H new ATOM 0 HE2 TYR B 227 2.732 -5.989 11.571 1.00 0.42 H new ATOM 0 HH TYR B 227 5.699 -4.219 12.590 1.00 0.44 H new ATOM 1056 N ARG B 228 -1.570 -5.214 15.215 1.00 0.43 N ATOM 1057 CA ARG B 228 -1.636 -6.677 15.512 1.00 0.50 C ATOM 1058 C ARG B 228 -1.456 -7.467 14.215 1.00 0.55 C ATOM 1059 O ARG B 228 -1.812 -7.016 13.144 1.00 0.61 O ATOM 1060 CB ARG B 228 -3.001 -7.018 16.125 1.00 0.56 C ATOM 1061 CG ARG B 228 -3.423 -5.911 17.099 1.00 0.67 C ATOM 1062 CD ARG B 228 -4.524 -6.427 18.032 1.00 0.73 C ATOM 1063 NE ARG B 228 -5.513 -7.255 17.261 1.00 1.49 N ATOM 1064 CZ ARG B 228 -6.136 -6.780 16.215 1.00 1.73 C ATOM 1065 NH1 ARG B 228 -6.049 -5.514 15.910 1.00 1.49 N ATOM 1066 NH2 ARG B 228 -6.891 -7.568 15.499 1.00 2.76 N ATOM 0 H ARG B 228 -2.449 -4.795 14.910 1.00 0.43 H new ATOM 0 HA ARG B 228 -0.845 -6.938 16.216 1.00 0.50 H new ATOM 0 HB2 ARG B 228 -3.747 -7.126 15.338 1.00 0.56 H new ATOM 0 HB3 ARG B 228 -2.947 -7.973 16.647 1.00 0.56 H new ATOM 0 HG2 ARG B 228 -2.564 -5.582 17.684 1.00 0.67 H new ATOM 0 HG3 ARG B 228 -3.782 -5.044 16.544 1.00 0.67 H new ATOM 0 HD2 ARG B 228 -4.084 -7.024 18.831 1.00 0.73 H new ATOM 0 HD3 ARG B 228 -5.033 -5.587 18.505 1.00 0.73 H new ATOM 0 HE ARG B 228 -5.703 -8.211 17.561 1.00 1.49 H new ATOM 0 HH11 ARG B 228 -5.491 -4.887 16.490 1.00 1.49 H new ATOM 0 HH12 ARG B 228 -6.539 -5.152 15.092 1.00 1.49 H new ATOM 0 HH21 ARG B 228 -6.993 -8.550 15.757 1.00 2.76 H new ATOM 0 HH22 ARG B 228 -7.379 -7.202 14.682 1.00 2.76 H new ATOM 1080 N ASP B 229 -0.920 -8.654 14.308 1.00 0.59 N ATOM 1081 CA ASP B 229 -0.725 -9.494 13.087 1.00 0.67 C ATOM 1082 C ASP B 229 -1.898 -10.467 12.963 1.00 0.75 C ATOM 1083 O ASP B 229 -2.665 -10.648 13.890 1.00 0.77 O ATOM 1084 CB ASP B 229 0.579 -10.284 13.215 1.00 0.73 C ATOM 1085 CG ASP B 229 1.713 -9.339 13.622 1.00 1.42 C ATOM 1086 OD1 ASP B 229 1.422 -8.199 13.943 1.00 2.08 O ATOM 1087 OD2 ASP B 229 2.852 -9.774 13.605 1.00 2.23 O ATOM 0 H ASP B 229 -0.607 -9.081 15.180 1.00 0.59 H new ATOM 0 HA ASP B 229 -0.676 -8.857 12.204 1.00 0.67 H new ATOM 0 HB2 ASP B 229 0.466 -11.074 13.957 1.00 0.73 H new ATOM 0 HB3 ASP B 229 0.817 -10.768 12.268 1.00 0.73 H new ATOM 1092 N SER B 230 -2.042 -11.104 11.835 1.00 0.85 N ATOM 1093 CA SER B 230 -3.163 -12.071 11.665 1.00 0.99 C ATOM 1094 C SER B 230 -2.756 -13.423 12.256 1.00 1.05 C ATOM 1095 O SER B 230 -3.560 -14.325 12.384 1.00 1.19 O ATOM 1096 CB SER B 230 -3.475 -12.236 10.177 1.00 1.08 C ATOM 1097 OG SER B 230 -4.559 -13.142 10.021 1.00 1.81 O ATOM 0 H SER B 230 -1.433 -10.997 11.024 1.00 0.85 H new ATOM 0 HA SER B 230 -4.049 -11.699 12.179 1.00 0.99 H new ATOM 0 HB2 SER B 230 -3.727 -11.271 9.737 1.00 1.08 H new ATOM 0 HB3 SER B 230 -2.597 -12.607 9.649 1.00 1.08 H new ATOM 0 HG SER B 230 -4.519 -13.824 10.723 1.00 1.81 H new ATOM 1103 N ARG B 231 -1.508 -13.569 12.617 1.00 1.01 N ATOM 1104 CA ARG B 231 -1.039 -14.860 13.203 1.00 1.12 C ATOM 1105 C ARG B 231 -1.195 -14.826 14.726 1.00 1.15 C ATOM 1106 O ARG B 231 -1.155 -15.848 15.383 1.00 1.31 O ATOM 1107 CB ARG B 231 0.435 -15.070 12.851 1.00 1.15 C ATOM 1108 CG ARG B 231 0.653 -14.771 11.367 1.00 1.19 C ATOM 1109 CD ARG B 231 2.038 -15.264 10.946 1.00 1.48 C ATOM 1110 NE ARG B 231 2.277 -14.914 9.517 1.00 2.10 N ATOM 1111 CZ ARG B 231 3.487 -14.962 9.030 1.00 2.68 C ATOM 1112 NH1 ARG B 231 4.483 -15.313 9.796 1.00 2.81 N ATOM 1113 NH2 ARG B 231 3.699 -14.659 7.778 1.00 3.64 N ATOM 0 H ARG B 231 -0.791 -12.848 12.531 1.00 1.01 H new ATOM 0 HA ARG B 231 -1.636 -15.677 12.797 1.00 1.12 H new ATOM 0 HB2 ARG B 231 1.062 -14.418 13.460 1.00 1.15 H new ATOM 0 HB3 ARG B 231 0.730 -16.095 13.073 1.00 1.15 H new ATOM 0 HG2 ARG B 231 -0.116 -15.260 10.770 1.00 1.19 H new ATOM 0 HG3 ARG B 231 0.565 -13.700 11.184 1.00 1.19 H new ATOM 0 HD2 ARG B 231 2.804 -14.811 11.575 1.00 1.48 H new ATOM 0 HD3 ARG B 231 2.109 -16.343 11.084 1.00 1.48 H new ATOM 0 HE ARG B 231 1.497 -14.638 8.921 1.00 2.10 H new ATOM 0 HH11 ARG B 231 4.316 -15.549 10.774 1.00 2.81 H new ATOM 0 HH12 ARG B 231 5.429 -15.351 9.417 1.00 2.81 H new ATOM 0 HH21 ARG B 231 2.919 -14.385 7.181 1.00 3.64 H new ATOM 0 HH22 ARG B 231 4.645 -14.696 7.397 1.00 3.64 H new ATOM 1127 N ASP B 232 -1.372 -13.662 15.296 1.00 1.03 N ATOM 1128 CA ASP B 232 -1.526 -13.570 16.778 1.00 1.08 C ATOM 1129 C ASP B 232 -2.190 -12.217 17.141 1.00 0.95 C ATOM 1130 O ASP B 232 -1.732 -11.192 16.676 1.00 0.83 O ATOM 1131 CB ASP B 232 -0.140 -13.633 17.427 1.00 1.15 C ATOM 1132 CG ASP B 232 0.428 -15.047 17.292 1.00 1.62 C ATOM 1133 OD1 ASP B 232 -0.277 -15.983 17.633 1.00 2.16 O ATOM 1134 OD2 ASP B 232 1.558 -15.172 16.848 1.00 2.13 O ATOM 0 H ASP B 232 -1.416 -12.772 14.799 1.00 1.03 H new ATOM 0 HA ASP B 232 -2.145 -14.393 17.136 1.00 1.08 H new ATOM 0 HB2 ASP B 232 0.528 -12.915 16.951 1.00 1.15 H new ATOM 0 HB3 ASP B 232 -0.207 -13.357 18.479 1.00 1.15 H new ATOM 1139 N PRO B 233 -3.243 -12.218 17.953 1.00 1.03 N ATOM 1140 CA PRO B 233 -3.910 -10.951 18.331 1.00 0.98 C ATOM 1141 C PRO B 233 -2.980 -10.096 19.209 1.00 0.86 C ATOM 1142 O PRO B 233 -3.398 -9.118 19.797 1.00 0.84 O ATOM 1143 CB PRO B 233 -5.164 -11.387 19.124 1.00 1.15 C ATOM 1144 CG PRO B 233 -5.013 -12.903 19.423 1.00 1.27 C ATOM 1145 CD PRO B 233 -3.854 -13.430 18.549 1.00 1.21 C ATOM 0 HA PRO B 233 -4.165 -10.342 17.464 1.00 0.98 H new ATOM 0 HB2 PRO B 233 -5.250 -10.819 20.050 1.00 1.15 H new ATOM 0 HB3 PRO B 233 -6.069 -11.197 18.548 1.00 1.15 H new ATOM 0 HG2 PRO B 233 -4.803 -13.067 20.480 1.00 1.27 H new ATOM 0 HG3 PRO B 233 -5.938 -13.434 19.196 1.00 1.27 H new ATOM 0 HD2 PRO B 233 -3.130 -13.985 19.146 1.00 1.21 H new ATOM 0 HD3 PRO B 233 -4.218 -14.109 17.778 1.00 1.21 H new ATOM 1153 N VAL B 234 -1.728 -10.456 19.312 1.00 0.86 N ATOM 1154 CA VAL B 234 -0.792 -9.662 20.163 1.00 0.81 C ATOM 1155 C VAL B 234 -0.261 -8.458 19.378 1.00 0.70 C ATOM 1156 O VAL B 234 0.115 -8.570 18.229 1.00 0.73 O ATOM 1157 CB VAL B 234 0.379 -10.551 20.592 1.00 0.91 C ATOM 1158 CG1 VAL B 234 -0.160 -11.834 21.229 1.00 1.74 C ATOM 1159 CG2 VAL B 234 1.230 -10.908 19.367 1.00 1.76 C ATOM 0 H VAL B 234 -1.313 -11.263 18.846 1.00 0.86 H new ATOM 0 HA VAL B 234 -1.324 -9.304 21.044 1.00 0.81 H new ATOM 0 HB VAL B 234 0.993 -10.015 21.316 1.00 0.91 H new ATOM 0 HG11 VAL B 234 0.673 -12.467 21.534 1.00 1.74 H new ATOM 0 HG12 VAL B 234 -0.763 -11.582 22.102 1.00 1.74 H new ATOM 0 HG13 VAL B 234 -0.775 -12.369 20.505 1.00 1.74 H new ATOM 0 HG21 VAL B 234 2.063 -11.541 19.674 1.00 1.76 H new ATOM 0 HG22 VAL B 234 0.617 -11.442 18.641 1.00 1.76 H new ATOM 0 HG23 VAL B 234 1.616 -9.995 18.914 1.00 1.76 H new ATOM 1169 N TRP B 235 -0.220 -7.307 19.995 1.00 0.65 N ATOM 1170 CA TRP B 235 0.294 -6.095 19.289 1.00 0.56 C ATOM 1171 C TRP B 235 1.700 -6.384 18.756 1.00 0.54 C ATOM 1172 O TRP B 235 2.320 -7.362 19.127 1.00 0.66 O ATOM 1173 CB TRP B 235 0.368 -4.920 20.271 1.00 0.56 C ATOM 1174 CG TRP B 235 -1.012 -4.464 20.625 1.00 0.58 C ATOM 1175 CD1 TRP B 235 -1.659 -4.763 21.774 1.00 0.66 C ATOM 1176 CD2 TRP B 235 -1.921 -3.635 19.845 1.00 0.54 C ATOM 1177 NE1 TRP B 235 -2.911 -4.172 21.752 1.00 0.67 N ATOM 1178 CE2 TRP B 235 -3.123 -3.465 20.585 1.00 0.60 C ATOM 1179 CE3 TRP B 235 -1.826 -3.018 18.576 1.00 0.47 C ATOM 1180 CZ2 TRP B 235 -4.192 -2.709 20.086 1.00 0.60 C ATOM 1181 CZ3 TRP B 235 -2.900 -2.255 18.068 1.00 0.47 C ATOM 1182 CH2 TRP B 235 -4.080 -2.103 18.822 1.00 0.53 C ATOM 0 H TRP B 235 -0.520 -7.153 20.958 1.00 0.65 H new ATOM 0 HA TRP B 235 -0.375 -5.844 18.466 1.00 0.56 H new ATOM 0 HB2 TRP B 235 0.903 -5.221 21.172 1.00 0.56 H new ATOM 0 HB3 TRP B 235 0.929 -4.098 19.826 1.00 0.56 H new ATOM 0 HD1 TRP B 235 -1.263 -5.365 22.579 1.00 0.66 H new ATOM 0 HE1 TRP B 235 -3.594 -4.249 22.506 1.00 0.67 H new ATOM 0 HE3 TRP B 235 -0.925 -3.131 17.991 1.00 0.47 H new ATOM 0 HZ2 TRP B 235 -5.095 -2.593 20.667 1.00 0.60 H new ATOM 0 HZ3 TRP B 235 -2.816 -1.787 17.098 1.00 0.47 H new ATOM 0 HH2 TRP B 235 -4.900 -1.520 18.429 1.00 0.53 H new ATOM 1193 N LYS B 236 2.214 -5.534 17.897 1.00 0.46 N ATOM 1194 CA LYS B 236 3.593 -5.743 17.339 1.00 0.45 C ATOM 1195 C LYS B 236 4.434 -4.488 17.587 1.00 0.44 C ATOM 1196 O LYS B 236 3.912 -3.410 17.788 1.00 0.67 O ATOM 1197 CB LYS B 236 3.505 -6.021 15.833 1.00 0.47 C ATOM 1198 CG LYS B 236 4.915 -6.296 15.267 1.00 0.81 C ATOM 1199 CD LYS B 236 4.817 -7.220 14.047 1.00 0.73 C ATOM 1200 CE LYS B 236 6.176 -7.299 13.349 1.00 1.09 C ATOM 1201 NZ LYS B 236 7.116 -8.098 14.183 1.00 1.44 N ATOM 0 H LYS B 236 1.736 -4.700 17.556 1.00 0.46 H new ATOM 0 HA LYS B 236 4.060 -6.596 17.831 1.00 0.45 H new ATOM 0 HB2 LYS B 236 2.856 -6.878 15.650 1.00 0.47 H new ATOM 0 HB3 LYS B 236 3.058 -5.168 15.322 1.00 0.47 H new ATOM 0 HG2 LYS B 236 5.393 -5.358 14.986 1.00 0.81 H new ATOM 0 HG3 LYS B 236 5.540 -6.755 16.033 1.00 0.81 H new ATOM 0 HD2 LYS B 236 4.498 -8.215 14.357 1.00 0.73 H new ATOM 0 HD3 LYS B 236 4.063 -6.845 13.355 1.00 0.73 H new ATOM 0 HE2 LYS B 236 6.066 -7.757 12.366 1.00 1.09 H new ATOM 0 HE3 LYS B 236 6.575 -6.297 13.191 1.00 1.09 H new ATOM 0 HZ1 LYS B 236 8.013 -8.224 13.672 1.00 1.44 H new ATOM 0 HZ2 LYS B 236 7.295 -7.600 15.078 1.00 1.44 H new ATOM 0 HZ3 LYS B 236 6.698 -9.029 14.383 1.00 1.44 H new ATOM 1215 N GLY B 237 5.735 -4.627 17.583 1.00 0.40 N ATOM 1216 CA GLY B 237 6.627 -3.452 17.832 1.00 0.37 C ATOM 1217 C GLY B 237 6.118 -2.220 17.061 1.00 0.31 C ATOM 1218 O GLY B 237 5.280 -2.349 16.191 1.00 0.31 O ATOM 0 H GLY B 237 6.221 -5.508 17.417 1.00 0.40 H new ATOM 0 HA2 GLY B 237 6.661 -3.233 18.899 1.00 0.37 H new ATOM 0 HA3 GLY B 237 7.645 -3.688 17.522 1.00 0.37 H new ATOM 1222 N PRO B 238 6.633 -1.053 17.404 1.00 0.31 N ATOM 1223 CA PRO B 238 6.226 0.200 16.735 1.00 0.29 C ATOM 1224 C PRO B 238 6.655 0.189 15.262 1.00 0.24 C ATOM 1225 O PRO B 238 7.531 -0.552 14.860 1.00 0.27 O ATOM 1226 CB PRO B 238 6.961 1.317 17.515 1.00 0.36 C ATOM 1227 CG PRO B 238 7.989 0.623 18.451 1.00 0.41 C ATOM 1228 CD PRO B 238 7.645 -0.882 18.474 1.00 0.38 C ATOM 0 HA PRO B 238 5.145 0.340 16.739 1.00 0.29 H new ATOM 0 HB2 PRO B 238 7.464 1.998 16.829 1.00 0.36 H new ATOM 0 HB3 PRO B 238 6.254 1.912 18.094 1.00 0.36 H new ATOM 0 HG2 PRO B 238 9.005 0.780 18.089 1.00 0.41 H new ATOM 0 HG3 PRO B 238 7.940 1.044 19.455 1.00 0.41 H new ATOM 0 HD2 PRO B 238 8.528 -1.493 18.285 1.00 0.38 H new ATOM 0 HD3 PRO B 238 7.250 -1.183 19.444 1.00 0.38 H new ATOM 1236 N ALA B 239 6.045 1.028 14.464 1.00 0.19 N ATOM 1237 CA ALA B 239 6.401 1.107 13.016 1.00 0.18 C ATOM 1238 C ALA B 239 6.450 2.579 12.599 1.00 0.17 C ATOM 1239 O ALA B 239 6.164 3.461 13.383 1.00 0.18 O ATOM 1240 CB ALA B 239 5.339 0.380 12.191 1.00 0.21 C ATOM 0 H ALA B 239 5.307 1.668 14.758 1.00 0.19 H new ATOM 0 HA ALA B 239 7.371 0.641 12.846 1.00 0.18 H new ATOM 0 HB1 ALA B 239 5.598 0.437 11.134 1.00 0.21 H new ATOM 0 HB2 ALA B 239 5.293 -0.665 12.497 1.00 0.21 H new ATOM 0 HB3 ALA B 239 4.368 0.849 12.353 1.00 0.21 H new ATOM 1246 N LYS B 240 6.809 2.857 11.371 1.00 0.18 N ATOM 1247 CA LYS B 240 6.872 4.279 10.909 1.00 0.21 C ATOM 1248 C LYS B 240 5.561 4.639 10.201 1.00 0.19 C ATOM 1249 O LYS B 240 5.031 3.866 9.429 1.00 0.18 O ATOM 1250 CB LYS B 240 8.048 4.445 9.935 1.00 0.27 C ATOM 1251 CG LYS B 240 8.461 5.918 9.858 1.00 1.15 C ATOM 1252 CD LYS B 240 9.662 6.062 8.922 1.00 1.44 C ATOM 1253 CE LYS B 240 10.285 7.447 9.099 1.00 2.03 C ATOM 1254 NZ LYS B 240 9.202 8.461 9.243 1.00 2.72 N ATOM 0 H LYS B 240 7.061 2.162 10.668 1.00 0.18 H new ATOM 0 HA LYS B 240 7.015 4.939 11.765 1.00 0.21 H new ATOM 0 HB2 LYS B 240 8.892 3.839 10.264 1.00 0.27 H new ATOM 0 HB3 LYS B 240 7.765 4.086 8.946 1.00 0.27 H new ATOM 0 HG2 LYS B 240 7.629 6.522 9.495 1.00 1.15 H new ATOM 0 HG3 LYS B 240 8.714 6.288 10.851 1.00 1.15 H new ATOM 0 HD2 LYS B 240 10.400 5.290 9.139 1.00 1.44 H new ATOM 0 HD3 LYS B 240 9.349 5.922 7.887 1.00 1.44 H new ATOM 0 HE2 LYS B 240 10.929 7.459 9.978 1.00 2.03 H new ATOM 0 HE3 LYS B 240 10.913 7.688 8.241 1.00 2.03 H new ATOM 0 HZ1 LYS B 240 9.584 9.407 9.042 1.00 2.72 H new ATOM 0 HZ2 LYS B 240 8.435 8.248 8.573 1.00 2.72 H new ATOM 0 HZ3 LYS B 240 8.830 8.436 10.214 1.00 2.72 H new ATOM 1268 N LEU B 241 5.043 5.812 10.459 1.00 0.20 N ATOM 1269 CA LEU B 241 3.759 6.242 9.816 1.00 0.20 C ATOM 1270 C LEU B 241 4.056 6.959 8.492 1.00 0.23 C ATOM 1271 O LEU B 241 4.808 7.913 8.453 1.00 0.30 O ATOM 1272 CB LEU B 241 3.033 7.198 10.773 1.00 0.23 C ATOM 1273 CG LEU B 241 1.820 7.840 10.087 1.00 0.24 C ATOM 1274 CD1 LEU B 241 0.927 6.756 9.473 1.00 0.29 C ATOM 1275 CD2 LEU B 241 1.020 8.629 11.128 1.00 0.30 C ATOM 0 H LEU B 241 5.455 6.497 11.092 1.00 0.20 H new ATOM 0 HA LEU B 241 3.134 5.373 9.611 1.00 0.20 H new ATOM 0 HB2 LEU B 241 2.709 6.654 11.660 1.00 0.23 H new ATOM 0 HB3 LEU B 241 3.720 7.975 11.108 1.00 0.23 H new ATOM 0 HG LEU B 241 2.163 8.506 9.295 1.00 0.24 H new ATOM 0 HD11 LEU B 241 0.069 7.223 8.989 1.00 0.29 H new ATOM 0 HD12 LEU B 241 1.496 6.190 8.736 1.00 0.29 H new ATOM 0 HD13 LEU B 241 0.580 6.084 10.257 1.00 0.29 H new ATOM 0 HD21 LEU B 241 0.155 9.089 10.650 1.00 0.30 H new ATOM 0 HD22 LEU B 241 0.683 7.955 11.915 1.00 0.30 H new ATOM 0 HD23 LEU B 241 1.651 9.405 11.560 1.00 0.30 H new ATOM 1287 N LEU B 242 3.463 6.507 7.407 1.00 0.22 N ATOM 1288 CA LEU B 242 3.695 7.151 6.071 1.00 0.26 C ATOM 1289 C LEU B 242 2.372 7.699 5.515 1.00 0.26 C ATOM 1290 O LEU B 242 2.154 8.893 5.466 1.00 0.28 O ATOM 1291 CB LEU B 242 4.248 6.114 5.085 1.00 0.27 C ATOM 1292 CG LEU B 242 5.340 5.274 5.749 1.00 0.32 C ATOM 1293 CD1 LEU B 242 5.831 4.217 4.757 1.00 0.31 C ATOM 1294 CD2 LEU B 242 6.511 6.176 6.155 1.00 0.45 C ATOM 0 H LEU B 242 2.823 5.713 7.391 1.00 0.22 H new ATOM 0 HA LEU B 242 4.408 7.966 6.196 1.00 0.26 H new ATOM 0 HB2 LEU B 242 3.442 5.466 4.739 1.00 0.27 H new ATOM 0 HB3 LEU B 242 4.652 6.618 4.207 1.00 0.27 H new ATOM 0 HG LEU B 242 4.937 4.788 6.638 1.00 0.32 H new ATOM 0 HD11 LEU B 242 6.610 3.614 5.224 1.00 0.31 H new ATOM 0 HD12 LEU B 242 4.999 3.575 4.468 1.00 0.31 H new ATOM 0 HD13 LEU B 242 6.234 4.708 3.872 1.00 0.31 H new ATOM 0 HD21 LEU B 242 7.287 5.574 6.628 1.00 0.45 H new ATOM 0 HD22 LEU B 242 6.919 6.663 5.269 1.00 0.45 H new ATOM 0 HD23 LEU B 242 6.161 6.933 6.857 1.00 0.45 H new ATOM 1306 N TRP B 243 1.496 6.829 5.072 1.00 0.26 N ATOM 1307 CA TRP B 243 0.194 7.287 4.490 1.00 0.27 C ATOM 1308 C TRP B 243 -0.889 7.325 5.576 1.00 0.23 C ATOM 1309 O TRP B 243 -0.963 6.459 6.425 1.00 0.22 O ATOM 1310 CB TRP B 243 -0.225 6.306 3.384 1.00 0.31 C ATOM 1311 CG TRP B 243 -1.213 6.952 2.466 1.00 0.30 C ATOM 1312 CD1 TRP B 243 -0.926 7.940 1.592 1.00 0.32 C ATOM 1313 CD2 TRP B 243 -2.632 6.670 2.312 1.00 0.29 C ATOM 1314 NE1 TRP B 243 -2.077 8.294 0.918 1.00 0.33 N ATOM 1315 CE2 TRP B 243 -3.159 7.546 1.325 1.00 0.31 C ATOM 1316 CE3 TRP B 243 -3.511 5.753 2.931 1.00 0.28 C ATOM 1317 CZ2 TRP B 243 -4.510 7.514 0.964 1.00 0.32 C ATOM 1318 CZ3 TRP B 243 -4.874 5.718 2.567 1.00 0.29 C ATOM 1319 CH2 TRP B 243 -5.371 6.599 1.587 1.00 0.31 C ATOM 0 H TRP B 243 1.627 5.818 5.089 1.00 0.26 H new ATOM 0 HA TRP B 243 0.313 8.290 4.079 1.00 0.27 H new ATOM 0 HB2 TRP B 243 0.651 5.987 2.820 1.00 0.31 H new ATOM 0 HB3 TRP B 243 -0.661 5.411 3.828 1.00 0.31 H new ATOM 0 HD1 TRP B 243 0.048 8.382 1.444 1.00 0.32 H new ATOM 0 HE1 TRP B 243 -2.121 9.022 0.205 1.00 0.33 H new ATOM 0 HE3 TRP B 243 -3.138 5.076 3.686 1.00 0.28 H new ATOM 0 HZ2 TRP B 243 -4.888 8.189 0.211 1.00 0.32 H new ATOM 0 HZ3 TRP B 243 -5.539 5.012 3.042 1.00 0.29 H new ATOM 0 HH2 TRP B 243 -6.416 6.570 1.315 1.00 0.31 H new ATOM 1330 N LYS B 244 -1.739 8.317 5.540 1.00 0.24 N ATOM 1331 CA LYS B 244 -2.837 8.419 6.550 1.00 0.24 C ATOM 1332 C LYS B 244 -4.057 9.073 5.892 1.00 0.25 C ATOM 1333 O LYS B 244 -3.995 10.198 5.437 1.00 0.29 O ATOM 1334 CB LYS B 244 -2.368 9.278 7.729 1.00 0.31 C ATOM 1335 CG LYS B 244 -3.499 9.414 8.753 1.00 0.72 C ATOM 1336 CD LYS B 244 -2.979 10.147 9.993 1.00 0.82 C ATOM 1337 CE LYS B 244 -4.036 10.097 11.096 1.00 1.51 C ATOM 1338 NZ LYS B 244 -4.108 8.718 11.654 1.00 2.33 N ATOM 0 H LYS B 244 -1.721 9.067 4.849 1.00 0.24 H new ATOM 0 HA LYS B 244 -3.101 7.426 6.912 1.00 0.24 H new ATOM 0 HB2 LYS B 244 -1.494 8.824 8.197 1.00 0.31 H new ATOM 0 HB3 LYS B 244 -2.065 10.263 7.375 1.00 0.31 H new ATOM 0 HG2 LYS B 244 -4.335 9.962 8.317 1.00 0.72 H new ATOM 0 HG3 LYS B 244 -3.874 8.429 9.030 1.00 0.72 H new ATOM 0 HD2 LYS B 244 -2.054 9.686 10.340 1.00 0.82 H new ATOM 0 HD3 LYS B 244 -2.746 11.182 9.745 1.00 0.82 H new ATOM 0 HE2 LYS B 244 -3.788 10.807 11.885 1.00 1.51 H new ATOM 0 HE3 LYS B 244 -5.007 10.390 10.697 1.00 1.51 H new ATOM 0 HZ1 LYS B 244 -4.582 8.742 12.579 1.00 2.33 H new ATOM 0 HZ2 LYS B 244 -4.646 8.109 11.005 1.00 2.33 H new ATOM 0 HZ3 LYS B 244 -3.146 8.339 11.768 1.00 2.33 H new ATOM 1352 N GLY B 245 -5.165 8.380 5.831 1.00 0.24 N ATOM 1353 CA GLY B 245 -6.379 8.977 5.193 1.00 0.27 C ATOM 1354 C GLY B 245 -7.643 8.317 5.748 1.00 0.26 C ATOM 1355 O GLY B 245 -8.109 8.647 6.821 1.00 0.28 O ATOM 0 H GLY B 245 -5.283 7.433 6.192 1.00 0.24 H new ATOM 0 HA2 GLY B 245 -6.407 10.050 5.381 1.00 0.27 H new ATOM 0 HA3 GLY B 245 -6.334 8.844 4.112 1.00 0.27 H new ATOM 1359 N GLU B 246 -8.207 7.393 5.019 1.00 0.27 N ATOM 1360 CA GLU B 246 -9.449 6.717 5.493 1.00 0.28 C ATOM 1361 C GLU B 246 -9.116 5.804 6.675 1.00 0.24 C ATOM 1362 O GLU B 246 -8.151 6.015 7.381 1.00 0.22 O ATOM 1363 CB GLU B 246 -10.044 5.883 4.354 1.00 0.33 C ATOM 1364 CG GLU B 246 -10.195 6.752 3.100 1.00 1.00 C ATOM 1365 CD GLU B 246 -10.608 5.872 1.919 1.00 0.92 C ATOM 1366 OE1 GLU B 246 -9.732 5.276 1.315 1.00 1.40 O ATOM 1367 OE2 GLU B 246 -11.794 5.812 1.638 1.00 1.40 O ATOM 0 H GLU B 246 -7.861 7.076 4.113 1.00 0.27 H new ATOM 0 HA GLU B 246 -10.172 7.469 5.809 1.00 0.28 H new ATOM 0 HB2 GLU B 246 -9.400 5.029 4.141 1.00 0.33 H new ATOM 0 HB3 GLU B 246 -11.014 5.485 4.651 1.00 0.33 H new ATOM 0 HG2 GLU B 246 -10.942 7.527 3.269 1.00 1.00 H new ATOM 0 HG3 GLU B 246 -9.255 7.258 2.879 1.00 1.00 H new ATOM 1374 N GLY B 247 -9.910 4.788 6.894 1.00 0.26 N ATOM 1375 CA GLY B 247 -9.640 3.861 8.029 1.00 0.25 C ATOM 1376 C GLY B 247 -8.486 2.924 7.666 1.00 0.25 C ATOM 1377 O GLY B 247 -8.564 1.726 7.845 1.00 0.29 O ATOM 0 H GLY B 247 -10.733 4.562 6.335 1.00 0.26 H new ATOM 0 HA2 GLY B 247 -9.391 4.430 8.925 1.00 0.25 H new ATOM 0 HA3 GLY B 247 -10.534 3.281 8.258 1.00 0.25 H new ATOM 1381 N ALA B 248 -7.413 3.466 7.158 1.00 0.22 N ATOM 1382 CA ALA B 248 -6.244 2.623 6.778 1.00 0.24 C ATOM 1383 C ALA B 248 -4.965 3.430 6.990 1.00 0.21 C ATOM 1384 O ALA B 248 -4.959 4.640 6.873 1.00 0.23 O ATOM 1385 CB ALA B 248 -6.359 2.220 5.307 1.00 0.29 C ATOM 0 H ALA B 248 -7.295 4.465 6.989 1.00 0.22 H new ATOM 0 HA ALA B 248 -6.220 1.723 7.393 1.00 0.24 H new ATOM 0 HB1 ALA B 248 -5.504 1.604 5.031 1.00 0.29 H new ATOM 0 HB2 ALA B 248 -7.278 1.654 5.156 1.00 0.29 H new ATOM 0 HB3 ALA B 248 -6.377 3.115 4.685 1.00 0.29 H new ATOM 1391 N VAL B 249 -3.879 2.775 7.303 1.00 0.20 N ATOM 1392 CA VAL B 249 -2.595 3.507 7.523 1.00 0.19 C ATOM 1393 C VAL B 249 -1.434 2.675 6.980 1.00 0.20 C ATOM 1394 O VAL B 249 -1.260 1.525 7.332 1.00 0.22 O ATOM 1395 CB VAL B 249 -2.392 3.763 9.022 1.00 0.18 C ATOM 1396 CG1 VAL B 249 -3.436 4.768 9.511 1.00 0.31 C ATOM 1397 CG2 VAL B 249 -2.545 2.455 9.807 1.00 0.30 C ATOM 0 H VAL B 249 -3.824 1.763 7.416 1.00 0.20 H new ATOM 0 HA VAL B 249 -2.631 4.463 7.000 1.00 0.19 H new ATOM 0 HB VAL B 249 -1.390 4.161 9.181 1.00 0.18 H new ATOM 0 HG11 VAL B 249 -3.294 4.951 10.576 1.00 0.31 H new ATOM 0 HG12 VAL B 249 -3.324 5.704 8.964 1.00 0.31 H new ATOM 0 HG13 VAL B 249 -4.435 4.366 9.342 1.00 0.31 H new ATOM 0 HG21 VAL B 249 -2.399 2.649 10.870 1.00 0.30 H new ATOM 0 HG22 VAL B 249 -3.544 2.049 9.646 1.00 0.30 H new ATOM 0 HG23 VAL B 249 -1.801 1.736 9.464 1.00 0.30 H new ATOM 1407 N VAL B 250 -0.636 3.250 6.121 1.00 0.21 N ATOM 1408 CA VAL B 250 0.523 2.501 5.559 1.00 0.23 C ATOM 1409 C VAL B 250 1.710 2.668 6.503 1.00 0.21 C ATOM 1410 O VAL B 250 1.933 3.734 7.042 1.00 0.22 O ATOM 1411 CB VAL B 250 0.882 3.064 4.179 1.00 0.27 C ATOM 1412 CG1 VAL B 250 2.055 2.276 3.607 1.00 0.27 C ATOM 1413 CG2 VAL B 250 -0.325 2.942 3.237 1.00 0.30 C ATOM 0 H VAL B 250 -0.737 4.207 5.784 1.00 0.21 H new ATOM 0 HA VAL B 250 0.271 1.446 5.456 1.00 0.23 H new ATOM 0 HB VAL B 250 1.155 4.115 4.275 1.00 0.27 H new ATOM 0 HG11 VAL B 250 2.315 2.672 2.625 1.00 0.27 H new ATOM 0 HG12 VAL B 250 2.913 2.366 4.273 1.00 0.27 H new ATOM 0 HG13 VAL B 250 1.777 1.226 3.513 1.00 0.27 H new ATOM 0 HG21 VAL B 250 -0.064 3.344 2.258 1.00 0.30 H new ATOM 0 HG22 VAL B 250 -0.604 1.893 3.137 1.00 0.30 H new ATOM 0 HG23 VAL B 250 -1.165 3.503 3.647 1.00 0.30 H new ATOM 1423 N ILE B 251 2.467 1.623 6.726 1.00 0.20 N ATOM 1424 CA ILE B 251 3.629 1.727 7.657 1.00 0.19 C ATOM 1425 C ILE B 251 4.808 0.916 7.124 1.00 0.20 C ATOM 1426 O ILE B 251 4.725 0.267 6.100 1.00 0.24 O ATOM 1427 CB ILE B 251 3.227 1.180 9.029 1.00 0.16 C ATOM 1428 CG1 ILE B 251 2.655 -0.235 8.871 1.00 0.19 C ATOM 1429 CG2 ILE B 251 2.167 2.089 9.653 1.00 0.17 C ATOM 1430 CD1 ILE B 251 2.348 -0.830 10.250 1.00 0.19 C ATOM 0 H ILE B 251 2.330 0.705 6.304 1.00 0.20 H new ATOM 0 HA ILE B 251 3.923 2.773 7.741 1.00 0.19 H new ATOM 0 HB ILE B 251 4.104 1.148 9.675 1.00 0.16 H new ATOM 0 HG12 ILE B 251 1.747 -0.205 8.268 1.00 0.19 H new ATOM 0 HG13 ILE B 251 3.368 -0.868 8.343 1.00 0.19 H new ATOM 0 HG21 ILE B 251 1.882 1.698 10.630 1.00 0.17 H new ATOM 0 HG22 ILE B 251 2.572 3.094 9.769 1.00 0.17 H new ATOM 0 HG23 ILE B 251 1.290 2.123 9.006 1.00 0.17 H new ATOM 0 HD11 ILE B 251 1.942 -1.835 10.131 1.00 0.19 H new ATOM 0 HD12 ILE B 251 3.264 -0.876 10.838 1.00 0.19 H new ATOM 0 HD13 ILE B 251 1.619 -0.203 10.763 1.00 0.19 H new ATOM 1442 N GLN B 252 5.908 0.942 7.829 1.00 0.20 N ATOM 1443 CA GLN B 252 7.107 0.163 7.396 1.00 0.23 C ATOM 1444 C GLN B 252 7.825 -0.367 8.636 1.00 0.24 C ATOM 1445 O GLN B 252 8.355 0.389 9.426 1.00 0.27 O ATOM 1446 CB GLN B 252 8.065 1.061 6.607 1.00 0.28 C ATOM 1447 CG GLN B 252 9.094 0.195 5.879 1.00 0.31 C ATOM 1448 CD GLN B 252 10.124 1.096 5.197 1.00 0.98 C ATOM 1449 OE1 GLN B 252 9.973 1.402 3.938 1.00 1.69 O flip ATOM 1450 NE2 GLN B 252 11.076 1.526 5.817 1.00 1.81 N flip ATOM 0 H GLN B 252 6.029 1.473 8.692 1.00 0.20 H new ATOM 0 HA GLN B 252 6.789 -0.663 6.759 1.00 0.23 H new ATOM 0 HB2 GLN B 252 7.508 1.663 5.889 1.00 0.28 H new ATOM 0 HB3 GLN B 252 8.569 1.754 7.281 1.00 0.28 H new ATOM 0 HG2 GLN B 252 9.589 -0.472 6.585 1.00 0.31 H new ATOM 0 HG3 GLN B 252 8.598 -0.434 5.140 1.00 0.31 H new ATOM 0 HE21 GLN B 252 11.194 1.287 6.801 1.00 1.81 H new ATOM 0 HE22 GLN B 252 11.758 2.127 5.353 1.00 1.81 H new ATOM 1459 N ASP B 253 7.861 -1.660 8.817 1.00 0.26 N ATOM 1460 CA ASP B 253 8.564 -2.224 10.006 1.00 0.30 C ATOM 1461 C ASP B 253 10.009 -2.492 9.598 1.00 0.32 C ATOM 1462 O ASP B 253 10.894 -1.707 9.874 1.00 0.35 O ATOM 1463 CB ASP B 253 7.881 -3.526 10.443 1.00 0.36 C ATOM 1464 CG ASP B 253 8.368 -3.912 11.841 1.00 0.49 C ATOM 1465 OD1 ASP B 253 8.356 -3.053 12.709 1.00 1.18 O ATOM 1466 OD2 ASP B 253 8.742 -5.060 12.021 1.00 1.18 O ATOM 0 H ASP B 253 7.436 -2.348 8.196 1.00 0.26 H new ATOM 0 HA ASP B 253 8.531 -1.528 10.845 1.00 0.30 H new ATOM 0 HB2 ASP B 253 6.798 -3.398 10.446 1.00 0.36 H new ATOM 0 HB3 ASP B 253 8.106 -4.323 9.735 1.00 0.36 H new ATOM 1471 N ASN B 254 10.252 -3.567 8.907 1.00 0.33 N ATOM 1472 CA ASN B 254 11.634 -3.846 8.440 1.00 0.37 C ATOM 1473 C ASN B 254 11.846 -3.021 7.172 1.00 0.34 C ATOM 1474 O ASN B 254 11.558 -1.842 7.144 1.00 0.37 O ATOM 1475 CB ASN B 254 11.777 -5.336 8.122 1.00 0.42 C ATOM 1476 CG ASN B 254 11.189 -6.158 9.271 1.00 1.22 C ATOM 1477 OD1 ASN B 254 10.875 -5.625 10.316 1.00 1.97 O ATOM 1478 ND2 ASN B 254 11.027 -7.445 9.120 1.00 1.89 N ATOM 0 H ASN B 254 9.554 -4.264 8.646 1.00 0.33 H new ATOM 0 HA ASN B 254 12.369 -3.587 9.202 1.00 0.37 H new ATOM 0 HB2 ASN B 254 11.262 -5.572 7.191 1.00 0.42 H new ATOM 0 HB3 ASN B 254 12.827 -5.590 7.979 1.00 0.42 H new ATOM 0 HD21 ASN B 254 10.637 -8.003 9.880 1.00 1.89 H new ATOM 0 HD22 ASN B 254 11.291 -7.893 8.242 1.00 1.89 H new ATOM 1485 N SER B 255 12.304 -3.633 6.112 1.00 0.35 N ATOM 1486 CA SER B 255 12.491 -2.885 4.829 1.00 0.37 C ATOM 1487 C SER B 255 11.366 -3.289 3.875 1.00 0.38 C ATOM 1488 O SER B 255 11.602 -3.736 2.771 1.00 0.43 O ATOM 1489 CB SER B 255 13.842 -3.249 4.213 1.00 0.42 C ATOM 1490 OG SER B 255 14.867 -3.055 5.180 1.00 1.38 O ATOM 0 H SER B 255 12.558 -4.620 6.077 1.00 0.35 H new ATOM 0 HA SER B 255 12.466 -1.811 5.011 1.00 0.37 H new ATOM 0 HB2 SER B 255 13.834 -4.286 3.878 1.00 0.42 H new ATOM 0 HB3 SER B 255 14.033 -2.632 3.335 1.00 0.42 H new ATOM 0 HG SER B 255 15.734 -3.289 4.789 1.00 1.38 H new ATOM 1496 N ASP B 256 10.143 -3.147 4.309 1.00 0.35 N ATOM 1497 CA ASP B 256 8.987 -3.530 3.448 1.00 0.38 C ATOM 1498 C ASP B 256 7.748 -2.752 3.892 1.00 0.34 C ATOM 1499 O ASP B 256 7.371 -2.766 5.047 1.00 0.31 O ATOM 1500 CB ASP B 256 8.723 -5.031 3.582 1.00 0.42 C ATOM 1501 CG ASP B 256 9.829 -5.809 2.865 1.00 0.47 C ATOM 1502 OD1 ASP B 256 10.168 -5.428 1.756 1.00 1.12 O ATOM 1503 OD2 ASP B 256 10.317 -6.770 3.436 1.00 1.12 O ATOM 0 H ASP B 256 9.893 -2.780 5.228 1.00 0.35 H new ATOM 0 HA ASP B 256 9.213 -3.295 2.408 1.00 0.38 H new ATOM 0 HB2 ASP B 256 8.689 -5.313 4.634 1.00 0.42 H new ATOM 0 HB3 ASP B 256 7.752 -5.280 3.154 1.00 0.42 H new ATOM 1508 N ILE B 257 7.119 -2.062 2.981 1.00 0.36 N ATOM 1509 CA ILE B 257 5.905 -1.268 3.333 1.00 0.34 C ATOM 1510 C ILE B 257 4.654 -2.118 3.096 1.00 0.35 C ATOM 1511 O ILE B 257 4.533 -2.797 2.097 1.00 0.39 O ATOM 1512 CB ILE B 257 5.870 -0.015 2.453 1.00 0.37 C ATOM 1513 CG1 ILE B 257 7.198 0.729 2.615 1.00 0.37 C ATOM 1514 CG2 ILE B 257 4.717 0.892 2.886 1.00 0.35 C ATOM 1515 CD1 ILE B 257 7.174 2.042 1.822 1.00 0.48 C ATOM 0 H ILE B 257 7.395 -2.013 2.000 1.00 0.36 H new ATOM 0 HA ILE B 257 5.934 -0.975 4.383 1.00 0.34 H new ATOM 0 HB ILE B 257 5.722 -0.297 1.411 1.00 0.37 H new ATOM 0 HG12 ILE B 257 7.380 0.937 3.669 1.00 0.37 H new ATOM 0 HG13 ILE B 257 8.019 0.102 2.268 1.00 0.37 H new ATOM 0 HG21 ILE B 257 4.698 1.781 2.256 1.00 0.35 H new ATOM 0 HG22 ILE B 257 3.774 0.355 2.785 1.00 0.35 H new ATOM 0 HG23 ILE B 257 4.857 1.187 3.926 1.00 0.35 H new ATOM 0 HD11 ILE B 257 8.125 2.560 1.947 1.00 0.48 H new ATOM 0 HD12 ILE B 257 7.014 1.826 0.766 1.00 0.48 H new ATOM 0 HD13 ILE B 257 6.366 2.674 2.189 1.00 0.48 H new ATOM 1527 N LYS B 258 3.723 -2.090 4.020 1.00 0.32 N ATOM 1528 CA LYS B 258 2.475 -2.902 3.871 1.00 0.34 C ATOM 1529 C LYS B 258 1.262 -2.071 4.295 1.00 0.30 C ATOM 1530 O LYS B 258 1.393 -0.991 4.837 1.00 0.28 O ATOM 1531 CB LYS B 258 2.575 -4.142 4.764 1.00 0.35 C ATOM 1532 CG LYS B 258 3.539 -5.149 4.134 1.00 0.43 C ATOM 1533 CD LYS B 258 3.759 -6.319 5.096 1.00 0.44 C ATOM 1534 CE LYS B 258 4.609 -7.391 4.412 1.00 1.42 C ATOM 1535 NZ LYS B 258 5.776 -6.748 3.742 1.00 2.13 N ATOM 0 H LYS B 258 3.775 -1.536 4.875 1.00 0.32 H new ATOM 0 HA LYS B 258 2.359 -3.201 2.829 1.00 0.34 H new ATOM 0 HB2 LYS B 258 2.925 -3.860 5.757 1.00 0.35 H new ATOM 0 HB3 LYS B 258 1.591 -4.594 4.889 1.00 0.35 H new ATOM 0 HG2 LYS B 258 3.135 -5.513 3.189 1.00 0.43 H new ATOM 0 HG3 LYS B 258 4.490 -4.666 3.909 1.00 0.43 H new ATOM 0 HD2 LYS B 258 4.255 -5.970 6.002 1.00 0.44 H new ATOM 0 HD3 LYS B 258 2.800 -6.739 5.399 1.00 0.44 H new ATOM 0 HE2 LYS B 258 4.954 -8.120 5.146 1.00 1.42 H new ATOM 0 HE3 LYS B 258 4.010 -7.934 3.681 1.00 1.42 H new ATOM 0 HZ1 LYS B 258 6.523 -7.456 3.591 1.00 2.13 H new ATOM 0 HZ2 LYS B 258 5.478 -6.358 2.825 1.00 2.13 H new ATOM 0 HZ3 LYS B 258 6.142 -5.981 4.342 1.00 2.13 H new ATOM 1549 N VAL B 259 0.077 -2.574 4.054 1.00 0.31 N ATOM 1550 CA VAL B 259 -1.163 -1.832 4.439 1.00 0.29 C ATOM 1551 C VAL B 259 -1.734 -2.424 5.732 1.00 0.28 C ATOM 1552 O VAL B 259 -1.771 -3.627 5.909 1.00 0.31 O ATOM 1553 CB VAL B 259 -2.200 -1.960 3.315 1.00 0.30 C ATOM 1554 CG1 VAL B 259 -3.270 -0.878 3.471 1.00 0.29 C ATOM 1555 CG2 VAL B 259 -1.506 -1.796 1.963 1.00 0.34 C ATOM 0 H VAL B 259 -0.086 -3.474 3.603 1.00 0.31 H new ATOM 0 HA VAL B 259 -0.924 -0.780 4.598 1.00 0.29 H new ATOM 0 HB VAL B 259 -2.670 -2.942 3.370 1.00 0.30 H new ATOM 0 HG11 VAL B 259 -4.004 -0.974 2.670 1.00 0.29 H new ATOM 0 HG12 VAL B 259 -3.767 -0.994 4.434 1.00 0.29 H new ATOM 0 HG13 VAL B 259 -2.803 0.106 3.420 1.00 0.29 H new ATOM 0 HG21 VAL B 259 -2.241 -1.887 1.163 1.00 0.34 H new ATOM 0 HG22 VAL B 259 -1.034 -0.815 1.913 1.00 0.34 H new ATOM 0 HG23 VAL B 259 -0.747 -2.570 1.847 1.00 0.34 H new ATOM 1565 N VAL B 260 -2.184 -1.584 6.635 1.00 0.26 N ATOM 1566 CA VAL B 260 -2.763 -2.076 7.923 1.00 0.27 C ATOM 1567 C VAL B 260 -4.072 -1.297 8.205 1.00 0.25 C ATOM 1568 O VAL B 260 -4.048 -0.082 8.192 1.00 0.22 O ATOM 1569 CB VAL B 260 -1.758 -1.806 9.050 1.00 0.28 C ATOM 1570 CG1 VAL B 260 -2.369 -2.195 10.400 1.00 0.34 C ATOM 1571 CG2 VAL B 260 -0.492 -2.636 8.811 1.00 0.29 C ATOM 0 H VAL B 260 -2.174 -0.569 6.532 1.00 0.26 H new ATOM 0 HA VAL B 260 -2.972 -3.144 7.864 1.00 0.27 H new ATOM 0 HB VAL B 260 -1.509 -0.745 9.060 1.00 0.28 H new ATOM 0 HG11 VAL B 260 -1.649 -2.000 11.195 1.00 0.34 H new ATOM 0 HG12 VAL B 260 -3.270 -1.607 10.574 1.00 0.34 H new ATOM 0 HG13 VAL B 260 -2.623 -3.255 10.392 1.00 0.34 H new ATOM 0 HG21 VAL B 260 0.224 -2.446 9.611 1.00 0.29 H new ATOM 0 HG22 VAL B 260 -0.749 -3.695 8.798 1.00 0.29 H new ATOM 0 HG23 VAL B 260 -0.050 -2.358 7.854 1.00 0.29 H new ATOM 1581 N PRO B 261 -5.188 -1.979 8.452 1.00 0.29 N ATOM 1582 CA PRO B 261 -6.456 -1.271 8.729 1.00 0.29 C ATOM 1583 C PRO B 261 -6.292 -0.332 9.938 1.00 0.24 C ATOM 1584 O PRO B 261 -5.587 -0.630 10.881 1.00 0.23 O ATOM 1585 CB PRO B 261 -7.488 -2.384 9.019 1.00 0.37 C ATOM 1586 CG PRO B 261 -6.773 -3.749 8.815 1.00 0.42 C ATOM 1587 CD PRO B 261 -5.296 -3.458 8.470 1.00 0.36 C ATOM 0 HA PRO B 261 -6.771 -0.645 7.894 1.00 0.29 H new ATOM 0 HB2 PRO B 261 -7.868 -2.299 10.037 1.00 0.37 H new ATOM 0 HB3 PRO B 261 -8.345 -2.296 8.351 1.00 0.37 H new ATOM 0 HG2 PRO B 261 -6.843 -4.356 9.718 1.00 0.42 H new ATOM 0 HG3 PRO B 261 -7.249 -4.314 8.014 1.00 0.42 H new ATOM 0 HD2 PRO B 261 -4.625 -3.893 9.210 1.00 0.36 H new ATOM 0 HD3 PRO B 261 -5.025 -3.885 7.504 1.00 0.36 H new ATOM 1595 N ARG B 262 -6.953 0.794 9.911 1.00 0.26 N ATOM 1596 CA ARG B 262 -6.852 1.761 11.041 1.00 0.27 C ATOM 1597 C ARG B 262 -7.449 1.148 12.315 1.00 0.29 C ATOM 1598 O ARG B 262 -6.964 1.373 13.407 1.00 0.34 O ATOM 1599 CB ARG B 262 -7.620 3.036 10.675 1.00 0.34 C ATOM 1600 CG ARG B 262 -7.672 3.982 11.887 1.00 0.59 C ATOM 1601 CD ARG B 262 -8.207 5.366 11.470 1.00 1.04 C ATOM 1602 NE ARG B 262 -7.595 6.419 12.342 1.00 1.76 N ATOM 1603 CZ ARG B 262 -7.606 6.308 13.644 1.00 2.19 C ATOM 1604 NH1 ARG B 262 -8.317 5.380 14.222 1.00 2.31 N ATOM 1605 NH2 ARG B 262 -6.948 7.167 14.373 1.00 3.11 N ATOM 0 H ARG B 262 -7.563 1.087 9.148 1.00 0.26 H new ATOM 0 HA ARG B 262 -5.804 1.998 11.223 1.00 0.27 H new ATOM 0 HB2 ARG B 262 -7.136 3.534 9.835 1.00 0.34 H new ATOM 0 HB3 ARG B 262 -8.631 2.783 10.356 1.00 0.34 H new ATOM 0 HG2 ARG B 262 -8.311 3.557 12.660 1.00 0.59 H new ATOM 0 HG3 ARG B 262 -6.676 4.085 12.318 1.00 0.59 H new ATOM 0 HD2 ARG B 262 -7.969 5.560 10.424 1.00 1.04 H new ATOM 0 HD3 ARG B 262 -9.293 5.390 11.559 1.00 1.04 H new ATOM 0 HE ARG B 262 -7.162 7.237 11.912 1.00 1.76 H new ATOM 0 HH11 ARG B 262 -8.869 4.735 13.657 1.00 2.31 H new ATOM 0 HH12 ARG B 262 -8.321 5.299 15.239 1.00 2.31 H new ATOM 0 HH21 ARG B 262 -6.427 7.922 13.926 1.00 3.11 H new ATOM 0 HH22 ARG B 262 -6.954 7.084 15.390 1.00 3.11 H new ATOM 1619 N ARG B 263 -8.506 0.391 12.189 1.00 0.33 N ATOM 1620 CA ARG B 263 -9.137 -0.216 13.399 1.00 0.39 C ATOM 1621 C ARG B 263 -8.213 -1.279 14.005 1.00 0.39 C ATOM 1622 O ARG B 263 -8.500 -1.827 15.052 1.00 0.48 O ATOM 1623 CB ARG B 263 -10.474 -0.859 13.013 1.00 0.47 C ATOM 1624 CG ARG B 263 -10.299 -1.672 11.729 1.00 1.31 C ATOM 1625 CD ARG B 263 -11.467 -2.646 11.566 1.00 1.59 C ATOM 1626 NE ARG B 263 -11.282 -3.433 10.314 1.00 2.29 N ATOM 1627 CZ ARG B 263 -11.970 -4.524 10.119 1.00 2.90 C ATOM 1628 NH1 ARG B 263 -12.820 -4.930 11.021 1.00 3.06 N ATOM 1629 NH2 ARG B 263 -11.806 -5.209 9.020 1.00 3.82 N ATOM 0 H ARG B 263 -8.960 0.167 11.303 1.00 0.33 H new ATOM 0 HA ARG B 263 -9.307 0.567 14.138 1.00 0.39 H new ATOM 0 HB2 ARG B 263 -10.825 -1.503 13.819 1.00 0.47 H new ATOM 0 HB3 ARG B 263 -11.231 -0.089 12.868 1.00 0.47 H new ATOM 0 HG2 ARG B 263 -10.249 -1.004 10.869 1.00 1.31 H new ATOM 0 HG3 ARG B 263 -9.358 -2.221 11.761 1.00 1.31 H new ATOM 0 HD2 ARG B 263 -11.520 -3.315 12.425 1.00 1.59 H new ATOM 0 HD3 ARG B 263 -12.409 -2.099 11.529 1.00 1.59 H new ATOM 0 HE ARG B 263 -10.616 -3.118 9.608 1.00 2.29 H new ATOM 0 HH11 ARG B 263 -12.947 -4.394 11.880 1.00 3.06 H new ATOM 0 HH12 ARG B 263 -13.358 -5.783 10.868 1.00 3.06 H new ATOM 0 HH21 ARG B 263 -11.141 -4.891 8.315 1.00 3.82 H new ATOM 0 HH22 ARG B 263 -12.343 -6.062 8.866 1.00 3.82 H new ATOM 1643 N LYS B 264 -7.106 -1.572 13.362 1.00 0.35 N ATOM 1644 CA LYS B 264 -6.153 -2.602 13.902 1.00 0.42 C ATOM 1645 C LYS B 264 -4.795 -1.944 14.162 1.00 0.35 C ATOM 1646 O LYS B 264 -3.778 -2.610 14.267 1.00 0.38 O ATOM 1647 CB LYS B 264 -5.977 -3.735 12.879 1.00 0.53 C ATOM 1648 CG LYS B 264 -7.275 -4.551 12.759 1.00 0.85 C ATOM 1649 CD LYS B 264 -6.964 -5.947 12.203 1.00 0.95 C ATOM 1650 CE LYS B 264 -8.253 -6.595 11.687 1.00 1.28 C ATOM 1651 NZ LYS B 264 -7.937 -7.924 11.092 1.00 2.08 N ATOM 0 H LYS B 264 -6.819 -1.142 12.483 1.00 0.35 H new ATOM 0 HA LYS B 264 -6.552 -3.012 14.830 1.00 0.42 H new ATOM 0 HB2 LYS B 264 -5.710 -3.319 11.908 1.00 0.53 H new ATOM 0 HB3 LYS B 264 -5.157 -4.385 13.184 1.00 0.53 H new ATOM 0 HG2 LYS B 264 -7.753 -4.637 13.735 1.00 0.85 H new ATOM 0 HG3 LYS B 264 -7.979 -4.037 12.104 1.00 0.85 H new ATOM 0 HD2 LYS B 264 -6.234 -5.874 11.397 1.00 0.95 H new ATOM 0 HD3 LYS B 264 -6.519 -6.568 12.980 1.00 0.95 H new ATOM 0 HE2 LYS B 264 -8.967 -6.710 12.503 1.00 1.28 H new ATOM 0 HE3 LYS B 264 -8.722 -5.953 10.941 1.00 1.28 H new ATOM 0 HZ1 LYS B 264 -8.812 -8.364 10.742 1.00 2.08 H new ATOM 0 HZ2 LYS B 264 -7.271 -7.801 10.303 1.00 2.08 H new ATOM 0 HZ3 LYS B 264 -7.508 -8.535 11.816 1.00 2.08 H new ATOM 1665 N ALA B 265 -4.772 -0.640 14.274 1.00 0.30 N ATOM 1666 CA ALA B 265 -3.486 0.081 14.526 1.00 0.27 C ATOM 1667 C ALA B 265 -3.724 1.224 15.517 1.00 0.28 C ATOM 1668 O ALA B 265 -4.849 1.553 15.841 1.00 0.32 O ATOM 1669 CB ALA B 265 -2.968 0.657 13.204 1.00 0.26 C ATOM 0 H ALA B 265 -5.594 -0.040 14.201 1.00 0.30 H new ATOM 0 HA ALA B 265 -2.754 -0.611 14.941 1.00 0.27 H new ATOM 0 HB1 ALA B 265 -2.030 1.184 13.379 1.00 0.26 H new ATOM 0 HB2 ALA B 265 -2.801 -0.153 12.495 1.00 0.26 H new ATOM 0 HB3 ALA B 265 -3.703 1.350 12.796 1.00 0.26 H new ATOM 1675 N LYS B 266 -2.671 1.841 15.994 1.00 0.26 N ATOM 1676 CA LYS B 266 -2.824 2.972 16.964 1.00 0.29 C ATOM 1677 C LYS B 266 -1.792 4.057 16.644 1.00 0.27 C ATOM 1678 O LYS B 266 -0.623 3.778 16.454 1.00 0.25 O ATOM 1679 CB LYS B 266 -2.599 2.460 18.392 1.00 0.34 C ATOM 1680 CG LYS B 266 -3.481 1.233 18.644 1.00 0.42 C ATOM 1681 CD LYS B 266 -3.565 0.960 20.148 1.00 0.50 C ATOM 1682 CE LYS B 266 -2.155 0.843 20.734 1.00 1.09 C ATOM 1683 NZ LYS B 266 -2.225 0.179 22.066 1.00 1.79 N ATOM 0 H LYS B 266 -1.707 1.609 15.753 1.00 0.26 H new ATOM 0 HA LYS B 266 -3.829 3.386 16.883 1.00 0.29 H new ATOM 0 HB2 LYS B 266 -1.550 2.202 18.535 1.00 0.34 H new ATOM 0 HB3 LYS B 266 -2.835 3.244 19.111 1.00 0.34 H new ATOM 0 HG2 LYS B 266 -4.479 1.401 18.238 1.00 0.42 H new ATOM 0 HG3 LYS B 266 -3.069 0.365 18.129 1.00 0.42 H new ATOM 0 HD2 LYS B 266 -4.109 1.765 20.643 1.00 0.50 H new ATOM 0 HD3 LYS B 266 -4.121 0.040 20.329 1.00 0.50 H new ATOM 0 HE2 LYS B 266 -1.517 0.269 20.062 1.00 1.09 H new ATOM 0 HE3 LYS B 266 -1.707 1.832 20.832 1.00 1.09 H new ATOM 0 HZ1 LYS B 266 -1.268 0.099 22.465 1.00 1.79 H new ATOM 0 HZ2 LYS B 266 -2.820 0.744 22.705 1.00 1.79 H new ATOM 0 HZ3 LYS B 266 -2.636 -0.770 21.959 1.00 1.79 H new ATOM 1697 N ILE B 267 -2.215 5.294 16.577 1.00 0.30 N ATOM 1698 CA ILE B 267 -1.261 6.404 16.268 1.00 0.32 C ATOM 1699 C ILE B 267 -0.644 6.929 17.568 1.00 0.37 C ATOM 1700 O ILE B 267 -1.287 7.620 18.331 1.00 0.41 O ATOM 1701 CB ILE B 267 -2.015 7.544 15.569 1.00 0.36 C ATOM 1702 CG1 ILE B 267 -2.836 6.979 14.392 1.00 0.36 C ATOM 1703 CG2 ILE B 267 -1.018 8.615 15.074 1.00 0.39 C ATOM 1704 CD1 ILE B 267 -1.966 6.087 13.500 1.00 0.45 C ATOM 0 H ILE B 267 -3.182 5.584 16.723 1.00 0.30 H new ATOM 0 HA ILE B 267 -0.472 6.031 15.616 1.00 0.32 H new ATOM 0 HB ILE B 267 -2.697 8.013 16.278 1.00 0.36 H new ATOM 0 HG12 ILE B 267 -3.681 6.406 14.774 1.00 0.36 H new ATOM 0 HG13 ILE B 267 -3.248 7.799 13.803 1.00 0.36 H new ATOM 0 HG21 ILE B 267 -1.563 9.419 14.580 1.00 0.39 H new ATOM 0 HG22 ILE B 267 -0.467 9.019 15.923 1.00 0.39 H new ATOM 0 HG23 ILE B 267 -0.319 8.164 14.369 1.00 0.39 H new ATOM 0 HD11 ILE B 267 -2.566 5.700 12.677 1.00 0.45 H new ATOM 0 HD12 ILE B 267 -1.136 6.670 13.101 1.00 0.45 H new ATOM 0 HD13 ILE B 267 -1.576 5.255 14.087 1.00 0.45 H new ATOM 1716 N ILE B 268 0.603 6.609 17.820 1.00 0.38 N ATOM 1717 CA ILE B 268 1.280 7.092 19.069 1.00 0.45 C ATOM 1718 C ILE B 268 2.260 8.211 18.710 1.00 0.48 C ATOM 1719 O ILE B 268 2.738 8.299 17.597 1.00 0.47 O ATOM 1720 CB ILE B 268 2.066 5.939 19.710 1.00 0.48 C ATOM 1721 CG1 ILE B 268 1.195 4.669 19.773 1.00 0.50 C ATOM 1722 CG2 ILE B 268 2.543 6.335 21.122 1.00 0.55 C ATOM 1723 CD1 ILE B 268 -0.071 4.906 20.603 1.00 0.57 C ATOM 0 H ILE B 268 1.185 6.032 17.213 1.00 0.38 H new ATOM 0 HA ILE B 268 0.527 7.459 19.767 1.00 0.45 H new ATOM 0 HB ILE B 268 2.941 5.730 19.095 1.00 0.48 H new ATOM 0 HG12 ILE B 268 0.919 4.363 18.764 1.00 0.50 H new ATOM 0 HG13 ILE B 268 1.770 3.852 20.208 1.00 0.50 H new ATOM 0 HG21 ILE B 268 3.099 5.508 21.564 1.00 0.55 H new ATOM 0 HG22 ILE B 268 3.188 7.211 21.056 1.00 0.55 H new ATOM 0 HG23 ILE B 268 1.680 6.567 21.746 1.00 0.55 H new ATOM 0 HD11 ILE B 268 -0.665 3.993 20.629 1.00 0.57 H new ATOM 0 HD12 ILE B 268 0.207 5.187 21.619 1.00 0.57 H new ATOM 0 HD13 ILE B 268 -0.657 5.707 20.152 1.00 0.57 H new ATOM 1735 N ARG B 269 2.568 9.062 19.652 1.00 0.56 N ATOM 1736 CA ARG B 269 3.526 10.180 19.384 1.00 0.62 C ATOM 1737 C ARG B 269 4.947 9.728 19.726 1.00 0.66 C ATOM 1738 O ARG B 269 5.156 8.939 20.627 1.00 0.73 O ATOM 1739 CB ARG B 269 3.157 11.383 20.252 1.00 0.73 C ATOM 1740 CG ARG B 269 3.919 12.618 19.765 1.00 1.49 C ATOM 1741 CD ARG B 269 3.576 13.814 20.656 1.00 1.80 C ATOM 1742 NE ARG B 269 2.176 14.248 20.387 1.00 2.22 N ATOM 1743 CZ ARG B 269 1.570 15.052 21.217 1.00 2.82 C ATOM 1744 NH1 ARG B 269 2.191 15.482 22.282 1.00 3.12 N ATOM 1745 NH2 ARG B 269 0.342 15.429 20.982 1.00 3.62 N ATOM 0 H ARG B 269 2.196 9.033 20.601 1.00 0.56 H new ATOM 0 HA ARG B 269 3.475 10.457 18.331 1.00 0.62 H new ATOM 0 HB2 ARG B 269 2.083 11.563 20.204 1.00 0.73 H new ATOM 0 HB3 ARG B 269 3.400 11.180 21.295 1.00 0.73 H new ATOM 0 HG2 ARG B 269 4.992 12.429 19.789 1.00 1.49 H new ATOM 0 HG3 ARG B 269 3.657 12.835 18.730 1.00 1.49 H new ATOM 0 HD2 ARG B 269 3.689 13.543 21.706 1.00 1.80 H new ATOM 0 HD3 ARG B 269 4.266 14.635 20.463 1.00 1.80 H new ATOM 0 HE ARG B 269 1.691 13.916 19.553 1.00 2.22 H new ATOM 0 HH11 ARG B 269 3.151 15.189 22.466 1.00 3.12 H new ATOM 0 HH12 ARG B 269 1.716 16.110 22.930 1.00 3.12 H new ATOM 0 HH21 ARG B 269 -0.144 15.095 20.150 1.00 3.62 H new ATOM 0 HH22 ARG B 269 -0.132 16.057 21.631 1.00 3.62 H new ATOM 1759 N ASP B 270 5.929 10.226 19.022 1.00 0.67 N ATOM 1760 CA ASP B 270 7.339 9.826 19.317 1.00 0.74 C ATOM 1761 C ASP B 270 7.924 10.766 20.374 1.00 1.18 C ATOM 1762 O ASP B 270 7.869 10.418 21.542 1.00 1.73 O ATOM 1763 CB ASP B 270 8.171 9.918 18.037 1.00 0.90 C ATOM 1764 CG ASP B 270 7.766 8.794 17.084 1.00 1.47 C ATOM 1765 OD1 ASP B 270 6.647 8.319 17.202 1.00 2.04 O ATOM 1766 OD2 ASP B 270 8.578 8.428 16.251 1.00 2.05 O ATOM 1767 OXT ASP B 270 8.417 11.816 19.997 1.00 1.84 O ATOM 0 H ASP B 270 5.818 10.891 18.257 1.00 0.67 H new ATOM 0 HA ASP B 270 7.357 8.802 19.691 1.00 0.74 H new ATOM 0 HB2 ASP B 270 8.018 10.886 17.560 1.00 0.90 H new ATOM 0 HB3 ASP B 270 9.232 9.843 18.274 1.00 0.90 H new TER 1772 ASP B 270