USER MOD reduce.3.24.130724 H: found=0, std=0, add=902, rem=0, adj=16 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 X(o=0,f=0) USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD Single : A 227 TYR OH : rot 60:sc= -2.74! USER MOD Single : A 230 SER OG : rot -39:sc= 0.32 USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 240 LYS NZ :NH3+ -160:sc=-0.00167 (180deg=-0.394) USER MOD Single : A 244 LYS NZ :NH3+ 159:sc= -0.119 (180deg=-0.654) USER MOD Single : A 252 GLN :FLIP amide:sc= 0 F(o=-3.4!,f=0) USER MOD Single : A 254 ASN : amide:sc= -0.028 X(o=-0.028,f=-0.028) USER MOD Single : A 255 SER OG : rot 180:sc= 0 USER MOD Single : A 258 LYS NZ :NH3+ -150:sc= -0.19 (180deg=-1.08) 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 X(o=0,f=0) USER MOD Single : B 226 TYR OH : rot 180:sc= 0 USER MOD Single : B 227 TYR OH : rot 48:sc= -2.7! USER MOD Single : B 230 SER OG : rot -22:sc= 0.346 USER MOD Single : B 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 240 LYS NZ :NH3+ -160:sc= -0.0118 (180deg=-0.415) USER MOD Single : B 244 LYS NZ :NH3+ 159:sc= -0.112 (180deg=-0.68) USER MOD Single : B 252 GLN :FLIP amide:sc= 0 F(o=-3.4!,f=0) USER MOD Single : B 254 ASN : amide:sc=-0.00152 X(o=-0.0015,f=-0.0034) USER MOD Single : B 255 SER OG : rot 180:sc= 0 USER MOD Single : B 258 LYS NZ :NH3+ -134:sc= -0.222 (180deg=-1.08) 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 1.990 16.642 -3.758 1.00 1.77 N ATOM 2 CA MET A 219 1.855 17.475 -4.986 1.00 1.15 C ATOM 3 C MET A 219 1.368 16.602 -6.146 1.00 1.04 C ATOM 4 O MET A 219 1.575 16.917 -7.300 1.00 1.10 O ATOM 5 CB MET A 219 3.211 18.085 -5.339 1.00 1.82 C ATOM 6 CG MET A 219 4.269 16.983 -5.386 1.00 2.31 C ATOM 7 SD MET A 219 5.876 17.704 -5.799 1.00 3.45 S ATOM 8 CE MET A 219 6.897 16.391 -5.089 1.00 3.82 C ATOM 0 HA MET A 219 1.134 18.273 -4.806 1.00 1.15 H new ATOM 0 HB2 MET A 219 3.154 18.591 -6.303 1.00 1.82 H new ATOM 0 HB3 MET A 219 3.487 18.837 -4.600 1.00 1.82 H new ATOM 0 HG2 MET A 219 4.323 16.475 -4.423 1.00 2.31 H new ATOM 0 HG3 MET A 219 3.994 16.232 -6.127 1.00 2.31 H new ATOM 0 HE1 MET A 219 7.950 16.632 -5.232 1.00 3.82 H new ATOM 0 HE2 MET A 219 6.687 16.303 -4.023 1.00 3.82 H new ATOM 0 HE3 MET A 219 6.670 15.446 -5.583 1.00 3.82 H new ATOM 18 N ILE A 220 0.716 15.509 -5.848 1.00 0.98 N ATOM 19 CA ILE A 220 0.211 14.623 -6.936 1.00 0.97 C ATOM 20 C ILE A 220 -1.133 15.168 -7.424 1.00 0.94 C ATOM 21 O ILE A 220 -2.161 14.942 -6.818 1.00 1.01 O ATOM 22 CB ILE A 220 0.015 13.195 -6.403 1.00 1.03 C ATOM 23 CG1 ILE A 220 1.362 12.615 -5.942 1.00 1.35 C ATOM 24 CG2 ILE A 220 -0.554 12.309 -7.513 1.00 1.78 C ATOM 25 CD1 ILE A 220 1.876 13.350 -4.689 1.00 2.08 C ATOM 0 H ILE A 220 0.512 15.193 -4.900 1.00 0.98 H new ATOM 0 HA ILE A 220 0.931 14.600 -7.754 1.00 0.97 H new ATOM 0 HB ILE A 220 -0.675 13.225 -5.560 1.00 1.03 H new ATOM 0 HG12 ILE A 220 1.250 11.553 -5.725 1.00 1.35 H new ATOM 0 HG13 ILE A 220 2.094 12.701 -6.745 1.00 1.35 H new ATOM 0 HG21 ILE A 220 -0.693 11.296 -7.135 1.00 1.78 H new ATOM 0 HG22 ILE A 220 -1.513 12.708 -7.842 1.00 1.78 H new ATOM 0 HG23 ILE A 220 0.139 12.290 -8.355 1.00 1.78 H new ATOM 0 HD11 ILE A 220 2.830 12.922 -4.382 1.00 2.08 H new ATOM 0 HD12 ILE A 220 2.009 14.408 -4.917 1.00 2.08 H new ATOM 0 HD13 ILE A 220 1.153 13.241 -3.881 1.00 2.08 H new ATOM 37 N GLN A 221 -1.138 15.889 -8.512 1.00 0.90 N ATOM 38 CA GLN A 221 -2.421 16.450 -9.029 1.00 0.92 C ATOM 39 C GLN A 221 -3.142 15.388 -9.860 1.00 0.83 C ATOM 40 O GLN A 221 -3.664 14.424 -9.335 1.00 0.85 O ATOM 41 CB GLN A 221 -2.131 17.677 -9.900 1.00 1.00 C ATOM 42 CG GLN A 221 -1.500 18.778 -9.041 1.00 1.28 C ATOM 43 CD GLN A 221 -1.574 20.114 -9.784 1.00 1.61 C ATOM 44 OE1 GLN A 221 -2.641 20.672 -9.946 1.00 2.08 O ATOM 45 NE2 GLN A 221 -0.480 20.651 -10.248 1.00 2.17 N ATOM 0 H GLN A 221 -0.311 16.114 -9.065 1.00 0.90 H new ATOM 0 HA GLN A 221 -3.053 16.745 -8.191 1.00 0.92 H new ATOM 0 HB2 GLN A 221 -1.459 17.407 -10.715 1.00 1.00 H new ATOM 0 HB3 GLN A 221 -3.053 18.039 -10.354 1.00 1.00 H new ATOM 0 HG2 GLN A 221 -2.021 18.852 -8.086 1.00 1.28 H new ATOM 0 HG3 GLN A 221 -0.462 18.530 -8.819 1.00 1.28 H new ATOM 0 HE21 GLN A 221 0.416 20.182 -10.112 1.00 2.17 H new ATOM 0 HE22 GLN A 221 -0.520 21.540 -10.747 1.00 2.17 H new ATOM 54 N ASN A 222 -3.181 15.558 -11.156 1.00 0.78 N ATOM 55 CA ASN A 222 -3.871 14.561 -12.031 1.00 0.73 C ATOM 56 C ASN A 222 -2.837 13.594 -12.615 1.00 0.63 C ATOM 57 O ASN A 222 -2.200 13.880 -13.610 1.00 0.65 O ATOM 58 CB ASN A 222 -4.585 15.300 -13.167 1.00 0.80 C ATOM 59 CG ASN A 222 -5.241 16.569 -12.617 1.00 0.93 C ATOM 60 OD1 ASN A 222 -4.718 17.655 -12.776 1.00 1.48 O ATOM 61 ND2 ASN A 222 -6.372 16.478 -11.973 1.00 1.39 N ATOM 0 H ASN A 222 -2.763 16.347 -11.649 1.00 0.78 H new ATOM 0 HA ASN A 222 -4.599 13.999 -11.447 1.00 0.73 H new ATOM 0 HB2 ASN A 222 -3.874 15.556 -13.952 1.00 0.80 H new ATOM 0 HB3 ASN A 222 -5.339 14.654 -13.618 1.00 0.80 H new ATOM 0 HD21 ASN A 222 -6.817 17.318 -11.603 1.00 1.39 H new ATOM 0 HD22 ASN A 222 -6.811 15.567 -11.839 1.00 1.39 H new ATOM 68 N PHE A 223 -2.669 12.450 -12.005 1.00 0.55 N ATOM 69 CA PHE A 223 -1.680 11.443 -12.512 1.00 0.46 C ATOM 70 C PHE A 223 -2.328 10.054 -12.482 1.00 0.39 C ATOM 71 O PHE A 223 -2.819 9.618 -11.459 1.00 0.38 O ATOM 72 CB PHE A 223 -0.448 11.441 -11.599 1.00 0.46 C ATOM 73 CG PHE A 223 0.410 12.647 -11.894 1.00 0.53 C ATOM 74 CD1 PHE A 223 1.336 12.610 -12.954 1.00 0.54 C ATOM 75 CD2 PHE A 223 0.287 13.809 -11.108 1.00 0.64 C ATOM 76 CE1 PHE A 223 2.138 13.736 -13.226 1.00 0.64 C ATOM 77 CE2 PHE A 223 1.088 14.934 -11.381 1.00 0.72 C ATOM 78 CZ PHE A 223 2.014 14.897 -12.440 1.00 0.71 C ATOM 0 H PHE A 223 -3.178 12.164 -11.169 1.00 0.55 H new ATOM 0 HA PHE A 223 -1.382 11.695 -13.530 1.00 0.46 H new ATOM 0 HB2 PHE A 223 -0.758 11.451 -10.554 1.00 0.46 H new ATOM 0 HB3 PHE A 223 0.127 10.528 -11.752 1.00 0.46 H new ATOM 0 HD1 PHE A 223 1.431 11.720 -13.558 1.00 0.54 H new ATOM 0 HD2 PHE A 223 -0.423 13.837 -10.295 1.00 0.64 H new ATOM 0 HE1 PHE A 223 2.849 13.708 -14.039 1.00 0.64 H new ATOM 0 HE2 PHE A 223 0.992 15.825 -10.778 1.00 0.72 H new ATOM 0 HZ PHE A 223 2.629 15.759 -12.650 1.00 0.71 H new ATOM 88 N ARG A 224 -2.324 9.348 -13.587 1.00 0.36 N ATOM 89 CA ARG A 224 -2.933 7.975 -13.617 1.00 0.31 C ATOM 90 C ARG A 224 -1.803 6.944 -13.578 1.00 0.26 C ATOM 91 O ARG A 224 -0.679 7.240 -13.934 1.00 0.29 O ATOM 92 CB ARG A 224 -3.739 7.798 -14.911 1.00 0.35 C ATOM 93 CG ARG A 224 -4.959 8.734 -14.897 1.00 1.00 C ATOM 94 CD ARG A 224 -5.966 8.309 -13.804 1.00 1.24 C ATOM 95 NE ARG A 224 -7.366 8.396 -14.337 1.00 1.82 N ATOM 96 CZ ARG A 224 -7.776 9.445 -15.006 1.00 2.36 C ATOM 97 NH1 ARG A 224 -7.013 10.495 -15.127 1.00 2.57 N ATOM 98 NH2 ARG A 224 -8.973 9.454 -15.527 1.00 3.26 N ATOM 0 H ARG A 224 -1.925 9.661 -14.472 1.00 0.36 H new ATOM 0 HA ARG A 224 -3.596 7.841 -12.762 1.00 0.31 H new ATOM 0 HB2 ARG A 224 -3.111 8.017 -15.774 1.00 0.35 H new ATOM 0 HB3 ARG A 224 -4.065 6.762 -15.009 1.00 0.35 H new ATOM 0 HG2 ARG A 224 -4.634 9.759 -14.719 1.00 1.00 H new ATOM 0 HG3 ARG A 224 -5.446 8.718 -15.872 1.00 1.00 H new ATOM 0 HD2 ARG A 224 -5.754 7.291 -13.479 1.00 1.24 H new ATOM 0 HD3 ARG A 224 -5.860 8.952 -12.930 1.00 1.24 H new ATOM 0 HE ARG A 224 -8.011 7.623 -14.175 1.00 1.82 H new ATOM 0 HH11 ARG A 224 -6.087 10.505 -14.699 1.00 2.57 H new ATOM 0 HH12 ARG A 224 -7.342 11.307 -15.650 1.00 2.57 H new ATOM 0 HH21 ARG A 224 -9.585 8.646 -15.412 1.00 3.26 H new ATOM 0 HH22 ARG A 224 -9.296 10.269 -16.049 1.00 3.26 H new ATOM 112 N VAL A 225 -2.082 5.739 -13.141 1.00 0.23 N ATOM 113 CA VAL A 225 -1.008 4.696 -13.068 1.00 0.20 C ATOM 114 C VAL A 225 -1.547 3.338 -13.529 1.00 0.20 C ATOM 115 O VAL A 225 -2.662 2.965 -13.224 1.00 0.22 O ATOM 116 CB VAL A 225 -0.529 4.574 -11.618 1.00 0.20 C ATOM 117 CG1 VAL A 225 0.490 3.436 -11.505 1.00 0.20 C ATOM 118 CG2 VAL A 225 0.125 5.887 -11.182 1.00 0.23 C ATOM 0 H VAL A 225 -3.005 5.432 -12.832 1.00 0.23 H new ATOM 0 HA VAL A 225 -0.184 4.990 -13.719 1.00 0.20 H new ATOM 0 HB VAL A 225 -1.383 4.361 -10.975 1.00 0.20 H new ATOM 0 HG11 VAL A 225 0.829 3.352 -10.472 1.00 0.20 H new ATOM 0 HG12 VAL A 225 0.025 2.499 -11.812 1.00 0.20 H new ATOM 0 HG13 VAL A 225 1.343 3.646 -12.151 1.00 0.20 H new ATOM 0 HG21 VAL A 225 0.465 5.799 -10.150 1.00 0.23 H new ATOM 0 HG22 VAL A 225 0.976 6.101 -11.828 1.00 0.23 H new ATOM 0 HG23 VAL A 225 -0.600 6.697 -11.257 1.00 0.23 H new ATOM 128 N TYR A 226 -0.741 2.587 -14.241 1.00 0.22 N ATOM 129 CA TYR A 226 -1.167 1.229 -14.708 1.00 0.25 C ATOM 130 C TYR A 226 -0.403 0.193 -13.879 1.00 0.26 C ATOM 131 O TYR A 226 0.649 0.480 -13.346 1.00 0.26 O ATOM 132 CB TYR A 226 -0.819 1.051 -16.193 1.00 0.32 C ATOM 133 CG TYR A 226 -1.830 1.774 -17.056 1.00 0.35 C ATOM 134 CD1 TYR A 226 -1.740 3.168 -17.226 1.00 0.43 C ATOM 135 CD2 TYR A 226 -2.855 1.052 -17.700 1.00 0.42 C ATOM 136 CE1 TYR A 226 -2.674 3.840 -18.040 1.00 0.50 C ATOM 137 CE2 TYR A 226 -3.789 1.725 -18.512 1.00 0.47 C ATOM 138 CZ TYR A 226 -3.698 3.119 -18.682 1.00 0.49 C ATOM 139 OH TYR A 226 -4.611 3.780 -19.477 1.00 0.58 O ATOM 0 H TYR A 226 0.201 2.859 -14.521 1.00 0.22 H new ATOM 0 HA TYR A 226 -2.243 1.107 -14.587 1.00 0.25 H new ATOM 0 HB2 TYR A 226 0.181 1.439 -16.389 1.00 0.32 H new ATOM 0 HB3 TYR A 226 -0.805 -0.009 -16.446 1.00 0.32 H new ATOM 0 HD1 TYR A 226 -0.955 3.723 -16.733 1.00 0.43 H new ATOM 0 HD2 TYR A 226 -2.924 -0.018 -17.571 1.00 0.42 H new ATOM 0 HE1 TYR A 226 -2.604 4.910 -18.171 1.00 0.50 H new ATOM 0 HE2 TYR A 226 -4.575 1.171 -19.004 1.00 0.47 H new ATOM 0 HH TYR A 226 -5.250 3.136 -19.846 1.00 0.58 H new ATOM 149 N TYR A 227 -0.909 -1.006 -13.754 1.00 0.28 N ATOM 150 CA TYR A 227 -0.181 -2.023 -12.934 1.00 0.32 C ATOM 151 C TYR A 227 -0.540 -3.438 -13.381 1.00 0.37 C ATOM 152 O TYR A 227 -1.622 -3.699 -13.869 1.00 0.39 O ATOM 153 CB TYR A 227 -0.571 -1.860 -11.462 1.00 0.31 C ATOM 154 CG TYR A 227 -2.077 -1.910 -11.322 1.00 0.31 C ATOM 155 CD1 TYR A 227 -2.861 -0.819 -11.748 1.00 0.28 C ATOM 156 CD2 TYR A 227 -2.700 -3.045 -10.762 1.00 0.38 C ATOM 157 CE1 TYR A 227 -4.264 -0.862 -11.614 1.00 0.31 C ATOM 158 CE2 TYR A 227 -4.103 -3.087 -10.627 1.00 0.41 C ATOM 159 CZ TYR A 227 -4.883 -1.996 -11.054 1.00 0.38 C ATOM 160 OH TYR A 227 -6.257 -2.037 -10.920 1.00 0.44 O ATOM 0 H TYR A 227 -1.781 -1.323 -14.177 1.00 0.28 H new ATOM 0 HA TYR A 227 0.890 -1.869 -13.066 1.00 0.32 H new ATOM 0 HB2 TYR A 227 -0.115 -2.650 -10.866 1.00 0.31 H new ATOM 0 HB3 TYR A 227 -0.192 -0.913 -11.079 1.00 0.31 H new ATOM 0 HD1 TYR A 227 -2.387 0.051 -12.178 1.00 0.28 H new ATOM 0 HD2 TYR A 227 -2.102 -3.883 -10.436 1.00 0.38 H new ATOM 0 HE1 TYR A 227 -4.864 -0.025 -11.941 1.00 0.31 H new ATOM 0 HE2 TYR A 227 -4.579 -3.956 -10.196 1.00 0.41 H new ATOM 0 HH TYR A 227 -6.674 -1.950 -11.802 1.00 0.44 H new ATOM 170 N ARG A 228 0.372 -4.361 -13.199 1.00 0.43 N ATOM 171 CA ARG A 228 0.110 -5.779 -13.591 1.00 0.49 C ATOM 172 C ARG A 228 -0.295 -6.581 -12.352 1.00 0.54 C ATOM 173 O ARG A 228 0.241 -6.396 -11.277 1.00 0.60 O ATOM 174 CB ARG A 228 1.387 -6.383 -14.191 1.00 0.55 C ATOM 175 CG ARG A 228 2.059 -5.347 -15.089 1.00 0.67 C ATOM 176 CD ARG A 228 3.158 -6.017 -15.918 1.00 0.73 C ATOM 177 NE ARG A 228 4.001 -6.870 -15.033 1.00 1.49 N ATOM 178 CZ ARG A 228 4.808 -7.752 -15.556 1.00 1.74 C ATOM 179 NH1 ARG A 228 4.894 -7.868 -16.854 1.00 1.49 N ATOM 180 NH2 ARG A 228 5.533 -8.513 -14.783 1.00 2.76 N ATOM 0 H ARG A 228 1.292 -4.191 -12.793 1.00 0.43 H new ATOM 0 HA ARG A 228 -0.693 -5.813 -14.327 1.00 0.49 H new ATOM 0 HB2 ARG A 228 2.067 -6.689 -13.396 1.00 0.55 H new ATOM 0 HB3 ARG A 228 1.145 -7.277 -14.765 1.00 0.55 H new ATOM 0 HG2 ARG A 228 1.321 -4.890 -15.748 1.00 0.67 H new ATOM 0 HG3 ARG A 228 2.484 -4.547 -14.483 1.00 0.67 H new ATOM 0 HD2 ARG A 228 2.714 -6.622 -16.708 1.00 0.73 H new ATOM 0 HD3 ARG A 228 3.773 -5.260 -16.404 1.00 0.73 H new ATOM 0 HE ARG A 228 3.947 -6.764 -14.020 1.00 1.49 H new ATOM 0 HH11 ARG A 228 4.331 -7.269 -17.458 1.00 1.49 H new ATOM 0 HH12 ARG A 228 5.525 -8.557 -17.264 1.00 1.49 H new ATOM 0 HH21 ARG A 228 5.469 -8.419 -13.769 1.00 2.76 H new ATOM 0 HH22 ARG A 228 6.164 -9.202 -15.192 1.00 2.76 H new ATOM 194 N ASP A 229 -1.232 -7.480 -12.497 1.00 0.58 N ATOM 195 CA ASP A 229 -1.670 -8.307 -11.333 1.00 0.66 C ATOM 196 C ASP A 229 -0.914 -9.634 -11.353 1.00 0.74 C ATOM 197 O ASP A 229 -0.176 -9.925 -12.274 1.00 0.76 O ATOM 198 CB ASP A 229 -3.169 -8.584 -11.437 1.00 0.72 C ATOM 199 CG ASP A 229 -3.495 -9.093 -12.843 1.00 1.41 C ATOM 200 OD1 ASP A 229 -2.568 -9.463 -13.545 1.00 2.07 O ATOM 201 OD2 ASP A 229 -4.663 -9.107 -13.194 1.00 2.23 O ATOM 0 H ASP A 229 -1.715 -7.678 -13.373 1.00 0.58 H new ATOM 0 HA ASP A 229 -1.462 -7.772 -10.406 1.00 0.66 H new ATOM 0 HB2 ASP A 229 -3.466 -9.323 -10.693 1.00 0.72 H new ATOM 0 HB3 ASP A 229 -3.733 -7.675 -11.227 1.00 0.72 H new ATOM 206 N SER A 230 -1.099 -10.446 -10.351 1.00 0.84 N ATOM 207 CA SER A 230 -0.398 -11.761 -10.318 1.00 0.97 C ATOM 208 C SER A 230 -1.221 -12.790 -11.099 1.00 1.04 C ATOM 209 O SER A 230 -0.795 -13.908 -11.307 1.00 1.17 O ATOM 210 CB SER A 230 -0.246 -12.218 -8.868 1.00 1.07 C ATOM 211 OG SER A 230 0.474 -13.445 -8.835 1.00 1.80 O ATOM 0 H SER A 230 -1.705 -10.257 -9.553 1.00 0.84 H new ATOM 0 HA SER A 230 0.589 -11.665 -10.771 1.00 0.97 H new ATOM 0 HB2 SER A 230 0.280 -11.459 -8.289 1.00 1.07 H new ATOM 0 HB3 SER A 230 -1.227 -12.346 -8.410 1.00 1.07 H new ATOM 0 HG SER A 230 0.187 -14.013 -9.580 1.00 1.80 H new ATOM 217 N ARG A 231 -2.399 -12.419 -11.534 1.00 1.00 N ATOM 218 CA ARG A 231 -3.252 -13.376 -12.303 1.00 1.11 C ATOM 219 C ARG A 231 -2.928 -13.271 -13.796 1.00 1.14 C ATOM 220 O ARG A 231 -3.239 -14.154 -14.568 1.00 1.30 O ATOM 221 CB ARG A 231 -4.731 -13.034 -12.086 1.00 1.14 C ATOM 222 CG ARG A 231 -5.056 -13.087 -10.591 1.00 1.18 C ATOM 223 CD ARG A 231 -6.544 -12.788 -10.377 1.00 1.46 C ATOM 224 NE ARG A 231 -6.938 -11.596 -11.183 1.00 2.09 N ATOM 225 CZ ARG A 231 -8.201 -11.340 -11.393 1.00 2.67 C ATOM 226 NH1 ARG A 231 -9.117 -12.134 -10.910 1.00 2.80 N ATOM 227 NH2 ARG A 231 -8.549 -10.292 -12.088 1.00 3.63 N ATOM 0 H ARG A 231 -2.807 -11.495 -11.390 1.00 1.00 H new ATOM 0 HA ARG A 231 -3.054 -14.390 -11.956 1.00 1.11 H new ATOM 0 HB2 ARG A 231 -4.947 -12.041 -12.480 1.00 1.14 H new ATOM 0 HB3 ARG A 231 -5.361 -13.737 -12.631 1.00 1.14 H new ATOM 0 HG2 ARG A 231 -4.811 -14.071 -10.190 1.00 1.18 H new ATOM 0 HG3 ARG A 231 -4.448 -12.362 -10.050 1.00 1.18 H new ATOM 0 HD2 ARG A 231 -7.144 -13.650 -10.668 1.00 1.46 H new ATOM 0 HD3 ARG A 231 -6.740 -12.606 -9.320 1.00 1.46 H new ATOM 0 HE ARG A 231 -6.221 -10.982 -11.570 1.00 2.09 H new ATOM 0 HH11 ARG A 231 -8.846 -12.955 -10.368 1.00 2.80 H new ATOM 0 HH12 ARG A 231 -10.104 -11.934 -11.074 1.00 2.80 H new ATOM 0 HH21 ARG A 231 -7.834 -9.672 -12.468 1.00 3.63 H new ATOM 0 HH22 ARG A 231 -9.536 -10.093 -12.251 1.00 3.63 H new ATOM 241 N ASP A 232 -2.305 -12.198 -14.211 1.00 1.02 N ATOM 242 CA ASP A 232 -1.967 -12.044 -15.656 1.00 1.07 C ATOM 243 C ASP A 232 -0.869 -10.960 -15.812 1.00 0.94 C ATOM 244 O ASP A 232 -1.033 -9.876 -15.289 1.00 0.82 O ATOM 245 CB ASP A 232 -3.224 -11.591 -16.405 1.00 1.14 C ATOM 246 CG ASP A 232 -4.180 -12.774 -16.578 1.00 1.61 C ATOM 247 OD1 ASP A 232 -3.759 -13.775 -17.136 1.00 2.12 O ATOM 248 OD2 ASP A 232 -5.317 -12.659 -16.149 1.00 2.16 O ATOM 0 H ASP A 232 -2.017 -11.424 -13.613 1.00 1.02 H new ATOM 0 HA ASP A 232 -1.607 -12.991 -16.058 1.00 1.07 H new ATOM 0 HB2 ASP A 232 -3.718 -10.790 -15.854 1.00 1.14 H new ATOM 0 HB3 ASP A 232 -2.952 -11.186 -17.380 1.00 1.14 H new ATOM 253 N PRO A 233 0.218 -11.244 -16.522 1.00 1.01 N ATOM 254 CA PRO A 233 1.283 -10.236 -16.705 1.00 0.97 C ATOM 255 C PRO A 233 0.763 -9.059 -17.548 1.00 0.85 C ATOM 256 O PRO A 233 1.519 -8.199 -17.954 1.00 0.83 O ATOM 257 CB PRO A 233 2.420 -10.980 -17.443 1.00 1.13 C ATOM 258 CG PRO A 233 1.860 -12.366 -17.870 1.00 1.25 C ATOM 259 CD PRO A 233 0.489 -12.545 -17.180 1.00 1.19 C ATOM 0 HA PRO A 233 1.623 -9.818 -15.758 1.00 0.97 H new ATOM 0 HB2 PRO A 233 2.749 -10.413 -18.314 1.00 1.13 H new ATOM 0 HB3 PRO A 233 3.287 -11.099 -16.794 1.00 1.13 H new ATOM 0 HG2 PRO A 233 1.754 -12.419 -18.954 1.00 1.25 H new ATOM 0 HG3 PRO A 233 2.544 -13.163 -17.577 1.00 1.25 H new ATOM 0 HD2 PRO A 233 -0.288 -12.791 -17.904 1.00 1.19 H new ATOM 0 HD3 PRO A 233 0.516 -13.357 -16.453 1.00 1.19 H new ATOM 267 N VAL A 234 -0.513 -9.014 -17.823 1.00 0.84 N ATOM 268 CA VAL A 234 -1.055 -7.892 -18.645 1.00 0.80 C ATOM 269 C VAL A 234 -1.325 -6.680 -17.754 1.00 0.69 C ATOM 270 O VAL A 234 -1.492 -6.798 -16.556 1.00 0.72 O ATOM 271 CB VAL A 234 -2.359 -8.323 -19.316 1.00 0.90 C ATOM 272 CG1 VAL A 234 -2.766 -7.280 -20.359 1.00 1.74 C ATOM 273 CG2 VAL A 234 -2.156 -9.674 -20.002 1.00 1.75 C ATOM 0 H VAL A 234 -1.201 -9.702 -17.516 1.00 0.84 H new ATOM 0 HA VAL A 234 -0.323 -7.628 -19.408 1.00 0.80 H new ATOM 0 HB VAL A 234 -3.143 -8.410 -18.563 1.00 0.90 H new ATOM 0 HG11 VAL A 234 -3.696 -7.587 -20.837 1.00 1.74 H new ATOM 0 HG12 VAL A 234 -2.910 -6.316 -19.872 1.00 1.74 H new ATOM 0 HG13 VAL A 234 -1.982 -7.193 -21.112 1.00 1.74 H new ATOM 0 HG21 VAL A 234 -3.085 -9.982 -20.481 1.00 1.75 H new ATOM 0 HG22 VAL A 234 -1.372 -9.586 -20.754 1.00 1.75 H new ATOM 0 HG23 VAL A 234 -1.866 -10.418 -19.261 1.00 1.75 H new ATOM 283 N TRP A 235 -1.373 -5.515 -18.337 1.00 0.64 N ATOM 284 CA TRP A 235 -1.633 -4.283 -17.539 1.00 0.55 C ATOM 285 C TRP A 235 -3.116 -4.232 -17.153 1.00 0.53 C ATOM 286 O TRP A 235 -3.945 -4.868 -17.773 1.00 0.65 O ATOM 287 CB TRP A 235 -1.285 -3.053 -18.385 1.00 0.56 C ATOM 288 CG TRP A 235 0.179 -3.059 -18.685 1.00 0.58 C ATOM 289 CD1 TRP A 235 0.733 -3.474 -19.848 1.00 0.65 C ATOM 290 CD2 TRP A 235 1.283 -2.648 -17.829 1.00 0.53 C ATOM 291 NE1 TRP A 235 2.109 -3.348 -19.760 1.00 0.66 N ATOM 292 CE2 TRP A 235 2.500 -2.842 -18.537 1.00 0.59 C ATOM 293 CE3 TRP A 235 1.349 -2.130 -16.515 1.00 0.47 C ATOM 294 CZ2 TRP A 235 3.740 -2.533 -17.961 1.00 0.59 C ATOM 295 CZ3 TRP A 235 2.595 -1.818 -15.931 1.00 0.47 C ATOM 296 CH2 TRP A 235 3.788 -2.019 -16.653 1.00 0.53 C ATOM 0 H TRP A 235 -1.243 -5.362 -19.337 1.00 0.64 H new ATOM 0 HA TRP A 235 -1.022 -4.293 -16.637 1.00 0.55 H new ATOM 0 HB2 TRP A 235 -1.858 -3.061 -19.312 1.00 0.56 H new ATOM 0 HB3 TRP A 235 -1.555 -2.142 -17.851 1.00 0.56 H new ATOM 0 HD1 TRP A 235 0.190 -3.843 -20.705 1.00 0.65 H new ATOM 0 HE1 TRP A 235 2.755 -3.599 -20.508 1.00 0.66 H new ATOM 0 HE3 TRP A 235 0.439 -1.972 -15.954 1.00 0.47 H new ATOM 0 HZ2 TRP A 235 4.652 -2.689 -18.518 1.00 0.59 H new ATOM 0 HZ3 TRP A 235 2.634 -1.423 -14.926 1.00 0.47 H new ATOM 0 HH2 TRP A 235 4.739 -1.778 -16.202 1.00 0.53 H new ATOM 307 N LYS A 236 -3.454 -3.468 -16.140 1.00 0.45 N ATOM 308 CA LYS A 236 -4.886 -3.350 -15.705 1.00 0.45 C ATOM 309 C LYS A 236 -5.322 -1.889 -15.856 1.00 0.43 C ATOM 310 O LYS A 236 -4.504 -1.006 -16.020 1.00 0.67 O ATOM 311 CB LYS A 236 -5.024 -3.795 -14.237 1.00 0.46 C ATOM 312 CG LYS A 236 -5.137 -5.325 -14.173 1.00 0.81 C ATOM 313 CD LYS A 236 -5.325 -5.784 -12.720 1.00 0.73 C ATOM 314 CE LYS A 236 -6.646 -5.249 -12.151 1.00 1.09 C ATOM 315 NZ LYS A 236 -7.121 -6.158 -11.070 1.00 1.43 N ATOM 0 H LYS A 236 -2.795 -2.916 -15.591 1.00 0.45 H new ATOM 0 HA LYS A 236 -5.518 -3.989 -16.321 1.00 0.45 H new ATOM 0 HB2 LYS A 236 -4.161 -3.459 -13.662 1.00 0.46 H new ATOM 0 HB3 LYS A 236 -5.905 -3.336 -13.788 1.00 0.46 H new ATOM 0 HG2 LYS A 236 -5.978 -5.660 -14.779 1.00 0.81 H new ATOM 0 HG3 LYS A 236 -4.240 -5.781 -14.593 1.00 0.81 H new ATOM 0 HD2 LYS A 236 -5.317 -6.873 -12.673 1.00 0.73 H new ATOM 0 HD3 LYS A 236 -4.492 -5.433 -12.111 1.00 0.73 H new ATOM 0 HE2 LYS A 236 -6.505 -4.242 -11.759 1.00 1.09 H new ATOM 0 HE3 LYS A 236 -7.395 -5.182 -12.940 1.00 1.09 H new ATOM 0 HZ1 LYS A 236 -8.016 -5.798 -10.682 1.00 1.43 H new ATOM 0 HZ2 LYS A 236 -7.270 -7.111 -11.458 1.00 1.43 H new ATOM 0 HZ3 LYS A 236 -6.408 -6.200 -10.314 1.00 1.43 H new ATOM 329 N GLY A 237 -6.603 -1.632 -15.815 1.00 0.39 N ATOM 330 CA GLY A 237 -7.099 -0.230 -15.977 1.00 0.36 C ATOM 331 C GLY A 237 -6.224 0.749 -15.169 1.00 0.31 C ATOM 332 O GLY A 237 -5.465 0.328 -14.320 1.00 0.31 O ATOM 0 H GLY A 237 -7.330 -2.333 -15.676 1.00 0.39 H new ATOM 0 HA2 GLY A 237 -7.086 0.047 -17.031 1.00 0.36 H new ATOM 0 HA3 GLY A 237 -8.134 -0.163 -15.642 1.00 0.36 H new ATOM 336 N PRO A 238 -6.349 2.035 -15.456 1.00 0.31 N ATOM 337 CA PRO A 238 -5.567 3.069 -14.747 1.00 0.29 C ATOM 338 C PRO A 238 -6.017 3.166 -13.281 1.00 0.24 C ATOM 339 O PRO A 238 -7.091 2.731 -12.916 1.00 0.27 O ATOM 340 CB PRO A 238 -5.877 4.383 -15.501 1.00 0.36 C ATOM 341 CG PRO A 238 -7.066 4.094 -16.459 1.00 0.41 C ATOM 342 CD PRO A 238 -7.256 2.562 -16.505 1.00 0.38 C ATOM 0 HA PRO A 238 -4.500 2.847 -14.733 1.00 0.29 H new ATOM 0 HB2 PRO A 238 -6.132 5.178 -14.800 1.00 0.36 H new ATOM 0 HB3 PRO A 238 -5.005 4.720 -16.061 1.00 0.36 H new ATOM 0 HG2 PRO A 238 -7.973 4.583 -16.104 1.00 0.41 H new ATOM 0 HG3 PRO A 238 -6.861 4.486 -17.455 1.00 0.41 H new ATOM 0 HD2 PRO A 238 -8.292 2.286 -16.307 1.00 0.38 H new ATOM 0 HD3 PRO A 238 -7.001 2.161 -17.486 1.00 0.38 H new ATOM 350 N ALA A 239 -5.199 3.754 -12.446 1.00 0.19 N ATOM 351 CA ALA A 239 -5.557 3.908 -11.004 1.00 0.18 C ATOM 352 C ALA A 239 -5.137 5.300 -10.531 1.00 0.17 C ATOM 353 O ALA A 239 -4.570 6.074 -11.277 1.00 0.19 O ATOM 354 CB ALA A 239 -4.817 2.855 -10.182 1.00 0.21 C ATOM 0 H ALA A 239 -4.290 4.138 -12.704 1.00 0.19 H new ATOM 0 HA ALA A 239 -6.632 3.781 -10.877 1.00 0.18 H new ATOM 0 HB1 ALA A 239 -5.077 2.966 -9.129 1.00 0.21 H new ATOM 0 HB2 ALA A 239 -5.103 1.860 -10.523 1.00 0.21 H new ATOM 0 HB3 ALA A 239 -3.742 2.986 -10.306 1.00 0.21 H new ATOM 360 N LYS A 240 -5.404 5.625 -9.291 1.00 0.19 N ATOM 361 CA LYS A 240 -5.012 6.967 -8.761 1.00 0.21 C ATOM 362 C LYS A 240 -3.678 6.838 -8.020 1.00 0.19 C ATOM 363 O LYS A 240 -3.452 5.887 -7.295 1.00 0.18 O ATOM 364 CB LYS A 240 -6.084 7.475 -7.790 1.00 0.27 C ATOM 365 CG LYS A 240 -7.475 7.352 -8.426 1.00 1.15 C ATOM 366 CD LYS A 240 -7.596 8.318 -9.611 1.00 1.43 C ATOM 367 CE LYS A 240 -9.072 8.511 -9.969 1.00 2.03 C ATOM 368 NZ LYS A 240 -9.721 7.182 -10.151 1.00 2.72 N ATOM 0 H LYS A 240 -5.877 5.018 -8.622 1.00 0.19 H new ATOM 0 HA LYS A 240 -4.914 7.671 -9.587 1.00 0.21 H new ATOM 0 HB2 LYS A 240 -6.047 6.902 -6.864 1.00 0.27 H new ATOM 0 HB3 LYS A 240 -5.886 8.515 -7.529 1.00 0.27 H new ATOM 0 HG2 LYS A 240 -7.641 6.328 -8.762 1.00 1.15 H new ATOM 0 HG3 LYS A 240 -8.244 7.573 -7.685 1.00 1.15 H new ATOM 0 HD2 LYS A 240 -7.144 9.277 -9.358 1.00 1.43 H new ATOM 0 HD3 LYS A 240 -7.052 7.926 -10.470 1.00 1.43 H new ATOM 0 HE2 LYS A 240 -9.578 9.069 -9.181 1.00 2.03 H new ATOM 0 HE3 LYS A 240 -9.161 9.098 -10.883 1.00 2.03 H new ATOM 0 HZ1 LYS A 240 -10.592 7.294 -10.708 1.00 2.72 H new ATOM 0 HZ2 LYS A 240 -9.070 6.544 -10.652 1.00 2.72 H new ATOM 0 HZ3 LYS A 240 -9.954 6.779 -9.221 1.00 2.72 H new ATOM 382 N LEU A 241 -2.797 7.788 -8.197 1.00 0.20 N ATOM 383 CA LEU A 241 -1.466 7.734 -7.515 1.00 0.20 C ATOM 384 C LEU A 241 -1.565 8.391 -6.132 1.00 0.22 C ATOM 385 O LEU A 241 -1.948 9.536 -6.009 1.00 0.29 O ATOM 386 CB LEU A 241 -0.449 8.493 -8.378 1.00 0.22 C ATOM 387 CG LEU A 241 0.872 8.691 -7.623 1.00 0.23 C ATOM 388 CD1 LEU A 241 1.382 7.346 -7.097 1.00 0.29 C ATOM 389 CD2 LEU A 241 1.904 9.286 -8.583 1.00 0.29 C ATOM 0 H LEU A 241 -2.942 8.606 -8.789 1.00 0.20 H new ATOM 0 HA LEU A 241 -1.151 6.698 -7.389 1.00 0.20 H new ATOM 0 HB2 LEU A 241 -0.266 7.942 -9.300 1.00 0.22 H new ATOM 0 HB3 LEU A 241 -0.859 9.462 -8.662 1.00 0.22 H new ATOM 0 HG LEU A 241 0.713 9.363 -6.780 1.00 0.23 H new ATOM 0 HD11 LEU A 241 2.320 7.496 -6.563 1.00 0.29 H new ATOM 0 HD12 LEU A 241 0.644 6.916 -6.420 1.00 0.29 H new ATOM 0 HD13 LEU A 241 1.546 6.667 -7.934 1.00 0.29 H new ATOM 0 HD21 LEU A 241 2.848 9.432 -8.058 1.00 0.29 H new ATOM 0 HD22 LEU A 241 2.056 8.606 -9.421 1.00 0.29 H new ATOM 0 HD23 LEU A 241 1.544 10.245 -8.955 1.00 0.29 H new ATOM 401 N LEU A 242 -1.217 7.670 -5.092 1.00 0.22 N ATOM 402 CA LEU A 242 -1.285 8.239 -3.705 1.00 0.25 C ATOM 403 C LEU A 242 0.125 8.400 -3.127 1.00 0.25 C ATOM 404 O LEU A 242 0.649 9.492 -3.042 1.00 0.27 O ATOM 405 CB LEU A 242 -2.083 7.285 -2.811 1.00 0.26 C ATOM 406 CG LEU A 242 -3.404 6.912 -3.494 1.00 0.32 C ATOM 407 CD1 LEU A 242 -4.236 6.043 -2.545 1.00 0.30 C ATOM 408 CD2 LEU A 242 -4.182 8.188 -3.848 1.00 0.45 C ATOM 0 H LEU A 242 -0.887 6.706 -5.144 1.00 0.22 H new ATOM 0 HA LEU A 242 -1.769 9.215 -3.745 1.00 0.25 H new ATOM 0 HB2 LEU A 242 -1.500 6.386 -2.612 1.00 0.26 H new ATOM 0 HB3 LEU A 242 -2.282 7.756 -1.848 1.00 0.26 H new ATOM 0 HG LEU A 242 -3.198 6.356 -4.409 1.00 0.32 H new ATOM 0 HD11 LEU A 242 -5.176 5.776 -3.027 1.00 0.30 H new ATOM 0 HD12 LEU A 242 -3.682 5.136 -2.302 1.00 0.30 H new ATOM 0 HD13 LEU A 242 -4.442 6.598 -1.630 1.00 0.30 H new ATOM 0 HD21 LEU A 242 -5.120 7.919 -4.333 1.00 0.45 H new ATOM 0 HD22 LEU A 242 -4.392 8.750 -2.938 1.00 0.45 H new ATOM 0 HD23 LEU A 242 -3.587 8.801 -4.524 1.00 0.45 H new ATOM 420 N TRP A 243 0.736 7.322 -2.709 1.00 0.25 N ATOM 421 CA TRP A 243 2.103 7.411 -2.108 1.00 0.26 C ATOM 422 C TRP A 243 3.175 7.289 -3.202 1.00 0.22 C ATOM 423 O TRP A 243 3.031 6.544 -4.150 1.00 0.21 O ATOM 424 CB TRP A 243 2.263 6.265 -1.097 1.00 0.30 C ATOM 425 CG TRP A 243 3.360 6.568 -0.126 1.00 0.29 C ATOM 426 CD1 TRP A 243 3.311 7.525 0.826 1.00 0.31 C ATOM 427 CD2 TRP A 243 4.654 5.919 0.014 1.00 0.28 C ATOM 428 NE1 TRP A 243 4.494 7.513 1.537 1.00 0.31 N ATOM 429 CE2 TRP A 243 5.358 6.545 1.076 1.00 0.30 C ATOM 430 CE3 TRP A 243 5.286 4.859 -0.675 1.00 0.27 C ATOM 431 CZ2 TRP A 243 6.645 6.134 1.445 1.00 0.31 C ATOM 432 CZ3 TRP A 243 6.582 4.442 -0.306 1.00 0.28 C ATOM 433 CH2 TRP A 243 7.258 5.079 0.751 1.00 0.29 C ATOM 0 H TRP A 243 0.347 6.380 -2.758 1.00 0.25 H new ATOM 0 HA TRP A 243 2.225 8.374 -1.612 1.00 0.26 H new ATOM 0 HB2 TRP A 243 1.327 6.113 -0.560 1.00 0.30 H new ATOM 0 HB3 TRP A 243 2.483 5.336 -1.624 1.00 0.30 H new ATOM 0 HD1 TRP A 243 2.480 8.192 1.002 1.00 0.31 H new ATOM 0 HE1 TRP A 243 4.703 8.145 2.310 1.00 0.31 H new ATOM 0 HE3 TRP A 243 4.774 4.366 -1.488 1.00 0.27 H new ATOM 0 HZ2 TRP A 243 7.162 6.625 2.257 1.00 0.31 H new ATOM 0 HZ3 TRP A 243 7.057 3.630 -0.837 1.00 0.28 H new ATOM 0 HH2 TRP A 243 8.250 4.756 1.029 1.00 0.29 H new ATOM 444 N LYS A 244 4.257 8.011 -3.060 1.00 0.24 N ATOM 445 CA LYS A 244 5.360 7.947 -4.069 1.00 0.23 C ATOM 446 C LYS A 244 6.698 8.116 -3.347 1.00 0.24 C ATOM 447 O LYS A 244 6.953 9.132 -2.733 1.00 0.28 O ATOM 448 CB LYS A 244 5.186 9.075 -5.091 1.00 0.30 C ATOM 449 CG LYS A 244 6.165 8.876 -6.253 1.00 0.71 C ATOM 450 CD LYS A 244 6.063 10.066 -7.212 1.00 0.82 C ATOM 451 CE LYS A 244 7.036 9.871 -8.377 1.00 1.50 C ATOM 452 NZ LYS A 244 6.712 8.604 -9.092 1.00 2.32 N ATOM 0 H LYS A 244 4.426 8.648 -2.282 1.00 0.24 H new ATOM 0 HA LYS A 244 5.334 6.988 -4.586 1.00 0.23 H new ATOM 0 HB2 LYS A 244 4.162 9.086 -5.464 1.00 0.30 H new ATOM 0 HB3 LYS A 244 5.362 10.040 -4.615 1.00 0.30 H new ATOM 0 HG2 LYS A 244 7.183 8.786 -5.874 1.00 0.71 H new ATOM 0 HG3 LYS A 244 5.938 7.949 -6.780 1.00 0.71 H new ATOM 0 HD2 LYS A 244 5.044 10.157 -7.588 1.00 0.82 H new ATOM 0 HD3 LYS A 244 6.292 10.992 -6.684 1.00 0.82 H new ATOM 0 HE2 LYS A 244 6.971 10.715 -9.064 1.00 1.50 H new ATOM 0 HE3 LYS A 244 8.061 9.840 -8.007 1.00 1.50 H new ATOM 0 HZ1 LYS A 244 7.106 8.637 -10.054 1.00 2.32 H new ATOM 0 HZ2 LYS A 244 7.123 7.800 -8.577 1.00 2.32 H new ATOM 0 HZ3 LYS A 244 5.680 8.490 -9.145 1.00 2.32 H new ATOM 466 N GLY A 245 7.559 7.132 -3.411 1.00 0.23 N ATOM 467 CA GLY A 245 8.875 7.253 -2.717 1.00 0.26 C ATOM 468 C GLY A 245 9.911 6.347 -3.387 1.00 0.26 C ATOM 469 O GLY A 245 10.309 6.569 -4.513 1.00 0.27 O ATOM 0 H GLY A 245 7.408 6.256 -3.911 1.00 0.23 H new ATOM 0 HA2 GLY A 245 9.215 8.288 -2.744 1.00 0.26 H new ATOM 0 HA3 GLY A 245 8.767 6.980 -1.667 1.00 0.26 H new ATOM 473 N GLU A 246 10.358 5.335 -2.695 1.00 0.26 N ATOM 474 CA GLU A 246 11.378 4.417 -3.277 1.00 0.27 C ATOM 475 C GLU A 246 10.807 3.742 -4.526 1.00 0.24 C ATOM 476 O GLU A 246 9.925 4.266 -5.175 1.00 0.22 O ATOM 477 CB GLU A 246 11.754 3.345 -2.247 1.00 0.33 C ATOM 478 CG GLU A 246 12.188 4.014 -0.937 1.00 1.00 C ATOM 479 CD GLU A 246 12.291 2.958 0.167 1.00 0.91 C ATOM 480 OE1 GLU A 246 11.265 2.624 0.739 1.00 1.39 O ATOM 481 OE2 GLU A 246 13.392 2.501 0.420 1.00 1.39 O ATOM 0 H GLU A 246 10.059 5.104 -1.748 1.00 0.26 H new ATOM 0 HA GLU A 246 12.266 4.990 -3.546 1.00 0.27 H new ATOM 0 HB2 GLU A 246 10.904 2.687 -2.066 1.00 0.33 H new ATOM 0 HB3 GLU A 246 12.561 2.723 -2.634 1.00 0.33 H new ATOM 0 HG2 GLU A 246 13.149 4.510 -1.071 1.00 1.00 H new ATOM 0 HG3 GLU A 246 11.469 4.783 -0.653 1.00 1.00 H new ATOM 488 N GLY A 247 11.301 2.581 -4.863 1.00 0.26 N ATOM 489 CA GLY A 247 10.786 1.871 -6.068 1.00 0.25 C ATOM 490 C GLY A 247 9.441 1.222 -5.740 1.00 0.25 C ATOM 491 O GLY A 247 9.227 0.050 -5.981 1.00 0.29 O ATOM 0 H GLY A 247 12.039 2.094 -4.355 1.00 0.26 H new ATOM 0 HA2 GLY A 247 10.672 2.572 -6.895 1.00 0.25 H new ATOM 0 HA3 GLY A 247 11.500 1.112 -6.389 1.00 0.25 H new ATOM 495 N ALA A 248 8.532 1.980 -5.192 1.00 0.22 N ATOM 496 CA ALA A 248 7.192 1.427 -4.842 1.00 0.24 C ATOM 497 C ALA A 248 6.152 2.536 -4.991 1.00 0.21 C ATOM 498 O ALA A 248 6.461 3.706 -4.869 1.00 0.23 O ATOM 499 CB ALA A 248 7.206 0.925 -3.397 1.00 0.29 C ATOM 0 H ALA A 248 8.661 2.967 -4.970 1.00 0.22 H new ATOM 0 HA ALA A 248 6.947 0.596 -5.504 1.00 0.24 H new ATOM 0 HB1 ALA A 248 6.226 0.521 -3.143 1.00 0.29 H new ATOM 0 HB2 ALA A 248 7.959 0.144 -3.290 1.00 0.29 H new ATOM 0 HB3 ALA A 248 7.443 1.751 -2.727 1.00 0.29 H new ATOM 505 N VAL A 249 4.923 2.190 -5.262 1.00 0.19 N ATOM 506 CA VAL A 249 3.873 3.238 -5.424 1.00 0.18 C ATOM 507 C VAL A 249 2.529 2.710 -4.928 1.00 0.20 C ATOM 508 O VAL A 249 2.110 1.622 -5.271 1.00 0.22 O ATOM 509 CB VAL A 249 3.758 3.625 -6.901 1.00 0.17 C ATOM 510 CG1 VAL A 249 4.972 4.466 -7.304 1.00 0.31 C ATOM 511 CG2 VAL A 249 3.709 2.362 -7.766 1.00 0.30 C ATOM 0 H VAL A 249 4.600 1.229 -5.378 1.00 0.19 H new ATOM 0 HA VAL A 249 4.150 4.115 -4.839 1.00 0.18 H new ATOM 0 HB VAL A 249 2.845 4.202 -7.050 1.00 0.17 H new ATOM 0 HG11 VAL A 249 4.891 4.742 -8.355 1.00 0.31 H new ATOM 0 HG12 VAL A 249 5.008 5.369 -6.694 1.00 0.31 H new ATOM 0 HG13 VAL A 249 5.883 3.887 -7.150 1.00 0.31 H new ATOM 0 HG21 VAL A 249 3.627 2.643 -8.816 1.00 0.30 H new ATOM 0 HG22 VAL A 249 4.620 1.782 -7.615 1.00 0.30 H new ATOM 0 HG23 VAL A 249 2.845 1.760 -7.483 1.00 0.30 H new ATOM 521 N VAL A 250 1.846 3.479 -4.121 1.00 0.20 N ATOM 522 CA VAL A 250 0.518 3.038 -3.604 1.00 0.22 C ATOM 523 C VAL A 250 -0.569 3.585 -4.528 1.00 0.20 C ATOM 524 O VAL A 250 -0.504 4.718 -4.962 1.00 0.21 O ATOM 525 CB VAL A 250 0.297 3.586 -2.191 1.00 0.26 C ATOM 526 CG1 VAL A 250 -1.084 3.160 -1.703 1.00 0.26 C ATOM 527 CG2 VAL A 250 1.368 3.034 -1.243 1.00 0.29 C ATOM 0 H VAL A 250 2.152 4.396 -3.797 1.00 0.20 H new ATOM 0 HA VAL A 250 0.481 1.949 -3.573 1.00 0.22 H new ATOM 0 HB VAL A 250 0.365 4.674 -2.208 1.00 0.26 H new ATOM 0 HG11 VAL A 250 -1.250 3.546 -0.697 1.00 0.26 H new ATOM 0 HG12 VAL A 250 -1.846 3.557 -2.374 1.00 0.26 H new ATOM 0 HG13 VAL A 250 -1.145 2.072 -1.688 1.00 0.26 H new ATOM 0 HG21 VAL A 250 1.204 3.428 -0.240 1.00 0.29 H new ATOM 0 HG22 VAL A 250 1.307 1.946 -1.220 1.00 0.29 H new ATOM 0 HG23 VAL A 250 2.355 3.335 -1.594 1.00 0.29 H new ATOM 537 N ILE A 251 -1.565 2.794 -4.838 1.00 0.19 N ATOM 538 CA ILE A 251 -2.651 3.279 -5.743 1.00 0.18 C ATOM 539 C ILE A 251 -4.006 2.776 -5.251 1.00 0.20 C ATOM 540 O ILE A 251 -4.103 2.054 -4.281 1.00 0.23 O ATOM 541 CB ILE A 251 -2.409 2.750 -7.162 1.00 0.16 C ATOM 542 CG1 ILE A 251 -2.314 1.221 -7.134 1.00 0.18 C ATOM 543 CG2 ILE A 251 -1.107 3.336 -7.722 1.00 0.16 C ATOM 544 CD1 ILE A 251 -2.040 0.700 -8.548 1.00 0.18 C ATOM 0 H ILE A 251 -1.673 1.836 -4.505 1.00 0.19 H new ATOM 0 HA ILE A 251 -2.648 4.369 -5.746 1.00 0.18 H new ATOM 0 HB ILE A 251 -3.240 3.049 -7.800 1.00 0.16 H new ATOM 0 HG12 ILE A 251 -1.518 0.908 -6.459 1.00 0.18 H new ATOM 0 HG13 ILE A 251 -3.242 0.795 -6.752 1.00 0.18 H new ATOM 0 HG21 ILE A 251 -0.941 2.956 -8.730 1.00 0.16 H new ATOM 0 HG22 ILE A 251 -1.180 4.423 -7.751 1.00 0.16 H new ATOM 0 HG23 ILE A 251 -0.273 3.046 -7.083 1.00 0.16 H new ATOM 0 HD11 ILE A 251 -1.972 -0.388 -8.528 1.00 0.18 H new ATOM 0 HD12 ILE A 251 -2.852 1.001 -9.210 1.00 0.18 H new ATOM 0 HD13 ILE A 251 -1.101 1.115 -8.913 1.00 0.18 H new ATOM 556 N GLN A 252 -5.056 3.149 -5.933 1.00 0.20 N ATOM 557 CA GLN A 252 -6.421 2.692 -5.539 1.00 0.23 C ATOM 558 C GLN A 252 -7.217 2.393 -6.808 1.00 0.24 C ATOM 559 O GLN A 252 -7.581 3.285 -7.547 1.00 0.27 O ATOM 560 CB GLN A 252 -7.141 3.784 -4.739 1.00 0.28 C ATOM 561 CG GLN A 252 -8.396 3.201 -4.088 1.00 0.31 C ATOM 562 CD GLN A 252 -9.091 4.284 -3.259 1.00 0.97 C ATOM 563 OE1 GLN A 252 -8.872 4.350 -1.973 1.00 1.68 O flip ATOM 564 NE2 GLN A 252 -9.841 5.079 -3.789 1.00 1.81 N flip ATOM 0 H GLN A 252 -5.026 3.755 -6.753 1.00 0.20 H new ATOM 0 HA GLN A 252 -6.339 1.800 -4.918 1.00 0.23 H new ATOM 0 HB2 GLN A 252 -6.476 4.187 -3.975 1.00 0.28 H new ATOM 0 HB3 GLN A 252 -7.411 4.612 -5.395 1.00 0.28 H new ATOM 0 HG2 GLN A 252 -9.074 2.823 -4.854 1.00 0.31 H new ATOM 0 HG3 GLN A 252 -8.130 2.356 -3.453 1.00 0.31 H new ATOM 0 HE21 GLN A 252 -10.012 5.027 -4.793 1.00 1.81 H new ATOM 0 HE22 GLN A 252 -10.300 5.798 -3.230 1.00 1.81 H new ATOM 573 N ASP A 253 -7.497 1.145 -7.069 1.00 0.25 N ATOM 574 CA ASP A 253 -8.279 0.799 -8.291 1.00 0.30 C ATOM 575 C ASP A 253 -9.754 0.819 -7.909 1.00 0.32 C ATOM 576 O ASP A 253 -10.448 1.790 -8.136 1.00 0.36 O ATOM 577 CB ASP A 253 -7.876 -0.593 -8.786 1.00 0.36 C ATOM 578 CG ASP A 253 -8.477 -0.835 -10.172 1.00 0.49 C ATOM 579 OD1 ASP A 253 -8.495 0.098 -10.958 1.00 1.18 O ATOM 580 OD2 ASP A 253 -8.912 -1.947 -10.422 1.00 1.18 O ATOM 0 H ASP A 253 -7.219 0.352 -6.491 1.00 0.25 H new ATOM 0 HA ASP A 253 -8.085 1.512 -9.093 1.00 0.30 H new ATOM 0 HB2 ASP A 253 -6.790 -0.675 -8.829 1.00 0.36 H new ATOM 0 HB3 ASP A 253 -8.225 -1.354 -8.088 1.00 0.36 H new ATOM 585 N ASN A 254 -10.234 -0.220 -7.286 1.00 0.33 N ATOM 586 CA ASN A 254 -11.650 -0.218 -6.844 1.00 0.36 C ATOM 587 C ASN A 254 -11.698 0.586 -5.546 1.00 0.34 C ATOM 588 O ASN A 254 -11.121 1.650 -5.456 1.00 0.36 O ATOM 589 CB ASN A 254 -12.118 -1.654 -6.586 1.00 0.42 C ATOM 590 CG ASN A 254 -11.687 -2.552 -7.748 1.00 1.22 C ATOM 591 OD1 ASN A 254 -10.745 -3.309 -7.628 1.00 1.98 O ATOM 592 ND2 ASN A 254 -12.344 -2.501 -8.876 1.00 1.88 N ATOM 0 H ASN A 254 -9.708 -1.066 -7.066 1.00 0.33 H new ATOM 0 HA ASN A 254 -12.301 0.216 -7.603 1.00 0.36 H new ATOM 0 HB2 ASN A 254 -11.694 -2.023 -5.652 1.00 0.42 H new ATOM 0 HB3 ASN A 254 -13.202 -1.680 -6.476 1.00 0.42 H new ATOM 0 HD21 ASN A 254 -12.066 -3.097 -9.656 1.00 1.88 H new ATOM 0 HD22 ASN A 254 -13.135 -1.865 -8.977 1.00 1.88 H new ATOM 599 N SER A 255 -12.337 0.074 -4.528 1.00 0.35 N ATOM 600 CA SER A 255 -12.376 0.800 -3.219 1.00 0.37 C ATOM 601 C SER A 255 -11.418 0.098 -2.257 1.00 0.37 C ATOM 602 O SER A 255 -11.790 -0.309 -1.174 1.00 0.42 O ATOM 603 CB SER A 255 -13.793 0.763 -2.646 1.00 0.42 C ATOM 604 OG SER A 255 -14.664 1.500 -3.492 1.00 1.39 O ATOM 0 H SER A 255 -12.835 -0.816 -4.544 1.00 0.35 H new ATOM 0 HA SER A 255 -12.082 1.840 -3.359 1.00 0.37 H new ATOM 0 HB2 SER A 255 -14.136 -0.268 -2.562 1.00 0.42 H new ATOM 0 HB3 SER A 255 -13.802 1.185 -1.641 1.00 0.42 H new ATOM 0 HG SER A 255 -15.573 1.476 -3.127 1.00 1.39 H new ATOM 610 N ASP A 256 -10.184 -0.055 -2.656 1.00 0.34 N ATOM 611 CA ASP A 256 -9.186 -0.738 -1.785 1.00 0.37 C ATOM 612 C ASP A 256 -7.784 -0.276 -2.181 1.00 0.34 C ATOM 613 O ASP A 256 -7.389 -0.362 -3.327 1.00 0.31 O ATOM 614 CB ASP A 256 -9.297 -2.254 -1.968 1.00 0.41 C ATOM 615 CG ASP A 256 -10.546 -2.768 -1.249 1.00 0.47 C ATOM 616 OD1 ASP A 256 -10.745 -2.390 -0.105 1.00 1.12 O ATOM 617 OD2 ASP A 256 -11.283 -3.530 -1.853 1.00 1.12 O ATOM 0 H ASP A 256 -9.823 0.266 -3.554 1.00 0.34 H new ATOM 0 HA ASP A 256 -9.376 -0.489 -0.741 1.00 0.37 H new ATOM 0 HB2 ASP A 256 -9.349 -2.500 -3.029 1.00 0.41 H new ATOM 0 HB3 ASP A 256 -8.408 -2.744 -1.570 1.00 0.41 H new ATOM 622 N ILE A 257 -7.032 0.228 -1.241 1.00 0.35 N ATOM 623 CA ILE A 257 -5.654 0.708 -1.551 1.00 0.33 C ATOM 624 C ILE A 257 -4.654 -0.434 -1.349 1.00 0.34 C ATOM 625 O ILE A 257 -4.723 -1.162 -0.379 1.00 0.38 O ATOM 626 CB ILE A 257 -5.310 1.864 -0.612 1.00 0.36 C ATOM 627 CG1 ILE A 257 -6.389 2.950 -0.740 1.00 0.36 C ATOM 628 CG2 ILE A 257 -3.946 2.432 -0.992 1.00 0.34 C ATOM 629 CD1 ILE A 257 -6.113 4.095 0.251 1.00 0.47 C ATOM 0 H ILE A 257 -7.314 0.329 -0.266 1.00 0.35 H new ATOM 0 HA ILE A 257 -5.604 1.046 -2.586 1.00 0.33 H new ATOM 0 HB ILE A 257 -5.274 1.512 0.419 1.00 0.36 H new ATOM 0 HG12 ILE A 257 -6.406 3.337 -1.759 1.00 0.36 H new ATOM 0 HG13 ILE A 257 -7.372 2.521 -0.546 1.00 0.36 H new ATOM 0 HG21 ILE A 257 -3.697 3.257 -0.325 1.00 0.34 H new ATOM 0 HG22 ILE A 257 -3.190 1.652 -0.903 1.00 0.34 H new ATOM 0 HG23 ILE A 257 -3.976 2.793 -2.020 1.00 0.34 H new ATOM 0 HD11 ILE A 257 -6.885 4.858 0.150 1.00 0.47 H new ATOM 0 HD12 ILE A 257 -6.120 3.705 1.269 1.00 0.47 H new ATOM 0 HD13 ILE A 257 -5.139 4.534 0.037 1.00 0.47 H new ATOM 641 N LYS A 258 -3.725 -0.602 -2.264 1.00 0.31 N ATOM 642 CA LYS A 258 -2.724 -1.709 -2.132 1.00 0.33 C ATOM 643 C LYS A 258 -1.332 -1.203 -2.523 1.00 0.30 C ATOM 644 O LYS A 258 -1.173 -0.098 -3.006 1.00 0.27 O ATOM 645 CB LYS A 258 -3.124 -2.857 -3.065 1.00 0.34 C ATOM 646 CG LYS A 258 -4.282 -3.642 -2.448 1.00 0.42 C ATOM 647 CD LYS A 258 -4.833 -4.629 -3.478 1.00 0.43 C ATOM 648 CE LYS A 258 -5.758 -5.630 -2.784 1.00 1.41 C ATOM 649 NZ LYS A 258 -4.985 -6.401 -1.771 1.00 2.11 N ATOM 0 H LYS A 258 -3.618 -0.020 -3.095 1.00 0.31 H new ATOM 0 HA LYS A 258 -2.702 -2.056 -1.099 1.00 0.33 H new ATOM 0 HB2 LYS A 258 -3.417 -2.463 -4.038 1.00 0.34 H new ATOM 0 HB3 LYS A 258 -2.272 -3.517 -3.232 1.00 0.34 H new ATOM 0 HG2 LYS A 258 -3.942 -4.177 -1.561 1.00 0.42 H new ATOM 0 HG3 LYS A 258 -5.068 -2.959 -2.126 1.00 0.42 H new ATOM 0 HD2 LYS A 258 -5.378 -4.093 -4.255 1.00 0.43 H new ATOM 0 HD3 LYS A 258 -4.013 -5.155 -3.968 1.00 0.43 H new ATOM 0 HE2 LYS A 258 -6.584 -5.106 -2.304 1.00 1.41 H new ATOM 0 HE3 LYS A 258 -6.194 -6.308 -3.518 1.00 1.41 H new ATOM 0 HZ1 LYS A 258 -5.396 -7.351 -1.670 1.00 2.11 H new ATOM 0 HZ2 LYS A 258 -3.995 -6.483 -2.079 1.00 2.11 H new ATOM 0 HZ3 LYS A 258 -5.024 -5.908 -0.856 1.00 2.11 H new ATOM 663 N VAL A 259 -0.321 -2.014 -2.319 1.00 0.30 N ATOM 664 CA VAL A 259 1.073 -1.603 -2.679 1.00 0.28 C ATOM 665 C VAL A 259 1.484 -2.270 -3.995 1.00 0.28 C ATOM 666 O VAL A 259 1.245 -3.443 -4.208 1.00 0.31 O ATOM 667 CB VAL A 259 2.047 -2.041 -1.576 1.00 0.30 C ATOM 668 CG1 VAL A 259 3.370 -1.290 -1.735 1.00 0.28 C ATOM 669 CG2 VAL A 259 1.448 -1.728 -0.206 1.00 0.33 C ATOM 0 H VAL A 259 -0.402 -2.948 -1.916 1.00 0.30 H new ATOM 0 HA VAL A 259 1.104 -0.519 -2.788 1.00 0.28 H new ATOM 0 HB VAL A 259 2.224 -3.114 -1.657 1.00 0.30 H new ATOM 0 HG11 VAL A 259 4.061 -1.601 -0.952 1.00 0.28 H new ATOM 0 HG12 VAL A 259 3.801 -1.515 -2.710 1.00 0.28 H new ATOM 0 HG13 VAL A 259 3.191 -0.218 -1.656 1.00 0.28 H new ATOM 0 HG21 VAL A 259 2.142 -2.040 0.574 1.00 0.33 H new ATOM 0 HG22 VAL A 259 1.268 -0.656 -0.124 1.00 0.33 H new ATOM 0 HG23 VAL A 259 0.506 -2.264 -0.090 1.00 0.33 H new ATOM 679 N VAL A 260 2.117 -1.530 -4.870 1.00 0.26 N ATOM 680 CA VAL A 260 2.572 -2.097 -6.176 1.00 0.26 C ATOM 681 C VAL A 260 4.038 -1.669 -6.410 1.00 0.24 C ATOM 682 O VAL A 260 4.313 -0.486 -6.399 1.00 0.22 O ATOM 683 CB VAL A 260 1.702 -1.519 -7.295 1.00 0.27 C ATOM 684 CG1 VAL A 260 2.077 -2.173 -8.624 1.00 0.34 C ATOM 685 CG2 VAL A 260 0.230 -1.802 -6.988 1.00 0.29 C ATOM 0 H VAL A 260 2.341 -0.544 -4.733 1.00 0.26 H new ATOM 0 HA VAL A 260 2.492 -3.184 -6.167 1.00 0.26 H new ATOM 0 HB VAL A 260 1.863 -0.443 -7.362 1.00 0.27 H new ATOM 0 HG11 VAL A 260 1.457 -1.761 -9.420 1.00 0.34 H new ATOM 0 HG12 VAL A 260 3.127 -1.977 -8.843 1.00 0.34 H new ATOM 0 HG13 VAL A 260 1.915 -3.249 -8.558 1.00 0.34 H new ATOM 0 HG21 VAL A 260 -0.393 -1.392 -7.783 1.00 0.29 H new ATOM 0 HG22 VAL A 260 0.072 -2.879 -6.923 1.00 0.29 H new ATOM 0 HG23 VAL A 260 -0.040 -1.338 -6.039 1.00 0.29 H new ATOM 695 N PRO A 261 4.960 -2.604 -6.609 1.00 0.29 N ATOM 696 CA PRO A 261 6.368 -2.225 -6.834 1.00 0.30 C ATOM 697 C PRO A 261 6.465 -1.265 -8.027 1.00 0.25 C ATOM 698 O PRO A 261 5.809 -1.440 -9.033 1.00 0.24 O ATOM 699 CB PRO A 261 7.107 -3.554 -7.114 1.00 0.37 C ATOM 700 CG PRO A 261 6.090 -4.707 -6.890 1.00 0.42 C ATOM 701 CD PRO A 261 4.707 -4.065 -6.629 1.00 0.36 C ATOM 0 HA PRO A 261 6.805 -1.706 -5.981 1.00 0.30 H new ATOM 0 HB2 PRO A 261 7.490 -3.573 -8.134 1.00 0.37 H new ATOM 0 HB3 PRO A 261 7.964 -3.664 -6.450 1.00 0.37 H new ATOM 0 HG2 PRO A 261 6.051 -5.359 -7.763 1.00 0.42 H new ATOM 0 HG3 PRO A 261 6.391 -5.325 -6.044 1.00 0.42 H new ATOM 0 HD2 PRO A 261 3.994 -4.332 -7.410 1.00 0.36 H new ATOM 0 HD3 PRO A 261 4.286 -4.406 -5.683 1.00 0.36 H new ATOM 709 N ARG A 262 7.286 -0.258 -7.924 1.00 0.27 N ATOM 710 CA ARG A 262 7.428 0.706 -9.049 1.00 0.28 C ATOM 711 C ARG A 262 7.827 -0.050 -10.321 1.00 0.30 C ATOM 712 O ARG A 262 7.457 0.321 -11.417 1.00 0.35 O ATOM 713 CB ARG A 262 8.505 1.738 -8.699 1.00 0.35 C ATOM 714 CG ARG A 262 8.797 2.620 -9.928 1.00 0.59 C ATOM 715 CD ARG A 262 9.644 3.857 -9.533 1.00 1.04 C ATOM 716 NE ARG A 262 9.058 5.096 -10.141 1.00 1.77 N ATOM 717 CZ ARG A 262 8.717 5.142 -11.403 1.00 2.20 C ATOM 718 NH1 ARG A 262 8.943 4.124 -12.186 1.00 2.31 N ATOM 719 NH2 ARG A 262 8.167 6.222 -11.887 1.00 3.12 N ATOM 0 H ARG A 262 7.865 -0.061 -7.108 1.00 0.27 H new ATOM 0 HA ARG A 262 6.480 1.217 -9.218 1.00 0.28 H new ATOM 0 HB2 ARG A 262 8.172 2.357 -7.866 1.00 0.35 H new ATOM 0 HB3 ARG A 262 9.416 1.233 -8.377 1.00 0.35 H new ATOM 0 HG2 ARG A 262 9.327 2.037 -10.681 1.00 0.59 H new ATOM 0 HG3 ARG A 262 7.859 2.945 -10.378 1.00 0.59 H new ATOM 0 HD2 ARG A 262 9.676 3.955 -8.448 1.00 1.04 H new ATOM 0 HD3 ARG A 262 10.672 3.727 -9.872 1.00 1.04 H new ATOM 0 HE ARG A 262 8.922 5.921 -9.557 1.00 1.77 H new ATOM 0 HH11 ARG A 262 9.388 3.285 -11.815 1.00 2.31 H new ATOM 0 HH12 ARG A 262 8.674 4.167 -13.169 1.00 2.31 H new ATOM 0 HH21 ARG A 262 8.004 7.027 -11.282 1.00 3.12 H new ATOM 0 HH22 ARG A 262 7.900 6.261 -12.871 1.00 3.12 H new ATOM 733 N ARG A 263 8.589 -1.100 -10.184 1.00 0.34 N ATOM 734 CA ARG A 263 9.024 -1.874 -11.383 1.00 0.40 C ATOM 735 C ARG A 263 7.821 -2.583 -12.012 1.00 0.40 C ATOM 736 O ARG A 263 7.929 -3.180 -13.065 1.00 0.49 O ATOM 737 CB ARG A 263 10.070 -2.911 -10.965 1.00 0.48 C ATOM 738 CG ARG A 263 11.168 -2.220 -10.153 1.00 1.31 C ATOM 739 CD ARG A 263 12.330 -3.187 -9.920 1.00 1.59 C ATOM 740 NE ARG A 263 13.471 -2.444 -9.312 1.00 2.29 N ATOM 741 CZ ARG A 263 14.451 -3.093 -8.748 1.00 2.90 C ATOM 742 NH1 ARG A 263 14.448 -4.397 -8.726 1.00 3.07 N ATOM 743 NH2 ARG A 263 15.438 -2.434 -8.204 1.00 3.82 N ATOM 0 H ARG A 263 8.930 -1.457 -9.292 1.00 0.34 H new ATOM 0 HA ARG A 263 9.457 -1.191 -12.114 1.00 0.40 H new ATOM 0 HB2 ARG A 263 9.603 -3.697 -10.372 1.00 0.48 H new ATOM 0 HB3 ARG A 263 10.499 -3.388 -11.846 1.00 0.48 H new ATOM 0 HG2 ARG A 263 11.521 -1.335 -10.682 1.00 1.31 H new ATOM 0 HG3 ARG A 263 10.767 -1.882 -9.197 1.00 1.31 H new ATOM 0 HD2 ARG A 263 12.017 -3.999 -9.263 1.00 1.59 H new ATOM 0 HD3 ARG A 263 12.636 -3.640 -10.863 1.00 1.59 H new ATOM 0 HE ARG A 263 13.485 -1.424 -9.337 1.00 2.29 H new ATOM 0 HH11 ARG A 263 13.677 -4.912 -9.151 1.00 3.07 H new ATOM 0 HH12 ARG A 263 15.216 -4.901 -8.284 1.00 3.07 H new ATOM 0 HH21 ARG A 263 15.441 -1.414 -8.221 1.00 3.82 H new ATOM 0 HH22 ARG A 263 16.206 -2.939 -7.762 1.00 3.82 H new ATOM 757 N LYS A 264 6.676 -2.519 -11.375 1.00 0.36 N ATOM 758 CA LYS A 264 5.449 -3.189 -11.925 1.00 0.42 C ATOM 759 C LYS A 264 4.353 -2.144 -12.143 1.00 0.36 C ATOM 760 O LYS A 264 3.186 -2.467 -12.275 1.00 0.38 O ATOM 761 CB LYS A 264 4.952 -4.235 -10.925 1.00 0.54 C ATOM 762 CG LYS A 264 6.047 -5.284 -10.687 1.00 0.85 C ATOM 763 CD LYS A 264 5.439 -6.547 -10.048 1.00 0.95 C ATOM 764 CE LYS A 264 4.884 -7.479 -11.132 1.00 1.29 C ATOM 765 NZ LYS A 264 4.451 -8.759 -10.505 1.00 2.08 N ATOM 0 H LYS A 264 6.536 -2.029 -10.492 1.00 0.36 H new ATOM 0 HA LYS A 264 5.691 -3.670 -12.873 1.00 0.42 H new ATOM 0 HB2 LYS A 264 4.685 -3.754 -9.984 1.00 0.54 H new ATOM 0 HB3 LYS A 264 4.051 -4.716 -11.305 1.00 0.54 H new ATOM 0 HG2 LYS A 264 6.528 -5.540 -11.631 1.00 0.85 H new ATOM 0 HG3 LYS A 264 6.820 -4.874 -10.037 1.00 0.85 H new ATOM 0 HD2 LYS A 264 6.198 -7.068 -9.464 1.00 0.95 H new ATOM 0 HD3 LYS A 264 4.643 -6.266 -9.358 1.00 0.95 H new ATOM 0 HE2 LYS A 264 4.043 -7.006 -11.639 1.00 1.29 H new ATOM 0 HE3 LYS A 264 5.645 -7.670 -11.888 1.00 1.29 H new ATOM 0 HZ1 LYS A 264 4.074 -9.394 -11.237 1.00 2.08 H new ATOM 0 HZ2 LYS A 264 5.265 -9.211 -10.040 1.00 2.08 H new ATOM 0 HZ3 LYS A 264 3.712 -8.567 -9.799 1.00 2.08 H new ATOM 779 N ALA A 265 4.723 -0.890 -12.182 1.00 0.30 N ATOM 780 CA ALA A 265 3.721 0.197 -12.384 1.00 0.27 C ATOM 781 C ALA A 265 4.294 1.239 -13.345 1.00 0.28 C ATOM 782 O ALA A 265 5.470 1.234 -13.649 1.00 0.32 O ATOM 783 CB ALA A 265 3.425 0.861 -11.036 1.00 0.27 C ATOM 0 H ALA A 265 5.686 -0.570 -12.081 1.00 0.30 H new ATOM 0 HA ALA A 265 2.803 -0.219 -12.800 1.00 0.27 H new ATOM 0 HB1 ALA A 265 2.693 1.657 -11.175 1.00 0.27 H new ATOM 0 HB2 ALA A 265 3.027 0.119 -10.344 1.00 0.27 H new ATOM 0 HB3 ALA A 265 4.344 1.281 -10.628 1.00 0.27 H new ATOM 789 N LYS A 266 3.473 2.140 -13.821 1.00 0.26 N ATOM 790 CA LYS A 266 3.966 3.193 -14.763 1.00 0.30 C ATOM 791 C LYS A 266 3.276 4.520 -14.440 1.00 0.27 C ATOM 792 O LYS A 266 2.073 4.584 -14.281 1.00 0.25 O ATOM 793 CB LYS A 266 3.647 2.781 -16.204 1.00 0.35 C ATOM 794 CG LYS A 266 4.260 1.405 -16.493 1.00 0.43 C ATOM 795 CD LYS A 266 4.325 1.160 -18.007 1.00 0.50 C ATOM 796 CE LYS A 266 2.986 1.519 -18.661 1.00 1.09 C ATOM 797 NZ LYS A 266 2.949 0.978 -20.049 1.00 1.79 N ATOM 0 H LYS A 266 2.479 2.193 -13.598 1.00 0.26 H new ATOM 0 HA LYS A 266 5.044 3.308 -14.654 1.00 0.30 H new ATOM 0 HB2 LYS A 266 2.568 2.748 -16.353 1.00 0.35 H new ATOM 0 HB3 LYS A 266 4.043 3.520 -16.900 1.00 0.35 H new ATOM 0 HG2 LYS A 266 5.261 1.348 -16.065 1.00 0.43 H new ATOM 0 HG3 LYS A 266 3.664 0.626 -16.017 1.00 0.43 H new ATOM 0 HD2 LYS A 266 5.124 1.758 -18.445 1.00 0.50 H new ATOM 0 HD3 LYS A 266 4.565 0.115 -18.203 1.00 0.50 H new ATOM 0 HE2 LYS A 266 2.162 1.108 -18.077 1.00 1.09 H new ATOM 0 HE3 LYS A 266 2.856 2.601 -18.678 1.00 1.09 H new ATOM 0 HZ1 LYS A 266 2.040 1.222 -20.492 1.00 1.79 H new ATOM 0 HZ2 LYS A 266 3.726 1.390 -20.603 1.00 1.79 H new ATOM 0 HZ3 LYS A 266 3.054 -0.056 -20.021 1.00 1.79 H new ATOM 811 N ILE A 267 4.034 5.581 -14.331 1.00 0.30 N ATOM 812 CA ILE A 267 3.431 6.910 -14.011 1.00 0.32 C ATOM 813 C ILE A 267 3.014 7.605 -15.311 1.00 0.37 C ATOM 814 O ILE A 267 3.846 8.024 -16.092 1.00 0.41 O ATOM 815 CB ILE A 267 4.461 7.793 -13.269 1.00 0.36 C ATOM 816 CG1 ILE A 267 5.267 6.968 -12.243 1.00 0.36 C ATOM 817 CG2 ILE A 267 3.746 8.944 -12.551 1.00 0.39 C ATOM 818 CD1 ILE A 267 4.390 6.565 -11.050 1.00 0.45 C ATOM 0 H ILE A 267 5.047 5.584 -14.450 1.00 0.30 H new ATOM 0 HA ILE A 267 2.559 6.762 -13.374 1.00 0.32 H new ATOM 0 HB ILE A 267 5.153 8.195 -14.009 1.00 0.36 H new ATOM 0 HG12 ILE A 267 5.667 6.075 -12.723 1.00 0.36 H new ATOM 0 HG13 ILE A 267 6.119 7.550 -11.892 1.00 0.36 H new ATOM 0 HG21 ILE A 267 4.480 9.560 -12.031 1.00 0.39 H new ATOM 0 HG22 ILE A 267 3.213 9.553 -13.281 1.00 0.39 H new ATOM 0 HG23 ILE A 267 3.037 8.538 -11.830 1.00 0.39 H new ATOM 0 HD11 ILE A 267 4.982 5.985 -10.342 1.00 0.45 H new ATOM 0 HD12 ILE A 267 4.012 7.461 -10.558 1.00 0.45 H new ATOM 0 HD13 ILE A 267 3.552 5.963 -11.401 1.00 0.45 H new ATOM 830 N ILE A 268 1.730 7.737 -15.546 1.00 0.39 N ATOM 831 CA ILE A 268 1.251 8.417 -16.794 1.00 0.45 C ATOM 832 C ILE A 268 0.799 9.835 -16.452 1.00 0.48 C ATOM 833 O ILE A 268 0.455 10.137 -15.326 1.00 0.47 O ATOM 834 CB ILE A 268 0.059 7.653 -17.382 1.00 0.48 C ATOM 835 CG1 ILE A 268 0.393 6.153 -17.473 1.00 0.50 C ATOM 836 CG2 ILE A 268 -0.303 8.216 -18.777 1.00 0.56 C ATOM 837 CD1 ILE A 268 1.674 5.928 -18.283 1.00 0.57 C ATOM 0 H ILE A 268 0.991 7.403 -14.927 1.00 0.39 H new ATOM 0 HA ILE A 268 2.064 8.442 -17.519 1.00 0.45 H new ATOM 0 HB ILE A 268 -0.803 7.780 -16.728 1.00 0.48 H new ATOM 0 HG12 ILE A 268 0.514 5.742 -16.471 1.00 0.50 H new ATOM 0 HG13 ILE A 268 -0.435 5.619 -17.939 1.00 0.50 H new ATOM 0 HG21 ILE A 268 -1.151 7.664 -19.183 1.00 0.56 H new ATOM 0 HG22 ILE A 268 -0.565 9.270 -18.687 1.00 0.56 H new ATOM 0 HG23 ILE A 268 0.552 8.111 -19.445 1.00 0.56 H new ATOM 0 HD11 ILE A 268 1.890 4.861 -18.334 1.00 0.57 H new ATOM 0 HD12 ILE A 268 1.540 6.319 -19.291 1.00 0.57 H new ATOM 0 HD13 ILE A 268 2.505 6.444 -17.801 1.00 0.57 H new ATOM 849 N ARG A 269 0.802 10.709 -17.420 1.00 0.56 N ATOM 850 CA ARG A 269 0.381 12.124 -17.172 1.00 0.62 C ATOM 851 C ARG A 269 -1.105 12.289 -17.511 1.00 0.66 C ATOM 852 O ARG A 269 -1.582 11.791 -18.511 1.00 0.73 O ATOM 853 CB ARG A 269 1.223 13.065 -18.052 1.00 0.73 C ATOM 854 CG ARG A 269 2.642 12.503 -18.212 1.00 1.48 C ATOM 855 CD ARG A 269 3.284 12.306 -16.837 1.00 1.80 C ATOM 856 NE ARG A 269 4.711 11.906 -17.005 1.00 2.23 N ATOM 857 CZ ARG A 269 5.532 11.982 -15.993 1.00 2.82 C ATOM 858 NH1 ARG A 269 5.101 12.402 -14.836 1.00 3.12 N ATOM 859 NH2 ARG A 269 6.781 11.637 -16.137 1.00 3.63 N ATOM 0 H ARG A 269 1.079 10.506 -18.380 1.00 0.56 H new ATOM 0 HA ARG A 269 0.535 12.372 -16.122 1.00 0.62 H new ATOM 0 HB2 ARG A 269 0.755 13.178 -19.030 1.00 0.73 H new ATOM 0 HB3 ARG A 269 1.264 14.057 -17.602 1.00 0.73 H new ATOM 0 HG2 ARG A 269 2.608 11.553 -18.746 1.00 1.48 H new ATOM 0 HG3 ARG A 269 3.247 13.184 -18.811 1.00 1.48 H new ATOM 0 HD2 ARG A 269 3.220 13.228 -16.259 1.00 1.80 H new ATOM 0 HD3 ARG A 269 2.744 11.541 -16.279 1.00 1.80 H new ATOM 0 HE ARG A 269 5.045 11.573 -17.910 1.00 2.23 H new ATOM 0 HH11 ARG A 269 4.124 12.671 -14.723 1.00 3.12 H new ATOM 0 HH12 ARG A 269 5.741 12.462 -14.044 1.00 3.12 H new ATOM 0 HH21 ARG A 269 7.118 11.307 -17.041 1.00 3.63 H new ATOM 0 HH22 ARG A 269 7.421 11.697 -15.345 1.00 3.63 H new ATOM 873 N ASP A 270 -1.838 12.992 -16.691 1.00 0.67 N ATOM 874 CA ASP A 270 -3.288 13.199 -16.971 1.00 0.75 C ATOM 875 C ASP A 270 -3.757 14.490 -16.299 1.00 1.18 C ATOM 876 O ASP A 270 -2.927 15.361 -16.093 1.00 1.73 O ATOM 877 CB ASP A 270 -4.088 12.015 -16.427 1.00 0.91 C ATOM 878 CG ASP A 270 -3.845 10.791 -17.312 1.00 1.47 C ATOM 879 OD1 ASP A 270 -2.856 10.112 -17.092 1.00 2.05 O ATOM 880 OD2 ASP A 270 -4.649 10.559 -18.200 1.00 2.05 O ATOM 881 OXT ASP A 270 -4.935 14.588 -16.003 1.00 1.84 O ATOM 0 H ASP A 270 -1.495 13.433 -15.838 1.00 0.67 H new ATOM 0 HA ASP A 270 -3.444 13.274 -18.047 1.00 0.75 H new ATOM 0 HB2 ASP A 270 -3.790 11.801 -15.401 1.00 0.91 H new ATOM 0 HB3 ASP A 270 -5.150 12.258 -16.406 1.00 0.91 H new TER 886 ASP A 270 ATOM 887 N MET B 219 2.814 16.043 6.810 1.00 1.76 N ATOM 888 CA MET B 219 3.160 16.708 8.097 1.00 1.15 C ATOM 889 C MET B 219 3.382 15.648 9.178 1.00 1.04 C ATOM 890 O MET B 219 3.262 15.918 10.358 1.00 1.10 O ATOM 891 CB MET B 219 2.018 17.637 8.516 1.00 1.82 C ATOM 892 CG MET B 219 0.701 16.865 8.493 1.00 2.31 C ATOM 893 SD MET B 219 -0.652 17.962 8.984 1.00 3.46 S ATOM 894 CE MET B 219 -1.988 17.039 8.189 1.00 3.83 C ATOM 0 HA MET B 219 4.072 17.291 7.970 1.00 1.15 H new ATOM 0 HB2 MET B 219 2.203 18.031 9.515 1.00 1.82 H new ATOM 0 HB3 MET B 219 1.963 18.491 7.841 1.00 1.82 H new ATOM 0 HG2 MET B 219 0.517 16.468 7.494 1.00 2.31 H new ATOM 0 HG3 MET B 219 0.755 16.012 9.170 1.00 2.31 H new ATOM 0 HE1 MET B 219 -2.936 17.546 8.366 1.00 3.83 H new ATOM 0 HE2 MET B 219 -1.802 16.981 7.116 1.00 3.83 H new ATOM 0 HE3 MET B 219 -2.032 16.032 8.604 1.00 3.83 H new ATOM 904 N ILE B 220 3.710 14.444 8.788 1.00 0.98 N ATOM 905 CA ILE B 220 3.947 13.372 9.797 1.00 0.97 C ATOM 906 C ILE B 220 5.386 13.489 10.307 1.00 0.94 C ATOM 907 O ILE B 220 6.317 13.041 9.669 1.00 1.01 O ATOM 908 CB ILE B 220 3.750 11.992 9.152 1.00 1.03 C ATOM 909 CG1 ILE B 220 2.298 11.839 8.665 1.00 1.36 C ATOM 910 CG2 ILE B 220 4.046 10.899 10.183 1.00 1.79 C ATOM 911 CD1 ILE B 220 2.015 12.785 7.480 1.00 2.08 C ATOM 0 H ILE B 220 3.824 14.158 7.816 1.00 0.98 H new ATOM 0 HA ILE B 220 3.242 13.483 10.621 1.00 0.97 H new ATOM 0 HB ILE B 220 4.429 11.899 8.304 1.00 1.03 H new ATOM 0 HG12 ILE B 220 2.118 10.807 8.363 1.00 1.36 H new ATOM 0 HG13 ILE B 220 1.611 12.057 9.482 1.00 1.36 H new ATOM 0 HG21 ILE B 220 3.906 9.920 9.725 1.00 1.79 H new ATOM 0 HG22 ILE B 220 5.075 10.994 10.529 1.00 1.79 H new ATOM 0 HG23 ILE B 220 3.368 11.004 11.030 1.00 1.79 H new ATOM 0 HD11 ILE B 220 0.983 12.659 7.153 1.00 2.08 H new ATOM 0 HD12 ILE B 220 2.174 13.817 7.793 1.00 2.08 H new ATOM 0 HD13 ILE B 220 2.688 12.548 6.656 1.00 2.08 H new ATOM 923 N GLN B 221 5.579 14.095 11.449 1.00 0.90 N ATOM 924 CA GLN B 221 6.961 14.242 11.989 1.00 0.92 C ATOM 925 C GLN B 221 7.360 12.961 12.724 1.00 0.83 C ATOM 926 O GLN B 221 7.601 11.936 12.118 1.00 0.85 O ATOM 927 CB GLN B 221 7.013 15.429 12.956 1.00 1.00 C ATOM 928 CG GLN B 221 6.713 16.724 12.195 1.00 1.28 C ATOM 929 CD GLN B 221 7.143 17.926 13.039 1.00 1.61 C ATOM 930 OE1 GLN B 221 8.320 18.159 13.226 1.00 2.08 O ATOM 931 NE2 GLN B 221 6.233 18.704 13.558 1.00 2.16 N ATOM 0 H GLN B 221 4.841 14.493 12.029 1.00 0.90 H new ATOM 0 HA GLN B 221 7.654 14.419 11.167 1.00 0.92 H new ATOM 0 HB2 GLN B 221 6.288 15.290 13.758 1.00 1.00 H new ATOM 0 HB3 GLN B 221 7.996 15.489 13.422 1.00 1.00 H new ATOM 0 HG2 GLN B 221 7.241 16.728 11.242 1.00 1.28 H new ATOM 0 HG3 GLN B 221 5.648 16.787 11.970 1.00 1.28 H new ATOM 0 HE21 GLN B 221 5.244 18.508 13.401 1.00 2.16 H new ATOM 0 HE22 GLN B 221 6.510 19.508 14.121 1.00 2.16 H new ATOM 940 N ASN B 222 7.433 13.012 14.029 1.00 0.78 N ATOM 941 CA ASN B 222 7.819 11.798 14.813 1.00 0.73 C ATOM 942 C ASN B 222 6.554 11.107 15.336 1.00 0.63 C ATOM 943 O ASN B 222 6.013 11.478 16.357 1.00 0.64 O ATOM 944 CB ASN B 222 8.698 12.223 15.993 1.00 0.80 C ATOM 945 CG ASN B 222 9.680 13.303 15.533 1.00 0.93 C ATOM 946 OD1 ASN B 222 9.474 14.475 15.783 1.00 1.48 O ATOM 947 ND2 ASN B 222 10.748 12.957 14.868 1.00 1.39 N ATOM 0 H ASN B 222 7.242 13.844 14.588 1.00 0.78 H new ATOM 0 HA ASN B 222 8.371 11.106 14.176 1.00 0.73 H new ATOM 0 HB2 ASN B 222 8.077 12.602 16.805 1.00 0.80 H new ATOM 0 HB3 ASN B 222 9.243 11.363 16.383 1.00 0.80 H new ATOM 0 HD21 ASN B 222 11.409 13.669 14.558 1.00 1.39 H new ATOM 0 HD22 ASN B 222 10.922 11.974 14.658 1.00 1.39 H new ATOM 954 N PHE B 223 6.084 10.104 14.641 1.00 0.55 N ATOM 955 CA PHE B 223 4.855 9.369 15.082 1.00 0.46 C ATOM 956 C PHE B 223 5.098 7.862 14.936 1.00 0.38 C ATOM 957 O PHE B 223 5.457 7.390 13.874 1.00 0.38 O ATOM 958 CB PHE B 223 3.675 9.776 14.189 1.00 0.46 C ATOM 959 CG PHE B 223 3.177 11.143 14.589 1.00 0.53 C ATOM 960 CD1 PHE B 223 2.269 11.278 15.655 1.00 0.54 C ATOM 961 CD2 PHE B 223 3.620 12.285 13.894 1.00 0.64 C ATOM 962 CE1 PHE B 223 1.803 12.555 16.025 1.00 0.64 C ATOM 963 CE2 PHE B 223 3.155 13.561 14.264 1.00 0.73 C ATOM 964 CZ PHE B 223 2.245 13.696 15.330 1.00 0.72 C ATOM 0 H PHE B 223 6.502 9.757 13.777 1.00 0.55 H new ATOM 0 HA PHE B 223 4.631 9.612 16.121 1.00 0.46 H new ATOM 0 HB2 PHE B 223 3.984 9.783 13.144 1.00 0.46 H new ATOM 0 HB3 PHE B 223 2.871 9.046 14.279 1.00 0.46 H new ATOM 0 HD1 PHE B 223 1.929 10.403 16.189 1.00 0.54 H new ATOM 0 HD2 PHE B 223 4.318 12.182 13.076 1.00 0.64 H new ATOM 0 HE1 PHE B 223 1.106 12.658 16.843 1.00 0.64 H new ATOM 0 HE2 PHE B 223 3.496 14.436 13.731 1.00 0.73 H new ATOM 0 HZ PHE B 223 1.887 14.674 15.614 1.00 0.72 H new ATOM 974 N ARG B 224 4.895 7.100 15.982 1.00 0.36 N ATOM 975 CA ARG B 224 5.104 5.616 15.896 1.00 0.30 C ATOM 976 C ARG B 224 3.735 4.939 15.794 1.00 0.26 C ATOM 977 O ARG B 224 2.732 5.502 16.186 1.00 0.28 O ATOM 978 CB ARG B 224 5.821 5.123 17.161 1.00 0.34 C ATOM 979 CG ARG B 224 7.251 5.688 17.202 1.00 1.00 C ATOM 980 CD ARG B 224 8.111 5.094 16.064 1.00 1.24 C ATOM 981 NE ARG B 224 9.477 4.752 16.583 1.00 1.82 N ATOM 982 CZ ARG B 224 10.153 5.592 17.327 1.00 2.35 C ATOM 983 NH1 ARG B 224 9.704 6.798 17.540 1.00 2.57 N ATOM 984 NH2 ARG B 224 11.302 5.232 17.830 1.00 3.26 N ATOM 0 H ARG B 224 4.593 7.440 16.895 1.00 0.36 H new ATOM 0 HA ARG B 224 5.711 5.375 15.023 1.00 0.30 H new ATOM 0 HB2 ARG B 224 5.270 5.437 18.048 1.00 0.34 H new ATOM 0 HB3 ARG B 224 5.850 4.033 17.173 1.00 0.34 H new ATOM 0 HG2 ARG B 224 7.220 6.774 17.111 1.00 1.00 H new ATOM 0 HG3 ARG B 224 7.708 5.462 18.165 1.00 1.00 H new ATOM 0 HD2 ARG B 224 7.631 4.202 15.661 1.00 1.24 H new ATOM 0 HD3 ARG B 224 8.192 5.809 15.246 1.00 1.24 H new ATOM 0 HE ARG B 224 9.887 3.847 16.352 1.00 1.82 H new ATOM 0 HH11 ARG B 224 8.820 7.094 17.126 1.00 2.57 H new ATOM 0 HH12 ARG B 224 10.237 7.445 18.121 1.00 2.57 H new ATOM 0 HH21 ARG B 224 11.671 4.299 17.643 1.00 3.26 H new ATOM 0 HH22 ARG B 224 11.831 5.883 18.410 1.00 3.26 H new ATOM 998 N VAL B 225 3.677 3.741 15.261 1.00 0.22 N ATOM 999 CA VAL B 225 2.360 3.039 15.122 1.00 0.20 C ATOM 1000 C VAL B 225 2.504 1.553 15.468 1.00 0.20 C ATOM 1001 O VAL B 225 3.477 0.916 15.120 1.00 0.22 O ATOM 1002 CB VAL B 225 1.878 3.167 13.674 1.00 0.20 C ATOM 1003 CG1 VAL B 225 0.588 2.365 13.487 1.00 0.20 C ATOM 1004 CG2 VAL B 225 1.610 4.639 13.352 1.00 0.23 C ATOM 0 H VAL B 225 4.483 3.220 14.917 1.00 0.22 H new ATOM 0 HA VAL B 225 1.643 3.494 15.805 1.00 0.20 H new ATOM 0 HB VAL B 225 2.646 2.780 13.004 1.00 0.20 H new ATOM 0 HG11 VAL B 225 0.248 2.458 12.456 1.00 0.20 H new ATOM 0 HG12 VAL B 225 0.776 1.316 13.714 1.00 0.20 H new ATOM 0 HG13 VAL B 225 -0.180 2.749 14.158 1.00 0.20 H new ATOM 0 HG21 VAL B 225 1.267 4.729 12.321 1.00 0.23 H new ATOM 0 HG22 VAL B 225 0.844 5.025 14.025 1.00 0.23 H new ATOM 0 HG23 VAL B 225 2.528 5.213 13.481 1.00 0.23 H new ATOM 1014 N TYR B 226 1.518 0.997 16.131 1.00 0.22 N ATOM 1015 CA TYR B 226 1.552 -0.458 16.485 1.00 0.25 C ATOM 1016 C TYR B 226 0.542 -1.177 15.589 1.00 0.26 C ATOM 1017 O TYR B 226 -0.388 -0.574 15.095 1.00 0.26 O ATOM 1018 CB TYR B 226 1.156 -0.649 17.957 1.00 0.32 C ATOM 1019 CG TYR B 226 2.321 -0.299 18.858 1.00 0.35 C ATOM 1020 CD1 TYR B 226 2.614 1.048 19.138 1.00 0.42 C ATOM 1021 CD2 TYR B 226 3.104 -1.322 19.431 1.00 0.42 C ATOM 1022 CE1 TYR B 226 3.690 1.374 19.988 1.00 0.50 C ATOM 1023 CE2 TYR B 226 4.181 -0.995 20.278 1.00 0.48 C ATOM 1024 CZ TYR B 226 4.473 0.353 20.557 1.00 0.49 C ATOM 1025 OH TYR B 226 5.527 0.674 21.388 1.00 0.58 O ATOM 0 H TYR B 226 0.684 1.493 16.445 1.00 0.22 H new ATOM 0 HA TYR B 226 2.555 -0.860 16.340 1.00 0.25 H new ATOM 0 HB2 TYR B 226 0.299 -0.019 18.196 1.00 0.32 H new ATOM 0 HB3 TYR B 226 0.851 -1.681 18.129 1.00 0.32 H new ATOM 0 HD1 TYR B 226 2.014 1.833 18.701 1.00 0.42 H new ATOM 0 HD2 TYR B 226 2.878 -2.357 19.220 1.00 0.42 H new ATOM 0 HE1 TYR B 226 3.914 2.409 20.203 1.00 0.50 H new ATOM 0 HE2 TYR B 226 4.783 -1.779 20.713 1.00 0.48 H new ATOM 0 HH TYR B 226 5.963 -0.148 21.696 1.00 0.58 H new ATOM 1035 N TYR B 227 0.702 -2.455 15.363 1.00 0.29 N ATOM 1036 CA TYR B 227 -0.270 -3.167 14.477 1.00 0.32 C ATOM 1037 C TYR B 227 -0.315 -4.657 14.807 1.00 0.38 C ATOM 1038 O TYR B 227 0.652 -5.241 15.258 1.00 0.39 O ATOM 1039 CB TYR B 227 0.161 -3.000 13.016 1.00 0.31 C ATOM 1040 CG TYR B 227 1.597 -3.448 12.852 1.00 0.31 C ATOM 1041 CD1 TYR B 227 2.645 -2.649 13.350 1.00 0.28 C ATOM 1042 CD2 TYR B 227 1.890 -4.662 12.196 1.00 0.39 C ATOM 1043 CE1 TYR B 227 3.983 -3.064 13.195 1.00 0.32 C ATOM 1044 CE2 TYR B 227 3.228 -5.074 12.039 1.00 0.42 C ATOM 1045 CZ TYR B 227 4.275 -4.276 12.539 1.00 0.38 C ATOM 1046 OH TYR B 227 5.586 -4.680 12.383 1.00 0.44 O ATOM 0 H TYR B 227 1.452 -3.031 15.747 1.00 0.29 H new ATOM 0 HA TYR B 227 -1.259 -2.738 14.636 1.00 0.32 H new ATOM 0 HB2 TYR B 227 -0.489 -3.586 12.366 1.00 0.31 H new ATOM 0 HB3 TYR B 227 0.059 -1.958 12.714 1.00 0.31 H new ATOM 0 HD1 TYR B 227 2.423 -1.718 13.851 1.00 0.28 H new ATOM 0 HD2 TYR B 227 1.088 -5.276 11.814 1.00 0.39 H new ATOM 0 HE1 TYR B 227 4.785 -2.452 13.580 1.00 0.32 H new ATOM 0 HE2 TYR B 227 3.451 -6.003 11.535 1.00 0.42 H new ATOM 0 HH TYR B 227 6.058 -4.597 13.238 1.00 0.44 H new ATOM 1056 N ARG B 228 -1.443 -5.278 14.568 1.00 0.43 N ATOM 1057 CA ARG B 228 -1.583 -6.739 14.844 1.00 0.50 C ATOM 1058 C ARG B 228 -1.402 -7.522 13.543 1.00 0.55 C ATOM 1059 O ARG B 228 -1.858 -7.115 12.493 1.00 0.61 O ATOM 1060 CB ARG B 228 -2.979 -7.017 15.415 1.00 0.56 C ATOM 1061 CG ARG B 228 -3.350 -5.910 16.400 1.00 0.67 C ATOM 1062 CD ARG B 228 -4.595 -6.319 17.189 1.00 0.73 C ATOM 1063 NE ARG B 228 -5.632 -6.836 16.254 1.00 1.49 N ATOM 1064 CZ ARG B 228 -6.654 -7.504 16.718 1.00 1.73 C ATOM 1065 NH1 ARG B 228 -6.778 -7.693 18.003 1.00 1.49 N ATOM 1066 NH2 ARG B 228 -7.555 -7.975 15.898 1.00 2.76 N ATOM 0 H ARG B 228 -2.279 -4.831 14.191 1.00 0.43 H new ATOM 0 HA ARG B 228 -0.825 -7.048 15.564 1.00 0.50 H new ATOM 0 HB2 ARG B 228 -3.712 -7.063 14.609 1.00 0.56 H new ATOM 0 HB3 ARG B 228 -2.994 -7.985 15.915 1.00 0.56 H new ATOM 0 HG2 ARG B 228 -2.520 -5.723 17.082 1.00 0.67 H new ATOM 0 HG3 ARG B 228 -3.537 -4.980 15.863 1.00 0.67 H new ATOM 0 HD2 ARG B 228 -4.338 -7.084 17.922 1.00 0.73 H new ATOM 0 HD3 ARG B 228 -4.984 -5.464 17.743 1.00 0.73 H new ATOM 0 HE ARG B 228 -5.544 -6.669 15.252 1.00 1.49 H new ATOM 0 HH11 ARG B 228 -6.078 -7.319 18.643 1.00 1.49 H new ATOM 0 HH12 ARG B 228 -7.575 -8.214 18.367 1.00 1.49 H new ATOM 0 HH21 ARG B 228 -7.461 -7.821 14.894 1.00 2.76 H new ATOM 0 HH22 ARG B 228 -8.353 -8.497 16.262 1.00 2.76 H new ATOM 1080 N ASP B 229 -0.746 -8.651 13.603 1.00 0.59 N ATOM 1081 CA ASP B 229 -0.543 -9.472 12.372 1.00 0.67 C ATOM 1082 C ASP B 229 -1.634 -10.539 12.300 1.00 0.75 C ATOM 1083 O ASP B 229 -2.430 -10.688 13.206 1.00 0.77 O ATOM 1084 CB ASP B 229 0.824 -10.155 12.434 1.00 0.73 C ATOM 1085 CG ASP B 229 0.986 -10.843 13.791 1.00 1.42 C ATOM 1086 OD1 ASP B 229 -0.011 -11.001 14.475 1.00 2.08 O ATOM 1087 OD2 ASP B 229 2.105 -11.202 14.123 1.00 2.23 O ATOM 0 H ASP B 229 -0.341 -9.041 14.454 1.00 0.59 H new ATOM 0 HA ASP B 229 -0.590 -8.831 11.492 1.00 0.67 H new ATOM 0 HB2 ASP B 229 0.915 -10.886 11.630 1.00 0.73 H new ATOM 0 HB3 ASP B 229 1.617 -9.421 12.289 1.00 0.73 H new ATOM 1092 N SER B 230 -1.670 -11.290 11.236 1.00 0.85 N ATOM 1093 CA SER B 230 -2.702 -12.357 11.110 1.00 0.99 C ATOM 1094 C SER B 230 -2.199 -13.630 11.797 1.00 1.05 C ATOM 1095 O SER B 230 -2.915 -14.604 11.924 1.00 1.19 O ATOM 1096 CB SER B 230 -2.964 -12.640 9.630 1.00 1.08 C ATOM 1097 OG SER B 230 -3.990 -13.616 9.514 1.00 1.81 O ATOM 0 H SER B 230 -1.029 -11.211 10.447 1.00 0.85 H new ATOM 0 HA SER B 230 -3.628 -12.030 11.583 1.00 0.99 H new ATOM 0 HB2 SER B 230 -3.259 -11.723 9.119 1.00 1.08 H new ATOM 0 HB3 SER B 230 -2.053 -12.995 9.149 1.00 1.08 H new ATOM 0 HG SER B 230 -4.045 -14.133 10.344 1.00 1.81 H new ATOM 1103 N ARG B 231 -0.967 -13.630 12.242 1.00 1.01 N ATOM 1104 CA ARG B 231 -0.414 -14.840 12.923 1.00 1.12 C ATOM 1105 C ARG B 231 -0.709 -14.768 14.424 1.00 1.15 C ATOM 1106 O ARG B 231 -0.658 -15.761 15.121 1.00 1.31 O ATOM 1107 CB ARG B 231 1.103 -14.898 12.710 1.00 1.15 C ATOM 1108 CG ARG B 231 1.413 -14.922 11.213 1.00 1.19 C ATOM 1109 CD ARG B 231 2.927 -15.024 11.001 1.00 1.48 C ATOM 1110 NE ARG B 231 3.626 -14.053 11.890 1.00 2.10 N ATOM 1111 CZ ARG B 231 4.910 -14.169 12.102 1.00 2.68 C ATOM 1112 NH1 ARG B 231 5.577 -15.141 11.545 1.00 2.81 N ATOM 1113 NH2 ARG B 231 5.525 -13.312 12.871 1.00 3.64 N ATOM 0 H ARG B 231 -0.321 -12.845 12.163 1.00 1.01 H new ATOM 0 HA ARG B 231 -0.879 -15.732 12.503 1.00 1.12 H new ATOM 0 HB2 ARG B 231 1.579 -14.035 13.176 1.00 1.15 H new ATOM 0 HB3 ARG B 231 1.514 -15.786 13.190 1.00 1.15 H new ATOM 0 HG2 ARG B 231 0.912 -15.768 10.742 1.00 1.19 H new ATOM 0 HG3 ARG B 231 1.029 -14.019 10.738 1.00 1.19 H new ATOM 0 HD2 ARG B 231 3.266 -16.037 11.215 1.00 1.48 H new ATOM 0 HD3 ARG B 231 3.172 -14.819 9.959 1.00 1.48 H new ATOM 0 HE ARG B 231 3.102 -13.298 12.333 1.00 2.10 H new ATOM 0 HH11 ARG B 231 5.096 -15.810 10.944 1.00 2.81 H new ATOM 0 HH12 ARG B 231 6.579 -15.232 11.710 1.00 2.81 H new ATOM 0 HH21 ARG B 231 5.003 -12.552 13.307 1.00 3.64 H new ATOM 0 HH22 ARG B 231 6.527 -13.403 13.036 1.00 3.64 H new ATOM 1127 N ASP B 232 -1.019 -13.602 14.930 1.00 1.03 N ATOM 1128 CA ASP B 232 -1.313 -13.476 16.386 1.00 1.08 C ATOM 1129 C ASP B 232 -2.074 -12.150 16.642 1.00 0.95 C ATOM 1130 O ASP B 232 -1.616 -11.115 16.203 1.00 0.83 O ATOM 1131 CB ASP B 232 0.015 -13.444 17.151 1.00 1.15 C ATOM 1132 CG ASP B 232 0.610 -14.852 17.218 1.00 1.62 C ATOM 1133 OD1 ASP B 232 -0.072 -15.740 17.702 1.00 2.13 O ATOM 1134 OD2 ASP B 232 1.738 -15.019 16.784 1.00 2.16 O ATOM 0 H ASP B 232 -1.081 -12.734 14.398 1.00 1.03 H new ATOM 0 HA ASP B 232 -1.921 -14.317 16.718 1.00 1.08 H new ATOM 0 HB2 ASP B 232 0.713 -12.768 16.658 1.00 1.15 H new ATOM 0 HB3 ASP B 232 -0.144 -13.059 18.158 1.00 1.15 H new ATOM 1139 N PRO B 233 -3.202 -12.180 17.343 1.00 1.03 N ATOM 1140 CA PRO B 233 -3.952 -10.936 17.618 1.00 0.98 C ATOM 1141 C PRO B 233 -3.136 -10.017 18.542 1.00 0.86 C ATOM 1142 O PRO B 233 -3.630 -9.018 19.025 1.00 0.84 O ATOM 1143 CB PRO B 233 -5.254 -11.398 18.313 1.00 1.15 C ATOM 1144 CG PRO B 233 -5.099 -12.913 18.622 1.00 1.27 C ATOM 1145 CD PRO B 233 -3.824 -13.406 17.901 1.00 1.21 C ATOM 0 HA PRO B 233 -4.158 -10.367 16.711 1.00 0.98 H new ATOM 0 HB2 PRO B 233 -5.421 -10.834 19.230 1.00 1.15 H new ATOM 0 HB3 PRO B 233 -6.116 -11.223 17.670 1.00 1.15 H new ATOM 0 HG2 PRO B 233 -5.020 -13.079 19.696 1.00 1.27 H new ATOM 0 HG3 PRO B 233 -5.973 -13.466 18.277 1.00 1.27 H new ATOM 0 HD2 PRO B 233 -3.150 -13.911 18.592 1.00 1.21 H new ATOM 0 HD3 PRO B 233 -4.066 -14.119 17.113 1.00 1.21 H new ATOM 1153 N VAL B 234 -1.899 -10.344 18.802 1.00 0.86 N ATOM 1154 CA VAL B 234 -1.078 -9.482 19.701 1.00 0.81 C ATOM 1155 C VAL B 234 -0.480 -8.322 18.904 1.00 0.70 C ATOM 1156 O VAL B 234 -0.342 -8.386 17.700 1.00 0.73 O ATOM 1157 CB VAL B 234 0.053 -10.302 20.319 1.00 0.91 C ATOM 1158 CG1 VAL B 234 0.722 -9.496 21.434 1.00 1.74 C ATOM 1159 CG2 VAL B 234 -0.516 -11.597 20.902 1.00 1.76 C ATOM 0 H VAL B 234 -1.423 -11.167 18.433 1.00 0.86 H new ATOM 0 HA VAL B 234 -1.717 -9.090 20.492 1.00 0.81 H new ATOM 0 HB VAL B 234 0.789 -10.539 19.550 1.00 0.91 H new ATOM 0 HG11 VAL B 234 1.529 -10.083 21.874 1.00 1.74 H new ATOM 0 HG12 VAL B 234 1.128 -8.572 21.022 1.00 1.74 H new ATOM 0 HG13 VAL B 234 -0.014 -9.258 22.202 1.00 1.74 H new ATOM 0 HG21 VAL B 234 0.291 -12.183 21.343 1.00 1.76 H new ATOM 0 HG22 VAL B 234 -1.252 -11.358 21.669 1.00 1.76 H new ATOM 0 HG23 VAL B 234 -0.992 -12.174 20.110 1.00 1.76 H new ATOM 1169 N TRP B 235 -0.119 -7.266 19.576 1.00 0.65 N ATOM 1170 CA TRP B 235 0.474 -6.092 18.872 1.00 0.56 C ATOM 1171 C TRP B 235 1.916 -6.416 18.471 1.00 0.54 C ATOM 1172 O TRP B 235 2.536 -7.302 19.028 1.00 0.66 O ATOM 1173 CB TRP B 235 0.468 -4.882 19.816 1.00 0.56 C ATOM 1174 CG TRP B 235 -0.944 -4.513 20.135 1.00 0.58 C ATOM 1175 CD1 TRP B 235 -1.599 -4.851 21.270 1.00 0.66 C ATOM 1176 CD2 TRP B 235 -1.887 -3.751 19.329 1.00 0.54 C ATOM 1177 NE1 TRP B 235 -2.888 -4.347 21.212 1.00 0.67 N ATOM 1178 CE2 TRP B 235 -3.115 -3.660 20.037 1.00 0.60 C ATOM 1179 CE3 TRP B 235 -1.799 -3.132 18.060 1.00 0.47 C ATOM 1180 CZ2 TRP B 235 -4.220 -2.981 19.504 1.00 0.60 C ATOM 1181 CZ3 TRP B 235 -2.908 -2.447 17.520 1.00 0.47 C ATOM 1182 CH2 TRP B 235 -4.117 -2.372 18.242 1.00 0.53 C ATOM 0 H TRP B 235 -0.209 -7.163 20.587 1.00 0.65 H new ATOM 0 HA TRP B 235 -0.110 -5.865 17.980 1.00 0.56 H new ATOM 0 HB2 TRP B 235 1.010 -5.118 20.732 1.00 0.56 H new ATOM 0 HB3 TRP B 235 0.980 -4.040 19.350 1.00 0.56 H new ATOM 0 HD1 TRP B 235 -1.184 -5.421 22.088 1.00 0.66 H new ATOM 0 HE1 TRP B 235 -3.584 -4.469 21.948 1.00 0.67 H new ATOM 0 HE3 TRP B 235 -0.877 -3.184 17.501 1.00 0.47 H new ATOM 0 HZ2 TRP B 235 -5.144 -2.926 20.060 1.00 0.60 H new ATOM 0 HZ3 TRP B 235 -2.831 -1.978 16.550 1.00 0.47 H new ATOM 0 HH2 TRP B 235 -4.963 -1.847 17.825 1.00 0.53 H new ATOM 1193 N LYS B 236 2.459 -5.698 17.515 1.00 0.46 N ATOM 1194 CA LYS B 236 3.872 -5.941 17.071 1.00 0.45 C ATOM 1195 C LYS B 236 4.689 -4.671 17.329 1.00 0.44 C ATOM 1196 O LYS B 236 4.141 -3.614 17.572 1.00 0.67 O ATOM 1197 CB LYS B 236 3.894 -6.290 15.570 1.00 0.47 C ATOM 1198 CG LYS B 236 3.585 -7.782 15.385 1.00 0.81 C ATOM 1199 CD LYS B 236 3.650 -8.160 13.899 1.00 0.73 C ATOM 1200 CE LYS B 236 5.074 -7.964 13.356 1.00 1.09 C ATOM 1201 NZ LYS B 236 5.289 -8.880 12.200 1.00 1.44 N ATOM 0 H LYS B 236 1.980 -4.947 17.018 1.00 0.46 H new ATOM 0 HA LYS B 236 4.301 -6.775 17.627 1.00 0.45 H new ATOM 0 HB2 LYS B 236 3.160 -5.687 15.035 1.00 0.47 H new ATOM 0 HB3 LYS B 236 4.870 -6.055 15.146 1.00 0.47 H new ATOM 0 HG2 LYS B 236 4.299 -8.381 15.951 1.00 0.81 H new ATOM 0 HG3 LYS B 236 2.595 -8.007 15.781 1.00 0.81 H new ATOM 0 HD2 LYS B 236 3.344 -9.198 13.768 1.00 0.73 H new ATOM 0 HD3 LYS B 236 2.950 -7.547 13.331 1.00 0.73 H new ATOM 0 HE2 LYS B 236 5.219 -6.929 13.047 1.00 1.09 H new ATOM 0 HE3 LYS B 236 5.805 -8.168 14.138 1.00 1.09 H new ATOM 0 HZ1 LYS B 236 6.252 -8.751 11.829 1.00 1.44 H new ATOM 0 HZ2 LYS B 236 5.167 -9.865 12.510 1.00 1.44 H new ATOM 0 HZ3 LYS B 236 4.598 -8.664 11.453 1.00 1.44 H new ATOM 1215 N GLY B 237 5.992 -4.771 17.289 1.00 0.40 N ATOM 1216 CA GLY B 237 6.851 -3.576 17.552 1.00 0.37 C ATOM 1217 C GLY B 237 6.283 -2.334 16.836 1.00 0.31 C ATOM 1218 O GLY B 237 5.445 -2.464 15.967 1.00 0.31 O ATOM 0 H GLY B 237 6.501 -5.631 17.085 1.00 0.40 H new ATOM 0 HA2 GLY B 237 6.908 -3.390 18.625 1.00 0.37 H new ATOM 0 HA3 GLY B 237 7.867 -3.768 17.208 1.00 0.37 H new ATOM 1222 N PRO B 238 6.753 -1.158 17.221 1.00 0.31 N ATOM 1223 CA PRO B 238 6.288 0.103 16.604 1.00 0.29 C ATOM 1224 C PRO B 238 6.760 0.188 15.144 1.00 0.24 C ATOM 1225 O PRO B 238 7.677 -0.495 14.732 1.00 0.27 O ATOM 1226 CB PRO B 238 6.940 1.220 17.453 1.00 0.36 C ATOM 1227 CG PRO B 238 7.997 0.543 18.370 1.00 0.41 C ATOM 1228 CD PRO B 238 7.761 -0.982 18.293 1.00 0.38 C ATOM 0 HA PRO B 238 5.201 0.182 16.587 1.00 0.29 H new ATOM 0 HB2 PRO B 238 7.409 1.967 16.812 1.00 0.36 H new ATOM 0 HB3 PRO B 238 6.189 1.738 18.049 1.00 0.36 H new ATOM 0 HG2 PRO B 238 9.006 0.793 18.043 1.00 0.41 H new ATOM 0 HG3 PRO B 238 7.898 0.896 19.396 1.00 0.41 H new ATOM 0 HD2 PRO B 238 8.684 -1.513 18.059 1.00 0.38 H new ATOM 0 HD3 PRO B 238 7.400 -1.374 19.244 1.00 0.38 H new ATOM 1236 N ALA B 239 6.140 1.041 14.369 1.00 0.19 N ATOM 1237 CA ALA B 239 6.535 1.205 12.937 1.00 0.18 C ATOM 1238 C ALA B 239 6.518 2.691 12.579 1.00 0.17 C ATOM 1239 O ALA B 239 6.180 3.529 13.392 1.00 0.18 O ATOM 1240 CB ALA B 239 5.542 0.461 12.046 1.00 0.21 C ATOM 0 H ALA B 239 5.369 1.637 14.670 1.00 0.19 H new ATOM 0 HA ALA B 239 7.535 0.799 12.785 1.00 0.18 H new ATOM 0 HB1 ALA B 239 5.830 0.581 11.002 1.00 0.21 H new ATOM 0 HB2 ALA B 239 5.544 -0.598 12.304 1.00 0.21 H new ATOM 0 HB3 ALA B 239 4.542 0.869 12.196 1.00 0.21 H new ATOM 1246 N LYS B 240 6.871 3.026 11.366 1.00 0.18 N ATOM 1247 CA LYS B 240 6.865 4.462 10.947 1.00 0.21 C ATOM 1248 C LYS B 240 5.554 4.761 10.217 1.00 0.19 C ATOM 1249 O LYS B 240 5.082 3.968 9.423 1.00 0.18 O ATOM 1250 CB LYS B 240 8.042 4.732 10.003 1.00 0.27 C ATOM 1251 CG LYS B 240 9.341 4.184 10.608 1.00 1.15 C ATOM 1252 CD LYS B 240 9.714 4.985 11.862 1.00 1.44 C ATOM 1253 CE LYS B 240 11.185 4.738 12.214 1.00 2.03 C ATOM 1254 NZ LYS B 240 11.443 3.272 12.283 1.00 2.72 N ATOM 0 H LYS B 240 7.164 2.367 10.645 1.00 0.18 H new ATOM 0 HA LYS B 240 6.957 5.099 11.827 1.00 0.21 H new ATOM 0 HB2 LYS B 240 7.857 4.265 9.036 1.00 0.27 H new ATOM 0 HB3 LYS B 240 8.138 5.803 9.826 1.00 0.27 H new ATOM 0 HG2 LYS B 240 9.218 3.131 10.862 1.00 1.15 H new ATOM 0 HG3 LYS B 240 10.146 4.243 9.876 1.00 1.15 H new ATOM 0 HD2 LYS B 240 9.545 6.048 11.690 1.00 1.44 H new ATOM 0 HD3 LYS B 240 9.076 4.692 12.696 1.00 1.44 H new ATOM 0 HE2 LYS B 240 11.831 5.196 11.465 1.00 2.03 H new ATOM 0 HE3 LYS B 240 11.424 5.205 13.169 1.00 2.03 H new ATOM 0 HZ1 LYS B 240 12.307 3.097 12.835 1.00 2.72 H new ATOM 0 HZ2 LYS B 240 10.638 2.799 12.741 1.00 2.72 H new ATOM 0 HZ3 LYS B 240 11.564 2.895 11.321 1.00 2.72 H new ATOM 1268 N LEU B 241 4.964 5.899 10.479 1.00 0.20 N ATOM 1269 CA LEU B 241 3.673 6.263 9.815 1.00 0.20 C ATOM 1270 C LEU B 241 3.958 6.974 8.487 1.00 0.23 C ATOM 1271 O LEU B 241 4.641 7.979 8.448 1.00 0.30 O ATOM 1272 CB LEU B 241 2.895 7.201 10.749 1.00 0.23 C ATOM 1273 CG LEU B 241 1.685 7.811 10.031 1.00 0.24 C ATOM 1274 CD1 LEU B 241 0.830 6.702 9.408 1.00 0.29 C ATOM 1275 CD2 LEU B 241 0.848 8.588 11.050 1.00 0.30 C ATOM 0 H LEU B 241 5.323 6.598 11.129 1.00 0.20 H new ATOM 0 HA LEU B 241 3.088 5.365 9.614 1.00 0.20 H new ATOM 0 HB2 LEU B 241 2.561 6.650 11.628 1.00 0.23 H new ATOM 0 HB3 LEU B 241 3.552 7.996 11.102 1.00 0.23 H new ATOM 0 HG LEU B 241 2.028 8.478 9.240 1.00 0.24 H new ATOM 0 HD11 LEU B 241 -0.027 7.145 8.900 1.00 0.29 H new ATOM 0 HD12 LEU B 241 1.428 6.142 8.689 1.00 0.29 H new ATOM 0 HD13 LEU B 241 0.480 6.029 10.191 1.00 0.29 H new ATOM 0 HD21 LEU B 241 -0.016 9.027 10.552 1.00 0.30 H new ATOM 0 HD22 LEU B 241 0.509 7.911 11.835 1.00 0.30 H new ATOM 0 HD23 LEU B 241 1.454 9.380 11.490 1.00 0.30 H new ATOM 1287 N LEU B 242 3.435 6.461 7.398 1.00 0.22 N ATOM 1288 CA LEU B 242 3.667 7.096 6.059 1.00 0.26 C ATOM 1289 C LEU B 242 2.359 7.682 5.515 1.00 0.26 C ATOM 1290 O LEU B 242 2.154 8.878 5.522 1.00 0.28 O ATOM 1291 CB LEU B 242 4.180 6.036 5.083 1.00 0.27 C ATOM 1292 CG LEU B 242 5.343 5.262 5.715 1.00 0.32 C ATOM 1293 CD1 LEU B 242 5.914 4.278 4.690 1.00 0.31 C ATOM 1294 CD2 LEU B 242 6.437 6.245 6.156 1.00 0.45 C ATOM 0 H LEU B 242 2.853 5.624 7.379 1.00 0.22 H new ATOM 0 HA LEU B 242 4.400 7.896 6.168 1.00 0.26 H new ATOM 0 HB2 LEU B 242 3.374 5.350 4.822 1.00 0.27 H new ATOM 0 HB3 LEU B 242 4.508 6.510 4.158 1.00 0.27 H new ATOM 0 HG LEU B 242 4.985 4.712 6.585 1.00 0.32 H new ATOM 0 HD11 LEU B 242 6.741 3.726 5.137 1.00 0.31 H new ATOM 0 HD12 LEU B 242 5.135 3.579 4.383 1.00 0.31 H new ATOM 0 HD13 LEU B 242 6.272 4.827 3.819 1.00 0.31 H new ATOM 0 HD21 LEU B 242 7.263 5.693 6.605 1.00 0.45 H new ATOM 0 HD22 LEU B 242 6.799 6.799 5.290 1.00 0.45 H new ATOM 0 HD23 LEU B 242 6.027 6.942 6.887 1.00 0.45 H new ATOM 1306 N TRP B 243 1.480 6.847 5.024 1.00 0.26 N ATOM 1307 CA TRP B 243 0.193 7.352 4.450 1.00 0.27 C ATOM 1308 C TRP B 243 -0.880 7.442 5.545 1.00 0.23 C ATOM 1309 O TRP B 243 -0.954 6.613 6.430 1.00 0.22 O ATOM 1310 CB TRP B 243 -0.265 6.378 3.354 1.00 0.31 C ATOM 1311 CG TRP B 243 -1.229 7.046 2.427 1.00 0.30 C ATOM 1312 CD1 TRP B 243 -0.913 8.028 1.553 1.00 0.32 C ATOM 1313 CD2 TRP B 243 -2.650 6.790 2.255 1.00 0.29 C ATOM 1314 NE1 TRP B 243 -2.050 8.396 0.861 1.00 0.33 N ATOM 1315 CE2 TRP B 243 -3.148 7.667 1.257 1.00 0.31 C ATOM 1316 CE3 TRP B 243 -3.553 5.891 2.869 1.00 0.28 C ATOM 1317 CZ2 TRP B 243 -4.496 7.654 0.877 1.00 0.32 C ATOM 1318 CZ3 TRP B 243 -4.910 5.875 2.487 1.00 0.29 C ATOM 1319 CH2 TRP B 243 -5.380 6.755 1.494 1.00 0.31 C ATOM 0 H TRP B 243 1.597 5.834 4.995 1.00 0.26 H new ATOM 0 HA TRP B 243 0.343 8.348 4.032 1.00 0.27 H new ATOM 0 HB2 TRP B 243 0.599 6.020 2.793 1.00 0.31 H new ATOM 0 HB3 TRP B 243 -0.734 5.505 3.808 1.00 0.31 H new ATOM 0 HD1 TRP B 243 0.070 8.455 1.418 1.00 0.32 H new ATOM 0 HE1 TRP B 243 -2.073 9.120 0.143 1.00 0.33 H new ATOM 0 HE3 TRP B 243 -3.202 5.214 3.634 1.00 0.28 H new ATOM 0 HZ2 TRP B 243 -4.853 8.331 0.115 1.00 0.32 H new ATOM 0 HZ3 TRP B 243 -5.593 5.184 2.959 1.00 0.29 H new ATOM 0 HH2 TRP B 243 -6.421 6.738 1.207 1.00 0.31 H new ATOM 1330 N LYS B 244 -1.721 8.443 5.476 1.00 0.24 N ATOM 1331 CA LYS B 244 -2.808 8.602 6.494 1.00 0.24 C ATOM 1332 C LYS B 244 -4.044 9.188 5.808 1.00 0.25 C ATOM 1333 O LYS B 244 -4.005 10.279 5.275 1.00 0.29 O ATOM 1334 CB LYS B 244 -2.341 9.557 7.597 1.00 0.31 C ATOM 1335 CG LYS B 244 -3.345 9.543 8.753 1.00 0.72 C ATOM 1336 CD LYS B 244 -2.931 10.580 9.800 1.00 0.82 C ATOM 1337 CE LYS B 244 -3.927 10.566 10.962 1.00 1.51 C ATOM 1338 NZ LYS B 244 -3.965 9.206 11.572 1.00 2.33 N ATOM 0 H LYS B 244 -1.702 9.163 4.753 1.00 0.24 H new ATOM 0 HA LYS B 244 -3.048 7.634 6.933 1.00 0.24 H new ATOM 0 HB2 LYS B 244 -1.355 9.260 7.955 1.00 0.31 H new ATOM 0 HB3 LYS B 244 -2.244 10.567 7.199 1.00 0.31 H new ATOM 0 HG2 LYS B 244 -4.346 9.764 8.382 1.00 0.72 H new ATOM 0 HG3 LYS B 244 -3.384 8.551 9.203 1.00 0.72 H new ATOM 0 HD2 LYS B 244 -1.928 10.361 10.166 1.00 0.82 H new ATOM 0 HD3 LYS B 244 -2.897 11.572 9.350 1.00 0.82 H new ATOM 0 HE2 LYS B 244 -3.638 11.303 11.711 1.00 1.51 H new ATOM 0 HE3 LYS B 244 -4.919 10.844 10.607 1.00 1.51 H new ATOM 0 HZ1 LYS B 244 -4.341 9.270 12.540 1.00 2.33 H new ATOM 0 HZ2 LYS B 244 -4.577 8.587 11.003 1.00 2.33 H new ATOM 0 HZ3 LYS B 244 -3.003 8.811 11.600 1.00 2.33 H new ATOM 1352 N GLY B 245 -5.141 8.475 5.806 1.00 0.24 N ATOM 1353 CA GLY B 245 -6.370 9.004 5.142 1.00 0.27 C ATOM 1354 C GLY B 245 -7.618 8.365 5.754 1.00 0.26 C ATOM 1355 O GLY B 245 -7.950 8.598 6.899 1.00 0.28 O ATOM 0 H GLY B 245 -5.239 7.554 6.233 1.00 0.24 H new ATOM 0 HA2 GLY B 245 -6.415 10.087 5.254 1.00 0.27 H new ATOM 0 HA3 GLY B 245 -6.333 8.795 4.073 1.00 0.27 H new ATOM 1359 N GLU B 246 -8.319 7.570 4.990 1.00 0.27 N ATOM 1360 CA GLU B 246 -9.556 6.923 5.514 1.00 0.28 C ATOM 1361 C GLU B 246 -9.200 6.022 6.699 1.00 0.24 C ATOM 1362 O GLU B 246 -8.214 6.232 7.377 1.00 0.22 O ATOM 1363 CB GLU B 246 -10.202 6.080 4.409 1.00 0.33 C ATOM 1364 CG GLU B 246 -10.428 6.943 3.162 1.00 1.00 C ATOM 1365 CD GLU B 246 -10.806 6.045 1.980 1.00 0.92 C ATOM 1366 OE1 GLU B 246 -9.906 5.491 1.367 1.00 1.40 O ATOM 1367 OE2 GLU B 246 -11.989 5.926 1.709 1.00 1.40 O ATOM 0 H GLU B 246 -8.087 7.341 4.024 1.00 0.27 H new ATOM 0 HA GLU B 246 -10.256 7.693 5.840 1.00 0.28 H new ATOM 0 HB2 GLU B 246 -9.562 5.232 4.165 1.00 0.33 H new ATOM 0 HB3 GLU B 246 -11.151 5.673 4.758 1.00 0.33 H new ATOM 0 HG2 GLU B 246 -11.219 7.669 3.348 1.00 1.00 H new ATOM 0 HG3 GLU B 246 -9.525 7.508 2.929 1.00 1.00 H new ATOM 1374 N GLY B 247 -9.996 5.018 6.952 1.00 0.26 N ATOM 1375 CA GLY B 247 -9.702 4.102 8.091 1.00 0.25 C ATOM 1376 C GLY B 247 -8.584 3.137 7.694 1.00 0.25 C ATOM 1377 O GLY B 247 -8.699 1.937 7.840 1.00 0.29 O ATOM 0 H GLY B 247 -10.836 4.793 6.420 1.00 0.26 H new ATOM 0 HA2 GLY B 247 -9.405 4.678 8.968 1.00 0.25 H new ATOM 0 HA3 GLY B 247 -10.598 3.545 8.364 1.00 0.25 H new ATOM 1381 N ALA B 248 -7.497 3.659 7.193 1.00 0.22 N ATOM 1382 CA ALA B 248 -6.357 2.792 6.783 1.00 0.24 C ATOM 1383 C ALA B 248 -5.055 3.560 7.003 1.00 0.21 C ATOM 1384 O ALA B 248 -5.031 4.775 6.976 1.00 0.23 O ATOM 1385 CB ALA B 248 -6.498 2.426 5.304 1.00 0.29 C ATOM 0 H ALA B 248 -7.350 4.658 7.049 1.00 0.22 H new ATOM 0 HA ALA B 248 -6.352 1.877 7.375 1.00 0.24 H new ATOM 0 HB1 ALA B 248 -5.664 1.792 5.005 1.00 0.29 H new ATOM 0 HB2 ALA B 248 -7.435 1.890 5.149 1.00 0.29 H new ATOM 0 HB3 ALA B 248 -6.496 3.335 4.702 1.00 0.29 H new ATOM 1391 N VAL B 249 -3.969 2.870 7.228 1.00 0.20 N ATOM 1392 CA VAL B 249 -2.673 3.575 7.456 1.00 0.19 C ATOM 1393 C VAL B 249 -1.521 2.741 6.901 1.00 0.20 C ATOM 1394 O VAL B 249 -1.416 1.557 7.154 1.00 0.22 O ATOM 1395 CB VAL B 249 -2.469 3.800 8.958 1.00 0.18 C ATOM 1396 CG1 VAL B 249 -3.409 4.905 9.442 1.00 0.31 C ATOM 1397 CG2 VAL B 249 -2.773 2.506 9.721 1.00 0.30 C ATOM 0 H VAL B 249 -3.922 1.852 7.264 1.00 0.20 H new ATOM 0 HA VAL B 249 -2.695 4.537 6.944 1.00 0.19 H new ATOM 0 HB VAL B 249 -1.435 4.094 9.139 1.00 0.18 H new ATOM 0 HG11 VAL B 249 -3.263 5.064 10.510 1.00 0.31 H new ATOM 0 HG12 VAL B 249 -3.192 5.828 8.904 1.00 0.31 H new ATOM 0 HG13 VAL B 249 -4.442 4.611 9.257 1.00 0.31 H new ATOM 0 HG21 VAL B 249 -2.627 2.670 10.789 1.00 0.30 H new ATOM 0 HG22 VAL B 249 -3.806 2.210 9.538 1.00 0.30 H new ATOM 0 HG23 VAL B 249 -2.103 1.717 9.380 1.00 0.30 H new ATOM 1407 N VAL B 250 -0.649 3.355 6.147 1.00 0.21 N ATOM 1408 CA VAL B 250 0.512 2.610 5.579 1.00 0.23 C ATOM 1409 C VAL B 250 1.699 2.766 6.526 1.00 0.21 C ATOM 1410 O VAL B 250 1.944 3.836 7.047 1.00 0.22 O ATOM 1411 CB VAL B 250 0.885 3.187 4.211 1.00 0.27 C ATOM 1412 CG1 VAL B 250 2.101 2.442 3.670 1.00 0.27 C ATOM 1413 CG2 VAL B 250 -0.288 3.023 3.237 1.00 0.30 C ATOM 0 H VAL B 250 -0.691 4.344 5.899 1.00 0.21 H new ATOM 0 HA VAL B 250 0.251 1.558 5.463 1.00 0.23 H new ATOM 0 HB VAL B 250 1.115 4.247 4.316 1.00 0.27 H new ATOM 0 HG11 VAL B 250 2.372 2.848 2.695 1.00 0.27 H new ATOM 0 HG12 VAL B 250 2.937 2.562 4.359 1.00 0.27 H new ATOM 0 HG13 VAL B 250 1.863 1.383 3.569 1.00 0.27 H new ATOM 0 HG21 VAL B 250 -0.015 3.436 2.266 1.00 0.30 H new ATOM 0 HG22 VAL B 250 -0.525 1.965 3.128 1.00 0.30 H new ATOM 0 HG23 VAL B 250 -1.159 3.552 3.624 1.00 0.30 H new ATOM 1423 N ILE B 251 2.439 1.712 6.762 1.00 0.20 N ATOM 1424 CA ILE B 251 3.610 1.808 7.686 1.00 0.19 C ATOM 1425 C ILE B 251 4.779 0.994 7.138 1.00 0.20 C ATOM 1426 O ILE B 251 4.682 0.351 6.112 1.00 0.24 O ATOM 1427 CB ILE B 251 3.221 1.257 9.064 1.00 0.16 C ATOM 1428 CG1 ILE B 251 2.712 -0.182 8.917 1.00 0.19 C ATOM 1429 CG2 ILE B 251 2.124 2.129 9.685 1.00 0.17 C ATOM 1430 CD1 ILE B 251 2.295 -0.717 10.290 1.00 0.19 C ATOM 0 H ILE B 251 2.283 0.790 6.355 1.00 0.20 H new ATOM 0 HA ILE B 251 3.906 2.853 7.772 1.00 0.19 H new ATOM 0 HB ILE B 251 4.096 1.268 9.713 1.00 0.16 H new ATOM 0 HG12 ILE B 251 1.866 -0.212 8.231 1.00 0.19 H new ATOM 0 HG13 ILE B 251 3.491 -0.813 8.490 1.00 0.19 H new ATOM 0 HG21 ILE B 251 1.853 1.731 10.663 1.00 0.17 H new ATOM 0 HG22 ILE B 251 2.490 3.150 9.797 1.00 0.17 H new ATOM 0 HG23 ILE B 251 1.247 2.127 9.037 1.00 0.17 H new ATOM 0 HD11 ILE B 251 1.933 -1.740 10.187 1.00 0.19 H new ATOM 0 HD12 ILE B 251 3.153 -0.702 10.962 1.00 0.19 H new ATOM 0 HD13 ILE B 251 1.502 -0.091 10.699 1.00 0.19 H new ATOM 1442 N GLN B 252 5.885 1.013 7.832 1.00 0.20 N ATOM 1443 CA GLN B 252 7.077 0.232 7.383 1.00 0.23 C ATOM 1444 C GLN B 252 7.752 -0.371 8.614 1.00 0.24 C ATOM 1445 O GLN B 252 8.338 0.328 9.414 1.00 0.27 O ATOM 1446 CB GLN B 252 8.074 1.147 6.661 1.00 0.28 C ATOM 1447 CG GLN B 252 9.128 0.295 5.948 1.00 0.31 C ATOM 1448 CD GLN B 252 10.098 1.209 5.199 1.00 0.98 C ATOM 1449 OE1 GLN B 252 9.916 1.434 3.925 1.00 1.69 O flip ATOM 1450 NE2 GLN B 252 11.032 1.726 5.779 1.00 1.81 N flip ATOM 0 H GLN B 252 6.016 1.539 8.696 1.00 0.20 H new ATOM 0 HA GLN B 252 6.759 -0.552 6.696 1.00 0.23 H new ATOM 0 HB2 GLN B 252 7.551 1.775 5.940 1.00 0.28 H new ATOM 0 HB3 GLN B 252 8.554 1.815 7.376 1.00 0.28 H new ATOM 0 HG2 GLN B 252 9.670 -0.314 6.672 1.00 0.31 H new ATOM 0 HG3 GLN B 252 8.646 -0.391 5.251 1.00 0.31 H new ATOM 0 HE21 GLN B 252 11.175 1.551 6.774 1.00 1.81 H new ATOM 0 HE22 GLN B 252 11.673 2.335 5.271 1.00 1.81 H new ATOM 1459 N ASP B 253 7.678 -1.664 8.774 1.00 0.26 N ATOM 1460 CA ASP B 253 8.326 -2.305 9.954 1.00 0.30 C ATOM 1461 C ASP B 253 9.754 -2.660 9.553 1.00 0.32 C ATOM 1462 O ASP B 253 10.685 -1.936 9.845 1.00 0.35 O ATOM 1463 CB ASP B 253 7.553 -3.569 10.345 1.00 0.36 C ATOM 1464 CG ASP B 253 8.056 -4.074 11.699 1.00 0.49 C ATOM 1465 OD1 ASP B 253 8.319 -3.247 12.556 1.00 1.18 O ATOM 1466 OD2 ASP B 253 8.168 -5.278 11.855 1.00 1.18 O ATOM 0 H ASP B 253 7.198 -2.303 8.140 1.00 0.26 H new ATOM 0 HA ASP B 253 8.329 -1.632 10.811 1.00 0.30 H new ATOM 0 HB2 ASP B 253 6.486 -3.354 10.398 1.00 0.36 H new ATOM 0 HB3 ASP B 253 7.685 -4.339 9.585 1.00 0.36 H new ATOM 1471 N ASN B 254 9.935 -3.737 8.845 1.00 0.33 N ATOM 1472 CA ASN B 254 11.302 -4.088 8.385 1.00 0.37 C ATOM 1473 C ASN B 254 11.577 -3.229 7.153 1.00 0.34 C ATOM 1474 O ASN B 254 11.313 -2.043 7.153 1.00 0.37 O ATOM 1475 CB ASN B 254 11.361 -5.573 8.009 1.00 0.42 C ATOM 1476 CG ASN B 254 10.691 -6.407 9.104 1.00 1.22 C ATOM 1477 OD1 ASN B 254 9.579 -6.866 8.940 1.00 1.97 O ATOM 1478 ND2 ASN B 254 11.328 -6.626 10.222 1.00 1.89 N ATOM 0 H ASN B 254 9.199 -4.386 8.567 1.00 0.33 H new ATOM 0 HA ASN B 254 12.041 -3.909 9.166 1.00 0.37 H new ATOM 0 HB2 ASN B 254 10.860 -5.737 7.055 1.00 0.42 H new ATOM 0 HB3 ASN B 254 12.398 -5.886 7.883 1.00 0.42 H new ATOM 0 HD21 ASN B 254 10.892 -7.182 10.957 1.00 1.89 H new ATOM 0 HD22 ASN B 254 12.262 -6.241 10.361 1.00 1.89 H new ATOM 1485 N SER B 255 12.061 -3.814 6.089 1.00 0.35 N ATOM 1486 CA SER B 255 12.306 -3.025 4.841 1.00 0.37 C ATOM 1487 C SER B 255 11.200 -3.361 3.839 1.00 0.38 C ATOM 1488 O SER B 255 11.456 -3.768 2.725 1.00 0.43 O ATOM 1489 CB SER B 255 13.663 -3.403 4.246 1.00 0.42 C ATOM 1490 OG SER B 255 14.697 -2.999 5.134 1.00 1.38 O ATOM 0 H SER B 255 12.298 -4.804 6.028 1.00 0.35 H new ATOM 0 HA SER B 255 12.305 -1.959 5.067 1.00 0.37 H new ATOM 0 HB2 SER B 255 13.712 -4.479 4.079 1.00 0.42 H new ATOM 0 HB3 SER B 255 13.794 -2.923 3.276 1.00 0.42 H new ATOM 0 HG SER B 255 15.567 -3.242 4.755 1.00 1.38 H new ATOM 1496 N ASP B 256 9.969 -3.202 4.243 1.00 0.35 N ATOM 1497 CA ASP B 256 8.830 -3.516 3.336 1.00 0.38 C ATOM 1498 C ASP B 256 7.603 -2.720 3.786 1.00 0.34 C ATOM 1499 O ASP B 256 7.191 -2.785 4.926 1.00 0.31 O ATOM 1500 CB ASP B 256 8.519 -5.015 3.399 1.00 0.42 C ATOM 1501 CG ASP B 256 9.587 -5.792 2.625 1.00 0.47 C ATOM 1502 OD1 ASP B 256 9.890 -5.394 1.512 1.00 1.12 O ATOM 1503 OD2 ASP B 256 10.082 -6.771 3.157 1.00 1.12 O ATOM 0 H ASP B 256 9.703 -2.866 5.168 1.00 0.35 H new ATOM 0 HA ASP B 256 9.090 -3.248 2.312 1.00 0.38 H new ATOM 0 HB2 ASP B 256 8.492 -5.348 4.436 1.00 0.42 H new ATOM 0 HB3 ASP B 256 7.534 -5.211 2.976 1.00 0.42 H new ATOM 1508 N ILE B 257 7.024 -1.959 2.899 1.00 0.36 N ATOM 1509 CA ILE B 257 5.827 -1.146 3.266 1.00 0.34 C ATOM 1510 C ILE B 257 4.555 -1.952 2.989 1.00 0.35 C ATOM 1511 O ILE B 257 4.430 -2.592 1.964 1.00 0.39 O ATOM 1512 CB ILE B 257 5.820 0.130 2.424 1.00 0.37 C ATOM 1513 CG1 ILE B 257 7.152 0.869 2.620 1.00 0.37 C ATOM 1514 CG2 ILE B 257 4.659 1.019 2.865 1.00 0.35 C ATOM 1515 CD1 ILE B 257 7.207 2.119 1.723 1.00 0.48 C ATOM 0 H ILE B 257 7.329 -1.864 1.930 1.00 0.36 H new ATOM 0 HA ILE B 257 5.863 -0.890 4.325 1.00 0.34 H new ATOM 0 HB ILE B 257 5.698 -0.119 1.370 1.00 0.37 H new ATOM 0 HG12 ILE B 257 7.265 1.158 3.665 1.00 0.37 H new ATOM 0 HG13 ILE B 257 7.983 0.205 2.381 1.00 0.37 H new ATOM 0 HG21 ILE B 257 4.651 1.930 2.267 1.00 0.35 H new ATOM 0 HG22 ILE B 257 3.719 0.485 2.726 1.00 0.35 H new ATOM 0 HG23 ILE B 257 4.778 1.277 3.917 1.00 0.35 H new ATOM 0 HD11 ILE B 257 8.157 2.633 1.873 1.00 0.48 H new ATOM 0 HD12 ILE B 257 7.116 1.821 0.678 1.00 0.48 H new ATOM 0 HD13 ILE B 257 6.387 2.789 1.982 1.00 0.48 H new ATOM 1527 N LYS B 258 3.611 -1.932 3.901 1.00 0.32 N ATOM 1528 CA LYS B 258 2.345 -2.710 3.698 1.00 0.34 C ATOM 1529 C LYS B 258 1.141 -1.876 4.147 1.00 0.30 C ATOM 1530 O LYS B 258 1.286 -0.812 4.718 1.00 0.28 O ATOM 1531 CB LYS B 258 2.409 -3.994 4.533 1.00 0.35 C ATOM 1532 CG LYS B 258 3.314 -5.014 3.840 1.00 0.43 C ATOM 1533 CD LYS B 258 3.566 -6.191 4.782 1.00 0.44 C ATOM 1534 CE LYS B 258 4.186 -7.350 3.999 1.00 1.42 C ATOM 1535 NZ LYS B 258 3.238 -7.799 2.941 1.00 2.13 N ATOM 0 H LYS B 258 3.662 -1.411 4.777 1.00 0.32 H new ATOM 0 HA LYS B 258 2.236 -2.955 2.641 1.00 0.34 H new ATOM 0 HB2 LYS B 258 2.791 -3.773 5.530 1.00 0.35 H new ATOM 0 HB3 LYS B 258 1.408 -4.408 4.659 1.00 0.35 H new ATOM 0 HG2 LYS B 258 2.848 -5.364 2.919 1.00 0.43 H new ATOM 0 HG3 LYS B 258 4.259 -4.548 3.561 1.00 0.43 H new ATOM 0 HD2 LYS B 258 4.232 -5.887 5.590 1.00 0.44 H new ATOM 0 HD3 LYS B 258 2.630 -6.509 5.242 1.00 0.44 H new ATOM 0 HE2 LYS B 258 5.128 -7.036 3.549 1.00 1.42 H new ATOM 0 HE3 LYS B 258 4.414 -8.176 4.672 1.00 1.42 H new ATOM 0 HZ1 LYS B 258 3.176 -8.837 2.948 1.00 2.13 H new ATOM 0 HZ2 LYS B 258 2.297 -7.395 3.124 1.00 2.13 H new ATOM 0 HZ3 LYS B 258 3.578 -7.479 2.012 1.00 2.13 H new ATOM 1549 N VAL B 259 -0.052 -2.360 3.894 1.00 0.31 N ATOM 1550 CA VAL B 259 -1.284 -1.615 4.305 1.00 0.29 C ATOM 1551 C VAL B 259 -1.871 -2.245 5.570 1.00 0.28 C ATOM 1552 O VAL B 259 -1.961 -3.452 5.690 1.00 0.31 O ATOM 1553 CB VAL B 259 -2.331 -1.682 3.186 1.00 0.30 C ATOM 1554 CG1 VAL B 259 -3.400 -0.613 3.422 1.00 0.29 C ATOM 1555 CG2 VAL B 259 -1.660 -1.436 1.835 1.00 0.34 C ATOM 0 H VAL B 259 -0.226 -3.245 3.417 1.00 0.31 H new ATOM 0 HA VAL B 259 -1.019 -0.576 4.498 1.00 0.29 H new ATOM 0 HB VAL B 259 -2.793 -2.669 3.186 1.00 0.30 H new ATOM 0 HG11 VAL B 259 -4.144 -0.661 2.627 1.00 0.29 H new ATOM 0 HG12 VAL B 259 -3.884 -0.788 4.383 1.00 0.29 H new ATOM 0 HG13 VAL B 259 -2.935 0.373 3.425 1.00 0.29 H new ATOM 0 HG21 VAL B 259 -2.408 -1.485 1.043 1.00 0.34 H new ATOM 0 HG22 VAL B 259 -1.194 -0.451 1.834 1.00 0.34 H new ATOM 0 HG23 VAL B 259 -0.899 -2.197 1.663 1.00 0.34 H new ATOM 1565 N VAL B 260 -2.285 -1.431 6.510 1.00 0.26 N ATOM 1566 CA VAL B 260 -2.886 -1.954 7.773 1.00 0.27 C ATOM 1567 C VAL B 260 -4.182 -1.162 8.062 1.00 0.25 C ATOM 1568 O VAL B 260 -4.123 0.049 8.145 1.00 0.22 O ATOM 1569 CB VAL B 260 -1.901 -1.727 8.921 1.00 0.28 C ATOM 1570 CG1 VAL B 260 -2.450 -2.356 10.200 1.00 0.34 C ATOM 1571 CG2 VAL B 260 -0.561 -2.375 8.572 1.00 0.29 C ATOM 0 H VAL B 260 -2.231 -0.414 6.453 1.00 0.26 H new ATOM 0 HA VAL B 260 -3.105 -3.017 7.677 1.00 0.27 H new ATOM 0 HB VAL B 260 -1.763 -0.657 9.075 1.00 0.28 H new ATOM 0 HG11 VAL B 260 -1.747 -2.193 11.017 1.00 0.34 H new ATOM 0 HG12 VAL B 260 -3.407 -1.898 10.449 1.00 0.34 H new ATOM 0 HG13 VAL B 260 -2.588 -3.427 10.049 1.00 0.34 H new ATOM 0 HG21 VAL B 260 0.144 -2.215 9.388 1.00 0.29 H new ATOM 0 HG22 VAL B 260 -0.703 -3.445 8.419 1.00 0.29 H new ATOM 0 HG23 VAL B 260 -0.167 -1.927 7.660 1.00 0.29 H new ATOM 1581 N PRO B 261 -5.326 -1.822 8.201 1.00 0.29 N ATOM 1582 CA PRO B 261 -6.578 -1.092 8.473 1.00 0.29 C ATOM 1583 C PRO B 261 -6.419 -0.238 9.738 1.00 0.24 C ATOM 1584 O PRO B 261 -5.843 -0.666 10.718 1.00 0.23 O ATOM 1585 CB PRO B 261 -7.655 -2.186 8.661 1.00 0.37 C ATOM 1586 CG PRO B 261 -6.989 -3.552 8.333 1.00 0.42 C ATOM 1587 CD PRO B 261 -5.482 -3.294 8.103 1.00 0.36 C ATOM 0 HA PRO B 261 -6.849 -0.409 7.668 1.00 0.29 H new ATOM 0 HB2 PRO B 261 -8.035 -2.179 9.683 1.00 0.37 H new ATOM 0 HB3 PRO B 261 -8.505 -2.005 8.003 1.00 0.37 H new ATOM 0 HG2 PRO B 261 -7.136 -4.256 9.152 1.00 0.42 H new ATOM 0 HG3 PRO B 261 -7.441 -3.995 7.446 1.00 0.42 H new ATOM 0 HD2 PRO B 261 -4.875 -3.806 8.850 1.00 0.36 H new ATOM 0 HD3 PRO B 261 -5.163 -3.661 7.127 1.00 0.36 H new ATOM 1595 N ARG B 262 -6.933 0.959 9.725 1.00 0.26 N ATOM 1596 CA ARG B 262 -6.814 1.833 10.924 1.00 0.27 C ATOM 1597 C ARG B 262 -7.415 1.119 12.140 1.00 0.29 C ATOM 1598 O ARG B 262 -6.966 1.288 13.256 1.00 0.34 O ATOM 1599 CB ARG B 262 -7.566 3.144 10.671 1.00 0.34 C ATOM 1600 CG ARG B 262 -7.614 3.974 11.967 1.00 0.59 C ATOM 1601 CD ARG B 262 -8.088 5.421 11.681 1.00 1.04 C ATOM 1602 NE ARG B 262 -7.189 6.401 12.375 1.00 1.76 N ATOM 1603 CZ ARG B 262 -6.858 6.253 13.632 1.00 2.19 C ATOM 1604 NH1 ARG B 262 -7.361 5.277 14.337 1.00 2.31 N ATOM 1605 NH2 ARG B 262 -6.038 7.100 14.192 1.00 3.11 N ATOM 0 H ARG B 262 -7.431 1.370 8.935 1.00 0.26 H new ATOM 0 HA ARG B 262 -5.763 2.048 11.118 1.00 0.27 H new ATOM 0 HB2 ARG B 262 -7.072 3.712 9.883 1.00 0.34 H new ATOM 0 HB3 ARG B 262 -8.578 2.933 10.325 1.00 0.34 H new ATOM 0 HG2 ARG B 262 -8.288 3.501 12.681 1.00 0.59 H new ATOM 0 HG3 ARG B 262 -6.626 3.995 12.427 1.00 0.59 H new ATOM 0 HD2 ARG B 262 -8.084 5.608 10.607 1.00 1.04 H new ATOM 0 HD3 ARG B 262 -9.115 5.551 12.023 1.00 1.04 H new ATOM 0 HE ARG B 262 -6.828 7.201 11.855 1.00 1.76 H new ATOM 0 HH11 ARG B 262 -8.017 4.624 13.909 1.00 2.31 H new ATOM 0 HH12 ARG B 262 -7.099 5.167 15.317 1.00 2.31 H new ATOM 0 HH21 ARG B 262 -5.657 7.875 13.650 1.00 3.11 H new ATOM 0 HH22 ARG B 262 -5.778 6.987 15.172 1.00 3.11 H new ATOM 1619 N ARG B 263 -8.433 0.329 11.932 1.00 0.33 N ATOM 1620 CA ARG B 263 -9.071 -0.388 13.074 1.00 0.39 C ATOM 1621 C ARG B 263 -8.113 -1.446 13.629 1.00 0.39 C ATOM 1622 O ARG B 263 -8.389 -2.073 14.633 1.00 0.48 O ATOM 1623 CB ARG B 263 -10.359 -1.064 12.592 1.00 0.47 C ATOM 1624 CG ARG B 263 -11.219 -0.039 11.851 1.00 1.31 C ATOM 1625 CD ARG B 263 -12.601 -0.630 11.559 1.00 1.59 C ATOM 1626 NE ARG B 263 -13.489 0.442 11.028 1.00 2.29 N ATOM 1627 CZ ARG B 263 -14.606 0.132 10.428 1.00 2.90 C ATOM 1628 NH1 ARG B 263 -14.960 -1.117 10.306 1.00 3.06 N ATOM 1629 NH2 ARG B 263 -15.370 1.076 9.951 1.00 3.82 N ATOM 0 H ARG B 263 -8.851 0.149 11.019 1.00 0.33 H new ATOM 0 HA ARG B 263 -9.305 0.328 13.862 1.00 0.39 H new ATOM 0 HB2 ARG B 263 -10.121 -1.900 11.934 1.00 0.47 H new ATOM 0 HB3 ARG B 263 -10.909 -1.472 13.440 1.00 0.47 H new ATOM 0 HG2 ARG B 263 -11.320 0.865 12.451 1.00 1.31 H new ATOM 0 HG3 ARG B 263 -10.733 0.250 10.919 1.00 1.31 H new ATOM 0 HD2 ARG B 263 -12.518 -1.441 10.836 1.00 1.59 H new ATOM 0 HD3 ARG B 263 -13.027 -1.055 12.467 1.00 1.59 H new ATOM 0 HE ARG B 263 -13.223 1.421 11.134 1.00 2.29 H new ATOM 0 HH11 ARG B 263 -14.363 -1.855 10.680 1.00 3.06 H new ATOM 0 HH12 ARG B 263 -15.833 -1.356 9.837 1.00 3.06 H new ATOM 0 HH21 ARG B 263 -15.094 2.053 10.047 1.00 3.82 H new ATOM 0 HH22 ARG B 263 -16.243 0.837 9.482 1.00 3.82 H new ATOM 1643 N LYS B 264 -6.990 -1.648 12.983 1.00 0.35 N ATOM 1644 CA LYS B 264 -5.997 -2.667 13.461 1.00 0.42 C ATOM 1645 C LYS B 264 -4.660 -1.982 13.743 1.00 0.35 C ATOM 1646 O LYS B 264 -3.626 -2.622 13.832 1.00 0.38 O ATOM 1647 CB LYS B 264 -5.797 -3.727 12.376 1.00 0.53 C ATOM 1648 CG LYS B 264 -7.135 -4.415 12.073 1.00 0.85 C ATOM 1649 CD LYS B 264 -6.891 -5.742 11.329 1.00 0.95 C ATOM 1650 CE LYS B 264 -6.619 -6.872 12.329 1.00 1.28 C ATOM 1651 NZ LYS B 264 -6.548 -8.168 11.599 1.00 2.08 N ATOM 0 H LYS B 264 -6.715 -1.147 12.138 1.00 0.35 H new ATOM 0 HA LYS B 264 -6.369 -3.136 14.372 1.00 0.42 H new ATOM 0 HB2 LYS B 264 -5.401 -3.265 11.471 1.00 0.53 H new ATOM 0 HB3 LYS B 264 -5.064 -4.464 12.705 1.00 0.53 H new ATOM 0 HG2 LYS B 264 -7.674 -4.603 13.001 1.00 0.85 H new ATOM 0 HG3 LYS B 264 -7.761 -3.759 11.468 1.00 0.85 H new ATOM 0 HD2 LYS B 264 -7.759 -5.989 10.718 1.00 0.95 H new ATOM 0 HD3 LYS B 264 -6.044 -5.636 10.651 1.00 0.95 H new ATOM 0 HE2 LYS B 264 -5.684 -6.688 12.858 1.00 1.28 H new ATOM 0 HE3 LYS B 264 -7.409 -6.907 13.080 1.00 1.28 H new ATOM 0 HZ1 LYS B 264 -6.364 -8.937 12.274 1.00 2.08 H new ATOM 0 HZ2 LYS B 264 -7.451 -8.343 11.113 1.00 2.08 H new ATOM 0 HZ3 LYS B 264 -5.780 -8.130 10.899 1.00 2.08 H new ATOM 1665 N ALA B 265 -4.674 -0.682 13.887 1.00 0.30 N ATOM 1666 CA ALA B 265 -3.413 0.070 14.158 1.00 0.27 C ATOM 1667 C ALA B 265 -3.686 1.150 15.205 1.00 0.28 C ATOM 1668 O ALA B 265 -4.821 1.442 15.525 1.00 0.32 O ATOM 1669 CB ALA B 265 -2.938 0.734 12.862 1.00 0.26 C ATOM 0 H ALA B 265 -5.513 -0.105 13.828 1.00 0.30 H new ATOM 0 HA ALA B 265 -2.647 -0.613 14.526 1.00 0.27 H new ATOM 0 HB1 ALA B 265 -2.017 1.285 13.052 1.00 0.26 H new ATOM 0 HB2 ALA B 265 -2.754 -0.031 12.108 1.00 0.26 H new ATOM 0 HB3 ALA B 265 -3.705 1.421 12.503 1.00 0.26 H new ATOM 1675 N LYS B 266 -2.655 1.753 15.736 1.00 0.26 N ATOM 1676 CA LYS B 266 -2.847 2.822 16.765 1.00 0.29 C ATOM 1677 C LYS B 266 -1.820 3.932 16.536 1.00 0.27 C ATOM 1678 O LYS B 266 -0.643 3.677 16.365 1.00 0.25 O ATOM 1679 CB LYS B 266 -2.664 2.227 18.164 1.00 0.34 C ATOM 1680 CG LYS B 266 -3.633 1.052 18.354 1.00 0.42 C ATOM 1681 CD LYS B 266 -3.773 0.716 19.846 1.00 0.50 C ATOM 1682 CE LYS B 266 -2.391 0.645 20.507 1.00 1.09 C ATOM 1683 NZ LYS B 266 -2.514 0.007 21.849 1.00 1.79 N ATOM 0 H LYS B 266 -1.683 1.551 15.501 1.00 0.26 H new ATOM 0 HA LYS B 266 -3.852 3.235 16.682 1.00 0.29 H new ATOM 0 HB2 LYS B 266 -1.636 1.889 18.295 1.00 0.34 H new ATOM 0 HB3 LYS B 266 -2.848 2.989 18.921 1.00 0.34 H new ATOM 0 HG2 LYS B 266 -4.608 1.304 17.938 1.00 0.42 H new ATOM 0 HG3 LYS B 266 -3.270 0.180 17.810 1.00 0.42 H new ATOM 0 HD2 LYS B 266 -4.382 1.473 20.341 1.00 0.50 H new ATOM 0 HD3 LYS B 266 -4.290 -0.236 19.964 1.00 0.50 H new ATOM 0 HE2 LYS B 266 -1.706 0.072 19.882 1.00 1.09 H new ATOM 0 HE3 LYS B 266 -1.971 1.646 20.606 1.00 1.09 H new ATOM 0 HZ1 LYS B 266 -1.577 -0.041 22.298 1.00 1.79 H new ATOM 0 HZ2 LYS B 266 -3.154 0.571 22.444 1.00 1.79 H new ATOM 0 HZ3 LYS B 266 -2.897 -0.954 21.743 1.00 1.79 H new ATOM 1697 N ILE B 267 -2.258 5.164 16.521 1.00 0.30 N ATOM 1698 CA ILE B 267 -1.312 6.300 16.296 1.00 0.32 C ATOM 1699 C ILE B 267 -0.732 6.750 17.641 1.00 0.37 C ATOM 1700 O ILE B 267 -1.424 7.317 18.463 1.00 0.41 O ATOM 1701 CB ILE B 267 -2.057 7.487 15.641 1.00 0.36 C ATOM 1702 CG1 ILE B 267 -3.050 6.995 14.564 1.00 0.36 C ATOM 1703 CG2 ILE B 267 -1.049 8.450 15.004 1.00 0.39 C ATOM 1704 CD1 ILE B 267 -2.306 6.463 13.332 1.00 0.45 C ATOM 0 H ILE B 267 -3.232 5.434 16.655 1.00 0.30 H new ATOM 0 HA ILE B 267 -0.509 5.971 15.636 1.00 0.32 H new ATOM 0 HB ILE B 267 -2.618 8.004 16.420 1.00 0.36 H new ATOM 0 HG12 ILE B 267 -3.682 6.210 14.979 1.00 0.36 H new ATOM 0 HG13 ILE B 267 -3.708 7.813 14.271 1.00 0.36 H new ATOM 0 HG21 ILE B 267 -1.582 9.283 14.545 1.00 0.39 H new ATOM 0 HG22 ILE B 267 -0.374 8.829 15.771 1.00 0.39 H new ATOM 0 HG23 ILE B 267 -0.474 7.923 14.242 1.00 0.39 H new ATOM 0 HD11 ILE B 267 -3.028 6.123 12.590 1.00 0.45 H new ATOM 0 HD12 ILE B 267 -1.694 7.258 12.906 1.00 0.45 H new ATOM 0 HD13 ILE B 267 -1.667 5.630 13.625 1.00 0.45 H new ATOM 1716 N ILE B 268 0.539 6.508 17.868 1.00 0.38 N ATOM 1717 CA ILE B 268 1.176 6.931 19.158 1.00 0.45 C ATOM 1718 C ILE B 268 2.000 8.195 18.919 1.00 0.48 C ATOM 1719 O ILE B 268 2.420 8.478 17.815 1.00 0.47 O ATOM 1720 CB ILE B 268 2.109 5.828 19.668 1.00 0.48 C ATOM 1721 CG1 ILE B 268 1.377 4.473 19.647 1.00 0.50 C ATOM 1722 CG2 ILE B 268 2.600 6.158 21.097 1.00 0.55 C ATOM 1723 CD1 ILE B 268 0.077 4.544 20.454 1.00 0.57 C ATOM 0 H ILE B 268 1.163 6.035 17.215 1.00 0.38 H new ATOM 0 HA ILE B 268 0.396 7.119 19.895 1.00 0.45 H new ATOM 0 HB ILE B 268 2.978 5.767 19.013 1.00 0.48 H new ATOM 0 HG12 ILE B 268 1.156 4.190 18.618 1.00 0.50 H new ATOM 0 HG13 ILE B 268 2.024 3.699 20.059 1.00 0.50 H new ATOM 0 HG21 ILE B 268 3.262 5.366 21.446 1.00 0.55 H new ATOM 0 HG22 ILE B 268 3.141 7.104 21.086 1.00 0.55 H new ATOM 0 HG23 ILE B 268 1.744 6.237 21.767 1.00 0.55 H new ATOM 0 HD11 ILE B 268 -0.423 3.576 20.425 1.00 0.57 H new ATOM 0 HD12 ILE B 268 0.304 4.804 21.488 1.00 0.57 H new ATOM 0 HD13 ILE B 268 -0.577 5.303 20.024 1.00 0.57 H new ATOM 1735 N ARG B 269 2.230 8.958 19.953 1.00 0.56 N ATOM 1736 CA ARG B 269 3.022 10.218 19.810 1.00 0.62 C ATOM 1737 C ARG B 269 4.494 9.944 20.139 1.00 0.66 C ATOM 1738 O ARG B 269 4.810 9.259 21.092 1.00 0.73 O ATOM 1739 CB ARG B 269 2.463 11.281 20.771 1.00 0.73 C ATOM 1740 CG ARG B 269 0.943 11.117 20.907 1.00 1.49 C ATOM 1741 CD ARG B 269 0.282 11.212 19.531 1.00 1.80 C ATOM 1742 NE ARG B 269 -1.200 11.205 19.686 1.00 2.22 N ATOM 1743 CZ ARG B 269 -1.961 11.582 18.695 1.00 2.82 C ATOM 1744 NH1 ARG B 269 -1.423 11.958 17.567 1.00 3.12 N ATOM 1745 NH2 ARG B 269 -3.259 11.581 18.829 1.00 3.62 N ATOM 0 H ARG B 269 1.902 8.763 20.899 1.00 0.56 H new ATOM 0 HA ARG B 269 2.948 10.580 18.785 1.00 0.62 H new ATOM 0 HB2 ARG B 269 2.936 11.185 21.748 1.00 0.73 H new ATOM 0 HB3 ARG B 269 2.698 12.279 20.400 1.00 0.73 H new ATOM 0 HG2 ARG B 269 0.712 10.155 21.365 1.00 1.49 H new ATOM 0 HG3 ARG B 269 0.543 11.888 21.566 1.00 1.49 H new ATOM 0 HD2 ARG B 269 0.600 12.124 19.026 1.00 1.80 H new ATOM 0 HD3 ARG B 269 0.596 10.375 18.907 1.00 1.80 H new ATOM 0 HE ARG B 269 -1.620 10.906 20.566 1.00 2.22 H new ATOM 0 HH11 ARG B 269 -0.409 11.957 17.460 1.00 3.12 H new ATOM 0 HH12 ARG B 269 -2.017 12.253 16.792 1.00 3.12 H new ATOM 0 HH21 ARG B 269 -3.681 11.285 19.709 1.00 3.62 H new ATOM 0 HH22 ARG B 269 -3.852 11.876 18.053 1.00 3.62 H new ATOM 1759 N ASP B 270 5.397 10.483 19.365 1.00 0.67 N ATOM 1760 CA ASP B 270 6.848 10.262 19.642 1.00 0.74 C ATOM 1761 C ASP B 270 7.656 11.425 19.065 1.00 1.18 C ATOM 1762 O ASP B 270 7.099 12.504 18.941 1.00 1.73 O ATOM 1763 CB ASP B 270 7.298 8.952 18.995 1.00 0.90 C ATOM 1764 CG ASP B 270 6.723 7.777 19.786 1.00 1.47 C ATOM 1765 OD1 ASP B 270 5.587 7.412 19.529 1.00 2.04 O ATOM 1766 OD2 ASP B 270 7.427 7.264 20.641 1.00 2.05 O ATOM 1767 OXT ASP B 270 8.818 11.219 18.757 1.00 1.84 O ATOM 0 H ASP B 270 5.194 11.066 18.553 1.00 0.67 H new ATOM 0 HA ASP B 270 7.010 10.206 20.718 1.00 0.74 H new ATOM 0 HB2 ASP B 270 6.960 8.909 17.960 1.00 0.90 H new ATOM 0 HB3 ASP B 270 8.386 8.896 18.978 1.00 0.90 H new TER 1772 ASP B 270