USER MOD reduce.3.24.130724 H: found=0, std=0, add=902, rem=0, adj=20 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 163:sc= -0.0452 (180deg=-0.749) USER MOD Single : A 221 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 222 ASN : amide:sc= -0.0364 K(o=-0.036,f=-1.5!) USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD Single : A 227 TYR OH : rot 15:sc= -1.17 USER MOD Single : A 230 SER OG : rot 180:sc= 0 USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 240 LYS NZ :NH3+ 162:sc= -2.77! (180deg=-3.3!) USER MOD Single : A 244 LYS NZ :NH3+ 171:sc= -1.64 (180deg=-1.67) USER MOD Single : A 252 GLN :FLIP amide:sc= 0 F(o=-3!,f=0) USER MOD Single : A 254 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 255 SER OG : rot 180:sc= 0 USER MOD Single : A 258 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.219) USER MOD Single : A 264 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.075) USER MOD Single : A 266 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 219 MET CE :methyl 162:sc= -0.0505 (180deg=-0.752) USER MOD Single : B 221 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 222 ASN : amide:sc= -0.022 K(o=-0.022,f=-1.6!) USER MOD Single : B 226 TYR OH : rot 180:sc= 0 USER MOD Single : B 227 TYR OH : rot 15:sc= -1.19 USER MOD Single : B 230 SER OG : rot 180:sc= 0 USER MOD Single : B 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 240 LYS NZ :NH3+ 167:sc= -2.78! (180deg=-3.46!) USER MOD Single : B 244 LYS NZ :NH3+ 178:sc= -1.73 (180deg=-1.74) USER MOD Single : B 252 GLN :FLIP amide:sc= 0 F(o=-3!,f=0) USER MOD Single : B 254 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 255 SER OG : rot 180:sc= 0 USER MOD Single : B 258 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.225) USER MOD Single : B 264 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0724) USER MOD Single : B 266 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 219 3.367 17.083 -3.046 1.00 1.77 N ATOM 2 CA MET A 219 2.663 18.001 -3.986 1.00 1.15 C ATOM 3 C MET A 219 2.442 17.290 -5.323 1.00 1.04 C ATOM 4 O MET A 219 2.835 17.772 -6.367 1.00 1.10 O ATOM 5 CB MET A 219 3.511 19.255 -4.206 1.00 1.82 C ATOM 6 CG MET A 219 3.582 20.059 -2.905 1.00 2.31 C ATOM 7 SD MET A 219 4.934 21.259 -3.011 1.00 3.45 S ATOM 8 CE MET A 219 4.234 22.270 -4.337 1.00 3.82 C ATOM 0 HA MET A 219 1.699 18.286 -3.563 1.00 1.15 H new ATOM 0 HB2 MET A 219 4.514 18.976 -4.529 1.00 1.82 H new ATOM 0 HB3 MET A 219 3.079 19.865 -4.999 1.00 1.82 H new ATOM 0 HG2 MET A 219 2.637 20.574 -2.731 1.00 2.31 H new ATOM 0 HG3 MET A 219 3.741 19.390 -2.059 1.00 2.31 H new ATOM 0 HE1 MET A 219 4.743 23.233 -4.367 1.00 3.82 H new ATOM 0 HE2 MET A 219 4.365 21.760 -5.291 1.00 3.82 H new ATOM 0 HE3 MET A 219 3.171 22.427 -4.153 1.00 3.82 H new ATOM 18 N ILE A 220 1.812 16.146 -5.299 1.00 0.98 N ATOM 19 CA ILE A 220 1.557 15.398 -6.568 1.00 0.97 C ATOM 20 C ILE A 220 0.267 15.934 -7.215 1.00 0.94 C ATOM 21 O ILE A 220 -0.757 16.058 -6.574 1.00 1.01 O ATOM 22 CB ILE A 220 1.424 13.876 -6.272 1.00 1.03 C ATOM 23 CG1 ILE A 220 1.007 13.636 -4.812 1.00 1.35 C ATOM 24 CG2 ILE A 220 2.769 13.178 -6.507 1.00 1.78 C ATOM 25 CD1 ILE A 220 -0.360 14.272 -4.533 1.00 2.08 C ATOM 0 H ILE A 220 1.461 15.695 -4.454 1.00 0.98 H new ATOM 0 HA ILE A 220 2.392 15.542 -7.254 1.00 0.97 H new ATOM 0 HB ILE A 220 0.663 13.472 -6.940 1.00 1.03 H new ATOM 0 HG12 ILE A 220 0.965 12.566 -4.611 1.00 1.35 H new ATOM 0 HG13 ILE A 220 1.755 14.057 -4.140 1.00 1.35 H new ATOM 0 HG21 ILE A 220 2.668 12.113 -6.298 1.00 1.78 H new ATOM 0 HG22 ILE A 220 3.075 13.317 -7.544 1.00 1.78 H new ATOM 0 HG23 ILE A 220 3.522 13.608 -5.846 1.00 1.78 H new ATOM 0 HD11 ILE A 220 -0.640 14.092 -3.495 1.00 2.08 H new ATOM 0 HD12 ILE A 220 -0.306 15.346 -4.714 1.00 2.08 H new ATOM 0 HD13 ILE A 220 -1.108 13.831 -5.192 1.00 2.08 H new ATOM 37 N GLN A 221 0.313 16.260 -8.481 1.00 0.90 N ATOM 38 CA GLN A 221 -0.908 16.789 -9.162 1.00 0.92 C ATOM 39 C GLN A 221 -1.773 15.619 -9.637 1.00 0.83 C ATOM 40 O GLN A 221 -2.001 14.668 -8.916 1.00 0.85 O ATOM 41 CB GLN A 221 -0.501 17.637 -10.374 1.00 1.00 C ATOM 42 CG GLN A 221 0.390 18.797 -9.924 1.00 1.28 C ATOM 43 CD GLN A 221 0.849 19.585 -11.154 1.00 1.61 C ATOM 44 OE1 GLN A 221 1.756 19.172 -11.849 1.00 2.08 O ATOM 45 NE2 GLN A 221 0.254 20.707 -11.457 1.00 2.17 N ATOM 0 H GLN A 221 1.141 16.183 -9.072 1.00 0.90 H new ATOM 0 HA GLN A 221 -1.471 17.405 -8.460 1.00 0.92 H new ATOM 0 HB2 GLN A 221 0.030 17.020 -11.099 1.00 1.00 H new ATOM 0 HB3 GLN A 221 -1.390 18.023 -10.874 1.00 1.00 H new ATOM 0 HG2 GLN A 221 -0.157 19.449 -9.243 1.00 1.28 H new ATOM 0 HG3 GLN A 221 1.253 18.418 -9.377 1.00 1.28 H new ATOM 0 HE21 GLN A 221 -0.507 21.054 -10.874 1.00 2.17 H new ATOM 0 HE22 GLN A 221 0.551 21.236 -12.277 1.00 2.17 H new ATOM 54 N ASN A 222 -2.251 15.681 -10.852 1.00 0.78 N ATOM 55 CA ASN A 222 -3.099 14.577 -11.392 1.00 0.73 C ATOM 56 C ASN A 222 -2.213 13.608 -12.180 1.00 0.63 C ATOM 57 O ASN A 222 -1.660 13.953 -13.207 1.00 0.65 O ATOM 58 CB ASN A 222 -4.162 15.171 -12.319 1.00 0.80 C ATOM 59 CG ASN A 222 -5.020 16.169 -11.538 1.00 0.93 C ATOM 60 OD1 ASN A 222 -5.019 16.167 -10.322 1.00 1.48 O ATOM 61 ND2 ASN A 222 -5.755 17.030 -12.188 1.00 1.39 N ATOM 0 H ASN A 222 -2.089 16.454 -11.498 1.00 0.78 H new ATOM 0 HA ASN A 222 -3.586 14.044 -10.575 1.00 0.73 H new ATOM 0 HB2 ASN A 222 -3.686 15.668 -13.164 1.00 0.80 H new ATOM 0 HB3 ASN A 222 -4.788 14.378 -12.727 1.00 0.80 H new ATOM 0 HD21 ASN A 222 -6.328 17.701 -11.676 1.00 1.39 H new ATOM 0 HD22 ASN A 222 -5.756 17.032 -13.208 1.00 1.39 H new ATOM 68 N PHE A 223 -2.069 12.397 -11.701 1.00 0.55 N ATOM 69 CA PHE A 223 -1.214 11.390 -12.408 1.00 0.46 C ATOM 70 C PHE A 223 -1.951 10.047 -12.460 1.00 0.39 C ATOM 71 O PHE A 223 -2.509 9.598 -11.477 1.00 0.38 O ATOM 72 CB PHE A 223 0.106 11.214 -11.638 1.00 0.46 C ATOM 73 CG PHE A 223 1.054 12.344 -11.970 1.00 0.53 C ATOM 74 CD1 PHE A 223 1.837 12.284 -13.139 1.00 0.54 C ATOM 75 CD2 PHE A 223 1.158 13.452 -11.109 1.00 0.64 C ATOM 76 CE1 PHE A 223 2.724 13.335 -13.447 1.00 0.64 C ATOM 77 CE2 PHE A 223 2.044 14.503 -11.417 1.00 0.72 C ATOM 78 CZ PHE A 223 2.827 14.444 -12.585 1.00 0.71 C ATOM 0 H PHE A 223 -2.509 12.060 -10.845 1.00 0.55 H new ATOM 0 HA PHE A 223 -1.005 11.734 -13.421 1.00 0.46 H new ATOM 0 HB2 PHE A 223 -0.089 11.195 -10.566 1.00 0.46 H new ATOM 0 HB3 PHE A 223 0.562 10.258 -11.896 1.00 0.46 H new ATOM 0 HD1 PHE A 223 1.758 11.433 -13.799 1.00 0.54 H new ATOM 0 HD2 PHE A 223 0.558 13.497 -10.212 1.00 0.64 H new ATOM 0 HE1 PHE A 223 3.324 13.290 -14.344 1.00 0.64 H new ATOM 0 HE2 PHE A 223 2.122 15.354 -10.757 1.00 0.72 H new ATOM 0 HZ PHE A 223 3.507 15.249 -12.820 1.00 0.71 H new ATOM 88 N ARG A 224 -1.942 9.396 -13.596 1.00 0.36 N ATOM 89 CA ARG A 224 -2.622 8.068 -13.724 1.00 0.31 C ATOM 90 C ARG A 224 -1.542 6.985 -13.707 1.00 0.26 C ATOM 91 O ARG A 224 -0.392 7.250 -13.991 1.00 0.29 O ATOM 92 CB ARG A 224 -3.391 8.012 -15.057 1.00 0.35 C ATOM 93 CG ARG A 224 -4.770 8.660 -14.893 1.00 1.00 C ATOM 94 CD ARG A 224 -5.362 8.960 -16.274 1.00 1.24 C ATOM 95 NE ARG A 224 -6.706 9.584 -16.119 1.00 1.82 N ATOM 96 CZ ARG A 224 -7.264 10.194 -17.131 1.00 2.36 C ATOM 97 NH1 ARG A 224 -6.643 10.256 -18.277 1.00 2.57 N ATOM 98 NH2 ARG A 224 -8.441 10.741 -16.996 1.00 3.26 N ATOM 0 H ARG A 224 -1.490 9.729 -14.447 1.00 0.36 H new ATOM 0 HA ARG A 224 -3.325 7.916 -12.905 1.00 0.31 H new ATOM 0 HB2 ARG A 224 -2.827 8.529 -15.834 1.00 0.35 H new ATOM 0 HB3 ARG A 224 -3.502 6.977 -15.379 1.00 0.35 H new ATOM 0 HG2 ARG A 224 -5.432 7.995 -14.338 1.00 1.00 H new ATOM 0 HG3 ARG A 224 -4.685 9.580 -14.315 1.00 1.00 H new ATOM 0 HD2 ARG A 224 -4.701 9.629 -16.826 1.00 1.24 H new ATOM 0 HD3 ARG A 224 -5.442 8.040 -16.854 1.00 1.24 H new ATOM 0 HE ARG A 224 -7.191 9.535 -15.223 1.00 1.82 H new ATOM 0 HH11 ARG A 224 -5.723 9.829 -18.382 1.00 2.57 H new ATOM 0 HH12 ARG A 224 -7.078 10.732 -19.068 1.00 2.57 H new ATOM 0 HH21 ARG A 224 -8.926 10.693 -16.100 1.00 3.26 H new ATOM 0 HH22 ARG A 224 -8.876 11.217 -17.786 1.00 3.26 H new ATOM 112 N VAL A 225 -1.891 5.768 -13.369 1.00 0.23 N ATOM 113 CA VAL A 225 -0.863 4.681 -13.328 1.00 0.20 C ATOM 114 C VAL A 225 -1.452 3.362 -13.833 1.00 0.20 C ATOM 115 O VAL A 225 -2.563 2.996 -13.504 1.00 0.22 O ATOM 116 CB VAL A 225 -0.387 4.497 -11.885 1.00 0.20 C ATOM 117 CG1 VAL A 225 0.598 3.326 -11.819 1.00 0.20 C ATOM 118 CG2 VAL A 225 0.305 5.780 -11.414 1.00 0.23 C ATOM 0 H VAL A 225 -2.838 5.481 -13.121 1.00 0.23 H new ATOM 0 HA VAL A 225 -0.028 4.962 -13.970 1.00 0.20 H new ATOM 0 HB VAL A 225 -1.240 4.287 -11.240 1.00 0.20 H new ATOM 0 HG11 VAL A 225 0.938 3.194 -10.792 1.00 0.20 H new ATOM 0 HG12 VAL A 225 0.104 2.415 -12.158 1.00 0.20 H new ATOM 0 HG13 VAL A 225 1.454 3.534 -12.460 1.00 0.20 H new ATOM 0 HG21 VAL A 225 0.646 5.653 -10.386 1.00 0.23 H new ATOM 0 HG22 VAL A 225 1.160 5.989 -12.057 1.00 0.23 H new ATOM 0 HG23 VAL A 225 -0.398 6.612 -11.463 1.00 0.23 H new ATOM 128 N TYR A 226 -0.690 2.635 -14.612 1.00 0.22 N ATOM 129 CA TYR A 226 -1.156 1.314 -15.135 1.00 0.25 C ATOM 130 C TYR A 226 -0.322 0.226 -14.460 1.00 0.26 C ATOM 131 O TYR A 226 0.806 0.456 -14.078 1.00 0.26 O ATOM 132 CB TYR A 226 -0.935 1.240 -16.650 1.00 0.32 C ATOM 133 CG TYR A 226 -1.876 2.186 -17.365 1.00 0.35 C ATOM 134 CD1 TYR A 226 -1.696 3.577 -17.250 1.00 0.43 C ATOM 135 CD2 TYR A 226 -2.920 1.675 -18.162 1.00 0.42 C ATOM 136 CE1 TYR A 226 -2.559 4.458 -17.933 1.00 0.50 C ATOM 137 CE2 TYR A 226 -3.784 2.556 -18.841 1.00 0.47 C ATOM 138 CZ TYR A 226 -3.603 3.947 -18.727 1.00 0.49 C ATOM 139 OH TYR A 226 -4.448 4.810 -19.395 1.00 0.58 O ATOM 0 H TYR A 226 0.247 2.905 -14.911 1.00 0.22 H new ATOM 0 HA TYR A 226 -2.218 1.183 -14.926 1.00 0.25 H new ATOM 0 HB2 TYR A 226 0.098 1.496 -16.887 1.00 0.32 H new ATOM 0 HB3 TYR A 226 -1.099 0.220 -16.999 1.00 0.32 H new ATOM 0 HD1 TYR A 226 -0.897 3.969 -16.639 1.00 0.43 H new ATOM 0 HD2 TYR A 226 -3.058 0.608 -18.252 1.00 0.42 H new ATOM 0 HE1 TYR A 226 -2.419 5.525 -17.847 1.00 0.50 H new ATOM 0 HE2 TYR A 226 -4.586 2.164 -19.449 1.00 0.47 H new ATOM 0 HH TYR A 226 -5.112 4.294 -19.898 1.00 0.58 H new ATOM 149 N TYR A 227 -0.851 -0.955 -14.299 1.00 0.28 N ATOM 150 CA TYR A 227 -0.054 -2.025 -13.632 1.00 0.32 C ATOM 151 C TYR A 227 -0.594 -3.404 -14.009 1.00 0.37 C ATOM 152 O TYR A 227 -1.751 -3.565 -14.350 1.00 0.39 O ATOM 153 CB TYR A 227 -0.136 -1.846 -12.114 1.00 0.31 C ATOM 154 CG TYR A 227 -1.583 -1.859 -11.672 1.00 0.31 C ATOM 155 CD1 TYR A 227 -2.416 -0.758 -11.955 1.00 0.28 C ATOM 156 CD2 TYR A 227 -2.101 -2.970 -10.977 1.00 0.38 C ATOM 157 CE1 TYR A 227 -3.761 -0.768 -11.543 1.00 0.31 C ATOM 158 CE2 TYR A 227 -3.446 -2.977 -10.564 1.00 0.41 C ATOM 159 CZ TYR A 227 -4.275 -1.877 -10.848 1.00 0.38 C ATOM 160 OH TYR A 227 -5.595 -1.886 -10.444 1.00 0.44 O ATOM 0 H TYR A 227 -1.789 -1.225 -14.596 1.00 0.28 H new ATOM 0 HA TYR A 227 0.983 -1.950 -13.960 1.00 0.32 H new ATOM 0 HB2 TYR A 227 0.413 -2.644 -11.615 1.00 0.31 H new ATOM 0 HB3 TYR A 227 0.334 -0.906 -11.824 1.00 0.31 H new ATOM 0 HD1 TYR A 227 -2.021 0.094 -12.489 1.00 0.28 H new ATOM 0 HD2 TYR A 227 -1.466 -3.816 -10.761 1.00 0.38 H new ATOM 0 HE1 TYR A 227 -4.399 0.076 -11.760 1.00 0.31 H new ATOM 0 HE2 TYR A 227 -3.842 -3.827 -10.029 1.00 0.41 H new ATOM 0 HH TYR A 227 -6.086 -1.179 -10.913 1.00 0.44 H new ATOM 170 N ARG A 228 0.247 -4.405 -13.947 1.00 0.43 N ATOM 171 CA ARG A 228 -0.195 -5.788 -14.297 1.00 0.49 C ATOM 172 C ARG A 228 -0.602 -6.535 -13.026 1.00 0.54 C ATOM 173 O ARG A 228 -0.108 -6.268 -11.948 1.00 0.60 O ATOM 174 CB ARG A 228 0.963 -6.531 -14.976 1.00 0.55 C ATOM 175 CG ARG A 228 1.689 -5.575 -15.921 1.00 0.67 C ATOM 176 CD ARG A 228 2.725 -6.349 -16.740 1.00 0.73 C ATOM 177 NE ARG A 228 3.810 -6.832 -15.839 1.00 1.49 N ATOM 178 CZ ARG A 228 4.645 -7.745 -16.254 1.00 1.74 C ATOM 179 NH1 ARG A 228 4.536 -8.230 -17.462 1.00 1.49 N ATOM 180 NH2 ARG A 228 5.593 -8.172 -15.464 1.00 2.76 N ATOM 0 H ARG A 228 1.225 -4.323 -13.668 1.00 0.43 H new ATOM 0 HA ARG A 228 -1.048 -5.737 -14.974 1.00 0.49 H new ATOM 0 HB2 ARG A 228 1.654 -6.914 -14.226 1.00 0.55 H new ATOM 0 HB3 ARG A 228 0.585 -7.390 -15.529 1.00 0.55 H new ATOM 0 HG2 ARG A 228 0.973 -5.091 -16.586 1.00 0.67 H new ATOM 0 HG3 ARG A 228 2.178 -4.785 -15.350 1.00 0.67 H new ATOM 0 HD2 ARG A 228 2.251 -7.193 -17.241 1.00 0.73 H new ATOM 0 HD3 ARG A 228 3.141 -5.709 -17.518 1.00 0.73 H new ATOM 0 HE ARG A 228 3.900 -6.449 -14.898 1.00 1.49 H new ATOM 0 HH11 ARG A 228 3.798 -7.895 -18.081 1.00 1.49 H new ATOM 0 HH12 ARG A 228 5.189 -8.944 -17.786 1.00 1.49 H new ATOM 0 HH21 ARG A 228 5.681 -7.792 -14.522 1.00 2.76 H new ATOM 0 HH22 ARG A 228 6.245 -8.886 -15.789 1.00 2.76 H new ATOM 194 N ASP A 229 -1.494 -7.481 -13.149 1.00 0.58 N ATOM 195 CA ASP A 229 -1.935 -8.263 -11.956 1.00 0.66 C ATOM 196 C ASP A 229 -1.072 -9.521 -11.844 1.00 0.74 C ATOM 197 O ASP A 229 -0.397 -9.905 -12.779 1.00 0.76 O ATOM 198 CB ASP A 229 -3.405 -8.671 -12.120 1.00 0.72 C ATOM 199 CG ASP A 229 -4.236 -7.461 -12.562 1.00 1.41 C ATOM 200 OD1 ASP A 229 -3.744 -6.684 -13.362 1.00 2.23 O ATOM 201 OD2 ASP A 229 -5.354 -7.336 -12.092 1.00 2.07 O ATOM 0 H ASP A 229 -1.938 -7.747 -14.028 1.00 0.58 H new ATOM 0 HA ASP A 229 -1.829 -7.654 -11.058 1.00 0.66 H new ATOM 0 HB2 ASP A 229 -3.490 -9.470 -12.857 1.00 0.72 H new ATOM 0 HB3 ASP A 229 -3.790 -9.063 -11.179 1.00 0.72 H new ATOM 206 N SER A 230 -1.091 -10.172 -10.715 1.00 0.84 N ATOM 207 CA SER A 230 -0.273 -11.407 -10.557 1.00 0.97 C ATOM 208 C SER A 230 -0.993 -12.580 -11.224 1.00 1.04 C ATOM 209 O SER A 230 -0.493 -13.686 -11.266 1.00 1.17 O ATOM 210 CB SER A 230 -0.079 -11.707 -9.070 1.00 1.07 C ATOM 211 OG SER A 230 0.756 -10.710 -8.496 1.00 1.80 O ATOM 0 H SER A 230 -1.636 -9.903 -9.896 1.00 0.84 H new ATOM 0 HA SER A 230 0.700 -11.261 -11.026 1.00 0.97 H new ATOM 0 HB2 SER A 230 -1.043 -11.727 -8.562 1.00 1.07 H new ATOM 0 HB3 SER A 230 0.370 -12.692 -8.941 1.00 1.07 H new ATOM 0 HG SER A 230 0.881 -10.898 -7.542 1.00 1.80 H new ATOM 217 N ARG A 231 -2.170 -12.346 -11.745 1.00 1.00 N ATOM 218 CA ARG A 231 -2.933 -13.446 -12.409 1.00 1.11 C ATOM 219 C ARG A 231 -2.587 -13.492 -13.901 1.00 1.14 C ATOM 220 O ARG A 231 -2.707 -14.519 -14.541 1.00 1.30 O ATOM 221 CB ARG A 231 -4.433 -13.189 -12.242 1.00 1.14 C ATOM 222 CG ARG A 231 -4.723 -12.760 -10.803 1.00 1.18 C ATOM 223 CD ARG A 231 -6.235 -12.718 -10.577 1.00 1.46 C ATOM 224 NE ARG A 231 -6.838 -11.662 -11.439 1.00 2.09 N ATOM 225 CZ ARG A 231 -8.126 -11.648 -11.648 1.00 2.67 C ATOM 226 NH1 ARG A 231 -8.884 -12.564 -11.110 1.00 2.80 N ATOM 227 NH2 ARG A 231 -8.655 -10.721 -12.398 1.00 3.63 N ATOM 0 H ARG A 231 -2.637 -11.439 -11.739 1.00 1.00 H new ATOM 0 HA ARG A 231 -2.668 -14.399 -11.951 1.00 1.11 H new ATOM 0 HB2 ARG A 231 -4.759 -12.414 -12.936 1.00 1.14 H new ATOM 0 HB3 ARG A 231 -4.996 -14.091 -12.484 1.00 1.14 H new ATOM 0 HG2 ARG A 231 -4.260 -13.457 -10.104 1.00 1.18 H new ATOM 0 HG3 ARG A 231 -4.289 -11.779 -10.610 1.00 1.18 H new ATOM 0 HD2 ARG A 231 -6.675 -13.688 -10.810 1.00 1.46 H new ATOM 0 HD3 ARG A 231 -6.451 -12.514 -9.528 1.00 1.46 H new ATOM 0 HE ARG A 231 -6.244 -10.951 -11.865 1.00 2.09 H new ATOM 0 HH11 ARG A 231 -8.470 -13.291 -10.526 1.00 2.80 H new ATOM 0 HH12 ARG A 231 -9.891 -12.553 -11.273 1.00 2.80 H new ATOM 0 HH21 ARG A 231 -8.062 -10.007 -12.821 1.00 3.63 H new ATOM 0 HH22 ARG A 231 -9.662 -10.710 -12.561 1.00 3.63 H new ATOM 241 N ASP A 232 -2.158 -12.392 -14.464 1.00 1.02 N ATOM 242 CA ASP A 232 -1.807 -12.387 -15.914 1.00 1.07 C ATOM 243 C ASP A 232 -0.942 -11.139 -16.221 1.00 0.94 C ATOM 244 O ASP A 232 -1.168 -10.099 -15.635 1.00 0.82 O ATOM 245 CB ASP A 232 -3.099 -12.334 -16.743 1.00 1.14 C ATOM 246 CG ASP A 232 -3.719 -13.733 -16.830 1.00 1.61 C ATOM 247 OD1 ASP A 232 -2.989 -14.666 -17.124 1.00 2.16 O ATOM 248 OD2 ASP A 232 -4.912 -13.846 -16.599 1.00 2.12 O ATOM 0 H ASP A 232 -2.036 -11.500 -13.984 1.00 1.02 H new ATOM 0 HA ASP A 232 -1.249 -13.289 -16.166 1.00 1.07 H new ATOM 0 HB2 ASP A 232 -3.806 -11.641 -16.287 1.00 1.14 H new ATOM 0 HB3 ASP A 232 -2.885 -11.959 -17.744 1.00 1.14 H new ATOM 253 N PRO A 233 0.024 -11.252 -17.125 1.00 1.01 N ATOM 254 CA PRO A 233 0.887 -10.098 -17.470 1.00 0.97 C ATOM 255 C PRO A 233 0.071 -9.004 -18.184 1.00 0.85 C ATOM 256 O PRO A 233 0.625 -8.120 -18.806 1.00 0.83 O ATOM 257 CB PRO A 233 1.961 -10.682 -18.418 1.00 1.13 C ATOM 258 CG PRO A 233 1.486 -12.104 -18.825 1.00 1.25 C ATOM 259 CD PRO A 233 0.347 -12.498 -17.861 1.00 1.19 C ATOM 0 HA PRO A 233 1.324 -9.631 -16.587 1.00 0.97 H new ATOM 0 HB2 PRO A 233 2.083 -10.050 -19.298 1.00 1.13 H new ATOM 0 HB3 PRO A 233 2.930 -10.727 -17.921 1.00 1.13 H new ATOM 0 HG2 PRO A 233 1.136 -12.112 -19.857 1.00 1.25 H new ATOM 0 HG3 PRO A 233 2.308 -12.817 -18.761 1.00 1.25 H new ATOM 0 HD2 PRO A 233 -0.520 -12.872 -18.405 1.00 1.19 H new ATOM 0 HD3 PRO A 233 0.661 -13.289 -17.180 1.00 1.19 H new ATOM 267 N VAL A 234 -1.233 -9.057 -18.114 1.00 0.84 N ATOM 268 CA VAL A 234 -2.057 -8.018 -18.806 1.00 0.80 C ATOM 269 C VAL A 234 -2.174 -6.769 -17.925 1.00 0.69 C ATOM 270 O VAL A 234 -2.381 -6.856 -16.732 1.00 0.72 O ATOM 271 CB VAL A 234 -3.456 -8.574 -19.086 1.00 0.90 C ATOM 272 CG1 VAL A 234 -3.347 -9.802 -19.994 1.00 1.74 C ATOM 273 CG2 VAL A 234 -4.123 -8.968 -17.766 1.00 1.75 C ATOM 0 H VAL A 234 -1.762 -9.769 -17.611 1.00 0.84 H new ATOM 0 HA VAL A 234 -1.574 -7.751 -19.746 1.00 0.80 H new ATOM 0 HB VAL A 234 -4.057 -7.811 -19.581 1.00 0.90 H new ATOM 0 HG11 VAL A 234 -4.343 -10.197 -20.193 1.00 1.74 H new ATOM 0 HG12 VAL A 234 -2.875 -9.518 -20.935 1.00 1.74 H new ATOM 0 HG13 VAL A 234 -2.745 -10.566 -19.502 1.00 1.74 H new ATOM 0 HG21 VAL A 234 -5.119 -9.364 -17.965 1.00 1.75 H new ATOM 0 HG22 VAL A 234 -3.523 -9.730 -17.268 1.00 1.75 H new ATOM 0 HG23 VAL A 234 -4.203 -8.092 -17.123 1.00 1.75 H new ATOM 283 N TRP A 235 -2.050 -5.604 -18.510 1.00 0.64 N ATOM 284 CA TRP A 235 -2.156 -4.346 -17.711 1.00 0.55 C ATOM 285 C TRP A 235 -3.567 -4.232 -17.129 1.00 0.53 C ATOM 286 O TRP A 235 -4.480 -4.910 -17.558 1.00 0.65 O ATOM 287 CB TRP A 235 -1.896 -3.136 -18.618 1.00 0.56 C ATOM 288 CG TRP A 235 -0.515 -3.215 -19.183 1.00 0.58 C ATOM 289 CD1 TRP A 235 -0.211 -3.634 -20.434 1.00 0.65 C ATOM 290 CD2 TRP A 235 0.750 -2.878 -18.544 1.00 0.53 C ATOM 291 NE1 TRP A 235 1.161 -3.580 -20.604 1.00 0.66 N ATOM 292 CE2 TRP A 235 1.799 -3.122 -19.469 1.00 0.59 C ATOM 293 CE3 TRP A 235 1.089 -2.390 -17.260 1.00 0.47 C ATOM 294 CZ2 TRP A 235 3.140 -2.890 -19.132 1.00 0.59 C ATOM 295 CZ3 TRP A 235 2.435 -2.156 -16.917 1.00 0.47 C ATOM 296 CH2 TRP A 235 3.457 -2.406 -17.851 1.00 0.53 C ATOM 0 H TRP A 235 -1.880 -5.470 -19.507 1.00 0.64 H new ATOM 0 HA TRP A 235 -1.421 -4.369 -16.907 1.00 0.55 H new ATOM 0 HB2 TRP A 235 -2.628 -3.111 -19.425 1.00 0.56 H new ATOM 0 HB3 TRP A 235 -2.015 -2.213 -18.051 1.00 0.56 H new ATOM 0 HD1 TRP A 235 -0.924 -3.958 -21.178 1.00 0.65 H new ATOM 0 HE1 TRP A 235 1.642 -3.846 -21.463 1.00 0.66 H new ATOM 0 HE3 TRP A 235 0.310 -2.195 -16.538 1.00 0.47 H new ATOM 0 HZ2 TRP A 235 3.923 -3.082 -19.851 1.00 0.59 H new ATOM 0 HZ3 TRP A 235 2.683 -1.784 -15.934 1.00 0.47 H new ATOM 0 HH2 TRP A 235 4.488 -2.226 -17.583 1.00 0.53 H new ATOM 307 N LYS A 236 -3.756 -3.363 -16.162 1.00 0.45 N ATOM 308 CA LYS A 236 -5.112 -3.176 -15.546 1.00 0.45 C ATOM 309 C LYS A 236 -5.558 -1.728 -15.760 1.00 0.43 C ATOM 310 O LYS A 236 -4.750 -0.850 -15.985 1.00 0.67 O ATOM 311 CB LYS A 236 -5.044 -3.477 -14.044 1.00 0.46 C ATOM 312 CG LYS A 236 -6.437 -3.292 -13.416 1.00 0.81 C ATOM 313 CD LYS A 236 -6.533 -4.108 -12.119 1.00 0.73 C ATOM 314 CE LYS A 236 -7.733 -3.640 -11.289 1.00 1.09 C ATOM 315 NZ LYS A 236 -8.994 -4.089 -11.944 1.00 1.43 N ATOM 0 H LYS A 236 -3.024 -2.771 -15.770 1.00 0.45 H new ATOM 0 HA LYS A 236 -5.825 -3.856 -16.013 1.00 0.45 H new ATOM 0 HB2 LYS A 236 -4.694 -4.497 -13.883 1.00 0.46 H new ATOM 0 HB3 LYS A 236 -4.326 -2.814 -13.562 1.00 0.46 H new ATOM 0 HG2 LYS A 236 -6.615 -2.237 -13.207 1.00 0.81 H new ATOM 0 HG3 LYS A 236 -7.208 -3.613 -14.117 1.00 0.81 H new ATOM 0 HD2 LYS A 236 -6.635 -5.168 -12.354 1.00 0.73 H new ATOM 0 HD3 LYS A 236 -5.616 -3.996 -11.541 1.00 0.73 H new ATOM 0 HE2 LYS A 236 -7.671 -4.045 -10.279 1.00 1.09 H new ATOM 0 HE3 LYS A 236 -7.725 -2.554 -11.198 1.00 1.09 H new ATOM 0 HZ1 LYS A 236 -9.809 -3.772 -11.382 1.00 1.43 H new ATOM 0 HZ2 LYS A 236 -9.053 -3.682 -12.899 1.00 1.43 H new ATOM 0 HZ3 LYS A 236 -9.001 -5.127 -12.009 1.00 1.43 H new ATOM 329 N GLY A 237 -6.841 -1.476 -15.701 1.00 0.39 N ATOM 330 CA GLY A 237 -7.351 -0.087 -15.914 1.00 0.36 C ATOM 331 C GLY A 237 -6.465 0.927 -15.168 1.00 0.31 C ATOM 332 O GLY A 237 -5.683 0.544 -14.322 1.00 0.31 O ATOM 0 H GLY A 237 -7.560 -2.175 -15.514 1.00 0.39 H new ATOM 0 HA2 GLY A 237 -7.363 0.144 -16.979 1.00 0.36 H new ATOM 0 HA3 GLY A 237 -8.379 -0.011 -15.560 1.00 0.36 H new ATOM 336 N PRO A 238 -6.608 2.199 -15.499 1.00 0.31 N ATOM 337 CA PRO A 238 -5.813 3.261 -14.849 1.00 0.29 C ATOM 338 C PRO A 238 -6.194 3.379 -13.364 1.00 0.24 C ATOM 339 O PRO A 238 -7.274 2.998 -12.956 1.00 0.27 O ATOM 340 CB PRO A 238 -6.185 4.553 -15.615 1.00 0.36 C ATOM 341 CG PRO A 238 -7.411 4.217 -16.511 1.00 0.41 C ATOM 342 CD PRO A 238 -7.551 2.679 -16.535 1.00 0.38 C ATOM 0 HA PRO A 238 -4.742 3.060 -14.881 1.00 0.29 H new ATOM 0 HB2 PRO A 238 -6.425 5.357 -14.920 1.00 0.36 H new ATOM 0 HB3 PRO A 238 -5.347 4.896 -16.222 1.00 0.36 H new ATOM 0 HG2 PRO A 238 -8.315 4.680 -16.115 1.00 0.41 H new ATOM 0 HG3 PRO A 238 -7.269 4.606 -17.519 1.00 0.41 H new ATOM 0 HD2 PRO A 238 -8.573 2.371 -16.313 1.00 0.38 H new ATOM 0 HD3 PRO A 238 -7.301 2.274 -17.516 1.00 0.38 H new ATOM 350 N ALA A 239 -5.314 3.923 -12.564 1.00 0.19 N ATOM 351 CA ALA A 239 -5.603 4.091 -11.108 1.00 0.18 C ATOM 352 C ALA A 239 -5.082 5.455 -10.653 1.00 0.17 C ATOM 353 O ALA A 239 -4.359 6.120 -11.370 1.00 0.19 O ATOM 354 CB ALA A 239 -4.899 2.988 -10.319 1.00 0.21 C ATOM 0 H ALA A 239 -4.398 4.261 -12.860 1.00 0.19 H new ATOM 0 HA ALA A 239 -6.677 4.029 -10.934 1.00 0.18 H new ATOM 0 HB1 ALA A 239 -5.109 3.110 -9.256 1.00 0.21 H new ATOM 0 HB2 ALA A 239 -5.261 2.015 -10.651 1.00 0.21 H new ATOM 0 HB3 ALA A 239 -3.824 3.051 -10.486 1.00 0.21 H new ATOM 360 N LYS A 240 -5.432 5.882 -9.465 1.00 0.19 N ATOM 361 CA LYS A 240 -4.943 7.207 -8.970 1.00 0.21 C ATOM 362 C LYS A 240 -3.656 7.003 -8.159 1.00 0.19 C ATOM 363 O LYS A 240 -3.509 6.030 -7.442 1.00 0.18 O ATOM 364 CB LYS A 240 -6.023 7.861 -8.097 1.00 0.27 C ATOM 365 CG LYS A 240 -6.124 7.139 -6.748 1.00 1.15 C ATOM 366 CD LYS A 240 -7.452 7.491 -6.061 1.00 1.43 C ATOM 367 CE LYS A 240 -7.660 9.010 -6.060 1.00 2.03 C ATOM 368 NZ LYS A 240 -6.412 9.684 -5.604 1.00 2.72 N ATOM 0 H LYS A 240 -6.033 5.372 -8.818 1.00 0.19 H new ATOM 0 HA LYS A 240 -4.731 7.861 -9.816 1.00 0.21 H new ATOM 0 HB2 LYS A 240 -5.784 8.913 -7.938 1.00 0.27 H new ATOM 0 HB3 LYS A 240 -6.985 7.826 -8.609 1.00 0.27 H new ATOM 0 HG2 LYS A 240 -6.057 6.061 -6.897 1.00 1.15 H new ATOM 0 HG3 LYS A 240 -5.288 7.425 -6.110 1.00 1.15 H new ATOM 0 HD2 LYS A 240 -8.278 7.004 -6.579 1.00 1.43 H new ATOM 0 HD3 LYS A 240 -7.451 7.116 -5.038 1.00 1.43 H new ATOM 0 HE2 LYS A 240 -7.925 9.352 -7.060 1.00 2.03 H new ATOM 0 HE3 LYS A 240 -8.489 9.273 -5.403 1.00 2.03 H new ATOM 0 HZ1 LYS A 240 -6.436 10.685 -5.885 1.00 2.72 H new ATOM 0 HZ2 LYS A 240 -6.339 9.617 -4.569 1.00 2.72 H new ATOM 0 HZ3 LYS A 240 -5.589 9.221 -6.040 1.00 2.72 H new ATOM 382 N LEU A 241 -2.724 7.912 -8.276 1.00 0.20 N ATOM 383 CA LEU A 241 -1.430 7.782 -7.535 1.00 0.20 C ATOM 384 C LEU A 241 -1.555 8.405 -6.138 1.00 0.22 C ATOM 385 O LEU A 241 -1.964 9.540 -5.990 1.00 0.29 O ATOM 386 CB LEU A 241 -0.345 8.517 -8.334 1.00 0.22 C ATOM 387 CG LEU A 241 0.963 8.595 -7.537 1.00 0.23 C ATOM 388 CD1 LEU A 241 1.382 7.194 -7.075 1.00 0.29 C ATOM 389 CD2 LEU A 241 2.055 9.183 -8.436 1.00 0.29 C ATOM 0 H LEU A 241 -2.803 8.746 -8.857 1.00 0.20 H new ATOM 0 HA LEU A 241 -1.171 6.729 -7.421 1.00 0.20 H new ATOM 0 HB2 LEU A 241 -0.170 8.001 -9.278 1.00 0.22 H new ATOM 0 HB3 LEU A 241 -0.687 9.523 -8.579 1.00 0.22 H new ATOM 0 HG LEU A 241 0.818 9.227 -6.661 1.00 0.23 H new ATOM 0 HD11 LEU A 241 2.312 7.260 -6.510 1.00 0.29 H new ATOM 0 HD12 LEU A 241 0.602 6.771 -6.442 1.00 0.29 H new ATOM 0 HD13 LEU A 241 1.530 6.553 -7.944 1.00 0.29 H new ATOM 0 HD21 LEU A 241 2.991 9.244 -7.880 1.00 0.29 H new ATOM 0 HD22 LEU A 241 2.192 8.543 -9.308 1.00 0.29 H new ATOM 0 HD23 LEU A 241 1.761 10.181 -8.761 1.00 0.29 H new ATOM 401 N LEU A 242 -1.187 7.670 -5.110 1.00 0.22 N ATOM 402 CA LEU A 242 -1.262 8.205 -3.709 1.00 0.25 C ATOM 403 C LEU A 242 0.149 8.319 -3.122 1.00 0.25 C ATOM 404 O LEU A 242 0.698 9.396 -3.008 1.00 0.27 O ATOM 405 CB LEU A 242 -2.075 7.250 -2.829 1.00 0.26 C ATOM 406 CG LEU A 242 -3.438 6.960 -3.465 1.00 0.32 C ATOM 407 CD1 LEU A 242 -4.280 6.136 -2.481 1.00 0.30 C ATOM 408 CD2 LEU A 242 -4.156 8.280 -3.788 1.00 0.45 C ATOM 0 H LEU A 242 -0.835 6.715 -5.183 1.00 0.22 H new ATOM 0 HA LEU A 242 -1.738 9.185 -3.735 1.00 0.25 H new ATOM 0 HB2 LEU A 242 -1.526 6.318 -2.691 1.00 0.26 H new ATOM 0 HB3 LEU A 242 -2.215 7.687 -1.840 1.00 0.26 H new ATOM 0 HG LEU A 242 -3.300 6.401 -4.390 1.00 0.32 H new ATOM 0 HD11 LEU A 242 -5.253 5.924 -2.924 1.00 0.30 H new ATOM 0 HD12 LEU A 242 -3.769 5.199 -2.261 1.00 0.30 H new ATOM 0 HD13 LEU A 242 -4.417 6.700 -1.558 1.00 0.30 H new ATOM 0 HD21 LEU A 242 -5.125 8.066 -4.240 1.00 0.45 H new ATOM 0 HD22 LEU A 242 -4.302 8.849 -2.870 1.00 0.45 H new ATOM 0 HD23 LEU A 242 -3.552 8.862 -4.484 1.00 0.45 H new ATOM 420 N TRP A 243 0.735 7.214 -2.729 1.00 0.25 N ATOM 421 CA TRP A 243 2.103 7.256 -2.125 1.00 0.26 C ATOM 422 C TRP A 243 3.166 7.038 -3.210 1.00 0.22 C ATOM 423 O TRP A 243 2.995 6.247 -4.115 1.00 0.21 O ATOM 424 CB TRP A 243 2.217 6.144 -1.067 1.00 0.30 C ATOM 425 CG TRP A 243 3.323 6.462 -0.113 1.00 0.29 C ATOM 426 CD1 TRP A 243 3.283 7.438 0.817 1.00 0.31 C ATOM 427 CD2 TRP A 243 4.622 5.819 0.021 1.00 0.28 C ATOM 428 NE1 TRP A 243 4.476 7.449 1.509 1.00 0.31 N ATOM 429 CE2 TRP A 243 5.339 6.474 1.058 1.00 0.30 C ATOM 430 CE3 TRP A 243 5.250 4.747 -0.650 1.00 0.27 C ATOM 431 CZ2 TRP A 243 6.632 6.081 1.418 1.00 0.31 C ATOM 432 CZ3 TRP A 243 6.553 4.346 -0.291 1.00 0.28 C ATOM 433 CH2 TRP A 243 7.242 5.013 0.740 1.00 0.29 C ATOM 0 H TRP A 243 0.324 6.283 -2.801 1.00 0.25 H new ATOM 0 HA TRP A 243 2.264 8.230 -1.663 1.00 0.26 H new ATOM 0 HB2 TRP A 243 1.276 6.046 -0.527 1.00 0.30 H new ATOM 0 HB3 TRP A 243 2.407 5.187 -1.552 1.00 0.30 H new ATOM 0 HD1 TRP A 243 2.451 8.104 0.992 1.00 0.31 H new ATOM 0 HE1 TRP A 243 4.693 8.100 2.263 1.00 0.31 H new ATOM 0 HE3 TRP A 243 4.729 4.231 -1.443 1.00 0.27 H new ATOM 0 HZ2 TRP A 243 7.157 6.594 2.210 1.00 0.31 H new ATOM 0 HZ3 TRP A 243 7.025 3.524 -0.809 1.00 0.28 H new ATOM 0 HH2 TRP A 243 8.241 4.703 1.010 1.00 0.29 H new ATOM 444 N LYS A 244 4.275 7.726 -3.109 1.00 0.24 N ATOM 445 CA LYS A 244 5.371 7.561 -4.113 1.00 0.23 C ATOM 446 C LYS A 244 6.717 7.724 -3.403 1.00 0.24 C ATOM 447 O LYS A 244 6.980 8.737 -2.787 1.00 0.28 O ATOM 448 CB LYS A 244 5.232 8.631 -5.211 1.00 0.30 C ATOM 449 CG LYS A 244 6.289 8.412 -6.328 1.00 0.71 C ATOM 450 CD LYS A 244 7.533 9.305 -6.096 1.00 0.82 C ATOM 451 CE LYS A 244 7.348 10.664 -6.782 1.00 1.50 C ATOM 452 NZ LYS A 244 6.028 11.242 -6.403 1.00 2.32 N ATOM 0 H LYS A 244 4.470 8.400 -2.369 1.00 0.24 H new ATOM 0 HA LYS A 244 5.310 6.573 -4.570 1.00 0.23 H new ATOM 0 HB2 LYS A 244 4.230 8.592 -5.639 1.00 0.30 H new ATOM 0 HB3 LYS A 244 5.355 9.623 -4.777 1.00 0.30 H new ATOM 0 HG2 LYS A 244 6.588 7.364 -6.351 1.00 0.71 H new ATOM 0 HG3 LYS A 244 5.850 8.639 -7.299 1.00 0.71 H new ATOM 0 HD2 LYS A 244 7.692 9.448 -5.027 1.00 0.82 H new ATOM 0 HD3 LYS A 244 8.422 8.811 -6.487 1.00 0.82 H new ATOM 0 HE2 LYS A 244 8.150 11.342 -6.490 1.00 1.50 H new ATOM 0 HE3 LYS A 244 7.408 10.547 -7.864 1.00 1.50 H new ATOM 0 HZ1 LYS A 244 5.968 12.223 -6.743 1.00 2.32 H new ATOM 0 HZ2 LYS A 244 5.266 10.680 -6.833 1.00 2.32 H new ATOM 0 HZ3 LYS A 244 5.927 11.227 -5.368 1.00 2.32 H new ATOM 466 N GLY A 245 7.574 6.740 -3.478 1.00 0.23 N ATOM 467 CA GLY A 245 8.898 6.856 -2.798 1.00 0.26 C ATOM 468 C GLY A 245 9.923 5.948 -3.480 1.00 0.26 C ATOM 469 O GLY A 245 10.389 6.223 -4.568 1.00 0.27 O ATOM 0 H GLY A 245 7.416 5.865 -3.978 1.00 0.23 H new ATOM 0 HA2 GLY A 245 9.241 7.890 -2.827 1.00 0.26 H new ATOM 0 HA3 GLY A 245 8.801 6.582 -1.747 1.00 0.26 H new ATOM 473 N GLU A 246 10.286 4.871 -2.839 1.00 0.26 N ATOM 474 CA GLU A 246 11.291 3.943 -3.432 1.00 0.27 C ATOM 475 C GLU A 246 10.688 3.243 -4.652 1.00 0.24 C ATOM 476 O GLU A 246 9.832 3.782 -5.326 1.00 0.22 O ATOM 477 CB GLU A 246 11.691 2.897 -2.386 1.00 0.33 C ATOM 478 CG GLU A 246 12.259 3.601 -1.148 1.00 1.00 C ATOM 479 CD GLU A 246 12.281 2.628 0.033 1.00 0.91 C ATOM 480 OE1 GLU A 246 11.242 2.451 0.651 1.00 1.39 O ATOM 481 OE2 GLU A 246 13.335 2.077 0.302 1.00 1.39 O ATOM 0 H GLU A 246 9.928 4.592 -1.925 1.00 0.26 H new ATOM 0 HA GLU A 246 12.171 4.507 -3.741 1.00 0.27 H new ATOM 0 HB2 GLU A 246 10.826 2.295 -2.110 1.00 0.33 H new ATOM 0 HB3 GLU A 246 12.433 2.216 -2.803 1.00 0.33 H new ATOM 0 HG2 GLU A 246 13.267 3.962 -1.353 1.00 1.00 H new ATOM 0 HG3 GLU A 246 11.652 4.472 -0.903 1.00 1.00 H new ATOM 488 N GLY A 247 11.125 2.045 -4.939 1.00 0.26 N ATOM 489 CA GLY A 247 10.573 1.312 -6.115 1.00 0.25 C ATOM 490 C GLY A 247 9.196 0.750 -5.761 1.00 0.25 C ATOM 491 O GLY A 247 8.913 -0.413 -5.967 1.00 0.29 O ATOM 0 H GLY A 247 11.839 1.544 -4.411 1.00 0.26 H new ATOM 0 HA2 GLY A 247 10.496 1.982 -6.972 1.00 0.25 H new ATOM 0 HA3 GLY A 247 11.245 0.504 -6.402 1.00 0.25 H new ATOM 495 N ALA A 248 8.336 1.575 -5.227 1.00 0.22 N ATOM 496 CA ALA A 248 6.972 1.113 -4.850 1.00 0.24 C ATOM 497 C ALA A 248 5.993 2.272 -5.026 1.00 0.21 C ATOM 498 O ALA A 248 6.354 3.424 -4.891 1.00 0.23 O ATOM 499 CB ALA A 248 6.973 0.662 -3.387 1.00 0.29 C ATOM 0 H ALA A 248 8.524 2.559 -5.035 1.00 0.22 H new ATOM 0 HA ALA A 248 6.674 0.277 -5.483 1.00 0.24 H new ATOM 0 HB1 ALA A 248 5.975 0.324 -3.110 1.00 0.29 H new ATOM 0 HB2 ALA A 248 7.682 -0.156 -3.259 1.00 0.29 H new ATOM 0 HB3 ALA A 248 7.263 1.497 -2.749 1.00 0.29 H new ATOM 505 N VAL A 249 4.757 1.982 -5.332 1.00 0.19 N ATOM 506 CA VAL A 249 3.758 3.075 -5.522 1.00 0.18 C ATOM 507 C VAL A 249 2.387 2.613 -5.030 1.00 0.20 C ATOM 508 O VAL A 249 1.907 1.557 -5.393 1.00 0.22 O ATOM 509 CB VAL A 249 3.677 3.443 -7.008 1.00 0.17 C ATOM 510 CG1 VAL A 249 4.950 4.186 -7.417 1.00 0.31 C ATOM 511 CG2 VAL A 249 3.540 2.174 -7.855 1.00 0.30 C ATOM 0 H VAL A 249 4.395 1.037 -5.459 1.00 0.19 H new ATOM 0 HA VAL A 249 4.067 3.949 -4.949 1.00 0.18 H new ATOM 0 HB VAL A 249 2.808 4.080 -7.171 1.00 0.17 H new ATOM 0 HG11 VAL A 249 4.894 4.449 -8.473 1.00 0.31 H new ATOM 0 HG12 VAL A 249 5.048 5.094 -6.822 1.00 0.31 H new ATOM 0 HG13 VAL A 249 5.816 3.546 -7.247 1.00 0.31 H new ATOM 0 HG21 VAL A 249 3.483 2.445 -8.909 1.00 0.30 H new ATOM 0 HG22 VAL A 249 4.406 1.532 -7.691 1.00 0.30 H new ATOM 0 HG23 VAL A 249 2.634 1.641 -7.568 1.00 0.30 H new ATOM 521 N VAL A 250 1.748 3.401 -4.207 1.00 0.20 N ATOM 522 CA VAL A 250 0.397 3.018 -3.700 1.00 0.22 C ATOM 523 C VAL A 250 -0.656 3.642 -4.612 1.00 0.20 C ATOM 524 O VAL A 250 -0.570 4.801 -4.967 1.00 0.21 O ATOM 525 CB VAL A 250 0.197 3.541 -2.274 1.00 0.26 C ATOM 526 CG1 VAL A 250 -1.207 3.174 -1.798 1.00 0.26 C ATOM 527 CG2 VAL A 250 1.237 2.916 -1.337 1.00 0.29 C ATOM 0 H VAL A 250 2.103 4.294 -3.864 1.00 0.20 H new ATOM 0 HA VAL A 250 0.306 1.932 -3.693 1.00 0.22 H new ATOM 0 HB VAL A 250 0.318 4.624 -2.265 1.00 0.26 H new ATOM 0 HG11 VAL A 250 -1.355 3.544 -0.783 1.00 0.26 H new ATOM 0 HG12 VAL A 250 -1.945 3.626 -2.460 1.00 0.26 H new ATOM 0 HG13 VAL A 250 -1.324 2.090 -1.810 1.00 0.26 H new ATOM 0 HG21 VAL A 250 1.088 3.293 -0.325 1.00 0.29 H new ATOM 0 HG22 VAL A 250 1.125 1.832 -1.341 1.00 0.29 H new ATOM 0 HG23 VAL A 250 2.238 3.178 -1.678 1.00 0.29 H new ATOM 537 N ILE A 251 -1.646 2.882 -5.003 1.00 0.19 N ATOM 538 CA ILE A 251 -2.706 3.424 -5.904 1.00 0.18 C ATOM 539 C ILE A 251 -4.076 2.955 -5.422 1.00 0.20 C ATOM 540 O ILE A 251 -4.192 2.223 -4.460 1.00 0.23 O ATOM 541 CB ILE A 251 -2.468 2.910 -7.327 1.00 0.16 C ATOM 542 CG1 ILE A 251 -2.523 1.378 -7.324 1.00 0.18 C ATOM 543 CG2 ILE A 251 -1.094 3.380 -7.820 1.00 0.16 C ATOM 544 CD1 ILE A 251 -2.070 0.835 -8.684 1.00 0.18 C ATOM 0 H ILE A 251 -1.766 1.905 -4.736 1.00 0.19 H new ATOM 0 HA ILE A 251 -2.671 4.513 -5.893 1.00 0.18 H new ATOM 0 HB ILE A 251 -3.238 3.300 -7.993 1.00 0.16 H new ATOM 0 HG12 ILE A 251 -1.883 0.984 -6.534 1.00 0.18 H new ATOM 0 HG13 ILE A 251 -3.538 1.043 -7.109 1.00 0.18 H new ATOM 0 HG21 ILE A 251 -0.926 3.014 -8.833 1.00 0.16 H new ATOM 0 HG22 ILE A 251 -1.060 4.469 -7.818 1.00 0.16 H new ATOM 0 HG23 ILE A 251 -0.318 2.992 -7.160 1.00 0.16 H new ATOM 0 HD11 ILE A 251 -2.112 -0.254 -8.673 1.00 0.18 H new ATOM 0 HD12 ILE A 251 -2.728 1.216 -9.465 1.00 0.18 H new ATOM 0 HD13 ILE A 251 -1.048 1.157 -8.882 1.00 0.18 H new ATOM 556 N GLN A 252 -5.117 3.368 -6.091 1.00 0.20 N ATOM 557 CA GLN A 252 -6.491 2.943 -5.686 1.00 0.23 C ATOM 558 C GLN A 252 -7.348 2.768 -6.939 1.00 0.24 C ATOM 559 O GLN A 252 -7.691 3.726 -7.604 1.00 0.27 O ATOM 560 CB GLN A 252 -7.130 4.008 -4.781 1.00 0.28 C ATOM 561 CG GLN A 252 -8.317 3.404 -4.027 1.00 0.31 C ATOM 562 CD GLN A 252 -9.061 4.515 -3.281 1.00 0.97 C ATOM 563 OE1 GLN A 252 -8.847 4.688 -2.004 1.00 1.68 O flip ATOM 564 NE2 GLN A 252 -9.843 5.236 -3.867 1.00 1.81 N flip ATOM 0 H GLN A 252 -5.077 3.983 -6.903 1.00 0.20 H new ATOM 0 HA GLN A 252 -6.429 2.002 -5.139 1.00 0.23 H new ATOM 0 HB2 GLN A 252 -6.393 4.387 -4.073 1.00 0.28 H new ATOM 0 HB3 GLN A 252 -7.462 4.856 -5.380 1.00 0.28 H new ATOM 0 HG2 GLN A 252 -8.990 2.905 -4.724 1.00 0.31 H new ATOM 0 HG3 GLN A 252 -7.969 2.648 -3.323 1.00 0.31 H new ATOM 0 HE21 GLN A 252 -10.011 5.102 -4.864 1.00 1.81 H new ATOM 0 HE22 GLN A 252 -10.332 5.975 -3.362 1.00 1.81 H new ATOM 573 N ASP A 253 -7.714 1.559 -7.261 1.00 0.25 N ATOM 574 CA ASP A 253 -8.569 1.338 -8.463 1.00 0.30 C ATOM 575 C ASP A 253 -10.020 1.439 -8.006 1.00 0.32 C ATOM 576 O ASP A 253 -10.640 2.478 -8.105 1.00 0.36 O ATOM 577 CB ASP A 253 -8.294 -0.050 -9.047 1.00 0.36 C ATOM 578 CG ASP A 253 -9.156 -0.260 -10.294 1.00 0.49 C ATOM 579 OD1 ASP A 253 -9.159 0.617 -11.142 1.00 1.18 O ATOM 580 OD2 ASP A 253 -9.795 -1.296 -10.381 1.00 1.18 O ATOM 0 H ASP A 253 -7.460 0.716 -6.746 1.00 0.25 H new ATOM 0 HA ASP A 253 -8.357 2.077 -9.236 1.00 0.30 H new ATOM 0 HB2 ASP A 253 -7.238 -0.146 -9.301 1.00 0.36 H new ATOM 0 HB3 ASP A 253 -8.515 -0.818 -8.306 1.00 0.36 H new ATOM 585 N ASN A 254 -10.555 0.385 -7.462 1.00 0.33 N ATOM 586 CA ASN A 254 -11.947 0.454 -6.951 1.00 0.36 C ATOM 587 C ASN A 254 -11.884 1.158 -5.597 1.00 0.34 C ATOM 588 O ASN A 254 -11.140 2.103 -5.425 1.00 0.36 O ATOM 589 CB ASN A 254 -12.504 -0.960 -6.773 1.00 0.42 C ATOM 590 CG ASN A 254 -12.326 -1.747 -8.075 1.00 1.22 C ATOM 591 OD1 ASN A 254 -11.608 -2.727 -8.112 1.00 1.98 O ATOM 592 ND2 ASN A 254 -12.954 -1.356 -9.150 1.00 1.88 N ATOM 0 H ASN A 254 -10.091 -0.516 -7.350 1.00 0.33 H new ATOM 0 HA ASN A 254 -12.595 0.991 -7.644 1.00 0.36 H new ATOM 0 HB2 ASN A 254 -11.988 -1.465 -5.957 1.00 0.42 H new ATOM 0 HB3 ASN A 254 -13.559 -0.915 -6.504 1.00 0.42 H new ATOM 0 HD21 ASN A 254 -12.843 -1.873 -10.022 1.00 1.88 H new ATOM 0 HD22 ASN A 254 -13.556 -0.533 -9.118 1.00 1.88 H new ATOM 599 N SER A 255 -12.622 0.699 -4.625 1.00 0.35 N ATOM 600 CA SER A 255 -12.563 1.341 -3.275 1.00 0.37 C ATOM 601 C SER A 255 -11.624 0.520 -2.390 1.00 0.37 C ATOM 602 O SER A 255 -11.996 0.051 -1.334 1.00 0.42 O ATOM 603 CB SER A 255 -13.961 1.367 -2.657 1.00 0.42 C ATOM 604 OG SER A 255 -14.802 2.210 -3.432 1.00 1.39 O ATOM 0 H SER A 255 -13.263 -0.091 -4.703 1.00 0.35 H new ATOM 0 HA SER A 255 -12.197 2.364 -3.362 1.00 0.37 H new ATOM 0 HB2 SER A 255 -14.373 0.359 -2.619 1.00 0.42 H new ATOM 0 HB3 SER A 255 -13.910 1.729 -1.630 1.00 0.42 H new ATOM 0 HG SER A 255 -15.700 2.227 -3.039 1.00 1.39 H new ATOM 610 N ASP A 256 -10.408 0.336 -2.828 1.00 0.34 N ATOM 611 CA ASP A 256 -9.430 -0.462 -2.034 1.00 0.37 C ATOM 612 C ASP A 256 -8.010 -0.042 -2.423 1.00 0.34 C ATOM 613 O ASP A 256 -7.645 -0.047 -3.581 1.00 0.31 O ATOM 614 CB ASP A 256 -9.624 -1.953 -2.331 1.00 0.41 C ATOM 615 CG ASP A 256 -10.867 -2.464 -1.599 1.00 0.47 C ATOM 616 OD1 ASP A 256 -10.996 -2.176 -0.420 1.00 1.12 O ATOM 617 OD2 ASP A 256 -11.669 -3.133 -2.228 1.00 1.12 O ATOM 0 H ASP A 256 -10.048 0.707 -3.707 1.00 0.34 H new ATOM 0 HA ASP A 256 -9.587 -0.285 -0.970 1.00 0.37 H new ATOM 0 HB2 ASP A 256 -9.731 -2.109 -3.404 1.00 0.41 H new ATOM 0 HB3 ASP A 256 -8.746 -2.515 -2.013 1.00 0.41 H new ATOM 622 N ILE A 257 -7.209 0.333 -1.461 1.00 0.35 N ATOM 623 CA ILE A 257 -5.810 0.763 -1.766 1.00 0.33 C ATOM 624 C ILE A 257 -4.867 -0.434 -1.642 1.00 0.34 C ATOM 625 O ILE A 257 -4.945 -1.203 -0.705 1.00 0.38 O ATOM 626 CB ILE A 257 -5.402 1.857 -0.778 1.00 0.36 C ATOM 627 CG1 ILE A 257 -6.366 3.041 -0.941 1.00 0.36 C ATOM 628 CG2 ILE A 257 -3.968 2.303 -1.072 1.00 0.34 C ATOM 629 CD1 ILE A 257 -6.078 4.126 0.113 1.00 0.47 C ATOM 0 H ILE A 257 -7.463 0.361 -0.474 1.00 0.35 H new ATOM 0 HA ILE A 257 -5.753 1.151 -2.783 1.00 0.33 H new ATOM 0 HB ILE A 257 -5.448 1.481 0.244 1.00 0.36 H new ATOM 0 HG12 ILE A 257 -6.266 3.463 -1.941 1.00 0.36 H new ATOM 0 HG13 ILE A 257 -7.395 2.695 -0.842 1.00 0.36 H new ATOM 0 HG21 ILE A 257 -3.678 3.083 -0.368 1.00 0.34 H new ATOM 0 HG22 ILE A 257 -3.294 1.452 -0.970 1.00 0.34 H new ATOM 0 HG23 ILE A 257 -3.909 2.692 -2.088 1.00 0.34 H new ATOM 0 HD11 ILE A 257 -6.772 4.956 -0.020 1.00 0.47 H new ATOM 0 HD12 ILE A 257 -6.202 3.706 1.111 1.00 0.47 H new ATOM 0 HD13 ILE A 257 -5.056 4.485 -0.005 1.00 0.47 H new ATOM 641 N LYS A 258 -3.977 -0.601 -2.593 1.00 0.31 N ATOM 642 CA LYS A 258 -3.025 -1.756 -2.552 1.00 0.33 C ATOM 643 C LYS A 258 -1.619 -1.280 -2.920 1.00 0.30 C ATOM 644 O LYS A 258 -1.434 -0.198 -3.443 1.00 0.27 O ATOM 645 CB LYS A 258 -3.480 -2.815 -3.559 1.00 0.34 C ATOM 646 CG LYS A 258 -4.761 -3.483 -3.053 1.00 0.42 C ATOM 647 CD LYS A 258 -5.216 -4.543 -4.058 1.00 0.43 C ATOM 648 CE LYS A 258 -6.614 -5.036 -3.681 1.00 1.41 C ATOM 649 NZ LYS A 258 -6.561 -5.715 -2.356 1.00 2.11 N ATOM 0 H LYS A 258 -3.870 0.016 -3.398 1.00 0.31 H new ATOM 0 HA LYS A 258 -3.010 -2.180 -1.548 1.00 0.33 H new ATOM 0 HB2 LYS A 258 -3.656 -2.355 -4.531 1.00 0.34 H new ATOM 0 HB3 LYS A 258 -2.698 -3.561 -3.696 1.00 0.34 H new ATOM 0 HG2 LYS A 258 -4.585 -3.941 -2.080 1.00 0.42 H new ATOM 0 HG3 LYS A 258 -5.543 -2.736 -2.917 1.00 0.42 H new ATOM 0 HD2 LYS A 258 -5.225 -4.125 -5.065 1.00 0.43 H new ATOM 0 HD3 LYS A 258 -4.514 -5.377 -4.066 1.00 0.43 H new ATOM 0 HE2 LYS A 258 -7.309 -4.197 -3.644 1.00 1.41 H new ATOM 0 HE3 LYS A 258 -6.985 -5.725 -4.440 1.00 1.41 H new ATOM 0 HZ1 LYS A 258 -7.453 -6.224 -2.191 1.00 2.11 H new ATOM 0 HZ2 LYS A 258 -5.770 -6.390 -2.343 1.00 2.11 H new ATOM 0 HZ3 LYS A 258 -6.424 -5.006 -1.608 1.00 2.11 H new ATOM 663 N VAL A 259 -0.624 -2.087 -2.647 1.00 0.30 N ATOM 664 CA VAL A 259 0.785 -1.704 -2.973 1.00 0.28 C ATOM 665 C VAL A 259 1.243 -2.442 -4.233 1.00 0.28 C ATOM 666 O VAL A 259 0.946 -3.606 -4.425 1.00 0.31 O ATOM 667 CB VAL A 259 1.693 -2.085 -1.800 1.00 0.30 C ATOM 668 CG1 VAL A 259 3.040 -1.374 -1.933 1.00 0.28 C ATOM 669 CG2 VAL A 259 1.024 -1.667 -0.490 1.00 0.33 C ATOM 0 H VAL A 259 -0.728 -3.002 -2.209 1.00 0.30 H new ATOM 0 HA VAL A 259 0.839 -0.629 -3.148 1.00 0.28 H new ATOM 0 HB VAL A 259 1.856 -3.163 -1.804 1.00 0.30 H new ATOM 0 HG11 VAL A 259 3.681 -1.649 -1.096 1.00 0.28 H new ATOM 0 HG12 VAL A 259 3.517 -1.670 -2.867 1.00 0.28 H new ATOM 0 HG13 VAL A 259 2.884 -0.295 -1.931 1.00 0.28 H new ATOM 0 HG21 VAL A 259 1.666 -1.936 0.349 1.00 0.33 H new ATOM 0 HG22 VAL A 259 0.862 -0.589 -0.492 1.00 0.33 H new ATOM 0 HG23 VAL A 259 0.066 -2.178 -0.392 1.00 0.33 H new ATOM 679 N VAL A 260 1.967 -1.770 -5.095 1.00 0.26 N ATOM 680 CA VAL A 260 2.460 -2.411 -6.353 1.00 0.26 C ATOM 681 C VAL A 260 3.931 -1.988 -6.582 1.00 0.24 C ATOM 682 O VAL A 260 4.219 -0.809 -6.525 1.00 0.22 O ATOM 683 CB VAL A 260 1.599 -1.910 -7.522 1.00 0.27 C ATOM 684 CG1 VAL A 260 2.141 -2.437 -8.855 1.00 0.34 C ATOM 685 CG2 VAL A 260 0.163 -2.404 -7.340 1.00 0.29 C ATOM 0 H VAL A 260 2.240 -0.794 -4.979 1.00 0.26 H new ATOM 0 HA VAL A 260 2.396 -3.497 -6.281 1.00 0.26 H new ATOM 0 HB VAL A 260 1.626 -0.820 -7.533 1.00 0.27 H new ATOM 0 HG11 VAL A 260 1.518 -2.071 -9.671 1.00 0.34 H new ATOM 0 HG12 VAL A 260 3.164 -2.088 -8.995 1.00 0.34 H new ATOM 0 HG13 VAL A 260 2.127 -3.527 -8.848 1.00 0.34 H new ATOM 0 HG21 VAL A 260 -0.451 -2.050 -8.168 1.00 0.29 H new ATOM 0 HG22 VAL A 260 0.153 -3.494 -7.320 1.00 0.29 H new ATOM 0 HG23 VAL A 260 -0.238 -2.021 -6.402 1.00 0.29 H new ATOM 695 N PRO A 261 4.836 -2.925 -6.847 1.00 0.29 N ATOM 696 CA PRO A 261 6.242 -2.552 -7.091 1.00 0.30 C ATOM 697 C PRO A 261 6.315 -1.546 -8.250 1.00 0.25 C ATOM 698 O PRO A 261 5.532 -1.596 -9.177 1.00 0.24 O ATOM 699 CB PRO A 261 6.957 -3.876 -7.448 1.00 0.37 C ATOM 700 CG PRO A 261 5.922 -5.024 -7.275 1.00 0.42 C ATOM 701 CD PRO A 261 4.565 -4.380 -6.915 1.00 0.36 C ATOM 0 HA PRO A 261 6.708 -2.074 -6.229 1.00 0.30 H new ATOM 0 HB2 PRO A 261 7.330 -3.847 -8.472 1.00 0.37 H new ATOM 0 HB3 PRO A 261 7.818 -4.034 -6.799 1.00 0.37 H new ATOM 0 HG2 PRO A 261 5.838 -5.605 -8.193 1.00 0.42 H new ATOM 0 HG3 PRO A 261 6.240 -5.711 -6.491 1.00 0.42 H new ATOM 0 HD2 PRO A 261 3.809 -4.606 -7.667 1.00 0.36 H new ATOM 0 HD3 PRO A 261 4.190 -4.756 -5.963 1.00 0.36 H new ATOM 709 N ARG A 262 7.251 -0.641 -8.204 1.00 0.27 N ATOM 710 CA ARG A 262 7.375 0.364 -9.297 1.00 0.28 C ATOM 711 C ARG A 262 7.752 -0.334 -10.611 1.00 0.30 C ATOM 712 O ARG A 262 7.378 0.098 -11.683 1.00 0.35 O ATOM 713 CB ARG A 262 8.464 1.379 -8.929 1.00 0.35 C ATOM 714 CG ARG A 262 8.756 2.281 -10.132 1.00 0.59 C ATOM 715 CD ARG A 262 9.517 3.526 -9.673 1.00 1.04 C ATOM 716 NE ARG A 262 10.005 4.272 -10.867 1.00 1.77 N ATOM 717 CZ ARG A 262 10.410 5.506 -10.744 1.00 2.20 C ATOM 718 NH1 ARG A 262 10.392 6.086 -9.575 1.00 2.31 N ATOM 719 NH2 ARG A 262 10.832 6.161 -11.792 1.00 3.12 N ATOM 0 H ARG A 262 7.938 -0.553 -7.455 1.00 0.27 H new ATOM 0 HA ARG A 262 6.421 0.875 -9.425 1.00 0.28 H new ATOM 0 HB2 ARG A 262 8.141 1.982 -8.080 1.00 0.35 H new ATOM 0 HB3 ARG A 262 9.372 0.859 -8.624 1.00 0.35 H new ATOM 0 HG2 ARG A 262 9.343 1.737 -10.872 1.00 0.59 H new ATOM 0 HG3 ARG A 262 7.823 2.571 -10.616 1.00 0.59 H new ATOM 0 HD2 ARG A 262 8.867 4.163 -9.072 1.00 1.04 H new ATOM 0 HD3 ARG A 262 10.357 3.240 -9.040 1.00 1.04 H new ATOM 0 HE ARG A 262 10.022 3.818 -11.780 1.00 1.77 H new ATOM 0 HH11 ARG A 262 10.061 5.574 -8.757 1.00 2.31 H new ATOM 0 HH12 ARG A 262 10.709 7.051 -9.479 1.00 2.31 H new ATOM 0 HH21 ARG A 262 10.845 5.708 -12.706 1.00 3.12 H new ATOM 0 HH22 ARG A 262 11.149 7.126 -11.697 1.00 3.12 H new ATOM 733 N ARG A 263 8.510 -1.394 -10.536 1.00 0.34 N ATOM 734 CA ARG A 263 8.933 -2.104 -11.779 1.00 0.40 C ATOM 735 C ARG A 263 7.742 -2.817 -12.432 1.00 0.40 C ATOM 736 O ARG A 263 7.866 -3.373 -13.504 1.00 0.49 O ATOM 737 CB ARG A 263 10.016 -3.130 -11.436 1.00 0.48 C ATOM 738 CG ARG A 263 11.281 -2.408 -10.957 1.00 1.31 C ATOM 739 CD ARG A 263 12.469 -3.371 -10.998 1.00 1.59 C ATOM 740 NE ARG A 263 13.675 -2.695 -10.442 1.00 2.29 N ATOM 741 CZ ARG A 263 14.722 -3.399 -10.110 1.00 2.90 C ATOM 742 NH1 ARG A 263 14.717 -4.694 -10.274 1.00 3.07 N ATOM 743 NH2 ARG A 263 15.777 -2.809 -9.618 1.00 3.82 N ATOM 0 H ARG A 263 8.856 -1.800 -9.667 1.00 0.34 H new ATOM 0 HA ARG A 263 9.325 -1.369 -12.482 1.00 0.40 H new ATOM 0 HB2 ARG A 263 9.657 -3.807 -10.661 1.00 0.48 H new ATOM 0 HB3 ARG A 263 10.243 -3.739 -12.311 1.00 0.48 H new ATOM 0 HG2 ARG A 263 11.479 -1.543 -11.590 1.00 1.31 H new ATOM 0 HG3 ARG A 263 11.137 -2.035 -9.943 1.00 1.31 H new ATOM 0 HD2 ARG A 263 12.244 -4.268 -10.422 1.00 1.59 H new ATOM 0 HD3 ARG A 263 12.658 -3.690 -12.023 1.00 1.59 H new ATOM 0 HE ARG A 263 13.682 -1.682 -10.321 1.00 2.29 H new ATOM 0 HH11 ARG A 263 13.894 -5.156 -10.662 1.00 3.07 H new ATOM 0 HH12 ARG A 263 15.536 -5.244 -10.014 1.00 3.07 H new ATOM 0 HH21 ARG A 263 15.783 -1.797 -9.493 1.00 3.82 H new ATOM 0 HH22 ARG A 263 16.595 -3.360 -9.359 1.00 3.82 H new ATOM 757 N LYS A 264 6.591 -2.802 -11.801 1.00 0.36 N ATOM 758 CA LYS A 264 5.385 -3.477 -12.392 1.00 0.42 C ATOM 759 C LYS A 264 4.296 -2.432 -12.632 1.00 0.36 C ATOM 760 O LYS A 264 3.139 -2.756 -12.834 1.00 0.38 O ATOM 761 CB LYS A 264 4.855 -4.539 -11.421 1.00 0.54 C ATOM 762 CG LYS A 264 5.969 -5.530 -11.057 1.00 0.85 C ATOM 763 CD LYS A 264 6.523 -6.195 -12.326 1.00 0.95 C ATOM 764 CE LYS A 264 7.238 -7.501 -11.960 1.00 1.29 C ATOM 765 NZ LYS A 264 8.430 -7.195 -11.120 1.00 2.08 N ATOM 0 H LYS A 264 6.432 -2.351 -10.900 1.00 0.36 H new ATOM 0 HA LYS A 264 5.662 -3.953 -13.333 1.00 0.42 H new ATOM 0 HB2 LYS A 264 4.476 -4.060 -10.518 1.00 0.54 H new ATOM 0 HB3 LYS A 264 4.019 -5.071 -11.874 1.00 0.54 H new ATOM 0 HG2 LYS A 264 6.770 -5.011 -10.531 1.00 0.85 H new ATOM 0 HG3 LYS A 264 5.582 -6.290 -10.379 1.00 0.85 H new ATOM 0 HD2 LYS A 264 5.711 -6.398 -13.025 1.00 0.95 H new ATOM 0 HD3 LYS A 264 7.215 -5.520 -12.829 1.00 0.95 H new ATOM 0 HE2 LYS A 264 6.559 -8.161 -11.420 1.00 1.29 H new ATOM 0 HE3 LYS A 264 7.542 -8.027 -12.865 1.00 1.29 H new ATOM 0 HZ1 LYS A 264 9.026 -8.044 -11.040 1.00 2.08 H new ATOM 0 HZ2 LYS A 264 8.977 -6.428 -11.560 1.00 2.08 H new ATOM 0 HZ3 LYS A 264 8.120 -6.899 -10.172 1.00 2.08 H new ATOM 779 N ALA A 265 4.665 -1.175 -12.618 1.00 0.30 N ATOM 780 CA ALA A 265 3.668 -0.085 -12.843 1.00 0.27 C ATOM 781 C ALA A 265 4.265 0.965 -13.785 1.00 0.28 C ATOM 782 O ALA A 265 5.433 0.919 -14.119 1.00 0.32 O ATOM 783 CB ALA A 265 3.328 0.571 -11.501 1.00 0.27 C ATOM 0 H ALA A 265 5.621 -0.856 -12.459 1.00 0.30 H new ATOM 0 HA ALA A 265 2.764 -0.501 -13.288 1.00 0.27 H new ATOM 0 HB1 ALA A 265 2.601 1.367 -11.659 1.00 0.27 H new ATOM 0 HB2 ALA A 265 2.908 -0.176 -10.827 1.00 0.27 H new ATOM 0 HB3 ALA A 265 4.233 0.989 -11.060 1.00 0.27 H new ATOM 789 N LYS A 266 3.471 1.912 -14.212 1.00 0.26 N ATOM 790 CA LYS A 266 3.980 2.972 -15.140 1.00 0.30 C ATOM 791 C LYS A 266 3.392 4.325 -14.731 1.00 0.27 C ATOM 792 O LYS A 266 2.202 4.464 -14.540 1.00 0.25 O ATOM 793 CB LYS A 266 3.553 2.630 -16.575 1.00 0.35 C ATOM 794 CG LYS A 266 4.470 1.534 -17.140 1.00 0.43 C ATOM 795 CD LYS A 266 3.785 0.804 -18.305 1.00 0.50 C ATOM 796 CE LYS A 266 3.150 1.804 -19.280 1.00 1.09 C ATOM 797 NZ LYS A 266 3.021 1.166 -20.622 1.00 1.79 N ATOM 0 H LYS A 266 2.487 1.999 -13.958 1.00 0.26 H new ATOM 0 HA LYS A 266 5.068 3.023 -15.088 1.00 0.30 H new ATOM 0 HB2 LYS A 266 2.517 2.292 -16.586 1.00 0.35 H new ATOM 0 HB3 LYS A 266 3.605 3.520 -17.202 1.00 0.35 H new ATOM 0 HG2 LYS A 266 5.406 1.976 -17.481 1.00 0.43 H new ATOM 0 HG3 LYS A 266 4.721 0.821 -16.354 1.00 0.43 H new ATOM 0 HD2 LYS A 266 4.514 0.188 -18.832 1.00 0.50 H new ATOM 0 HD3 LYS A 266 3.020 0.131 -17.918 1.00 0.50 H new ATOM 0 HE2 LYS A 266 2.170 2.114 -18.916 1.00 1.09 H new ATOM 0 HE3 LYS A 266 3.763 2.703 -19.349 1.00 1.09 H new ATOM 0 HZ1 LYS A 266 2.591 1.840 -21.287 1.00 1.79 H new ATOM 0 HZ2 LYS A 266 3.963 0.892 -20.968 1.00 1.79 H new ATOM 0 HZ3 LYS A 266 2.419 0.321 -20.548 1.00 1.79 H new ATOM 811 N ILE A 267 4.225 5.324 -14.589 1.00 0.30 N ATOM 812 CA ILE A 267 3.723 6.673 -14.185 1.00 0.32 C ATOM 813 C ILE A 267 3.333 7.474 -15.431 1.00 0.37 C ATOM 814 O ILE A 267 4.181 7.944 -16.164 1.00 0.41 O ATOM 815 CB ILE A 267 4.831 7.425 -13.436 1.00 0.36 C ATOM 816 CG1 ILE A 267 5.403 6.529 -12.319 1.00 0.36 C ATOM 817 CG2 ILE A 267 4.280 8.743 -12.852 1.00 0.39 C ATOM 818 CD1 ILE A 267 4.276 5.974 -11.440 1.00 0.45 C ATOM 0 H ILE A 267 5.233 5.264 -14.735 1.00 0.30 H new ATOM 0 HA ILE A 267 2.853 6.553 -13.540 1.00 0.32 H new ATOM 0 HB ILE A 267 5.633 7.671 -14.132 1.00 0.36 H new ATOM 0 HG12 ILE A 267 5.967 5.706 -12.759 1.00 0.36 H new ATOM 0 HG13 ILE A 267 6.100 7.102 -11.707 1.00 0.36 H new ATOM 0 HG21 ILE A 267 5.076 9.267 -12.323 1.00 0.39 H new ATOM 0 HG22 ILE A 267 3.907 9.371 -13.661 1.00 0.39 H new ATOM 0 HG23 ILE A 267 3.468 8.523 -12.159 1.00 0.39 H new ATOM 0 HD11 ILE A 267 4.701 5.344 -10.658 1.00 0.45 H new ATOM 0 HD12 ILE A 267 3.730 6.800 -10.984 1.00 0.45 H new ATOM 0 HD13 ILE A 267 3.595 5.383 -12.052 1.00 0.45 H new ATOM 830 N ILE A 268 2.054 7.644 -15.670 1.00 0.39 N ATOM 831 CA ILE A 268 1.595 8.430 -16.864 1.00 0.45 C ATOM 832 C ILE A 268 1.077 9.787 -16.392 1.00 0.48 C ATOM 833 O ILE A 268 0.667 9.948 -15.261 1.00 0.47 O ATOM 834 CB ILE A 268 0.450 7.696 -17.580 1.00 0.48 C ATOM 835 CG1 ILE A 268 0.803 6.211 -17.811 1.00 0.50 C ATOM 836 CG2 ILE A 268 0.161 8.381 -18.920 1.00 0.56 C ATOM 837 CD1 ILE A 268 1.766 6.047 -18.995 1.00 0.57 C ATOM 0 H ILE A 268 1.304 7.271 -15.088 1.00 0.39 H new ATOM 0 HA ILE A 268 2.433 8.551 -17.551 1.00 0.45 H new ATOM 0 HB ILE A 268 -0.438 7.738 -16.949 1.00 0.48 H new ATOM 0 HG12 ILE A 268 1.257 5.798 -16.910 1.00 0.50 H new ATOM 0 HG13 ILE A 268 -0.108 5.643 -17.998 1.00 0.50 H new ATOM 0 HG21 ILE A 268 -0.651 7.860 -19.427 1.00 0.56 H new ATOM 0 HG22 ILE A 268 -0.127 9.418 -18.744 1.00 0.56 H new ATOM 0 HG23 ILE A 268 1.055 8.353 -19.543 1.00 0.56 H new ATOM 0 HD11 ILE A 268 1.996 4.991 -19.133 1.00 0.57 H new ATOM 0 HD12 ILE A 268 1.300 6.438 -19.900 1.00 0.57 H new ATOM 0 HD13 ILE A 268 2.686 6.596 -18.794 1.00 0.57 H new ATOM 849 N ARG A 269 1.079 10.764 -17.258 1.00 0.56 N ATOM 850 CA ARG A 269 0.575 12.117 -16.874 1.00 0.62 C ATOM 851 C ARG A 269 -0.919 12.208 -17.195 1.00 0.66 C ATOM 852 O ARG A 269 -1.392 11.618 -18.147 1.00 0.73 O ATOM 853 CB ARG A 269 1.335 13.187 -17.665 1.00 0.73 C ATOM 854 CG ARG A 269 1.127 14.555 -17.011 1.00 1.48 C ATOM 855 CD ARG A 269 1.938 15.615 -17.762 1.00 1.80 C ATOM 856 NE ARG A 269 2.092 16.821 -16.901 1.00 2.23 N ATOM 857 CZ ARG A 269 2.976 17.733 -17.205 1.00 2.82 C ATOM 858 NH1 ARG A 269 3.723 17.588 -18.265 1.00 3.12 N ATOM 859 NH2 ARG A 269 3.111 18.786 -16.449 1.00 3.63 N ATOM 0 H ARG A 269 1.409 10.684 -18.220 1.00 0.56 H new ATOM 0 HA ARG A 269 0.730 12.278 -15.807 1.00 0.62 H new ATOM 0 HB2 ARG A 269 2.397 12.945 -17.695 1.00 0.73 H new ATOM 0 HB3 ARG A 269 0.984 13.209 -18.697 1.00 0.73 H new ATOM 0 HG2 ARG A 269 0.069 14.817 -17.022 1.00 1.48 H new ATOM 0 HG3 ARG A 269 1.435 14.520 -15.966 1.00 1.48 H new ATOM 0 HD2 ARG A 269 2.917 15.218 -18.029 1.00 1.80 H new ATOM 0 HD3 ARG A 269 1.437 15.881 -18.693 1.00 1.80 H new ATOM 0 HE ARG A 269 1.507 16.934 -16.073 1.00 2.23 H new ATOM 0 HH11 ARG A 269 3.616 16.763 -18.855 1.00 3.12 H new ATOM 0 HH12 ARG A 269 4.414 18.300 -18.503 1.00 3.12 H new ATOM 0 HH21 ARG A 269 2.526 18.897 -15.621 1.00 3.63 H new ATOM 0 HH22 ARG A 269 3.801 19.499 -16.686 1.00 3.63 H new ATOM 873 N ASP A 270 -1.666 12.945 -16.419 1.00 0.67 N ATOM 874 CA ASP A 270 -3.129 13.072 -16.692 1.00 0.75 C ATOM 875 C ASP A 270 -3.367 14.224 -17.671 1.00 1.18 C ATOM 876 O ASP A 270 -4.257 14.099 -18.495 1.00 1.73 O ATOM 877 CB ASP A 270 -3.869 13.357 -15.384 1.00 0.91 C ATOM 878 CG ASP A 270 -3.937 12.078 -14.548 1.00 1.47 C ATOM 879 OD1 ASP A 270 -3.049 11.254 -14.686 1.00 2.05 O ATOM 880 OD2 ASP A 270 -4.878 11.945 -13.781 1.00 2.05 O ATOM 881 OXT ASP A 270 -2.655 15.209 -17.579 1.00 1.84 O ATOM 0 H ASP A 270 -1.329 13.465 -15.609 1.00 0.67 H new ATOM 0 HA ASP A 270 -3.499 12.143 -17.125 1.00 0.75 H new ATOM 0 HB2 ASP A 270 -3.356 14.141 -14.827 1.00 0.91 H new ATOM 0 HB3 ASP A 270 -4.875 13.721 -15.594 1.00 0.91 H new TER 886 ASP A 270 ATOM 887 N MET B 219 1.642 16.946 6.217 1.00 1.76 N ATOM 888 CA MET B 219 2.559 17.555 7.220 1.00 1.15 C ATOM 889 C MET B 219 2.561 16.704 8.493 1.00 1.04 C ATOM 890 O MET B 219 2.304 17.187 9.576 1.00 1.10 O ATOM 891 CB MET B 219 2.084 18.972 7.553 1.00 1.82 C ATOM 892 CG MET B 219 2.251 19.869 6.323 1.00 2.31 C ATOM 893 SD MET B 219 1.279 21.380 6.542 1.00 3.46 S ATOM 894 CE MET B 219 2.211 22.049 7.940 1.00 3.83 C ATOM 0 HA MET B 219 3.568 17.598 6.810 1.00 1.15 H new ATOM 0 HB2 MET B 219 1.039 18.953 7.863 1.00 1.82 H new ATOM 0 HB3 MET B 219 2.658 19.372 8.389 1.00 1.82 H new ATOM 0 HG2 MET B 219 3.303 20.118 6.181 1.00 2.31 H new ATOM 0 HG3 MET B 219 1.925 19.341 5.427 1.00 2.31 H new ATOM 0 HE1 MET B 219 1.998 23.113 8.044 1.00 3.83 H new ATOM 0 HE2 MET B 219 1.920 21.530 8.853 1.00 3.83 H new ATOM 0 HE3 MET B 219 3.278 21.908 7.767 1.00 3.83 H new ATOM 904 N ILE B 220 2.856 15.437 8.367 1.00 0.98 N ATOM 905 CA ILE B 220 2.882 14.546 9.567 1.00 0.97 C ATOM 906 C ILE B 220 4.260 14.655 10.242 1.00 0.94 C ATOM 907 O ILE B 220 5.286 14.546 9.602 1.00 1.01 O ATOM 908 CB ILE B 220 2.598 13.076 9.146 1.00 1.03 C ATOM 909 CG1 ILE B 220 2.950 12.853 7.666 1.00 1.36 C ATOM 910 CG2 ILE B 220 1.110 12.755 9.338 1.00 1.79 C ATOM 911 CD1 ILE B 220 4.441 13.112 7.425 1.00 2.08 C ATOM 0 H ILE B 220 3.081 14.979 7.484 1.00 0.98 H new ATOM 0 HA ILE B 220 2.110 14.855 10.271 1.00 0.97 H new ATOM 0 HB ILE B 220 3.212 12.426 9.769 1.00 1.03 H new ATOM 0 HG12 ILE B 220 2.701 11.832 7.376 1.00 1.36 H new ATOM 0 HG13 ILE B 220 2.354 13.517 7.040 1.00 1.36 H new ATOM 0 HG21 ILE B 220 0.919 11.724 9.041 1.00 1.79 H new ATOM 0 HG22 ILE B 220 0.842 12.886 10.386 1.00 1.79 H new ATOM 0 HG23 ILE B 220 0.511 13.427 8.723 1.00 1.79 H new ATOM 0 HD11 ILE B 220 4.673 12.950 6.372 1.00 2.08 H new ATOM 0 HD12 ILE B 220 4.680 14.141 7.695 1.00 2.08 H new ATOM 0 HD13 ILE B 220 5.032 12.430 8.036 1.00 2.08 H new ATOM 923 N GLN B 221 4.290 14.876 11.531 1.00 0.90 N ATOM 924 CA GLN B 221 5.600 14.994 12.240 1.00 0.92 C ATOM 925 C GLN B 221 6.107 13.597 12.607 1.00 0.83 C ATOM 926 O GLN B 221 6.077 12.683 11.807 1.00 0.85 O ATOM 927 CB GLN B 221 5.427 15.818 13.522 1.00 1.00 C ATOM 928 CG GLN B 221 4.894 17.211 13.178 1.00 1.28 C ATOM 929 CD GLN B 221 4.652 17.990 14.474 1.00 1.61 C ATOM 930 OE1 GLN B 221 3.658 17.785 15.140 1.00 2.08 O ATOM 931 NE2 GLN B 221 5.527 18.878 14.861 1.00 2.16 N ATOM 0 H GLN B 221 3.466 14.980 12.123 1.00 0.90 H new ATOM 0 HA GLN B 221 6.317 15.489 11.585 1.00 0.92 H new ATOM 0 HB2 GLN B 221 4.738 15.313 14.199 1.00 1.00 H new ATOM 0 HB3 GLN B 221 6.381 15.902 14.042 1.00 1.00 H new ATOM 0 HG2 GLN B 221 5.608 17.742 12.548 1.00 1.28 H new ATOM 0 HG3 GLN B 221 3.967 17.129 12.610 1.00 1.28 H new ATOM 0 HE21 GLN B 221 6.362 19.049 14.301 1.00 2.16 H new ATOM 0 HE22 GLN B 221 5.376 19.401 15.724 1.00 2.16 H new ATOM 940 N ASN B 222 6.570 13.426 13.819 1.00 0.78 N ATOM 941 CA ASN B 222 7.078 12.092 14.257 1.00 0.73 C ATOM 942 C ASN B 222 5.952 11.340 14.972 1.00 0.63 C ATOM 943 O ASN B 222 5.503 11.738 16.030 1.00 0.64 O ATOM 944 CB ASN B 222 8.252 12.295 15.217 1.00 0.80 C ATOM 945 CG ASN B 222 9.359 13.082 14.510 1.00 0.93 C ATOM 946 OD1 ASN B 222 9.372 13.179 13.300 1.00 1.48 O ATOM 947 ND2 ASN B 222 10.293 13.653 15.222 1.00 1.39 N ATOM 0 H ASN B 222 6.618 14.158 14.528 1.00 0.78 H new ATOM 0 HA ASN B 222 7.410 11.515 13.394 1.00 0.73 H new ATOM 0 HB2 ASN B 222 7.920 12.832 16.106 1.00 0.80 H new ATOM 0 HB3 ASN B 222 8.634 11.330 15.551 1.00 0.80 H new ATOM 0 HD21 ASN B 222 11.034 14.181 14.761 1.00 1.39 H new ATOM 0 HD22 ASN B 222 10.281 13.571 16.239 1.00 1.39 H new ATOM 954 N PHE B 223 5.488 10.259 14.397 1.00 0.55 N ATOM 955 CA PHE B 223 4.382 9.468 15.028 1.00 0.46 C ATOM 956 C PHE B 223 4.723 7.976 14.960 1.00 0.38 C ATOM 957 O PHE B 223 5.150 7.473 13.938 1.00 0.38 O ATOM 958 CB PHE B 223 3.074 9.723 14.259 1.00 0.46 C ATOM 959 CG PHE B 223 2.467 11.038 14.694 1.00 0.53 C ATOM 960 CD1 PHE B 223 1.684 11.099 15.863 1.00 0.54 C ATOM 961 CD2 PHE B 223 2.680 12.200 13.928 1.00 0.64 C ATOM 962 CE1 PHE B 223 1.114 12.322 16.266 1.00 0.64 C ATOM 963 CE2 PHE B 223 2.109 13.422 14.330 1.00 0.73 C ATOM 964 CZ PHE B 223 1.327 13.484 15.500 1.00 0.72 C ATOM 0 H PHE B 223 5.829 9.886 13.511 1.00 0.55 H new ATOM 0 HA PHE B 223 4.263 9.770 16.068 1.00 0.46 H new ATOM 0 HB2 PHE B 223 3.270 9.740 13.187 1.00 0.46 H new ATOM 0 HB3 PHE B 223 2.371 8.910 14.441 1.00 0.46 H new ATOM 0 HD1 PHE B 223 1.521 10.208 16.451 1.00 0.54 H new ATOM 0 HD2 PHE B 223 3.281 12.154 13.032 1.00 0.64 H new ATOM 0 HE1 PHE B 223 0.514 12.369 17.162 1.00 0.64 H new ATOM 0 HE2 PHE B 223 2.271 14.313 13.741 1.00 0.73 H new ATOM 0 HZ PHE B 223 0.891 14.422 15.809 1.00 0.72 H new ATOM 974 N ARG B 224 4.525 7.262 16.039 1.00 0.36 N ATOM 975 CA ARG B 224 4.816 5.792 16.051 1.00 0.30 C ATOM 976 C ARG B 224 3.481 5.049 15.955 1.00 0.26 C ATOM 977 O ARG B 224 2.443 5.596 16.275 1.00 0.28 O ATOM 978 CB ARG B 224 5.523 5.418 17.365 1.00 0.34 C ATOM 979 CG ARG B 224 7.029 5.676 17.241 1.00 1.00 C ATOM 980 CD ARG B 224 7.663 5.691 18.635 1.00 1.24 C ATOM 981 NE ARG B 224 9.128 5.936 18.516 1.00 1.82 N ATOM 982 CZ ARG B 224 9.818 6.285 19.568 1.00 2.35 C ATOM 983 NH1 ARG B 224 9.226 6.420 20.723 1.00 2.57 N ATOM 984 NH2 ARG B 224 11.102 6.500 19.466 1.00 3.26 N ATOM 0 H ARG B 224 4.172 7.635 16.920 1.00 0.36 H new ATOM 0 HA ARG B 224 5.463 5.523 15.216 1.00 0.30 H new ATOM 0 HB2 ARG B 224 5.112 6.003 18.188 1.00 0.34 H new ATOM 0 HB3 ARG B 224 5.343 4.369 17.599 1.00 0.34 H new ATOM 0 HG2 ARG B 224 7.492 4.902 16.628 1.00 1.00 H new ATOM 0 HG3 ARG B 224 7.205 6.628 16.740 1.00 1.00 H new ATOM 0 HD2 ARG B 224 7.203 6.467 19.246 1.00 1.24 H new ATOM 0 HD3 ARG B 224 7.483 4.741 19.138 1.00 1.24 H new ATOM 0 HE ARG B 224 9.591 5.831 17.613 1.00 1.82 H new ATOM 0 HH11 ARG B 224 8.223 6.253 20.805 1.00 2.57 H new ATOM 0 HH12 ARG B 224 9.766 6.693 21.544 1.00 2.57 H new ATOM 0 HH21 ARG B 224 11.567 6.395 18.564 1.00 3.26 H new ATOM 0 HH22 ARG B 224 11.640 6.773 20.288 1.00 3.26 H new ATOM 998 N VAL B 225 3.488 3.817 15.515 1.00 0.22 N ATOM 999 CA VAL B 225 2.202 3.058 15.395 1.00 0.20 C ATOM 1000 C VAL B 225 2.403 1.593 15.784 1.00 0.20 C ATOM 1001 O VAL B 225 3.374 0.964 15.413 1.00 0.22 O ATOM 1002 CB VAL B 225 1.711 3.131 13.948 1.00 0.20 C ATOM 1003 CG1 VAL B 225 0.446 2.282 13.797 1.00 0.20 C ATOM 1004 CG2 VAL B 225 1.401 4.589 13.592 1.00 0.23 C ATOM 0 H VAL B 225 4.323 3.304 15.234 1.00 0.22 H new ATOM 0 HA VAL B 225 1.467 3.502 16.067 1.00 0.20 H new ATOM 0 HB VAL B 225 2.482 2.751 13.278 1.00 0.20 H new ATOM 0 HG11 VAL B 225 0.095 2.333 12.766 1.00 0.20 H new ATOM 0 HG12 VAL B 225 0.670 1.247 14.053 1.00 0.20 H new ATOM 0 HG13 VAL B 225 -0.329 2.661 14.464 1.00 0.20 H new ATOM 0 HG21 VAL B 225 1.051 4.645 12.561 1.00 0.23 H new ATOM 0 HG22 VAL B 225 0.628 4.970 14.259 1.00 0.23 H new ATOM 0 HG23 VAL B 225 2.304 5.190 13.702 1.00 0.23 H new ATOM 1014 N TYR B 226 1.462 1.039 16.510 1.00 0.22 N ATOM 1015 CA TYR B 226 1.543 -0.398 16.916 1.00 0.25 C ATOM 1016 C TYR B 226 0.452 -1.156 16.163 1.00 0.26 C ATOM 1017 O TYR B 226 -0.566 -0.597 15.815 1.00 0.26 O ATOM 1018 CB TYR B 226 1.293 -0.531 18.423 1.00 0.32 C ATOM 1019 CG TYR B 226 2.447 0.060 19.201 1.00 0.35 C ATOM 1020 CD1 TYR B 226 2.655 1.452 19.205 1.00 0.42 C ATOM 1021 CD2 TYR B 226 3.303 -0.780 19.943 1.00 0.42 C ATOM 1022 CE1 TYR B 226 3.718 2.003 19.948 1.00 0.50 C ATOM 1023 CE2 TYR B 226 4.367 -0.229 20.683 1.00 0.48 C ATOM 1024 CZ TYR B 226 4.574 1.163 20.686 1.00 0.49 C ATOM 1025 OH TYR B 226 5.615 1.705 21.413 1.00 0.58 O ATOM 0 H TYR B 226 0.631 1.529 16.842 1.00 0.22 H new ATOM 0 HA TYR B 226 2.530 -0.798 16.685 1.00 0.25 H new ATOM 0 HB2 TYR B 226 0.367 -0.023 18.691 1.00 0.32 H new ATOM 0 HB3 TYR B 226 1.168 -1.581 18.686 1.00 0.32 H new ATOM 0 HD1 TYR B 226 2.000 2.098 18.639 1.00 0.42 H new ATOM 0 HD2 TYR B 226 3.142 -1.848 19.944 1.00 0.42 H new ATOM 0 HE1 TYR B 226 3.876 3.071 19.951 1.00 0.50 H new ATOM 0 HE2 TYR B 226 5.024 -0.874 21.248 1.00 0.48 H new ATOM 0 HH TYR B 226 6.107 0.988 21.864 1.00 0.58 H new ATOM 1035 N TYR B 227 0.641 -2.421 15.901 1.00 0.29 N ATOM 1036 CA TYR B 227 -0.411 -3.174 15.157 1.00 0.32 C ATOM 1037 C TYR B 227 -0.272 -4.674 15.413 1.00 0.38 C ATOM 1038 O TYR B 227 0.793 -5.171 15.725 1.00 0.39 O ATOM 1039 CB TYR B 227 -0.265 -2.899 13.656 1.00 0.31 C ATOM 1040 CG TYR B 227 1.129 -3.270 13.201 1.00 0.31 C ATOM 1041 CD1 TYR B 227 2.227 -2.465 13.563 1.00 0.28 C ATOM 1042 CD2 TYR B 227 1.331 -4.418 12.410 1.00 0.39 C ATOM 1043 CE1 TYR B 227 3.524 -2.809 13.136 1.00 0.32 C ATOM 1044 CE2 TYR B 227 2.629 -4.760 11.983 1.00 0.42 C ATOM 1045 CZ TYR B 227 3.724 -3.955 12.346 1.00 0.38 C ATOM 1046 OH TYR B 227 4.995 -4.291 11.928 1.00 0.44 O ATOM 0 H TYR B 227 1.466 -2.960 16.165 1.00 0.29 H new ATOM 0 HA TYR B 227 -1.392 -2.846 15.502 1.00 0.32 H new ATOM 0 HB2 TYR B 227 -1.005 -3.473 13.098 1.00 0.31 H new ATOM 0 HB3 TYR B 227 -0.457 -1.846 13.449 1.00 0.31 H new ATOM 0 HD1 TYR B 227 2.074 -1.584 14.168 1.00 0.28 H new ATOM 0 HD2 TYR B 227 0.490 -5.036 12.131 1.00 0.39 H new ATOM 0 HE1 TYR B 227 4.366 -2.192 13.415 1.00 0.32 H new ATOM 0 HE2 TYR B 227 2.784 -5.640 11.377 1.00 0.42 H new ATOM 0 HH TYR B 227 5.655 -3.787 12.449 1.00 0.44 H new ATOM 1056 N ARG B 228 -1.353 -5.398 15.278 1.00 0.43 N ATOM 1057 CA ARG B 228 -1.311 -6.873 15.507 1.00 0.50 C ATOM 1058 C ARG B 228 -1.108 -7.596 14.175 1.00 0.55 C ATOM 1059 O ARG B 228 -1.496 -7.116 13.129 1.00 0.61 O ATOM 1060 CB ARG B 228 -2.635 -7.324 16.135 1.00 0.56 C ATOM 1061 CG ARG B 228 -3.083 -6.288 17.164 1.00 0.67 C ATOM 1062 CD ARG B 228 -4.301 -6.814 17.928 1.00 0.73 C ATOM 1063 NE ARG B 228 -5.466 -6.907 17.002 1.00 1.49 N ATOM 1064 CZ ARG B 228 -6.524 -7.588 17.350 1.00 1.73 C ATOM 1065 NH1 ARG B 228 -6.566 -8.181 18.511 1.00 1.49 N ATOM 1066 NH2 ARG B 228 -7.542 -7.674 16.537 1.00 2.76 N ATOM 0 H ARG B 228 -2.268 -5.029 15.018 1.00 0.43 H new ATOM 0 HA ARG B 228 -0.485 -7.113 16.176 1.00 0.50 H new ATOM 0 HB2 ARG B 228 -3.396 -7.440 15.363 1.00 0.56 H new ATOM 0 HB3 ARG B 228 -2.513 -8.297 16.611 1.00 0.56 H new ATOM 0 HG2 ARG B 228 -2.270 -6.075 17.858 1.00 0.67 H new ATOM 0 HG3 ARG B 228 -3.331 -5.350 16.666 1.00 0.67 H new ATOM 0 HD2 ARG B 228 -4.082 -7.793 18.353 1.00 0.73 H new ATOM 0 HD3 ARG B 228 -4.536 -6.150 18.760 1.00 0.73 H new ATOM 0 HE ARG B 228 -5.436 -6.438 16.096 1.00 1.49 H new ATOM 0 HH11 ARG B 228 -5.772 -8.113 19.148 1.00 1.49 H new ATOM 0 HH12 ARG B 228 -7.393 -8.713 18.782 1.00 1.49 H new ATOM 0 HH21 ARG B 228 -7.511 -7.209 15.630 1.00 2.76 H new ATOM 0 HH22 ARG B 228 -8.369 -8.206 16.809 1.00 2.76 H new ATOM 1080 N ASP B 229 -0.509 -8.757 14.210 1.00 0.59 N ATOM 1081 CA ASP B 229 -0.284 -9.528 12.952 1.00 0.67 C ATOM 1082 C ASP B 229 -1.457 -10.489 12.747 1.00 0.75 C ATOM 1083 O ASP B 229 -2.222 -10.748 13.655 1.00 0.77 O ATOM 1084 CB ASP B 229 1.017 -10.334 13.066 1.00 0.73 C ATOM 1085 CG ASP B 229 2.141 -9.439 13.599 1.00 1.42 C ATOM 1086 OD1 ASP B 229 1.869 -8.627 14.466 1.00 2.23 O ATOM 1087 OD2 ASP B 229 3.256 -9.586 13.129 1.00 2.08 O ATOM 0 H ASP B 229 -0.165 -9.206 15.059 1.00 0.59 H new ATOM 0 HA ASP B 229 -0.209 -8.842 12.108 1.00 0.67 H new ATOM 0 HB2 ASP B 229 0.871 -11.184 13.732 1.00 0.73 H new ATOM 0 HB3 ASP B 229 1.292 -10.736 12.091 1.00 0.73 H new ATOM 1092 N SER B 230 -1.603 -11.026 11.567 1.00 0.85 N ATOM 1093 CA SER B 230 -2.726 -11.972 11.318 1.00 0.99 C ATOM 1094 C SER B 230 -2.360 -13.349 11.878 1.00 1.05 C ATOM 1095 O SER B 230 -3.144 -14.277 11.833 1.00 1.19 O ATOM 1096 CB SER B 230 -2.976 -12.084 9.814 1.00 1.08 C ATOM 1097 OG SER B 230 -3.500 -10.854 9.333 1.00 1.81 O ATOM 0 H SER B 230 -0.995 -10.851 10.767 1.00 0.85 H new ATOM 0 HA SER B 230 -3.628 -11.605 11.808 1.00 0.99 H new ATOM 0 HB2 SER B 230 -2.047 -12.324 9.296 1.00 1.08 H new ATOM 0 HB3 SER B 230 -3.675 -12.895 9.609 1.00 1.08 H new ATOM 0 HG SER B 230 -3.660 -10.921 8.369 1.00 1.81 H new ATOM 1103 N ARG B 231 -1.171 -13.488 12.403 1.00 1.01 N ATOM 1104 CA ARG B 231 -0.746 -14.805 12.966 1.00 1.12 C ATOM 1105 C ARG B 231 -1.109 -14.878 14.453 1.00 1.15 C ATOM 1106 O ARG B 231 -1.282 -15.947 15.005 1.00 1.31 O ATOM 1107 CB ARG B 231 0.769 -14.955 12.805 1.00 1.15 C ATOM 1108 CG ARG B 231 1.182 -14.505 11.401 1.00 1.19 C ATOM 1109 CD ARG B 231 2.651 -14.860 11.164 1.00 1.48 C ATOM 1110 NE ARG B 231 3.510 -14.083 12.102 1.00 2.10 N ATOM 1111 CZ ARG B 231 4.749 -14.440 12.299 1.00 2.68 C ATOM 1112 NH1 ARG B 231 5.234 -15.481 11.681 1.00 2.81 N ATOM 1113 NH2 ARG B 231 5.504 -13.756 13.116 1.00 3.64 N ATOM 0 H ARG B 231 -0.474 -12.746 12.467 1.00 1.01 H new ATOM 0 HA ARG B 231 -1.257 -15.607 12.433 1.00 1.12 H new ATOM 0 HB2 ARG B 231 1.286 -14.358 13.556 1.00 1.15 H new ATOM 0 HB3 ARG B 231 1.061 -15.993 12.966 1.00 1.15 H new ATOM 0 HG2 ARG B 231 0.554 -14.989 10.653 1.00 1.19 H new ATOM 0 HG3 ARG B 231 1.034 -13.430 11.294 1.00 1.19 H new ATOM 0 HD2 ARG B 231 2.806 -15.929 11.313 1.00 1.48 H new ATOM 0 HD3 ARG B 231 2.928 -14.638 10.133 1.00 1.48 H new ATOM 0 HE ARG B 231 3.129 -13.272 12.590 1.00 2.10 H new ATOM 0 HH11 ARG B 231 4.644 -16.016 11.043 1.00 2.81 H new ATOM 0 HH12 ARG B 231 6.203 -15.760 11.835 1.00 2.81 H new ATOM 0 HH21 ARG B 231 5.125 -12.942 13.600 1.00 3.64 H new ATOM 0 HH22 ARG B 231 6.473 -14.035 13.270 1.00 3.64 H new ATOM 1127 N ASP B 232 -1.229 -13.753 15.109 1.00 1.03 N ATOM 1128 CA ASP B 232 -1.581 -13.771 16.559 1.00 1.08 C ATOM 1129 C ASP B 232 -2.076 -12.364 16.977 1.00 0.95 C ATOM 1130 O ASP B 232 -1.567 -11.381 16.475 1.00 0.83 O ATOM 1131 CB ASP B 232 -0.333 -14.141 17.374 1.00 1.15 C ATOM 1132 CG ASP B 232 -0.120 -15.659 17.339 1.00 1.62 C ATOM 1133 OD1 ASP B 232 -1.080 -16.377 17.565 1.00 2.16 O ATOM 1134 OD2 ASP B 232 0.998 -16.074 17.087 1.00 2.13 O ATOM 0 H ASP B 232 -1.099 -12.826 14.704 1.00 1.03 H new ATOM 0 HA ASP B 232 -2.367 -14.503 16.744 1.00 1.08 H new ATOM 0 HB2 ASP B 232 0.541 -13.633 16.968 1.00 1.15 H new ATOM 0 HB3 ASP B 232 -0.448 -13.804 18.404 1.00 1.15 H new ATOM 1139 N PRO B 233 -3.047 -12.281 17.879 1.00 1.03 N ATOM 1140 CA PRO B 233 -3.566 -10.971 18.329 1.00 0.98 C ATOM 1141 C PRO B 233 -2.490 -10.202 19.120 1.00 0.86 C ATOM 1142 O PRO B 233 -2.789 -9.255 19.818 1.00 0.84 O ATOM 1143 CB PRO B 233 -4.769 -11.315 19.236 1.00 1.15 C ATOM 1144 CG PRO B 233 -4.704 -12.840 19.520 1.00 1.27 C ATOM 1145 CD PRO B 233 -3.705 -13.449 18.515 1.00 1.21 C ATOM 0 HA PRO B 233 -3.850 -10.331 17.493 1.00 0.98 H new ATOM 0 HB2 PRO B 233 -4.725 -10.748 20.166 1.00 1.15 H new ATOM 0 HB3 PRO B 233 -5.707 -11.054 18.747 1.00 1.15 H new ATOM 0 HG2 PRO B 233 -4.382 -13.027 20.544 1.00 1.27 H new ATOM 0 HG3 PRO B 233 -5.688 -13.295 19.408 1.00 1.27 H new ATOM 0 HD2 PRO B 233 -2.978 -14.087 19.017 1.00 1.21 H new ATOM 0 HD3 PRO B 233 -4.215 -14.067 17.776 1.00 1.21 H new ATOM 1153 N VAL B 234 -1.250 -10.604 19.031 1.00 0.86 N ATOM 1154 CA VAL B 234 -0.182 -9.890 19.796 1.00 0.81 C ATOM 1155 C VAL B 234 0.282 -8.652 19.020 1.00 0.70 C ATOM 1156 O VAL B 234 0.471 -8.693 17.821 1.00 0.73 O ATOM 1157 CB VAL B 234 1.009 -10.826 20.014 1.00 0.91 C ATOM 1158 CG1 VAL B 234 0.558 -12.047 20.819 1.00 1.74 C ATOM 1159 CG2 VAL B 234 1.558 -11.279 18.660 1.00 1.76 C ATOM 0 H VAL B 234 -0.930 -11.391 18.466 1.00 0.86 H new ATOM 0 HA VAL B 234 -0.586 -9.580 20.760 1.00 0.81 H new ATOM 0 HB VAL B 234 1.790 -10.299 20.562 1.00 0.91 H new ATOM 0 HG11 VAL B 234 1.406 -12.714 20.974 1.00 1.74 H new ATOM 0 HG12 VAL B 234 0.169 -11.723 21.784 1.00 1.74 H new ATOM 0 HG13 VAL B 234 -0.223 -12.575 20.272 1.00 1.74 H new ATOM 0 HG21 VAL B 234 2.406 -11.946 18.816 1.00 1.76 H new ATOM 0 HG22 VAL B 234 0.779 -11.806 18.109 1.00 1.76 H new ATOM 0 HG23 VAL B 234 1.881 -10.409 18.089 1.00 1.76 H new ATOM 1169 N TRP B 235 0.474 -7.551 19.700 1.00 0.65 N ATOM 1170 CA TRP B 235 0.929 -6.308 19.006 1.00 0.56 C ATOM 1171 C TRP B 235 2.325 -6.534 18.420 1.00 0.54 C ATOM 1172 O TRP B 235 3.013 -7.468 18.783 1.00 0.66 O ATOM 1173 CB TRP B 235 0.998 -5.150 20.012 1.00 0.56 C ATOM 1174 CG TRP B 235 -0.357 -4.896 20.584 1.00 0.58 C ATOM 1175 CD1 TRP B 235 -0.779 -5.318 21.800 1.00 0.66 C ATOM 1176 CD2 TRP B 235 -1.475 -4.176 19.989 1.00 0.54 C ATOM 1177 NE1 TRP B 235 -2.087 -4.905 21.990 1.00 0.67 N ATOM 1178 CE2 TRP B 235 -2.562 -4.198 20.904 1.00 0.60 C ATOM 1179 CE3 TRP B 235 -1.652 -3.509 18.754 1.00 0.47 C ATOM 1180 CZ2 TRP B 235 -3.785 -3.581 20.602 1.00 0.60 C ATOM 1181 CZ3 TRP B 235 -2.880 -2.890 18.447 1.00 0.47 C ATOM 1182 CH2 TRP B 235 -3.942 -2.925 19.369 1.00 0.53 C ATOM 0 H TRP B 235 0.335 -7.459 20.706 1.00 0.65 H new ATOM 0 HA TRP B 235 0.225 -6.065 18.211 1.00 0.56 H new ATOM 0 HB2 TRP B 235 1.700 -5.391 20.810 1.00 0.56 H new ATOM 0 HB3 TRP B 235 1.370 -4.251 19.521 1.00 0.56 H new ATOM 0 HD1 TRP B 235 -0.191 -5.885 22.507 1.00 0.66 H new ATOM 0 HE1 TRP B 235 -2.633 -5.099 22.830 1.00 0.67 H new ATOM 0 HE3 TRP B 235 -0.841 -3.474 18.042 1.00 0.47 H new ATOM 0 HZ2 TRP B 235 -4.599 -3.610 21.311 1.00 0.60 H new ATOM 0 HZ3 TRP B 235 -3.006 -2.387 17.500 1.00 0.47 H new ATOM 0 HH2 TRP B 235 -4.880 -2.447 19.129 1.00 0.53 H new ATOM 1193 N LYS B 236 2.755 -5.675 17.526 1.00 0.46 N ATOM 1194 CA LYS B 236 4.117 -5.815 16.913 1.00 0.45 C ATOM 1195 C LYS B 236 4.941 -4.567 17.240 1.00 0.44 C ATOM 1196 O LYS B 236 4.400 -3.522 17.547 1.00 0.67 O ATOM 1197 CB LYS B 236 3.989 -5.961 15.392 1.00 0.47 C ATOM 1198 CG LYS B 236 5.386 -6.113 14.765 1.00 0.81 C ATOM 1199 CD LYS B 236 5.273 -6.815 13.404 1.00 0.73 C ATOM 1200 CE LYS B 236 6.564 -6.623 12.602 1.00 1.09 C ATOM 1201 NZ LYS B 236 7.647 -7.453 13.203 1.00 1.44 N ATOM 0 H LYS B 236 2.217 -4.876 17.191 1.00 0.46 H new ATOM 0 HA LYS B 236 4.610 -6.700 17.315 1.00 0.45 H new ATOM 0 HB2 LYS B 236 3.375 -6.829 15.151 1.00 0.47 H new ATOM 0 HB3 LYS B 236 3.486 -5.089 14.975 1.00 0.47 H new ATOM 0 HG2 LYS B 236 5.848 -5.133 14.642 1.00 0.81 H new ATOM 0 HG3 LYS B 236 6.032 -6.688 15.429 1.00 0.81 H new ATOM 0 HD2 LYS B 236 5.081 -7.878 13.550 1.00 0.73 H new ATOM 0 HD3 LYS B 236 4.427 -6.412 12.848 1.00 0.73 H new ATOM 0 HE2 LYS B 236 6.405 -6.909 11.562 1.00 1.09 H new ATOM 0 HE3 LYS B 236 6.853 -5.572 12.603 1.00 1.09 H new ATOM 0 HZ1 LYS B 236 8.525 -7.324 12.660 1.00 1.44 H new ATOM 0 HZ2 LYS B 236 7.803 -7.159 14.188 1.00 1.44 H new ATOM 0 HZ3 LYS B 236 7.370 -8.455 13.180 1.00 1.44 H new ATOM 1215 N GLY B 237 6.244 -4.671 17.188 1.00 0.40 N ATOM 1216 CA GLY B 237 7.112 -3.497 17.509 1.00 0.37 C ATOM 1217 C GLY B 237 6.545 -2.221 16.859 1.00 0.31 C ATOM 1218 O GLY B 237 5.697 -2.305 15.992 1.00 0.31 O ATOM 0 H GLY B 237 6.747 -5.522 16.936 1.00 0.40 H new ATOM 0 HA2 GLY B 237 7.174 -3.366 18.589 1.00 0.37 H new ATOM 0 HA3 GLY B 237 8.126 -3.676 17.151 1.00 0.37 H new ATOM 1222 N PRO B 238 7.026 -1.069 17.292 1.00 0.31 N ATOM 1223 CA PRO B 238 6.558 0.221 16.740 1.00 0.29 C ATOM 1224 C PRO B 238 6.975 0.351 15.267 1.00 0.24 C ATOM 1225 O PRO B 238 7.914 -0.276 14.816 1.00 0.27 O ATOM 1226 CB PRO B 238 7.261 1.295 17.606 1.00 0.36 C ATOM 1227 CG PRO B 238 8.336 0.564 18.458 1.00 0.41 C ATOM 1228 CD PRO B 238 8.052 -0.950 18.354 1.00 0.38 C ATOM 0 HA PRO B 238 5.473 0.319 16.767 1.00 0.29 H new ATOM 0 HB2 PRO B 238 7.721 2.057 16.976 1.00 0.36 H new ATOM 0 HB3 PRO B 238 6.542 1.804 18.248 1.00 0.36 H new ATOM 0 HG2 PRO B 238 9.337 0.793 18.093 1.00 0.41 H new ATOM 0 HG3 PRO B 238 8.292 0.893 19.496 1.00 0.41 H new ATOM 0 HD2 PRO B 238 8.954 -1.505 18.097 1.00 0.38 H new ATOM 0 HD3 PRO B 238 7.690 -1.351 19.301 1.00 0.38 H new ATOM 1236 N ALA B 239 6.286 1.178 14.524 1.00 0.19 N ATOM 1237 CA ALA B 239 6.628 1.380 13.083 1.00 0.18 C ATOM 1238 C ALA B 239 6.503 2.868 12.746 1.00 0.17 C ATOM 1239 O ALA B 239 5.983 3.643 13.523 1.00 0.18 O ATOM 1240 CB ALA B 239 5.658 0.581 12.213 1.00 0.21 C ATOM 0 H ALA B 239 5.494 1.727 14.857 1.00 0.19 H new ATOM 0 HA ALA B 239 7.647 1.041 12.895 1.00 0.18 H new ATOM 0 HB1 ALA B 239 5.907 0.728 11.162 1.00 0.21 H new ATOM 0 HB2 ALA B 239 5.735 -0.478 12.460 1.00 0.21 H new ATOM 0 HB3 ALA B 239 4.639 0.923 12.396 1.00 0.21 H new ATOM 1246 N LYS B 240 6.970 3.278 11.594 1.00 0.18 N ATOM 1247 CA LYS B 240 6.869 4.723 11.216 1.00 0.21 C ATOM 1248 C LYS B 240 5.586 4.946 10.405 1.00 0.19 C ATOM 1249 O LYS B 240 5.186 4.114 9.613 1.00 0.18 O ATOM 1250 CB LYS B 240 8.096 5.128 10.387 1.00 0.27 C ATOM 1251 CG LYS B 240 8.013 4.519 8.982 1.00 1.15 C ATOM 1252 CD LYS B 240 9.394 4.551 8.312 1.00 1.44 C ATOM 1253 CE LYS B 240 10.010 5.948 8.435 1.00 2.03 C ATOM 1254 NZ LYS B 240 8.998 6.973 8.051 1.00 2.72 N ATOM 0 H LYS B 240 7.416 2.678 10.900 1.00 0.18 H new ATOM 0 HA LYS B 240 6.835 5.336 12.116 1.00 0.21 H new ATOM 0 HB2 LYS B 240 8.154 6.214 10.317 1.00 0.27 H new ATOM 0 HB3 LYS B 240 9.006 4.792 10.884 1.00 0.27 H new ATOM 0 HG2 LYS B 240 7.653 3.492 9.043 1.00 1.15 H new ATOM 0 HG3 LYS B 240 7.294 5.073 8.379 1.00 1.15 H new ATOM 0 HD2 LYS B 240 10.049 3.815 8.777 1.00 1.44 H new ATOM 0 HD3 LYS B 240 9.303 4.277 7.261 1.00 1.44 H new ATOM 0 HE2 LYS B 240 10.347 6.120 9.457 1.00 2.03 H new ATOM 0 HE3 LYS B 240 10.887 6.028 7.792 1.00 2.03 H new ATOM 0 HZ1 LYS B 240 9.331 7.915 8.339 1.00 2.72 H new ATOM 0 HZ2 LYS B 240 8.860 6.955 7.020 1.00 2.72 H new ATOM 0 HZ3 LYS B 240 8.096 6.765 8.525 1.00 2.72 H new ATOM 1268 N LEU B 241 4.936 6.063 10.607 1.00 0.20 N ATOM 1269 CA LEU B 241 3.665 6.352 9.872 1.00 0.20 C ATOM 1270 C LEU B 241 3.971 7.031 8.528 1.00 0.23 C ATOM 1271 O LEU B 241 4.677 8.018 8.471 1.00 0.30 O ATOM 1272 CB LEU B 241 2.811 7.288 10.741 1.00 0.23 C ATOM 1273 CG LEU B 241 1.583 7.784 9.967 1.00 0.24 C ATOM 1274 CD1 LEU B 241 0.805 6.593 9.395 1.00 0.29 C ATOM 1275 CD2 LEU B 241 0.683 8.574 10.923 1.00 0.30 C ATOM 0 H LEU B 241 5.232 6.794 11.254 1.00 0.20 H new ATOM 0 HA LEU B 241 3.131 5.422 9.675 1.00 0.20 H new ATOM 0 HB2 LEU B 241 2.491 6.764 11.641 1.00 0.23 H new ATOM 0 HB3 LEU B 241 3.411 8.139 11.064 1.00 0.23 H new ATOM 0 HG LEU B 241 1.904 8.422 9.143 1.00 0.24 H new ATOM 0 HD11 LEU B 241 -0.065 6.956 8.847 1.00 0.29 H new ATOM 0 HD12 LEU B 241 1.449 6.028 8.721 1.00 0.29 H new ATOM 0 HD13 LEU B 241 0.477 5.947 10.210 1.00 0.29 H new ATOM 0 HD21 LEU B 241 -0.194 8.932 10.384 1.00 0.30 H new ATOM 0 HD22 LEU B 241 0.367 7.928 11.742 1.00 0.30 H new ATOM 0 HD23 LEU B 241 1.235 9.424 11.323 1.00 0.30 H new ATOM 1287 N LEU B 242 3.428 6.511 7.449 1.00 0.22 N ATOM 1288 CA LEU B 242 3.664 7.118 6.095 1.00 0.26 C ATOM 1289 C LEU B 242 2.345 7.661 5.535 1.00 0.26 C ATOM 1290 O LEU B 242 2.111 8.853 5.515 1.00 0.28 O ATOM 1291 CB LEU B 242 4.196 6.053 5.130 1.00 0.27 C ATOM 1292 CG LEU B 242 5.420 5.349 5.726 1.00 0.32 C ATOM 1293 CD1 LEU B 242 6.016 4.412 4.668 1.00 0.31 C ATOM 1294 CD2 LEU B 242 6.468 6.394 6.148 1.00 0.45 C ATOM 0 H LEU B 242 2.827 5.687 7.448 1.00 0.22 H new ATOM 0 HA LEU B 242 4.390 7.924 6.197 1.00 0.26 H new ATOM 0 HB2 LEU B 242 3.415 5.322 4.920 1.00 0.27 H new ATOM 0 HB3 LEU B 242 4.463 6.516 4.180 1.00 0.27 H new ATOM 0 HG LEU B 242 5.124 4.774 6.603 1.00 0.32 H new ATOM 0 HD11 LEU B 242 6.888 3.905 5.081 1.00 0.31 H new ATOM 0 HD12 LEU B 242 5.271 3.672 4.376 1.00 0.31 H new ATOM 0 HD13 LEU B 242 6.313 4.992 3.794 1.00 0.31 H new ATOM 0 HD21 LEU B 242 7.336 5.888 6.571 1.00 0.45 H new ATOM 0 HD22 LEU B 242 6.774 6.974 5.278 1.00 0.45 H new ATOM 0 HD23 LEU B 242 6.037 7.061 6.895 1.00 0.45 H new ATOM 1306 N TRP B 243 1.484 6.793 5.060 1.00 0.26 N ATOM 1307 CA TRP B 243 0.186 7.256 4.476 1.00 0.27 C ATOM 1308 C TRP B 243 -0.908 7.251 5.551 1.00 0.23 C ATOM 1309 O TRP B 243 -0.971 6.371 6.385 1.00 0.22 O ATOM 1310 CB TRP B 243 -0.215 6.310 3.332 1.00 0.31 C ATOM 1311 CG TRP B 243 -1.181 6.994 2.419 1.00 0.30 C ATOM 1312 CD1 TRP B 243 -0.864 7.994 1.571 1.00 0.32 C ATOM 1313 CD2 TRP B 243 -2.604 6.744 2.245 1.00 0.29 C ATOM 1314 NE1 TRP B 243 -2.000 8.388 0.896 1.00 0.33 N ATOM 1315 CE2 TRP B 243 -3.101 7.652 1.274 1.00 0.31 C ATOM 1316 CE3 TRP B 243 -3.508 5.832 2.834 1.00 0.28 C ATOM 1317 CZ2 TRP B 243 -4.449 7.656 0.897 1.00 0.32 C ATOM 1318 CZ3 TRP B 243 -4.867 5.832 2.457 1.00 0.29 C ATOM 1319 CH2 TRP B 243 -5.335 6.744 1.490 1.00 0.31 C ATOM 0 H TRP B 243 1.625 5.783 5.052 1.00 0.26 H new ATOM 0 HA TRP B 243 0.303 8.271 4.096 1.00 0.27 H new ATOM 0 HB2 TRP B 243 0.670 6.004 2.775 1.00 0.31 H new ATOM 0 HB3 TRP B 243 -0.665 5.404 3.739 1.00 0.31 H new ATOM 0 HD1 TRP B 243 0.121 8.418 1.442 1.00 0.32 H new ATOM 0 HE1 TRP B 243 -2.022 9.134 0.201 1.00 0.33 H new ATOM 0 HE3 TRP B 243 -3.157 5.131 3.577 1.00 0.28 H new ATOM 0 HZ2 TRP B 243 -4.804 8.356 0.155 1.00 0.32 H new ATOM 0 HZ3 TRP B 243 -5.551 5.131 2.911 1.00 0.29 H new ATOM 0 HH2 TRP B 243 -6.377 6.741 1.205 1.00 0.31 H new ATOM 1330 N LYS B 244 -1.785 8.221 5.519 1.00 0.24 N ATOM 1331 CA LYS B 244 -2.897 8.279 6.518 1.00 0.24 C ATOM 1332 C LYS B 244 -4.138 8.861 5.839 1.00 0.25 C ATOM 1333 O LYS B 244 -4.107 9.954 5.310 1.00 0.29 O ATOM 1334 CB LYS B 244 -2.485 9.177 7.699 1.00 0.31 C ATOM 1335 CG LYS B 244 -3.575 9.163 8.805 1.00 0.72 C ATOM 1336 CD LYS B 244 -4.525 10.377 8.661 1.00 0.82 C ATOM 1337 CE LYS B 244 -3.985 11.574 9.454 1.00 1.51 C ATOM 1338 NZ LYS B 244 -2.553 11.799 9.110 1.00 2.33 N ATOM 0 H LYS B 244 -1.779 8.981 4.839 1.00 0.24 H new ATOM 0 HA LYS B 244 -3.113 7.278 6.891 1.00 0.24 H new ATOM 0 HB2 LYS B 244 -1.537 8.832 8.111 1.00 0.31 H new ATOM 0 HB3 LYS B 244 -2.328 10.197 7.349 1.00 0.31 H new ATOM 0 HG2 LYS B 244 -4.149 8.238 8.744 1.00 0.72 H new ATOM 0 HG3 LYS B 244 -3.102 9.181 9.787 1.00 0.72 H new ATOM 0 HD2 LYS B 244 -4.626 10.645 7.609 1.00 0.82 H new ATOM 0 HD3 LYS B 244 -5.520 10.113 9.020 1.00 0.82 H new ATOM 0 HE2 LYS B 244 -4.568 12.466 9.226 1.00 1.51 H new ATOM 0 HE3 LYS B 244 -4.088 11.390 10.523 1.00 1.51 H new ATOM 0 HZ1 LYS B 244 -2.199 12.631 9.623 1.00 2.33 H new ATOM 0 HZ2 LYS B 244 -1.996 10.963 9.380 1.00 2.33 H new ATOM 0 HZ3 LYS B 244 -2.463 11.960 8.086 1.00 2.33 H new ATOM 1352 N GLY B 245 -5.232 8.146 5.843 1.00 0.24 N ATOM 1353 CA GLY B 245 -6.466 8.675 5.189 1.00 0.27 C ATOM 1354 C GLY B 245 -7.709 8.029 5.805 1.00 0.26 C ATOM 1355 O GLY B 245 -8.093 8.330 6.917 1.00 0.28 O ATOM 0 H GLY B 245 -5.325 7.224 6.268 1.00 0.24 H new ATOM 0 HA2 GLY B 245 -6.513 9.758 5.307 1.00 0.27 H new ATOM 0 HA3 GLY B 245 -6.434 8.472 4.118 1.00 0.27 H new ATOM 1359 N GLU B 246 -8.345 7.148 5.080 1.00 0.27 N ATOM 1360 CA GLU B 246 -9.572 6.484 5.608 1.00 0.28 C ATOM 1361 C GLU B 246 -9.198 5.548 6.759 1.00 0.24 C ATOM 1362 O GLU B 246 -8.237 5.775 7.466 1.00 0.22 O ATOM 1363 CB GLU B 246 -10.230 5.677 4.482 1.00 0.33 C ATOM 1364 CG GLU B 246 -10.569 6.610 3.313 1.00 1.00 C ATOM 1365 CD GLU B 246 -10.842 5.780 2.055 1.00 0.92 C ATOM 1366 OE1 GLU B 246 -9.884 5.378 1.413 1.00 1.40 O ATOM 1367 OE2 GLU B 246 -12.004 5.560 1.757 1.00 1.40 O ATOM 0 H GLU B 246 -8.067 6.859 4.142 1.00 0.27 H new ATOM 0 HA GLU B 246 -10.267 7.239 5.974 1.00 0.28 H new ATOM 0 HB2 GLU B 246 -9.559 4.886 4.147 1.00 0.33 H new ATOM 0 HB3 GLU B 246 -11.135 5.193 4.849 1.00 0.33 H new ATOM 0 HG2 GLU B 246 -11.442 7.214 3.559 1.00 1.00 H new ATOM 0 HG3 GLU B 246 -9.744 7.300 3.134 1.00 1.00 H new ATOM 1374 N GLY B 247 -9.949 4.496 6.951 1.00 0.26 N ATOM 1375 CA GLY B 247 -9.633 3.546 8.056 1.00 0.25 C ATOM 1376 C GLY B 247 -8.455 2.660 7.641 1.00 0.25 C ATOM 1377 O GLY B 247 -8.502 1.452 7.749 1.00 0.29 O ATOM 0 H GLY B 247 -10.766 4.254 6.391 1.00 0.26 H new ATOM 0 HA2 GLY B 247 -9.387 4.096 8.964 1.00 0.25 H new ATOM 0 HA3 GLY B 247 -10.504 2.931 8.282 1.00 0.25 H new ATOM 1381 N ALA B 248 -7.398 3.260 7.168 1.00 0.22 N ATOM 1382 CA ALA B 248 -6.207 2.475 6.739 1.00 0.24 C ATOM 1383 C ALA B 248 -4.951 3.304 7.000 1.00 0.21 C ATOM 1384 O ALA B 248 -4.982 4.518 6.963 1.00 0.23 O ATOM 1385 CB ALA B 248 -6.314 2.164 5.246 1.00 0.29 C ATOM 0 H ALA B 248 -7.308 4.270 7.059 1.00 0.22 H new ATOM 0 HA ALA B 248 -6.156 1.540 7.298 1.00 0.24 H new ATOM 0 HB1 ALA B 248 -5.443 1.590 4.931 1.00 0.29 H new ATOM 0 HB2 ALA B 248 -7.218 1.584 5.059 1.00 0.29 H new ATOM 0 HB3 ALA B 248 -6.357 3.096 4.682 1.00 0.29 H new ATOM 1391 N VAL B 249 -3.846 2.664 7.267 1.00 0.20 N ATOM 1392 CA VAL B 249 -2.589 3.423 7.534 1.00 0.19 C ATOM 1393 C VAL B 249 -1.389 2.646 6.992 1.00 0.20 C ATOM 1394 O VAL B 249 -1.220 1.473 7.261 1.00 0.22 O ATOM 1395 CB VAL B 249 -2.427 3.632 9.044 1.00 0.18 C ATOM 1396 CG1 VAL B 249 -3.452 4.659 9.528 1.00 0.31 C ATOM 1397 CG2 VAL B 249 -2.652 2.308 9.782 1.00 0.30 C ATOM 0 H VAL B 249 -3.758 1.649 7.312 1.00 0.20 H new ATOM 0 HA VAL B 249 -2.642 4.392 7.037 1.00 0.19 H new ATOM 0 HB VAL B 249 -1.419 3.992 9.248 1.00 0.18 H new ATOM 0 HG11 VAL B 249 -3.338 4.809 10.602 1.00 0.31 H new ATOM 0 HG12 VAL B 249 -3.291 5.605 9.011 1.00 0.31 H new ATOM 0 HG13 VAL B 249 -4.458 4.296 9.317 1.00 0.31 H new ATOM 0 HG21 VAL B 249 -2.535 2.465 10.854 1.00 0.30 H new ATOM 0 HG22 VAL B 249 -3.658 1.943 9.576 1.00 0.30 H new ATOM 0 HG23 VAL B 249 -1.923 1.573 9.441 1.00 0.30 H new ATOM 1407 N VAL B 250 -0.548 3.295 6.230 1.00 0.21 N ATOM 1408 CA VAL B 250 0.652 2.601 5.678 1.00 0.23 C ATOM 1409 C VAL B 250 1.824 2.836 6.626 1.00 0.21 C ATOM 1410 O VAL B 250 2.053 3.941 7.077 1.00 0.22 O ATOM 1411 CB VAL B 250 1.004 3.164 4.297 1.00 0.27 C ATOM 1412 CG1 VAL B 250 2.260 2.466 3.777 1.00 0.27 C ATOM 1413 CG2 VAL B 250 -0.157 2.925 3.323 1.00 0.30 C ATOM 0 H VAL B 250 -0.641 4.276 5.966 1.00 0.21 H new ATOM 0 HA VAL B 250 0.443 1.536 5.581 1.00 0.23 H new ATOM 0 HB VAL B 250 1.184 4.236 4.378 1.00 0.27 H new ATOM 0 HG11 VAL B 250 2.516 2.862 2.794 1.00 0.27 H new ATOM 0 HG12 VAL B 250 3.086 2.643 4.466 1.00 0.27 H new ATOM 0 HG13 VAL B 250 2.075 1.395 3.699 1.00 0.27 H new ATOM 0 HG21 VAL B 250 0.101 3.328 2.344 1.00 0.30 H new ATOM 0 HG22 VAL B 250 -0.345 1.855 3.237 1.00 0.30 H new ATOM 0 HG23 VAL B 250 -1.053 3.422 3.696 1.00 0.30 H new ATOM 1423 N ILE B 251 2.564 1.805 6.942 1.00 0.20 N ATOM 1424 CA ILE B 251 3.721 1.960 7.873 1.00 0.19 C ATOM 1425 C ILE B 251 4.917 1.177 7.340 1.00 0.20 C ATOM 1426 O ILE B 251 4.840 0.522 6.319 1.00 0.24 O ATOM 1427 CB ILE B 251 3.335 1.416 9.251 1.00 0.16 C ATOM 1428 CG1 ILE B 251 2.969 -0.068 9.122 1.00 0.19 C ATOM 1429 CG2 ILE B 251 2.136 2.201 9.796 1.00 0.17 C ATOM 1430 CD1 ILE B 251 2.368 -0.575 10.437 1.00 0.19 C ATOM 0 H ILE B 251 2.416 0.858 6.593 1.00 0.20 H new ATOM 0 HA ILE B 251 3.985 3.015 7.952 1.00 0.19 H new ATOM 0 HB ILE B 251 4.174 1.525 9.938 1.00 0.16 H new ATOM 0 HG12 ILE B 251 2.256 -0.206 8.309 1.00 0.19 H new ATOM 0 HG13 ILE B 251 3.856 -0.649 8.870 1.00 0.19 H new ATOM 0 HG21 ILE B 251 1.862 1.813 10.777 1.00 0.17 H new ATOM 0 HG22 ILE B 251 2.401 3.255 9.884 1.00 0.17 H new ATOM 0 HG23 ILE B 251 1.291 2.094 9.115 1.00 0.17 H new ATOM 0 HD11 ILE B 251 2.111 -1.629 10.337 1.00 0.19 H new ATOM 0 HD12 ILE B 251 3.095 -0.453 11.240 1.00 0.19 H new ATOM 0 HD13 ILE B 251 1.470 -0.003 10.671 1.00 0.19 H new ATOM 1442 N GLN B 252 6.025 1.233 8.028 1.00 0.20 N ATOM 1443 CA GLN B 252 7.234 0.483 7.575 1.00 0.23 C ATOM 1444 C GLN B 252 7.996 -0.021 8.800 1.00 0.24 C ATOM 1445 O GLN B 252 8.579 0.748 9.537 1.00 0.27 O ATOM 1446 CB GLN B 252 8.149 1.404 6.754 1.00 0.28 C ATOM 1447 CG GLN B 252 9.136 0.563 5.939 1.00 0.31 C ATOM 1448 CD GLN B 252 10.163 1.486 5.279 1.00 0.98 C ATOM 1449 OE1 GLN B 252 10.020 1.814 4.023 1.00 1.69 O flip ATOM 1450 NE2 GLN B 252 11.105 1.914 5.915 1.00 1.81 N flip ATOM 0 H GLN B 252 6.146 1.768 8.888 1.00 0.20 H new ATOM 0 HA GLN B 252 6.924 -0.357 6.954 1.00 0.23 H new ATOM 0 HB2 GLN B 252 7.551 2.026 6.088 1.00 0.28 H new ATOM 0 HB3 GLN B 252 8.692 2.077 7.417 1.00 0.28 H new ATOM 0 HG2 GLN B 252 9.639 -0.156 6.585 1.00 0.31 H new ATOM 0 HG3 GLN B 252 8.603 -0.009 5.179 1.00 0.31 H new ATOM 0 HE21 GLN B 252 11.217 1.658 6.896 1.00 1.81 H new ATOM 0 HE22 GLN B 252 11.784 2.530 5.468 1.00 1.81 H new ATOM 1459 N ASP B 253 8.013 -1.306 9.018 1.00 0.26 N ATOM 1460 CA ASP B 253 8.761 -1.850 10.187 1.00 0.30 C ATOM 1461 C ASP B 253 10.189 -2.114 9.725 1.00 0.32 C ATOM 1462 O ASP B 253 11.068 -1.294 9.903 1.00 0.35 O ATOM 1463 CB ASP B 253 8.109 -3.154 10.659 1.00 0.36 C ATOM 1464 CG ASP B 253 8.865 -3.693 11.875 1.00 0.49 C ATOM 1465 OD1 ASP B 253 9.101 -2.922 12.791 1.00 1.18 O ATOM 1466 OD2 ASP B 253 9.196 -4.867 11.870 1.00 1.18 O ATOM 0 H ASP B 253 7.543 -2.002 8.439 1.00 0.26 H new ATOM 0 HA ASP B 253 8.751 -1.146 11.019 1.00 0.30 H new ATOM 0 HB2 ASP B 253 7.064 -2.978 10.916 1.00 0.36 H new ATOM 0 HB3 ASP B 253 8.120 -3.890 9.855 1.00 0.36 H new ATOM 1471 N ASN B 254 10.422 -3.224 9.089 1.00 0.33 N ATOM 1472 CA ASN B 254 11.786 -3.497 8.571 1.00 0.37 C ATOM 1473 C ASN B 254 11.934 -2.693 7.282 1.00 0.34 C ATOM 1474 O ASN B 254 11.479 -1.569 7.197 1.00 0.37 O ATOM 1475 CB ASN B 254 11.938 -4.990 8.272 1.00 0.42 C ATOM 1476 CG ASN B 254 11.535 -5.802 9.504 1.00 1.22 C ATOM 1477 OD1 ASN B 254 10.579 -6.549 9.469 1.00 1.97 O ATOM 1478 ND2 ASN B 254 12.233 -5.687 10.601 1.00 1.89 N ATOM 0 H ASN B 254 9.730 -3.951 8.906 1.00 0.33 H new ATOM 0 HA ASN B 254 12.548 -3.218 9.299 1.00 0.37 H new ATOM 0 HB2 ASN B 254 11.315 -5.266 7.422 1.00 0.42 H new ATOM 0 HB3 ASN B 254 12.969 -5.213 7.998 1.00 0.42 H new ATOM 0 HD21 ASN B 254 11.975 -6.225 11.428 1.00 1.89 H new ATOM 0 HD22 ASN B 254 13.036 -5.059 10.631 1.00 1.89 H new ATOM 1485 N SER B 255 12.532 -3.254 6.266 1.00 0.35 N ATOM 1486 CA SER B 255 12.666 -2.513 4.975 1.00 0.37 C ATOM 1487 C SER B 255 11.549 -2.970 4.035 1.00 0.38 C ATOM 1488 O SER B 255 11.792 -3.435 2.939 1.00 0.43 O ATOM 1489 CB SER B 255 14.025 -2.820 4.345 1.00 0.42 C ATOM 1490 OG SER B 255 15.055 -2.303 5.178 1.00 1.38 O ATOM 0 H SER B 255 12.933 -4.192 6.272 1.00 0.35 H new ATOM 0 HA SER B 255 12.592 -1.440 5.150 1.00 0.37 H new ATOM 0 HB2 SER B 255 14.147 -3.896 4.221 1.00 0.42 H new ATOM 0 HB3 SER B 255 14.087 -2.376 3.352 1.00 0.42 H new ATOM 0 HG SER B 255 15.928 -2.499 4.779 1.00 1.38 H new ATOM 1496 N ASP B 256 10.323 -2.850 4.470 1.00 0.35 N ATOM 1497 CA ASP B 256 9.173 -3.282 3.624 1.00 0.38 C ATOM 1498 C ASP B 256 7.918 -2.525 4.061 1.00 0.34 C ATOM 1499 O ASP B 256 7.552 -2.524 5.220 1.00 0.31 O ATOM 1500 CB ASP B 256 8.949 -4.788 3.794 1.00 0.42 C ATOM 1501 CG ASP B 256 10.014 -5.556 3.009 1.00 0.47 C ATOM 1502 OD1 ASP B 256 10.231 -5.219 1.857 1.00 1.12 O ATOM 1503 OD2 ASP B 256 10.595 -6.469 3.573 1.00 1.12 O ATOM 0 H ASP B 256 10.068 -2.469 5.381 1.00 0.35 H new ATOM 0 HA ASP B 256 9.386 -3.066 2.577 1.00 0.38 H new ATOM 0 HB2 ASP B 256 8.996 -5.056 4.849 1.00 0.42 H new ATOM 0 HB3 ASP B 256 7.955 -5.060 3.440 1.00 0.42 H new ATOM 1508 N ILE B 257 7.260 -1.867 3.142 1.00 0.36 N ATOM 1509 CA ILE B 257 6.030 -1.098 3.497 1.00 0.34 C ATOM 1510 C ILE B 257 4.796 -1.977 3.286 1.00 0.35 C ATOM 1511 O ILE B 257 4.673 -2.659 2.287 1.00 0.39 O ATOM 1512 CB ILE B 257 5.947 0.143 2.606 1.00 0.37 C ATOM 1513 CG1 ILE B 257 7.196 1.000 2.855 1.00 0.37 C ATOM 1514 CG2 ILE B 257 4.686 0.938 2.952 1.00 0.35 C ATOM 1515 CD1 ILE B 257 7.228 2.205 1.899 1.00 0.48 C ATOM 0 H ILE B 257 7.523 -1.829 2.157 1.00 0.36 H new ATOM 0 HA ILE B 257 6.071 -0.794 4.543 1.00 0.34 H new ATOM 0 HB ILE B 257 5.900 -0.145 1.556 1.00 0.37 H new ATOM 0 HG12 ILE B 257 7.204 1.348 3.888 1.00 0.37 H new ATOM 0 HG13 ILE B 257 8.092 0.395 2.716 1.00 0.37 H new ATOM 0 HG21 ILE B 257 4.627 1.822 2.317 1.00 0.35 H new ATOM 0 HG22 ILE B 257 3.807 0.315 2.789 1.00 0.35 H new ATOM 0 HG23 ILE B 257 4.724 1.244 3.997 1.00 0.35 H new ATOM 0 HD11 ILE B 257 8.121 2.799 2.092 1.00 0.48 H new ATOM 0 HD12 ILE B 257 7.244 1.851 0.868 1.00 0.48 H new ATOM 0 HD13 ILE B 257 6.342 2.820 2.058 1.00 0.48 H new ATOM 1527 N LYS B 258 3.884 -1.973 4.229 1.00 0.32 N ATOM 1528 CA LYS B 258 2.654 -2.816 4.103 1.00 0.34 C ATOM 1529 C LYS B 258 1.427 -2.006 4.524 1.00 0.30 C ATOM 1530 O LYS B 258 1.537 -0.961 5.136 1.00 0.28 O ATOM 1531 CB LYS B 258 2.789 -4.039 5.014 1.00 0.35 C ATOM 1532 CG LYS B 258 3.845 -4.986 4.442 1.00 0.43 C ATOM 1533 CD LYS B 258 3.982 -6.208 5.351 1.00 0.44 C ATOM 1534 CE LYS B 258 5.197 -7.033 4.920 1.00 1.42 C ATOM 1535 NZ LYS B 258 4.975 -7.561 3.544 1.00 2.13 N ATOM 0 H LYS B 258 3.940 -1.419 5.084 1.00 0.32 H new ATOM 0 HA LYS B 258 2.537 -3.135 3.067 1.00 0.34 H new ATOM 0 HB2 LYS B 258 3.071 -3.727 6.020 1.00 0.35 H new ATOM 0 HB3 LYS B 258 1.831 -4.552 5.096 1.00 0.35 H new ATOM 0 HG2 LYS B 258 3.563 -5.298 3.436 1.00 0.43 H new ATOM 0 HG3 LYS B 258 4.803 -4.472 4.359 1.00 0.43 H new ATOM 0 HD2 LYS B 258 4.093 -5.892 6.388 1.00 0.44 H new ATOM 0 HD3 LYS B 258 3.079 -6.816 5.298 1.00 0.44 H new ATOM 0 HE2 LYS B 258 6.096 -6.417 4.944 1.00 1.42 H new ATOM 0 HE3 LYS B 258 5.356 -7.857 5.616 1.00 1.42 H new ATOM 0 HZ1 LYS B 258 5.684 -8.292 3.334 1.00 2.13 H new ATOM 0 HZ2 LYS B 258 4.023 -7.974 3.480 1.00 2.13 H new ATOM 0 HZ3 LYS B 258 5.063 -6.786 2.856 1.00 2.13 H new ATOM 1549 N VAL B 259 0.253 -2.486 4.198 1.00 0.31 N ATOM 1550 CA VAL B 259 -1.003 -1.760 4.570 1.00 0.29 C ATOM 1551 C VAL B 259 -1.659 -2.446 5.770 1.00 0.28 C ATOM 1552 O VAL B 259 -1.693 -3.658 5.862 1.00 0.31 O ATOM 1553 CB VAL B 259 -1.965 -1.783 3.379 1.00 0.30 C ATOM 1554 CG1 VAL B 259 -3.069 -0.743 3.584 1.00 0.29 C ATOM 1555 CG2 VAL B 259 -1.192 -1.456 2.100 1.00 0.34 C ATOM 0 H VAL B 259 0.109 -3.356 3.686 1.00 0.31 H new ATOM 0 HA VAL B 259 -0.766 -0.729 4.833 1.00 0.29 H new ATOM 0 HB VAL B 259 -2.414 -2.773 3.296 1.00 0.30 H new ATOM 0 HG11 VAL B 259 -3.751 -0.764 2.734 1.00 0.29 H new ATOM 0 HG12 VAL B 259 -3.620 -0.972 4.496 1.00 0.29 H new ATOM 0 HG13 VAL B 259 -2.624 0.248 3.668 1.00 0.29 H new ATOM 0 HG21 VAL B 259 -1.873 -1.471 1.249 1.00 0.34 H new ATOM 0 HG22 VAL B 259 -0.744 -0.466 2.189 1.00 0.34 H new ATOM 0 HG23 VAL B 259 -0.407 -2.197 1.950 1.00 0.34 H new ATOM 1565 N VAL B 260 -2.183 -1.675 6.691 1.00 0.26 N ATOM 1566 CA VAL B 260 -2.846 -2.259 7.897 1.00 0.27 C ATOM 1567 C VAL B 260 -4.148 -1.471 8.176 1.00 0.25 C ATOM 1568 O VAL B 260 -4.103 -0.257 8.220 1.00 0.22 O ATOM 1569 CB VAL B 260 -1.896 -2.109 9.095 1.00 0.28 C ATOM 1570 CG1 VAL B 260 -2.578 -2.576 10.385 1.00 0.34 C ATOM 1571 CG2 VAL B 260 -0.647 -2.959 8.857 1.00 0.29 C ATOM 0 H VAL B 260 -2.179 -0.656 6.658 1.00 0.26 H new ATOM 0 HA VAL B 260 -3.078 -3.312 7.735 1.00 0.27 H new ATOM 0 HB VAL B 260 -1.625 -1.058 9.197 1.00 0.28 H new ATOM 0 HG11 VAL B 260 -1.890 -2.462 11.222 1.00 0.34 H new ATOM 0 HG12 VAL B 260 -3.469 -1.974 10.564 1.00 0.34 H new ATOM 0 HG13 VAL B 260 -2.861 -3.624 10.288 1.00 0.34 H new ATOM 0 HG21 VAL B 260 0.030 -2.856 9.705 1.00 0.29 H new ATOM 0 HG22 VAL B 260 -0.934 -4.005 8.747 1.00 0.29 H new ATOM 0 HG23 VAL B 260 -0.146 -2.623 7.949 1.00 0.29 H new ATOM 1581 N PRO B 261 -5.278 -2.141 8.373 1.00 0.29 N ATOM 1582 CA PRO B 261 -6.532 -1.422 8.663 1.00 0.29 C ATOM 1583 C PRO B 261 -6.341 -0.531 9.901 1.00 0.24 C ATOM 1584 O PRO B 261 -5.612 -0.868 10.812 1.00 0.23 O ATOM 1585 CB PRO B 261 -7.586 -2.525 8.919 1.00 0.37 C ATOM 1586 CG PRO B 261 -6.901 -3.892 8.642 1.00 0.42 C ATOM 1587 CD PRO B 261 -5.415 -3.617 8.320 1.00 0.36 C ATOM 0 HA PRO B 261 -6.841 -0.768 7.848 1.00 0.29 H new ATOM 0 HB2 PRO B 261 -7.949 -2.478 9.946 1.00 0.37 H new ATOM 0 HB3 PRO B 261 -8.450 -2.389 8.268 1.00 0.37 H new ATOM 0 HG2 PRO B 261 -6.989 -4.547 9.509 1.00 0.42 H new ATOM 0 HG3 PRO B 261 -7.385 -4.400 7.808 1.00 0.42 H new ATOM 0 HD2 PRO B 261 -4.758 -4.101 9.043 1.00 0.36 H new ATOM 0 HD3 PRO B 261 -5.146 -4.003 7.337 1.00 0.36 H new ATOM 1595 N ARG B 262 -6.996 0.595 9.941 1.00 0.26 N ATOM 1596 CA ARG B 262 -6.852 1.502 11.113 1.00 0.27 C ATOM 1597 C ARG B 262 -7.421 0.828 12.369 1.00 0.29 C ATOM 1598 O ARG B 262 -6.956 1.052 13.469 1.00 0.34 O ATOM 1599 CB ARG B 262 -7.619 2.801 10.843 1.00 0.34 C ATOM 1600 CG ARG B 262 -7.668 3.649 12.119 1.00 0.59 C ATOM 1601 CD ARG B 262 -8.053 5.087 11.772 1.00 1.04 C ATOM 1602 NE ARG B 262 -8.334 5.837 13.029 1.00 1.76 N ATOM 1603 CZ ARG B 262 -8.385 7.140 13.013 1.00 2.19 C ATOM 1604 NH1 ARG B 262 -8.196 7.787 11.895 1.00 2.31 N ATOM 1605 NH2 ARG B 262 -8.625 7.796 14.116 1.00 3.11 N ATOM 0 H ARG B 262 -7.626 0.927 9.211 1.00 0.26 H new ATOM 0 HA ARG B 262 -5.796 1.721 11.271 1.00 0.27 H new ATOM 0 HB2 ARG B 262 -7.135 3.360 10.042 1.00 0.34 H new ATOM 0 HB3 ARG B 262 -8.631 2.574 10.507 1.00 0.34 H new ATOM 0 HG2 ARG B 262 -8.390 3.228 12.818 1.00 0.59 H new ATOM 0 HG3 ARG B 262 -6.697 3.632 12.615 1.00 0.59 H new ATOM 0 HD2 ARG B 262 -7.246 5.569 11.220 1.00 1.04 H new ATOM 0 HD3 ARG B 262 -8.931 5.095 11.126 1.00 1.04 H new ATOM 0 HE ARG B 262 -8.486 5.331 13.902 1.00 1.76 H new ATOM 0 HH11 ARG B 262 -8.008 7.273 11.034 1.00 2.31 H new ATOM 0 HH12 ARG B 262 -8.236 8.806 11.883 1.00 2.31 H new ATOM 0 HH21 ARG B 262 -8.772 7.289 14.989 1.00 3.11 H new ATOM 0 HH22 ARG B 262 -8.665 8.815 14.105 1.00 3.11 H new ATOM 1619 N ARG B 263 -8.439 0.025 12.216 1.00 0.33 N ATOM 1620 CA ARG B 263 -9.054 -0.643 13.401 1.00 0.39 C ATOM 1621 C ARG B 263 -8.111 -1.705 13.980 1.00 0.39 C ATOM 1622 O ARG B 263 -8.395 -2.292 15.005 1.00 0.48 O ATOM 1623 CB ARG B 263 -10.373 -1.301 12.988 1.00 0.47 C ATOM 1624 CG ARG B 263 -11.385 -0.224 12.582 1.00 1.31 C ATOM 1625 CD ARG B 263 -12.792 -0.826 12.558 1.00 1.59 C ATOM 1626 NE ARG B 263 -13.761 0.198 12.072 1.00 2.29 N ATOM 1627 CZ ARG B 263 -14.958 -0.164 11.696 1.00 2.90 C ATOM 1628 NH1 ARG B 263 -15.308 -1.419 11.753 1.00 3.06 N ATOM 1629 NH2 ARG B 263 -15.804 0.731 11.266 1.00 3.82 N ATOM 0 H ARG B 263 -8.873 -0.198 11.320 1.00 0.33 H new ATOM 0 HA ARG B 263 -9.238 0.110 14.167 1.00 0.39 H new ATOM 0 HB2 ARG B 263 -10.204 -1.986 12.157 1.00 0.47 H new ATOM 0 HB3 ARG B 263 -10.769 -1.893 13.813 1.00 0.47 H new ATOM 0 HG2 ARG B 263 -11.347 0.609 13.284 1.00 1.31 H new ATOM 0 HG3 ARG B 263 -11.132 0.175 11.600 1.00 1.31 H new ATOM 0 HD2 ARG B 263 -12.814 -1.701 11.908 1.00 1.59 H new ATOM 0 HD3 ARG B 263 -13.072 -1.163 13.556 1.00 1.59 H new ATOM 0 HE ARG B 263 -13.489 1.180 12.033 1.00 2.29 H new ATOM 0 HH11 ARG B 263 -14.647 -2.118 12.091 1.00 3.06 H new ATOM 0 HH12 ARG B 263 -16.243 -1.702 11.459 1.00 3.06 H new ATOM 0 HH21 ARG B 263 -15.530 1.713 11.224 1.00 3.82 H new ATOM 0 HH22 ARG B 263 -16.739 0.449 10.972 1.00 3.82 H new ATOM 1643 N LYS B 264 -6.992 -1.953 13.341 1.00 0.35 N ATOM 1644 CA LYS B 264 -6.023 -2.978 13.861 1.00 0.42 C ATOM 1645 C LYS B 264 -4.693 -2.293 14.172 1.00 0.35 C ATOM 1646 O LYS B 264 -3.671 -2.936 14.334 1.00 0.38 O ATOM 1647 CB LYS B 264 -5.794 -4.061 12.800 1.00 0.53 C ATOM 1648 CG LYS B 264 -7.131 -4.677 12.368 1.00 0.85 C ATOM 1649 CD LYS B 264 -7.861 -5.267 13.584 1.00 0.95 C ATOM 1650 CE LYS B 264 -8.900 -6.293 13.119 1.00 1.28 C ATOM 1651 NZ LYS B 264 -9.955 -5.605 12.322 1.00 2.08 N ATOM 0 H LYS B 264 -6.705 -1.490 12.479 1.00 0.35 H new ATOM 0 HA LYS B 264 -6.429 -3.436 14.763 1.00 0.42 H new ATOM 0 HB2 LYS B 264 -5.288 -3.631 11.936 1.00 0.53 H new ATOM 0 HB3 LYS B 264 -5.140 -4.837 13.198 1.00 0.53 H new ATOM 0 HG2 LYS B 264 -7.753 -3.918 11.894 1.00 0.85 H new ATOM 0 HG3 LYS B 264 -6.958 -5.456 11.625 1.00 0.85 H new ATOM 0 HD2 LYS B 264 -7.144 -5.740 14.255 1.00 0.95 H new ATOM 0 HD3 LYS B 264 -8.349 -4.472 14.148 1.00 0.95 H new ATOM 0 HE2 LYS B 264 -8.420 -7.065 12.518 1.00 1.28 H new ATOM 0 HE3 LYS B 264 -9.346 -6.791 13.980 1.00 1.28 H new ATOM 0 HZ1 LYS B 264 -10.758 -6.250 12.179 1.00 2.08 H new ATOM 0 HZ2 LYS B 264 -10.278 -4.758 12.831 1.00 2.08 H new ATOM 0 HZ3 LYS B 264 -9.566 -5.326 11.399 1.00 2.08 H new ATOM 1665 N ALA B 265 -4.705 -0.987 14.268 1.00 0.30 N ATOM 1666 CA ALA B 265 -3.452 -0.232 14.570 1.00 0.27 C ATOM 1667 C ALA B 265 -3.751 0.859 15.602 1.00 0.28 C ATOM 1668 O ALA B 265 -4.891 1.107 15.944 1.00 0.32 O ATOM 1669 CB ALA B 265 -2.931 0.415 13.282 1.00 0.26 C ATOM 0 H ALA B 265 -5.536 -0.408 14.149 1.00 0.30 H new ATOM 0 HA ALA B 265 -2.700 -0.913 14.969 1.00 0.27 H new ATOM 0 HB1 ALA B 265 -2.016 0.968 13.497 1.00 0.26 H new ATOM 0 HB2 ALA B 265 -2.722 -0.360 12.544 1.00 0.26 H new ATOM 0 HB3 ALA B 265 -3.683 1.098 12.888 1.00 0.26 H new ATOM 1675 N LYS B 266 -2.734 1.515 16.097 1.00 0.26 N ATOM 1676 CA LYS B 266 -2.945 2.593 17.114 1.00 0.29 C ATOM 1677 C LYS B 266 -2.006 3.764 16.812 1.00 0.27 C ATOM 1678 O LYS B 266 -0.820 3.587 16.620 1.00 0.25 O ATOM 1679 CB LYS B 266 -2.643 2.031 18.512 1.00 0.34 C ATOM 1680 CG LYS B 266 -3.832 1.185 18.996 1.00 0.42 C ATOM 1681 CD LYS B 266 -3.386 0.203 20.088 1.00 0.50 C ATOM 1682 CE LYS B 266 -2.514 0.908 21.136 1.00 1.09 C ATOM 1683 NZ LYS B 266 -2.578 0.150 22.419 1.00 1.79 N ATOM 0 H LYS B 266 -1.761 1.351 15.840 1.00 0.26 H new ATOM 0 HA LYS B 266 -3.977 2.941 17.078 1.00 0.29 H new ATOM 0 HB2 LYS B 266 -1.739 1.423 18.483 1.00 0.34 H new ATOM 0 HB3 LYS B 266 -2.456 2.847 19.210 1.00 0.34 H new ATOM 0 HG2 LYS B 266 -4.615 1.837 19.383 1.00 0.42 H new ATOM 0 HG3 LYS B 266 -4.260 0.635 18.157 1.00 0.42 H new ATOM 0 HD2 LYS B 266 -4.261 -0.232 20.571 1.00 0.50 H new ATOM 0 HD3 LYS B 266 -2.828 -0.618 19.638 1.00 0.50 H new ATOM 0 HE2 LYS B 266 -1.483 0.969 20.787 1.00 1.09 H new ATOM 0 HE3 LYS B 266 -2.861 1.930 21.286 1.00 1.09 H new ATOM 0 HZ1 LYS B 266 -1.988 0.624 23.132 1.00 1.79 H new ATOM 0 HZ2 LYS B 266 -3.563 0.114 22.752 1.00 1.79 H new ATOM 0 HZ3 LYS B 266 -2.228 -0.818 22.268 1.00 1.79 H new ATOM 1697 N ILE B 267 -2.531 4.961 16.761 1.00 0.30 N ATOM 1698 CA ILE B 267 -1.675 6.150 16.465 1.00 0.32 C ATOM 1699 C ILE B 267 -1.096 6.709 17.768 1.00 0.37 C ATOM 1700 O ILE B 267 -1.793 7.331 18.546 1.00 0.41 O ATOM 1701 CB ILE B 267 -2.527 7.235 15.792 1.00 0.36 C ATOM 1702 CG1 ILE B 267 -3.307 6.624 14.611 1.00 0.36 C ATOM 1703 CG2 ILE B 267 -1.630 8.396 15.312 1.00 0.39 C ATOM 1704 CD1 ILE B 267 -2.365 5.855 13.678 1.00 0.45 C ATOM 0 H ILE B 267 -3.518 5.167 16.912 1.00 0.30 H new ATOM 0 HA ILE B 267 -0.862 5.850 15.803 1.00 0.32 H new ATOM 0 HB ILE B 267 -3.240 7.632 16.514 1.00 0.36 H new ATOM 0 HG12 ILE B 267 -4.080 5.954 14.987 1.00 0.36 H new ATOM 0 HG13 ILE B 267 -3.812 7.414 14.055 1.00 0.36 H new ATOM 0 HG21 ILE B 267 -2.246 9.159 14.836 1.00 0.39 H new ATOM 0 HG22 ILE B 267 -1.109 8.830 16.165 1.00 0.39 H new ATOM 0 HG23 ILE B 267 -0.901 8.020 14.595 1.00 0.39 H new ATOM 0 HD11 ILE B 267 -2.937 5.432 12.852 1.00 0.45 H new ATOM 0 HD12 ILE B 267 -1.608 6.534 13.286 1.00 0.45 H new ATOM 0 HD13 ILE B 267 -1.880 5.051 14.232 1.00 0.45 H new ATOM 1716 N ILE B 268 0.177 6.503 18.006 1.00 0.38 N ATOM 1717 CA ILE B 268 0.818 7.032 19.254 1.00 0.45 C ATOM 1718 C ILE B 268 1.694 8.231 18.891 1.00 0.48 C ATOM 1719 O ILE B 268 2.146 8.365 17.773 1.00 0.47 O ATOM 1720 CB ILE B 268 1.711 5.958 19.895 1.00 0.48 C ATOM 1721 CG1 ILE B 268 0.964 4.611 20.007 1.00 0.50 C ATOM 1722 CG2 ILE B 268 2.159 6.426 21.286 1.00 0.55 C ATOM 1723 CD1 ILE B 268 -0.021 4.620 21.185 1.00 0.57 C ATOM 0 H ILE B 268 0.804 5.989 17.387 1.00 0.38 H new ATOM 0 HA ILE B 268 0.036 7.320 19.957 1.00 0.45 H new ATOM 0 HB ILE B 268 2.584 5.809 19.260 1.00 0.48 H new ATOM 0 HG12 ILE B 268 0.425 4.412 19.080 1.00 0.50 H new ATOM 0 HG13 ILE B 268 1.683 3.803 20.137 1.00 0.50 H new ATOM 0 HG21 ILE B 268 2.792 5.664 21.740 1.00 0.55 H new ATOM 0 HG22 ILE B 268 2.720 7.356 21.194 1.00 0.55 H new ATOM 0 HG23 ILE B 268 1.283 6.591 21.914 1.00 0.55 H new ATOM 0 HD11 ILE B 268 -0.532 3.659 21.239 1.00 0.57 H new ATOM 0 HD12 ILE B 268 0.523 4.794 22.113 1.00 0.57 H new ATOM 0 HD13 ILE B 268 -0.754 5.413 21.040 1.00 0.57 H new ATOM 1735 N ARG B 269 1.947 9.097 19.834 1.00 0.56 N ATOM 1736 CA ARG B 269 2.807 10.288 19.557 1.00 0.62 C ATOM 1737 C ARG B 269 4.264 9.940 19.869 1.00 0.66 C ATOM 1738 O ARG B 269 4.548 9.168 20.764 1.00 0.73 O ATOM 1739 CB ARG B 269 2.360 11.456 20.441 1.00 0.73 C ATOM 1740 CG ARG B 269 2.942 12.764 19.899 1.00 1.49 C ATOM 1741 CD ARG B 269 2.442 13.939 20.744 1.00 1.80 C ATOM 1742 NE ARG B 269 2.632 15.209 19.987 1.00 2.22 N ATOM 1743 CZ ARG B 269 2.028 16.298 20.374 1.00 2.82 C ATOM 1744 NH1 ARG B 269 1.257 16.277 21.428 1.00 3.12 N ATOM 1745 NH2 ARG B 269 2.193 17.407 19.709 1.00 3.62 N ATOM 0 H ARG B 269 1.595 9.033 20.789 1.00 0.56 H new ATOM 0 HA ARG B 269 2.715 10.572 18.509 1.00 0.62 H new ATOM 0 HB2 ARG B 269 1.272 11.512 20.463 1.00 0.73 H new ATOM 0 HB3 ARG B 269 2.692 11.296 21.467 1.00 0.73 H new ATOM 0 HG2 ARG B 269 4.031 12.725 19.920 1.00 1.49 H new ATOM 0 HG3 ARG B 269 2.648 12.901 18.858 1.00 1.49 H new ATOM 0 HD2 ARG B 269 1.389 13.803 20.989 1.00 1.80 H new ATOM 0 HD3 ARG B 269 2.986 13.980 21.688 1.00 1.80 H new ATOM 0 HE ARG B 269 3.236 15.226 19.165 1.00 2.22 H new ATOM 0 HH11 ARG B 269 1.128 15.409 21.948 1.00 3.12 H new ATOM 0 HH12 ARG B 269 0.784 17.129 21.731 1.00 3.12 H new ATOM 0 HH21 ARG B 269 2.795 17.423 18.886 1.00 3.62 H new ATOM 0 HH22 ARG B 269 1.720 18.259 20.012 1.00 3.62 H new ATOM 1759 N ASP B 270 5.194 10.506 19.147 1.00 0.67 N ATOM 1760 CA ASP B 270 6.633 10.205 19.414 1.00 0.74 C ATOM 1761 C ASP B 270 7.165 11.163 20.482 1.00 1.18 C ATOM 1762 O ASP B 270 7.978 10.734 21.283 1.00 1.73 O ATOM 1763 CB ASP B 270 7.438 10.385 18.126 1.00 0.90 C ATOM 1764 CG ASP B 270 7.165 9.210 17.185 1.00 1.47 C ATOM 1765 OD1 ASP B 270 6.082 8.653 17.264 1.00 2.04 O ATOM 1766 OD2 ASP B 270 8.042 8.888 16.401 1.00 2.05 O ATOM 1767 OXT ASP B 270 6.748 12.310 20.480 1.00 1.84 O ATOM 0 H ASP B 270 5.021 11.162 18.385 1.00 0.67 H new ATOM 0 HA ASP B 270 6.730 9.178 19.765 1.00 0.74 H new ATOM 0 HB2 ASP B 270 7.165 11.323 17.642 1.00 0.90 H new ATOM 0 HB3 ASP B 270 8.502 10.442 18.355 1.00 0.90 H new TER 1772 ASP B 270