USER MOD reduce.3.24.130724 H: found=0, std=0, add=902, rem=0, adj=14 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 Set 1.1: B 254 ASN : amide:sc= 0.831 K(o=0.99,f=-3.8!) USER MOD Set 1.2: B 255 SER OG : rot -61:sc= 0.162 USER MOD Set 2.1: A 254 ASN : amide:sc= 0.849 K(o=1,f=-3.7!) USER MOD Set 2.2: A 255 SER OG : rot -61:sc= 0.195 USER MOD Single : A 219 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 221 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 222 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 226 TYR OH : rot 180:sc= 0.274 USER MOD Single : A 227 TYR OH : rot -150:sc= -1.97 USER MOD Single : A 230 SER OG : rot -29:sc= 0.354 USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 240 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.249) USER MOD Single : A 244 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 252 GLN :FLIP amide:sc= 0 F(o=-3!,f=0) USER MOD Single : A 258 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 264 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 266 LYS NZ :NH3+ -160:sc= 0.0936 (180deg=-0.877) USER MOD Single : B 219 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 221 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 222 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 226 TYR OH : rot 180:sc= 0.276 USER MOD Single : B 227 TYR OH : rot -150:sc= -1.94 USER MOD Single : B 230 SER OG : rot -37:sc= 0.257 USER MOD Single : B 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 240 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.198) USER MOD Single : B 244 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 252 GLN :FLIP amide:sc= 0 F(o=-3!,f=0) USER MOD Single : B 258 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 264 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 266 LYS NZ :NH3+ -159:sc= 0.0877 (180deg=-0.859) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 219 3.766 17.864 -2.350 1.00 1.77 N ATOM 2 CA MET A 219 2.341 17.547 -2.651 1.00 1.15 C ATOM 3 C MET A 219 2.242 16.915 -4.040 1.00 1.04 C ATOM 4 O MET A 219 2.771 17.428 -5.005 1.00 1.10 O ATOM 5 CB MET A 219 1.513 18.835 -2.615 1.00 1.82 C ATOM 6 CG MET A 219 2.039 19.813 -3.667 1.00 2.31 C ATOM 7 SD MET A 219 1.401 21.472 -3.321 1.00 3.45 S ATOM 8 CE MET A 219 2.672 22.395 -4.218 1.00 3.82 C ATOM 0 HA MET A 219 1.959 16.849 -1.906 1.00 1.15 H new ATOM 0 HB2 MET A 219 0.464 18.610 -2.805 1.00 1.82 H new ATOM 0 HB3 MET A 219 1.567 19.287 -1.624 1.00 1.82 H new ATOM 0 HG2 MET A 219 3.129 19.822 -3.658 1.00 2.31 H new ATOM 0 HG3 MET A 219 1.731 19.493 -4.662 1.00 2.31 H new ATOM 0 HE1 MET A 219 2.472 23.463 -4.136 1.00 3.82 H new ATOM 0 HE2 MET A 219 3.651 22.176 -3.791 1.00 3.82 H new ATOM 0 HE3 MET A 219 2.661 22.103 -5.268 1.00 3.82 H new ATOM 18 N ILE A 220 1.567 15.802 -4.151 1.00 0.98 N ATOM 19 CA ILE A 220 1.435 15.136 -5.481 1.00 0.97 C ATOM 20 C ILE A 220 0.287 15.789 -6.260 1.00 0.94 C ATOM 21 O ILE A 220 -0.765 16.068 -5.717 1.00 1.01 O ATOM 22 CB ILE A 220 1.140 13.642 -5.277 1.00 1.03 C ATOM 23 CG1 ILE A 220 0.981 12.939 -6.637 1.00 1.35 C ATOM 24 CG2 ILE A 220 -0.156 13.486 -4.479 1.00 1.78 C ATOM 25 CD1 ILE A 220 2.268 13.080 -7.462 1.00 2.08 C ATOM 0 H ILE A 220 1.101 15.325 -3.379 1.00 0.98 H new ATOM 0 HA ILE A 220 2.363 15.245 -6.042 1.00 0.97 H new ATOM 0 HB ILE A 220 1.970 13.189 -4.735 1.00 1.03 H new ATOM 0 HG12 ILE A 220 0.752 11.884 -6.485 1.00 1.35 H new ATOM 0 HG13 ILE A 220 0.142 13.372 -7.182 1.00 1.35 H new ATOM 0 HG21 ILE A 220 -0.368 12.427 -4.333 1.00 1.78 H new ATOM 0 HG22 ILE A 220 -0.047 13.972 -3.509 1.00 1.78 H new ATOM 0 HG23 ILE A 220 -0.978 13.948 -5.026 1.00 1.78 H new ATOM 0 HD11 ILE A 220 2.142 12.578 -8.421 1.00 2.08 H new ATOM 0 HD12 ILE A 220 2.479 14.136 -7.630 1.00 2.08 H new ATOM 0 HD13 ILE A 220 3.098 12.626 -6.921 1.00 2.08 H new ATOM 37 N GLN A 221 0.481 16.037 -7.527 1.00 0.90 N ATOM 38 CA GLN A 221 -0.596 16.671 -8.347 1.00 0.92 C ATOM 39 C GLN A 221 -1.511 15.579 -8.906 1.00 0.83 C ATOM 40 O GLN A 221 -1.722 14.556 -8.287 1.00 0.85 O ATOM 41 CB GLN A 221 0.032 17.453 -9.506 1.00 1.00 C ATOM 42 CG GLN A 221 1.082 18.425 -8.960 1.00 1.28 C ATOM 43 CD GLN A 221 1.857 19.043 -10.126 1.00 1.61 C ATOM 44 OE1 GLN A 221 2.699 18.400 -10.719 1.00 2.08 O ATOM 45 NE2 GLN A 221 1.607 20.274 -10.480 1.00 2.17 N ATOM 0 H GLN A 221 1.342 15.828 -8.033 1.00 0.90 H new ATOM 0 HA GLN A 221 -1.175 17.353 -7.724 1.00 0.92 H new ATOM 0 HB2 GLN A 221 0.492 16.765 -10.215 1.00 1.00 H new ATOM 0 HB3 GLN A 221 -0.739 18.001 -10.048 1.00 1.00 H new ATOM 0 HG2 GLN A 221 0.600 19.207 -8.374 1.00 1.28 H new ATOM 0 HG3 GLN A 221 1.765 17.902 -8.291 1.00 1.28 H new ATOM 0 HE21 GLN A 221 0.900 20.814 -9.982 1.00 2.17 H new ATOM 0 HE22 GLN A 221 2.119 20.696 -11.255 1.00 2.17 H new ATOM 54 N ASN A 222 -2.045 15.779 -10.083 1.00 0.78 N ATOM 55 CA ASN A 222 -2.937 14.746 -10.691 1.00 0.73 C ATOM 56 C ASN A 222 -2.097 13.813 -11.570 1.00 0.63 C ATOM 57 O ASN A 222 -1.556 14.218 -12.581 1.00 0.65 O ATOM 58 CB ASN A 222 -4.004 15.432 -11.549 1.00 0.80 C ATOM 59 CG ASN A 222 -4.860 16.344 -10.666 1.00 0.93 C ATOM 60 OD1 ASN A 222 -4.743 17.552 -10.728 1.00 1.48 O ATOM 61 ND2 ASN A 222 -5.723 15.813 -9.842 1.00 1.39 N ATOM 0 H ASN A 222 -1.902 16.614 -10.651 1.00 0.78 H new ATOM 0 HA ASN A 222 -3.423 14.171 -9.903 1.00 0.73 H new ATOM 0 HB2 ASN A 222 -3.531 16.014 -12.340 1.00 0.80 H new ATOM 0 HB3 ASN A 222 -4.632 14.685 -12.034 1.00 0.80 H new ATOM 0 HD21 ASN A 222 -6.299 16.412 -9.251 1.00 1.39 H new ATOM 0 HD22 ASN A 222 -5.821 14.799 -9.790 1.00 1.39 H new ATOM 68 N PHE A 223 -1.978 12.567 -11.182 1.00 0.55 N ATOM 69 CA PHE A 223 -1.167 11.590 -11.977 1.00 0.46 C ATOM 70 C PHE A 223 -1.940 10.273 -12.110 1.00 0.39 C ATOM 71 O PHE A 223 -2.586 9.826 -11.184 1.00 0.38 O ATOM 72 CB PHE A 223 0.158 11.318 -11.244 1.00 0.46 C ATOM 73 CG PHE A 223 1.143 12.435 -11.504 1.00 0.53 C ATOM 74 CD1 PHE A 223 1.909 12.439 -12.686 1.00 0.54 C ATOM 75 CD2 PHE A 223 1.302 13.466 -10.560 1.00 0.64 C ATOM 76 CE1 PHE A 223 2.833 13.475 -12.925 1.00 0.64 C ATOM 77 CE2 PHE A 223 2.226 14.502 -10.797 1.00 0.72 C ATOM 78 CZ PHE A 223 2.992 14.507 -11.980 1.00 0.71 C ATOM 0 H PHE A 223 -2.411 12.181 -10.343 1.00 0.55 H new ATOM 0 HA PHE A 223 -0.969 12.003 -12.966 1.00 0.46 H new ATOM 0 HB2 PHE A 223 -0.024 11.227 -10.173 1.00 0.46 H new ATOM 0 HB3 PHE A 223 0.578 10.369 -11.578 1.00 0.46 H new ATOM 0 HD1 PHE A 223 1.788 11.647 -13.410 1.00 0.54 H new ATOM 0 HD2 PHE A 223 0.715 13.463 -9.653 1.00 0.64 H new ATOM 0 HE1 PHE A 223 3.419 13.478 -13.832 1.00 0.64 H new ATOM 0 HE2 PHE A 223 2.348 15.293 -10.072 1.00 0.72 H new ATOM 0 HZ PHE A 223 3.700 15.302 -12.162 1.00 0.71 H new ATOM 88 N ARG A 224 -1.852 9.637 -13.252 1.00 0.36 N ATOM 89 CA ARG A 224 -2.548 8.327 -13.463 1.00 0.31 C ATOM 90 C ARG A 224 -1.476 7.237 -13.504 1.00 0.26 C ATOM 91 O ARG A 224 -0.326 7.510 -13.786 1.00 0.29 O ATOM 92 CB ARG A 224 -3.314 8.358 -14.796 1.00 0.35 C ATOM 93 CG ARG A 224 -4.688 9.006 -14.589 1.00 1.00 C ATOM 94 CD ARG A 224 -5.267 9.432 -15.941 1.00 1.24 C ATOM 95 NE ARG A 224 -5.228 8.279 -16.885 1.00 1.82 N ATOM 96 CZ ARG A 224 -5.925 8.317 -17.989 1.00 2.36 C ATOM 97 NH1 ARG A 224 -6.651 9.366 -18.266 1.00 2.57 N ATOM 98 NH2 ARG A 224 -5.895 7.307 -18.815 1.00 3.26 N ATOM 0 H ARG A 224 -1.322 9.972 -14.056 1.00 0.36 H new ATOM 0 HA ARG A 224 -3.259 8.133 -12.660 1.00 0.31 H new ATOM 0 HB2 ARG A 224 -2.746 8.917 -15.540 1.00 0.35 H new ATOM 0 HB3 ARG A 224 -3.433 7.345 -15.181 1.00 0.35 H new ATOM 0 HG2 ARG A 224 -5.362 8.303 -14.099 1.00 1.00 H new ATOM 0 HG3 ARG A 224 -4.597 9.871 -13.932 1.00 1.00 H new ATOM 0 HD2 ARG A 224 -6.293 9.779 -15.816 1.00 1.24 H new ATOM 0 HD3 ARG A 224 -4.695 10.267 -16.346 1.00 1.24 H new ATOM 0 HE ARG A 224 -4.658 7.461 -16.669 1.00 1.82 H new ATOM 0 HH11 ARG A 224 -6.674 10.155 -17.620 1.00 2.57 H new ATOM 0 HH12 ARG A 224 -7.195 9.396 -19.128 1.00 2.57 H new ATOM 0 HH21 ARG A 224 -5.327 6.488 -18.598 1.00 3.26 H new ATOM 0 HH22 ARG A 224 -6.439 7.337 -19.677 1.00 3.26 H new ATOM 112 N VAL A 225 -1.828 6.009 -13.216 1.00 0.23 N ATOM 113 CA VAL A 225 -0.803 4.916 -13.228 1.00 0.20 C ATOM 114 C VAL A 225 -1.390 3.629 -13.801 1.00 0.20 C ATOM 115 O VAL A 225 -2.534 3.295 -13.571 1.00 0.22 O ATOM 116 CB VAL A 225 -0.335 4.650 -11.795 1.00 0.20 C ATOM 117 CG1 VAL A 225 0.693 3.517 -11.791 1.00 0.20 C ATOM 118 CG2 VAL A 225 0.307 5.916 -11.227 1.00 0.23 C ATOM 0 H VAL A 225 -2.774 5.715 -12.974 1.00 0.23 H new ATOM 0 HA VAL A 225 0.034 5.231 -13.852 1.00 0.20 H new ATOM 0 HB VAL A 225 -1.191 4.366 -11.183 1.00 0.20 H new ATOM 0 HG11 VAL A 225 1.024 3.330 -10.770 1.00 0.20 H new ATOM 0 HG12 VAL A 225 0.239 2.613 -12.197 1.00 0.20 H new ATOM 0 HG13 VAL A 225 1.549 3.800 -12.404 1.00 0.20 H new ATOM 0 HG21 VAL A 225 0.641 5.728 -10.206 1.00 0.23 H new ATOM 0 HG22 VAL A 225 1.161 6.198 -11.842 1.00 0.23 H new ATOM 0 HG23 VAL A 225 -0.423 6.725 -11.227 1.00 0.23 H new ATOM 128 N TYR A 226 -0.588 2.889 -14.526 1.00 0.22 N ATOM 129 CA TYR A 226 -1.046 1.591 -15.105 1.00 0.25 C ATOM 130 C TYR A 226 -0.302 0.473 -14.378 1.00 0.26 C ATOM 131 O TYR A 226 0.760 0.688 -13.835 1.00 0.26 O ATOM 132 CB TYR A 226 -0.711 1.543 -16.599 1.00 0.32 C ATOM 133 CG TYR A 226 -1.662 2.435 -17.367 1.00 0.35 C ATOM 134 CD1 TYR A 226 -1.557 3.835 -17.258 1.00 0.43 C ATOM 135 CD2 TYR A 226 -2.648 1.865 -18.198 1.00 0.42 C ATOM 136 CE1 TYR A 226 -2.435 4.665 -17.981 1.00 0.50 C ATOM 137 CE2 TYR A 226 -3.527 2.697 -18.919 1.00 0.47 C ATOM 138 CZ TYR A 226 -3.421 4.097 -18.811 1.00 0.49 C ATOM 139 OH TYR A 226 -4.280 4.912 -19.519 1.00 0.58 O ATOM 0 H TYR A 226 0.378 3.134 -14.743 1.00 0.22 H new ATOM 0 HA TYR A 226 -2.124 1.478 -14.986 1.00 0.25 H new ATOM 0 HB2 TYR A 226 0.317 1.867 -16.761 1.00 0.32 H new ATOM 0 HB3 TYR A 226 -0.784 0.519 -16.965 1.00 0.32 H new ATOM 0 HD1 TYR A 226 -0.803 4.272 -16.620 1.00 0.43 H new ATOM 0 HD2 TYR A 226 -2.729 0.791 -18.282 1.00 0.42 H new ATOM 0 HE1 TYR A 226 -2.352 5.739 -17.899 1.00 0.50 H new ATOM 0 HE2 TYR A 226 -4.283 2.261 -19.555 1.00 0.47 H new ATOM 0 HH TYR A 226 -4.898 4.360 -20.043 1.00 0.58 H new ATOM 149 N TYR A 227 -0.839 -0.715 -14.346 1.00 0.28 N ATOM 150 CA TYR A 227 -0.137 -1.814 -13.621 1.00 0.32 C ATOM 151 C TYR A 227 -0.583 -3.171 -14.160 1.00 0.37 C ATOM 152 O TYR A 227 -1.687 -3.329 -14.643 1.00 0.39 O ATOM 153 CB TYR A 227 -0.478 -1.723 -12.130 1.00 0.31 C ATOM 154 CG TYR A 227 -1.980 -1.782 -11.950 1.00 0.31 C ATOM 155 CD1 TYR A 227 -2.781 -0.682 -12.321 1.00 0.28 C ATOM 156 CD2 TYR A 227 -2.582 -2.939 -11.412 1.00 0.38 C ATOM 157 CE1 TYR A 227 -4.179 -0.740 -12.155 1.00 0.31 C ATOM 158 CE2 TYR A 227 -3.980 -2.994 -11.245 1.00 0.41 C ATOM 159 CZ TYR A 227 -4.777 -1.895 -11.617 1.00 0.38 C ATOM 160 OH TYR A 227 -6.146 -1.949 -11.452 1.00 0.44 O ATOM 0 H TYR A 227 -1.723 -0.972 -14.785 1.00 0.28 H new ATOM 0 HA TYR A 227 0.938 -1.713 -13.767 1.00 0.32 H new ATOM 0 HB2 TYR A 227 -0.004 -2.541 -11.587 1.00 0.31 H new ATOM 0 HB3 TYR A 227 -0.087 -0.795 -11.713 1.00 0.31 H new ATOM 0 HD1 TYR A 227 -2.323 0.205 -12.732 1.00 0.28 H new ATOM 0 HD2 TYR A 227 -1.971 -3.783 -11.128 1.00 0.38 H new ATOM 0 HE1 TYR A 227 -4.792 0.102 -12.441 1.00 0.31 H new ATOM 0 HE2 TYR A 227 -4.440 -3.879 -10.832 1.00 0.41 H new ATOM 0 HH TYR A 227 -6.361 -2.526 -10.689 1.00 0.44 H new ATOM 170 N ARG A 228 0.272 -4.157 -14.076 1.00 0.43 N ATOM 171 CA ARG A 228 -0.098 -5.515 -14.580 1.00 0.49 C ATOM 172 C ARG A 228 -0.691 -6.343 -13.440 1.00 0.54 C ATOM 173 O ARG A 228 -0.205 -6.326 -12.327 1.00 0.60 O ATOM 174 CB ARG A 228 1.151 -6.217 -15.131 1.00 0.55 C ATOM 175 CG ARG A 228 1.964 -5.228 -15.977 1.00 0.67 C ATOM 176 CD ARG A 228 2.892 -5.990 -16.931 1.00 0.73 C ATOM 177 NE ARG A 228 3.513 -7.160 -16.224 1.00 1.49 N ATOM 178 CZ ARG A 228 4.184 -7.014 -15.112 1.00 1.74 C ATOM 179 NH1 ARG A 228 4.487 -5.824 -14.671 1.00 1.49 N ATOM 180 NH2 ARG A 228 4.601 -8.068 -14.467 1.00 2.76 N ATOM 0 H ARG A 228 1.209 -4.082 -13.681 1.00 0.43 H new ATOM 0 HA ARG A 228 -0.837 -5.416 -15.375 1.00 0.49 H new ATOM 0 HB2 ARG A 228 1.760 -6.596 -14.310 1.00 0.55 H new ATOM 0 HB3 ARG A 228 0.861 -7.076 -15.736 1.00 0.55 H new ATOM 0 HG2 ARG A 228 1.292 -4.586 -16.546 1.00 0.67 H new ATOM 0 HG3 ARG A 228 2.551 -4.579 -15.328 1.00 0.67 H new ATOM 0 HD2 ARG A 228 2.330 -6.336 -17.798 1.00 0.73 H new ATOM 0 HD3 ARG A 228 3.671 -5.324 -17.302 1.00 0.73 H new ATOM 0 HE ARG A 228 3.408 -8.093 -16.622 1.00 1.49 H new ATOM 0 HH11 ARG A 228 4.200 -4.997 -15.195 1.00 1.49 H new ATOM 0 HH12 ARG A 228 5.011 -5.720 -13.802 1.00 1.49 H new ATOM 0 HH21 ARG A 228 4.403 -9.000 -14.831 1.00 2.76 H new ATOM 0 HH22 ARG A 228 5.125 -7.960 -13.599 1.00 2.76 H new ATOM 194 N ASP A 229 -1.743 -7.069 -13.714 1.00 0.58 N ATOM 195 CA ASP A 229 -2.384 -7.907 -12.656 1.00 0.66 C ATOM 196 C ASP A 229 -1.820 -9.328 -12.719 1.00 0.74 C ATOM 197 O ASP A 229 -1.110 -9.683 -13.640 1.00 0.76 O ATOM 198 CB ASP A 229 -3.898 -7.946 -12.891 1.00 0.72 C ATOM 199 CG ASP A 229 -4.599 -8.467 -11.634 1.00 1.41 C ATOM 200 OD1 ASP A 229 -4.179 -8.097 -10.549 1.00 2.07 O ATOM 201 OD2 ASP A 229 -5.543 -9.226 -11.777 1.00 2.23 O ATOM 0 H ASP A 229 -2.189 -7.118 -14.630 1.00 0.58 H new ATOM 0 HA ASP A 229 -2.177 -7.480 -11.675 1.00 0.66 H new ATOM 0 HB2 ASP A 229 -4.264 -6.949 -13.137 1.00 0.72 H new ATOM 0 HB3 ASP A 229 -4.128 -8.589 -13.741 1.00 0.72 H new ATOM 206 N SER A 230 -2.131 -10.144 -11.750 1.00 0.84 N ATOM 207 CA SER A 230 -1.617 -11.545 -11.752 1.00 0.97 C ATOM 208 C SER A 230 -2.567 -12.437 -12.555 1.00 1.04 C ATOM 209 O SER A 230 -2.275 -13.584 -12.829 1.00 1.17 O ATOM 210 CB SER A 230 -1.534 -12.057 -10.313 1.00 1.07 C ATOM 211 OG SER A 230 -0.992 -13.371 -10.310 1.00 1.80 O ATOM 0 H SER A 230 -2.721 -9.901 -10.954 1.00 0.84 H new ATOM 0 HA SER A 230 -0.626 -11.568 -12.206 1.00 0.97 H new ATOM 0 HB2 SER A 230 -0.910 -11.393 -9.715 1.00 1.07 H new ATOM 0 HB3 SER A 230 -2.525 -12.059 -9.858 1.00 1.07 H new ATOM 0 HG SER A 230 -1.225 -13.823 -11.148 1.00 1.80 H new ATOM 217 N ARG A 231 -3.707 -11.919 -12.929 1.00 1.00 N ATOM 218 CA ARG A 231 -4.684 -12.735 -13.710 1.00 1.11 C ATOM 219 C ARG A 231 -4.394 -12.609 -15.209 1.00 1.14 C ATOM 220 O ARG A 231 -4.923 -13.348 -16.014 1.00 1.30 O ATOM 221 CB ARG A 231 -6.102 -12.234 -13.429 1.00 1.14 C ATOM 222 CG ARG A 231 -6.398 -12.334 -11.928 1.00 1.18 C ATOM 223 CD ARG A 231 -6.367 -13.802 -11.474 1.00 1.46 C ATOM 224 NE ARG A 231 -7.233 -13.963 -10.272 1.00 2.09 N ATOM 225 CZ ARG A 231 -7.602 -15.155 -9.889 1.00 2.67 C ATOM 226 NH1 ARG A 231 -7.209 -16.207 -10.553 1.00 2.80 N ATOM 227 NH2 ARG A 231 -8.366 -15.294 -8.841 1.00 3.63 N ATOM 0 H ARG A 231 -4.005 -10.964 -12.727 1.00 1.00 H new ATOM 0 HA ARG A 231 -4.593 -13.780 -13.413 1.00 1.11 H new ATOM 0 HB2 ARG A 231 -6.206 -11.201 -13.762 1.00 1.14 H new ATOM 0 HB3 ARG A 231 -6.825 -12.824 -13.992 1.00 1.14 H new ATOM 0 HG2 ARG A 231 -5.663 -11.757 -11.366 1.00 1.18 H new ATOM 0 HG3 ARG A 231 -7.375 -11.901 -11.714 1.00 1.18 H new ATOM 0 HD2 ARG A 231 -6.716 -14.451 -12.277 1.00 1.46 H new ATOM 0 HD3 ARG A 231 -5.345 -14.102 -11.243 1.00 1.46 H new ATOM 0 HE ARG A 231 -7.537 -13.142 -9.749 1.00 2.09 H new ATOM 0 HH11 ARG A 231 -6.612 -16.099 -11.373 1.00 2.80 H new ATOM 0 HH12 ARG A 231 -7.498 -17.138 -10.252 1.00 2.80 H new ATOM 0 HH21 ARG A 231 -8.674 -14.472 -8.322 1.00 3.63 H new ATOM 0 HH22 ARG A 231 -8.655 -16.225 -8.541 1.00 3.63 H new ATOM 241 N ASP A 232 -3.567 -11.674 -15.598 1.00 1.02 N ATOM 242 CA ASP A 232 -3.264 -11.507 -17.045 1.00 1.07 C ATOM 243 C ASP A 232 -1.921 -10.740 -17.208 1.00 0.94 C ATOM 244 O ASP A 232 -1.708 -9.761 -16.522 1.00 0.82 O ATOM 245 CB ASP A 232 -4.412 -10.723 -17.681 1.00 1.14 C ATOM 246 CG ASP A 232 -4.416 -9.277 -17.177 1.00 1.61 C ATOM 247 OD1 ASP A 232 -3.863 -9.032 -16.118 1.00 2.12 O ATOM 248 OD2 ASP A 232 -4.990 -8.440 -17.852 1.00 2.16 O ATOM 0 H ASP A 232 -3.091 -11.021 -14.976 1.00 1.02 H new ATOM 0 HA ASP A 232 -3.165 -12.476 -17.535 1.00 1.07 H new ATOM 0 HB2 ASP A 232 -4.312 -10.736 -18.766 1.00 1.14 H new ATOM 0 HB3 ASP A 232 -5.362 -11.200 -17.443 1.00 1.14 H new ATOM 253 N PRO A 233 -1.029 -11.197 -18.081 1.00 1.01 N ATOM 254 CA PRO A 233 0.278 -10.521 -18.263 1.00 0.97 C ATOM 255 C PRO A 233 0.114 -9.124 -18.897 1.00 0.85 C ATOM 256 O PRO A 233 1.067 -8.378 -18.997 1.00 0.83 O ATOM 257 CB PRO A 233 1.072 -11.452 -19.210 1.00 1.13 C ATOM 258 CG PRO A 233 0.066 -12.488 -19.783 1.00 1.25 C ATOM 259 CD PRO A 233 -1.218 -12.397 -18.934 1.00 1.19 C ATOM 0 HA PRO A 233 0.781 -10.360 -17.309 1.00 0.97 H new ATOM 0 HB2 PRO A 233 1.535 -10.879 -20.014 1.00 1.13 H new ATOM 0 HB3 PRO A 233 1.876 -11.953 -18.672 1.00 1.13 H new ATOM 0 HG2 PRO A 233 -0.150 -12.276 -20.830 1.00 1.25 H new ATOM 0 HG3 PRO A 233 0.484 -13.494 -19.741 1.00 1.25 H new ATOM 0 HD2 PRO A 233 -2.102 -12.298 -19.564 1.00 1.19 H new ATOM 0 HD3 PRO A 233 -1.356 -13.293 -18.329 1.00 1.19 H new ATOM 267 N VAL A 234 -1.062 -8.762 -19.337 1.00 0.84 N ATOM 268 CA VAL A 234 -1.225 -7.414 -19.967 1.00 0.80 C ATOM 269 C VAL A 234 -1.457 -6.353 -18.897 1.00 0.69 C ATOM 270 O VAL A 234 -1.781 -6.647 -17.764 1.00 0.72 O ATOM 271 CB VAL A 234 -2.408 -7.421 -20.940 1.00 0.90 C ATOM 272 CG1 VAL A 234 -3.674 -7.873 -20.212 1.00 1.74 C ATOM 273 CG2 VAL A 234 -2.618 -6.012 -21.511 1.00 1.75 C ATOM 0 H VAL A 234 -1.908 -9.331 -19.290 1.00 0.84 H new ATOM 0 HA VAL A 234 -0.311 -7.180 -20.513 1.00 0.80 H new ATOM 0 HB VAL A 234 -2.196 -8.112 -21.755 1.00 0.90 H new ATOM 0 HG11 VAL A 234 -4.513 -7.876 -20.908 1.00 1.74 H new ATOM 0 HG12 VAL A 234 -3.527 -8.878 -19.816 1.00 1.74 H new ATOM 0 HG13 VAL A 234 -3.886 -7.187 -19.392 1.00 1.74 H new ATOM 0 HG21 VAL A 234 -3.460 -6.022 -22.203 1.00 1.75 H new ATOM 0 HG22 VAL A 234 -2.824 -5.317 -20.697 1.00 1.75 H new ATOM 0 HG23 VAL A 234 -1.719 -5.696 -22.039 1.00 1.75 H new ATOM 283 N TRP A 235 -1.296 -5.115 -19.264 1.00 0.64 N ATOM 284 CA TRP A 235 -1.501 -4.002 -18.292 1.00 0.55 C ATOM 285 C TRP A 235 -2.978 -3.931 -17.897 1.00 0.53 C ATOM 286 O TRP A 235 -3.824 -4.528 -18.532 1.00 0.65 O ATOM 287 CB TRP A 235 -1.083 -2.680 -18.945 1.00 0.56 C ATOM 288 CG TRP A 235 0.380 -2.722 -19.248 1.00 0.58 C ATOM 289 CD1 TRP A 235 0.922 -3.102 -20.428 1.00 0.65 C ATOM 290 CD2 TRP A 235 1.496 -2.393 -18.372 1.00 0.53 C ATOM 291 NE1 TRP A 235 2.302 -3.028 -20.335 1.00 0.66 N ATOM 292 CE2 TRP A 235 2.706 -2.595 -19.088 1.00 0.59 C ATOM 293 CE3 TRP A 235 1.576 -1.941 -17.035 1.00 0.47 C ATOM 294 CZ2 TRP A 235 3.956 -2.356 -18.497 1.00 0.59 C ATOM 295 CZ3 TRP A 235 2.829 -1.698 -16.437 1.00 0.47 C ATOM 296 CH2 TRP A 235 4.017 -1.905 -17.166 1.00 0.53 C ATOM 0 H TRP A 235 -1.029 -4.821 -20.204 1.00 0.64 H new ATOM 0 HA TRP A 235 -0.898 -4.179 -17.401 1.00 0.55 H new ATOM 0 HB2 TRP A 235 -1.652 -2.517 -19.861 1.00 0.56 H new ATOM 0 HB3 TRP A 235 -1.305 -1.846 -18.279 1.00 0.56 H new ATOM 0 HD1 TRP A 235 0.368 -3.413 -21.301 1.00 0.65 H new ATOM 0 HE1 TRP A 235 2.941 -3.264 -21.094 1.00 0.66 H new ATOM 0 HE3 TRP A 235 0.671 -1.781 -16.468 1.00 0.47 H new ATOM 0 HZ2 TRP A 235 4.864 -2.517 -19.059 1.00 0.59 H new ATOM 0 HZ3 TRP A 235 2.879 -1.352 -15.415 1.00 0.47 H new ATOM 0 HH2 TRP A 235 4.974 -1.717 -16.703 1.00 0.53 H new ATOM 307 N LYS A 236 -3.297 -3.197 -16.853 1.00 0.45 N ATOM 308 CA LYS A 236 -4.724 -3.075 -16.404 1.00 0.45 C ATOM 309 C LYS A 236 -5.157 -1.607 -16.479 1.00 0.43 C ATOM 310 O LYS A 236 -4.341 -0.718 -16.622 1.00 0.67 O ATOM 311 CB LYS A 236 -4.844 -3.578 -14.961 1.00 0.46 C ATOM 312 CG LYS A 236 -6.323 -3.614 -14.530 1.00 0.81 C ATOM 313 CD LYS A 236 -6.508 -4.636 -13.401 1.00 0.73 C ATOM 314 CE LYS A 236 -7.847 -4.398 -12.695 1.00 1.09 C ATOM 315 NZ LYS A 236 -8.247 -5.634 -11.965 1.00 1.43 N ATOM 0 H LYS A 236 -2.626 -2.675 -16.290 1.00 0.45 H new ATOM 0 HA LYS A 236 -5.367 -3.673 -17.050 1.00 0.45 H new ATOM 0 HB2 LYS A 236 -4.409 -4.574 -14.878 1.00 0.46 H new ATOM 0 HB3 LYS A 236 -4.279 -2.927 -14.293 1.00 0.46 H new ATOM 0 HG2 LYS A 236 -6.638 -2.626 -14.194 1.00 0.81 H new ATOM 0 HG3 LYS A 236 -6.953 -3.878 -15.379 1.00 0.81 H new ATOM 0 HD2 LYS A 236 -6.475 -5.648 -13.806 1.00 0.73 H new ATOM 0 HD3 LYS A 236 -5.690 -4.552 -12.686 1.00 0.73 H new ATOM 0 HE2 LYS A 236 -7.761 -3.563 -11.999 1.00 1.09 H new ATOM 0 HE3 LYS A 236 -8.612 -4.129 -13.423 1.00 1.09 H new ATOM 0 HZ1 LYS A 236 -9.156 -5.475 -11.485 1.00 1.43 H new ATOM 0 HZ2 LYS A 236 -8.345 -6.419 -12.640 1.00 1.43 H new ATOM 0 HZ3 LYS A 236 -7.520 -5.872 -11.260 1.00 1.43 H new ATOM 329 N GLY A 237 -6.436 -1.349 -16.389 1.00 0.39 N ATOM 330 CA GLY A 237 -6.927 0.061 -16.468 1.00 0.36 C ATOM 331 C GLY A 237 -6.050 0.977 -15.594 1.00 0.31 C ATOM 332 O GLY A 237 -5.312 0.491 -14.760 1.00 0.31 O ATOM 0 H GLY A 237 -7.163 -2.054 -16.264 1.00 0.39 H new ATOM 0 HA2 GLY A 237 -6.906 0.404 -17.502 1.00 0.36 H new ATOM 0 HA3 GLY A 237 -7.964 0.112 -16.136 1.00 0.36 H new ATOM 336 N PRO A 238 -6.146 2.280 -15.805 1.00 0.31 N ATOM 337 CA PRO A 238 -5.355 3.250 -15.021 1.00 0.29 C ATOM 338 C PRO A 238 -5.810 3.258 -13.553 1.00 0.24 C ATOM 339 O PRO A 238 -6.874 2.776 -13.214 1.00 0.27 O ATOM 340 CB PRO A 238 -5.638 4.619 -15.686 1.00 0.36 C ATOM 341 CG PRO A 238 -6.808 4.411 -16.687 1.00 0.41 C ATOM 342 CD PRO A 238 -7.027 2.888 -16.832 1.00 0.38 C ATOM 0 HA PRO A 238 -4.293 3.006 -15.015 1.00 0.29 H new ATOM 0 HB2 PRO A 238 -5.902 5.364 -14.935 1.00 0.36 H new ATOM 0 HB3 PRO A 238 -4.751 4.987 -16.202 1.00 0.36 H new ATOM 0 HG2 PRO A 238 -7.714 4.896 -16.324 1.00 0.41 H new ATOM 0 HG3 PRO A 238 -6.571 4.858 -17.652 1.00 0.41 H new ATOM 0 HD2 PRO A 238 -8.071 2.621 -16.667 1.00 0.38 H new ATOM 0 HD3 PRO A 238 -6.765 2.544 -17.832 1.00 0.38 H new ATOM 350 N ALA A 239 -5.008 3.823 -12.688 1.00 0.19 N ATOM 351 CA ALA A 239 -5.368 3.900 -11.241 1.00 0.18 C ATOM 352 C ALA A 239 -4.952 5.270 -10.700 1.00 0.17 C ATOM 353 O ALA A 239 -4.357 6.063 -11.401 1.00 0.19 O ATOM 354 CB ALA A 239 -4.632 2.807 -10.469 1.00 0.21 C ATOM 0 H ALA A 239 -4.108 4.239 -12.926 1.00 0.19 H new ATOM 0 HA ALA A 239 -6.443 3.762 -11.122 1.00 0.18 H new ATOM 0 HB1 ALA A 239 -4.897 2.866 -9.413 1.00 0.21 H new ATOM 0 HB2 ALA A 239 -4.917 1.830 -10.861 1.00 0.21 H new ATOM 0 HB3 ALA A 239 -3.556 2.944 -10.581 1.00 0.21 H new ATOM 360 N LYS A 240 -5.255 5.556 -9.458 1.00 0.19 N ATOM 361 CA LYS A 240 -4.869 6.879 -8.869 1.00 0.21 C ATOM 362 C LYS A 240 -3.558 6.715 -8.084 1.00 0.19 C ATOM 363 O LYS A 240 -3.361 5.736 -7.389 1.00 0.18 O ATOM 364 CB LYS A 240 -5.994 7.360 -7.931 1.00 0.27 C ATOM 365 CG LYS A 240 -6.057 8.893 -7.917 1.00 1.15 C ATOM 366 CD LYS A 240 -7.223 9.349 -7.033 1.00 1.43 C ATOM 367 CE LYS A 240 -7.553 10.814 -7.328 1.00 2.03 C ATOM 368 NZ LYS A 240 -6.351 11.655 -7.071 1.00 2.72 N ATOM 0 H LYS A 240 -5.753 4.931 -8.825 1.00 0.19 H new ATOM 0 HA LYS A 240 -4.723 7.616 -9.659 1.00 0.21 H new ATOM 0 HB2 LYS A 240 -6.950 6.953 -8.260 1.00 0.27 H new ATOM 0 HB3 LYS A 240 -5.819 6.987 -6.922 1.00 0.27 H new ATOM 0 HG2 LYS A 240 -5.120 9.303 -7.541 1.00 1.15 H new ATOM 0 HG3 LYS A 240 -6.186 9.271 -8.931 1.00 1.15 H new ATOM 0 HD2 LYS A 240 -8.097 8.725 -7.218 1.00 1.43 H new ATOM 0 HD3 LYS A 240 -6.963 9.230 -5.981 1.00 1.43 H new ATOM 0 HE2 LYS A 240 -7.872 10.924 -8.364 1.00 2.03 H new ATOM 0 HE3 LYS A 240 -8.382 11.144 -6.702 1.00 2.03 H new ATOM 0 HZ1 LYS A 240 -6.631 12.655 -7.022 1.00 2.72 H new ATOM 0 HZ2 LYS A 240 -5.916 11.372 -6.170 1.00 2.72 H new ATOM 0 HZ3 LYS A 240 -5.665 11.525 -7.842 1.00 2.72 H new ATOM 382 N LEU A 241 -2.664 7.668 -8.189 1.00 0.20 N ATOM 383 CA LEU A 241 -1.358 7.576 -7.459 1.00 0.20 C ATOM 384 C LEU A 241 -1.498 8.193 -6.063 1.00 0.22 C ATOM 385 O LEU A 241 -1.830 9.354 -5.922 1.00 0.29 O ATOM 386 CB LEU A 241 -0.286 8.344 -8.250 1.00 0.22 C ATOM 387 CG LEU A 241 1.011 8.463 -7.432 1.00 0.23 C ATOM 388 CD1 LEU A 241 1.439 7.083 -6.919 1.00 0.29 C ATOM 389 CD2 LEU A 241 2.116 9.036 -8.325 1.00 0.29 C ATOM 0 H LEU A 241 -2.782 8.511 -8.752 1.00 0.20 H new ATOM 0 HA LEU A 241 -1.070 6.529 -7.361 1.00 0.20 H new ATOM 0 HB2 LEU A 241 -0.083 7.831 -9.190 1.00 0.22 H new ATOM 0 HB3 LEU A 241 -0.655 9.338 -8.502 1.00 0.22 H new ATOM 0 HG LEU A 241 0.839 9.122 -6.581 1.00 0.23 H new ATOM 0 HD11 LEU A 241 2.358 7.179 -6.341 1.00 0.29 H new ATOM 0 HD12 LEU A 241 0.654 6.671 -6.286 1.00 0.29 H new ATOM 0 HD13 LEU A 241 1.610 6.417 -7.765 1.00 0.29 H new ATOM 0 HD21 LEU A 241 3.039 9.123 -7.751 1.00 0.29 H new ATOM 0 HD22 LEU A 241 2.278 8.372 -9.174 1.00 0.29 H new ATOM 0 HD23 LEU A 241 1.818 10.021 -8.685 1.00 0.29 H new ATOM 401 N LEU A 242 -1.229 7.429 -5.030 1.00 0.22 N ATOM 402 CA LEU A 242 -1.326 7.961 -3.633 1.00 0.25 C ATOM 403 C LEU A 242 0.077 8.084 -3.025 1.00 0.25 C ATOM 404 O LEU A 242 0.607 9.168 -2.878 1.00 0.27 O ATOM 405 CB LEU A 242 -2.154 6.999 -2.775 1.00 0.26 C ATOM 406 CG LEU A 242 -3.427 6.589 -3.517 1.00 0.32 C ATOM 407 CD1 LEU A 242 -4.271 5.698 -2.598 1.00 0.30 C ATOM 408 CD2 LEU A 242 -4.224 7.843 -3.903 1.00 0.45 C ATOM 0 H LEU A 242 -0.944 6.452 -5.096 1.00 0.22 H new ATOM 0 HA LEU A 242 -1.802 8.941 -3.659 1.00 0.25 H new ATOM 0 HB2 LEU A 242 -1.564 6.115 -2.535 1.00 0.26 H new ATOM 0 HB3 LEU A 242 -2.413 7.475 -1.829 1.00 0.26 H new ATOM 0 HG LEU A 242 -3.169 6.041 -4.423 1.00 0.32 H new ATOM 0 HD11 LEU A 242 -5.182 5.399 -3.117 1.00 0.30 H new ATOM 0 HD12 LEU A 242 -3.700 4.810 -2.327 1.00 0.30 H new ATOM 0 HD13 LEU A 242 -4.532 6.250 -1.695 1.00 0.30 H new ATOM 0 HD21 LEU A 242 -5.131 7.549 -4.432 1.00 0.45 H new ATOM 0 HD22 LEU A 242 -4.492 8.395 -3.002 1.00 0.45 H new ATOM 0 HD23 LEU A 242 -3.616 8.476 -4.549 1.00 0.45 H new ATOM 420 N TRP A 243 0.678 6.981 -2.654 1.00 0.25 N ATOM 421 CA TRP A 243 2.040 7.029 -2.031 1.00 0.26 C ATOM 422 C TRP A 243 3.125 6.892 -3.108 1.00 0.22 C ATOM 423 O TRP A 243 2.969 6.176 -4.076 1.00 0.21 O ATOM 424 CB TRP A 243 2.170 5.873 -1.024 1.00 0.30 C ATOM 425 CG TRP A 243 3.269 6.159 -0.053 1.00 0.29 C ATOM 426 CD1 TRP A 243 3.234 7.117 0.897 1.00 0.31 C ATOM 427 CD2 TRP A 243 4.558 5.497 0.080 1.00 0.28 C ATOM 428 NE1 TRP A 243 4.422 7.096 1.601 1.00 0.31 N ATOM 429 CE2 TRP A 243 5.275 6.119 1.136 1.00 0.30 C ATOM 430 CE3 TRP A 243 5.177 4.429 -0.610 1.00 0.27 C ATOM 431 CZ2 TRP A 243 6.559 5.698 1.498 1.00 0.31 C ATOM 432 CZ3 TRP A 243 6.471 4.001 -0.248 1.00 0.28 C ATOM 433 CH2 TRP A 243 7.160 4.636 0.803 1.00 0.29 C ATOM 0 H TRP A 243 0.284 6.046 -2.755 1.00 0.25 H new ATOM 0 HA TRP A 243 2.169 7.985 -1.524 1.00 0.26 H new ATOM 0 HB2 TRP A 243 1.229 5.738 -0.491 1.00 0.30 H new ATOM 0 HB3 TRP A 243 2.374 4.942 -1.552 1.00 0.30 H new ATOM 0 HD1 TRP A 243 2.410 7.791 1.078 1.00 0.31 H new ATOM 0 HE1 TRP A 243 4.641 7.727 2.372 1.00 0.31 H new ATOM 0 HE3 TRP A 243 4.656 3.938 -1.419 1.00 0.27 H new ATOM 0 HZ2 TRP A 243 7.084 6.186 2.306 1.00 0.31 H new ATOM 0 HZ3 TRP A 243 6.935 3.183 -0.779 1.00 0.28 H new ATOM 0 HH2 TRP A 243 8.152 4.306 1.075 1.00 0.29 H new ATOM 444 N LYS A 244 4.233 7.568 -2.928 1.00 0.24 N ATOM 445 CA LYS A 244 5.349 7.481 -3.920 1.00 0.23 C ATOM 446 C LYS A 244 6.684 7.632 -3.182 1.00 0.24 C ATOM 447 O LYS A 244 6.936 8.636 -2.546 1.00 0.28 O ATOM 448 CB LYS A 244 5.206 8.606 -4.950 1.00 0.30 C ATOM 449 CG LYS A 244 6.407 8.593 -5.901 1.00 0.71 C ATOM 450 CD LYS A 244 6.157 9.568 -7.055 1.00 0.82 C ATOM 451 CE LYS A 244 7.404 9.650 -7.942 1.00 1.50 C ATOM 452 NZ LYS A 244 7.323 10.866 -8.802 1.00 2.32 N ATOM 0 H LYS A 244 4.413 8.180 -2.132 1.00 0.24 H new ATOM 0 HA LYS A 244 5.315 6.518 -4.430 1.00 0.23 H new ATOM 0 HB2 LYS A 244 4.282 8.480 -5.514 1.00 0.30 H new ATOM 0 HB3 LYS A 244 5.141 9.569 -4.444 1.00 0.30 H new ATOM 0 HG2 LYS A 244 7.313 8.874 -5.364 1.00 0.71 H new ATOM 0 HG3 LYS A 244 6.566 7.587 -6.289 1.00 0.71 H new ATOM 0 HD2 LYS A 244 5.301 9.238 -7.644 1.00 0.82 H new ATOM 0 HD3 LYS A 244 5.912 10.555 -6.663 1.00 0.82 H new ATOM 0 HE2 LYS A 244 8.301 9.688 -7.324 1.00 1.50 H new ATOM 0 HE3 LYS A 244 7.481 8.757 -8.562 1.00 1.50 H new ATOM 0 HZ1 LYS A 244 8.169 10.922 -9.404 1.00 2.32 H new ATOM 0 HZ2 LYS A 244 6.475 10.812 -9.401 1.00 2.32 H new ATOM 0 HZ3 LYS A 244 7.269 11.713 -8.201 1.00 2.32 H new ATOM 466 N GLY A 245 7.544 6.647 -3.256 1.00 0.23 N ATOM 467 CA GLY A 245 8.855 6.754 -2.550 1.00 0.26 C ATOM 468 C GLY A 245 9.896 5.850 -3.215 1.00 0.26 C ATOM 469 O GLY A 245 10.398 6.141 -4.283 1.00 0.27 O ATOM 0 H GLY A 245 7.396 5.779 -3.771 1.00 0.23 H new ATOM 0 HA2 GLY A 245 9.200 7.788 -2.565 1.00 0.26 H new ATOM 0 HA3 GLY A 245 8.736 6.473 -1.504 1.00 0.26 H new ATOM 473 N GLU A 246 10.231 4.757 -2.580 1.00 0.26 N ATOM 474 CA GLU A 246 11.250 3.831 -3.157 1.00 0.27 C ATOM 475 C GLU A 246 10.696 3.171 -4.423 1.00 0.24 C ATOM 476 O GLU A 246 9.838 3.713 -5.091 1.00 0.22 O ATOM 477 CB GLU A 246 11.590 2.748 -2.127 1.00 0.33 C ATOM 478 CG GLU A 246 12.081 3.406 -0.833 1.00 1.00 C ATOM 479 CD GLU A 246 12.100 2.368 0.292 1.00 0.91 C ATOM 480 OE1 GLU A 246 11.050 2.120 0.862 1.00 1.39 O ATOM 481 OE2 GLU A 246 13.165 1.837 0.562 1.00 1.39 O ATOM 0 H GLU A 246 9.841 4.465 -1.684 1.00 0.26 H new ATOM 0 HA GLU A 246 12.148 4.395 -3.410 1.00 0.27 H new ATOM 0 HB2 GLU A 246 10.711 2.135 -1.925 1.00 0.33 H new ATOM 0 HB3 GLU A 246 12.358 2.083 -2.523 1.00 0.33 H new ATOM 0 HG2 GLU A 246 13.079 3.819 -0.978 1.00 1.00 H new ATOM 0 HG3 GLU A 246 11.429 4.237 -0.565 1.00 1.00 H new ATOM 488 N GLY A 247 11.180 2.003 -4.752 1.00 0.26 N ATOM 489 CA GLY A 247 10.687 1.302 -5.973 1.00 0.25 C ATOM 490 C GLY A 247 9.315 0.687 -5.689 1.00 0.25 C ATOM 491 O GLY A 247 9.068 -0.470 -5.969 1.00 0.29 O ATOM 0 H GLY A 247 11.897 1.503 -4.226 1.00 0.26 H new ATOM 0 HA2 GLY A 247 10.618 2.003 -6.805 1.00 0.25 H new ATOM 0 HA3 GLY A 247 11.392 0.525 -6.269 1.00 0.25 H new ATOM 495 N ALA A 248 8.419 1.459 -5.137 1.00 0.22 N ATOM 496 CA ALA A 248 7.056 0.943 -4.826 1.00 0.24 C ATOM 497 C ALA A 248 6.058 2.091 -4.963 1.00 0.21 C ATOM 498 O ALA A 248 6.393 3.240 -4.749 1.00 0.23 O ATOM 499 CB ALA A 248 7.026 0.405 -3.395 1.00 0.29 C ATOM 0 H ALA A 248 8.575 2.435 -4.886 1.00 0.22 H new ATOM 0 HA ALA A 248 6.795 0.138 -5.514 1.00 0.24 H new ATOM 0 HB1 ALA A 248 6.029 0.028 -3.169 1.00 0.29 H new ATOM 0 HB2 ALA A 248 7.751 -0.403 -3.295 1.00 0.29 H new ATOM 0 HB3 ALA A 248 7.277 1.206 -2.700 1.00 0.29 H new ATOM 505 N VAL A 249 4.837 1.799 -5.324 1.00 0.19 N ATOM 506 CA VAL A 249 3.824 2.884 -5.478 1.00 0.18 C ATOM 507 C VAL A 249 2.452 2.382 -5.025 1.00 0.20 C ATOM 508 O VAL A 249 1.977 1.353 -5.462 1.00 0.22 O ATOM 509 CB VAL A 249 3.758 3.322 -6.945 1.00 0.17 C ATOM 510 CG1 VAL A 249 5.013 4.124 -7.293 1.00 0.31 C ATOM 511 CG2 VAL A 249 3.676 2.094 -7.857 1.00 0.30 C ATOM 0 H VAL A 249 4.497 0.857 -5.519 1.00 0.19 H new ATOM 0 HA VAL A 249 4.113 3.735 -4.861 1.00 0.18 H new ATOM 0 HB VAL A 249 2.871 3.938 -7.092 1.00 0.17 H new ATOM 0 HG11 VAL A 249 4.968 4.436 -8.336 1.00 0.31 H new ATOM 0 HG12 VAL A 249 5.071 5.004 -6.653 1.00 0.31 H new ATOM 0 HG13 VAL A 249 5.896 3.504 -7.138 1.00 0.31 H new ATOM 0 HG21 VAL A 249 3.629 2.416 -8.897 1.00 0.30 H new ATOM 0 HG22 VAL A 249 4.558 1.471 -7.709 1.00 0.30 H new ATOM 0 HG23 VAL A 249 2.782 1.520 -7.615 1.00 0.30 H new ATOM 521 N VAL A 250 1.810 3.109 -4.151 1.00 0.20 N ATOM 522 CA VAL A 250 0.460 2.691 -3.671 1.00 0.22 C ATOM 523 C VAL A 250 -0.589 3.310 -4.591 1.00 0.20 C ATOM 524 O VAL A 250 -0.497 4.465 -4.956 1.00 0.21 O ATOM 525 CB VAL A 250 0.237 3.191 -2.240 1.00 0.26 C ATOM 526 CG1 VAL A 250 -1.147 2.755 -1.755 1.00 0.26 C ATOM 527 CG2 VAL A 250 1.314 2.612 -1.313 1.00 0.29 C ATOM 0 H VAL A 250 2.163 3.977 -3.747 1.00 0.20 H new ATOM 0 HA VAL A 250 0.383 1.604 -3.681 1.00 0.22 H new ATOM 0 HB VAL A 250 0.300 4.279 -2.226 1.00 0.26 H new ATOM 0 HG11 VAL A 250 -1.305 3.111 -0.737 1.00 0.26 H new ATOM 0 HG12 VAL A 250 -1.911 3.176 -2.409 1.00 0.26 H new ATOM 0 HG13 VAL A 250 -1.213 1.667 -1.773 1.00 0.26 H new ATOM 0 HG21 VAL A 250 1.151 2.971 -0.297 1.00 0.29 H new ATOM 0 HG22 VAL A 250 1.259 1.523 -1.327 1.00 0.29 H new ATOM 0 HG23 VAL A 250 2.299 2.930 -1.656 1.00 0.29 H new ATOM 537 N ILE A 251 -1.580 2.551 -4.981 1.00 0.19 N ATOM 538 CA ILE A 251 -2.631 3.096 -5.892 1.00 0.18 C ATOM 539 C ILE A 251 -4.002 2.584 -5.461 1.00 0.20 C ATOM 540 O ILE A 251 -4.129 1.826 -4.521 1.00 0.23 O ATOM 541 CB ILE A 251 -2.353 2.631 -7.325 1.00 0.16 C ATOM 542 CG1 ILE A 251 -2.352 1.097 -7.373 1.00 0.18 C ATOM 543 CG2 ILE A 251 -0.992 3.163 -7.786 1.00 0.16 C ATOM 544 CD1 ILE A 251 -1.909 0.623 -8.760 1.00 0.18 C ATOM 0 H ILE A 251 -1.707 1.577 -4.708 1.00 0.19 H new ATOM 0 HA ILE A 251 -2.616 4.185 -5.845 1.00 0.18 H new ATOM 0 HB ILE A 251 -3.130 3.014 -7.987 1.00 0.16 H new ATOM 0 HG12 ILE A 251 -1.681 0.700 -6.611 1.00 0.18 H new ATOM 0 HG13 ILE A 251 -3.348 0.716 -7.149 1.00 0.18 H new ATOM 0 HG21 ILE A 251 -0.798 2.830 -8.806 1.00 0.16 H new ATOM 0 HG22 ILE A 251 -0.998 4.253 -7.755 1.00 0.16 H new ATOM 0 HG23 ILE A 251 -0.211 2.785 -7.126 1.00 0.16 H new ATOM 0 HD11 ILE A 251 -1.910 -0.467 -8.790 1.00 0.18 H new ATOM 0 HD12 ILE A 251 -2.598 1.007 -9.513 1.00 0.18 H new ATOM 0 HD13 ILE A 251 -0.904 0.991 -8.966 1.00 0.18 H new ATOM 556 N GLN A 252 -5.031 2.987 -6.157 1.00 0.20 N ATOM 557 CA GLN A 252 -6.408 2.517 -5.813 1.00 0.23 C ATOM 558 C GLN A 252 -7.181 2.283 -7.111 1.00 0.24 C ATOM 559 O GLN A 252 -7.499 3.208 -7.830 1.00 0.27 O ATOM 560 CB GLN A 252 -7.136 3.570 -4.963 1.00 0.28 C ATOM 561 CG GLN A 252 -8.323 2.926 -4.245 1.00 0.31 C ATOM 562 CD GLN A 252 -9.110 4.005 -3.496 1.00 0.97 C ATOM 563 OE1 GLN A 252 -8.891 4.190 -2.221 1.00 1.68 O flip ATOM 564 NE2 GLN A 252 -9.931 4.685 -4.076 1.00 1.81 N flip ATOM 0 H GLN A 252 -4.979 3.624 -6.952 1.00 0.20 H new ATOM 0 HA GLN A 252 -6.344 1.593 -5.239 1.00 0.23 H new ATOM 0 HB2 GLN A 252 -6.449 4.001 -4.235 1.00 0.28 H new ATOM 0 HB3 GLN A 252 -7.482 4.386 -5.597 1.00 0.28 H new ATOM 0 HG2 GLN A 252 -8.969 2.423 -4.965 1.00 0.31 H new ATOM 0 HG3 GLN A 252 -7.971 2.166 -3.547 1.00 0.31 H new ATOM 0 HE21 GLN A 252 -10.102 4.540 -5.071 1.00 1.81 H new ATOM 0 HE22 GLN A 252 -10.450 5.401 -3.568 1.00 1.81 H new ATOM 573 N ASP A 253 -7.491 1.052 -7.416 1.00 0.25 N ATOM 574 CA ASP A 253 -8.253 0.763 -8.668 1.00 0.30 C ATOM 575 C ASP A 253 -9.737 0.771 -8.316 1.00 0.32 C ATOM 576 O ASP A 253 -10.416 1.764 -8.487 1.00 0.36 O ATOM 577 CB ASP A 253 -7.839 -0.605 -9.219 1.00 0.36 C ATOM 578 CG ASP A 253 -8.474 -0.814 -10.596 1.00 0.49 C ATOM 579 OD1 ASP A 253 -8.304 0.050 -11.441 1.00 1.18 O ATOM 580 OD2 ASP A 253 -9.121 -1.832 -10.780 1.00 1.18 O ATOM 0 H ASP A 253 -7.251 0.235 -6.855 1.00 0.25 H new ATOM 0 HA ASP A 253 -8.045 1.512 -9.433 1.00 0.30 H new ATOM 0 HB2 ASP A 253 -6.753 -0.665 -9.295 1.00 0.36 H new ATOM 0 HB3 ASP A 253 -8.155 -1.394 -8.537 1.00 0.36 H new ATOM 585 N ASN A 254 -10.245 -0.305 -7.786 1.00 0.33 N ATOM 586 CA ASN A 254 -11.675 -0.313 -7.386 1.00 0.36 C ATOM 587 C ASN A 254 -11.756 0.429 -6.054 1.00 0.34 C ATOM 588 O ASN A 254 -11.213 1.506 -5.911 1.00 0.36 O ATOM 589 CB ASN A 254 -12.161 -1.756 -7.213 1.00 0.42 C ATOM 590 CG ASN A 254 -13.691 -1.782 -7.193 1.00 1.22 C ATOM 591 OD1 ASN A 254 -14.296 -1.813 -6.138 1.00 1.98 O ATOM 592 ND2 ASN A 254 -14.349 -1.767 -8.322 1.00 1.88 N ATOM 0 H ASN A 254 -9.736 -1.172 -7.614 1.00 0.33 H new ATOM 0 HA ASN A 254 -12.301 0.162 -8.142 1.00 0.36 H new ATOM 0 HB2 ASN A 254 -11.787 -2.377 -8.027 1.00 0.42 H new ATOM 0 HB3 ASN A 254 -11.768 -2.175 -6.287 1.00 0.42 H new ATOM 0 HD21 ASN A 254 -15.369 -1.781 -8.318 1.00 1.88 H new ATOM 0 HD22 ASN A 254 -13.843 -1.741 -9.207 1.00 1.88 H new ATOM 599 N SER A 255 -12.391 -0.143 -5.064 1.00 0.35 N ATOM 600 CA SER A 255 -12.465 0.525 -3.726 1.00 0.37 C ATOM 601 C SER A 255 -11.516 -0.203 -2.771 1.00 0.37 C ATOM 602 O SER A 255 -11.908 -0.651 -1.711 1.00 0.42 O ATOM 603 CB SER A 255 -13.897 0.449 -3.193 1.00 0.42 C ATOM 604 OG SER A 255 -14.437 -0.834 -3.478 1.00 1.39 O ATOM 0 H SER A 255 -12.863 -1.045 -5.123 1.00 0.35 H new ATOM 0 HA SER A 255 -12.177 1.573 -3.811 1.00 0.37 H new ATOM 0 HB2 SER A 255 -13.907 0.630 -2.118 1.00 0.42 H new ATOM 0 HB3 SER A 255 -14.510 1.224 -3.653 1.00 0.42 H new ATOM 0 HG SER A 255 -14.449 -0.976 -4.448 1.00 1.39 H new ATOM 610 N ASP A 256 -10.272 -0.331 -3.149 1.00 0.34 N ATOM 611 CA ASP A 256 -9.286 -1.036 -2.279 1.00 0.37 C ATOM 612 C ASP A 256 -7.876 -0.546 -2.616 1.00 0.34 C ATOM 613 O ASP A 256 -7.466 -0.542 -3.760 1.00 0.31 O ATOM 614 CB ASP A 256 -9.371 -2.545 -2.527 1.00 0.41 C ATOM 615 CG ASP A 256 -10.640 -3.102 -1.879 1.00 0.47 C ATOM 616 OD1 ASP A 256 -10.990 -2.633 -0.809 1.00 1.12 O ATOM 617 OD2 ASP A 256 -11.238 -3.989 -2.465 1.00 1.12 O ATOM 0 H ASP A 256 -9.895 0.024 -4.027 1.00 0.34 H new ATOM 0 HA ASP A 256 -9.508 -0.827 -1.233 1.00 0.37 H new ATOM 0 HB2 ASP A 256 -9.379 -2.748 -3.598 1.00 0.41 H new ATOM 0 HB3 ASP A 256 -8.492 -3.041 -2.115 1.00 0.41 H new ATOM 622 N ILE A 257 -7.128 -0.124 -1.630 1.00 0.35 N ATOM 623 CA ILE A 257 -5.742 0.368 -1.895 1.00 0.33 C ATOM 624 C ILE A 257 -4.757 -0.794 -1.759 1.00 0.34 C ATOM 625 O ILE A 257 -4.819 -1.566 -0.822 1.00 0.38 O ATOM 626 CB ILE A 257 -5.392 1.470 -0.889 1.00 0.36 C ATOM 627 CG1 ILE A 257 -6.387 2.630 -1.064 1.00 0.36 C ATOM 628 CG2 ILE A 257 -3.959 1.952 -1.150 1.00 0.34 C ATOM 629 CD1 ILE A 257 -6.143 3.725 -0.005 1.00 0.47 C ATOM 0 H ILE A 257 -7.417 -0.099 -0.652 1.00 0.35 H new ATOM 0 HA ILE A 257 -5.682 0.773 -2.905 1.00 0.33 H new ATOM 0 HB ILE A 257 -5.456 1.091 0.131 1.00 0.36 H new ATOM 0 HG12 ILE A 257 -6.286 3.055 -2.063 1.00 0.36 H new ATOM 0 HG13 ILE A 257 -7.407 2.256 -0.979 1.00 0.36 H new ATOM 0 HG21 ILE A 257 -3.704 2.736 -0.438 1.00 0.34 H new ATOM 0 HG22 ILE A 257 -3.268 1.117 -1.034 1.00 0.34 H new ATOM 0 HG23 ILE A 257 -3.886 2.345 -2.164 1.00 0.34 H new ATOM 0 HD11 ILE A 257 -6.858 4.535 -0.148 1.00 0.47 H new ATOM 0 HD12 ILE A 257 -6.269 3.302 0.992 1.00 0.47 H new ATOM 0 HD13 ILE A 257 -5.130 4.113 -0.109 1.00 0.47 H new ATOM 641 N LYS A 258 -3.851 -0.931 -2.698 1.00 0.31 N ATOM 642 CA LYS A 258 -2.862 -2.051 -2.645 1.00 0.33 C ATOM 643 C LYS A 258 -1.471 -1.536 -3.018 1.00 0.30 C ATOM 644 O LYS A 258 -1.312 -0.430 -3.497 1.00 0.27 O ATOM 645 CB LYS A 258 -3.277 -3.134 -3.644 1.00 0.34 C ATOM 646 CG LYS A 258 -4.522 -3.860 -3.130 1.00 0.42 C ATOM 647 CD LYS A 258 -5.039 -4.813 -4.211 1.00 0.43 C ATOM 648 CE LYS A 258 -6.367 -5.426 -3.764 1.00 1.41 C ATOM 649 NZ LYS A 258 -6.870 -6.348 -4.822 1.00 2.11 N ATOM 0 H LYS A 258 -3.755 -0.311 -3.502 1.00 0.31 H new ATOM 0 HA LYS A 258 -2.837 -2.461 -1.635 1.00 0.33 H new ATOM 0 HB2 LYS A 258 -3.481 -2.686 -4.617 1.00 0.34 H new ATOM 0 HB3 LYS A 258 -2.462 -3.844 -3.785 1.00 0.34 H new ATOM 0 HG2 LYS A 258 -4.284 -4.416 -2.223 1.00 0.42 H new ATOM 0 HG3 LYS A 258 -5.295 -3.138 -2.867 1.00 0.42 H new ATOM 0 HD2 LYS A 258 -5.173 -4.275 -5.150 1.00 0.43 H new ATOM 0 HD3 LYS A 258 -4.308 -5.600 -4.396 1.00 0.43 H new ATOM 0 HE2 LYS A 258 -6.233 -5.968 -2.828 1.00 1.41 H new ATOM 0 HE3 LYS A 258 -7.097 -4.639 -3.575 1.00 1.41 H new ATOM 0 HZ1 LYS A 258 -7.773 -6.765 -4.518 1.00 2.11 H new ATOM 0 HZ2 LYS A 258 -7.013 -5.818 -5.705 1.00 2.11 H new ATOM 0 HZ3 LYS A 258 -6.175 -7.105 -4.982 1.00 2.11 H new ATOM 663 N VAL A 259 -0.459 -2.342 -2.803 1.00 0.30 N ATOM 664 CA VAL A 259 0.936 -1.926 -3.145 1.00 0.28 C ATOM 665 C VAL A 259 1.362 -2.604 -4.450 1.00 0.28 C ATOM 666 O VAL A 259 1.088 -3.768 -4.669 1.00 0.31 O ATOM 667 CB VAL A 259 1.883 -2.354 -2.022 1.00 0.30 C ATOM 668 CG1 VAL A 259 3.261 -1.729 -2.248 1.00 0.28 C ATOM 669 CG2 VAL A 259 1.327 -1.881 -0.677 1.00 0.33 C ATOM 0 H VAL A 259 -0.541 -3.276 -2.402 1.00 0.30 H new ATOM 0 HA VAL A 259 0.975 -0.843 -3.264 1.00 0.28 H new ATOM 0 HB VAL A 259 1.972 -3.440 -2.019 1.00 0.30 H new ATOM 0 HG11 VAL A 259 3.935 -2.034 -1.448 1.00 0.28 H new ATOM 0 HG12 VAL A 259 3.660 -2.064 -3.206 1.00 0.28 H new ATOM 0 HG13 VAL A 259 3.172 -0.643 -2.252 1.00 0.28 H new ATOM 0 HG21 VAL A 259 2.002 -2.186 0.123 1.00 0.33 H new ATOM 0 HG22 VAL A 259 1.238 -0.795 -0.682 1.00 0.33 H new ATOM 0 HG23 VAL A 259 0.345 -2.325 -0.513 1.00 0.33 H new ATOM 679 N VAL A 260 2.038 -1.884 -5.314 1.00 0.26 N ATOM 680 CA VAL A 260 2.498 -2.472 -6.610 1.00 0.26 C ATOM 681 C VAL A 260 3.982 -2.087 -6.827 1.00 0.24 C ATOM 682 O VAL A 260 4.318 -0.929 -6.683 1.00 0.22 O ATOM 683 CB VAL A 260 1.659 -1.886 -7.748 1.00 0.27 C ATOM 684 CG1 VAL A 260 1.993 -2.607 -9.054 1.00 0.34 C ATOM 685 CG2 VAL A 260 0.173 -2.074 -7.435 1.00 0.29 C ATOM 0 H VAL A 260 2.292 -0.906 -5.174 1.00 0.26 H new ATOM 0 HA VAL A 260 2.389 -3.556 -6.592 1.00 0.26 H new ATOM 0 HB VAL A 260 1.881 -0.824 -7.850 1.00 0.27 H new ATOM 0 HG11 VAL A 260 1.395 -2.189 -9.864 1.00 0.34 H new ATOM 0 HG12 VAL A 260 3.051 -2.478 -9.281 1.00 0.34 H new ATOM 0 HG13 VAL A 260 1.771 -3.669 -8.950 1.00 0.34 H new ATOM 0 HG21 VAL A 260 -0.425 -1.657 -8.245 1.00 0.29 H new ATOM 0 HG22 VAL A 260 -0.046 -3.137 -7.333 1.00 0.29 H new ATOM 0 HG23 VAL A 260 -0.070 -1.562 -6.504 1.00 0.29 H new ATOM 695 N PRO A 261 4.847 -3.037 -7.168 1.00 0.29 N ATOM 696 CA PRO A 261 6.270 -2.711 -7.393 1.00 0.30 C ATOM 697 C PRO A 261 6.399 -1.621 -8.468 1.00 0.25 C ATOM 698 O PRO A 261 5.729 -1.652 -9.481 1.00 0.24 O ATOM 699 CB PRO A 261 6.921 -4.035 -7.858 1.00 0.37 C ATOM 700 CG PRO A 261 5.834 -5.143 -7.773 1.00 0.42 C ATOM 701 CD PRO A 261 4.510 -4.468 -7.350 1.00 0.36 C ATOM 0 HA PRO A 261 6.755 -2.323 -6.497 1.00 0.30 H new ATOM 0 HB2 PRO A 261 7.295 -3.941 -8.878 1.00 0.37 H new ATOM 0 HB3 PRO A 261 7.774 -4.285 -7.228 1.00 0.37 H new ATOM 0 HG2 PRO A 261 5.719 -5.641 -8.736 1.00 0.42 H new ATOM 0 HG3 PRO A 261 6.122 -5.907 -7.051 1.00 0.42 H new ATOM 0 HD2 PRO A 261 3.741 -4.598 -8.111 1.00 0.36 H new ATOM 0 HD3 PRO A 261 4.123 -4.902 -6.428 1.00 0.36 H new ATOM 709 N ARG A 262 7.266 -0.669 -8.257 1.00 0.27 N ATOM 710 CA ARG A 262 7.443 0.413 -9.265 1.00 0.28 C ATOM 711 C ARG A 262 7.813 -0.202 -10.621 1.00 0.30 C ATOM 712 O ARG A 262 7.417 0.283 -11.662 1.00 0.35 O ATOM 713 CB ARG A 262 8.561 1.356 -8.809 1.00 0.35 C ATOM 714 CG ARG A 262 8.851 2.386 -9.916 1.00 0.59 C ATOM 715 CD ARG A 262 9.757 3.524 -9.390 1.00 1.04 C ATOM 716 NE ARG A 262 9.253 4.844 -9.890 1.00 1.77 N ATOM 717 CZ ARG A 262 8.936 5.017 -11.147 1.00 2.20 C ATOM 718 NH1 ARG A 262 9.181 4.086 -12.026 1.00 2.31 N ATOM 719 NH2 ARG A 262 8.405 6.146 -11.531 1.00 3.12 N ATOM 0 H ARG A 262 7.859 -0.594 -7.430 1.00 0.27 H new ATOM 0 HA ARG A 262 6.512 0.972 -9.364 1.00 0.28 H new ATOM 0 HB2 ARG A 262 8.269 1.866 -7.891 1.00 0.35 H new ATOM 0 HB3 ARG A 262 9.462 0.786 -8.584 1.00 0.35 H new ATOM 0 HG2 ARG A 262 9.334 1.892 -10.760 1.00 0.59 H new ATOM 0 HG3 ARG A 262 7.914 2.803 -10.284 1.00 0.59 H new ATOM 0 HD2 ARG A 262 9.769 3.518 -8.300 1.00 1.04 H new ATOM 0 HD3 ARG A 262 10.784 3.367 -9.721 1.00 1.04 H new ATOM 0 HE ARG A 262 9.155 5.622 -9.238 1.00 1.77 H new ATOM 0 HH11 ARG A 262 9.623 3.214 -11.735 1.00 2.31 H new ATOM 0 HH12 ARG A 262 8.930 4.230 -13.004 1.00 2.31 H new ATOM 0 HH21 ARG A 262 8.239 6.889 -10.852 1.00 3.12 H new ATOM 0 HH22 ARG A 262 8.156 6.286 -12.510 1.00 3.12 H new ATOM 733 N ARG A 263 8.585 -1.256 -10.615 1.00 0.34 N ATOM 734 CA ARG A 263 8.999 -1.892 -11.902 1.00 0.40 C ATOM 735 C ARG A 263 7.805 -2.575 -12.578 1.00 0.40 C ATOM 736 O ARG A 263 7.926 -3.095 -13.670 1.00 0.49 O ATOM 737 CB ARG A 263 10.105 -2.922 -11.643 1.00 0.48 C ATOM 738 CG ARG A 263 9.681 -3.890 -10.535 1.00 1.31 C ATOM 739 CD ARG A 263 10.856 -4.804 -10.186 1.00 1.59 C ATOM 740 NE ARG A 263 11.881 -4.023 -9.436 1.00 2.29 N ATOM 741 CZ ARG A 263 12.842 -4.639 -8.803 1.00 2.90 C ATOM 742 NH1 ARG A 263 12.911 -5.943 -8.831 1.00 3.07 N ATOM 743 NH2 ARG A 263 13.734 -3.952 -8.143 1.00 3.82 N ATOM 0 H ARG A 263 8.948 -1.705 -9.774 1.00 0.34 H new ATOM 0 HA ARG A 263 9.376 -1.113 -12.565 1.00 0.40 H new ATOM 0 HB2 ARG A 263 10.317 -3.476 -12.558 1.00 0.48 H new ATOM 0 HB3 ARG A 263 11.026 -2.413 -11.358 1.00 0.48 H new ATOM 0 HG2 ARG A 263 9.363 -3.334 -9.653 1.00 1.31 H new ATOM 0 HG3 ARG A 263 8.828 -4.484 -10.862 1.00 1.31 H new ATOM 0 HD2 ARG A 263 10.511 -5.645 -9.585 1.00 1.59 H new ATOM 0 HD3 ARG A 263 11.291 -5.219 -11.095 1.00 1.59 H new ATOM 0 HE ARG A 263 11.831 -3.004 -9.418 1.00 2.29 H new ATOM 0 HH11 ARG A 263 12.214 -6.480 -9.347 1.00 3.07 H new ATOM 0 HH12 ARG A 263 13.662 -6.425 -8.336 1.00 3.07 H new ATOM 0 HH21 ARG A 263 13.680 -2.934 -8.122 1.00 3.82 H new ATOM 0 HH22 ARG A 263 14.485 -4.433 -7.648 1.00 3.82 H new ATOM 757 N LYS A 264 6.651 -2.572 -11.951 1.00 0.36 N ATOM 758 CA LYS A 264 5.440 -3.216 -12.568 1.00 0.42 C ATOM 759 C LYS A 264 4.355 -2.156 -12.760 1.00 0.36 C ATOM 760 O LYS A 264 3.183 -2.464 -12.911 1.00 0.38 O ATOM 761 CB LYS A 264 4.906 -4.320 -11.645 1.00 0.54 C ATOM 762 CG LYS A 264 5.885 -5.509 -11.605 1.00 0.85 C ATOM 763 CD LYS A 264 5.133 -6.792 -11.221 1.00 0.95 C ATOM 764 CE LYS A 264 6.129 -7.854 -10.752 1.00 1.29 C ATOM 765 NZ LYS A 264 5.410 -9.142 -10.533 1.00 2.08 N ATOM 0 H LYS A 264 6.493 -2.151 -11.036 1.00 0.36 H new ATOM 0 HA LYS A 264 5.714 -3.652 -13.529 1.00 0.42 H new ATOM 0 HB2 LYS A 264 4.764 -3.924 -10.639 1.00 0.54 H new ATOM 0 HB3 LYS A 264 3.930 -4.656 -11.996 1.00 0.54 H new ATOM 0 HG2 LYS A 264 6.360 -5.633 -12.578 1.00 0.85 H new ATOM 0 HG3 LYS A 264 6.679 -5.313 -10.885 1.00 0.85 H new ATOM 0 HD2 LYS A 264 4.414 -6.580 -10.430 1.00 0.95 H new ATOM 0 HD3 LYS A 264 4.567 -7.163 -12.076 1.00 0.95 H new ATOM 0 HE2 LYS A 264 6.915 -7.985 -11.495 1.00 1.29 H new ATOM 0 HE3 LYS A 264 6.613 -7.533 -9.830 1.00 1.29 H new ATOM 0 HZ1 LYS A 264 6.085 -9.866 -10.214 1.00 2.08 H new ATOM 0 HZ2 LYS A 264 4.675 -9.011 -9.809 1.00 2.08 H new ATOM 0 HZ3 LYS A 264 4.968 -9.449 -11.423 1.00 2.08 H new ATOM 779 N ALA A 265 4.741 -0.905 -12.760 1.00 0.30 N ATOM 780 CA ALA A 265 3.751 0.197 -12.937 1.00 0.27 C ATOM 781 C ALA A 265 4.355 1.290 -13.826 1.00 0.28 C ATOM 782 O ALA A 265 5.526 1.267 -14.146 1.00 0.32 O ATOM 783 CB ALA A 265 3.413 0.788 -11.562 1.00 0.27 C ATOM 0 H ALA A 265 5.707 -0.599 -12.644 1.00 0.30 H new ATOM 0 HA ALA A 265 2.847 -0.191 -13.406 1.00 0.27 H new ATOM 0 HB1 ALA A 265 2.690 1.595 -11.681 1.00 0.27 H new ATOM 0 HB2 ALA A 265 2.989 0.011 -10.926 1.00 0.27 H new ATOM 0 HB3 ALA A 265 4.320 1.179 -11.101 1.00 0.27 H new ATOM 789 N LYS A 266 3.561 2.254 -14.216 1.00 0.26 N ATOM 790 CA LYS A 266 4.075 3.363 -15.079 1.00 0.30 C ATOM 791 C LYS A 266 3.462 4.684 -14.610 1.00 0.27 C ATOM 792 O LYS A 266 2.264 4.797 -14.449 1.00 0.25 O ATOM 793 CB LYS A 266 3.670 3.114 -16.541 1.00 0.35 C ATOM 794 CG LYS A 266 4.553 2.024 -17.168 1.00 0.43 C ATOM 795 CD LYS A 266 4.447 2.100 -18.695 1.00 0.50 C ATOM 796 CE LYS A 266 4.999 0.813 -19.313 1.00 1.09 C ATOM 797 NZ LYS A 266 6.134 0.313 -18.486 1.00 1.79 N ATOM 0 H LYS A 266 2.573 2.322 -13.973 1.00 0.26 H new ATOM 0 HA LYS A 266 5.162 3.406 -15.006 1.00 0.30 H new ATOM 0 HB2 LYS A 266 2.623 2.813 -16.588 1.00 0.35 H new ATOM 0 HB3 LYS A 266 3.762 4.038 -17.112 1.00 0.35 H new ATOM 0 HG2 LYS A 266 5.589 2.156 -16.857 1.00 0.43 H new ATOM 0 HG3 LYS A 266 4.239 1.040 -16.819 1.00 0.43 H new ATOM 0 HD2 LYS A 266 3.407 2.241 -18.991 1.00 0.50 H new ATOM 0 HD3 LYS A 266 5.003 2.961 -19.066 1.00 0.50 H new ATOM 0 HE2 LYS A 266 4.215 0.058 -19.368 1.00 1.09 H new ATOM 0 HE3 LYS A 266 5.333 1.001 -20.333 1.00 1.09 H new ATOM 0 HZ1 LYS A 266 6.717 -0.335 -19.053 1.00 1.79 H new ATOM 0 HZ2 LYS A 266 6.715 1.116 -18.172 1.00 1.79 H new ATOM 0 HZ3 LYS A 266 5.763 -0.191 -17.656 1.00 1.79 H new ATOM 811 N ILE A 267 4.272 5.683 -14.385 1.00 0.30 N ATOM 812 CA ILE A 267 3.732 6.999 -13.923 1.00 0.32 C ATOM 813 C ILE A 267 3.351 7.851 -15.136 1.00 0.37 C ATOM 814 O ILE A 267 4.205 8.362 -15.833 1.00 0.41 O ATOM 815 CB ILE A 267 4.804 7.739 -13.113 1.00 0.36 C ATOM 816 CG1 ILE A 267 5.361 6.812 -12.014 1.00 0.36 C ATOM 817 CG2 ILE A 267 4.209 9.023 -12.494 1.00 0.39 C ATOM 818 CD1 ILE A 267 4.223 6.196 -11.192 1.00 0.45 C ATOM 0 H ILE A 267 5.285 5.647 -14.500 1.00 0.30 H new ATOM 0 HA ILE A 267 2.853 6.826 -13.302 1.00 0.32 H new ATOM 0 HB ILE A 267 5.621 8.024 -13.775 1.00 0.36 H new ATOM 0 HG12 ILE A 267 5.957 6.020 -12.468 1.00 0.36 H new ATOM 0 HG13 ILE A 267 6.025 7.376 -11.359 1.00 0.36 H new ATOM 0 HG21 ILE A 267 4.978 9.541 -11.921 1.00 0.39 H new ATOM 0 HG22 ILE A 267 3.847 9.676 -13.288 1.00 0.39 H new ATOM 0 HG23 ILE A 267 3.381 8.760 -11.835 1.00 0.39 H new ATOM 0 HD11 ILE A 267 4.640 5.546 -10.423 1.00 0.45 H new ATOM 0 HD12 ILE A 267 3.643 6.990 -10.721 1.00 0.45 H new ATOM 0 HD13 ILE A 267 3.575 5.614 -11.847 1.00 0.45 H new ATOM 830 N ILE A 268 2.074 8.016 -15.386 1.00 0.39 N ATOM 831 CA ILE A 268 1.624 8.850 -16.549 1.00 0.45 C ATOM 832 C ILE A 268 1.089 10.179 -16.019 1.00 0.48 C ATOM 833 O ILE A 268 0.632 10.270 -14.900 1.00 0.47 O ATOM 834 CB ILE A 268 0.499 8.137 -17.321 1.00 0.48 C ATOM 835 CG1 ILE A 268 0.853 6.655 -17.573 1.00 0.50 C ATOM 836 CG2 ILE A 268 0.260 8.849 -18.656 1.00 0.56 C ATOM 837 CD1 ILE A 268 1.870 6.517 -18.716 1.00 0.57 C ATOM 0 H ILE A 268 1.320 7.608 -14.833 1.00 0.39 H new ATOM 0 HA ILE A 268 2.468 9.011 -17.220 1.00 0.45 H new ATOM 0 HB ILE A 268 -0.409 8.173 -16.719 1.00 0.48 H new ATOM 0 HG12 ILE A 268 1.262 6.216 -16.663 1.00 0.50 H new ATOM 0 HG13 ILE A 268 -0.052 6.098 -17.817 1.00 0.50 H new ATOM 0 HG21 ILE A 268 -0.537 8.343 -19.201 1.00 0.56 H new ATOM 0 HG22 ILE A 268 -0.028 9.884 -18.470 1.00 0.56 H new ATOM 0 HG23 ILE A 268 1.175 8.828 -19.248 1.00 0.56 H new ATOM 0 HD11 ILE A 268 2.101 5.463 -18.872 1.00 0.57 H new ATOM 0 HD12 ILE A 268 1.449 6.935 -19.630 1.00 0.57 H new ATOM 0 HD13 ILE A 268 2.783 7.054 -18.458 1.00 0.57 H new ATOM 849 N ARG A 269 1.136 11.209 -16.819 1.00 0.56 N ATOM 850 CA ARG A 269 0.628 12.538 -16.364 1.00 0.62 C ATOM 851 C ARG A 269 -0.870 12.644 -16.655 1.00 0.66 C ATOM 852 O ARG A 269 -1.368 12.077 -17.608 1.00 0.73 O ATOM 853 CB ARG A 269 1.367 13.649 -17.113 1.00 0.73 C ATOM 854 CG ARG A 269 0.977 15.009 -16.518 1.00 1.48 C ATOM 855 CD ARG A 269 1.784 16.143 -17.189 1.00 1.80 C ATOM 856 NE ARG A 269 2.243 17.123 -16.150 1.00 2.23 N ATOM 857 CZ ARG A 269 1.423 17.576 -15.236 1.00 2.82 C ATOM 858 NH1 ARG A 269 0.152 17.288 -15.285 1.00 3.12 N ATOM 859 NH2 ARG A 269 1.874 18.356 -14.292 1.00 3.63 N ATOM 0 H ARG A 269 1.505 11.189 -17.770 1.00 0.56 H new ATOM 0 HA ARG A 269 0.798 12.641 -15.292 1.00 0.62 H new ATOM 0 HB2 ARG A 269 2.444 13.501 -17.036 1.00 0.73 H new ATOM 0 HB3 ARG A 269 1.116 13.618 -18.173 1.00 0.73 H new ATOM 0 HG2 ARG A 269 -0.090 15.182 -16.658 1.00 1.48 H new ATOM 0 HG3 ARG A 269 1.162 15.009 -15.444 1.00 1.48 H new ATOM 0 HD2 ARG A 269 2.643 15.728 -17.715 1.00 1.80 H new ATOM 0 HD3 ARG A 269 1.168 16.649 -17.933 1.00 1.80 H new ATOM 0 HE ARG A 269 3.212 17.442 -16.156 1.00 2.23 H new ATOM 0 HH11 ARG A 269 -0.210 16.705 -16.040 1.00 3.12 H new ATOM 0 HH12 ARG A 269 -0.480 17.645 -14.568 1.00 3.12 H new ATOM 0 HH21 ARG A 269 2.862 18.610 -14.269 1.00 3.63 H new ATOM 0 HH22 ARG A 269 1.239 18.712 -13.577 1.00 3.63 H new ATOM 873 N ASP A 270 -1.595 13.370 -15.845 1.00 0.67 N ATOM 874 CA ASP A 270 -3.063 13.514 -16.079 1.00 0.75 C ATOM 875 C ASP A 270 -3.312 14.678 -17.042 1.00 1.18 C ATOM 876 O ASP A 270 -2.364 15.110 -17.676 1.00 1.73 O ATOM 877 CB ASP A 270 -3.768 13.794 -14.750 1.00 0.91 C ATOM 878 CG ASP A 270 -3.829 12.508 -13.924 1.00 1.47 C ATOM 879 OD1 ASP A 270 -2.985 11.650 -14.134 1.00 2.05 O ATOM 880 OD2 ASP A 270 -4.719 12.402 -13.095 1.00 2.05 O ATOM 881 OXT ASP A 270 -4.447 15.116 -17.128 1.00 1.84 O ATOM 0 H ASP A 270 -1.235 13.869 -15.032 1.00 0.67 H new ATOM 0 HA ASP A 270 -3.454 12.593 -16.510 1.00 0.75 H new ATOM 0 HB2 ASP A 270 -3.234 14.568 -14.199 1.00 0.91 H new ATOM 0 HB3 ASP A 270 -4.775 14.170 -14.932 1.00 0.91 H new TER 886 ASP A 270 ATOM 887 N MET B 219 1.467 17.893 5.639 1.00 1.76 N ATOM 888 CA MET B 219 2.747 17.175 5.892 1.00 1.15 C ATOM 889 C MET B 219 2.656 16.424 7.221 1.00 1.04 C ATOM 890 O MET B 219 2.278 16.979 8.232 1.00 1.10 O ATOM 891 CB MET B 219 3.897 18.186 5.950 1.00 1.82 C ATOM 892 CG MET B 219 3.651 19.178 7.090 1.00 2.31 C ATOM 893 SD MET B 219 4.721 20.622 6.873 1.00 3.46 S ATOM 894 CE MET B 219 3.744 21.778 7.865 1.00 3.83 C ATOM 0 HA MET B 219 2.931 16.464 5.087 1.00 1.15 H new ATOM 0 HB2 MET B 219 4.843 17.667 6.104 1.00 1.82 H new ATOM 0 HB3 MET B 219 3.975 18.718 5.002 1.00 1.82 H new ATOM 0 HG2 MET B 219 2.605 19.485 7.100 1.00 2.31 H new ATOM 0 HG3 MET B 219 3.853 18.703 8.050 1.00 2.31 H new ATOM 0 HE1 MET B 219 4.229 22.754 7.870 1.00 3.83 H new ATOM 0 HE2 MET B 219 2.746 21.871 7.437 1.00 3.83 H new ATOM 0 HE3 MET B 219 3.667 21.406 8.887 1.00 3.83 H new ATOM 904 N ILE B 220 3.002 15.164 7.227 1.00 0.98 N ATOM 905 CA ILE B 220 2.936 14.376 8.494 1.00 0.97 C ATOM 906 C ILE B 220 4.211 14.622 9.306 1.00 0.94 C ATOM 907 O ILE B 220 5.304 14.646 8.773 1.00 1.01 O ATOM 908 CB ILE B 220 2.813 12.882 8.161 1.00 1.03 C ATOM 909 CG1 ILE B 220 2.761 12.050 9.454 1.00 1.36 C ATOM 910 CG2 ILE B 220 4.022 12.446 7.333 1.00 1.79 C ATOM 911 CD1 ILE B 220 1.555 12.467 10.308 1.00 2.08 C ATOM 0 H ILE B 220 3.327 14.646 6.411 1.00 0.98 H new ATOM 0 HA ILE B 220 2.068 14.686 9.077 1.00 0.97 H new ATOM 0 HB ILE B 220 1.895 12.721 7.596 1.00 1.03 H new ATOM 0 HG12 ILE B 220 2.693 10.990 9.210 1.00 1.36 H new ATOM 0 HG13 ILE B 220 3.682 12.188 10.021 1.00 1.36 H new ATOM 0 HG21 ILE B 220 3.937 11.386 7.095 1.00 1.79 H new ATOM 0 HG22 ILE B 220 4.057 13.023 6.409 1.00 1.79 H new ATOM 0 HG23 ILE B 220 4.935 12.618 7.903 1.00 1.79 H new ATOM 0 HD11 ILE B 220 1.531 11.870 11.220 1.00 2.08 H new ATOM 0 HD12 ILE B 220 1.640 13.522 10.567 1.00 2.08 H new ATOM 0 HD13 ILE B 220 0.636 12.305 9.744 1.00 2.08 H new ATOM 923 N GLN B 221 4.082 14.805 10.593 1.00 0.90 N ATOM 924 CA GLN B 221 5.285 15.048 11.446 1.00 0.92 C ATOM 925 C GLN B 221 5.862 13.704 11.898 1.00 0.83 C ATOM 926 O GLN B 221 5.789 12.718 11.192 1.00 0.85 O ATOM 927 CB GLN B 221 4.886 15.871 12.675 1.00 1.00 C ATOM 928 CG GLN B 221 4.146 17.137 12.231 1.00 1.28 C ATOM 929 CD GLN B 221 3.561 17.841 13.456 1.00 1.61 C ATOM 930 OE1 GLN B 221 2.572 17.403 14.008 1.00 2.08 O ATOM 931 NE2 GLN B 221 4.135 18.923 13.908 1.00 2.16 N ATOM 0 H GLN B 221 3.193 14.797 11.093 1.00 0.90 H new ATOM 0 HA GLN B 221 6.034 15.595 10.873 1.00 0.92 H new ATOM 0 HB2 GLN B 221 4.249 15.277 13.331 1.00 1.00 H new ATOM 0 HB3 GLN B 221 5.773 16.139 13.249 1.00 1.00 H new ATOM 0 HG2 GLN B 221 4.829 17.805 11.706 1.00 1.28 H new ATOM 0 HG3 GLN B 221 3.351 16.880 11.532 1.00 1.28 H new ATOM 0 HE21 GLN B 221 4.966 19.291 13.445 1.00 2.16 H new ATOM 0 HE22 GLN B 221 3.753 19.400 14.724 1.00 2.16 H new ATOM 940 N ASN B 222 6.420 13.650 13.080 1.00 0.78 N ATOM 941 CA ASN B 222 6.992 12.363 13.584 1.00 0.73 C ATOM 942 C ASN B 222 5.921 11.625 14.394 1.00 0.63 C ATOM 943 O ASN B 222 5.505 12.073 15.445 1.00 0.64 O ATOM 944 CB ASN B 222 8.198 12.657 14.480 1.00 0.80 C ATOM 945 CG ASN B 222 9.278 13.372 13.665 1.00 0.93 C ATOM 946 OD1 ASN B 222 9.496 14.556 13.830 1.00 1.48 O ATOM 947 ND2 ASN B 222 9.970 12.697 12.787 1.00 1.39 N ATOM 0 H ASN B 222 6.505 14.441 13.719 1.00 0.78 H new ATOM 0 HA ASN B 222 7.310 11.746 12.744 1.00 0.73 H new ATOM 0 HB2 ASN B 222 7.895 13.276 15.324 1.00 0.80 H new ATOM 0 HB3 ASN B 222 8.593 11.728 14.892 1.00 0.80 H new ATOM 0 HD21 ASN B 222 10.693 13.164 12.240 1.00 1.39 H new ATOM 0 HD22 ASN B 222 9.787 11.703 12.648 1.00 1.39 H new ATOM 954 N PHE B 223 5.467 10.497 13.904 1.00 0.55 N ATOM 955 CA PHE B 223 4.413 9.715 14.627 1.00 0.46 C ATOM 956 C PHE B 223 4.794 8.230 14.639 1.00 0.38 C ATOM 957 O PHE B 223 5.302 7.704 13.667 1.00 0.38 O ATOM 958 CB PHE B 223 3.070 9.878 13.895 1.00 0.46 C ATOM 959 CG PHE B 223 2.427 11.196 14.264 1.00 0.53 C ATOM 960 CD1 PHE B 223 1.682 11.309 15.453 1.00 0.54 C ATOM 961 CD2 PHE B 223 2.565 12.309 13.412 1.00 0.64 C ATOM 962 CE1 PHE B 223 1.076 12.535 15.793 1.00 0.64 C ATOM 963 CE2 PHE B 223 1.958 13.534 13.749 1.00 0.73 C ATOM 964 CZ PHE B 223 1.214 13.646 14.941 1.00 0.72 C ATOM 0 H PHE B 223 5.783 10.081 13.028 1.00 0.55 H new ATOM 0 HA PHE B 223 4.328 10.082 15.650 1.00 0.46 H new ATOM 0 HB2 PHE B 223 3.228 9.832 12.817 1.00 0.46 H new ATOM 0 HB3 PHE B 223 2.404 9.055 14.155 1.00 0.46 H new ATOM 0 HD1 PHE B 223 1.575 10.455 16.105 1.00 0.54 H new ATOM 0 HD2 PHE B 223 3.137 12.223 12.500 1.00 0.64 H new ATOM 0 HE1 PHE B 223 0.506 12.622 16.706 1.00 0.64 H new ATOM 0 HE2 PHE B 223 2.062 14.387 13.095 1.00 0.73 H new ATOM 0 HZ PHE B 223 0.749 14.586 15.201 1.00 0.72 H new ATOM 974 N ARG B 224 4.526 7.549 15.725 1.00 0.36 N ATOM 975 CA ARG B 224 4.836 6.085 15.815 1.00 0.30 C ATOM 976 C ARG B 224 3.507 5.330 15.780 1.00 0.26 C ATOM 977 O ARG B 224 2.473 5.882 16.101 1.00 0.28 O ATOM 978 CB ARG B 224 5.571 5.790 17.134 1.00 0.34 C ATOM 979 CG ARG B 224 7.072 6.055 16.961 1.00 1.00 C ATOM 980 CD ARG B 224 7.734 6.190 18.335 1.00 1.24 C ATOM 981 NE ARG B 224 7.373 5.016 19.178 1.00 1.82 N ATOM 982 CZ ARG B 224 8.044 4.768 20.269 1.00 2.35 C ATOM 983 NH1 ARG B 224 9.027 5.550 20.623 1.00 2.57 N ATOM 984 NH2 ARG B 224 7.732 3.738 21.007 1.00 3.26 N ATOM 0 H ARG B 224 4.101 7.947 16.563 1.00 0.36 H new ATOM 0 HA ARG B 224 5.475 5.774 14.988 1.00 0.30 H new ATOM 0 HB2 ARG B 224 5.171 6.416 17.932 1.00 0.34 H new ATOM 0 HB3 ARG B 224 5.407 4.754 17.429 1.00 0.34 H new ATOM 0 HG2 ARG B 224 7.533 5.240 16.403 1.00 1.00 H new ATOM 0 HG3 ARG B 224 7.226 6.965 16.381 1.00 1.00 H new ATOM 0 HD2 ARG B 224 8.817 6.253 18.224 1.00 1.24 H new ATOM 0 HD3 ARG B 224 7.409 7.112 18.818 1.00 1.24 H new ATOM 0 HE ARG B 224 6.602 4.407 18.903 1.00 1.82 H new ATOM 0 HH11 ARG B 224 9.271 6.355 20.047 1.00 2.57 H new ATOM 0 HH12 ARG B 224 9.551 5.356 21.476 1.00 2.57 H new ATOM 0 HH21 ARG B 224 6.964 3.127 20.731 1.00 3.26 H new ATOM 0 HH22 ARG B 224 8.257 3.544 21.860 1.00 3.26 H new ATOM 998 N VAL B 225 3.512 4.082 15.383 1.00 0.22 N ATOM 999 CA VAL B 225 2.226 3.315 15.319 1.00 0.20 C ATOM 1000 C VAL B 225 2.436 1.872 15.773 1.00 0.20 C ATOM 1001 O VAL B 225 3.447 1.260 15.496 1.00 0.22 O ATOM 1002 CB VAL B 225 1.716 3.310 13.877 1.00 0.20 C ATOM 1003 CG1 VAL B 225 0.418 2.504 13.794 1.00 0.20 C ATOM 1004 CG2 VAL B 225 1.449 4.745 13.427 1.00 0.23 C ATOM 0 H VAL B 225 4.344 3.562 15.102 1.00 0.22 H new ATOM 0 HA VAL B 225 1.501 3.792 15.979 1.00 0.20 H new ATOM 0 HB VAL B 225 2.467 2.857 13.230 1.00 0.20 H new ATOM 0 HG11 VAL B 225 0.056 2.502 12.766 1.00 0.20 H new ATOM 0 HG12 VAL B 225 0.605 1.479 14.115 1.00 0.20 H new ATOM 0 HG13 VAL B 225 -0.333 2.956 14.442 1.00 0.20 H new ATOM 0 HG21 VAL B 225 1.086 4.742 12.399 1.00 0.23 H new ATOM 0 HG22 VAL B 225 0.699 5.196 14.076 1.00 0.23 H new ATOM 0 HG23 VAL B 225 2.372 5.322 13.484 1.00 0.23 H new ATOM 1014 N TYR B 226 1.456 1.321 16.444 1.00 0.22 N ATOM 1015 CA TYR B 226 1.536 -0.098 16.906 1.00 0.25 C ATOM 1016 C TYR B 226 0.519 -0.903 16.100 1.00 0.26 C ATOM 1017 O TYR B 226 -0.439 -0.361 15.594 1.00 0.26 O ATOM 1018 CB TYR B 226 1.188 -0.179 18.395 1.00 0.32 C ATOM 1019 CG TYR B 226 2.340 0.350 19.222 1.00 0.35 C ATOM 1020 CD1 TYR B 226 2.623 1.730 19.233 1.00 0.42 C ATOM 1021 CD2 TYR B 226 3.124 -0.535 19.988 1.00 0.42 C ATOM 1022 CE1 TYR B 226 3.688 2.224 20.009 1.00 0.50 C ATOM 1023 CE2 TYR B 226 4.192 -0.041 20.761 1.00 0.48 C ATOM 1024 CZ TYR B 226 4.473 1.339 20.773 1.00 0.49 C ATOM 1025 OH TYR B 226 5.519 1.823 21.533 1.00 0.58 O ATOM 0 H TYR B 226 0.592 1.801 16.695 1.00 0.22 H new ATOM 0 HA TYR B 226 2.543 -0.491 16.762 1.00 0.25 H new ATOM 0 HB2 TYR B 226 0.287 0.399 18.599 1.00 0.32 H new ATOM 0 HB3 TYR B 226 0.974 -1.211 18.672 1.00 0.32 H new ATOM 0 HD1 TYR B 226 2.023 2.409 18.646 1.00 0.42 H new ATOM 0 HD2 TYR B 226 2.906 -1.593 19.982 1.00 0.42 H new ATOM 0 HE1 TYR B 226 3.903 3.282 20.019 1.00 0.50 H new ATOM 0 HE2 TYR B 226 4.796 -0.720 21.345 1.00 0.48 H new ATOM 0 HH TYR B 226 5.956 1.080 21.999 1.00 0.58 H new ATOM 1035 N TYR B 227 0.711 -2.185 15.959 1.00 0.29 N ATOM 1036 CA TYR B 227 -0.260 -2.985 15.156 1.00 0.32 C ATOM 1037 C TYR B 227 -0.207 -4.454 15.573 1.00 0.38 C ATOM 1038 O TYR B 227 0.807 -4.948 16.024 1.00 0.39 O ATOM 1039 CB TYR B 227 0.105 -2.866 13.672 1.00 0.31 C ATOM 1040 CG TYR B 227 1.536 -3.319 13.466 1.00 0.31 C ATOM 1041 CD1 TYR B 227 2.604 -2.515 13.916 1.00 0.28 C ATOM 1042 CD2 TYR B 227 1.803 -4.545 12.822 1.00 0.39 C ATOM 1043 CE1 TYR B 227 3.933 -2.938 13.724 1.00 0.32 C ATOM 1044 CE2 TYR B 227 3.133 -4.965 12.631 1.00 0.42 C ATOM 1045 CZ TYR B 227 4.198 -4.162 13.082 1.00 0.38 C ATOM 1046 OH TYR B 227 5.500 -4.575 12.893 1.00 0.44 O ATOM 0 H TYR B 227 1.488 -2.710 16.359 1.00 0.29 H new ATOM 0 HA TYR B 227 -1.267 -2.606 15.327 1.00 0.32 H new ATOM 0 HB2 TYR B 227 -0.570 -3.474 13.070 1.00 0.31 H new ATOM 0 HB3 TYR B 227 -0.013 -1.835 13.339 1.00 0.31 H new ATOM 0 HD1 TYR B 227 2.402 -1.575 14.408 1.00 0.28 H new ATOM 0 HD2 TYR B 227 0.987 -5.162 12.475 1.00 0.39 H new ATOM 0 HE1 TYR B 227 4.750 -2.322 14.070 1.00 0.32 H new ATOM 0 HE2 TYR B 227 3.337 -5.904 12.138 1.00 0.42 H new ATOM 0 HH TYR B 227 5.555 -5.122 12.082 1.00 0.44 H new ATOM 1056 N ARG B 228 -1.299 -5.158 15.419 1.00 0.43 N ATOM 1057 CA ARG B 228 -1.317 -6.604 15.804 1.00 0.50 C ATOM 1058 C ARG B 228 -0.964 -7.461 14.588 1.00 0.55 C ATOM 1059 O ARG B 228 -1.417 -7.217 13.488 1.00 0.61 O ATOM 1060 CB ARG B 228 -2.715 -6.982 16.310 1.00 0.56 C ATOM 1061 CG ARG B 228 -3.233 -5.884 17.248 1.00 0.67 C ATOM 1062 CD ARG B 228 -4.343 -6.439 18.149 1.00 0.73 C ATOM 1063 NE ARG B 228 -5.255 -7.331 17.357 1.00 1.49 N ATOM 1064 CZ ARG B 228 -5.851 -6.913 16.272 1.00 1.73 C ATOM 1065 NH1 ARG B 228 -5.811 -5.652 15.938 1.00 1.49 N ATOM 1066 NH2 ARG B 228 -6.536 -7.753 15.547 1.00 2.76 N ATOM 0 H ARG B 228 -2.177 -4.797 15.045 1.00 0.43 H new ATOM 0 HA ARG B 228 -0.586 -6.778 16.594 1.00 0.50 H new ATOM 0 HB2 ARG B 228 -3.396 -7.108 15.469 1.00 0.56 H new ATOM 0 HB3 ARG B 228 -2.678 -7.936 16.835 1.00 0.56 H new ATOM 0 HG2 ARG B 228 -2.415 -5.502 17.859 1.00 0.67 H new ATOM 0 HG3 ARG B 228 -3.613 -5.046 16.664 1.00 0.67 H new ATOM 0 HD2 ARG B 228 -3.905 -6.997 18.977 1.00 0.73 H new ATOM 0 HD3 ARG B 228 -4.913 -5.618 18.584 1.00 0.73 H new ATOM 0 HE ARG B 228 -5.413 -8.287 17.674 1.00 1.49 H new ATOM 0 HH11 ARG B 228 -5.312 -4.984 16.526 1.00 1.49 H new ATOM 0 HH12 ARG B 228 -6.279 -5.334 15.089 1.00 1.49 H new ATOM 0 HH21 ARG B 228 -6.605 -8.731 15.828 1.00 2.76 H new ATOM 0 HH22 ARG B 228 -7.003 -7.432 14.699 1.00 2.76 H new ATOM 1080 N ASP B 229 -0.154 -8.468 14.782 1.00 0.59 N ATOM 1081 CA ASP B 229 0.241 -9.355 13.647 1.00 0.67 C ATOM 1082 C ASP B 229 -0.692 -10.567 13.600 1.00 0.75 C ATOM 1083 O ASP B 229 -1.480 -10.790 14.499 1.00 0.77 O ATOM 1084 CB ASP B 229 1.684 -9.827 13.855 1.00 0.73 C ATOM 1085 CG ASP B 229 2.226 -10.411 12.548 1.00 1.42 C ATOM 1086 OD1 ASP B 229 1.933 -9.851 11.505 1.00 2.08 O ATOM 1087 OD2 ASP B 229 2.927 -11.408 12.614 1.00 2.23 O ATOM 0 H ASP B 229 0.254 -8.716 15.683 1.00 0.59 H new ATOM 0 HA ASP B 229 0.168 -8.806 12.708 1.00 0.67 H new ATOM 0 HB2 ASP B 229 2.307 -8.993 14.179 1.00 0.73 H new ATOM 0 HB3 ASP B 229 1.722 -10.578 14.644 1.00 0.73 H new ATOM 1092 N SER B 230 -0.608 -11.353 12.560 1.00 0.85 N ATOM 1093 CA SER B 230 -1.487 -12.555 12.454 1.00 0.99 C ATOM 1094 C SER B 230 -0.821 -13.737 13.163 1.00 1.05 C ATOM 1095 O SER B 230 -1.418 -14.779 13.345 1.00 1.19 O ATOM 1096 CB SER B 230 -1.694 -12.901 10.979 1.00 1.08 C ATOM 1097 OG SER B 230 -2.574 -14.012 10.876 1.00 1.81 O ATOM 0 H SER B 230 0.032 -11.215 11.778 1.00 0.85 H new ATOM 0 HA SER B 230 -2.450 -12.346 12.920 1.00 0.99 H new ATOM 0 HB2 SER B 230 -2.108 -12.044 10.447 1.00 1.08 H new ATOM 0 HB3 SER B 230 -0.738 -13.135 10.511 1.00 1.08 H new ATOM 0 HG SER B 230 -2.390 -14.643 11.603 1.00 1.81 H new ATOM 1103 N ARG B 231 0.413 -13.584 13.562 1.00 1.01 N ATOM 1104 CA ARG B 231 1.124 -14.700 14.257 1.00 1.12 C ATOM 1105 C ARG B 231 0.866 -14.627 15.765 1.00 1.15 C ATOM 1106 O ARG B 231 1.167 -15.550 16.496 1.00 1.31 O ATOM 1107 CB ARG B 231 2.627 -14.585 13.996 1.00 1.15 C ATOM 1108 CG ARG B 231 2.895 -14.634 12.489 1.00 1.19 C ATOM 1109 CD ARG B 231 2.467 -15.994 11.916 1.00 1.48 C ATOM 1110 NE ARG B 231 3.265 -16.282 10.692 1.00 2.10 N ATOM 1111 CZ ARG B 231 3.298 -17.492 10.204 1.00 2.68 C ATOM 1112 NH1 ARG B 231 2.626 -18.450 10.782 1.00 2.81 N ATOM 1113 NH2 ARG B 231 4.003 -17.745 9.136 1.00 3.64 N ATOM 0 H ARG B 231 0.962 -12.733 13.437 1.00 1.01 H new ATOM 0 HA ARG B 231 0.754 -15.651 13.875 1.00 1.12 H new ATOM 0 HB2 ARG B 231 3.008 -13.653 14.413 1.00 1.15 H new ATOM 0 HB3 ARG B 231 3.156 -15.397 14.496 1.00 1.15 H new ATOM 0 HG2 ARG B 231 2.350 -13.833 11.989 1.00 1.19 H new ATOM 0 HG3 ARG B 231 3.955 -14.467 12.295 1.00 1.19 H new ATOM 0 HD2 ARG B 231 2.619 -16.779 12.657 1.00 1.48 H new ATOM 0 HD3 ARG B 231 1.404 -15.983 11.677 1.00 1.48 H new ATOM 0 HE ARG B 231 3.786 -15.533 10.235 1.00 2.10 H new ATOM 0 HH11 ARG B 231 2.074 -18.254 11.617 1.00 2.81 H new ATOM 0 HH12 ARG B 231 2.653 -19.395 10.399 1.00 2.81 H new ATOM 0 HH21 ARG B 231 4.528 -16.997 8.683 1.00 3.64 H new ATOM 0 HH22 ARG B 231 4.029 -18.691 8.754 1.00 3.64 H new ATOM 1127 N ASP B 232 0.323 -13.539 16.244 1.00 1.03 N ATOM 1128 CA ASP B 232 0.066 -13.419 17.705 1.00 1.08 C ATOM 1129 C ASP B 232 -1.017 -12.331 17.952 1.00 0.95 C ATOM 1130 O ASP B 232 -0.948 -11.276 17.355 1.00 0.83 O ATOM 1131 CB ASP B 232 1.379 -13.036 18.385 1.00 1.15 C ATOM 1132 CG ASP B 232 1.785 -11.609 18.006 1.00 1.62 C ATOM 1133 OD1 ASP B 232 1.331 -11.133 16.979 1.00 2.13 O ATOM 1134 OD2 ASP B 232 2.559 -11.022 18.741 1.00 2.16 O ATOM 0 H ASP B 232 0.048 -12.731 15.686 1.00 1.03 H new ATOM 0 HA ASP B 232 -0.298 -14.362 18.114 1.00 1.08 H new ATOM 0 HB2 ASP B 232 1.271 -13.114 19.467 1.00 1.15 H new ATOM 0 HB3 ASP B 232 2.164 -13.733 18.092 1.00 1.15 H new ATOM 1139 N PRO B 233 -2.008 -12.599 18.797 1.00 1.03 N ATOM 1140 CA PRO B 233 -3.081 -11.608 19.055 1.00 0.98 C ATOM 1141 C PRO B 233 -2.546 -10.370 19.802 1.00 0.86 C ATOM 1142 O PRO B 233 -3.259 -9.400 19.977 1.00 0.84 O ATOM 1143 CB PRO B 233 -4.107 -12.365 19.933 1.00 1.15 C ATOM 1144 CG PRO B 233 -3.428 -13.680 20.402 1.00 1.27 C ATOM 1145 CD PRO B 233 -2.160 -13.872 19.544 1.00 1.21 C ATOM 0 HA PRO B 233 -3.512 -11.233 18.127 1.00 0.98 H new ATOM 0 HB2 PRO B 233 -4.403 -11.758 20.789 1.00 1.15 H new ATOM 0 HB3 PRO B 233 -5.013 -12.581 19.367 1.00 1.15 H new ATOM 0 HG2 PRO B 233 -3.171 -13.624 21.460 1.00 1.27 H new ATOM 0 HG3 PRO B 233 -4.105 -14.526 20.282 1.00 1.27 H new ATOM 0 HD2 PRO B 233 -1.288 -14.071 20.167 1.00 1.21 H new ATOM 0 HD3 PRO B 233 -2.267 -14.718 18.865 1.00 1.21 H new ATOM 1153 N VAL B 234 -1.320 -10.383 20.254 1.00 0.86 N ATOM 1154 CA VAL B 234 -0.798 -9.188 20.993 1.00 0.81 C ATOM 1155 C VAL B 234 -0.275 -8.143 20.011 1.00 0.70 C ATOM 1156 O VAL B 234 -0.033 -8.417 18.853 1.00 0.73 O ATOM 1157 CB VAL B 234 0.329 -9.601 21.941 1.00 0.91 C ATOM 1158 CG1 VAL B 234 1.429 -10.318 21.160 1.00 1.74 C ATOM 1159 CG2 VAL B 234 0.912 -8.356 22.625 1.00 1.76 C ATOM 0 H VAL B 234 -0.663 -11.156 20.148 1.00 0.86 H new ATOM 0 HA VAL B 234 -1.617 -8.760 21.571 1.00 0.81 H new ATOM 0 HB VAL B 234 -0.071 -10.276 22.698 1.00 0.91 H new ATOM 0 HG11 VAL B 234 2.228 -10.609 21.841 1.00 1.74 H new ATOM 0 HG12 VAL B 234 1.016 -11.207 20.684 1.00 1.74 H new ATOM 0 HG13 VAL B 234 1.828 -9.650 20.397 1.00 1.74 H new ATOM 0 HG21 VAL B 234 1.715 -8.654 23.300 1.00 1.76 H new ATOM 0 HG22 VAL B 234 1.306 -7.677 21.869 1.00 1.76 H new ATOM 0 HG23 VAL B 234 0.129 -7.852 23.192 1.00 1.76 H new ATOM 1169 N TRP B 235 -0.095 -6.945 20.484 1.00 0.65 N ATOM 1170 CA TRP B 235 0.416 -5.851 19.606 1.00 0.56 C ATOM 1171 C TRP B 235 1.861 -6.154 19.198 1.00 0.54 C ATOM 1172 O TRP B 235 2.506 -7.011 19.770 1.00 0.66 O ATOM 1173 CB TRP B 235 0.369 -4.524 20.373 1.00 0.56 C ATOM 1174 CG TRP B 235 -1.052 -4.192 20.694 1.00 0.58 C ATOM 1175 CD1 TRP B 235 -1.686 -4.508 21.847 1.00 0.66 C ATOM 1176 CD2 TRP B 235 -2.028 -3.498 19.867 1.00 0.54 C ATOM 1177 NE1 TRP B 235 -2.992 -4.052 21.781 1.00 0.67 N ATOM 1178 CE2 TRP B 235 -3.253 -3.421 20.582 1.00 0.60 C ATOM 1179 CE3 TRP B 235 -1.970 -2.928 18.574 1.00 0.47 C ATOM 1180 CZ2 TRP B 235 -4.384 -2.800 20.031 1.00 0.60 C ATOM 1181 CZ3 TRP B 235 -3.104 -2.302 18.017 1.00 0.47 C ATOM 1182 CH2 TRP B 235 -4.308 -2.239 18.744 1.00 0.53 C ATOM 0 H TRP B 235 -0.280 -6.671 21.449 1.00 0.65 H new ATOM 0 HA TRP B 235 -0.204 -5.780 18.712 1.00 0.56 H new ATOM 0 HB2 TRP B 235 0.953 -4.599 21.290 1.00 0.56 H new ATOM 0 HB3 TRP B 235 0.815 -3.729 19.775 1.00 0.56 H new ATOM 0 HD1 TRP B 235 -1.245 -5.031 22.683 1.00 0.66 H new ATOM 0 HE1 TRP B 235 -3.677 -4.168 22.528 1.00 0.67 H new ATOM 0 HE3 TRP B 235 -1.051 -2.973 18.009 1.00 0.47 H new ATOM 0 HZ2 TRP B 235 -5.306 -2.753 20.591 1.00 0.60 H new ATOM 0 HZ3 TRP B 235 -3.049 -1.869 17.029 1.00 0.47 H new ATOM 0 HH2 TRP B 235 -5.174 -1.759 18.313 1.00 0.53 H new ATOM 1193 N LYS B 236 2.376 -5.451 18.215 1.00 0.46 N ATOM 1194 CA LYS B 236 3.785 -5.684 17.753 1.00 0.45 C ATOM 1195 C LYS B 236 4.602 -4.402 17.943 1.00 0.44 C ATOM 1196 O LYS B 236 4.061 -3.339 18.174 1.00 0.67 O ATOM 1197 CB LYS B 236 3.773 -6.076 16.270 1.00 0.47 C ATOM 1198 CG LYS B 236 5.188 -6.479 15.814 1.00 0.81 C ATOM 1199 CD LYS B 236 5.096 -7.413 14.600 1.00 0.73 C ATOM 1200 CE LYS B 236 6.455 -7.492 13.898 1.00 1.09 C ATOM 1201 NZ LYS B 236 6.511 -8.723 13.060 1.00 1.44 N ATOM 0 H LYS B 236 1.877 -4.720 17.709 1.00 0.46 H new ATOM 0 HA LYS B 236 4.236 -6.487 18.336 1.00 0.45 H new ATOM 0 HB2 LYS B 236 3.082 -6.904 16.111 1.00 0.47 H new ATOM 0 HB3 LYS B 236 3.413 -5.241 15.669 1.00 0.47 H new ATOM 0 HG2 LYS B 236 5.764 -5.590 15.558 1.00 0.81 H new ATOM 0 HG3 LYS B 236 5.715 -6.977 16.628 1.00 0.81 H new ATOM 0 HD2 LYS B 236 4.783 -8.407 14.918 1.00 0.73 H new ATOM 0 HD3 LYS B 236 4.339 -7.048 13.906 1.00 0.73 H new ATOM 0 HE2 LYS B 236 6.607 -6.609 13.277 1.00 1.09 H new ATOM 0 HE3 LYS B 236 7.257 -7.505 14.636 1.00 1.09 H new ATOM 0 HZ1 LYS B 236 7.434 -8.777 12.583 1.00 1.44 H new ATOM 0 HZ2 LYS B 236 6.384 -9.560 13.664 1.00 1.44 H new ATOM 0 HZ3 LYS B 236 5.754 -8.692 12.347 1.00 1.44 H new ATOM 1215 N GLY B 237 5.904 -4.498 17.856 1.00 0.40 N ATOM 1216 CA GLY B 237 6.762 -3.289 18.047 1.00 0.37 C ATOM 1217 C GLY B 237 6.175 -2.099 17.265 1.00 0.31 C ATOM 1218 O GLY B 237 5.341 -2.292 16.404 1.00 0.31 O ATOM 0 H GLY B 237 6.411 -5.362 17.661 1.00 0.40 H new ATOM 0 HA2 GLY B 237 6.827 -3.042 19.107 1.00 0.37 H new ATOM 0 HA3 GLY B 237 7.776 -3.495 17.705 1.00 0.37 H new ATOM 1222 N PRO B 238 6.623 -0.894 17.583 1.00 0.31 N ATOM 1223 CA PRO B 238 6.131 0.319 16.897 1.00 0.29 C ATOM 1224 C PRO B 238 6.583 0.328 15.427 1.00 0.24 C ATOM 1225 O PRO B 238 7.479 -0.393 15.032 1.00 0.27 O ATOM 1226 CB PRO B 238 6.775 1.497 17.668 1.00 0.36 C ATOM 1227 CG PRO B 238 7.836 0.893 18.631 1.00 0.41 C ATOM 1228 CD PRO B 238 7.627 -0.638 18.643 1.00 0.38 C ATOM 0 HA PRO B 238 5.042 0.375 16.890 1.00 0.29 H new ATOM 0 HB2 PRO B 238 7.239 2.201 16.977 1.00 0.36 H new ATOM 0 HB3 PRO B 238 6.020 2.050 18.226 1.00 0.36 H new ATOM 0 HG2 PRO B 238 8.843 1.141 18.297 1.00 0.41 H new ATOM 0 HG3 PRO B 238 7.723 1.304 19.634 1.00 0.41 H new ATOM 0 HD2 PRO B 238 8.559 -1.166 18.440 1.00 0.38 H new ATOM 0 HD3 PRO B 238 7.272 -0.981 19.615 1.00 0.38 H new ATOM 1236 N ALA B 239 5.972 1.164 14.626 1.00 0.19 N ATOM 1237 CA ALA B 239 6.354 1.263 13.185 1.00 0.18 C ATOM 1238 C ALA B 239 6.334 2.735 12.767 1.00 0.17 C ATOM 1239 O ALA B 239 5.975 3.599 13.542 1.00 0.18 O ATOM 1240 CB ALA B 239 5.354 0.481 12.334 1.00 0.21 C ATOM 0 H ALA B 239 5.218 1.788 14.912 1.00 0.19 H new ATOM 0 HA ALA B 239 7.351 0.848 13.040 1.00 0.18 H new ATOM 0 HB1 ALA B 239 5.635 0.555 11.283 1.00 0.21 H new ATOM 0 HB2 ALA B 239 5.358 -0.566 12.638 1.00 0.21 H new ATOM 0 HB3 ALA B 239 4.356 0.896 12.473 1.00 0.21 H new ATOM 1246 N LYS B 240 6.714 3.030 11.549 1.00 0.18 N ATOM 1247 CA LYS B 240 6.711 4.454 11.079 1.00 0.21 C ATOM 1248 C LYS B 240 5.411 4.723 10.306 1.00 0.19 C ATOM 1249 O LYS B 240 4.959 3.898 9.534 1.00 0.18 O ATOM 1250 CB LYS B 240 7.932 4.686 10.166 1.00 0.27 C ATOM 1251 CG LYS B 240 8.413 6.138 10.279 1.00 1.15 C ATOM 1252 CD LYS B 240 9.665 6.333 9.419 1.00 1.44 C ATOM 1253 CE LYS B 240 10.381 7.621 9.834 1.00 2.03 C ATOM 1254 NZ LYS B 240 9.457 8.778 9.666 1.00 2.72 N ATOM 0 H LYS B 240 7.027 2.348 10.858 1.00 0.18 H new ATOM 0 HA LYS B 240 6.768 5.133 11.930 1.00 0.21 H new ATOM 0 HB2 LYS B 240 8.737 4.006 10.445 1.00 0.27 H new ATOM 0 HB3 LYS B 240 7.669 4.462 9.132 1.00 0.27 H new ATOM 0 HG2 LYS B 240 7.626 6.819 9.953 1.00 1.15 H new ATOM 0 HG3 LYS B 240 8.633 6.379 11.319 1.00 1.15 H new ATOM 0 HD2 LYS B 240 10.334 5.480 9.535 1.00 1.44 H new ATOM 0 HD3 LYS B 240 9.390 6.382 8.365 1.00 1.44 H new ATOM 0 HE2 LYS B 240 10.708 7.550 10.871 1.00 2.03 H new ATOM 0 HE3 LYS B 240 11.275 7.765 9.227 1.00 2.03 H new ATOM 0 HZ1 LYS B 240 9.996 9.665 9.732 1.00 2.72 H new ATOM 0 HZ2 LYS B 240 8.996 8.722 8.735 1.00 2.72 H new ATOM 0 HZ3 LYS B 240 8.733 8.756 10.413 1.00 2.72 H new ATOM 1268 N LEU B 241 4.813 5.872 10.504 1.00 0.20 N ATOM 1269 CA LEU B 241 3.537 6.201 9.788 1.00 0.20 C ATOM 1270 C LEU B 241 3.852 6.873 8.446 1.00 0.23 C ATOM 1271 O LEU B 241 4.493 7.906 8.398 1.00 0.30 O ATOM 1272 CB LEU B 241 2.709 7.163 10.657 1.00 0.23 C ATOM 1273 CG LEU B 241 1.501 7.700 9.871 1.00 0.24 C ATOM 1274 CD1 LEU B 241 0.716 6.540 9.251 1.00 0.29 C ATOM 1275 CD2 LEU B 241 0.588 8.477 10.825 1.00 0.30 C ATOM 0 H LEU B 241 5.153 6.600 11.132 1.00 0.20 H new ATOM 0 HA LEU B 241 2.975 5.285 9.606 1.00 0.20 H new ATOM 0 HB2 LEU B 241 2.366 6.647 11.554 1.00 0.23 H new ATOM 0 HB3 LEU B 241 3.334 7.993 10.986 1.00 0.23 H new ATOM 0 HG LEU B 241 1.854 8.355 9.074 1.00 0.24 H new ATOM 0 HD11 LEU B 241 -0.137 6.933 8.697 1.00 0.29 H new ATOM 0 HD12 LEU B 241 1.364 5.983 8.574 1.00 0.29 H new ATOM 0 HD13 LEU B 241 0.362 5.877 10.041 1.00 0.29 H new ATOM 0 HD21 LEU B 241 -0.271 8.861 10.275 1.00 0.30 H new ATOM 0 HD22 LEU B 241 0.244 7.815 11.619 1.00 0.30 H new ATOM 0 HD23 LEU B 241 1.141 9.309 11.261 1.00 0.30 H new ATOM 1287 N LEU B 242 3.391 6.302 7.357 1.00 0.22 N ATOM 1288 CA LEU B 242 3.642 6.903 6.007 1.00 0.26 C ATOM 1289 C LEU B 242 2.331 7.457 5.432 1.00 0.26 C ATOM 1290 O LEU B 242 2.121 8.652 5.382 1.00 0.28 O ATOM 1291 CB LEU B 242 4.182 5.828 5.058 1.00 0.27 C ATOM 1292 CG LEU B 242 5.289 5.024 5.743 1.00 0.32 C ATOM 1293 CD1 LEU B 242 5.863 4.018 4.741 1.00 0.31 C ATOM 1294 CD2 LEU B 242 6.393 5.976 6.221 1.00 0.45 C ATOM 0 H LEU B 242 2.848 5.439 7.346 1.00 0.22 H new ATOM 0 HA LEU B 242 4.369 7.709 6.108 1.00 0.26 H new ATOM 0 HB2 LEU B 242 3.374 5.162 4.754 1.00 0.27 H new ATOM 0 HB3 LEU B 242 4.569 6.294 4.152 1.00 0.27 H new ATOM 0 HG LEU B 242 4.885 4.491 6.604 1.00 0.32 H new ATOM 0 HD11 LEU B 242 6.653 3.439 5.219 1.00 0.31 H new ATOM 0 HD12 LEU B 242 5.073 3.346 4.407 1.00 0.31 H new ATOM 0 HD13 LEU B 242 6.272 4.552 3.883 1.00 0.31 H new ATOM 0 HD21 LEU B 242 7.181 5.403 6.709 1.00 0.45 H new ATOM 0 HD22 LEU B 242 6.808 6.510 5.366 1.00 0.45 H new ATOM 0 HD23 LEU B 242 5.975 6.693 6.928 1.00 0.45 H new ATOM 1306 N TRP B 243 1.453 6.595 4.979 1.00 0.26 N ATOM 1307 CA TRP B 243 0.163 7.069 4.384 1.00 0.27 C ATOM 1308 C TRP B 243 -0.927 7.143 5.461 1.00 0.23 C ATOM 1309 O TRP B 243 -0.981 6.333 6.364 1.00 0.22 O ATOM 1310 CB TRP B 243 -0.271 6.082 3.286 1.00 0.31 C ATOM 1311 CG TRP B 243 -1.242 6.737 2.360 1.00 0.30 C ATOM 1312 CD1 TRP B 243 -0.939 7.724 1.491 1.00 0.32 C ATOM 1313 CD2 TRP B 243 -2.661 6.466 2.191 1.00 0.29 C ATOM 1314 NE1 TRP B 243 -2.079 8.088 0.806 1.00 0.33 N ATOM 1315 CE2 TRP B 243 -3.170 7.345 1.200 1.00 0.31 C ATOM 1316 CE3 TRP B 243 -3.555 5.555 2.799 1.00 0.28 C ATOM 1317 CZ2 TRP B 243 -4.518 7.324 0.823 1.00 0.32 C ATOM 1318 CZ3 TRP B 243 -4.913 5.528 2.421 1.00 0.29 C ATOM 1319 CH2 TRP B 243 -5.393 6.412 1.435 1.00 0.31 C ATOM 0 H TRP B 243 1.574 5.582 4.995 1.00 0.26 H new ATOM 0 HA TRP B 243 0.306 8.064 3.962 1.00 0.27 H new ATOM 0 HB2 TRP B 243 0.601 5.740 2.728 1.00 0.31 H new ATOM 0 HB3 TRP B 243 -0.726 5.201 3.738 1.00 0.31 H new ATOM 0 HD1 TRP B 243 0.040 8.159 1.354 1.00 0.32 H new ATOM 0 HE1 TRP B 243 -2.111 8.818 0.094 1.00 0.33 H new ATOM 0 HE3 TRP B 243 -3.195 4.876 3.558 1.00 0.28 H new ATOM 0 HZ2 TRP B 243 -4.882 8.004 0.067 1.00 0.32 H new ATOM 0 HZ3 TRP B 243 -5.588 4.827 2.889 1.00 0.29 H new ATOM 0 HH2 TRP B 243 -6.434 6.388 1.150 1.00 0.31 H new ATOM 1330 N LYS B 244 -1.806 8.109 5.358 1.00 0.24 N ATOM 1331 CA LYS B 244 -2.912 8.246 6.357 1.00 0.24 C ATOM 1332 C LYS B 244 -4.146 8.818 5.655 1.00 0.25 C ATOM 1333 O LYS B 244 -4.109 9.904 5.109 1.00 0.29 O ATOM 1334 CB LYS B 244 -2.474 9.196 7.476 1.00 0.31 C ATOM 1335 CG LYS B 244 -3.642 9.431 8.440 1.00 0.72 C ATOM 1336 CD LYS B 244 -3.144 10.199 9.666 1.00 0.82 C ATOM 1337 CE LYS B 244 -4.326 10.543 10.577 1.00 1.51 C ATOM 1338 NZ LYS B 244 -3.922 11.612 11.533 1.00 2.33 N ATOM 0 H LYS B 244 -1.805 8.813 4.620 1.00 0.24 H new ATOM 0 HA LYS B 244 -3.148 7.271 6.784 1.00 0.24 H new ATOM 0 HB2 LYS B 244 -1.625 8.773 8.014 1.00 0.31 H new ATOM 0 HB3 LYS B 244 -2.143 10.144 7.053 1.00 0.31 H new ATOM 0 HG2 LYS B 244 -4.432 9.993 7.941 1.00 0.72 H new ATOM 0 HG3 LYS B 244 -4.073 8.478 8.745 1.00 0.72 H new ATOM 0 HD2 LYS B 244 -2.415 9.599 10.211 1.00 0.82 H new ATOM 0 HD3 LYS B 244 -2.636 11.111 9.354 1.00 0.82 H new ATOM 0 HE2 LYS B 244 -5.174 10.876 9.979 1.00 1.51 H new ATOM 0 HE3 LYS B 244 -4.649 9.656 11.122 1.00 1.51 H new ATOM 0 HZ1 LYS B 244 -4.725 11.846 12.152 1.00 2.33 H new ATOM 0 HZ2 LYS B 244 -3.125 11.277 12.111 1.00 2.33 H new ATOM 0 HZ3 LYS B 244 -3.634 12.460 11.004 1.00 2.33 H new ATOM 1352 N GLY B 245 -5.244 8.103 5.659 1.00 0.24 N ATOM 1353 CA GLY B 245 -6.471 8.625 4.983 1.00 0.27 C ATOM 1354 C GLY B 245 -7.725 7.985 5.587 1.00 0.26 C ATOM 1355 O GLY B 245 -8.137 8.310 6.681 1.00 0.28 O ATOM 0 H GLY B 245 -5.343 7.187 6.098 1.00 0.24 H new ATOM 0 HA2 GLY B 245 -6.520 9.709 5.090 1.00 0.27 H new ATOM 0 HA3 GLY B 245 -6.424 8.412 3.915 1.00 0.27 H new ATOM 1359 N GLU B 246 -8.340 7.084 4.867 1.00 0.27 N ATOM 1360 CA GLU B 246 -9.578 6.426 5.378 1.00 0.28 C ATOM 1361 C GLU B 246 -9.237 5.535 6.575 1.00 0.24 C ATOM 1362 O GLU B 246 -8.270 5.762 7.275 1.00 0.22 O ATOM 1363 CB GLU B 246 -10.193 5.570 4.266 1.00 0.33 C ATOM 1364 CG GLU B 246 -10.474 6.443 3.040 1.00 1.00 C ATOM 1365 CD GLU B 246 -10.769 5.550 1.832 1.00 0.92 C ATOM 1366 OE1 GLU B 246 -9.822 5.074 1.224 1.00 1.40 O ATOM 1367 OE2 GLU B 246 -11.936 5.355 1.535 1.00 1.40 O ATOM 0 H GLU B 246 -8.037 6.775 3.944 1.00 0.27 H new ATOM 0 HA GLU B 246 -10.289 7.191 5.691 1.00 0.28 H new ATOM 0 HB2 GLU B 246 -9.514 4.760 4.000 1.00 0.33 H new ATOM 0 HB3 GLU B 246 -11.117 5.110 4.617 1.00 0.33 H new ATOM 0 HG2 GLU B 246 -11.322 7.100 3.235 1.00 1.00 H new ATOM 0 HG3 GLU B 246 -9.616 7.082 2.832 1.00 1.00 H new ATOM 1374 N GLY B 247 -10.027 4.520 6.814 1.00 0.26 N ATOM 1375 CA GLY B 247 -9.753 3.611 7.965 1.00 0.25 C ATOM 1376 C GLY B 247 -8.601 2.670 7.608 1.00 0.25 C ATOM 1377 O GLY B 247 -8.683 1.470 7.786 1.00 0.29 O ATOM 0 H GLY B 247 -10.850 4.282 6.261 1.00 0.26 H new ATOM 0 HA2 GLY B 247 -9.500 4.194 8.850 1.00 0.25 H new ATOM 0 HA3 GLY B 247 -10.646 3.035 8.208 1.00 0.25 H new ATOM 1381 N ALA B 248 -7.524 3.211 7.109 1.00 0.22 N ATOM 1382 CA ALA B 248 -6.352 2.372 6.735 1.00 0.24 C ATOM 1383 C ALA B 248 -5.078 3.187 6.953 1.00 0.21 C ATOM 1384 O ALA B 248 -5.084 4.398 6.842 1.00 0.23 O ATOM 1385 CB ALA B 248 -6.458 1.969 5.262 1.00 0.29 C ATOM 0 H ALA B 248 -7.405 4.210 6.943 1.00 0.22 H new ATOM 0 HA ALA B 248 -6.328 1.472 7.349 1.00 0.24 H new ATOM 0 HB1 ALA B 248 -5.599 1.355 4.990 1.00 0.29 H new ATOM 0 HB2 ALA B 248 -7.375 1.401 5.105 1.00 0.29 H new ATOM 0 HB3 ALA B 248 -6.475 2.864 4.640 1.00 0.29 H new ATOM 1391 N VAL B 249 -3.986 2.542 7.268 1.00 0.20 N ATOM 1392 CA VAL B 249 -2.716 3.292 7.498 1.00 0.19 C ATOM 1393 C VAL B 249 -1.530 2.474 6.985 1.00 0.20 C ATOM 1394 O VAL B 249 -1.358 1.321 7.327 1.00 0.22 O ATOM 1395 CB VAL B 249 -2.543 3.568 8.997 1.00 0.18 C ATOM 1396 CG1 VAL B 249 -3.535 4.651 9.428 1.00 0.31 C ATOM 1397 CG2 VAL B 249 -2.809 2.291 9.801 1.00 0.30 C ATOM 0 H VAL B 249 -3.918 1.530 7.376 1.00 0.20 H new ATOM 0 HA VAL B 249 -2.757 4.239 6.959 1.00 0.19 H new ATOM 0 HB VAL B 249 -1.522 3.902 9.184 1.00 0.18 H new ATOM 0 HG11 VAL B 249 -3.416 4.851 10.493 1.00 0.31 H new ATOM 0 HG12 VAL B 249 -3.344 5.564 8.864 1.00 0.31 H new ATOM 0 HG13 VAL B 249 -4.552 4.311 9.234 1.00 0.31 H new ATOM 0 HG21 VAL B 249 -2.684 2.497 10.864 1.00 0.30 H new ATOM 0 HG22 VAL B 249 -3.827 1.950 9.615 1.00 0.30 H new ATOM 0 HG23 VAL B 249 -2.105 1.516 9.496 1.00 0.30 H new ATOM 1407 N VAL B 250 -0.707 3.069 6.164 1.00 0.21 N ATOM 1408 CA VAL B 250 0.481 2.340 5.630 1.00 0.23 C ATOM 1409 C VAL B 250 1.651 2.568 6.583 1.00 0.21 C ATOM 1410 O VAL B 250 1.878 3.668 7.044 1.00 0.22 O ATOM 1411 CB VAL B 250 0.845 2.880 4.242 1.00 0.27 C ATOM 1412 CG1 VAL B 250 2.059 2.123 3.703 1.00 0.27 C ATOM 1413 CG2 VAL B 250 -0.342 2.697 3.287 1.00 0.30 C ATOM 0 H VAL B 250 -0.806 4.031 5.839 1.00 0.21 H new ATOM 0 HA VAL B 250 0.257 1.276 5.547 1.00 0.23 H new ATOM 0 HB VAL B 250 1.083 3.941 4.318 1.00 0.27 H new ATOM 0 HG11 VAL B 250 2.318 2.507 2.716 1.00 0.27 H new ATOM 0 HG12 VAL B 250 2.903 2.260 4.379 1.00 0.27 H new ATOM 0 HG13 VAL B 250 1.823 1.062 3.629 1.00 0.27 H new ATOM 0 HG21 VAL B 250 -0.079 3.082 2.302 1.00 0.30 H new ATOM 0 HG22 VAL B 250 -0.586 1.638 3.209 1.00 0.30 H new ATOM 0 HG23 VAL B 250 -1.205 3.241 3.671 1.00 0.30 H new ATOM 1423 N ILE B 251 2.394 1.536 6.891 1.00 0.20 N ATOM 1424 CA ILE B 251 3.546 1.692 7.828 1.00 0.19 C ATOM 1425 C ILE B 251 4.728 0.865 7.334 1.00 0.20 C ATOM 1426 O ILE B 251 4.652 0.183 6.332 1.00 0.24 O ATOM 1427 CB ILE B 251 3.141 1.202 9.222 1.00 0.16 C ATOM 1428 CG1 ILE B 251 2.719 -0.271 9.141 1.00 0.19 C ATOM 1429 CG2 ILE B 251 1.974 2.045 9.747 1.00 0.17 C ATOM 1430 CD1 ILE B 251 2.152 -0.722 10.491 1.00 0.19 C ATOM 0 H ILE B 251 2.252 0.591 6.533 1.00 0.20 H new ATOM 0 HA ILE B 251 3.830 2.743 7.873 1.00 0.19 H new ATOM 0 HB ILE B 251 3.987 1.301 9.902 1.00 0.16 H new ATOM 0 HG12 ILE B 251 1.971 -0.402 8.359 1.00 0.19 H new ATOM 0 HG13 ILE B 251 3.574 -0.890 8.870 1.00 0.19 H new ATOM 0 HG21 ILE B 251 1.689 1.694 10.739 1.00 0.17 H new ATOM 0 HG22 ILE B 251 2.278 3.090 9.806 1.00 0.17 H new ATOM 0 HG23 ILE B 251 1.124 1.952 9.071 1.00 0.17 H new ATOM 0 HD11 ILE B 251 1.854 -1.769 10.429 1.00 0.19 H new ATOM 0 HD12 ILE B 251 2.914 -0.607 11.262 1.00 0.19 H new ATOM 0 HD13 ILE B 251 1.285 -0.112 10.744 1.00 0.19 H new ATOM 1442 N GLN B 252 5.822 0.910 8.046 1.00 0.20 N ATOM 1443 CA GLN B 252 7.021 0.113 7.645 1.00 0.23 C ATOM 1444 C GLN B 252 7.690 -0.433 8.906 1.00 0.24 C ATOM 1445 O GLN B 252 8.243 0.306 9.695 1.00 0.27 O ATOM 1446 CB GLN B 252 8.018 0.997 6.876 1.00 0.28 C ATOM 1447 CG GLN B 252 8.988 0.115 6.088 1.00 0.31 C ATOM 1448 CD GLN B 252 10.045 0.996 5.420 1.00 0.98 C ATOM 1449 OE1 GLN B 252 9.896 1.341 4.171 1.00 1.69 O flip ATOM 1450 NE2 GLN B 252 11.017 1.374 6.043 1.00 1.81 N flip ATOM 0 H GLN B 252 5.939 1.467 8.893 1.00 0.20 H new ATOM 0 HA GLN B 252 6.711 -0.707 6.997 1.00 0.23 H new ATOM 0 HB2 GLN B 252 7.482 1.661 6.198 1.00 0.28 H new ATOM 0 HB3 GLN B 252 8.570 1.630 7.572 1.00 0.28 H new ATOM 0 HG2 GLN B 252 9.465 -0.604 6.753 1.00 0.31 H new ATOM 0 HG3 GLN B 252 8.447 -0.458 5.335 1.00 0.31 H new ATOM 0 HE21 GLN B 252 11.133 1.104 7.020 1.00 1.81 H new ATOM 0 HE22 GLN B 252 11.717 1.961 5.589 1.00 1.81 H new ATOM 1459 N ASP B 253 7.647 -1.722 9.104 1.00 0.26 N ATOM 1460 CA ASP B 253 8.291 -2.314 10.313 1.00 0.30 C ATOM 1461 C ASP B 253 9.724 -2.683 9.940 1.00 0.32 C ATOM 1462 O ASP B 253 10.647 -1.932 10.184 1.00 0.35 O ATOM 1463 CB ASP B 253 7.515 -3.559 10.752 1.00 0.36 C ATOM 1464 CG ASP B 253 8.058 -4.049 12.097 1.00 0.49 C ATOM 1465 OD1 ASP B 253 8.126 -3.247 13.015 1.00 1.18 O ATOM 1466 OD2 ASP B 253 8.400 -5.217 12.185 1.00 1.18 O ATOM 0 H ASP B 253 7.194 -2.391 8.482 1.00 0.26 H new ATOM 0 HA ASP B 253 8.290 -1.605 11.141 1.00 0.30 H new ATOM 0 HB2 ASP B 253 6.453 -3.328 10.839 1.00 0.36 H new ATOM 0 HB3 ASP B 253 7.610 -4.344 10.001 1.00 0.36 H new ATOM 1471 N ASN B 254 9.922 -3.808 9.315 1.00 0.33 N ATOM 1472 CA ASN B 254 11.299 -4.172 8.892 1.00 0.37 C ATOM 1473 C ASN B 254 11.591 -3.370 7.625 1.00 0.34 C ATOM 1474 O ASN B 254 11.366 -2.177 7.584 1.00 0.37 O ATOM 1475 CB ASN B 254 11.373 -5.674 8.591 1.00 0.42 C ATOM 1476 CG ASN B 254 12.838 -6.115 8.545 1.00 1.22 C ATOM 1477 OD1 ASN B 254 13.419 -6.221 7.484 1.00 1.97 O ATOM 1478 ND2 ASN B 254 13.466 -6.376 9.662 1.00 1.89 N ATOM 0 H ASN B 254 9.196 -4.486 9.081 1.00 0.33 H new ATOM 0 HA ASN B 254 12.025 -3.951 9.674 1.00 0.37 H new ATOM 0 HB2 ASN B 254 10.837 -6.236 9.356 1.00 0.42 H new ATOM 0 HB3 ASN B 254 10.888 -5.889 7.639 1.00 0.42 H new ATOM 0 HD21 ASN B 254 14.443 -6.668 9.641 1.00 1.89 H new ATOM 0 HD22 ASN B 254 12.979 -6.287 10.554 1.00 1.89 H new ATOM 1485 N SER B 255 12.054 -4.008 6.582 1.00 0.35 N ATOM 1486 CA SER B 255 12.319 -3.273 5.305 1.00 0.37 C ATOM 1487 C SER B 255 11.216 -3.630 4.306 1.00 0.38 C ATOM 1488 O SER B 255 11.476 -4.076 3.206 1.00 0.43 O ATOM 1489 CB SER B 255 13.680 -3.693 4.744 1.00 0.42 C ATOM 1490 OG SER B 255 13.845 -5.095 4.911 1.00 1.38 O ATOM 0 H SER B 255 12.261 -5.007 6.557 1.00 0.35 H new ATOM 0 HA SER B 255 12.328 -2.198 5.484 1.00 0.37 H new ATOM 0 HB2 SER B 255 13.748 -3.431 3.688 1.00 0.42 H new ATOM 0 HB3 SER B 255 14.479 -3.158 5.257 1.00 0.42 H new ATOM 0 HG SER B 255 13.810 -5.317 5.865 1.00 1.38 H new ATOM 1496 N ASP B 256 9.981 -3.445 4.692 1.00 0.35 N ATOM 1497 CA ASP B 256 8.846 -3.779 3.781 1.00 0.38 C ATOM 1498 C ASP B 256 7.621 -2.953 4.180 1.00 0.34 C ATOM 1499 O ASP B 256 7.218 -2.935 5.327 1.00 0.31 O ATOM 1500 CB ASP B 256 8.511 -5.268 3.900 1.00 0.42 C ATOM 1501 CG ASP B 256 9.584 -6.094 3.188 1.00 0.47 C ATOM 1502 OD1 ASP B 256 10.056 -5.651 2.155 1.00 1.12 O ATOM 1503 OD2 ASP B 256 9.915 -7.158 3.687 1.00 1.12 O ATOM 0 H ASP B 256 9.708 -3.075 5.603 1.00 0.35 H new ATOM 0 HA ASP B 256 9.127 -3.552 2.753 1.00 0.38 H new ATOM 0 HB2 ASP B 256 8.454 -5.555 4.950 1.00 0.42 H new ATOM 0 HB3 ASP B 256 7.533 -5.467 3.461 1.00 0.42 H new ATOM 1508 N ILE B 257 7.027 -2.261 3.244 1.00 0.36 N ATOM 1509 CA ILE B 257 5.827 -1.432 3.569 1.00 0.34 C ATOM 1510 C ILE B 257 4.562 -2.265 3.350 1.00 0.35 C ATOM 1511 O ILE B 257 4.419 -2.942 2.352 1.00 0.39 O ATOM 1512 CB ILE B 257 5.799 -0.197 2.665 1.00 0.37 C ATOM 1513 CG1 ILE B 257 7.072 0.627 2.923 1.00 0.37 C ATOM 1514 CG2 ILE B 257 4.552 0.635 2.989 1.00 0.35 C ATOM 1515 CD1 ILE B 257 7.146 1.833 1.967 1.00 0.48 C ATOM 0 H ILE B 257 7.320 -2.233 2.268 1.00 0.36 H new ATOM 0 HA ILE B 257 5.873 -1.112 4.610 1.00 0.34 H new ATOM 0 HB ILE B 257 5.763 -0.491 1.616 1.00 0.37 H new ATOM 0 HG12 ILE B 257 7.082 0.975 3.956 1.00 0.37 H new ATOM 0 HG13 ILE B 257 7.952 -0.003 2.790 1.00 0.37 H new ATOM 0 HG21 ILE B 257 4.526 1.516 2.348 1.00 0.35 H new ATOM 0 HG22 ILE B 257 3.659 0.034 2.816 1.00 0.35 H new ATOM 0 HG23 ILE B 257 4.583 0.946 4.033 1.00 0.35 H new ATOM 0 HD11 ILE B 257 8.054 2.401 2.168 1.00 0.48 H new ATOM 0 HD12 ILE B 257 7.159 1.480 0.936 1.00 0.48 H new ATOM 0 HD13 ILE B 257 6.277 2.473 2.120 1.00 0.48 H new ATOM 1527 N LYS B 258 3.645 -2.226 4.289 1.00 0.32 N ATOM 1528 CA LYS B 258 2.387 -3.026 4.157 1.00 0.34 C ATOM 1529 C LYS B 258 1.187 -2.183 4.595 1.00 0.30 C ATOM 1530 O LYS B 258 1.333 -1.120 5.167 1.00 0.28 O ATOM 1531 CB LYS B 258 2.482 -4.262 5.057 1.00 0.35 C ATOM 1532 CG LYS B 258 3.485 -5.254 4.465 1.00 0.43 C ATOM 1533 CD LYS B 258 3.711 -6.399 5.453 1.00 0.44 C ATOM 1534 CE LYS B 258 4.823 -7.312 4.936 1.00 1.42 C ATOM 1535 NZ LYS B 258 5.046 -8.423 5.905 1.00 2.13 N ATOM 0 H LYS B 258 3.715 -1.673 5.143 1.00 0.32 H new ATOM 0 HA LYS B 258 2.259 -3.327 3.117 1.00 0.34 H new ATOM 0 HB2 LYS B 258 2.793 -3.970 6.060 1.00 0.35 H new ATOM 0 HB3 LYS B 258 1.503 -4.732 5.151 1.00 0.35 H new ATOM 0 HG2 LYS B 258 3.111 -5.644 3.518 1.00 0.43 H new ATOM 0 HG3 LYS B 258 4.428 -4.751 4.252 1.00 0.43 H new ATOM 0 HD2 LYS B 258 3.979 -6.001 6.431 1.00 0.44 H new ATOM 0 HD3 LYS B 258 2.790 -6.968 5.582 1.00 0.44 H new ATOM 0 HE2 LYS B 258 4.553 -7.715 3.960 1.00 1.42 H new ATOM 0 HE3 LYS B 258 5.743 -6.742 4.802 1.00 1.42 H new ATOM 0 HZ1 LYS B 258 5.802 -9.044 5.553 1.00 2.13 H new ATOM 0 HZ2 LYS B 258 5.322 -8.029 6.827 1.00 2.13 H new ATOM 0 HZ3 LYS B 258 4.169 -8.972 6.012 1.00 2.13 H new ATOM 1549 N VAL B 259 -0.004 -2.659 4.329 1.00 0.31 N ATOM 1550 CA VAL B 259 -1.236 -1.908 4.726 1.00 0.29 C ATOM 1551 C VAL B 259 -1.843 -2.553 5.974 1.00 0.28 C ATOM 1552 O VAL B 259 -1.901 -3.762 6.089 1.00 0.31 O ATOM 1553 CB VAL B 259 -2.255 -1.963 3.585 1.00 0.30 C ATOM 1554 CG1 VAL B 259 -3.411 -1.006 3.883 1.00 0.29 C ATOM 1555 CG2 VAL B 259 -1.580 -1.549 2.276 1.00 0.34 C ATOM 0 H VAL B 259 -0.177 -3.543 3.850 1.00 0.31 H new ATOM 0 HA VAL B 259 -0.977 -0.870 4.937 1.00 0.29 H new ATOM 0 HB VAL B 259 -2.638 -2.979 3.493 1.00 0.30 H new ATOM 0 HG11 VAL B 259 -4.136 -1.046 3.070 1.00 0.29 H new ATOM 0 HG12 VAL B 259 -3.895 -1.299 4.815 1.00 0.29 H new ATOM 0 HG13 VAL B 259 -3.027 0.010 3.977 1.00 0.29 H new ATOM 0 HG21 VAL B 259 -2.306 -1.588 1.464 1.00 0.34 H new ATOM 0 HG22 VAL B 259 -1.196 -0.533 2.370 1.00 0.34 H new ATOM 0 HG23 VAL B 259 -0.757 -2.230 2.060 1.00 0.34 H new ATOM 1565 N VAL B 260 -2.301 -1.752 6.908 1.00 0.26 N ATOM 1566 CA VAL B 260 -2.918 -2.301 8.156 1.00 0.27 C ATOM 1567 C VAL B 260 -4.240 -1.544 8.427 1.00 0.25 C ATOM 1568 O VAL B 260 -4.244 -0.330 8.384 1.00 0.22 O ATOM 1569 CB VAL B 260 -1.959 -2.065 9.327 1.00 0.28 C ATOM 1570 CG1 VAL B 260 -2.488 -2.776 10.572 1.00 0.34 C ATOM 1571 CG2 VAL B 260 -0.579 -2.624 8.975 1.00 0.29 C ATOM 0 H VAL B 260 -2.273 -0.734 6.857 1.00 0.26 H new ATOM 0 HA VAL B 260 -3.112 -3.368 8.044 1.00 0.27 H new ATOM 0 HB VAL B 260 -1.883 -0.995 9.522 1.00 0.28 H new ATOM 0 HG11 VAL B 260 -1.805 -2.608 11.405 1.00 0.34 H new ATOM 0 HG12 VAL B 260 -3.473 -2.383 10.825 1.00 0.34 H new ATOM 0 HG13 VAL B 260 -2.564 -3.845 10.376 1.00 0.34 H new ATOM 0 HG21 VAL B 260 0.104 -2.457 9.807 1.00 0.29 H new ATOM 0 HG22 VAL B 260 -0.659 -3.693 8.780 1.00 0.29 H new ATOM 0 HG23 VAL B 260 -0.198 -2.121 8.086 1.00 0.29 H new ATOM 1581 N PRO B 261 -5.334 -2.246 8.702 1.00 0.29 N ATOM 1582 CA PRO B 261 -6.615 -1.564 8.975 1.00 0.29 C ATOM 1583 C PRO B 261 -6.451 -0.575 10.139 1.00 0.24 C ATOM 1584 O PRO B 261 -5.825 -0.873 11.135 1.00 0.23 O ATOM 1585 CB PRO B 261 -7.607 -2.694 9.336 1.00 0.37 C ATOM 1586 CG PRO B 261 -6.865 -4.045 9.142 1.00 0.42 C ATOM 1587 CD PRO B 261 -5.403 -3.725 8.757 1.00 0.36 C ATOM 0 HA PRO B 261 -6.967 -0.984 8.122 1.00 0.29 H new ATOM 0 HB2 PRO B 261 -7.950 -2.589 10.365 1.00 0.37 H new ATOM 0 HB3 PRO B 261 -8.490 -2.647 8.699 1.00 0.37 H new ATOM 0 HG2 PRO B 261 -6.899 -4.635 10.058 1.00 0.42 H new ATOM 0 HG3 PRO B 261 -7.345 -4.637 8.363 1.00 0.42 H new ATOM 0 HD2 PRO B 261 -4.705 -4.125 9.492 1.00 0.36 H new ATOM 0 HD3 PRO B 261 -5.142 -4.168 7.796 1.00 0.36 H new ATOM 1595 N ARG B 262 -7.022 0.591 10.022 1.00 0.26 N ATOM 1596 CA ARG B 262 -6.906 1.591 11.119 1.00 0.27 C ATOM 1597 C ARG B 262 -7.440 0.988 12.424 1.00 0.29 C ATOM 1598 O ARG B 262 -6.934 1.255 13.496 1.00 0.34 O ATOM 1599 CB ARG B 262 -7.718 2.840 10.760 1.00 0.34 C ATOM 1600 CG ARG B 262 -7.723 3.812 11.956 1.00 0.59 C ATOM 1601 CD ARG B 262 -8.280 5.196 11.542 1.00 1.04 C ATOM 1602 NE ARG B 262 -7.435 6.278 12.142 1.00 1.76 N ATOM 1603 CZ ARG B 262 -7.094 6.251 13.404 1.00 2.19 C ATOM 1604 NH1 ARG B 262 -7.593 5.351 14.206 1.00 2.31 N ATOM 1605 NH2 ARG B 262 -6.278 7.155 13.874 1.00 3.11 N ATOM 0 H ARG B 262 -7.564 0.895 9.213 1.00 0.26 H new ATOM 0 HA ARG B 262 -5.859 1.865 11.251 1.00 0.27 H new ATOM 0 HB2 ARG B 262 -7.288 3.327 9.884 1.00 0.34 H new ATOM 0 HB3 ARG B 262 -8.739 2.561 10.501 1.00 0.34 H new ATOM 0 HG2 ARG B 262 -8.328 3.399 12.763 1.00 0.59 H new ATOM 0 HG3 ARG B 262 -6.710 3.924 12.343 1.00 0.59 H new ATOM 0 HD2 ARG B 262 -8.287 5.286 10.456 1.00 1.04 H new ATOM 0 HD3 ARG B 262 -9.312 5.299 11.877 1.00 1.04 H new ATOM 0 HE ARG B 262 -7.120 7.050 11.555 1.00 1.76 H new ATOM 0 HH11 ARG B 262 -8.255 4.661 13.850 1.00 2.31 H new ATOM 0 HH12 ARG B 262 -7.321 5.337 15.189 1.00 2.31 H new ATOM 0 HH21 ARG B 262 -5.909 7.879 13.257 1.00 3.11 H new ATOM 0 HH22 ARG B 262 -6.009 7.138 14.858 1.00 3.11 H new ATOM 1619 N ARG B 263 -8.472 0.191 12.342 1.00 0.33 N ATOM 1620 CA ARG B 263 -9.054 -0.415 13.577 1.00 0.39 C ATOM 1621 C ARG B 263 -8.097 -1.454 14.177 1.00 0.39 C ATOM 1622 O ARG B 263 -8.365 -2.010 15.223 1.00 0.48 O ATOM 1623 CB ARG B 263 -10.398 -1.078 13.250 1.00 0.47 C ATOM 1624 CG ARG B 263 -10.245 -2.025 12.058 1.00 1.31 C ATOM 1625 CD ARG B 263 -11.623 -2.550 11.652 1.00 1.59 C ATOM 1626 NE ARG B 263 -12.388 -1.459 10.986 1.00 2.29 N ATOM 1627 CZ ARG B 263 -13.475 -1.734 10.318 1.00 2.90 C ATOM 1628 NH1 ARG B 263 -13.900 -2.965 10.238 1.00 3.06 N ATOM 1629 NH2 ARG B 263 -14.140 -0.774 9.732 1.00 3.82 N ATOM 0 H ARG B 263 -8.938 -0.067 11.472 1.00 0.33 H new ATOM 0 HA ARG B 263 -9.208 0.378 14.309 1.00 0.39 H new ATOM 0 HB2 ARG B 263 -10.760 -1.630 14.118 1.00 0.47 H new ATOM 0 HB3 ARG B 263 -11.143 -0.315 13.024 1.00 0.47 H new ATOM 0 HG2 ARG B 263 -9.780 -1.503 11.221 1.00 1.31 H new ATOM 0 HG3 ARG B 263 -9.589 -2.855 12.320 1.00 1.31 H new ATOM 0 HD2 ARG B 263 -11.517 -3.400 10.978 1.00 1.59 H new ATOM 0 HD3 ARG B 263 -12.163 -2.905 12.530 1.00 1.59 H new ATOM 0 HE ARG B 263 -12.062 -0.495 11.052 1.00 2.29 H new ATOM 0 HH11 ARG B 263 -13.383 -3.714 10.698 1.00 3.06 H new ATOM 0 HH12 ARG B 263 -14.750 -3.178 9.716 1.00 3.06 H new ATOM 0 HH21 ARG B 263 -13.809 0.189 9.797 1.00 3.82 H new ATOM 0 HH22 ARG B 263 -14.990 -0.987 9.210 1.00 3.82 H new ATOM 1643 N LYS B 264 -6.983 -1.715 13.533 1.00 0.35 N ATOM 1644 CA LYS B 264 -5.998 -2.716 14.075 1.00 0.42 C ATOM 1645 C LYS B 264 -4.667 -2.013 14.339 1.00 0.35 C ATOM 1646 O LYS B 264 -3.626 -2.642 14.447 1.00 0.38 O ATOM 1647 CB LYS B 264 -5.779 -3.839 13.052 1.00 0.53 C ATOM 1648 CG LYS B 264 -7.045 -4.707 12.928 1.00 0.85 C ATOM 1649 CD LYS B 264 -6.670 -6.109 12.426 1.00 0.95 C ATOM 1650 CE LYS B 264 -7.915 -6.815 11.886 1.00 1.28 C ATOM 1651 NZ LYS B 264 -7.575 -8.226 11.550 1.00 2.08 N ATOM 0 H LYS B 264 -6.710 -1.278 12.653 1.00 0.35 H new ATOM 0 HA LYS B 264 -6.387 -3.142 15.000 1.00 0.42 H new ATOM 0 HB2 LYS B 264 -5.527 -3.411 12.082 1.00 0.53 H new ATOM 0 HB3 LYS B 264 -4.935 -4.457 13.357 1.00 0.53 H new ATOM 0 HG2 LYS B 264 -7.544 -4.779 13.895 1.00 0.85 H new ATOM 0 HG3 LYS B 264 -7.750 -4.241 12.239 1.00 0.85 H new ATOM 0 HD2 LYS B 264 -5.914 -6.035 11.644 1.00 0.95 H new ATOM 0 HD3 LYS B 264 -6.233 -6.691 13.237 1.00 0.95 H new ATOM 0 HE2 LYS B 264 -8.713 -6.788 12.628 1.00 1.28 H new ATOM 0 HE3 LYS B 264 -8.285 -6.298 11.001 1.00 1.28 H new ATOM 0 HZ1 LYS B 264 -8.420 -8.709 11.183 1.00 2.08 H new ATOM 0 HZ2 LYS B 264 -6.827 -8.240 10.828 1.00 2.08 H new ATOM 0 HZ3 LYS B 264 -7.241 -8.716 12.405 1.00 2.08 H new ATOM 1665 N ALA B 265 -4.695 -0.709 14.450 1.00 0.30 N ATOM 1666 CA ALA B 265 -3.443 0.062 14.702 1.00 0.27 C ATOM 1667 C ALA B 265 -3.732 1.198 15.690 1.00 0.28 C ATOM 1668 O ALA B 265 -4.868 1.468 16.024 1.00 0.32 O ATOM 1669 CB ALA B 265 -2.945 0.652 13.378 1.00 0.26 C ATOM 0 H ALA B 265 -5.540 -0.142 14.376 1.00 0.30 H new ATOM 0 HA ALA B 265 -2.683 -0.597 15.122 1.00 0.27 H new ATOM 0 HB1 ALA B 265 -2.030 1.217 13.553 1.00 0.26 H new ATOM 0 HB2 ALA B 265 -2.744 -0.155 12.673 1.00 0.26 H new ATOM 0 HB3 ALA B 265 -3.707 1.313 12.965 1.00 0.26 H new ATOM 1675 N LYS B 266 -2.709 1.873 16.146 1.00 0.26 N ATOM 1676 CA LYS B 266 -2.907 3.003 17.109 1.00 0.29 C ATOM 1677 C LYS B 266 -1.951 4.140 16.742 1.00 0.27 C ATOM 1678 O LYS B 266 -0.767 3.935 16.575 1.00 0.25 O ATOM 1679 CB LYS B 266 -2.598 2.528 18.538 1.00 0.34 C ATOM 1680 CG LYS B 266 -3.749 1.672 19.085 1.00 0.42 C ATOM 1681 CD LYS B 266 -3.638 1.586 20.612 1.00 0.50 C ATOM 1682 CE LYS B 266 -4.527 0.451 21.127 1.00 1.09 C ATOM 1683 NZ LYS B 266 -5.748 0.354 20.278 1.00 1.79 N ATOM 0 H LYS B 266 -1.738 1.691 15.892 1.00 0.26 H new ATOM 0 HA LYS B 266 -3.940 3.348 17.059 1.00 0.29 H new ATOM 0 HB2 LYS B 266 -1.674 1.950 18.543 1.00 0.34 H new ATOM 0 HB3 LYS B 266 -2.438 3.389 19.187 1.00 0.34 H new ATOM 0 HG2 LYS B 266 -4.707 2.108 18.803 1.00 0.42 H new ATOM 0 HG3 LYS B 266 -3.713 0.673 18.650 1.00 0.42 H new ATOM 0 HD2 LYS B 266 -2.602 1.411 20.902 1.00 0.50 H new ATOM 0 HD3 LYS B 266 -3.940 2.531 21.063 1.00 0.50 H new ATOM 0 HE2 LYS B 266 -3.980 -0.492 21.106 1.00 1.09 H new ATOM 0 HE3 LYS B 266 -4.806 0.635 22.165 1.00 1.09 H new ATOM 0 HZ1 LYS B 266 -6.497 -0.141 20.803 1.00 1.79 H new ATOM 0 HZ2 LYS B 266 -6.074 1.309 20.028 1.00 1.79 H new ATOM 0 HZ3 LYS B 266 -5.526 -0.174 19.410 1.00 1.79 H new ATOM 1697 N ILE B 267 -2.455 5.339 16.613 1.00 0.30 N ATOM 1698 CA ILE B 267 -1.570 6.491 16.257 1.00 0.32 C ATOM 1699 C ILE B 267 -0.981 7.100 17.532 1.00 0.37 C ATOM 1700 O ILE B 267 -1.668 7.765 18.283 1.00 0.41 O ATOM 1701 CB ILE B 267 -2.392 7.562 15.528 1.00 0.36 C ATOM 1702 CG1 ILE B 267 -3.173 6.918 14.365 1.00 0.36 C ATOM 1703 CG2 ILE B 267 -1.463 8.682 15.011 1.00 0.39 C ATOM 1704 CD1 ILE B 267 -2.240 6.087 13.476 1.00 0.45 C ATOM 0 H ILE B 267 -3.440 5.572 16.738 1.00 0.30 H new ATOM 0 HA ILE B 267 -0.766 6.138 15.612 1.00 0.32 H new ATOM 0 HB ILE B 267 -3.106 8.004 16.223 1.00 0.36 H new ATOM 0 HG12 ILE B 267 -3.966 6.283 14.761 1.00 0.36 H new ATOM 0 HG13 ILE B 267 -3.654 7.694 13.770 1.00 0.36 H new ATOM 0 HG21 ILE B 267 -2.056 9.437 14.495 1.00 0.39 H new ATOM 0 HG22 ILE B 267 -0.943 9.141 15.852 1.00 0.39 H new ATOM 0 HG23 ILE B 267 -0.733 8.260 14.320 1.00 0.39 H new ATOM 0 HD11 ILE B 267 -2.813 5.642 12.662 1.00 0.45 H new ATOM 0 HD12 ILE B 267 -1.463 6.730 13.063 1.00 0.45 H new ATOM 0 HD13 ILE B 267 -1.780 5.297 14.070 1.00 0.45 H new ATOM 1716 N ILE B 268 0.290 6.888 17.776 1.00 0.38 N ATOM 1717 CA ILE B 268 0.942 7.465 18.999 1.00 0.45 C ATOM 1718 C ILE B 268 1.825 8.637 18.573 1.00 0.48 C ATOM 1719 O ILE B 268 2.297 8.695 17.458 1.00 0.47 O ATOM 1720 CB ILE B 268 1.823 6.408 19.689 1.00 0.48 C ATOM 1721 CG1 ILE B 268 1.076 5.063 19.820 1.00 0.50 C ATOM 1722 CG2 ILE B 268 2.239 6.911 21.077 1.00 0.55 C ATOM 1723 CD1 ILE B 268 0.049 5.114 20.962 1.00 0.57 C ATOM 0 H ILE B 268 0.908 6.338 17.179 1.00 0.38 H new ATOM 0 HA ILE B 268 0.170 7.793 19.695 1.00 0.45 H new ATOM 0 HB ILE B 268 2.710 6.246 19.077 1.00 0.48 H new ATOM 0 HG12 ILE B 268 0.572 4.830 18.882 1.00 0.50 H new ATOM 0 HG13 ILE B 268 1.791 4.262 20.005 1.00 0.50 H new ATOM 0 HG21 ILE B 268 2.863 6.161 21.564 1.00 0.55 H new ATOM 0 HG22 ILE B 268 2.801 7.839 20.974 1.00 0.55 H new ATOM 0 HG23 ILE B 268 1.349 7.090 21.681 1.00 0.55 H new ATOM 0 HD11 ILE B 268 -0.464 4.155 21.033 1.00 0.57 H new ATOM 0 HD12 ILE B 268 0.560 5.323 21.902 1.00 0.57 H new ATOM 0 HD13 ILE B 268 -0.679 5.900 20.762 1.00 0.57 H new ATOM 1735 N ARG B 269 2.056 9.568 19.457 1.00 0.56 N ATOM 1736 CA ARG B 269 2.912 10.742 19.107 1.00 0.62 C ATOM 1737 C ARG B 269 4.380 10.407 19.381 1.00 0.66 C ATOM 1738 O ARG B 269 4.696 9.645 20.273 1.00 0.73 O ATOM 1739 CB ARG B 269 2.499 11.945 19.957 1.00 0.73 C ATOM 1740 CG ARG B 269 3.251 13.193 19.473 1.00 1.49 C ATOM 1741 CD ARG B 269 2.781 14.442 20.251 1.00 1.80 C ATOM 1742 NE ARG B 269 2.616 15.595 19.305 1.00 2.22 N ATOM 1743 CZ ARG B 269 3.536 15.882 18.420 1.00 2.82 C ATOM 1744 NH1 ARG B 269 4.679 15.254 18.423 1.00 3.12 N ATOM 1745 NH2 ARG B 269 3.324 16.832 17.551 1.00 3.62 N ATOM 0 H ARG B 269 1.689 9.568 20.409 1.00 0.56 H new ATOM 0 HA ARG B 269 2.785 10.980 18.051 1.00 0.62 H new ATOM 0 HB2 ARG B 269 1.423 12.104 19.884 1.00 0.73 H new ATOM 0 HB3 ARG B 269 2.723 11.756 21.007 1.00 0.73 H new ATOM 0 HG2 ARG B 269 4.324 13.054 19.609 1.00 1.49 H new ATOM 0 HG3 ARG B 269 3.081 13.336 18.406 1.00 1.49 H new ATOM 0 HD2 ARG B 269 1.837 14.235 20.755 1.00 1.80 H new ATOM 0 HD3 ARG B 269 3.506 14.695 21.024 1.00 1.80 H new ATOM 0 HE ARG B 269 1.772 16.165 19.353 1.00 2.22 H new ATOM 0 HH11 ARG B 269 4.862 14.532 19.120 1.00 3.12 H new ATOM 0 HH12 ARG B 269 5.390 15.485 17.729 1.00 3.12 H new ATOM 0 HH21 ARG B 269 2.444 17.347 17.563 1.00 3.62 H new ATOM 0 HH22 ARG B 269 4.038 17.059 16.859 1.00 3.62 H new ATOM 1759 N ASP B 270 5.282 10.974 18.625 1.00 0.67 N ATOM 1760 CA ASP B 270 6.732 10.692 18.849 1.00 0.74 C ATOM 1761 C ASP B 270 7.281 11.657 19.900 1.00 1.18 C ATOM 1762 O ASP B 270 6.481 12.276 20.582 1.00 1.73 O ATOM 1763 CB ASP B 270 7.496 10.879 17.536 1.00 0.90 C ATOM 1764 CG ASP B 270 7.211 9.700 16.605 1.00 1.47 C ATOM 1765 OD1 ASP B 270 6.164 9.089 16.757 1.00 2.05 O ATOM 1766 OD2 ASP B 270 8.043 9.426 15.756 1.00 2.04 O ATOM 1767 OXT ASP B 270 8.492 11.760 20.006 1.00 1.84 O ATOM 0 H ASP B 270 5.079 11.620 17.862 1.00 0.67 H new ATOM 0 HA ASP B 270 6.854 9.667 19.198 1.00 0.74 H new ATOM 0 HB2 ASP B 270 7.197 11.813 17.059 1.00 0.90 H new ATOM 0 HB3 ASP B 270 8.566 10.950 17.733 1.00 0.90 H new TER 1772 ASP B 270