USER MOD reduce.3.24.130724 H: found=0, std=0, add=1056, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1058 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 31 GLN : amide:sc= -0.435 K(o=-0.57,f=-2) USER MOD Set 1.2: A 34 ASN : amide:sc= -0.132 K(o=-0.57,f=-2.1) USER MOD Set 2.1: A 17 THR OG1 : rot -120:sc= 0.346 USER MOD Set 2.2: A 20 SER OG : rot 94:sc= 1.3 USER MOD Set 3.1: A 5 ASN : amide:sc= -1.38! C(o=-2!,f=-19!) USER MOD Set 3.2: A 8 LYS NZ :NH3+ -168:sc= -0.619! (180deg=-1.15) USER MOD Single : A 4 SER OG : rot 61:sc= -0.474 USER MOD Single : A 15 SER OG : rot 48:sc= 0.321 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 MET CE :methyl 160:sc= -0.444 (180deg=-1.42) USER MOD Single : A 28 SER OG : rot -173:sc= -0.682 USER MOD Single : A 30 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 33 CYS SG : rot 75:sc= 0.173 USER MOD Single : A 37 GLN : amide:sc=-3.57e-05 K(o=-3.6e-05,f=-0.86) USER MOD Single : A 38 SER OG : rot 115:sc= 1.08 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ -163:sc= -0.026 (180deg=-0.33) USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 90:sc= 1.24 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= -0.0428 X(o=-0.043,f=0) USER MOD Single : B 4 SER OG : rot 180:sc= 0 USER MOD Single : B 5 ASN :FLIP amide:sc= -0.829 F(o=-2.5!,f=-0.83) USER MOD Single : B 8 LYS NZ :NH3+ 140:sc= -3.87! (180deg=-7.08!) USER MOD Single : B 15 SER OG : rot -11:sc= 0.985 USER MOD Single : B 17 THR OG1 : rot 180:sc= -0.365 USER MOD Single : B 19 LYS NZ :NH3+ -160:sc= -1.29 (180deg=-1.82) USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 25 MET CE :methyl 176:sc= 0 (180deg=-0.0521) USER MOD Single : B 28 SER OG : rot 180:sc= -0.0289 USER MOD Single : B 30 GLN : amide:sc=-0.00115 K(o=-0.0011,f=-1.5!) USER MOD Single : B 31 GLN : amide:sc= -0.161 K(o=-0.16,f=-0.79) USER MOD Single : B 33 CYS SG : rot 74:sc= 0.0673 USER MOD Single : B 34 ASN : amide:sc= -0.0506 X(o=-0.051,f=-0.52!) USER MOD Single : B 37 GLN : amide:sc= -0.33 K(o=-0.33,f=-1.2) USER MOD Single : B 38 SER OG : rot 180:sc= 0 USER MOD Single : B 40 THR OG1 : rot 180:sc= 0 USER MOD Single : B 46 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.012) USER MOD Single : B 47 TYR OH : rot 180:sc= 0 USER MOD Single : B 53 SER OG : rot 93:sc= 1.21 USER MOD Single : B 54 LYS NZ :NH3+ -165:sc= -0.0257 (180deg=-0.276) USER MOD Single : B 59 ASN : amide:sc= -1.33 K(o=-1.3,f=-4.5!) USER MOD ----------------------------------------------------------------- ATOM 20 N GLU A 2 10.100 12.470 7.775 1.00 0.00 N ATOM 21 CA GLU A 2 9.386 11.202 8.101 1.00 0.00 C ATOM 22 C GLU A 2 8.154 11.051 7.207 1.00 0.00 C ATOM 23 O GLU A 2 7.473 12.008 6.899 1.00 0.00 O ATOM 24 CB GLU A 2 8.969 11.216 9.576 1.00 0.00 C ATOM 25 CG GLU A 2 10.194 10.943 10.455 1.00 0.00 C ATOM 26 CD GLU A 2 10.635 9.488 10.269 1.00 0.00 C ATOM 27 OE1 GLU A 2 9.984 8.616 10.818 1.00 0.00 O ATOM 28 OE2 GLU A 2 11.593 9.269 9.542 1.00 0.00 O ATOM 0 HA GLU A 2 10.051 10.357 7.924 1.00 0.00 H new ATOM 0 HB2 GLU A 2 8.532 12.181 9.832 1.00 0.00 H new ATOM 0 HB3 GLU A 2 8.203 10.461 9.756 1.00 0.00 H new ATOM 0 HG2 GLU A 2 11.006 11.619 10.187 1.00 0.00 H new ATOM 0 HG3 GLU A 2 9.955 11.132 11.501 1.00 0.00 H new ATOM 35 N LEU A 3 7.873 9.849 6.780 1.00 0.00 N ATOM 36 CA LEU A 3 6.697 9.614 5.894 1.00 0.00 C ATOM 37 C LEU A 3 5.403 9.985 6.618 1.00 0.00 C ATOM 38 O LEU A 3 4.536 10.631 6.066 1.00 0.00 O ATOM 39 CB LEU A 3 6.658 8.129 5.512 1.00 0.00 C ATOM 40 CG LEU A 3 5.426 7.824 4.649 1.00 0.00 C ATOM 41 CD1 LEU A 3 5.411 8.722 3.400 1.00 0.00 C ATOM 42 CD2 LEU A 3 5.471 6.352 4.228 1.00 0.00 C ATOM 0 H LEU A 3 8.412 9.014 7.009 1.00 0.00 H new ATOM 0 HA LEU A 3 6.788 10.233 5.001 1.00 0.00 H new ATOM 0 HB2 LEU A 3 7.564 7.864 4.967 1.00 0.00 H new ATOM 0 HB3 LEU A 3 6.638 7.517 6.414 1.00 0.00 H new ATOM 0 HG LEU A 3 4.522 8.020 5.226 1.00 0.00 H new ATOM 0 HD11 LEU A 3 4.531 8.494 2.798 1.00 0.00 H new ATOM 0 HD12 LEU A 3 5.381 9.768 3.704 1.00 0.00 H new ATOM 0 HD13 LEU A 3 6.310 8.541 2.811 1.00 0.00 H new ATOM 0 HD21 LEU A 3 4.600 6.122 3.614 1.00 0.00 H new ATOM 0 HD22 LEU A 3 6.379 6.165 3.655 1.00 0.00 H new ATOM 0 HD23 LEU A 3 5.466 5.719 5.116 1.00 0.00 H new ATOM 54 N SER A 4 5.262 9.577 7.846 1.00 0.00 N ATOM 55 CA SER A 4 4.018 9.899 8.596 1.00 0.00 C ATOM 56 C SER A 4 3.858 11.413 8.701 1.00 0.00 C ATOM 57 O SER A 4 2.765 11.938 8.641 1.00 0.00 O ATOM 58 CB SER A 4 4.103 9.289 9.993 1.00 0.00 C ATOM 59 OG SER A 4 3.971 7.880 9.888 1.00 0.00 O ATOM 0 H SER A 4 5.954 9.035 8.363 1.00 0.00 H new ATOM 0 HA SER A 4 3.156 9.487 8.071 1.00 0.00 H new ATOM 0 HB2 SER A 4 5.055 9.545 10.459 1.00 0.00 H new ATOM 0 HB3 SER A 4 3.317 9.695 10.630 1.00 0.00 H new ATOM 0 HG SER A 4 4.697 7.524 9.334 1.00 0.00 H new ATOM 65 N ASN A 5 4.941 12.119 8.862 1.00 0.00 N ATOM 66 CA ASN A 5 4.856 13.597 8.979 1.00 0.00 C ATOM 67 C ASN A 5 4.269 14.186 7.698 1.00 0.00 C ATOM 68 O ASN A 5 3.398 15.031 7.734 1.00 0.00 O ATOM 69 CB ASN A 5 6.264 14.150 9.200 1.00 0.00 C ATOM 70 CG ASN A 5 6.193 15.639 9.521 1.00 0.00 C ATOM 71 OD1 ASN A 5 5.171 16.138 9.940 1.00 0.00 O ATOM 72 ND2 ASN A 5 7.254 16.378 9.347 1.00 0.00 N ATOM 0 H ASN A 5 5.884 11.733 8.918 1.00 0.00 H new ATOM 0 HA ASN A 5 4.212 13.866 9.817 1.00 0.00 H new ATOM 0 HB2 ASN A 5 6.750 13.616 10.017 1.00 0.00 H new ATOM 0 HB3 ASN A 5 6.871 13.990 8.309 1.00 0.00 H new ATOM 0 HD21 ASN A 5 7.223 17.374 9.564 1.00 0.00 H new ATOM 0 HD22 ASN A 5 8.115 15.959 8.994 1.00 0.00 H new ATOM 79 N GLU A 6 4.731 13.744 6.566 1.00 0.00 N ATOM 80 CA GLU A 6 4.195 14.279 5.285 1.00 0.00 C ATOM 81 C GLU A 6 2.763 13.773 5.073 1.00 0.00 C ATOM 82 O GLU A 6 1.889 14.498 4.628 1.00 0.00 O ATOM 83 CB GLU A 6 5.077 13.783 4.138 1.00 0.00 C ATOM 84 CG GLU A 6 4.703 14.511 2.849 1.00 0.00 C ATOM 85 CD GLU A 6 5.360 13.805 1.658 1.00 0.00 C ATOM 86 OE1 GLU A 6 5.763 12.666 1.819 1.00 0.00 O ATOM 87 OE2 GLU A 6 5.436 14.411 0.601 1.00 0.00 O ATOM 0 H GLU A 6 5.458 13.034 6.471 1.00 0.00 H new ATOM 0 HA GLU A 6 4.192 15.369 5.314 1.00 0.00 H new ATOM 0 HB2 GLU A 6 6.127 13.956 4.373 1.00 0.00 H new ATOM 0 HB3 GLU A 6 4.952 12.708 4.009 1.00 0.00 H new ATOM 0 HG2 GLU A 6 3.620 14.524 2.726 1.00 0.00 H new ATOM 0 HG3 GLU A 6 5.031 15.550 2.896 1.00 0.00 H new ATOM 94 N LEU A 7 2.526 12.520 5.362 1.00 0.00 N ATOM 95 CA LEU A 7 1.167 11.943 5.153 1.00 0.00 C ATOM 96 C LEU A 7 0.142 12.657 6.036 1.00 0.00 C ATOM 97 O LEU A 7 -0.938 12.997 5.598 1.00 0.00 O ATOM 98 CB LEU A 7 1.199 10.455 5.516 1.00 0.00 C ATOM 99 CG LEU A 7 -0.139 9.792 5.162 1.00 0.00 C ATOM 100 CD1 LEU A 7 -0.360 9.818 3.635 1.00 0.00 C ATOM 101 CD2 LEU A 7 -0.122 8.344 5.663 1.00 0.00 C ATOM 0 H LEU A 7 3.218 11.870 5.735 1.00 0.00 H new ATOM 0 HA LEU A 7 0.880 12.072 4.109 1.00 0.00 H new ATOM 0 HB2 LEU A 7 2.010 9.961 4.982 1.00 0.00 H new ATOM 0 HB3 LEU A 7 1.400 10.338 6.581 1.00 0.00 H new ATOM 0 HG LEU A 7 -0.954 10.338 5.638 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -1.313 9.345 3.397 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -0.371 10.851 3.286 1.00 0.00 H new ATOM 0 HD13 LEU A 7 0.447 9.277 3.141 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -1.068 7.863 5.417 1.00 0.00 H new ATOM 0 HD22 LEU A 7 0.695 7.803 5.185 1.00 0.00 H new ATOM 0 HD23 LEU A 7 0.020 8.335 6.744 1.00 0.00 H new ATOM 113 N LYS A 8 0.467 12.877 7.279 1.00 0.00 N ATOM 114 CA LYS A 8 -0.494 13.555 8.195 1.00 0.00 C ATOM 115 C LYS A 8 -0.719 14.995 7.721 1.00 0.00 C ATOM 116 O LYS A 8 -1.791 15.548 7.863 1.00 0.00 O ATOM 117 CB LYS A 8 0.087 13.521 9.633 1.00 0.00 C ATOM 118 CG LYS A 8 0.819 14.831 9.966 1.00 0.00 C ATOM 119 CD LYS A 8 1.547 14.708 11.300 1.00 0.00 C ATOM 120 CE LYS A 8 2.105 16.082 11.677 1.00 0.00 C ATOM 121 NZ LYS A 8 2.905 16.621 10.541 1.00 0.00 N ATOM 0 H LYS A 8 1.358 12.616 7.702 1.00 0.00 H new ATOM 0 HA LYS A 8 -1.457 13.044 8.191 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -0.718 13.358 10.350 1.00 0.00 H new ATOM 0 HB3 LYS A 8 0.775 12.681 9.731 1.00 0.00 H new ATOM 0 HG2 LYS A 8 1.532 15.068 9.176 1.00 0.00 H new ATOM 0 HG3 LYS A 8 0.105 15.653 10.008 1.00 0.00 H new ATOM 0 HD2 LYS A 8 0.865 14.351 12.072 1.00 0.00 H new ATOM 0 HD3 LYS A 8 2.354 13.979 11.225 1.00 0.00 H new ATOM 0 HE2 LYS A 8 1.290 16.764 11.918 1.00 0.00 H new ATOM 0 HE3 LYS A 8 2.727 16.002 12.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 3.448 17.449 10.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 3.559 15.889 10.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 2.267 16.902 9.770 1.00 0.00 H new ATOM 135 N VAL A 9 0.296 15.609 7.179 1.00 0.00 N ATOM 136 CA VAL A 9 0.158 17.017 6.721 1.00 0.00 C ATOM 137 C VAL A 9 -0.962 17.104 5.681 1.00 0.00 C ATOM 138 O VAL A 9 -1.811 17.970 5.750 1.00 0.00 O ATOM 139 CB VAL A 9 1.499 17.473 6.115 1.00 0.00 C ATOM 140 CG1 VAL A 9 1.300 18.775 5.328 1.00 0.00 C ATOM 141 CG2 VAL A 9 2.534 17.700 7.244 1.00 0.00 C ATOM 0 H VAL A 9 1.216 15.194 7.034 1.00 0.00 H new ATOM 0 HA VAL A 9 -0.096 17.667 7.558 1.00 0.00 H new ATOM 0 HB VAL A 9 1.866 16.699 5.441 1.00 0.00 H new ATOM 0 HG11 VAL A 9 2.252 19.092 4.902 1.00 0.00 H new ATOM 0 HG12 VAL A 9 0.581 18.609 4.526 1.00 0.00 H new ATOM 0 HG13 VAL A 9 0.925 19.550 5.996 1.00 0.00 H new ATOM 0 HG21 VAL A 9 3.481 18.022 6.810 1.00 0.00 H new ATOM 0 HG22 VAL A 9 2.167 18.468 7.925 1.00 0.00 H new ATOM 0 HG23 VAL A 9 2.684 16.770 7.792 1.00 0.00 H new ATOM 151 N GLU A 10 -0.989 16.217 4.729 1.00 0.00 N ATOM 152 CA GLU A 10 -2.074 16.267 3.708 1.00 0.00 C ATOM 153 C GLU A 10 -3.428 16.005 4.383 1.00 0.00 C ATOM 154 O GLU A 10 -4.394 16.702 4.142 1.00 0.00 O ATOM 155 CB GLU A 10 -1.806 15.194 2.652 1.00 0.00 C ATOM 156 CG GLU A 10 -0.650 15.642 1.732 1.00 0.00 C ATOM 157 CD GLU A 10 -1.200 16.457 0.555 1.00 0.00 C ATOM 158 OE1 GLU A 10 -2.345 16.865 0.625 1.00 0.00 O ATOM 159 OE2 GLU A 10 -0.462 16.653 -0.399 1.00 0.00 O ATOM 0 H GLU A 10 -0.312 15.463 4.612 1.00 0.00 H new ATOM 0 HA GLU A 10 -2.097 17.250 3.237 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -1.553 14.250 3.135 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -2.706 15.019 2.062 1.00 0.00 H new ATOM 0 HG2 GLU A 10 0.064 16.241 2.297 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -0.111 14.770 1.361 1.00 0.00 H new ATOM 166 N ARG A 11 -3.505 15.014 5.230 1.00 0.00 N ATOM 167 CA ARG A 11 -4.796 14.716 5.916 1.00 0.00 C ATOM 168 C ARG A 11 -5.241 15.939 6.727 1.00 0.00 C ATOM 169 O ARG A 11 -6.393 16.331 6.692 1.00 0.00 O ATOM 170 CB ARG A 11 -4.587 13.523 6.855 1.00 0.00 C ATOM 171 CG ARG A 11 -5.909 13.144 7.519 1.00 0.00 C ATOM 172 CD ARG A 11 -5.677 11.969 8.471 1.00 0.00 C ATOM 173 NE ARG A 11 -6.885 11.786 9.331 1.00 0.00 N ATOM 174 CZ ARG A 11 -6.770 11.343 10.559 1.00 0.00 C ATOM 175 NH1 ARG A 11 -5.598 11.012 11.036 1.00 0.00 N ATOM 176 NH2 ARG A 11 -7.832 11.221 11.308 1.00 0.00 N ATOM 0 H ARG A 11 -2.730 14.398 5.477 1.00 0.00 H new ATOM 0 HA ARG A 11 -5.564 14.480 5.180 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -4.195 12.674 6.296 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -3.847 13.773 7.615 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -6.312 13.996 8.066 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -6.645 12.874 6.762 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -5.479 11.060 7.904 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -4.800 12.155 9.091 1.00 0.00 H new ATOM 0 HE ARG A 11 -7.808 12.008 8.959 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -4.767 11.098 10.451 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -5.515 10.668 11.993 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -8.749 11.470 10.937 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -7.745 10.876 12.264 1.00 0.00 H new ATOM 190 N ILE A 12 -4.335 16.546 7.449 1.00 0.00 N ATOM 191 CA ILE A 12 -4.695 17.750 8.255 1.00 0.00 C ATOM 192 C ILE A 12 -5.076 18.898 7.316 1.00 0.00 C ATOM 193 O ILE A 12 -6.035 19.608 7.545 1.00 0.00 O ATOM 194 CB ILE A 12 -3.495 18.165 9.112 1.00 0.00 C ATOM 195 CG1 ILE A 12 -3.248 17.100 10.187 1.00 0.00 C ATOM 196 CG2 ILE A 12 -3.781 19.514 9.782 1.00 0.00 C ATOM 197 CD1 ILE A 12 -1.909 17.368 10.883 1.00 0.00 C ATOM 0 H ILE A 12 -3.359 16.259 7.515 1.00 0.00 H new ATOM 0 HA ILE A 12 -5.541 17.517 8.902 1.00 0.00 H new ATOM 0 HB ILE A 12 -2.612 18.258 8.480 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -4.057 17.112 10.917 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -3.242 16.108 9.735 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.926 19.806 10.391 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -3.957 20.270 9.017 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -4.664 19.426 10.415 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -1.737 16.609 11.646 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -1.104 17.333 10.149 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.932 18.353 11.350 1.00 0.00 H new ATOM 209 N ARG A 13 -4.325 19.089 6.265 1.00 0.00 N ATOM 210 CA ARG A 13 -4.628 20.197 5.314 1.00 0.00 C ATOM 211 C ARG A 13 -6.039 20.027 4.759 1.00 0.00 C ATOM 212 O ARG A 13 -6.796 20.972 4.666 1.00 0.00 O ATOM 213 CB ARG A 13 -3.625 20.150 4.155 1.00 0.00 C ATOM 214 CG ARG A 13 -3.878 21.311 3.179 1.00 0.00 C ATOM 215 CD ARG A 13 -2.958 21.175 1.954 1.00 0.00 C ATOM 216 NE ARG A 13 -1.612 21.748 2.261 1.00 0.00 N ATOM 217 CZ ARG A 13 -1.352 23.009 2.012 1.00 0.00 C ATOM 218 NH1 ARG A 13 -2.270 23.786 1.499 1.00 0.00 N ATOM 219 NH2 ARG A 13 -0.169 23.493 2.276 1.00 0.00 N ATOM 0 H ARG A 13 -3.512 18.523 6.023 1.00 0.00 H new ATOM 0 HA ARG A 13 -4.555 21.152 5.834 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -2.608 20.208 4.543 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -3.712 19.199 3.629 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -4.921 21.311 2.863 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -3.696 22.263 3.678 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -2.861 20.125 1.676 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -3.396 21.692 1.100 1.00 0.00 H new ATOM 0 HE ARG A 13 -0.890 21.153 2.667 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -3.196 23.412 1.290 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -2.060 24.766 1.308 1.00 0.00 H new ATOM 0 HH21 ARG A 13 0.551 22.891 2.675 1.00 0.00 H new ATOM 0 HH22 ARG A 13 0.036 24.473 2.083 1.00 0.00 H new ATOM 233 N LEU A 14 -6.396 18.837 4.377 1.00 0.00 N ATOM 234 CA LEU A 14 -7.755 18.609 3.813 1.00 0.00 C ATOM 235 C LEU A 14 -8.719 18.266 4.950 1.00 0.00 C ATOM 236 O LEU A 14 -9.900 18.073 4.735 1.00 0.00 O ATOM 237 CB LEU A 14 -7.685 17.449 2.817 1.00 0.00 C ATOM 238 CG LEU A 14 -6.654 17.767 1.721 1.00 0.00 C ATOM 239 CD1 LEU A 14 -6.534 16.568 0.774 1.00 0.00 C ATOM 240 CD2 LEU A 14 -7.090 19.011 0.923 1.00 0.00 C ATOM 0 H LEU A 14 -5.804 18.008 4.430 1.00 0.00 H new ATOM 0 HA LEU A 14 -8.110 19.505 3.304 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -7.409 16.530 3.334 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -8.665 17.281 2.370 1.00 0.00 H new ATOM 0 HG LEU A 14 -5.689 17.967 2.187 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -5.804 16.791 -0.004 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -6.210 15.692 1.336 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -7.503 16.368 0.316 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -6.351 19.225 0.150 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -8.058 18.824 0.458 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -7.170 19.865 1.595 1.00 0.00 H new ATOM 252 N SER A 15 -8.220 18.200 6.162 1.00 0.00 N ATOM 253 CA SER A 15 -9.092 17.874 7.335 1.00 0.00 C ATOM 254 C SER A 15 -10.064 16.755 6.958 1.00 0.00 C ATOM 255 O SER A 15 -11.239 16.985 6.756 1.00 0.00 O ATOM 256 CB SER A 15 -9.873 19.126 7.752 1.00 0.00 C ATOM 257 OG SER A 15 -10.338 19.802 6.590 1.00 0.00 O ATOM 0 H SER A 15 -7.239 18.359 6.390 1.00 0.00 H new ATOM 0 HA SER A 15 -8.473 17.541 8.168 1.00 0.00 H new ATOM 0 HB2 SER A 15 -10.715 18.848 8.386 1.00 0.00 H new ATOM 0 HB3 SER A 15 -9.236 19.787 8.340 1.00 0.00 H new ATOM 0 HG SER A 15 -10.757 19.158 5.982 1.00 0.00 H new ATOM 263 N LEU A 16 -9.580 15.546 6.850 1.00 0.00 N ATOM 264 CA LEU A 16 -10.471 14.403 6.468 1.00 0.00 C ATOM 265 C LEU A 16 -10.890 13.633 7.718 1.00 0.00 C ATOM 266 O LEU A 16 -10.093 13.365 8.593 1.00 0.00 O ATOM 267 CB LEU A 16 -9.707 13.469 5.530 1.00 0.00 C ATOM 268 CG LEU A 16 -9.228 14.256 4.309 1.00 0.00 C ATOM 269 CD1 LEU A 16 -8.404 13.335 3.405 1.00 0.00 C ATOM 270 CD2 LEU A 16 -10.434 14.810 3.527 1.00 0.00 C ATOM 0 H LEU A 16 -8.604 15.297 7.010 1.00 0.00 H new ATOM 0 HA LEU A 16 -11.361 14.786 5.969 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.856 13.030 6.050 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -10.349 12.645 5.217 1.00 0.00 H new ATOM 0 HG LEU A 16 -8.612 15.092 4.640 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.061 13.893 2.534 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.543 12.959 3.957 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -9.021 12.497 3.080 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -10.080 15.368 2.660 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -11.063 13.984 3.195 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -11.014 15.470 4.172 1.00 0.00 H new ATOM 282 N THR A 17 -12.140 13.284 7.807 1.00 0.00 N ATOM 283 CA THR A 17 -12.631 12.535 8.999 1.00 0.00 C ATOM 284 C THR A 17 -12.478 11.032 8.763 1.00 0.00 C ATOM 285 O THR A 17 -12.810 10.519 7.716 1.00 0.00 O ATOM 286 CB THR A 17 -14.105 12.866 9.225 1.00 0.00 C ATOM 287 OG1 THR A 17 -14.806 12.755 7.993 1.00 0.00 O ATOM 288 CG2 THR A 17 -14.232 14.292 9.760 1.00 0.00 C ATOM 0 H THR A 17 -12.849 13.485 7.102 1.00 0.00 H new ATOM 0 HA THR A 17 -12.049 12.822 9.875 1.00 0.00 H new ATOM 0 HB THR A 17 -14.529 12.170 9.949 1.00 0.00 H new ATOM 0 HG1 THR A 17 -15.212 13.618 7.769 1.00 0.00 H new ATOM 0 HG21 THR A 17 -15.284 14.528 9.921 1.00 0.00 H new ATOM 0 HG22 THR A 17 -13.693 14.376 10.703 1.00 0.00 H new ATOM 0 HG23 THR A 17 -13.810 14.991 9.037 1.00 0.00 H new ATOM 296 N ALA A 18 -11.979 10.326 9.737 1.00 0.00 N ATOM 297 CA ALA A 18 -11.800 8.856 9.587 1.00 0.00 C ATOM 298 C ALA A 18 -13.165 8.185 9.421 1.00 0.00 C ATOM 299 O ALA A 18 -13.311 7.222 8.694 1.00 0.00 O ATOM 300 CB ALA A 18 -11.113 8.308 10.836 1.00 0.00 C ATOM 0 H ALA A 18 -11.685 10.706 10.637 1.00 0.00 H new ATOM 0 HA ALA A 18 -11.190 8.650 8.708 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -10.978 7.231 10.734 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -10.141 8.786 10.956 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -11.729 8.515 11.711 1.00 0.00 H new ATOM 306 N LYS A 19 -14.162 8.681 10.100 1.00 0.00 N ATOM 307 CA LYS A 19 -15.516 8.070 9.999 1.00 0.00 C ATOM 308 C LYS A 19 -16.031 8.188 8.564 1.00 0.00 C ATOM 309 O LYS A 19 -16.544 7.243 7.998 1.00 0.00 O ATOM 310 CB LYS A 19 -16.467 8.815 10.941 1.00 0.00 C ATOM 311 CG LYS A 19 -17.804 8.060 11.057 1.00 0.00 C ATOM 312 CD LYS A 19 -17.708 6.989 12.151 1.00 0.00 C ATOM 313 CE LYS A 19 -19.064 6.305 12.320 1.00 0.00 C ATOM 314 NZ LYS A 19 -18.964 5.275 13.390 1.00 0.00 N ATOM 0 H LYS A 19 -14.096 9.486 10.723 1.00 0.00 H new ATOM 0 HA LYS A 19 -15.464 7.017 10.275 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -16.011 8.914 11.926 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -16.642 9.824 10.568 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -18.607 8.759 11.290 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -18.053 7.596 10.103 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -16.949 6.253 11.888 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -17.399 7.443 13.092 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -19.826 7.041 12.577 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -19.371 5.843 11.382 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -19.885 4.807 13.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -18.248 4.569 13.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -18.689 5.729 14.284 1.00 0.00 H new ATOM 328 N SER A 20 -15.905 9.343 7.971 1.00 0.00 N ATOM 329 CA SER A 20 -16.396 9.522 6.575 1.00 0.00 C ATOM 330 C SER A 20 -15.658 8.563 5.642 1.00 0.00 C ATOM 331 O SER A 20 -16.255 7.917 4.804 1.00 0.00 O ATOM 332 CB SER A 20 -16.138 10.963 6.134 1.00 0.00 C ATOM 333 OG SER A 20 -16.879 11.844 6.969 1.00 0.00 O ATOM 0 H SER A 20 -15.483 10.171 8.392 1.00 0.00 H new ATOM 0 HA SER A 20 -17.464 9.310 6.534 1.00 0.00 H new ATOM 0 HB2 SER A 20 -15.074 11.191 6.197 1.00 0.00 H new ATOM 0 HB3 SER A 20 -16.431 11.096 5.093 1.00 0.00 H new ATOM 0 HG SER A 20 -16.312 12.148 7.709 1.00 0.00 H new ATOM 339 N VAL A 21 -14.366 8.462 5.782 1.00 0.00 N ATOM 340 CA VAL A 21 -13.587 7.544 4.907 1.00 0.00 C ATOM 341 C VAL A 21 -13.974 6.097 5.215 1.00 0.00 C ATOM 342 O VAL A 21 -14.153 5.285 4.329 1.00 0.00 O ATOM 343 CB VAL A 21 -12.093 7.740 5.169 1.00 0.00 C ATOM 344 CG1 VAL A 21 -11.292 6.707 4.376 1.00 0.00 C ATOM 345 CG2 VAL A 21 -11.679 9.151 4.735 1.00 0.00 C ATOM 0 H VAL A 21 -13.814 8.978 6.468 1.00 0.00 H new ATOM 0 HA VAL A 21 -13.805 7.763 3.862 1.00 0.00 H new ATOM 0 HB VAL A 21 -11.893 7.613 6.233 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -10.228 6.849 4.564 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -11.585 5.704 4.686 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -11.492 6.831 3.312 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -10.614 9.291 4.922 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -11.881 9.279 3.671 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -12.247 9.888 5.303 1.00 0.00 H new ATOM 355 N ALA A 22 -14.090 5.765 6.473 1.00 0.00 N ATOM 356 CA ALA A 22 -14.446 4.370 6.856 1.00 0.00 C ATOM 357 C ALA A 22 -15.789 3.977 6.238 1.00 0.00 C ATOM 358 O ALA A 22 -15.933 2.908 5.680 1.00 0.00 O ATOM 359 CB ALA A 22 -14.535 4.284 8.383 1.00 0.00 C ATOM 0 H ALA A 22 -13.952 6.405 7.255 1.00 0.00 H new ATOM 0 HA ALA A 22 -13.681 3.686 6.488 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -14.795 3.267 8.676 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -13.573 4.552 8.819 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -15.300 4.972 8.742 1.00 0.00 H new ATOM 365 N GLU A 23 -16.772 4.826 6.335 1.00 0.00 N ATOM 366 CA GLU A 23 -18.102 4.490 5.755 1.00 0.00 C ATOM 367 C GLU A 23 -17.984 4.388 4.232 1.00 0.00 C ATOM 368 O GLU A 23 -18.603 3.550 3.607 1.00 0.00 O ATOM 369 CB GLU A 23 -19.100 5.593 6.119 1.00 0.00 C ATOM 370 CG GLU A 23 -19.301 5.612 7.636 1.00 0.00 C ATOM 371 CD GLU A 23 -20.035 4.343 8.073 1.00 0.00 C ATOM 372 OE1 GLU A 23 -21.255 4.360 8.081 1.00 0.00 O ATOM 373 OE2 GLU A 23 -19.366 3.368 8.373 1.00 0.00 O ATOM 0 H GLU A 23 -16.713 5.737 6.790 1.00 0.00 H new ATOM 0 HA GLU A 23 -18.447 3.536 6.154 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -18.731 6.560 5.777 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -20.051 5.419 5.617 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -18.337 5.678 8.140 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -19.873 6.493 7.926 1.00 0.00 H new ATOM 380 N GLU A 24 -17.203 5.244 3.629 1.00 0.00 N ATOM 381 CA GLU A 24 -17.052 5.212 2.144 1.00 0.00 C ATOM 382 C GLU A 24 -16.240 3.978 1.729 1.00 0.00 C ATOM 383 O GLU A 24 -16.639 3.219 0.868 1.00 0.00 O ATOM 384 CB GLU A 24 -16.329 6.507 1.699 1.00 0.00 C ATOM 385 CG GLU A 24 -17.020 7.116 0.470 1.00 0.00 C ATOM 386 CD GLU A 24 -18.300 7.830 0.912 1.00 0.00 C ATOM 387 OE1 GLU A 24 -18.700 7.636 2.048 1.00 0.00 O ATOM 388 OE2 GLU A 24 -18.861 8.554 0.106 1.00 0.00 O ATOM 0 H GLU A 24 -16.661 5.967 4.102 1.00 0.00 H new ATOM 0 HA GLU A 24 -18.030 5.154 1.667 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -16.327 7.228 2.516 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -15.287 6.287 1.466 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -16.351 7.819 -0.027 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -17.256 6.335 -0.253 1.00 0.00 H new ATOM 395 N MET A 25 -15.104 3.781 2.334 1.00 0.00 N ATOM 396 CA MET A 25 -14.259 2.610 1.977 1.00 0.00 C ATOM 397 C MET A 25 -14.992 1.318 2.342 1.00 0.00 C ATOM 398 O MET A 25 -14.936 0.342 1.622 1.00 0.00 O ATOM 399 CB MET A 25 -12.941 2.689 2.746 1.00 0.00 C ATOM 400 CG MET A 25 -12.048 3.763 2.123 1.00 0.00 C ATOM 401 SD MET A 25 -10.510 3.895 3.074 1.00 0.00 S ATOM 402 CE MET A 25 -9.809 2.286 2.624 1.00 0.00 C ATOM 0 H MET A 25 -14.723 4.383 3.064 1.00 0.00 H new ATOM 0 HA MET A 25 -14.058 2.616 0.906 1.00 0.00 H new ATOM 0 HB2 MET A 25 -13.133 2.923 3.793 1.00 0.00 H new ATOM 0 HB3 MET A 25 -12.436 1.723 2.723 1.00 0.00 H new ATOM 0 HG2 MET A 25 -11.827 3.511 1.086 1.00 0.00 H new ATOM 0 HG3 MET A 25 -12.566 4.722 2.114 1.00 0.00 H new ATOM 0 HE1 MET A 25 -8.733 2.296 2.800 1.00 0.00 H new ATOM 0 HE2 MET A 25 -10.269 1.506 3.231 1.00 0.00 H new ATOM 0 HE3 MET A 25 -10.003 2.087 1.570 1.00 0.00 H new ATOM 412 N GLY A 26 -15.675 1.302 3.457 1.00 0.00 N ATOM 413 CA GLY A 26 -16.410 0.069 3.879 1.00 0.00 C ATOM 414 C GLY A 26 -15.568 -0.706 4.896 1.00 0.00 C ATOM 415 O GLY A 26 -15.643 -1.914 4.976 1.00 0.00 O ATOM 0 H GLY A 26 -15.757 2.092 4.097 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -17.371 0.338 4.317 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -16.619 -0.557 3.012 1.00 0.00 H new ATOM 419 N ILE A 27 -14.765 -0.015 5.676 1.00 0.00 N ATOM 420 CA ILE A 27 -13.905 -0.700 6.702 1.00 0.00 C ATOM 421 C ILE A 27 -14.135 -0.075 8.077 1.00 0.00 C ATOM 422 O ILE A 27 -14.746 0.966 8.207 1.00 0.00 O ATOM 423 CB ILE A 27 -12.428 -0.565 6.319 1.00 0.00 C ATOM 424 CG1 ILE A 27 -12.051 0.914 6.174 1.00 0.00 C ATOM 425 CG2 ILE A 27 -12.184 -1.288 4.993 1.00 0.00 C ATOM 426 CD1 ILE A 27 -10.533 1.042 6.033 1.00 0.00 C ATOM 0 H ILE A 27 -14.668 1.000 5.646 1.00 0.00 H new ATOM 0 HA ILE A 27 -14.173 -1.756 6.738 1.00 0.00 H new ATOM 0 HB ILE A 27 -11.813 -1.009 7.102 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -12.545 1.343 5.302 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -12.395 1.475 7.043 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -11.134 -1.195 4.716 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -12.439 -2.342 5.101 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -12.805 -0.843 4.216 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -10.265 2.093 5.930 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -10.049 0.629 6.918 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -10.202 0.495 5.150 1.00 0.00 H new ATOM 438 N SER A 28 -13.655 -0.712 9.106 1.00 0.00 N ATOM 439 CA SER A 28 -13.850 -0.171 10.479 1.00 0.00 C ATOM 440 C SER A 28 -12.919 1.022 10.719 1.00 0.00 C ATOM 441 O SER A 28 -11.870 1.144 10.116 1.00 0.00 O ATOM 442 CB SER A 28 -13.531 -1.270 11.490 1.00 0.00 C ATOM 443 OG SER A 28 -12.275 -1.852 11.166 1.00 0.00 O ATOM 0 H SER A 28 -13.134 -1.587 9.056 1.00 0.00 H new ATOM 0 HA SER A 28 -14.882 0.161 10.592 1.00 0.00 H new ATOM 0 HB2 SER A 28 -13.505 -0.857 12.498 1.00 0.00 H new ATOM 0 HB3 SER A 28 -14.312 -2.030 11.477 1.00 0.00 H new ATOM 0 HG SER A 28 -12.116 -2.628 11.742 1.00 0.00 H new ATOM 449 N ARG A 29 -13.299 1.895 11.611 1.00 0.00 N ATOM 450 CA ARG A 29 -12.457 3.082 11.920 1.00 0.00 C ATOM 451 C ARG A 29 -11.144 2.618 12.558 1.00 0.00 C ATOM 452 O ARG A 29 -10.087 3.153 12.281 1.00 0.00 O ATOM 453 CB ARG A 29 -13.224 4.021 12.866 1.00 0.00 C ATOM 454 CG ARG A 29 -12.394 5.283 13.126 1.00 0.00 C ATOM 455 CD ARG A 29 -13.285 6.395 13.695 1.00 0.00 C ATOM 456 NE ARG A 29 -13.789 6.014 15.045 1.00 0.00 N ATOM 457 CZ ARG A 29 -14.332 6.923 15.812 1.00 0.00 C ATOM 458 NH1 ARG A 29 -14.406 8.164 15.404 1.00 0.00 N ATOM 459 NH2 ARG A 29 -14.792 6.597 16.989 1.00 0.00 N ATOM 0 H ARG A 29 -14.167 1.835 12.144 1.00 0.00 H new ATOM 0 HA ARG A 29 -12.226 3.627 11.004 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -14.185 4.290 12.427 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -13.435 3.512 13.807 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -11.588 5.059 13.825 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -11.928 5.618 12.199 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -12.721 7.325 13.759 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -14.124 6.577 13.024 1.00 0.00 H new ATOM 0 HE ARG A 29 -13.711 5.050 15.369 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -14.040 8.422 14.488 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -14.830 8.873 16.002 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -14.728 5.632 17.312 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -15.215 7.308 17.586 1.00 0.00 H new ATOM 473 N GLN A 30 -11.199 1.624 13.403 1.00 0.00 N ATOM 474 CA GLN A 30 -9.951 1.124 14.049 1.00 0.00 C ATOM 475 C GLN A 30 -8.950 0.710 12.970 1.00 0.00 C ATOM 476 O GLN A 30 -7.771 0.988 13.065 1.00 0.00 O ATOM 477 CB GLN A 30 -10.286 -0.089 14.918 1.00 0.00 C ATOM 478 CG GLN A 30 -9.037 -0.529 15.679 1.00 0.00 C ATOM 479 CD GLN A 30 -9.372 -1.740 16.548 1.00 0.00 C ATOM 480 OE1 GLN A 30 -10.527 -2.035 16.785 1.00 0.00 O ATOM 481 NE2 GLN A 30 -8.400 -2.457 17.040 1.00 0.00 N ATOM 0 H GLN A 30 -12.053 1.137 13.674 1.00 0.00 H new ATOM 0 HA GLN A 30 -9.518 1.911 14.666 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -11.083 0.161 15.619 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -10.653 -0.906 14.296 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -8.240 -0.780 14.978 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -8.670 0.288 16.300 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -7.431 -2.208 16.840 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -8.609 -3.266 17.624 1.00 0.00 H new ATOM 490 N GLN A 31 -9.409 0.050 11.941 1.00 0.00 N ATOM 491 CA GLN A 31 -8.484 -0.377 10.854 1.00 0.00 C ATOM 492 C GLN A 31 -7.882 0.860 10.190 1.00 0.00 C ATOM 493 O GLN A 31 -6.713 0.893 9.860 1.00 0.00 O ATOM 494 CB GLN A 31 -9.263 -1.181 9.810 1.00 0.00 C ATOM 495 CG GLN A 31 -9.579 -2.571 10.363 1.00 0.00 C ATOM 496 CD GLN A 31 -8.297 -3.404 10.410 1.00 0.00 C ATOM 497 OE1 GLN A 31 -7.547 -3.338 11.364 1.00 0.00 O ATOM 498 NE2 GLN A 31 -8.011 -4.191 9.408 1.00 0.00 N ATOM 0 H GLN A 31 -10.386 -0.212 11.807 1.00 0.00 H new ATOM 0 HA GLN A 31 -7.689 -0.994 11.272 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -10.187 -0.663 9.552 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -8.680 -1.267 8.893 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -10.008 -2.488 11.361 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -10.323 -3.063 9.736 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -8.640 -4.246 8.607 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -7.158 -4.750 9.426 1.00 0.00 H new ATOM 507 N LEU A 32 -8.673 1.877 9.991 1.00 0.00 N ATOM 508 CA LEU A 32 -8.150 3.112 9.346 1.00 0.00 C ATOM 509 C LEU A 32 -7.048 3.715 10.217 1.00 0.00 C ATOM 510 O LEU A 32 -6.027 4.159 9.730 1.00 0.00 O ATOM 511 CB LEU A 32 -9.287 4.129 9.186 1.00 0.00 C ATOM 512 CG LEU A 32 -8.898 5.196 8.141 1.00 0.00 C ATOM 513 CD1 LEU A 32 -9.234 4.702 6.729 1.00 0.00 C ATOM 514 CD2 LEU A 32 -9.670 6.489 8.411 1.00 0.00 C ATOM 0 H LEU A 32 -9.660 1.906 10.248 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.744 2.864 8.365 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -10.200 3.620 8.876 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -9.497 4.606 10.144 1.00 0.00 H new ATOM 0 HG LEU A 32 -7.826 5.381 8.215 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -8.955 5.464 6.001 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -8.683 3.784 6.524 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -10.304 4.506 6.657 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -9.392 7.240 7.671 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -10.740 6.294 8.346 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -9.428 6.856 9.408 1.00 0.00 H new ATOM 526 N CYS A 33 -7.250 3.736 11.502 1.00 0.00 N ATOM 527 CA CYS A 33 -6.222 4.315 12.412 1.00 0.00 C ATOM 528 C CYS A 33 -4.920 3.526 12.275 1.00 0.00 C ATOM 529 O CYS A 33 -3.841 4.074 12.336 1.00 0.00 O ATOM 530 CB CYS A 33 -6.727 4.235 13.855 1.00 0.00 C ATOM 531 SG CYS A 33 -8.179 5.301 14.035 1.00 0.00 S ATOM 0 H CYS A 33 -8.085 3.376 11.965 1.00 0.00 H new ATOM 0 HA CYS A 33 -6.039 5.357 12.148 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -6.983 3.206 14.107 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -5.943 4.547 14.545 1.00 0.00 H new ATOM 0 HG CYS A 33 -9.205 4.736 13.471 1.00 0.00 H new ATOM 537 N ASN A 34 -5.014 2.243 12.087 1.00 0.00 N ATOM 538 CA ASN A 34 -3.783 1.419 11.943 1.00 0.00 C ATOM 539 C ASN A 34 -3.027 1.839 10.679 1.00 0.00 C ATOM 540 O ASN A 34 -1.813 1.848 10.646 1.00 0.00 O ATOM 541 CB ASN A 34 -4.173 -0.055 11.841 1.00 0.00 C ATOM 542 CG ASN A 34 -5.024 -0.440 13.050 1.00 0.00 C ATOM 543 OD1 ASN A 34 -5.061 0.270 14.036 1.00 0.00 O ATOM 544 ND2 ASN A 34 -5.719 -1.542 13.014 1.00 0.00 N ATOM 0 H ASN A 34 -5.891 1.727 12.026 1.00 0.00 H new ATOM 0 HA ASN A 34 -3.141 1.568 12.811 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -4.728 -0.233 10.920 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -3.279 -0.677 11.799 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -6.294 -1.809 13.813 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -5.688 -2.138 12.187 1.00 0.00 H new ATOM 551 N ILE A 35 -3.735 2.170 9.630 1.00 0.00 N ATOM 552 CA ILE A 35 -3.057 2.566 8.362 1.00 0.00 C ATOM 553 C ILE A 35 -2.217 3.826 8.586 1.00 0.00 C ATOM 554 O ILE A 35 -1.089 3.916 8.141 1.00 0.00 O ATOM 555 CB ILE A 35 -4.119 2.852 7.294 1.00 0.00 C ATOM 556 CG1 ILE A 35 -4.833 1.544 6.930 1.00 0.00 C ATOM 557 CG2 ILE A 35 -3.453 3.442 6.044 1.00 0.00 C ATOM 558 CD1 ILE A 35 -6.042 1.836 6.032 1.00 0.00 C ATOM 0 H ILE A 35 -4.754 2.183 9.598 1.00 0.00 H new ATOM 0 HA ILE A 35 -2.405 1.756 8.035 1.00 0.00 H new ATOM 0 HB ILE A 35 -4.843 3.568 7.683 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -4.143 0.874 6.417 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -5.158 1.034 7.837 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -4.212 3.643 5.288 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.946 4.371 6.306 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.727 2.731 5.649 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.542 0.901 5.779 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -6.738 2.488 6.559 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -5.706 2.326 5.118 1.00 0.00 H new ATOM 570 N GLU A 36 -2.752 4.802 9.265 1.00 0.00 N ATOM 571 CA GLU A 36 -1.976 6.050 9.506 1.00 0.00 C ATOM 572 C GLU A 36 -0.824 5.742 10.472 1.00 0.00 C ATOM 573 O GLU A 36 0.241 6.321 10.389 1.00 0.00 O ATOM 574 CB GLU A 36 -2.926 7.138 10.064 1.00 0.00 C ATOM 575 CG GLU A 36 -2.892 7.184 11.594 1.00 0.00 C ATOM 576 CD GLU A 36 -4.094 7.974 12.113 1.00 0.00 C ATOM 577 OE1 GLU A 36 -5.208 7.557 11.846 1.00 0.00 O ATOM 578 OE2 GLU A 36 -3.879 8.976 12.775 1.00 0.00 O ATOM 0 H GLU A 36 -3.691 4.790 9.663 1.00 0.00 H new ATOM 0 HA GLU A 36 -1.546 6.427 8.578 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -2.641 8.111 9.664 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.944 6.941 9.728 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.908 6.172 11.998 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -1.966 7.648 11.933 1.00 0.00 H new ATOM 585 N GLN A 37 -1.031 4.825 11.381 1.00 0.00 N ATOM 586 CA GLN A 37 0.051 4.464 12.346 1.00 0.00 C ATOM 587 C GLN A 37 1.002 3.464 11.688 1.00 0.00 C ATOM 588 O GLN A 37 1.736 2.760 12.352 1.00 0.00 O ATOM 589 CB GLN A 37 -0.562 3.837 13.605 1.00 0.00 C ATOM 590 CG GLN A 37 -1.173 4.934 14.481 1.00 0.00 C ATOM 591 CD GLN A 37 -1.839 4.304 15.706 1.00 0.00 C ATOM 592 OE1 GLN A 37 -2.397 3.227 15.623 1.00 0.00 O ATOM 593 NE2 GLN A 37 -1.805 4.935 16.848 1.00 0.00 N ATOM 0 H GLN A 37 -1.904 4.310 11.497 1.00 0.00 H new ATOM 0 HA GLN A 37 0.600 5.363 12.626 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -1.327 3.112 13.327 1.00 0.00 H new ATOM 0 HB3 GLN A 37 0.202 3.296 14.163 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -0.400 5.635 14.796 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -1.906 5.504 13.909 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -1.337 5.839 16.918 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -2.247 4.525 17.671 1.00 0.00 H new ATOM 602 N SER A 38 1.002 3.403 10.387 1.00 0.00 N ATOM 603 CA SER A 38 1.910 2.456 9.687 1.00 0.00 C ATOM 604 C SER A 38 3.346 2.979 9.778 1.00 0.00 C ATOM 605 O SER A 38 4.282 2.310 9.394 1.00 0.00 O ATOM 606 CB SER A 38 1.495 2.346 8.220 1.00 0.00 C ATOM 607 OG SER A 38 0.201 1.766 8.142 1.00 0.00 O ATOM 0 H SER A 38 0.411 3.969 9.778 1.00 0.00 H new ATOM 0 HA SER A 38 1.849 1.473 10.153 1.00 0.00 H new ATOM 0 HB2 SER A 38 1.493 3.332 7.756 1.00 0.00 H new ATOM 0 HB3 SER A 38 2.213 1.737 7.671 1.00 0.00 H new ATOM 0 HG SER A 38 -0.428 2.419 7.770 1.00 0.00 H new ATOM 613 N GLU A 39 3.517 4.171 10.289 1.00 0.00 N ATOM 614 CA GLU A 39 4.884 4.760 10.421 1.00 0.00 C ATOM 615 C GLU A 39 5.664 4.609 9.116 1.00 0.00 C ATOM 616 O GLU A 39 5.706 5.509 8.305 1.00 0.00 O ATOM 617 CB GLU A 39 5.644 4.060 11.546 1.00 0.00 C ATOM 618 CG GLU A 39 4.996 4.396 12.890 1.00 0.00 C ATOM 619 CD GLU A 39 5.817 3.770 14.018 1.00 0.00 C ATOM 620 OE1 GLU A 39 6.734 4.424 14.488 1.00 0.00 O ATOM 621 OE2 GLU A 39 5.517 2.649 14.392 1.00 0.00 O ATOM 0 H GLU A 39 2.760 4.768 10.624 1.00 0.00 H new ATOM 0 HA GLU A 39 4.780 5.820 10.651 1.00 0.00 H new ATOM 0 HB2 GLU A 39 5.637 2.982 11.387 1.00 0.00 H new ATOM 0 HB3 GLU A 39 6.687 4.376 11.545 1.00 0.00 H new ATOM 0 HG2 GLU A 39 4.942 5.477 13.021 1.00 0.00 H new ATOM 0 HG3 GLU A 39 3.973 4.020 12.918 1.00 0.00 H new ATOM 628 N THR A 40 6.296 3.482 8.909 1.00 0.00 N ATOM 629 CA THR A 40 7.090 3.277 7.655 1.00 0.00 C ATOM 630 C THR A 40 6.254 2.488 6.647 1.00 0.00 C ATOM 631 O THR A 40 5.585 1.532 6.986 1.00 0.00 O ATOM 632 CB THR A 40 8.369 2.505 7.993 1.00 0.00 C ATOM 633 OG1 THR A 40 9.194 2.430 6.840 1.00 0.00 O ATOM 634 CG2 THR A 40 8.014 1.093 8.462 1.00 0.00 C ATOM 0 H THR A 40 6.298 2.692 9.554 1.00 0.00 H new ATOM 0 HA THR A 40 7.354 4.241 7.220 1.00 0.00 H new ATOM 0 HB THR A 40 8.902 3.023 8.790 1.00 0.00 H new ATOM 0 HG1 THR A 40 10.013 1.938 7.056 1.00 0.00 H new ATOM 0 HG21 THR A 40 8.928 0.549 8.701 1.00 0.00 H new ATOM 0 HG22 THR A 40 7.384 1.152 9.350 1.00 0.00 H new ATOM 0 HG23 THR A 40 7.477 0.571 7.670 1.00 0.00 H new ATOM 642 N ALA A 41 6.274 2.894 5.408 1.00 0.00 N ATOM 643 CA ALA A 41 5.465 2.191 4.373 1.00 0.00 C ATOM 644 C ALA A 41 6.076 0.808 4.077 1.00 0.00 C ATOM 645 O ALA A 41 7.267 0.613 4.221 1.00 0.00 O ATOM 646 CB ALA A 41 5.467 3.037 3.095 1.00 0.00 C ATOM 0 H ALA A 41 6.818 3.686 5.066 1.00 0.00 H new ATOM 0 HA ALA A 41 4.445 2.054 4.732 1.00 0.00 H new ATOM 0 HB1 ALA A 41 4.879 2.536 2.326 1.00 0.00 H new ATOM 0 HB2 ALA A 41 5.033 4.014 3.305 1.00 0.00 H new ATOM 0 HB3 ALA A 41 6.491 3.163 2.744 1.00 0.00 H new ATOM 652 N PRO A 42 5.268 -0.145 3.660 1.00 0.00 N ATOM 653 CA PRO A 42 5.746 -1.528 3.331 1.00 0.00 C ATOM 654 C PRO A 42 6.562 -1.581 2.030 1.00 0.00 C ATOM 655 O PRO A 42 6.482 -0.702 1.195 1.00 0.00 O ATOM 656 CB PRO A 42 4.445 -2.336 3.195 1.00 0.00 C ATOM 657 CG PRO A 42 3.413 -1.336 2.780 1.00 0.00 C ATOM 658 CD PRO A 42 3.808 -0.019 3.455 1.00 0.00 C ATOM 0 HA PRO A 42 6.422 -1.914 4.094 1.00 0.00 H new ATOM 0 HB2 PRO A 42 4.548 -3.129 2.454 1.00 0.00 H new ATOM 0 HB3 PRO A 42 4.176 -2.814 4.137 1.00 0.00 H new ATOM 0 HG2 PRO A 42 3.389 -1.227 1.696 1.00 0.00 H new ATOM 0 HG3 PRO A 42 2.417 -1.651 3.091 1.00 0.00 H new ATOM 0 HD2 PRO A 42 3.566 0.839 2.828 1.00 0.00 H new ATOM 0 HD3 PRO A 42 3.283 0.118 4.400 1.00 0.00 H new ATOM 666 N VAL A 43 7.339 -2.617 1.855 1.00 0.00 N ATOM 667 CA VAL A 43 8.156 -2.746 0.616 1.00 0.00 C ATOM 668 C VAL A 43 7.225 -2.768 -0.599 1.00 0.00 C ATOM 669 O VAL A 43 7.632 -2.494 -1.710 1.00 0.00 O ATOM 670 CB VAL A 43 8.966 -4.044 0.677 1.00 0.00 C ATOM 671 CG1 VAL A 43 10.129 -3.879 1.658 1.00 0.00 C ATOM 672 CG2 VAL A 43 8.062 -5.177 1.159 1.00 0.00 C ATOM 0 H VAL A 43 7.442 -3.382 2.521 1.00 0.00 H new ATOM 0 HA VAL A 43 8.840 -1.901 0.531 1.00 0.00 H new ATOM 0 HB VAL A 43 9.356 -4.275 -0.314 1.00 0.00 H new ATOM 0 HG11 VAL A 43 10.704 -4.804 1.700 1.00 0.00 H new ATOM 0 HG12 VAL A 43 10.774 -3.066 1.325 1.00 0.00 H new ATOM 0 HG13 VAL A 43 9.739 -3.649 2.650 1.00 0.00 H new ATOM 0 HG21 VAL A 43 8.633 -6.104 1.204 1.00 0.00 H new ATOM 0 HG22 VAL A 43 7.677 -4.939 2.151 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.229 -5.298 0.466 1.00 0.00 H new ATOM 682 N VAL A 44 5.976 -3.088 -0.393 1.00 0.00 N ATOM 683 CA VAL A 44 5.016 -3.119 -1.531 1.00 0.00 C ATOM 684 C VAL A 44 4.928 -1.721 -2.146 1.00 0.00 C ATOM 685 O VAL A 44 4.976 -1.557 -3.349 1.00 0.00 O ATOM 686 CB VAL A 44 3.636 -3.537 -1.014 1.00 0.00 C ATOM 687 CG1 VAL A 44 2.605 -3.413 -2.137 1.00 0.00 C ATOM 688 CG2 VAL A 44 3.693 -4.987 -0.530 1.00 0.00 C ATOM 0 H VAL A 44 5.580 -3.329 0.515 1.00 0.00 H new ATOM 0 HA VAL A 44 5.354 -3.831 -2.284 1.00 0.00 H new ATOM 0 HB VAL A 44 3.347 -2.887 -0.188 1.00 0.00 H new ATOM 0 HG11 VAL A 44 1.625 -3.711 -1.765 1.00 0.00 H new ATOM 0 HG12 VAL A 44 2.564 -2.379 -2.481 1.00 0.00 H new ATOM 0 HG13 VAL A 44 2.891 -4.060 -2.966 1.00 0.00 H new ATOM 0 HG21 VAL A 44 2.712 -5.286 -0.162 1.00 0.00 H new ATOM 0 HG22 VAL A 44 3.984 -5.635 -1.357 1.00 0.00 H new ATOM 0 HG23 VAL A 44 4.424 -5.074 0.274 1.00 0.00 H new ATOM 698 N VAL A 45 4.813 -0.710 -1.327 1.00 0.00 N ATOM 699 CA VAL A 45 4.735 0.678 -1.860 1.00 0.00 C ATOM 700 C VAL A 45 6.039 1.005 -2.588 1.00 0.00 C ATOM 701 O VAL A 45 6.037 1.544 -3.677 1.00 0.00 O ATOM 702 CB VAL A 45 4.527 1.651 -0.693 1.00 0.00 C ATOM 703 CG1 VAL A 45 4.685 3.093 -1.182 1.00 0.00 C ATOM 704 CG2 VAL A 45 3.122 1.459 -0.117 1.00 0.00 C ATOM 0 H VAL A 45 4.770 -0.787 -0.311 1.00 0.00 H new ATOM 0 HA VAL A 45 3.901 0.769 -2.556 1.00 0.00 H new ATOM 0 HB VAL A 45 5.271 1.452 0.078 1.00 0.00 H new ATOM 0 HG11 VAL A 45 4.536 3.778 -0.348 1.00 0.00 H new ATOM 0 HG12 VAL A 45 5.686 3.231 -1.591 1.00 0.00 H new ATOM 0 HG13 VAL A 45 3.946 3.298 -1.956 1.00 0.00 H new ATOM 0 HG21 VAL A 45 2.971 2.150 0.713 1.00 0.00 H new ATOM 0 HG22 VAL A 45 2.381 1.656 -0.892 1.00 0.00 H new ATOM 0 HG23 VAL A 45 3.011 0.435 0.239 1.00 0.00 H new ATOM 714 N LYS A 46 7.152 0.670 -1.999 1.00 0.00 N ATOM 715 CA LYS A 46 8.459 0.949 -2.653 1.00 0.00 C ATOM 716 C LYS A 46 8.545 0.165 -3.963 1.00 0.00 C ATOM 717 O LYS A 46 9.044 0.651 -4.958 1.00 0.00 O ATOM 718 CB LYS A 46 9.593 0.523 -1.721 1.00 0.00 C ATOM 719 CG LYS A 46 9.623 1.448 -0.504 1.00 0.00 C ATOM 720 CD LYS A 46 10.740 1.009 0.440 1.00 0.00 C ATOM 721 CE LYS A 46 10.736 1.896 1.685 1.00 0.00 C ATOM 722 NZ LYS A 46 11.125 3.285 1.307 1.00 0.00 N ATOM 0 H LYS A 46 7.212 0.213 -1.089 1.00 0.00 H new ATOM 0 HA LYS A 46 8.546 2.015 -2.863 1.00 0.00 H new ATOM 0 HB2 LYS A 46 9.449 -0.510 -1.403 1.00 0.00 H new ATOM 0 HB3 LYS A 46 10.547 0.565 -2.247 1.00 0.00 H new ATOM 0 HG2 LYS A 46 9.784 2.479 -0.821 1.00 0.00 H new ATOM 0 HG3 LYS A 46 8.663 1.419 0.012 1.00 0.00 H new ATOM 0 HD2 LYS A 46 10.601 -0.034 0.724 1.00 0.00 H new ATOM 0 HD3 LYS A 46 11.704 1.077 -0.064 1.00 0.00 H new ATOM 0 HE2 LYS A 46 9.746 1.896 2.142 1.00 0.00 H new ATOM 0 HE3 LYS A 46 11.430 1.502 2.428 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 11.402 3.812 2.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 11.926 3.253 0.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 10.319 3.760 0.853 1.00 0.00 H new ATOM 736 N TYR A 47 8.061 -1.047 -3.972 1.00 0.00 N ATOM 737 CA TYR A 47 8.112 -1.866 -5.214 1.00 0.00 C ATOM 738 C TYR A 47 7.336 -1.148 -6.322 1.00 0.00 C ATOM 739 O TYR A 47 7.755 -1.105 -7.466 1.00 0.00 O ATOM 740 CB TYR A 47 7.479 -3.232 -4.945 1.00 0.00 C ATOM 741 CG TYR A 47 7.586 -4.083 -6.184 1.00 0.00 C ATOM 742 CD1 TYR A 47 8.799 -4.710 -6.494 1.00 0.00 C ATOM 743 CD2 TYR A 47 6.478 -4.248 -7.023 1.00 0.00 C ATOM 744 CE1 TYR A 47 8.905 -5.501 -7.643 1.00 0.00 C ATOM 745 CE2 TYR A 47 6.585 -5.040 -8.172 1.00 0.00 C ATOM 746 CZ TYR A 47 7.797 -5.666 -8.482 1.00 0.00 C ATOM 747 OH TYR A 47 7.900 -6.445 -9.615 1.00 0.00 O ATOM 0 H TYR A 47 7.631 -1.506 -3.169 1.00 0.00 H new ATOM 0 HA TYR A 47 9.148 -2.003 -5.525 1.00 0.00 H new ATOM 0 HB2 TYR A 47 7.981 -3.720 -4.110 1.00 0.00 H new ATOM 0 HB3 TYR A 47 6.433 -3.112 -4.662 1.00 0.00 H new ATOM 0 HD1 TYR A 47 9.653 -4.583 -5.846 1.00 0.00 H new ATOM 0 HD2 TYR A 47 5.542 -3.765 -6.784 1.00 0.00 H new ATOM 0 HE1 TYR A 47 9.841 -5.984 -7.882 1.00 0.00 H new ATOM 0 HE2 TYR A 47 5.731 -5.168 -8.820 1.00 0.00 H new ATOM 0 HH TYR A 47 7.040 -6.455 -10.084 1.00 0.00 H new ATOM 757 N ILE A 48 6.210 -0.580 -5.990 1.00 0.00 N ATOM 758 CA ILE A 48 5.403 0.138 -7.013 1.00 0.00 C ATOM 759 C ILE A 48 6.217 1.310 -7.559 1.00 0.00 C ATOM 760 O ILE A 48 6.251 1.556 -8.748 1.00 0.00 O ATOM 761 CB ILE A 48 4.116 0.659 -6.365 1.00 0.00 C ATOM 762 CG1 ILE A 48 3.222 -0.526 -5.990 1.00 0.00 C ATOM 763 CG2 ILE A 48 3.377 1.569 -7.347 1.00 0.00 C ATOM 764 CD1 ILE A 48 2.049 -0.035 -5.139 1.00 0.00 C ATOM 0 H ILE A 48 5.813 -0.583 -5.050 1.00 0.00 H new ATOM 0 HA ILE A 48 5.148 -0.538 -7.829 1.00 0.00 H new ATOM 0 HB ILE A 48 4.364 1.226 -5.468 1.00 0.00 H new ATOM 0 HG12 ILE A 48 2.851 -1.014 -6.891 1.00 0.00 H new ATOM 0 HG13 ILE A 48 3.798 -1.269 -5.439 1.00 0.00 H new ATOM 0 HG21 ILE A 48 2.462 1.938 -6.883 1.00 0.00 H new ATOM 0 HG22 ILE A 48 4.015 2.412 -7.612 1.00 0.00 H new ATOM 0 HG23 ILE A 48 3.127 1.006 -8.246 1.00 0.00 H new ATOM 0 HD11 ILE A 48 1.414 -0.880 -4.873 1.00 0.00 H new ATOM 0 HD12 ILE A 48 2.429 0.433 -4.231 1.00 0.00 H new ATOM 0 HD13 ILE A 48 1.467 0.692 -5.706 1.00 0.00 H new ATOM 776 N ALA A 49 6.880 2.033 -6.701 1.00 0.00 N ATOM 777 CA ALA A 49 7.694 3.186 -7.171 1.00 0.00 C ATOM 778 C ALA A 49 8.737 2.689 -8.171 1.00 0.00 C ATOM 779 O ALA A 49 9.078 3.370 -9.117 1.00 0.00 O ATOM 780 CB ALA A 49 8.398 3.826 -5.974 1.00 0.00 C ATOM 0 H ALA A 49 6.893 1.875 -5.693 1.00 0.00 H new ATOM 0 HA ALA A 49 7.050 3.923 -7.651 1.00 0.00 H new ATOM 0 HB1 ALA A 49 8.996 4.672 -6.313 1.00 0.00 H new ATOM 0 HB2 ALA A 49 7.654 4.172 -5.257 1.00 0.00 H new ATOM 0 HB3 ALA A 49 9.047 3.091 -5.498 1.00 0.00 H new ATOM 786 N PHE A 50 9.248 1.505 -7.967 1.00 0.00 N ATOM 787 CA PHE A 50 10.272 0.963 -8.901 1.00 0.00 C ATOM 788 C PHE A 50 9.661 0.842 -10.299 1.00 0.00 C ATOM 789 O PHE A 50 10.234 1.272 -11.280 1.00 0.00 O ATOM 790 CB PHE A 50 10.708 -0.423 -8.399 1.00 0.00 C ATOM 791 CG PHE A 50 12.079 -0.763 -8.936 1.00 0.00 C ATOM 792 CD1 PHE A 50 13.199 -0.086 -8.443 1.00 0.00 C ATOM 793 CD2 PHE A 50 12.234 -1.757 -9.913 1.00 0.00 C ATOM 794 CE1 PHE A 50 14.474 -0.399 -8.922 1.00 0.00 C ATOM 795 CE2 PHE A 50 13.512 -2.070 -10.393 1.00 0.00 C ATOM 796 CZ PHE A 50 14.632 -1.391 -9.897 1.00 0.00 C ATOM 0 H PHE A 50 8.999 0.890 -7.192 1.00 0.00 H new ATOM 0 HA PHE A 50 11.136 1.626 -8.945 1.00 0.00 H new ATOM 0 HB2 PHE A 50 10.723 -0.435 -7.309 1.00 0.00 H new ATOM 0 HB3 PHE A 50 9.987 -1.177 -8.717 1.00 0.00 H new ATOM 0 HD1 PHE A 50 13.078 0.680 -7.691 1.00 0.00 H new ATOM 0 HD2 PHE A 50 11.370 -2.280 -10.295 1.00 0.00 H new ATOM 0 HE1 PHE A 50 15.338 0.125 -8.540 1.00 0.00 H new ATOM 0 HE2 PHE A 50 13.634 -2.835 -11.146 1.00 0.00 H new ATOM 0 HZ PHE A 50 15.618 -1.633 -10.267 1.00 0.00 H new ATOM 806 N LEU A 51 8.495 0.264 -10.393 1.00 0.00 N ATOM 807 CA LEU A 51 7.839 0.114 -11.723 1.00 0.00 C ATOM 808 C LEU A 51 7.535 1.498 -12.292 1.00 0.00 C ATOM 809 O LEU A 51 7.721 1.753 -13.464 1.00 0.00 O ATOM 810 CB LEU A 51 6.533 -0.659 -11.552 1.00 0.00 C ATOM 811 CG LEU A 51 6.829 -2.072 -11.032 1.00 0.00 C ATOM 812 CD1 LEU A 51 5.503 -2.806 -10.799 1.00 0.00 C ATOM 813 CD2 LEU A 51 7.696 -2.849 -12.042 1.00 0.00 C ATOM 0 H LEU A 51 7.967 -0.111 -9.605 1.00 0.00 H new ATOM 0 HA LEU A 51 8.500 -0.425 -12.402 1.00 0.00 H new ATOM 0 HB2 LEU A 51 5.878 -0.135 -10.856 1.00 0.00 H new ATOM 0 HB3 LEU A 51 6.006 -0.715 -12.504 1.00 0.00 H new ATOM 0 HG LEU A 51 7.380 -2.003 -10.094 1.00 0.00 H new ATOM 0 HD11 LEU A 51 5.704 -3.812 -10.429 1.00 0.00 H new ATOM 0 HD12 LEU A 51 4.910 -2.261 -10.065 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.952 -2.868 -11.737 1.00 0.00 H new ATOM 0 HD21 LEU A 51 7.896 -3.849 -11.656 1.00 0.00 H new ATOM 0 HD22 LEU A 51 7.167 -2.925 -12.992 1.00 0.00 H new ATOM 0 HD23 LEU A 51 8.639 -2.323 -12.193 1.00 0.00 H new ATOM 825 N ARG A 52 7.075 2.394 -11.465 1.00 0.00 N ATOM 826 CA ARG A 52 6.765 3.764 -11.945 1.00 0.00 C ATOM 827 C ARG A 52 8.051 4.365 -12.515 1.00 0.00 C ATOM 828 O ARG A 52 8.058 4.966 -13.570 1.00 0.00 O ATOM 829 CB ARG A 52 6.248 4.590 -10.749 1.00 0.00 C ATOM 830 CG ARG A 52 5.318 5.728 -11.207 1.00 0.00 C ATOM 831 CD ARG A 52 6.145 6.930 -11.671 1.00 0.00 C ATOM 832 NE ARG A 52 5.222 8.022 -12.108 1.00 0.00 N ATOM 833 CZ ARG A 52 4.749 8.877 -11.237 1.00 0.00 C ATOM 834 NH1 ARG A 52 5.062 8.766 -9.972 1.00 0.00 N ATOM 835 NH2 ARG A 52 3.954 9.838 -11.628 1.00 0.00 N ATOM 0 H ARG A 52 6.900 2.233 -10.473 1.00 0.00 H new ATOM 0 HA ARG A 52 6.000 3.758 -12.722 1.00 0.00 H new ATOM 0 HB2 ARG A 52 5.713 3.937 -10.059 1.00 0.00 H new ATOM 0 HB3 ARG A 52 7.093 5.008 -10.202 1.00 0.00 H new ATOM 0 HG2 ARG A 52 4.679 5.381 -12.019 1.00 0.00 H new ATOM 0 HG3 ARG A 52 4.661 6.023 -10.389 1.00 0.00 H new ATOM 0 HD2 ARG A 52 6.785 7.281 -10.861 1.00 0.00 H new ATOM 0 HD3 ARG A 52 6.800 6.641 -12.493 1.00 0.00 H new ATOM 0 HE ARG A 52 4.959 8.101 -13.090 1.00 0.00 H new ATOM 0 HH11 ARG A 52 5.676 8.012 -9.663 1.00 0.00 H new ATOM 0 HH12 ARG A 52 4.692 9.433 -9.295 1.00 0.00 H new ATOM 0 HH21 ARG A 52 3.702 9.922 -12.613 1.00 0.00 H new ATOM 0 HH22 ARG A 52 3.586 10.504 -10.948 1.00 0.00 H new ATOM 849 N SER A 53 9.144 4.178 -11.829 1.00 0.00 N ATOM 850 CA SER A 53 10.447 4.704 -12.324 1.00 0.00 C ATOM 851 C SER A 53 10.767 4.073 -13.678 1.00 0.00 C ATOM 852 O SER A 53 11.367 4.690 -14.537 1.00 0.00 O ATOM 853 CB SER A 53 11.547 4.351 -11.325 1.00 0.00 C ATOM 854 OG SER A 53 11.147 4.768 -10.028 1.00 0.00 O ATOM 0 H SER A 53 9.191 3.680 -10.940 1.00 0.00 H new ATOM 0 HA SER A 53 10.387 5.787 -12.433 1.00 0.00 H new ATOM 0 HB2 SER A 53 11.733 3.277 -11.334 1.00 0.00 H new ATOM 0 HB3 SER A 53 12.481 4.839 -11.606 1.00 0.00 H new ATOM 0 HG SER A 53 10.663 4.040 -9.585 1.00 0.00 H new ATOM 860 N LYS A 54 10.372 2.847 -13.875 1.00 0.00 N ATOM 861 CA LYS A 54 10.654 2.171 -15.169 1.00 0.00 C ATOM 862 C LYS A 54 9.718 2.734 -16.241 1.00 0.00 C ATOM 863 O LYS A 54 9.723 2.296 -17.375 1.00 0.00 O ATOM 864 CB LYS A 54 10.415 0.664 -15.002 1.00 0.00 C ATOM 865 CG LYS A 54 11.419 0.068 -13.998 1.00 0.00 C ATOM 866 CD LYS A 54 12.764 -0.206 -14.682 1.00 0.00 C ATOM 867 CE LYS A 54 13.747 -0.793 -13.667 1.00 0.00 C ATOM 868 NZ LYS A 54 15.047 -1.057 -14.343 1.00 0.00 N ATOM 0 H LYS A 54 9.865 2.283 -13.193 1.00 0.00 H new ATOM 0 HA LYS A 54 11.687 2.343 -15.470 1.00 0.00 H new ATOM 0 HB2 LYS A 54 9.397 0.487 -14.656 1.00 0.00 H new ATOM 0 HB3 LYS A 54 10.515 0.165 -15.966 1.00 0.00 H new ATOM 0 HG2 LYS A 54 11.561 0.756 -13.165 1.00 0.00 H new ATOM 0 HG3 LYS A 54 11.021 -0.857 -13.582 1.00 0.00 H new ATOM 0 HD2 LYS A 54 12.627 -0.899 -15.512 1.00 0.00 H new ATOM 0 HD3 LYS A 54 13.165 0.717 -15.100 1.00 0.00 H new ATOM 0 HE2 LYS A 54 13.889 -0.101 -12.837 1.00 0.00 H new ATOM 0 HE3 LYS A 54 13.347 -1.716 -13.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 15.720 -1.456 -13.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 14.903 -1.732 -15.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 15.428 -0.167 -14.723 1.00 0.00 H new ATOM 882 N GLY A 55 8.928 3.715 -15.895 1.00 0.00 N ATOM 883 CA GLY A 55 8.004 4.324 -16.895 1.00 0.00 C ATOM 884 C GLY A 55 6.787 3.422 -17.106 1.00 0.00 C ATOM 885 O GLY A 55 6.073 3.556 -18.077 1.00 0.00 O ATOM 0 H GLY A 55 8.883 4.122 -14.961 1.00 0.00 H new ATOM 0 HA2 GLY A 55 7.682 5.307 -16.552 1.00 0.00 H new ATOM 0 HA3 GLY A 55 8.525 4.471 -17.841 1.00 0.00 H new ATOM 889 N VAL A 56 6.541 2.508 -16.212 1.00 0.00 N ATOM 890 CA VAL A 56 5.366 1.605 -16.383 1.00 0.00 C ATOM 891 C VAL A 56 4.077 2.424 -16.292 1.00 0.00 C ATOM 892 O VAL A 56 3.917 3.255 -15.423 1.00 0.00 O ATOM 893 CB VAL A 56 5.396 0.527 -15.295 1.00 0.00 C ATOM 894 CG1 VAL A 56 4.081 -0.258 -15.302 1.00 0.00 C ATOM 895 CG2 VAL A 56 6.558 -0.429 -15.578 1.00 0.00 C ATOM 0 H VAL A 56 7.098 2.346 -15.373 1.00 0.00 H new ATOM 0 HA VAL A 56 5.405 1.122 -17.360 1.00 0.00 H new ATOM 0 HB VAL A 56 5.525 0.997 -14.320 1.00 0.00 H new ATOM 0 HG11 VAL A 56 4.110 -1.023 -14.526 1.00 0.00 H new ATOM 0 HG12 VAL A 56 3.250 0.422 -15.111 1.00 0.00 H new ATOM 0 HG13 VAL A 56 3.946 -0.732 -16.274 1.00 0.00 H new ATOM 0 HG21 VAL A 56 6.589 -1.201 -14.809 1.00 0.00 H new ATOM 0 HG22 VAL A 56 6.417 -0.894 -16.554 1.00 0.00 H new ATOM 0 HG23 VAL A 56 7.496 0.127 -15.573 1.00 0.00 H new ATOM 905 N ASP A 57 3.160 2.203 -17.194 1.00 0.00 N ATOM 906 CA ASP A 57 1.886 2.979 -17.175 1.00 0.00 C ATOM 907 C ASP A 57 1.040 2.565 -15.966 1.00 0.00 C ATOM 908 O ASP A 57 -0.046 2.040 -16.102 1.00 0.00 O ATOM 909 CB ASP A 57 1.108 2.712 -18.467 1.00 0.00 C ATOM 910 CG ASP A 57 1.172 1.222 -18.802 1.00 0.00 C ATOM 911 OD1 ASP A 57 2.207 0.787 -19.280 1.00 0.00 O ATOM 912 OD2 ASP A 57 0.187 0.540 -18.574 1.00 0.00 O ATOM 0 H ASP A 57 3.238 1.517 -17.945 1.00 0.00 H new ATOM 0 HA ASP A 57 2.113 4.042 -17.101 1.00 0.00 H new ATOM 0 HB2 ASP A 57 0.070 3.025 -18.351 1.00 0.00 H new ATOM 0 HB3 ASP A 57 1.528 3.298 -19.285 1.00 0.00 H new ATOM 917 N LEU A 58 1.533 2.822 -14.787 1.00 0.00 N ATOM 918 CA LEU A 58 0.775 2.480 -13.550 1.00 0.00 C ATOM 919 C LEU A 58 -0.488 3.340 -13.478 1.00 0.00 C ATOM 920 O LEU A 58 -1.508 2.926 -12.966 1.00 0.00 O ATOM 921 CB LEU A 58 1.657 2.752 -12.325 1.00 0.00 C ATOM 922 CG LEU A 58 1.120 1.986 -11.098 1.00 0.00 C ATOM 923 CD1 LEU A 58 1.667 0.554 -11.081 1.00 0.00 C ATOM 924 CD2 LEU A 58 1.561 2.700 -9.818 1.00 0.00 C ATOM 0 H LEU A 58 2.440 3.260 -14.625 1.00 0.00 H new ATOM 0 HA LEU A 58 0.495 1.427 -13.567 1.00 0.00 H new ATOM 0 HB2 LEU A 58 2.683 2.447 -12.532 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.678 3.821 -12.114 1.00 0.00 H new ATOM 0 HG LEU A 58 0.032 1.954 -11.155 1.00 0.00 H new ATOM 0 HD11 LEU A 58 1.279 0.027 -10.209 1.00 0.00 H new ATOM 0 HD12 LEU A 58 1.356 0.035 -11.987 1.00 0.00 H new ATOM 0 HD13 LEU A 58 2.756 0.581 -11.034 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.182 2.159 -8.951 1.00 0.00 H new ATOM 0 HD22 LEU A 58 2.650 2.734 -9.777 1.00 0.00 H new ATOM 0 HD23 LEU A 58 1.166 3.716 -9.813 1.00 0.00 H new ATOM 936 N ASN A 59 -0.416 4.543 -13.976 1.00 0.00 N ATOM 937 CA ASN A 59 -1.599 5.445 -13.926 1.00 0.00 C ATOM 938 C ASN A 59 -2.769 4.764 -14.625 1.00 0.00 C ATOM 939 O ASN A 59 -3.888 4.789 -14.152 1.00 0.00 O ATOM 940 CB ASN A 59 -1.266 6.748 -14.662 1.00 0.00 C ATOM 941 CG ASN A 59 -0.404 7.644 -13.773 1.00 0.00 C ATOM 942 OD1 ASN A 59 -0.901 8.566 -13.153 1.00 0.00 O ATOM 943 ND2 ASN A 59 0.877 7.409 -13.678 1.00 0.00 N ATOM 0 H ASN A 59 0.414 4.941 -14.416 1.00 0.00 H new ATOM 0 HA ASN A 59 -1.859 5.661 -12.890 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -0.739 6.527 -15.590 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -2.185 7.267 -14.934 1.00 0.00 H new ATOM 0 HD21 ASN A 59 1.461 7.998 -13.084 1.00 0.00 H new ATOM 0 HD22 ASN A 59 1.294 6.636 -14.197 1.00 0.00 H new ATOM 950 N ALA A 60 -2.523 4.147 -15.743 1.00 0.00 N ATOM 951 CA ALA A 60 -3.626 3.461 -16.460 1.00 0.00 C ATOM 952 C ALA A 60 -4.154 2.317 -15.599 1.00 0.00 C ATOM 953 O ALA A 60 -5.345 2.124 -15.472 1.00 0.00 O ATOM 954 CB ALA A 60 -3.099 2.905 -17.782 1.00 0.00 C ATOM 0 H ALA A 60 -1.608 4.088 -16.190 1.00 0.00 H new ATOM 0 HA ALA A 60 -4.432 4.168 -16.658 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -3.907 2.400 -18.312 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -2.718 3.722 -18.394 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -2.296 2.195 -17.584 1.00 0.00 H new ATOM 960 N LEU A 61 -3.280 1.554 -15.001 1.00 0.00 N ATOM 961 CA LEU A 61 -3.746 0.421 -14.156 1.00 0.00 C ATOM 962 C LEU A 61 -4.589 0.956 -12.998 1.00 0.00 C ATOM 963 O LEU A 61 -5.653 0.449 -12.707 1.00 0.00 O ATOM 964 CB LEU A 61 -2.520 -0.321 -13.604 1.00 0.00 C ATOM 965 CG LEU A 61 -2.954 -1.439 -12.648 1.00 0.00 C ATOM 966 CD1 LEU A 61 -3.921 -2.401 -13.356 1.00 0.00 C ATOM 967 CD2 LEU A 61 -1.711 -2.205 -12.185 1.00 0.00 C ATOM 0 H LEU A 61 -2.268 1.666 -15.061 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.354 -0.260 -14.752 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -1.942 -0.742 -14.426 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -1.868 0.379 -13.082 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.465 -1.003 -11.790 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -4.221 -3.189 -12.665 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -4.803 -1.853 -13.686 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.426 -2.844 -14.220 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -2.008 -3.003 -11.504 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -1.206 -2.635 -13.050 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -1.034 -1.523 -11.671 1.00 0.00 H new ATOM 979 N PHE A 62 -4.120 1.976 -12.338 1.00 0.00 N ATOM 980 CA PHE A 62 -4.882 2.554 -11.193 1.00 0.00 C ATOM 981 C PHE A 62 -6.138 3.262 -11.700 1.00 0.00 C ATOM 982 O PHE A 62 -7.191 3.197 -11.094 1.00 0.00 O ATOM 983 CB PHE A 62 -3.985 3.562 -10.458 1.00 0.00 C ATOM 984 CG PHE A 62 -3.098 2.845 -9.456 1.00 0.00 C ATOM 985 CD1 PHE A 62 -2.314 1.751 -9.855 1.00 0.00 C ATOM 986 CD2 PHE A 62 -3.061 3.279 -8.125 1.00 0.00 C ATOM 987 CE1 PHE A 62 -1.497 1.099 -8.923 1.00 0.00 C ATOM 988 CE2 PHE A 62 -2.245 2.626 -7.196 1.00 0.00 C ATOM 989 CZ PHE A 62 -1.463 1.537 -7.595 1.00 0.00 C ATOM 0 H PHE A 62 -3.235 2.439 -12.543 1.00 0.00 H new ATOM 0 HA PHE A 62 -5.180 1.754 -10.515 1.00 0.00 H new ATOM 0 HB2 PHE A 62 -3.370 4.103 -11.177 1.00 0.00 H new ATOM 0 HB3 PHE A 62 -4.601 4.301 -9.945 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -2.341 1.412 -10.880 1.00 0.00 H new ATOM 0 HD2 PHE A 62 -3.664 4.120 -7.815 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -0.893 0.258 -9.230 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -2.219 2.963 -6.170 1.00 0.00 H new ATOM 0 HZ PHE A 62 -0.832 1.034 -6.877 1.00 0.00 H new ATOM 999 N ASP A 63 -6.029 3.956 -12.792 1.00 0.00 N ATOM 1000 CA ASP A 63 -7.197 4.698 -13.326 1.00 0.00 C ATOM 1001 C ASP A 63 -8.412 3.775 -13.404 1.00 0.00 C ATOM 1002 O ASP A 63 -9.496 4.135 -12.989 1.00 0.00 O ATOM 1003 CB ASP A 63 -6.847 5.216 -14.721 1.00 0.00 C ATOM 1004 CG ASP A 63 -7.998 6.061 -15.263 1.00 0.00 C ATOM 1005 OD1 ASP A 63 -8.871 6.410 -14.486 1.00 0.00 O ATOM 1006 OD2 ASP A 63 -7.983 6.353 -16.448 1.00 0.00 O ATOM 0 H ASP A 63 -5.174 4.042 -13.342 1.00 0.00 H new ATOM 0 HA ASP A 63 -7.438 5.533 -12.668 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -5.935 5.811 -14.680 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -6.651 4.379 -15.391 1.00 0.00 H new ATOM 1011 N ARG A 64 -8.257 2.593 -13.931 1.00 0.00 N ATOM 1012 CA ARG A 64 -9.428 1.676 -14.023 1.00 0.00 C ATOM 1013 C ARG A 64 -9.844 1.228 -12.623 1.00 0.00 C ATOM 1014 O ARG A 64 -11.015 1.094 -12.329 1.00 0.00 O ATOM 1015 CB ARG A 64 -9.068 0.454 -14.872 1.00 0.00 C ATOM 1016 CG ARG A 64 -8.401 0.899 -16.184 1.00 0.00 C ATOM 1017 CD ARG A 64 -9.175 2.058 -16.825 1.00 0.00 C ATOM 1018 NE ARG A 64 -8.774 2.187 -18.258 1.00 0.00 N ATOM 1019 CZ ARG A 64 -9.460 1.586 -19.197 1.00 0.00 C ATOM 1020 NH1 ARG A 64 -10.477 0.827 -18.885 1.00 0.00 N ATOM 1021 NH2 ARG A 64 -9.119 1.733 -20.447 1.00 0.00 N ATOM 0 H ARG A 64 -7.380 2.224 -14.299 1.00 0.00 H new ATOM 0 HA ARG A 64 -10.258 2.204 -14.493 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -8.395 -0.199 -14.316 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -9.966 -0.124 -15.090 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -7.374 1.206 -15.988 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -8.356 0.059 -16.877 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -10.248 1.879 -16.750 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -8.969 2.987 -16.293 1.00 0.00 H new ATOM 0 HE ARG A 64 -7.959 2.748 -18.507 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -10.739 0.701 -17.907 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -11.009 0.360 -19.619 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -8.319 2.316 -20.692 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -9.653 1.265 -21.180 1.00 0.00 H new ATOM 1035 N ILE A 65 -8.899 0.997 -11.757 1.00 0.00 N ATOM 1036 CA ILE A 65 -9.246 0.557 -10.378 1.00 0.00 C ATOM 1037 C ILE A 65 -10.046 1.657 -9.680 1.00 0.00 C ATOM 1038 O ILE A 65 -11.033 1.395 -9.025 1.00 0.00 O ATOM 1039 CB ILE A 65 -7.958 0.290 -9.598 1.00 0.00 C ATOM 1040 CG1 ILE A 65 -7.255 -0.942 -10.179 1.00 0.00 C ATOM 1041 CG2 ILE A 65 -8.286 0.042 -8.123 1.00 0.00 C ATOM 1042 CD1 ILE A 65 -5.841 -1.069 -9.597 1.00 0.00 C ATOM 0 H ILE A 65 -7.901 1.094 -11.944 1.00 0.00 H new ATOM 0 HA ILE A 65 -9.844 -0.353 -10.422 1.00 0.00 H new ATOM 0 HB ILE A 65 -7.303 1.157 -9.679 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -7.831 -1.839 -9.953 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -7.203 -0.862 -11.265 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -7.365 -0.148 -7.572 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -8.783 0.919 -7.708 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -8.945 -0.822 -8.037 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -5.352 -1.948 -10.017 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -5.264 -0.179 -9.846 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -5.901 -1.171 -8.513 1.00 0.00 H new ATOM 1282 N GLU B 2 -7.778 -8.644 -10.701 1.00 0.00 N ATOM 1283 CA GLU B 2 -6.798 -8.920 -9.608 1.00 0.00 C ATOM 1284 C GLU B 2 -5.546 -8.051 -9.793 1.00 0.00 C ATOM 1285 O GLU B 2 -5.016 -7.929 -10.878 1.00 0.00 O ATOM 1286 CB GLU B 2 -6.414 -10.417 -9.623 1.00 0.00 C ATOM 1287 CG GLU B 2 -7.536 -11.232 -10.281 1.00 0.00 C ATOM 1288 CD GLU B 2 -7.411 -12.706 -9.888 1.00 0.00 C ATOM 1289 OE1 GLU B 2 -6.317 -13.235 -9.981 1.00 0.00 O ATOM 1290 OE2 GLU B 2 -8.416 -13.279 -9.499 1.00 0.00 O ATOM 0 HA GLU B 2 -7.253 -8.677 -8.647 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -5.481 -10.558 -10.169 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -6.244 -10.769 -8.605 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -8.507 -10.846 -9.972 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -7.483 -11.130 -11.365 1.00 0.00 H new ATOM 1297 N LEU B 3 -5.070 -7.456 -8.732 1.00 0.00 N ATOM 1298 CA LEU B 3 -3.852 -6.601 -8.829 1.00 0.00 C ATOM 1299 C LEU B 3 -2.652 -7.457 -9.233 1.00 0.00 C ATOM 1300 O LEU B 3 -1.845 -7.067 -10.053 1.00 0.00 O ATOM 1301 CB LEU B 3 -3.585 -5.964 -7.459 1.00 0.00 C ATOM 1302 CG LEU B 3 -2.326 -5.086 -7.507 1.00 0.00 C ATOM 1303 CD1 LEU B 3 -2.488 -3.968 -8.553 1.00 0.00 C ATOM 1304 CD2 LEU B 3 -2.102 -4.474 -6.121 1.00 0.00 C ATOM 0 H LEU B 3 -5.475 -7.526 -7.798 1.00 0.00 H new ATOM 0 HA LEU B 3 -4.006 -5.825 -9.579 1.00 0.00 H new ATOM 0 HB2 LEU B 3 -4.443 -5.363 -7.158 1.00 0.00 H new ATOM 0 HB3 LEU B 3 -3.463 -6.744 -6.707 1.00 0.00 H new ATOM 0 HG LEU B 3 -1.468 -5.696 -7.790 1.00 0.00 H new ATOM 0 HD11 LEU B 3 -1.587 -3.356 -8.574 1.00 0.00 H new ATOM 0 HD12 LEU B 3 -2.649 -4.410 -9.536 1.00 0.00 H new ATOM 0 HD13 LEU B 3 -3.344 -3.346 -8.291 1.00 0.00 H new ATOM 0 HD21 LEU B 3 -1.210 -3.847 -6.140 1.00 0.00 H new ATOM 0 HD22 LEU B 3 -2.966 -3.868 -5.847 1.00 0.00 H new ATOM 0 HD23 LEU B 3 -1.970 -5.270 -5.389 1.00 0.00 H new ATOM 1316 N SER B 4 -2.523 -8.618 -8.654 1.00 0.00 N ATOM 1317 CA SER B 4 -1.367 -9.495 -8.985 1.00 0.00 C ATOM 1318 C SER B 4 -1.396 -9.854 -10.472 1.00 0.00 C ATOM 1319 O SER B 4 -0.375 -9.883 -11.130 1.00 0.00 O ATOM 1320 CB SER B 4 -1.448 -10.772 -8.147 1.00 0.00 C ATOM 1321 OG SER B 4 -0.322 -11.591 -8.430 1.00 0.00 O ATOM 0 H SER B 4 -3.171 -8.998 -7.964 1.00 0.00 H new ATOM 0 HA SER B 4 -0.438 -8.969 -8.764 1.00 0.00 H new ATOM 0 HB2 SER B 4 -1.474 -10.523 -7.086 1.00 0.00 H new ATOM 0 HB3 SER B 4 -2.369 -11.310 -8.371 1.00 0.00 H new ATOM 0 HG SER B 4 -0.370 -12.410 -7.893 1.00 0.00 H new ATOM 1327 N ASN B 5 -2.551 -10.129 -11.006 1.00 0.00 N ATOM 1328 CA ASN B 5 -2.637 -10.493 -12.446 1.00 0.00 C ATOM 1329 C ASN B 5 -2.131 -9.338 -13.309 1.00 0.00 C ATOM 1330 O ASN B 5 -1.342 -9.526 -14.213 1.00 0.00 O ATOM 1331 CB ASN B 5 -4.102 -10.776 -12.786 1.00 0.00 C ATOM 1332 CG ASN B 5 -4.212 -11.352 -14.198 1.00 0.00 C ATOM 1333 OD1 ASN B 5 -3.206 -11.245 -15.022 1.00 0.00 O flip ATOM 1334 ND2 ASN B 5 -5.233 -11.907 -14.556 1.00 0.00 N flip ATOM 0 H ASN B 5 -3.441 -10.118 -10.507 1.00 0.00 H new ATOM 0 HA ASN B 5 -2.024 -11.373 -12.641 1.00 0.00 H new ATOM 0 HB2 ASN B 5 -4.522 -11.477 -12.065 1.00 0.00 H new ATOM 0 HB3 ASN B 5 -4.684 -9.857 -12.713 1.00 0.00 H new ATOM 0 HD21 ASN B 5 -6.020 -11.991 -13.913 1.00 0.00 H new ATOM 0 HD22 ASN B 5 -5.302 -12.288 -15.500 1.00 0.00 H new ATOM 1341 N GLU B 6 -2.573 -8.144 -13.039 1.00 0.00 N ATOM 1342 CA GLU B 6 -2.118 -6.976 -13.844 1.00 0.00 C ATOM 1343 C GLU B 6 -0.647 -6.694 -13.534 1.00 0.00 C ATOM 1344 O GLU B 6 0.143 -6.408 -14.412 1.00 0.00 O ATOM 1345 CB GLU B 6 -2.958 -5.756 -13.461 1.00 0.00 C ATOM 1346 CG GLU B 6 -4.444 -6.050 -13.714 1.00 0.00 C ATOM 1347 CD GLU B 6 -4.752 -5.935 -15.209 1.00 0.00 C ATOM 1348 OE1 GLU B 6 -4.556 -4.860 -15.753 1.00 0.00 O ATOM 1349 OE2 GLU B 6 -5.181 -6.921 -15.784 1.00 0.00 O ATOM 0 H GLU B 6 -3.233 -7.924 -12.293 1.00 0.00 H new ATOM 0 HA GLU B 6 -2.233 -7.188 -14.907 1.00 0.00 H new ATOM 0 HB2 GLU B 6 -2.800 -5.509 -12.411 1.00 0.00 H new ATOM 0 HB3 GLU B 6 -2.645 -4.889 -14.043 1.00 0.00 H new ATOM 0 HG2 GLU B 6 -4.691 -7.051 -13.359 1.00 0.00 H new ATOM 0 HG3 GLU B 6 -5.063 -5.351 -13.152 1.00 0.00 H new ATOM 1356 N LEU B 7 -0.280 -6.766 -12.284 1.00 0.00 N ATOM 1357 CA LEU B 7 1.132 -6.496 -11.895 1.00 0.00 C ATOM 1358 C LEU B 7 2.048 -7.534 -12.542 1.00 0.00 C ATOM 1359 O LEU B 7 3.111 -7.217 -13.035 1.00 0.00 O ATOM 1360 CB LEU B 7 1.250 -6.581 -10.369 1.00 0.00 C ATOM 1361 CG LEU B 7 2.666 -6.197 -9.920 1.00 0.00 C ATOM 1362 CD1 LEU B 7 2.956 -4.722 -10.263 1.00 0.00 C ATOM 1363 CD2 LEU B 7 2.780 -6.410 -8.405 1.00 0.00 C ATOM 0 H LEU B 7 -0.902 -7.002 -11.511 1.00 0.00 H new ATOM 0 HA LEU B 7 1.427 -5.502 -12.232 1.00 0.00 H new ATOM 0 HB2 LEU B 7 0.521 -5.917 -9.904 1.00 0.00 H new ATOM 0 HB3 LEU B 7 1.018 -7.592 -10.036 1.00 0.00 H new ATOM 0 HG LEU B 7 3.393 -6.821 -10.440 1.00 0.00 H new ATOM 0 HD11 LEU B 7 3.964 -4.464 -9.938 1.00 0.00 H new ATOM 0 HD12 LEU B 7 2.873 -4.576 -11.340 1.00 0.00 H new ATOM 0 HD13 LEU B 7 2.236 -4.082 -9.753 1.00 0.00 H new ATOM 0 HD21 LEU B 7 3.783 -6.140 -8.074 1.00 0.00 H new ATOM 0 HD22 LEU B 7 2.049 -5.784 -7.894 1.00 0.00 H new ATOM 0 HD23 LEU B 7 2.590 -7.457 -8.169 1.00 0.00 H new ATOM 1375 N LYS B 8 1.647 -8.775 -12.539 1.00 0.00 N ATOM 1376 CA LYS B 8 2.496 -9.840 -13.145 1.00 0.00 C ATOM 1377 C LYS B 8 2.667 -9.578 -14.642 1.00 0.00 C ATOM 1378 O LYS B 8 3.722 -9.799 -15.204 1.00 0.00 O ATOM 1379 CB LYS B 8 1.825 -11.198 -12.934 1.00 0.00 C ATOM 1380 CG LYS B 8 2.753 -12.303 -13.432 1.00 0.00 C ATOM 1381 CD LYS B 8 2.108 -13.663 -13.172 1.00 0.00 C ATOM 1382 CE LYS B 8 3.042 -14.770 -13.663 1.00 0.00 C ATOM 1383 NZ LYS B 8 4.318 -14.721 -12.896 1.00 0.00 N ATOM 0 H LYS B 8 0.765 -9.099 -12.142 1.00 0.00 H new ATOM 0 HA LYS B 8 3.477 -9.838 -12.670 1.00 0.00 H new ATOM 0 HB2 LYS B 8 1.600 -11.345 -11.878 1.00 0.00 H new ATOM 0 HB3 LYS B 8 0.877 -11.235 -13.470 1.00 0.00 H new ATOM 0 HG2 LYS B 8 2.947 -12.178 -14.497 1.00 0.00 H new ATOM 0 HG3 LYS B 8 3.715 -12.241 -12.924 1.00 0.00 H new ATOM 0 HD2 LYS B 8 1.909 -13.786 -12.107 1.00 0.00 H new ATOM 0 HD3 LYS B 8 1.149 -13.727 -13.685 1.00 0.00 H new ATOM 0 HE2 LYS B 8 2.567 -15.743 -13.537 1.00 0.00 H new ATOM 0 HE3 LYS B 8 3.241 -14.647 -14.728 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 4.632 -15.689 -12.682 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 5.045 -14.238 -13.462 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 4.169 -14.201 -12.008 1.00 0.00 H new ATOM 1397 N VAL B 9 1.638 -9.113 -15.296 1.00 0.00 N ATOM 1398 CA VAL B 9 1.738 -8.843 -16.759 1.00 0.00 C ATOM 1399 C VAL B 9 2.818 -7.786 -17.016 1.00 0.00 C ATOM 1400 O VAL B 9 3.646 -7.935 -17.892 1.00 0.00 O ATOM 1401 CB VAL B 9 0.384 -8.326 -17.261 1.00 0.00 C ATOM 1402 CG1 VAL B 9 0.525 -7.789 -18.690 1.00 0.00 C ATOM 1403 CG2 VAL B 9 -0.643 -9.466 -17.242 1.00 0.00 C ATOM 0 H VAL B 9 0.730 -8.908 -14.879 1.00 0.00 H new ATOM 0 HA VAL B 9 2.004 -9.759 -17.286 1.00 0.00 H new ATOM 0 HB VAL B 9 0.047 -7.521 -16.608 1.00 0.00 H new ATOM 0 HG11 VAL B 9 -0.441 -7.424 -19.039 1.00 0.00 H new ATOM 0 HG12 VAL B 9 1.247 -6.973 -18.702 1.00 0.00 H new ATOM 0 HG13 VAL B 9 0.869 -8.588 -19.347 1.00 0.00 H new ATOM 0 HG21 VAL B 9 -1.604 -9.096 -17.599 1.00 0.00 H new ATOM 0 HG22 VAL B 9 -0.302 -10.274 -17.889 1.00 0.00 H new ATOM 0 HG23 VAL B 9 -0.754 -9.839 -16.224 1.00 0.00 H new ATOM 1413 N GLU B 10 2.811 -6.719 -16.266 1.00 0.00 N ATOM 1414 CA GLU B 10 3.833 -5.655 -16.474 1.00 0.00 C ATOM 1415 C GLU B 10 5.213 -6.184 -16.082 1.00 0.00 C ATOM 1416 O GLU B 10 6.202 -5.899 -16.727 1.00 0.00 O ATOM 1417 CB GLU B 10 3.476 -4.434 -15.607 1.00 0.00 C ATOM 1418 CG GLU B 10 2.499 -3.518 -16.353 1.00 0.00 C ATOM 1419 CD GLU B 10 1.138 -4.204 -16.491 1.00 0.00 C ATOM 1420 OE1 GLU B 10 0.458 -4.328 -15.486 1.00 0.00 O ATOM 1421 OE2 GLU B 10 0.798 -4.586 -17.598 1.00 0.00 O ATOM 0 H GLU B 10 2.142 -6.538 -15.518 1.00 0.00 H new ATOM 0 HA GLU B 10 3.850 -5.363 -17.524 1.00 0.00 H new ATOM 0 HB2 GLU B 10 3.031 -4.764 -14.668 1.00 0.00 H new ATOM 0 HB3 GLU B 10 4.381 -3.882 -15.354 1.00 0.00 H new ATOM 0 HG2 GLU B 10 2.388 -2.577 -15.815 1.00 0.00 H new ATOM 0 HG3 GLU B 10 2.895 -3.277 -17.339 1.00 0.00 H new ATOM 1428 N ARG B 11 5.291 -6.946 -15.032 1.00 0.00 N ATOM 1429 CA ARG B 11 6.614 -7.483 -14.606 1.00 0.00 C ATOM 1430 C ARG B 11 7.221 -8.268 -15.768 1.00 0.00 C ATOM 1431 O ARG B 11 8.393 -8.127 -16.087 1.00 0.00 O ATOM 1432 CB ARG B 11 6.406 -8.410 -13.394 1.00 0.00 C ATOM 1433 CG ARG B 11 7.764 -8.898 -12.828 1.00 0.00 C ATOM 1434 CD ARG B 11 8.131 -10.279 -13.402 1.00 0.00 C ATOM 1435 NE ARG B 11 7.024 -11.254 -13.123 1.00 0.00 N ATOM 1436 CZ ARG B 11 7.165 -12.241 -12.260 1.00 0.00 C ATOM 1437 NH1 ARG B 11 8.279 -12.412 -11.592 1.00 0.00 N ATOM 1438 NH2 ARG B 11 6.173 -13.065 -12.067 1.00 0.00 N ATOM 0 H ARG B 11 4.500 -7.221 -14.450 1.00 0.00 H new ATOM 0 HA ARG B 11 7.286 -6.672 -14.327 1.00 0.00 H new ATOM 0 HB2 ARG B 11 5.853 -7.881 -12.618 1.00 0.00 H new ATOM 0 HB3 ARG B 11 5.801 -9.268 -13.687 1.00 0.00 H new ATOM 0 HG2 ARG B 11 8.545 -8.178 -13.073 1.00 0.00 H new ATOM 0 HG3 ARG B 11 7.711 -8.953 -11.741 1.00 0.00 H new ATOM 0 HD2 ARG B 11 8.300 -10.204 -14.476 1.00 0.00 H new ATOM 0 HD3 ARG B 11 9.061 -10.633 -12.957 1.00 0.00 H new ATOM 0 HE ARG B 11 6.137 -11.150 -13.615 1.00 0.00 H new ATOM 0 HH11 ARG B 11 9.062 -11.774 -11.734 1.00 0.00 H new ATOM 0 HH12 ARG B 11 8.363 -13.183 -10.930 1.00 0.00 H new ATOM 0 HH21 ARG B 11 5.301 -12.942 -12.581 1.00 0.00 H new ATOM 0 HH22 ARG B 11 6.270 -13.833 -11.402 1.00 0.00 H new ATOM 1452 N ILE B 12 6.426 -9.089 -16.406 1.00 0.00 N ATOM 1453 CA ILE B 12 6.929 -9.888 -17.557 1.00 0.00 C ATOM 1454 C ILE B 12 7.289 -8.952 -18.715 1.00 0.00 C ATOM 1455 O ILE B 12 8.311 -9.103 -19.353 1.00 0.00 O ATOM 1456 CB ILE B 12 5.837 -10.864 -18.008 1.00 0.00 C ATOM 1457 CG1 ILE B 12 5.604 -11.910 -16.915 1.00 0.00 C ATOM 1458 CG2 ILE B 12 6.275 -11.571 -19.295 1.00 0.00 C ATOM 1459 CD1 ILE B 12 4.324 -12.690 -17.222 1.00 0.00 C ATOM 0 H ILE B 12 5.444 -9.239 -16.175 1.00 0.00 H new ATOM 0 HA ILE B 12 7.817 -10.444 -17.255 1.00 0.00 H new ATOM 0 HB ILE B 12 4.916 -10.311 -18.191 1.00 0.00 H new ATOM 0 HG12 ILE B 12 6.454 -12.591 -16.861 1.00 0.00 H new ATOM 0 HG13 ILE B 12 5.522 -11.424 -15.943 1.00 0.00 H new ATOM 0 HG21 ILE B 12 5.496 -12.264 -19.613 1.00 0.00 H new ATOM 0 HG22 ILE B 12 6.443 -10.831 -20.077 1.00 0.00 H new ATOM 0 HG23 ILE B 12 7.198 -12.121 -19.112 1.00 0.00 H new ATOM 0 HD11 ILE B 12 4.157 -13.435 -16.444 1.00 0.00 H new ATOM 0 HD12 ILE B 12 3.478 -12.003 -17.254 1.00 0.00 H new ATOM 0 HD13 ILE B 12 4.424 -13.188 -18.186 1.00 0.00 H new ATOM 1471 N ARG B 13 6.448 -7.988 -18.997 1.00 0.00 N ATOM 1472 CA ARG B 13 6.735 -7.050 -20.121 1.00 0.00 C ATOM 1473 C ARG B 13 8.048 -6.317 -19.859 1.00 0.00 C ATOM 1474 O ARG B 13 8.889 -6.211 -20.730 1.00 0.00 O ATOM 1475 CB ARG B 13 5.591 -6.038 -20.234 1.00 0.00 C ATOM 1476 CG ARG B 13 5.837 -5.087 -21.413 1.00 0.00 C ATOM 1477 CD ARG B 13 4.736 -4.025 -21.446 1.00 0.00 C ATOM 1478 NE ARG B 13 3.469 -4.628 -21.951 1.00 0.00 N ATOM 1479 CZ ARG B 13 2.323 -4.060 -21.687 1.00 0.00 C ATOM 1480 NH1 ARG B 13 2.279 -2.995 -20.929 1.00 0.00 N ATOM 1481 NH2 ARG B 13 1.221 -4.558 -22.176 1.00 0.00 N ATOM 0 H ARG B 13 5.577 -7.812 -18.497 1.00 0.00 H new ATOM 0 HA ARG B 13 6.822 -7.610 -21.052 1.00 0.00 H new ATOM 0 HB2 ARG B 13 4.645 -6.562 -20.372 1.00 0.00 H new ATOM 0 HB3 ARG B 13 5.508 -5.468 -19.309 1.00 0.00 H new ATOM 0 HG2 ARG B 13 6.813 -4.612 -21.314 1.00 0.00 H new ATOM 0 HG3 ARG B 13 5.847 -5.645 -22.349 1.00 0.00 H new ATOM 0 HD2 ARG B 13 4.582 -3.616 -20.447 1.00 0.00 H new ATOM 0 HD3 ARG B 13 5.036 -3.196 -22.087 1.00 0.00 H new ATOM 0 HE ARG B 13 3.497 -5.485 -22.503 1.00 0.00 H new ATOM 0 HH11 ARG B 13 3.140 -2.607 -20.544 1.00 0.00 H new ATOM 0 HH12 ARG B 13 1.384 -2.552 -20.723 1.00 0.00 H new ATOM 0 HH21 ARG B 13 1.255 -5.391 -22.764 1.00 0.00 H new ATOM 0 HH22 ARG B 13 0.326 -4.115 -21.970 1.00 0.00 H new ATOM 1495 N LEU B 14 8.243 -5.815 -18.675 1.00 0.00 N ATOM 1496 CA LEU B 14 9.507 -5.104 -18.381 1.00 0.00 C ATOM 1497 C LEU B 14 10.588 -6.137 -18.076 1.00 0.00 C ATOM 1498 O LEU B 14 11.734 -5.797 -17.861 1.00 0.00 O ATOM 1499 CB LEU B 14 9.281 -4.207 -17.162 1.00 0.00 C ATOM 1500 CG LEU B 14 8.572 -2.909 -17.579 1.00 0.00 C ATOM 1501 CD1 LEU B 14 9.534 -1.977 -18.347 1.00 0.00 C ATOM 1502 CD2 LEU B 14 7.357 -3.232 -18.454 1.00 0.00 C ATOM 0 H LEU B 14 7.581 -5.868 -17.901 1.00 0.00 H new ATOM 0 HA LEU B 14 9.819 -4.496 -19.230 1.00 0.00 H new ATOM 0 HB2 LEU B 14 8.682 -4.735 -16.420 1.00 0.00 H new ATOM 0 HB3 LEU B 14 10.236 -3.973 -16.692 1.00 0.00 H new ATOM 0 HG LEU B 14 8.242 -2.397 -16.675 1.00 0.00 H new ATOM 0 HD11 LEU B 14 9.008 -1.065 -18.631 1.00 0.00 H new ATOM 0 HD12 LEU B 14 10.381 -1.724 -17.710 1.00 0.00 H new ATOM 0 HD13 LEU B 14 9.893 -2.483 -19.243 1.00 0.00 H new ATOM 0 HD21 LEU B 14 6.861 -2.306 -18.744 1.00 0.00 H new ATOM 0 HD22 LEU B 14 7.683 -3.764 -19.347 1.00 0.00 H new ATOM 0 HD23 LEU B 14 6.661 -3.856 -17.894 1.00 0.00 H new ATOM 1514 N SER B 15 10.222 -7.403 -18.069 1.00 0.00 N ATOM 1515 CA SER B 15 11.211 -8.494 -17.790 1.00 0.00 C ATOM 1516 C SER B 15 12.209 -8.027 -16.729 1.00 0.00 C ATOM 1517 O SER B 15 13.401 -7.986 -16.960 1.00 0.00 O ATOM 1518 CB SER B 15 11.952 -8.837 -19.083 1.00 0.00 C ATOM 1519 OG SER B 15 11.001 -9.100 -20.109 1.00 0.00 O ATOM 0 H SER B 15 9.271 -7.726 -18.247 1.00 0.00 H new ATOM 0 HA SER B 15 10.690 -9.377 -17.421 1.00 0.00 H new ATOM 0 HB2 SER B 15 12.601 -8.011 -19.375 1.00 0.00 H new ATOM 0 HB3 SER B 15 12.591 -9.707 -18.931 1.00 0.00 H new ATOM 0 HG SER B 15 10.107 -9.172 -19.715 1.00 0.00 H new ATOM 1525 N LEU B 16 11.729 -7.644 -15.578 1.00 0.00 N ATOM 1526 CA LEU B 16 12.658 -7.146 -14.518 1.00 0.00 C ATOM 1527 C LEU B 16 13.345 -8.325 -13.827 1.00 0.00 C ATOM 1528 O LEU B 16 12.785 -9.391 -13.688 1.00 0.00 O ATOM 1529 CB LEU B 16 11.866 -6.334 -13.493 1.00 0.00 C ATOM 1530 CG LEU B 16 11.168 -5.160 -14.189 1.00 0.00 C ATOM 1531 CD1 LEU B 16 10.334 -4.393 -13.164 1.00 0.00 C ATOM 1532 CD2 LEU B 16 12.208 -4.215 -14.819 1.00 0.00 C ATOM 0 H LEU B 16 10.741 -7.653 -15.324 1.00 0.00 H new ATOM 0 HA LEU B 16 13.420 -6.514 -14.974 1.00 0.00 H new ATOM 0 HB2 LEU B 16 11.128 -6.970 -13.004 1.00 0.00 H new ATOM 0 HB3 LEU B 16 12.533 -5.963 -12.715 1.00 0.00 H new ATOM 0 HG LEU B 16 10.523 -5.546 -14.978 1.00 0.00 H new ATOM 0 HD11 LEU B 16 9.835 -3.557 -13.653 1.00 0.00 H new ATOM 0 HD12 LEU B 16 9.587 -5.058 -12.732 1.00 0.00 H new ATOM 0 HD13 LEU B 16 10.984 -4.016 -12.375 1.00 0.00 H new ATOM 0 HD21 LEU B 16 11.697 -3.387 -15.309 1.00 0.00 H new ATOM 0 HD22 LEU B 16 12.865 -3.827 -14.041 1.00 0.00 H new ATOM 0 HD23 LEU B 16 12.799 -4.762 -15.553 1.00 0.00 H new ATOM 1544 N THR B 17 14.567 -8.136 -13.404 1.00 0.00 N ATOM 1545 CA THR B 17 15.320 -9.239 -12.732 1.00 0.00 C ATOM 1546 C THR B 17 15.231 -9.084 -11.215 1.00 0.00 C ATOM 1547 O THR B 17 15.304 -7.996 -10.681 1.00 0.00 O ATOM 1548 CB THR B 17 16.785 -9.175 -13.161 1.00 0.00 C ATOM 1549 OG1 THR B 17 17.243 -7.832 -13.070 1.00 0.00 O ATOM 1550 CG2 THR B 17 16.914 -9.662 -14.603 1.00 0.00 C ATOM 0 H THR B 17 15.080 -7.259 -13.495 1.00 0.00 H new ATOM 0 HA THR B 17 14.888 -10.198 -13.018 1.00 0.00 H new ATOM 0 HB THR B 17 17.386 -9.810 -12.509 1.00 0.00 H new ATOM 0 HG1 THR B 17 18.183 -7.788 -13.343 1.00 0.00 H new ATOM 0 HG21 THR B 17 17.959 -9.617 -14.910 1.00 0.00 H new ATOM 0 HG22 THR B 17 16.559 -10.690 -14.673 1.00 0.00 H new ATOM 0 HG23 THR B 17 16.316 -9.027 -15.256 1.00 0.00 H new ATOM 1558 N ALA B 18 15.072 -10.173 -10.518 1.00 0.00 N ATOM 1559 CA ALA B 18 14.973 -10.113 -9.034 1.00 0.00 C ATOM 1560 C ALA B 18 16.291 -9.615 -8.439 1.00 0.00 C ATOM 1561 O ALA B 18 16.307 -8.882 -7.471 1.00 0.00 O ATOM 1562 CB ALA B 18 14.670 -11.514 -8.501 1.00 0.00 C ATOM 0 H ALA B 18 15.006 -11.110 -10.916 1.00 0.00 H new ATOM 0 HA ALA B 18 14.176 -9.425 -8.751 1.00 0.00 H new ATOM 0 HB1 ALA B 18 14.595 -11.481 -7.414 1.00 0.00 H new ATOM 0 HB2 ALA B 18 13.727 -11.866 -8.919 1.00 0.00 H new ATOM 0 HB3 ALA B 18 15.471 -12.194 -8.789 1.00 0.00 H new ATOM 1568 N LYS B 19 17.396 -10.014 -9.005 1.00 0.00 N ATOM 1569 CA LYS B 19 18.713 -9.572 -8.468 1.00 0.00 C ATOM 1570 C LYS B 19 18.835 -8.051 -8.577 1.00 0.00 C ATOM 1571 O LYS B 19 19.223 -7.382 -7.639 1.00 0.00 O ATOM 1572 CB LYS B 19 19.822 -10.233 -9.286 1.00 0.00 C ATOM 1573 CG LYS B 19 21.186 -9.891 -8.684 1.00 0.00 C ATOM 1574 CD LYS B 19 22.294 -10.555 -9.512 1.00 0.00 C ATOM 1575 CE LYS B 19 22.168 -12.087 -9.462 1.00 0.00 C ATOM 1576 NZ LYS B 19 21.672 -12.518 -8.124 1.00 0.00 N ATOM 0 H LYS B 19 17.444 -10.628 -9.818 1.00 0.00 H new ATOM 0 HA LYS B 19 18.799 -9.859 -7.420 1.00 0.00 H new ATOM 0 HB2 LYS B 19 19.681 -11.314 -9.300 1.00 0.00 H new ATOM 0 HB3 LYS B 19 19.775 -9.893 -10.320 1.00 0.00 H new ATOM 0 HG2 LYS B 19 21.327 -8.810 -8.668 1.00 0.00 H new ATOM 0 HG3 LYS B 19 21.235 -10.234 -7.650 1.00 0.00 H new ATOM 0 HD2 LYS B 19 22.236 -10.214 -10.546 1.00 0.00 H new ATOM 0 HD3 LYS B 19 23.270 -10.253 -9.131 1.00 0.00 H new ATOM 0 HE2 LYS B 19 21.484 -12.429 -10.239 1.00 0.00 H new ATOM 0 HE3 LYS B 19 23.136 -12.546 -9.665 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 21.905 -13.520 -7.974 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 22.124 -11.943 -7.385 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 20.641 -12.391 -8.079 1.00 0.00 H new ATOM 1590 N SER B 20 18.515 -7.501 -9.715 1.00 0.00 N ATOM 1591 CA SER B 20 18.620 -6.025 -9.886 1.00 0.00 C ATOM 1592 C SER B 20 17.676 -5.326 -8.908 1.00 0.00 C ATOM 1593 O SER B 20 18.035 -4.359 -8.267 1.00 0.00 O ATOM 1594 CB SER B 20 18.240 -5.661 -11.322 1.00 0.00 C ATOM 1595 OG SER B 20 18.380 -4.258 -11.503 1.00 0.00 O ATOM 0 H SER B 20 18.185 -8.010 -10.535 1.00 0.00 H new ATOM 0 HA SER B 20 19.642 -5.703 -9.685 1.00 0.00 H new ATOM 0 HB2 SER B 20 18.878 -6.196 -12.026 1.00 0.00 H new ATOM 0 HB3 SER B 20 17.214 -5.965 -11.527 1.00 0.00 H new ATOM 0 HG SER B 20 18.139 -4.021 -12.423 1.00 0.00 H new ATOM 1601 N VAL B 21 16.473 -5.814 -8.785 1.00 0.00 N ATOM 1602 CA VAL B 21 15.500 -5.188 -7.848 1.00 0.00 C ATOM 1603 C VAL B 21 16.002 -5.346 -6.412 1.00 0.00 C ATOM 1604 O VAL B 21 15.937 -4.432 -5.613 1.00 0.00 O ATOM 1605 CB VAL B 21 14.144 -5.880 -7.991 1.00 0.00 C ATOM 1606 CG1 VAL B 21 13.174 -5.329 -6.943 1.00 0.00 C ATOM 1607 CG2 VAL B 21 13.583 -5.624 -9.392 1.00 0.00 C ATOM 0 H VAL B 21 16.121 -6.623 -9.296 1.00 0.00 H new ATOM 0 HA VAL B 21 15.397 -4.129 -8.082 1.00 0.00 H new ATOM 0 HB VAL B 21 14.268 -6.952 -7.841 1.00 0.00 H new ATOM 0 HG11 VAL B 21 12.208 -5.823 -7.046 1.00 0.00 H new ATOM 0 HG12 VAL B 21 13.572 -5.515 -5.945 1.00 0.00 H new ATOM 0 HG13 VAL B 21 13.050 -4.256 -7.090 1.00 0.00 H new ATOM 0 HG21 VAL B 21 12.616 -6.118 -9.493 1.00 0.00 H new ATOM 0 HG22 VAL B 21 13.460 -4.552 -9.544 1.00 0.00 H new ATOM 0 HG23 VAL B 21 14.272 -6.020 -10.138 1.00 0.00 H new ATOM 1617 N ALA B 22 16.488 -6.508 -6.076 1.00 0.00 N ATOM 1618 CA ALA B 22 16.979 -6.746 -4.689 1.00 0.00 C ATOM 1619 C ALA B 22 18.105 -5.768 -4.348 1.00 0.00 C ATOM 1620 O ALA B 22 18.140 -5.210 -3.270 1.00 0.00 O ATOM 1621 CB ALA B 22 17.499 -8.182 -4.586 1.00 0.00 C ATOM 0 H ALA B 22 16.567 -7.307 -6.705 1.00 0.00 H new ATOM 0 HA ALA B 22 16.160 -6.593 -3.986 1.00 0.00 H new ATOM 0 HB1 ALA B 22 17.861 -8.366 -3.574 1.00 0.00 H new ATOM 0 HB2 ALA B 22 16.692 -8.878 -4.815 1.00 0.00 H new ATOM 0 HB3 ALA B 22 18.315 -8.325 -5.295 1.00 0.00 H new ATOM 1627 N GLU B 23 19.026 -5.550 -5.246 1.00 0.00 N ATOM 1628 CA GLU B 23 20.138 -4.604 -4.940 1.00 0.00 C ATOM 1629 C GLU B 23 19.586 -3.184 -4.789 1.00 0.00 C ATOM 1630 O GLU B 23 19.998 -2.440 -3.923 1.00 0.00 O ATOM 1631 CB GLU B 23 21.182 -4.632 -6.064 1.00 0.00 C ATOM 1632 CG GLU B 23 21.985 -5.937 -6.002 1.00 0.00 C ATOM 1633 CD GLU B 23 23.204 -5.820 -6.920 1.00 0.00 C ATOM 1634 OE1 GLU B 23 23.390 -4.756 -7.488 1.00 0.00 O ATOM 1635 OE2 GLU B 23 23.935 -6.790 -7.032 1.00 0.00 O ATOM 0 H GLU B 23 19.058 -5.981 -6.170 1.00 0.00 H new ATOM 0 HA GLU B 23 20.611 -4.910 -4.007 1.00 0.00 H new ATOM 0 HB2 GLU B 23 20.689 -4.545 -7.032 1.00 0.00 H new ATOM 0 HB3 GLU B 23 21.853 -3.778 -5.970 1.00 0.00 H new ATOM 0 HG2 GLU B 23 22.303 -6.134 -4.978 1.00 0.00 H new ATOM 0 HG3 GLU B 23 21.362 -6.777 -6.310 1.00 0.00 H new ATOM 1642 N GLU B 24 18.656 -2.801 -5.620 1.00 0.00 N ATOM 1643 CA GLU B 24 18.078 -1.429 -5.517 1.00 0.00 C ATOM 1644 C GLU B 24 17.288 -1.312 -4.211 1.00 0.00 C ATOM 1645 O GLU B 24 17.544 -0.452 -3.392 1.00 0.00 O ATOM 1646 CB GLU B 24 17.143 -1.198 -6.724 1.00 0.00 C ATOM 1647 CG GLU B 24 17.929 -0.598 -7.912 1.00 0.00 C ATOM 1648 CD GLU B 24 17.951 0.936 -7.829 1.00 0.00 C ATOM 1649 OE1 GLU B 24 17.238 1.488 -7.006 1.00 0.00 O ATOM 1650 OE2 GLU B 24 18.687 1.536 -8.597 1.00 0.00 O ATOM 0 H GLU B 24 18.270 -3.379 -6.367 1.00 0.00 H new ATOM 0 HA GLU B 24 18.871 -0.681 -5.520 1.00 0.00 H new ATOM 0 HB2 GLU B 24 16.685 -2.141 -7.023 1.00 0.00 H new ATOM 0 HB3 GLU B 24 16.333 -0.526 -6.440 1.00 0.00 H new ATOM 0 HG2 GLU B 24 18.949 -0.982 -7.911 1.00 0.00 H new ATOM 0 HG3 GLU B 24 17.472 -0.910 -8.851 1.00 0.00 H new ATOM 1657 N MET B 25 16.333 -2.175 -4.013 1.00 0.00 N ATOM 1658 CA MET B 25 15.526 -2.127 -2.765 1.00 0.00 C ATOM 1659 C MET B 25 16.417 -2.466 -1.571 1.00 0.00 C ATOM 1660 O MET B 25 16.289 -1.892 -0.508 1.00 0.00 O ATOM 1661 CB MET B 25 14.382 -3.134 -2.868 1.00 0.00 C ATOM 1662 CG MET B 25 13.315 -2.592 -3.821 1.00 0.00 C ATOM 1663 SD MET B 25 11.991 -3.813 -4.008 1.00 0.00 S ATOM 1664 CE MET B 25 11.056 -3.370 -2.523 1.00 0.00 C ATOM 0 H MET B 25 16.076 -2.915 -4.666 1.00 0.00 H new ATOM 0 HA MET B 25 15.113 -1.127 -2.628 1.00 0.00 H new ATOM 0 HB2 MET B 25 14.757 -4.091 -3.230 1.00 0.00 H new ATOM 0 HB3 MET B 25 13.950 -3.312 -1.883 1.00 0.00 H new ATOM 0 HG2 MET B 25 12.909 -1.657 -3.435 1.00 0.00 H new ATOM 0 HG3 MET B 25 13.759 -2.370 -4.792 1.00 0.00 H new ATOM 0 HE1 MET B 25 10.143 -3.963 -2.478 1.00 0.00 H new ATOM 0 HE2 MET B 25 11.662 -3.569 -1.639 1.00 0.00 H new ATOM 0 HE3 MET B 25 10.800 -2.311 -2.557 1.00 0.00 H new ATOM 1674 N GLY B 26 17.317 -3.403 -1.733 1.00 0.00 N ATOM 1675 CA GLY B 26 18.215 -3.786 -0.602 1.00 0.00 C ATOM 1676 C GLY B 26 17.574 -4.931 0.186 1.00 0.00 C ATOM 1677 O GLY B 26 17.675 -4.988 1.395 1.00 0.00 O ATOM 0 H GLY B 26 17.468 -3.919 -2.600 1.00 0.00 H new ATOM 0 HA2 GLY B 26 19.189 -4.092 -0.983 1.00 0.00 H new ATOM 0 HA3 GLY B 26 18.383 -2.929 0.051 1.00 0.00 H new ATOM 1681 N ILE B 27 16.909 -5.840 -0.490 1.00 0.00 N ATOM 1682 CA ILE B 27 16.245 -6.992 0.209 1.00 0.00 C ATOM 1683 C ILE B 27 16.704 -8.317 -0.405 1.00 0.00 C ATOM 1684 O ILE B 27 17.315 -8.354 -1.454 1.00 0.00 O ATOM 1685 CB ILE B 27 14.725 -6.866 0.081 1.00 0.00 C ATOM 1686 CG1 ILE B 27 14.319 -6.834 -1.399 1.00 0.00 C ATOM 1687 CG2 ILE B 27 14.266 -5.575 0.761 1.00 0.00 C ATOM 1688 CD1 ILE B 27 12.795 -6.882 -1.517 1.00 0.00 C ATOM 0 H ILE B 27 16.796 -5.834 -1.504 1.00 0.00 H new ATOM 0 HA ILE B 27 16.524 -6.974 1.263 1.00 0.00 H new ATOM 0 HB ILE B 27 14.255 -7.725 0.560 1.00 0.00 H new ATOM 0 HG12 ILE B 27 14.702 -5.929 -1.871 1.00 0.00 H new ATOM 0 HG13 ILE B 27 14.761 -7.680 -1.926 1.00 0.00 H new ATOM 0 HG21 ILE B 27 13.184 -5.482 0.672 1.00 0.00 H new ATOM 0 HG22 ILE B 27 14.542 -5.601 1.815 1.00 0.00 H new ATOM 0 HG23 ILE B 27 14.744 -4.721 0.281 1.00 0.00 H new ATOM 0 HD11 ILE B 27 12.511 -6.859 -2.569 1.00 0.00 H new ATOM 0 HD12 ILE B 27 12.423 -7.799 -1.061 1.00 0.00 H new ATOM 0 HD13 ILE B 27 12.363 -6.022 -1.006 1.00 0.00 H new ATOM 1700 N SER B 28 16.416 -9.404 0.251 1.00 0.00 N ATOM 1701 CA SER B 28 16.834 -10.735 -0.272 1.00 0.00 C ATOM 1702 C SER B 28 15.970 -11.129 -1.472 1.00 0.00 C ATOM 1703 O SER B 28 14.902 -10.593 -1.689 1.00 0.00 O ATOM 1704 CB SER B 28 16.668 -11.774 0.834 1.00 0.00 C ATOM 1705 OG SER B 28 15.285 -11.929 1.125 1.00 0.00 O ATOM 0 H SER B 28 15.905 -9.429 1.134 1.00 0.00 H new ATOM 0 HA SER B 28 17.875 -10.686 -0.590 1.00 0.00 H new ATOM 0 HB2 SER B 28 17.095 -12.727 0.522 1.00 0.00 H new ATOM 0 HB3 SER B 28 17.207 -11.461 1.728 1.00 0.00 H new ATOM 0 HG SER B 28 15.173 -12.597 1.834 1.00 0.00 H new ATOM 1711 N ARG B 29 16.435 -12.068 -2.248 1.00 0.00 N ATOM 1712 CA ARG B 29 15.667 -12.521 -3.443 1.00 0.00 C ATOM 1713 C ARG B 29 14.361 -13.177 -2.982 1.00 0.00 C ATOM 1714 O ARG B 29 13.316 -12.996 -3.574 1.00 0.00 O ATOM 1715 CB ARG B 29 16.507 -13.549 -4.204 1.00 0.00 C ATOM 1716 CG ARG B 29 17.804 -12.893 -4.697 1.00 0.00 C ATOM 1717 CD ARG B 29 18.662 -13.925 -5.445 1.00 0.00 C ATOM 1718 NE ARG B 29 20.101 -13.547 -5.337 1.00 0.00 N ATOM 1719 CZ ARG B 29 20.745 -13.756 -4.221 1.00 0.00 C ATOM 1720 NH1 ARG B 29 20.120 -14.266 -3.193 1.00 0.00 N ATOM 1721 NH2 ARG B 29 22.013 -13.456 -4.129 1.00 0.00 N ATOM 0 H ARG B 29 17.324 -12.547 -2.104 1.00 0.00 H new ATOM 0 HA ARG B 29 15.441 -11.672 -4.088 1.00 0.00 H new ATOM 0 HB2 ARG B 29 16.739 -14.395 -3.557 1.00 0.00 H new ATOM 0 HB3 ARG B 29 15.942 -13.941 -5.050 1.00 0.00 H new ATOM 0 HG2 ARG B 29 17.571 -12.056 -5.355 1.00 0.00 H new ATOM 0 HG3 ARG B 29 18.361 -12.488 -3.852 1.00 0.00 H new ATOM 0 HD2 ARG B 29 18.503 -14.918 -5.025 1.00 0.00 H new ATOM 0 HD3 ARG B 29 18.364 -13.970 -6.493 1.00 0.00 H new ATOM 0 HE ARG B 29 20.580 -13.126 -6.133 1.00 0.00 H new ATOM 0 HH11 ARG B 29 19.130 -14.500 -3.263 1.00 0.00 H new ATOM 0 HH12 ARG B 29 20.622 -14.430 -2.321 1.00 0.00 H new ATOM 0 HH21 ARG B 29 22.502 -13.057 -4.930 1.00 0.00 H new ATOM 0 HH22 ARG B 29 22.514 -13.620 -3.256 1.00 0.00 H new ATOM 1735 N GLN B 30 14.421 -13.940 -1.921 1.00 0.00 N ATOM 1736 CA GLN B 30 13.195 -14.615 -1.407 1.00 0.00 C ATOM 1737 C GLN B 30 12.203 -13.561 -0.924 1.00 0.00 C ATOM 1738 O GLN B 30 11.007 -13.691 -1.099 1.00 0.00 O ATOM 1739 CB GLN B 30 13.572 -15.533 -0.242 1.00 0.00 C ATOM 1740 CG GLN B 30 12.328 -16.278 0.243 1.00 0.00 C ATOM 1741 CD GLN B 30 12.723 -17.267 1.340 1.00 0.00 C ATOM 1742 OE1 GLN B 30 13.882 -17.601 1.487 1.00 0.00 O ATOM 1743 NE2 GLN B 30 11.800 -17.756 2.124 1.00 0.00 N ATOM 0 H GLN B 30 15.271 -14.124 -1.387 1.00 0.00 H new ATOM 0 HA GLN B 30 12.741 -15.205 -2.203 1.00 0.00 H new ATOM 0 HB2 GLN B 30 14.335 -16.244 -0.558 1.00 0.00 H new ATOM 0 HB3 GLN B 30 13.999 -14.948 0.572 1.00 0.00 H new ATOM 0 HG2 GLN B 30 11.592 -15.570 0.624 1.00 0.00 H new ATOM 0 HG3 GLN B 30 11.861 -16.807 -0.588 1.00 0.00 H new ATOM 0 HE21 GLN B 30 10.827 -17.477 2.002 1.00 0.00 H new ATOM 0 HE22 GLN B 30 12.053 -18.417 2.858 1.00 0.00 H new ATOM 1752 N GLN B 31 12.691 -12.517 -0.315 1.00 0.00 N ATOM 1753 CA GLN B 31 11.783 -11.452 0.186 1.00 0.00 C ATOM 1754 C GLN B 31 11.045 -10.829 -0.999 1.00 0.00 C ATOM 1755 O GLN B 31 9.875 -10.513 -0.920 1.00 0.00 O ATOM 1756 CB GLN B 31 12.615 -10.380 0.896 1.00 0.00 C ATOM 1757 CG GLN B 31 11.694 -9.337 1.534 1.00 0.00 C ATOM 1758 CD GLN B 31 10.876 -9.991 2.652 1.00 0.00 C ATOM 1759 OE1 GLN B 31 11.389 -10.796 3.405 1.00 0.00 O ATOM 1760 NE2 GLN B 31 9.617 -9.678 2.792 1.00 0.00 N ATOM 0 H GLN B 31 13.683 -12.356 -0.143 1.00 0.00 H new ATOM 0 HA GLN B 31 11.060 -11.873 0.885 1.00 0.00 H new ATOM 0 HB2 GLN B 31 13.240 -10.841 1.661 1.00 0.00 H new ATOM 0 HB3 GLN B 31 13.285 -9.898 0.184 1.00 0.00 H new ATOM 0 HG2 GLN B 31 12.284 -8.513 1.935 1.00 0.00 H new ATOM 0 HG3 GLN B 31 11.028 -8.915 0.781 1.00 0.00 H new ATOM 0 HE21 GLN B 31 9.186 -9.003 2.161 1.00 0.00 H new ATOM 0 HE22 GLN B 31 9.064 -10.109 3.533 1.00 0.00 H new ATOM 1769 N LEU B 32 11.721 -10.653 -2.099 1.00 0.00 N ATOM 1770 CA LEU B 32 11.062 -10.051 -3.290 1.00 0.00 C ATOM 1771 C LEU B 32 9.921 -10.957 -3.751 1.00 0.00 C ATOM 1772 O LEU B 32 8.849 -10.497 -4.092 1.00 0.00 O ATOM 1773 CB LEU B 32 12.092 -9.908 -4.412 1.00 0.00 C ATOM 1774 CG LEU B 32 11.445 -9.292 -5.658 1.00 0.00 C ATOM 1775 CD1 LEU B 32 10.912 -7.882 -5.345 1.00 0.00 C ATOM 1776 CD2 LEU B 32 12.497 -9.218 -6.764 1.00 0.00 C ATOM 0 H LEU B 32 12.703 -10.900 -2.225 1.00 0.00 H new ATOM 0 HA LEU B 32 10.661 -9.070 -3.035 1.00 0.00 H new ATOM 0 HB2 LEU B 32 12.919 -9.282 -4.077 1.00 0.00 H new ATOM 0 HB3 LEU B 32 12.510 -10.884 -4.657 1.00 0.00 H new ATOM 0 HG LEU B 32 10.606 -9.910 -5.979 1.00 0.00 H new ATOM 0 HD11 LEU B 32 10.456 -7.459 -6.240 1.00 0.00 H new ATOM 0 HD12 LEU B 32 10.167 -7.942 -4.552 1.00 0.00 H new ATOM 0 HD13 LEU B 32 11.735 -7.245 -5.022 1.00 0.00 H new ATOM 0 HD21 LEU B 32 12.054 -8.782 -7.659 1.00 0.00 H new ATOM 0 HD22 LEU B 32 13.330 -8.598 -6.433 1.00 0.00 H new ATOM 0 HD23 LEU B 32 12.858 -10.221 -6.990 1.00 0.00 H new ATOM 1788 N CYS B 33 10.141 -12.241 -3.762 1.00 0.00 N ATOM 1789 CA CYS B 33 9.072 -13.177 -4.207 1.00 0.00 C ATOM 1790 C CYS B 33 7.853 -13.033 -3.293 1.00 0.00 C ATOM 1791 O CYS B 33 6.723 -13.106 -3.733 1.00 0.00 O ATOM 1792 CB CYS B 33 9.608 -14.608 -4.137 1.00 0.00 C ATOM 1793 SG CYS B 33 10.927 -14.815 -5.360 1.00 0.00 S ATOM 0 H CYS B 33 11.016 -12.684 -3.482 1.00 0.00 H new ATOM 0 HA CYS B 33 8.777 -12.946 -5.230 1.00 0.00 H new ATOM 0 HB2 CYS B 33 9.988 -14.818 -3.137 1.00 0.00 H new ATOM 0 HB3 CYS B 33 8.804 -15.319 -4.328 1.00 0.00 H new ATOM 0 HG CYS B 33 12.000 -14.209 -4.947 1.00 0.00 H new ATOM 1799 N ASN B 34 8.075 -12.824 -2.026 1.00 0.00 N ATOM 1800 CA ASN B 34 6.936 -12.671 -1.077 1.00 0.00 C ATOM 1801 C ASN B 34 6.141 -11.410 -1.430 1.00 0.00 C ATOM 1802 O ASN B 34 4.931 -11.379 -1.324 1.00 0.00 O ATOM 1803 CB ASN B 34 7.489 -12.562 0.349 1.00 0.00 C ATOM 1804 CG ASN B 34 6.400 -12.924 1.359 1.00 0.00 C ATOM 1805 OD1 ASN B 34 5.224 -12.833 1.067 1.00 0.00 O ATOM 1806 ND2 ASN B 34 6.747 -13.342 2.547 1.00 0.00 N ATOM 0 H ASN B 34 9.001 -12.752 -1.604 1.00 0.00 H new ATOM 0 HA ASN B 34 6.275 -13.535 -1.146 1.00 0.00 H new ATOM 0 HB2 ASN B 34 8.344 -13.228 0.469 1.00 0.00 H new ATOM 0 HB3 ASN B 34 7.846 -11.549 0.533 1.00 0.00 H new ATOM 0 HD21 ASN B 34 6.031 -13.592 3.229 1.00 0.00 H new ATOM 0 HD22 ASN B 34 7.734 -13.419 2.793 1.00 0.00 H new ATOM 1813 N ILE B 35 6.810 -10.370 -1.849 1.00 0.00 N ATOM 1814 CA ILE B 35 6.091 -9.113 -2.204 1.00 0.00 C ATOM 1815 C ILE B 35 5.141 -9.396 -3.368 1.00 0.00 C ATOM 1816 O ILE B 35 4.011 -8.952 -3.385 1.00 0.00 O ATOM 1817 CB ILE B 35 7.109 -8.046 -2.626 1.00 0.00 C ATOM 1818 CG1 ILE B 35 7.948 -7.639 -1.409 1.00 0.00 C ATOM 1819 CG2 ILE B 35 6.374 -6.820 -3.182 1.00 0.00 C ATOM 1820 CD1 ILE B 35 9.088 -6.714 -1.846 1.00 0.00 C ATOM 0 H ILE B 35 7.823 -10.337 -1.961 1.00 0.00 H new ATOM 0 HA ILE B 35 5.526 -8.755 -1.344 1.00 0.00 H new ATOM 0 HB ILE B 35 7.762 -8.450 -3.400 1.00 0.00 H new ATOM 0 HG12 ILE B 35 7.319 -7.134 -0.676 1.00 0.00 H new ATOM 0 HG13 ILE B 35 8.354 -8.526 -0.923 1.00 0.00 H new ATOM 0 HG21 ILE B 35 7.101 -6.065 -3.481 1.00 0.00 H new ATOM 0 HG22 ILE B 35 5.780 -7.114 -4.047 1.00 0.00 H new ATOM 0 HG23 ILE B 35 5.719 -6.409 -2.414 1.00 0.00 H new ATOM 0 HD11 ILE B 35 9.679 -6.429 -0.976 1.00 0.00 H new ATOM 0 HD12 ILE B 35 9.724 -7.234 -2.563 1.00 0.00 H new ATOM 0 HD13 ILE B 35 8.673 -5.820 -2.311 1.00 0.00 H new ATOM 1832 N GLU B 36 5.598 -10.131 -4.339 1.00 0.00 N ATOM 1833 CA GLU B 36 4.740 -10.447 -5.513 1.00 0.00 C ATOM 1834 C GLU B 36 3.559 -11.303 -5.058 1.00 0.00 C ATOM 1835 O GLU B 36 2.455 -11.177 -5.553 1.00 0.00 O ATOM 1836 CB GLU B 36 5.567 -11.242 -6.521 1.00 0.00 C ATOM 1837 CG GLU B 36 6.836 -10.462 -6.867 1.00 0.00 C ATOM 1838 CD GLU B 36 7.738 -11.330 -7.744 1.00 0.00 C ATOM 1839 OE1 GLU B 36 7.246 -12.317 -8.267 1.00 0.00 O ATOM 1840 OE2 GLU B 36 8.908 -11.009 -7.858 1.00 0.00 O ATOM 0 H GLU B 36 6.536 -10.530 -4.371 1.00 0.00 H new ATOM 0 HA GLU B 36 4.374 -9.526 -5.966 1.00 0.00 H new ATOM 0 HB2 GLU B 36 5.828 -12.216 -6.106 1.00 0.00 H new ATOM 0 HB3 GLU B 36 4.983 -11.425 -7.423 1.00 0.00 H new ATOM 0 HG2 GLU B 36 6.579 -9.540 -7.389 1.00 0.00 H new ATOM 0 HG3 GLU B 36 7.361 -10.176 -5.956 1.00 0.00 H new ATOM 1847 N GLN B 37 3.787 -12.176 -4.119 1.00 0.00 N ATOM 1848 CA GLN B 37 2.693 -13.054 -3.624 1.00 0.00 C ATOM 1849 C GLN B 37 1.754 -12.226 -2.748 1.00 0.00 C ATOM 1850 O GLN B 37 1.242 -12.692 -1.750 1.00 0.00 O ATOM 1851 CB GLN B 37 3.309 -14.189 -2.796 1.00 0.00 C ATOM 1852 CG GLN B 37 2.318 -15.347 -2.666 1.00 0.00 C ATOM 1853 CD GLN B 37 2.157 -16.032 -4.028 1.00 0.00 C ATOM 1854 OE1 GLN B 37 3.123 -16.221 -4.740 1.00 0.00 O ATOM 1855 NE2 GLN B 37 0.974 -16.416 -4.421 1.00 0.00 N ATOM 0 H GLN B 37 4.691 -12.320 -3.670 1.00 0.00 H new ATOM 0 HA GLN B 37 2.133 -13.474 -4.460 1.00 0.00 H new ATOM 0 HB2 GLN B 37 4.227 -14.538 -3.270 1.00 0.00 H new ATOM 0 HB3 GLN B 37 3.581 -13.821 -1.807 1.00 0.00 H new ATOM 0 HG2 GLN B 37 2.674 -16.064 -1.926 1.00 0.00 H new ATOM 0 HG3 GLN B 37 1.354 -14.978 -2.315 1.00 0.00 H new ATOM 0 HE21 GLN B 37 0.162 -16.258 -3.824 1.00 0.00 H new ATOM 0 HE22 GLN B 37 0.861 -16.874 -5.325 1.00 0.00 H new ATOM 1864 N SER B 38 1.535 -10.994 -3.109 1.00 0.00 N ATOM 1865 CA SER B 38 0.640 -10.124 -2.293 1.00 0.00 C ATOM 1866 C SER B 38 -0.808 -10.597 -2.434 1.00 0.00 C ATOM 1867 O SER B 38 -1.477 -10.302 -3.402 1.00 0.00 O ATOM 1868 CB SER B 38 0.756 -8.682 -2.785 1.00 0.00 C ATOM 1869 OG SER B 38 -0.098 -7.852 -2.011 1.00 0.00 O ATOM 0 H SER B 38 1.937 -10.550 -3.935 1.00 0.00 H new ATOM 0 HA SER B 38 0.935 -10.180 -1.245 1.00 0.00 H new ATOM 0 HB2 SER B 38 1.787 -8.339 -2.703 1.00 0.00 H new ATOM 0 HB3 SER B 38 0.483 -8.622 -3.839 1.00 0.00 H new ATOM 0 HG SER B 38 -0.025 -6.926 -2.323 1.00 0.00 H new ATOM 1875 N GLU B 39 -1.298 -11.325 -1.472 1.00 0.00 N ATOM 1876 CA GLU B 39 -2.700 -11.813 -1.549 1.00 0.00 C ATOM 1877 C GLU B 39 -3.646 -10.614 -1.443 1.00 0.00 C ATOM 1878 O GLU B 39 -3.906 -10.107 -0.372 1.00 0.00 O ATOM 1879 CB GLU B 39 -2.954 -12.789 -0.396 1.00 0.00 C ATOM 1880 CG GLU B 39 -2.002 -13.984 -0.527 1.00 0.00 C ATOM 1881 CD GLU B 39 -2.307 -14.754 -1.813 1.00 0.00 C ATOM 1882 OE1 GLU B 39 -3.430 -15.214 -1.956 1.00 0.00 O ATOM 1883 OE2 GLU B 39 -1.418 -14.860 -2.643 1.00 0.00 O ATOM 0 H GLU B 39 -0.787 -11.603 -0.634 1.00 0.00 H new ATOM 0 HA GLU B 39 -2.873 -12.326 -2.495 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -2.799 -12.289 0.560 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -3.989 -13.130 -0.414 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -0.969 -13.637 -0.537 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -2.109 -14.642 0.335 1.00 0.00 H new ATOM 1890 N THR B 40 -4.144 -10.159 -2.562 1.00 0.00 N ATOM 1891 CA THR B 40 -5.070 -8.983 -2.580 1.00 0.00 C ATOM 1892 C THR B 40 -4.359 -7.764 -1.983 1.00 0.00 C ATOM 1893 O THR B 40 -3.569 -7.879 -1.067 1.00 0.00 O ATOM 1894 CB THR B 40 -6.343 -9.301 -1.785 1.00 0.00 C ATOM 1895 OG1 THR B 40 -6.967 -10.448 -2.348 1.00 0.00 O ATOM 1896 CG2 THR B 40 -7.309 -8.116 -1.866 1.00 0.00 C ATOM 0 H THR B 40 -3.946 -10.557 -3.480 1.00 0.00 H new ATOM 0 HA THR B 40 -5.353 -8.762 -3.609 1.00 0.00 H new ATOM 0 HB THR B 40 -6.084 -9.489 -0.743 1.00 0.00 H new ATOM 0 HG1 THR B 40 -7.781 -10.658 -1.844 1.00 0.00 H new ATOM 0 HG21 THR B 40 -8.213 -8.344 -1.301 1.00 0.00 H new ATOM 0 HG22 THR B 40 -6.833 -7.229 -1.447 1.00 0.00 H new ATOM 0 HG23 THR B 40 -7.570 -7.930 -2.908 1.00 0.00 H new ATOM 1904 N ALA B 41 -4.616 -6.597 -2.517 1.00 0.00 N ATOM 1905 CA ALA B 41 -3.934 -5.371 -2.006 1.00 0.00 C ATOM 1906 C ALA B 41 -4.458 -5.011 -0.602 1.00 0.00 C ATOM 1907 O ALA B 41 -5.633 -5.152 -0.328 1.00 0.00 O ATOM 1908 CB ALA B 41 -4.219 -4.210 -2.961 1.00 0.00 C ATOM 0 H ALA B 41 -5.269 -6.441 -3.285 1.00 0.00 H new ATOM 0 HA ALA B 41 -2.862 -5.558 -1.946 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -3.725 -3.309 -2.596 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -3.841 -4.454 -3.954 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -5.294 -4.038 -3.014 1.00 0.00 H new ATOM 1914 N PRO B 42 -3.599 -4.535 0.283 1.00 0.00 N ATOM 1915 CA PRO B 42 -4.003 -4.143 1.671 1.00 0.00 C ATOM 1916 C PRO B 42 -4.807 -2.834 1.714 1.00 0.00 C ATOM 1917 O PRO B 42 -4.782 -2.043 0.793 1.00 0.00 O ATOM 1918 CB PRO B 42 -2.664 -3.991 2.405 1.00 0.00 C ATOM 1919 CG PRO B 42 -1.689 -3.604 1.341 1.00 0.00 C ATOM 1920 CD PRO B 42 -2.150 -4.318 0.069 1.00 0.00 C ATOM 0 HA PRO B 42 -4.666 -4.881 2.121 1.00 0.00 H new ATOM 0 HB2 PRO B 42 -2.723 -3.230 3.183 1.00 0.00 H new ATOM 0 HB3 PRO B 42 -2.371 -4.922 2.891 1.00 0.00 H new ATOM 0 HG2 PRO B 42 -1.675 -2.523 1.199 1.00 0.00 H new ATOM 0 HG3 PRO B 42 -0.676 -3.903 1.612 1.00 0.00 H new ATOM 0 HD2 PRO B 42 -1.964 -3.712 -0.818 1.00 0.00 H new ATOM 0 HD3 PRO B 42 -1.622 -5.261 -0.073 1.00 0.00 H new ATOM 1928 N VAL B 43 -5.513 -2.604 2.790 1.00 0.00 N ATOM 1929 CA VAL B 43 -6.320 -1.356 2.919 1.00 0.00 C ATOM 1930 C VAL B 43 -5.395 -0.138 2.839 1.00 0.00 C ATOM 1931 O VAL B 43 -5.826 0.962 2.555 1.00 0.00 O ATOM 1932 CB VAL B 43 -7.055 -1.371 4.264 1.00 0.00 C ATOM 1933 CG1 VAL B 43 -8.072 -2.514 4.276 1.00 0.00 C ATOM 1934 CG2 VAL B 43 -6.049 -1.589 5.395 1.00 0.00 C ATOM 0 H VAL B 43 -5.565 -3.233 3.591 1.00 0.00 H new ATOM 0 HA VAL B 43 -7.049 -1.300 2.110 1.00 0.00 H new ATOM 0 HB VAL B 43 -7.566 -0.419 4.405 1.00 0.00 H new ATOM 0 HG11 VAL B 43 -8.595 -2.525 5.232 1.00 0.00 H new ATOM 0 HG12 VAL B 43 -8.792 -2.369 3.470 1.00 0.00 H new ATOM 0 HG13 VAL B 43 -7.555 -3.463 4.134 1.00 0.00 H new ATOM 0 HG21 VAL B 43 -6.573 -1.599 6.351 1.00 0.00 H new ATOM 0 HG22 VAL B 43 -5.539 -2.542 5.250 1.00 0.00 H new ATOM 0 HG23 VAL B 43 -5.317 -0.782 5.391 1.00 0.00 H new ATOM 1944 N VAL B 44 -4.130 -0.327 3.088 1.00 0.00 N ATOM 1945 CA VAL B 44 -3.170 0.812 3.028 1.00 0.00 C ATOM 1946 C VAL B 44 -3.155 1.388 1.608 1.00 0.00 C ATOM 1947 O VAL B 44 -3.208 2.588 1.408 1.00 0.00 O ATOM 1948 CB VAL B 44 -1.776 0.297 3.390 1.00 0.00 C ATOM 1949 CG1 VAL B 44 -0.746 1.409 3.194 1.00 0.00 C ATOM 1950 CG2 VAL B 44 -1.767 -0.159 4.851 1.00 0.00 C ATOM 0 H VAL B 44 -3.716 -1.227 3.332 1.00 0.00 H new ATOM 0 HA VAL B 44 -3.469 1.593 3.728 1.00 0.00 H new ATOM 0 HB VAL B 44 -1.522 -0.543 2.744 1.00 0.00 H new ATOM 0 HG11 VAL B 44 0.245 1.037 3.453 1.00 0.00 H new ATOM 0 HG12 VAL B 44 -0.752 1.731 2.153 1.00 0.00 H new ATOM 0 HG13 VAL B 44 -0.996 2.254 3.836 1.00 0.00 H new ATOM 0 HG21 VAL B 44 -0.774 -0.527 5.111 1.00 0.00 H new ATOM 0 HG22 VAL B 44 -2.023 0.681 5.496 1.00 0.00 H new ATOM 0 HG23 VAL B 44 -2.497 -0.957 4.988 1.00 0.00 H new ATOM 1960 N VAL B 45 -3.092 0.539 0.620 1.00 0.00 N ATOM 1961 CA VAL B 45 -3.081 1.021 -0.789 1.00 0.00 C ATOM 1962 C VAL B 45 -4.393 1.753 -1.075 1.00 0.00 C ATOM 1963 O VAL B 45 -4.414 2.801 -1.689 1.00 0.00 O ATOM 1964 CB VAL B 45 -2.940 -0.178 -1.731 1.00 0.00 C ATOM 1965 CG1 VAL B 45 -3.111 0.279 -3.181 1.00 0.00 C ATOM 1966 CG2 VAL B 45 -1.553 -0.801 -1.554 1.00 0.00 C ATOM 0 H VAL B 45 -3.047 -0.474 0.729 1.00 0.00 H new ATOM 0 HA VAL B 45 -2.244 1.701 -0.945 1.00 0.00 H new ATOM 0 HB VAL B 45 -3.707 -0.915 -1.494 1.00 0.00 H new ATOM 0 HG11 VAL B 45 -3.010 -0.578 -3.847 1.00 0.00 H new ATOM 0 HG12 VAL B 45 -4.098 0.723 -3.309 1.00 0.00 H new ATOM 0 HG13 VAL B 45 -2.347 1.018 -3.422 1.00 0.00 H new ATOM 0 HG21 VAL B 45 -1.450 -1.655 -2.223 1.00 0.00 H new ATOM 0 HG22 VAL B 45 -0.789 -0.060 -1.790 1.00 0.00 H new ATOM 0 HG23 VAL B 45 -1.432 -1.132 -0.523 1.00 0.00 H new ATOM 1976 N LYS B 46 -5.488 1.207 -0.628 1.00 0.00 N ATOM 1977 CA LYS B 46 -6.804 1.860 -0.866 1.00 0.00 C ATOM 1978 C LYS B 46 -6.806 3.249 -0.223 1.00 0.00 C ATOM 1979 O LYS B 46 -7.354 4.189 -0.761 1.00 0.00 O ATOM 1980 CB LYS B 46 -7.912 1.008 -0.242 1.00 0.00 C ATOM 1981 CG LYS B 46 -8.018 -0.323 -0.990 1.00 0.00 C ATOM 1982 CD LYS B 46 -9.125 -1.171 -0.362 1.00 0.00 C ATOM 1983 CE LYS B 46 -9.279 -2.483 -1.138 1.00 0.00 C ATOM 1984 NZ LYS B 46 -8.174 -3.412 -0.767 1.00 0.00 N ATOM 0 H LYS B 46 -5.528 0.332 -0.105 1.00 0.00 H new ATOM 0 HA LYS B 46 -6.977 1.955 -1.938 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -7.697 0.829 0.811 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -8.863 1.539 -0.288 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -8.234 -0.145 -2.043 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -7.068 -0.855 -0.945 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -8.887 -1.381 0.681 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -10.066 -0.621 -0.370 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -10.243 -2.940 -0.914 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -9.260 -2.288 -2.210 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -8.324 -4.332 -1.228 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -7.266 -3.013 -1.079 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -8.160 -3.540 0.265 1.00 0.00 H new ATOM 1998 N TYR B 47 -6.196 3.388 0.924 1.00 0.00 N ATOM 1999 CA TYR B 47 -6.167 4.719 1.594 1.00 0.00 C ATOM 2000 C TYR B 47 -5.501 5.730 0.661 1.00 0.00 C ATOM 2001 O TYR B 47 -5.965 6.846 0.499 1.00 0.00 O ATOM 2002 CB TYR B 47 -5.367 4.618 2.892 1.00 0.00 C ATOM 2003 CG TYR B 47 -5.301 5.980 3.536 1.00 0.00 C ATOM 2004 CD1 TYR B 47 -6.390 6.448 4.281 1.00 0.00 C ATOM 2005 CD2 TYR B 47 -4.160 6.776 3.387 1.00 0.00 C ATOM 2006 CE1 TYR B 47 -6.339 7.714 4.876 1.00 0.00 C ATOM 2007 CE2 TYR B 47 -4.108 8.041 3.983 1.00 0.00 C ATOM 2008 CZ TYR B 47 -5.197 8.510 4.728 1.00 0.00 C ATOM 2009 OH TYR B 47 -5.147 9.758 5.312 1.00 0.00 O ATOM 0 H TYR B 47 -5.718 2.639 1.424 1.00 0.00 H new ATOM 0 HA TYR B 47 -7.183 5.041 1.822 1.00 0.00 H new ATOM 0 HB2 TYR B 47 -5.836 3.904 3.569 1.00 0.00 H new ATOM 0 HB3 TYR B 47 -4.362 4.250 2.687 1.00 0.00 H new ATOM 0 HD1 TYR B 47 -7.270 5.832 4.397 1.00 0.00 H new ATOM 0 HD2 TYR B 47 -3.320 6.414 2.812 1.00 0.00 H new ATOM 0 HE1 TYR B 47 -7.180 8.076 5.449 1.00 0.00 H new ATOM 0 HE2 TYR B 47 -3.228 8.656 3.868 1.00 0.00 H new ATOM 0 HH TYR B 47 -4.284 10.178 5.113 1.00 0.00 H new ATOM 2019 N ILE B 48 -4.425 5.344 0.033 1.00 0.00 N ATOM 2020 CA ILE B 48 -3.739 6.278 -0.901 1.00 0.00 C ATOM 2021 C ILE B 48 -4.710 6.619 -2.026 1.00 0.00 C ATOM 2022 O ILE B 48 -4.830 7.756 -2.438 1.00 0.00 O ATOM 2023 CB ILE B 48 -2.493 5.605 -1.479 1.00 0.00 C ATOM 2024 CG1 ILE B 48 -1.465 5.405 -0.364 1.00 0.00 C ATOM 2025 CG2 ILE B 48 -1.892 6.493 -2.573 1.00 0.00 C ATOM 2026 CD1 ILE B 48 -0.337 4.503 -0.870 1.00 0.00 C ATOM 0 H ILE B 48 -3.993 4.425 0.126 1.00 0.00 H new ATOM 0 HA ILE B 48 -3.435 7.184 -0.377 1.00 0.00 H new ATOM 0 HB ILE B 48 -2.764 4.639 -1.906 1.00 0.00 H new ATOM 0 HG12 ILE B 48 -1.062 6.367 -0.048 1.00 0.00 H new ATOM 0 HG13 ILE B 48 -1.941 4.957 0.508 1.00 0.00 H new ATOM 0 HG21 ILE B 48 -1.004 6.013 -2.984 1.00 0.00 H new ATOM 0 HG22 ILE B 48 -2.625 6.640 -3.366 1.00 0.00 H new ATOM 0 HG23 ILE B 48 -1.618 7.459 -2.148 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.397 4.359 -0.077 1.00 0.00 H new ATOM 0 HD12 ILE B 48 -0.748 3.537 -1.164 1.00 0.00 H new ATOM 0 HD13 ILE B 48 0.144 4.970 -1.730 1.00 0.00 H new ATOM 2038 N ALA B 49 -5.415 5.639 -2.519 1.00 0.00 N ATOM 2039 CA ALA B 49 -6.388 5.900 -3.610 1.00 0.00 C ATOM 2040 C ALA B 49 -7.348 7.003 -3.169 1.00 0.00 C ATOM 2041 O ALA B 49 -7.764 7.822 -3.958 1.00 0.00 O ATOM 2042 CB ALA B 49 -7.176 4.622 -3.904 1.00 0.00 C ATOM 0 H ALA B 49 -5.357 4.668 -2.211 1.00 0.00 H new ATOM 0 HA ALA B 49 -5.859 6.213 -4.510 1.00 0.00 H new ATOM 0 HB1 ALA B 49 -7.891 4.811 -4.705 1.00 0.00 H new ATOM 0 HB2 ALA B 49 -6.489 3.833 -4.210 1.00 0.00 H new ATOM 0 HB3 ALA B 49 -7.710 4.310 -3.007 1.00 0.00 H new ATOM 2048 N PHE B 50 -7.697 7.039 -1.911 1.00 0.00 N ATOM 2049 CA PHE B 50 -8.620 8.106 -1.438 1.00 0.00 C ATOM 2050 C PHE B 50 -7.942 9.460 -1.656 1.00 0.00 C ATOM 2051 O PHE B 50 -8.522 10.379 -2.200 1.00 0.00 O ATOM 2052 CB PHE B 50 -8.909 7.895 0.053 1.00 0.00 C ATOM 2053 CG PHE B 50 -10.157 8.646 0.451 1.00 0.00 C ATOM 2054 CD1 PHE B 50 -10.074 9.976 0.880 1.00 0.00 C ATOM 2055 CD2 PHE B 50 -11.400 8.003 0.399 1.00 0.00 C ATOM 2056 CE1 PHE B 50 -11.236 10.663 1.257 1.00 0.00 C ATOM 2057 CE2 PHE B 50 -12.560 8.690 0.774 1.00 0.00 C ATOM 2058 CZ PHE B 50 -12.478 10.020 1.204 1.00 0.00 C ATOM 0 H PHE B 50 -7.385 6.381 -1.197 1.00 0.00 H new ATOM 0 HA PHE B 50 -9.560 8.073 -1.988 1.00 0.00 H new ATOM 0 HB2 PHE B 50 -9.033 6.832 0.260 1.00 0.00 H new ATOM 0 HB3 PHE B 50 -8.063 8.239 0.648 1.00 0.00 H new ATOM 0 HD1 PHE B 50 -9.116 10.472 0.920 1.00 0.00 H new ATOM 0 HD2 PHE B 50 -11.463 6.976 0.069 1.00 0.00 H new ATOM 0 HE1 PHE B 50 -11.173 11.689 1.589 1.00 0.00 H new ATOM 0 HE2 PHE B 50 -13.519 8.194 0.732 1.00 0.00 H new ATOM 0 HZ PHE B 50 -13.373 10.550 1.495 1.00 0.00 H new ATOM 2068 N LEU B 51 -6.706 9.581 -1.246 1.00 0.00 N ATOM 2069 CA LEU B 51 -5.971 10.867 -1.441 1.00 0.00 C ATOM 2070 C LEU B 51 -5.787 11.119 -2.943 1.00 0.00 C ATOM 2071 O LEU B 51 -5.949 12.222 -3.425 1.00 0.00 O ATOM 2072 CB LEU B 51 -4.593 10.767 -0.764 1.00 0.00 C ATOM 2073 CG LEU B 51 -4.705 11.042 0.746 1.00 0.00 C ATOM 2074 CD1 LEU B 51 -4.979 12.534 1.016 1.00 0.00 C ATOM 2075 CD2 LEU B 51 -5.830 10.195 1.346 1.00 0.00 C ATOM 0 H LEU B 51 -6.173 8.844 -0.784 1.00 0.00 H new ATOM 0 HA LEU B 51 -6.536 11.688 -1.000 1.00 0.00 H new ATOM 0 HB2 LEU B 51 -4.174 9.774 -0.927 1.00 0.00 H new ATOM 0 HB3 LEU B 51 -3.907 11.482 -1.218 1.00 0.00 H new ATOM 0 HG LEU B 51 -3.757 10.775 1.213 1.00 0.00 H new ATOM 0 HD11 LEU B 51 -5.054 12.702 2.090 1.00 0.00 H new ATOM 0 HD12 LEU B 51 -4.163 13.133 0.611 1.00 0.00 H new ATOM 0 HD13 LEU B 51 -5.914 12.825 0.538 1.00 0.00 H new ATOM 0 HD21 LEU B 51 -5.905 10.394 2.415 1.00 0.00 H new ATOM 0 HD22 LEU B 51 -6.774 10.449 0.863 1.00 0.00 H new ATOM 0 HD23 LEU B 51 -5.614 9.138 1.188 1.00 0.00 H new ATOM 2087 N ARG B 52 -5.443 10.099 -3.680 1.00 0.00 N ATOM 2088 CA ARG B 52 -5.234 10.259 -5.145 1.00 0.00 C ATOM 2089 C ARG B 52 -6.565 10.605 -5.811 1.00 0.00 C ATOM 2090 O ARG B 52 -6.629 11.400 -6.729 1.00 0.00 O ATOM 2091 CB ARG B 52 -4.699 8.947 -5.716 1.00 0.00 C ATOM 2092 CG ARG B 52 -4.308 9.133 -7.186 1.00 0.00 C ATOM 2093 CD ARG B 52 -3.127 10.110 -7.311 1.00 0.00 C ATOM 2094 NE ARG B 52 -2.325 9.752 -8.514 1.00 0.00 N ATOM 2095 CZ ARG B 52 -1.497 10.616 -9.026 1.00 0.00 C ATOM 2096 NH1 ARG B 52 -1.374 11.796 -8.482 1.00 0.00 N ATOM 2097 NH2 ARG B 52 -0.793 10.304 -10.080 1.00 0.00 N ATOM 0 H ARG B 52 -5.297 9.154 -3.326 1.00 0.00 H new ATOM 0 HA ARG B 52 -4.519 11.059 -5.334 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -3.834 8.617 -5.141 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -5.456 8.168 -5.629 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -4.039 8.171 -7.621 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -5.161 9.510 -7.750 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -3.493 11.134 -7.393 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -2.505 10.065 -6.417 1.00 0.00 H new ATOM 0 HE ARG B 52 -2.425 8.829 -8.937 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -1.926 12.038 -7.659 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -0.726 12.476 -8.880 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -0.891 9.382 -10.504 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -0.145 10.983 -10.480 1.00 0.00 H new ATOM 2111 N SER B 53 -7.626 9.999 -5.359 1.00 0.00 N ATOM 2112 CA SER B 53 -8.966 10.264 -5.953 1.00 0.00 C ATOM 2113 C SER B 53 -9.265 11.759 -5.909 1.00 0.00 C ATOM 2114 O SER B 53 -9.910 12.298 -6.787 1.00 0.00 O ATOM 2115 CB SER B 53 -10.025 9.506 -5.155 1.00 0.00 C ATOM 2116 OG SER B 53 -9.858 8.111 -5.367 1.00 0.00 O ATOM 0 H SER B 53 -7.622 9.324 -4.595 1.00 0.00 H new ATOM 0 HA SER B 53 -8.977 9.930 -6.990 1.00 0.00 H new ATOM 0 HB2 SER B 53 -9.934 9.738 -4.094 1.00 0.00 H new ATOM 0 HB3 SER B 53 -11.023 9.816 -5.465 1.00 0.00 H new ATOM 0 HG SER B 53 -9.289 7.739 -4.662 1.00 0.00 H new ATOM 2122 N LYS B 54 -8.806 12.439 -4.897 1.00 0.00 N ATOM 2123 CA LYS B 54 -9.067 13.902 -4.806 1.00 0.00 C ATOM 2124 C LYS B 54 -8.031 14.657 -5.640 1.00 0.00 C ATOM 2125 O LYS B 54 -8.027 15.870 -5.690 1.00 0.00 O ATOM 2126 CB LYS B 54 -8.980 14.339 -3.343 1.00 0.00 C ATOM 2127 CG LYS B 54 -10.222 13.859 -2.588 1.00 0.00 C ATOM 2128 CD LYS B 54 -10.107 14.253 -1.115 1.00 0.00 C ATOM 2129 CE LYS B 54 -11.311 13.705 -0.346 1.00 0.00 C ATOM 2130 NZ LYS B 54 -12.546 14.411 -0.791 1.00 0.00 N ATOM 0 H LYS B 54 -8.262 12.046 -4.129 1.00 0.00 H new ATOM 0 HA LYS B 54 -10.063 14.124 -5.189 1.00 0.00 H new ATOM 0 HB2 LYS B 54 -8.081 13.928 -2.883 1.00 0.00 H new ATOM 0 HB3 LYS B 54 -8.902 15.424 -3.281 1.00 0.00 H new ATOM 0 HG2 LYS B 54 -11.119 14.299 -3.024 1.00 0.00 H new ATOM 0 HG3 LYS B 54 -10.321 12.777 -2.680 1.00 0.00 H new ATOM 0 HD2 LYS B 54 -9.182 13.859 -0.693 1.00 0.00 H new ATOM 0 HD3 LYS B 54 -10.064 15.338 -1.020 1.00 0.00 H new ATOM 0 HE2 LYS B 54 -11.409 12.633 -0.519 1.00 0.00 H new ATOM 0 HE3 LYS B 54 -11.166 13.843 0.725 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 -13.312 14.233 -0.110 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 -12.361 15.433 -0.845 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 -12.828 14.060 -1.729 1.00 0.00 H new ATOM 2144 N GLY B 55 -7.161 13.948 -6.311 1.00 0.00 N ATOM 2145 CA GLY B 55 -6.137 14.626 -7.157 1.00 0.00 C ATOM 2146 C GLY B 55 -5.066 15.269 -6.275 1.00 0.00 C ATOM 2147 O GLY B 55 -4.441 16.237 -6.657 1.00 0.00 O ATOM 0 H GLY B 55 -7.116 12.929 -6.309 1.00 0.00 H new ATOM 0 HA2 GLY B 55 -5.677 13.905 -7.833 1.00 0.00 H new ATOM 0 HA3 GLY B 55 -6.612 15.386 -7.777 1.00 0.00 H new ATOM 2151 N VAL B 56 -4.847 14.750 -5.100 1.00 0.00 N ATOM 2152 CA VAL B 56 -3.813 15.350 -4.206 1.00 0.00 C ATOM 2153 C VAL B 56 -2.425 15.116 -4.803 1.00 0.00 C ATOM 2154 O VAL B 56 -2.114 14.042 -5.265 1.00 0.00 O ATOM 2155 CB VAL B 56 -3.916 14.716 -2.816 1.00 0.00 C ATOM 2156 CG1 VAL B 56 -2.716 15.129 -1.954 1.00 0.00 C ATOM 2157 CG2 VAL B 56 -5.203 15.208 -2.158 1.00 0.00 C ATOM 0 H VAL B 56 -5.336 13.940 -4.719 1.00 0.00 H new ATOM 0 HA VAL B 56 -3.977 16.424 -4.116 1.00 0.00 H new ATOM 0 HB VAL B 56 -3.923 13.630 -2.908 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -2.801 14.672 -0.968 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -1.794 14.795 -2.430 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -2.699 16.214 -1.850 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -5.296 14.767 -1.165 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -5.175 16.294 -2.072 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -6.058 14.914 -2.767 1.00 0.00 H new ATOM 2167 N ASP B 57 -1.602 16.130 -4.808 1.00 0.00 N ATOM 2168 CA ASP B 57 -0.230 16.005 -5.388 1.00 0.00 C ATOM 2169 C ASP B 57 0.455 14.733 -4.870 1.00 0.00 C ATOM 2170 O ASP B 57 1.215 14.773 -3.925 1.00 0.00 O ATOM 2171 CB ASP B 57 0.589 17.224 -4.963 1.00 0.00 C ATOM 2172 CG ASP B 57 -0.250 18.486 -5.159 1.00 0.00 C ATOM 2173 OD1 ASP B 57 -0.689 18.713 -6.274 1.00 0.00 O ATOM 2174 OD2 ASP B 57 -0.445 19.201 -4.190 1.00 0.00 O ATOM 0 H ASP B 57 -1.823 17.051 -4.431 1.00 0.00 H new ATOM 0 HA ASP B 57 -0.299 15.949 -6.474 1.00 0.00 H new ATOM 0 HB2 ASP B 57 0.888 17.130 -3.919 1.00 0.00 H new ATOM 0 HB3 ASP B 57 1.504 17.286 -5.552 1.00 0.00 H new ATOM 2179 N LEU B 58 0.193 13.609 -5.485 1.00 0.00 N ATOM 2180 CA LEU B 58 0.827 12.330 -5.039 1.00 0.00 C ATOM 2181 C LEU B 58 2.128 12.101 -5.814 1.00 0.00 C ATOM 2182 O LEU B 58 3.131 11.689 -5.262 1.00 0.00 O ATOM 2183 CB LEU B 58 -0.135 11.170 -5.315 1.00 0.00 C ATOM 2184 CG LEU B 58 0.458 9.848 -4.802 1.00 0.00 C ATOM 2185 CD1 LEU B 58 0.659 9.905 -3.276 1.00 0.00 C ATOM 2186 CD2 LEU B 58 -0.501 8.705 -5.157 1.00 0.00 C ATOM 0 H LEU B 58 -0.437 13.521 -6.282 1.00 0.00 H new ATOM 0 HA LEU B 58 1.046 12.386 -3.973 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -1.092 11.359 -4.829 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -0.330 11.098 -6.385 1.00 0.00 H new ATOM 0 HG LEU B 58 1.428 9.681 -5.271 1.00 0.00 H new ATOM 0 HD11 LEU B 58 1.080 8.961 -2.929 1.00 0.00 H new ATOM 0 HD12 LEU B 58 1.341 10.719 -3.029 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -0.301 10.075 -2.789 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -0.091 7.761 -4.798 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -1.468 8.882 -4.687 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -0.626 8.658 -6.239 1.00 0.00 H new ATOM 2198 N ASN B 59 2.112 12.351 -7.097 1.00 0.00 N ATOM 2199 CA ASN B 59 3.336 12.131 -7.921 1.00 0.00 C ATOM 2200 C ASN B 59 4.521 12.846 -7.280 1.00 0.00 C ATOM 2201 O ASN B 59 5.546 12.250 -7.010 1.00 0.00 O ATOM 2202 CB ASN B 59 3.097 12.678 -9.342 1.00 0.00 C ATOM 2203 CG ASN B 59 2.130 13.863 -9.278 1.00 0.00 C ATOM 2204 OD1 ASN B 59 2.500 14.946 -8.867 1.00 0.00 O ATOM 2205 ND2 ASN B 59 0.896 13.698 -9.665 1.00 0.00 N ATOM 0 H ASN B 59 1.302 12.699 -7.610 1.00 0.00 H new ATOM 0 HA ASN B 59 3.554 11.064 -7.977 1.00 0.00 H new ATOM 0 HB2 ASN B 59 4.042 12.990 -9.787 1.00 0.00 H new ATOM 0 HB3 ASN B 59 2.688 11.895 -9.980 1.00 0.00 H new ATOM 0 HD21 ASN B 59 0.240 14.478 -9.623 1.00 0.00 H new ATOM 0 HD22 ASN B 59 0.587 12.789 -10.010 1.00 0.00 H new ATOM 2212 N ALA B 60 4.398 14.117 -7.031 1.00 0.00 N ATOM 2213 CA ALA B 60 5.528 14.853 -6.412 1.00 0.00 C ATOM 2214 C ALA B 60 5.787 14.304 -5.014 1.00 0.00 C ATOM 2215 O ALA B 60 6.915 14.149 -4.609 1.00 0.00 O ATOM 2216 CB ALA B 60 5.175 16.335 -6.316 1.00 0.00 C ATOM 0 H ALA B 60 3.567 14.675 -7.229 1.00 0.00 H new ATOM 0 HA ALA B 60 6.422 14.728 -7.023 1.00 0.00 H new ATOM 0 HB1 ALA B 60 6.004 16.878 -5.861 1.00 0.00 H new ATOM 0 HB2 ALA B 60 4.987 16.730 -7.314 1.00 0.00 H new ATOM 0 HB3 ALA B 60 4.282 16.457 -5.703 1.00 0.00 H new ATOM 2222 N LEU B 61 4.746 14.005 -4.280 1.00 0.00 N ATOM 2223 CA LEU B 61 4.912 13.473 -2.892 1.00 0.00 C ATOM 2224 C LEU B 61 6.053 12.452 -2.848 1.00 0.00 C ATOM 2225 O LEU B 61 7.011 12.610 -2.118 1.00 0.00 O ATOM 2226 CB LEU B 61 3.600 12.792 -2.483 1.00 0.00 C ATOM 2227 CG LEU B 61 3.519 12.650 -0.949 1.00 0.00 C ATOM 2228 CD1 LEU B 61 2.858 13.893 -0.350 1.00 0.00 C ATOM 2229 CD2 LEU B 61 2.681 11.417 -0.582 1.00 0.00 C ATOM 0 H LEU B 61 3.778 14.107 -4.585 1.00 0.00 H new ATOM 0 HA LEU B 61 5.151 14.288 -2.209 1.00 0.00 H new ATOM 0 HB2 LEU B 61 2.753 13.375 -2.845 1.00 0.00 H new ATOM 0 HB3 LEU B 61 3.533 11.809 -2.949 1.00 0.00 H new ATOM 0 HG LEU B 61 4.528 12.539 -0.552 1.00 0.00 H new ATOM 0 HD11 LEU B 61 2.802 13.789 0.734 1.00 0.00 H new ATOM 0 HD12 LEU B 61 3.448 14.775 -0.600 1.00 0.00 H new ATOM 0 HD13 LEU B 61 1.852 14.002 -0.756 1.00 0.00 H new ATOM 0 HD21 LEU B 61 2.628 11.323 0.503 1.00 0.00 H new ATOM 0 HD22 LEU B 61 1.675 11.527 -0.986 1.00 0.00 H new ATOM 0 HD23 LEU B 61 3.144 10.524 -1.001 1.00 0.00 H new ATOM 2241 N PHE B 62 5.962 11.415 -3.631 1.00 0.00 N ATOM 2242 CA PHE B 62 7.044 10.389 -3.646 1.00 0.00 C ATOM 2243 C PHE B 62 8.343 11.023 -4.146 1.00 0.00 C ATOM 2244 O PHE B 62 9.404 10.805 -3.596 1.00 0.00 O ATOM 2245 CB PHE B 62 6.637 9.248 -4.590 1.00 0.00 C ATOM 2246 CG PHE B 62 5.768 8.249 -3.855 1.00 0.00 C ATOM 2247 CD1 PHE B 62 4.524 8.640 -3.345 1.00 0.00 C ATOM 2248 CD2 PHE B 62 6.205 6.929 -3.692 1.00 0.00 C ATOM 2249 CE1 PHE B 62 3.718 7.712 -2.674 1.00 0.00 C ATOM 2250 CE2 PHE B 62 5.402 6.003 -3.021 1.00 0.00 C ATOM 2251 CZ PHE B 62 4.158 6.393 -2.513 1.00 0.00 C ATOM 0 H PHE B 62 5.183 11.232 -4.264 1.00 0.00 H new ATOM 0 HA PHE B 62 7.197 10.000 -2.639 1.00 0.00 H new ATOM 0 HB2 PHE B 62 6.097 9.650 -5.447 1.00 0.00 H new ATOM 0 HB3 PHE B 62 7.527 8.752 -4.978 1.00 0.00 H new ATOM 0 HD1 PHE B 62 4.186 9.658 -3.469 1.00 0.00 H new ATOM 0 HD2 PHE B 62 7.164 6.626 -4.085 1.00 0.00 H new ATOM 0 HE1 PHE B 62 2.758 8.014 -2.281 1.00 0.00 H new ATOM 0 HE2 PHE B 62 5.742 4.986 -2.894 1.00 0.00 H new ATOM 0 HZ PHE B 62 3.537 5.676 -1.996 1.00 0.00 H new ATOM 2261 N ASP B 63 8.264 11.799 -5.192 1.00 0.00 N ATOM 2262 CA ASP B 63 9.485 12.443 -5.748 1.00 0.00 C ATOM 2263 C ASP B 63 10.333 13.020 -4.613 1.00 0.00 C ATOM 2264 O ASP B 63 11.545 13.037 -4.680 1.00 0.00 O ATOM 2265 CB ASP B 63 9.069 13.561 -6.702 1.00 0.00 C ATOM 2266 CG ASP B 63 10.270 13.985 -7.547 1.00 0.00 C ATOM 2267 OD1 ASP B 63 10.998 13.109 -7.984 1.00 0.00 O ATOM 2268 OD2 ASP B 63 10.439 15.175 -7.744 1.00 0.00 O ATOM 0 H ASP B 63 7.399 12.015 -5.688 1.00 0.00 H new ATOM 0 HA ASP B 63 10.075 11.701 -6.286 1.00 0.00 H new ATOM 0 HB2 ASP B 63 8.259 13.220 -7.347 1.00 0.00 H new ATOM 0 HB3 ASP B 63 8.690 14.413 -6.137 1.00 0.00 H new ATOM 2273 N ARG B 64 9.707 13.493 -3.574 1.00 0.00 N ATOM 2274 CA ARG B 64 10.479 14.063 -2.437 1.00 0.00 C ATOM 2275 C ARG B 64 11.302 12.952 -1.782 1.00 0.00 C ATOM 2276 O ARG B 64 12.451 13.139 -1.435 1.00 0.00 O ATOM 2277 CB ARG B 64 9.505 14.643 -1.403 1.00 0.00 C ATOM 2278 CG ARG B 64 8.490 15.573 -2.087 1.00 0.00 C ATOM 2279 CD ARG B 64 9.183 16.813 -2.657 1.00 0.00 C ATOM 2280 NE ARG B 64 10.004 17.452 -1.584 1.00 0.00 N ATOM 2281 CZ ARG B 64 9.571 18.504 -0.928 1.00 0.00 C ATOM 2282 NH1 ARG B 64 8.413 19.049 -1.208 1.00 0.00 N ATOM 2283 NH2 ARG B 64 10.307 19.010 0.020 1.00 0.00 N ATOM 0 H ARG B 64 8.693 13.510 -3.463 1.00 0.00 H new ATOM 0 HA ARG B 64 11.141 14.849 -2.800 1.00 0.00 H new ATOM 0 HB2 ARG B 64 8.981 13.834 -0.893 1.00 0.00 H new ATOM 0 HB3 ARG B 64 10.058 15.194 -0.642 1.00 0.00 H new ATOM 0 HG2 ARG B 64 7.981 15.036 -2.887 1.00 0.00 H new ATOM 0 HG3 ARG B 64 7.727 15.875 -1.370 1.00 0.00 H new ATOM 0 HD2 ARG B 64 9.816 16.536 -3.500 1.00 0.00 H new ATOM 0 HD3 ARG B 64 8.442 17.518 -3.033 1.00 0.00 H new ATOM 0 HE ARG B 64 10.919 17.063 -1.357 1.00 0.00 H new ATOM 0 HH11 ARG B 64 7.830 18.656 -1.947 1.00 0.00 H new ATOM 0 HH12 ARG B 64 8.094 19.866 -0.687 1.00 0.00 H new ATOM 0 HH21 ARG B 64 11.208 18.589 0.245 1.00 0.00 H new ATOM 0 HH22 ARG B 64 9.982 19.827 0.537 1.00 0.00 H new ATOM 2297 N ILE B 65 10.718 11.798 -1.607 1.00 0.00 N ATOM 2298 CA ILE B 65 11.456 10.673 -0.969 1.00 0.00 C ATOM 2299 C ILE B 65 12.611 10.218 -1.868 1.00 0.00 C ATOM 2300 O ILE B 65 13.704 9.966 -1.403 1.00 0.00 O ATOM 2301 CB ILE B 65 10.492 9.502 -0.754 1.00 0.00 C ATOM 2302 CG1 ILE B 65 9.441 9.893 0.287 1.00 0.00 C ATOM 2303 CG2 ILE B 65 11.268 8.279 -0.255 1.00 0.00 C ATOM 2304 CD1 ILE B 65 8.324 8.847 0.295 1.00 0.00 C ATOM 0 H ILE B 65 9.758 11.586 -1.880 1.00 0.00 H new ATOM 0 HA ILE B 65 11.861 11.007 -0.014 1.00 0.00 H new ATOM 0 HB ILE B 65 10.003 9.260 -1.698 1.00 0.00 H new ATOM 0 HG12 ILE B 65 9.898 9.961 1.274 1.00 0.00 H new ATOM 0 HG13 ILE B 65 9.032 10.877 0.056 1.00 0.00 H new ATOM 0 HG21 ILE B 65 10.579 7.448 -0.103 1.00 0.00 H new ATOM 0 HG22 ILE B 65 12.018 7.998 -0.994 1.00 0.00 H new ATOM 0 HG23 ILE B 65 11.759 8.520 0.688 1.00 0.00 H new ATOM 0 HD11 ILE B 65 7.573 9.122 1.036 1.00 0.00 H new ATOM 0 HD12 ILE B 65 7.861 8.801 -0.691 1.00 0.00 H new ATOM 0 HD13 ILE B 65 8.741 7.872 0.546 1.00 0.00 H new