USER MOD reduce.3.24.130724 H: found=0, std=0, add=1205, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1208 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 135 LYS NZ :NH3+ -164:sc= 0.781 (180deg=0) USER MOD Set 1.2: A 148 SER OG : rot 180:sc= 0.696 USER MOD Set 2.1: A 127 HIS : no HD1:sc= -2.38! K(o=-2!,f=0.082) USER MOD Set 2.2: A 129 ASN : amide:sc= 0.434 K(o=-2,f=-0.49) USER MOD Set 3.1: A 93 LYS NZ :NH3+ 166:sc= -0.0744 (180deg=-1.71!) USER MOD Set 3.2: A 108 ASN : amide:sc= -0.903! C(o=-0.98!,f=-13!) USER MOD Set 4.1: A 25 ASN : amide:sc= -4.57! C(o=-6.8!,f=-7.3!) USER MOD Set 4.2: A 31 SER OG : rot -74:sc= -2.23! USER MOD Set 5.1: A 29 ASN : amide:sc= 0.105 K(o=0.2,f=-0.65) USER MOD Set 5.2: A 153 GLN : amide:sc= 0.0968 K(o=0.2,f=-0.65) USER MOD Single : A 9 ASN : amide:sc= 0.775 K(o=0.77,f=-7.5!) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= -10! C(o=-10!,f=-20!) USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 162:sc= -0.061 (180deg=-0.35) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= -0.364 K(o=-0.36,f=-7.8!) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= -0.0633 X(o=-0.063,f=-0.015) USER MOD Single : A 47 ASN : amide:sc= 0.0734 K(o=0.073,f=-0.84) USER MOD Single : A 53 LYS NZ :NH3+ 170:sc= 1.35 (180deg=1.29) USER MOD Single : A 56 MET CE :methyl 138:sc= -3.04! (180deg=-4.32!) USER MOD Single : A 59 TYR OH : rot 150:sc= -1.15 USER MOD Single : A 60 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0515) USER MOD Single : A 61 SER OG : rot 180:sc= -0.236 USER MOD Single : A 62 SER OG : rot 180:sc= 0.00894 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ -136:sc= 1.33 (180deg=0.303) USER MOD Single : A 69 THR OG1 : rot -115:sc= -1.26! USER MOD Single : A 75 SER OG : rot 110:sc= -0.131 USER MOD Single : A 76 LYS NZ :NH3+ 162:sc= -0.126 (180deg=-0.569) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= -0.602 K(o=-0.6,f=-1.5) USER MOD Single : A 80 TYR OH : rot 15:sc= -0.0174 USER MOD Single : A 82 THR OG1 : rot -165:sc= -3.09! USER MOD Single : A 84 GLN : amide:sc= -1.99! K(o=-2!,f=-0.34) USER MOD Single : A 88 GLN : amide:sc= -0.41 K(o=-0.41,f=-5.6!) USER MOD Single : A 95 MET CE :methyl -173:sc= -0.695 (180deg=-0.792) USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 THR OG1 : rot -37:sc= 0.646 USER MOD Single : A 103 THR OG1 : rot 180:sc= -0.132 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot -96:sc= 1.32 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 HIS : no HD1:sc=-0.00995 X(o=-0.01,f=-0.2) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 LYS NZ :NH3+ -171:sc=-0.00245 (180deg=-0.0798) USER MOD Single : A 120 ASN : amide:sc= -1.26 K(o=-1.3,f=-7!) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot -62:sc= 1.5 USER MOD Single : A 124 SER OG : rot -120:sc= -1.63! USER MOD Single : A 134 THR OG1 : rot 132:sc= 0.121 USER MOD Single : A 136 GLN : amide:sc= -5.14! K(o=-5.1!,f=-0.49) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 CYS SG : rot -148:sc= 1.93 USER MOD Single : A 150 THR OG1 : rot 140:sc= 0.0229 USER MOD Single : A 157 ASN : amide:sc= 0.0818 K(o=0.082,f=-1.9!) USER MOD Single : A 158 GLN : amide:sc= -0.107 X(o=-0.11,f=-0.35) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 9 24.523 0.622 -6.508 1.00 4.20 N ATOM 2 CA ASN A 9 24.750 -0.838 -6.555 1.00 4.32 C ATOM 3 C ASN A 9 23.454 -1.542 -6.174 1.00 4.11 C ATOM 4 O ASN A 9 22.418 -0.891 -6.009 1.00 4.02 O ATOM 5 CB ASN A 9 25.884 -1.220 -5.586 1.00 4.41 C ATOM 6 CG ASN A 9 26.592 -2.519 -5.957 1.00 4.99 C ATOM 7 OD1 ASN A 9 26.003 -3.433 -6.533 1.00 5.29 O ATOM 8 ND2 ASN A 9 27.875 -2.602 -5.636 1.00 5.50 N ATOM 0 HA ASN A 9 25.045 -1.144 -7.559 1.00 4.32 H new ATOM 0 HB2 ASN A 9 26.615 -0.412 -5.559 1.00 4.41 H new ATOM 0 HB3 ASN A 9 25.475 -1.313 -4.580 1.00 4.41 H new ATOM 0 HD21 ASN A 9 28.405 -3.442 -5.866 1.00 5.50 H new ATOM 0 HD22 ASN A 9 28.333 -1.825 -5.159 1.00 5.50 H new ATOM 17 N VAL A 10 23.492 -2.858 -6.040 1.00 4.35 N ATOM 18 CA VAL A 10 22.307 -3.606 -5.686 1.00 4.25 C ATOM 19 C VAL A 10 22.252 -3.862 -4.189 1.00 3.43 C ATOM 20 O VAL A 10 23.171 -4.446 -3.608 1.00 3.52 O ATOM 21 CB VAL A 10 22.258 -4.957 -6.431 1.00 5.19 C ATOM 22 CG1 VAL A 10 20.997 -5.727 -6.082 1.00 5.29 C ATOM 23 CG2 VAL A 10 22.345 -4.740 -7.931 1.00 6.05 C ATOM 0 H VAL A 10 24.330 -3.424 -6.172 1.00 4.35 H new ATOM 0 HA VAL A 10 21.447 -3.004 -5.980 1.00 4.25 H new ATOM 0 HB VAL A 10 23.116 -5.548 -6.112 1.00 5.19 H new ATOM 0 HG11 VAL A 10 20.988 -6.675 -6.621 1.00 5.29 H new ATOM 0 HG12 VAL A 10 20.973 -5.919 -5.009 1.00 5.29 H new ATOM 0 HG13 VAL A 10 20.123 -5.141 -6.365 1.00 5.29 H new ATOM 0 HG21 VAL A 10 22.309 -5.703 -8.441 1.00 6.05 H new ATOM 0 HG22 VAL A 10 21.507 -4.124 -8.259 1.00 6.05 H new ATOM 0 HG23 VAL A 10 23.281 -4.237 -8.172 1.00 6.05 H new ATOM 33 N LYS A 11 21.183 -3.402 -3.571 1.00 3.01 N ATOM 34 CA LYS A 11 20.839 -3.821 -2.233 1.00 2.38 C ATOM 35 C LYS A 11 19.701 -4.827 -2.316 1.00 2.30 C ATOM 36 O LYS A 11 18.979 -4.846 -3.291 1.00 2.75 O ATOM 37 CB LYS A 11 20.537 -2.640 -1.309 1.00 2.57 C ATOM 38 CG LYS A 11 21.770 -1.817 -0.986 1.00 3.33 C ATOM 39 CD LYS A 11 22.859 -2.694 -0.391 1.00 4.00 C ATOM 40 CE LYS A 11 24.162 -1.940 -0.215 1.00 4.63 C ATOM 41 NZ LYS A 11 25.244 -2.828 0.280 1.00 5.11 N ATOM 0 H LYS A 11 20.533 -2.731 -3.982 1.00 3.01 H new ATOM 0 HA LYS A 11 21.699 -4.309 -1.774 1.00 2.38 H new ATOM 0 HB2 LYS A 11 19.790 -1.999 -1.778 1.00 2.57 H new ATOM 0 HB3 LYS A 11 20.101 -3.012 -0.382 1.00 2.57 H new ATOM 0 HG2 LYS A 11 22.139 -1.334 -1.891 1.00 3.33 H new ATOM 0 HG3 LYS A 11 21.511 -1.024 -0.285 1.00 3.33 H new ATOM 0 HD2 LYS A 11 22.529 -3.077 0.574 1.00 4.00 H new ATOM 0 HD3 LYS A 11 23.023 -3.556 -1.037 1.00 4.00 H new ATOM 0 HE2 LYS A 11 24.459 -1.499 -1.166 1.00 4.63 H new ATOM 0 HE3 LYS A 11 24.016 -1.118 0.486 1.00 4.63 H new ATOM 0 HZ1 LYS A 11 26.121 -2.279 0.389 1.00 5.11 H new ATOM 0 HZ2 LYS A 11 24.970 -3.229 1.200 1.00 5.11 H new ATOM 0 HZ3 LYS A 11 25.400 -3.598 -0.401 1.00 5.11 H new ATOM 55 N TYR A 12 19.674 -5.727 -1.360 1.00 2.26 N ATOM 56 CA TYR A 12 18.765 -6.889 -1.307 1.00 2.39 C ATOM 57 C TYR A 12 17.704 -6.740 -0.203 1.00 1.68 C ATOM 58 O TYR A 12 18.093 -6.535 0.923 1.00 2.15 O ATOM 59 CB TYR A 12 19.584 -8.166 -1.073 1.00 3.48 C ATOM 60 CG TYR A 12 21.035 -7.881 -0.752 1.00 4.09 C ATOM 61 CD1 TYR A 12 21.441 -7.596 0.546 1.00 4.36 C ATOM 62 CD2 TYR A 12 21.990 -7.861 -1.759 1.00 4.67 C ATOM 63 CE1 TYR A 12 22.762 -7.306 0.831 1.00 5.04 C ATOM 64 CE2 TYR A 12 23.308 -7.565 -1.483 1.00 5.39 C ATOM 65 CZ TYR A 12 23.690 -7.289 -0.188 1.00 5.50 C ATOM 66 OH TYR A 12 25.000 -6.979 0.083 1.00 6.30 O ATOM 0 H TYR A 12 20.303 -5.684 -0.558 1.00 2.26 H new ATOM 0 HA TYR A 12 18.240 -6.948 -2.260 1.00 2.39 H new ATOM 0 HB2 TYR A 12 19.140 -8.732 -0.254 1.00 3.48 H new ATOM 0 HB3 TYR A 12 19.530 -8.795 -1.962 1.00 3.48 H new ATOM 0 HD1 TYR A 12 20.713 -7.601 1.344 1.00 4.36 H new ATOM 0 HD2 TYR A 12 21.696 -8.081 -2.775 1.00 4.67 H new ATOM 0 HE1 TYR A 12 23.065 -7.094 1.846 1.00 5.04 H new ATOM 0 HE2 TYR A 12 24.038 -7.549 -2.279 1.00 5.39 H new ATOM 0 HH TYR A 12 25.522 -7.013 -0.745 1.00 6.30 H new ATOM 76 N ASN A 13 16.375 -6.754 -0.476 1.00 1.23 N ATOM 77 CA ASN A 13 15.474 -6.813 0.648 1.00 1.00 C ATOM 78 C ASN A 13 14.791 -8.165 0.832 1.00 0.86 C ATOM 79 O ASN A 13 13.717 -8.415 0.334 1.00 1.29 O ATOM 80 CB ASN A 13 14.378 -5.759 0.431 1.00 1.76 C ATOM 81 CG ASN A 13 13.640 -5.849 -0.928 1.00 2.67 C ATOM 82 OD1 ASN A 13 13.978 -5.172 -1.875 1.00 3.27 O ATOM 83 ND2 ASN A 13 12.615 -6.677 -1.030 1.00 3.42 N ATOM 0 H ASN A 13 15.948 -6.727 -1.402 1.00 1.23 H new ATOM 0 HA ASN A 13 16.073 -6.636 1.541 1.00 1.00 H new ATOM 0 HB2 ASN A 13 13.644 -5.850 1.232 1.00 1.76 H new ATOM 0 HB3 ASN A 13 14.825 -4.769 0.519 1.00 1.76 H new ATOM 0 HD21 ASN A 13 12.103 -6.749 -1.909 1.00 3.42 H new ATOM 0 HD22 ASN A 13 12.336 -7.244 -0.229 1.00 3.42 H new ATOM 90 N PHE A 14 15.345 -8.979 1.685 1.00 0.97 N ATOM 91 CA PHE A 14 14.585 -9.965 2.447 1.00 1.06 C ATOM 92 C PHE A 14 14.137 -9.369 3.780 1.00 0.93 C ATOM 93 O PHE A 14 14.990 -8.956 4.562 1.00 1.27 O ATOM 94 CB PHE A 14 15.409 -11.248 2.661 1.00 1.64 C ATOM 95 CG PHE A 14 16.753 -11.033 3.311 1.00 2.26 C ATOM 96 CD1 PHE A 14 17.832 -10.569 2.571 1.00 3.13 C ATOM 97 CD2 PHE A 14 16.935 -11.288 4.662 1.00 2.47 C ATOM 98 CE1 PHE A 14 19.063 -10.368 3.166 1.00 4.16 C ATOM 99 CE2 PHE A 14 18.165 -11.090 5.261 1.00 3.36 C ATOM 100 CZ PHE A 14 19.232 -10.643 4.510 1.00 4.21 C ATOM 0 H PHE A 14 16.346 -8.988 1.883 1.00 0.97 H new ATOM 0 HA PHE A 14 13.697 -10.236 1.876 1.00 1.06 H new ATOM 0 HB2 PHE A 14 14.830 -11.937 3.275 1.00 1.64 H new ATOM 0 HB3 PHE A 14 15.561 -11.731 1.696 1.00 1.64 H new ATOM 0 HD1 PHE A 14 17.708 -10.363 1.518 1.00 3.13 H new ATOM 0 HD2 PHE A 14 16.105 -11.646 5.254 1.00 2.47 H new ATOM 0 HE1 PHE A 14 19.892 -9.997 2.582 1.00 4.16 H new ATOM 0 HE2 PHE A 14 18.290 -11.285 6.316 1.00 3.36 H new ATOM 0 HZ PHE A 14 20.199 -10.508 4.972 1.00 4.21 H new ATOM 110 N MET A 15 12.846 -9.280 4.071 1.00 0.73 N ATOM 111 CA MET A 15 12.446 -9.051 5.446 1.00 0.74 C ATOM 112 C MET A 15 11.697 -10.275 5.947 1.00 0.70 C ATOM 113 O MET A 15 12.207 -11.062 6.744 1.00 0.79 O ATOM 114 CB MET A 15 11.625 -7.771 5.567 1.00 0.84 C ATOM 115 CG MET A 15 11.711 -7.091 6.929 1.00 1.48 C ATOM 116 SD MET A 15 10.991 -8.061 8.267 1.00 2.32 S ATOM 117 CE MET A 15 11.298 -6.981 9.663 1.00 2.91 C ATOM 0 H MET A 15 12.084 -9.360 3.398 1.00 0.73 H new ATOM 0 HA MET A 15 13.325 -8.906 6.074 1.00 0.74 H new ATOM 0 HB2 MET A 15 11.956 -7.068 4.803 1.00 0.84 H new ATOM 0 HB3 MET A 15 10.581 -8.003 5.356 1.00 0.84 H new ATOM 0 HG2 MET A 15 12.757 -6.890 7.160 1.00 1.48 H new ATOM 0 HG3 MET A 15 11.205 -6.127 6.877 1.00 1.48 H new ATOM 0 HE1 MET A 15 10.909 -7.441 10.571 1.00 2.91 H new ATOM 0 HE2 MET A 15 12.371 -6.819 9.769 1.00 2.91 H new ATOM 0 HE3 MET A 15 10.801 -6.025 9.500 1.00 2.91 H new ATOM 127 N ARG A 16 10.481 -10.427 5.430 1.00 0.61 N ATOM 128 CA ARG A 16 9.636 -11.573 5.688 1.00 0.61 C ATOM 129 C ARG A 16 8.425 -11.551 4.751 1.00 0.56 C ATOM 130 O ARG A 16 7.964 -10.478 4.345 1.00 0.52 O ATOM 131 CB ARG A 16 9.190 -11.573 7.149 1.00 0.63 C ATOM 132 CG ARG A 16 8.588 -10.257 7.642 1.00 0.72 C ATOM 133 CD ARG A 16 7.119 -10.108 7.283 1.00 1.06 C ATOM 134 NE ARG A 16 6.355 -11.324 7.569 1.00 1.64 N ATOM 135 CZ ARG A 16 5.173 -11.336 8.184 1.00 2.09 C ATOM 136 NH1 ARG A 16 4.646 -10.208 8.646 1.00 2.43 N ATOM 137 NH2 ARG A 16 4.527 -12.482 8.357 1.00 2.73 N ATOM 0 H ARG A 16 10.054 -9.740 4.809 1.00 0.61 H new ATOM 0 HA ARG A 16 10.201 -12.486 5.500 1.00 0.61 H new ATOM 0 HB2 ARG A 16 8.455 -12.366 7.289 1.00 0.63 H new ATOM 0 HB3 ARG A 16 10.048 -11.820 7.775 1.00 0.63 H new ATOM 0 HG2 ARG A 16 8.700 -10.195 8.724 1.00 0.72 H new ATOM 0 HG3 ARG A 16 9.148 -9.425 7.215 1.00 0.72 H new ATOM 0 HD2 ARG A 16 6.693 -9.274 7.840 1.00 1.06 H new ATOM 0 HD3 ARG A 16 7.028 -9.864 6.225 1.00 1.06 H new ATOM 0 HE ARG A 16 6.752 -12.218 7.279 1.00 1.64 H new ATOM 0 HH11 ARG A 16 5.146 -9.327 8.531 1.00 2.43 H new ATOM 0 HH12 ARG A 16 3.741 -10.223 9.116 1.00 2.43 H new ATOM 0 HH21 ARG A 16 4.935 -13.354 8.019 1.00 2.73 H new ATOM 0 HH22 ARG A 16 3.622 -12.491 8.828 1.00 2.73 H new ATOM 151 N ILE A 17 7.924 -12.729 4.399 1.00 0.62 N ATOM 152 CA ILE A 17 6.723 -12.842 3.575 1.00 0.61 C ATOM 153 C ILE A 17 5.457 -12.653 4.415 1.00 0.57 C ATOM 154 O ILE A 17 5.183 -13.426 5.337 1.00 0.64 O ATOM 155 CB ILE A 17 6.669 -14.192 2.826 1.00 0.73 C ATOM 156 CG1 ILE A 17 6.871 -15.368 3.789 1.00 1.68 C ATOM 157 CG2 ILE A 17 7.717 -14.217 1.721 1.00 1.41 C ATOM 158 CD1 ILE A 17 6.794 -16.722 3.119 1.00 2.26 C ATOM 0 H ILE A 17 8.331 -13.623 4.672 1.00 0.62 H new ATOM 0 HA ILE A 17 6.770 -12.046 2.832 1.00 0.61 H new ATOM 0 HB ILE A 17 5.681 -14.297 2.378 1.00 0.73 H new ATOM 0 HG12 ILE A 17 7.842 -15.267 4.273 1.00 1.68 H new ATOM 0 HG13 ILE A 17 6.116 -15.317 4.574 1.00 1.68 H new ATOM 0 HG21 ILE A 17 7.672 -15.172 1.198 1.00 1.41 H new ATOM 0 HG22 ILE A 17 7.522 -13.408 1.017 1.00 1.41 H new ATOM 0 HG23 ILE A 17 8.708 -14.088 2.156 1.00 1.41 H new ATOM 0 HD11 ILE A 17 6.946 -17.505 3.862 1.00 2.26 H new ATOM 0 HD12 ILE A 17 5.814 -16.845 2.658 1.00 2.26 H new ATOM 0 HD13 ILE A 17 7.566 -16.793 2.353 1.00 2.26 H new ATOM 170 N ILE A 18 4.714 -11.592 4.125 1.00 0.49 N ATOM 171 CA ILE A 18 3.500 -11.281 4.871 1.00 0.48 C ATOM 172 C ILE A 18 2.268 -11.950 4.239 1.00 0.48 C ATOM 173 O ILE A 18 2.283 -13.141 3.928 1.00 0.52 O ATOM 174 CB ILE A 18 3.274 -9.751 5.008 1.00 0.44 C ATOM 175 CG1 ILE A 18 4.608 -9.030 5.221 1.00 0.44 C ATOM 176 CG2 ILE A 18 2.335 -9.446 6.176 1.00 0.50 C ATOM 177 CD1 ILE A 18 4.468 -7.536 5.428 1.00 0.94 C ATOM 0 H ILE A 18 4.931 -10.932 3.378 1.00 0.49 H new ATOM 0 HA ILE A 18 3.637 -11.686 5.874 1.00 0.48 H new ATOM 0 HB ILE A 18 2.818 -9.394 4.085 1.00 0.44 H new ATOM 0 HG12 ILE A 18 5.110 -9.462 6.087 1.00 0.44 H new ATOM 0 HG13 ILE A 18 5.249 -9.210 4.358 1.00 0.44 H new ATOM 0 HG21 ILE A 18 2.190 -8.369 6.254 1.00 0.50 H new ATOM 0 HG22 ILE A 18 1.373 -9.930 6.006 1.00 0.50 H new ATOM 0 HG23 ILE A 18 2.772 -9.822 7.101 1.00 0.50 H new ATOM 0 HD11 ILE A 18 5.454 -7.095 5.572 1.00 0.94 H new ATOM 0 HD12 ILE A 18 3.995 -7.090 4.553 1.00 0.94 H new ATOM 0 HD13 ILE A 18 3.854 -7.347 6.308 1.00 0.94 H new ATOM 189 N LYS A 19 1.205 -11.175 4.074 1.00 0.45 N ATOM 190 CA LYS A 19 -0.109 -11.702 3.693 1.00 0.46 C ATOM 191 C LYS A 19 -0.485 -11.249 2.281 1.00 0.42 C ATOM 192 O LYS A 19 0.049 -10.264 1.794 1.00 0.49 O ATOM 193 CB LYS A 19 -1.164 -11.244 4.709 1.00 0.54 C ATOM 194 CG LYS A 19 -0.802 -11.583 6.152 1.00 1.13 C ATOM 195 CD LYS A 19 -1.837 -11.068 7.144 1.00 1.85 C ATOM 196 CE LYS A 19 -3.134 -11.864 7.085 1.00 2.57 C ATOM 197 NZ LYS A 19 -2.939 -13.288 7.467 1.00 2.68 N ATOM 0 H LYS A 19 1.224 -10.163 4.199 1.00 0.45 H new ATOM 0 HA LYS A 19 -0.067 -12.791 3.694 1.00 0.46 H new ATOM 0 HB2 LYS A 19 -1.300 -10.166 4.620 1.00 0.54 H new ATOM 0 HB3 LYS A 19 -2.120 -11.707 4.463 1.00 0.54 H new ATOM 0 HG2 LYS A 19 -0.708 -12.664 6.256 1.00 1.13 H new ATOM 0 HG3 LYS A 19 0.171 -11.154 6.390 1.00 1.13 H new ATOM 0 HD2 LYS A 19 -1.427 -11.118 8.153 1.00 1.85 H new ATOM 0 HD3 LYS A 19 -2.047 -10.019 6.936 1.00 1.85 H new ATOM 0 HE2 LYS A 19 -3.868 -11.409 7.750 1.00 2.57 H new ATOM 0 HE3 LYS A 19 -3.543 -11.813 6.076 1.00 2.57 H new ATOM 0 HZ1 LYS A 19 -3.858 -13.712 7.708 1.00 2.68 H new ATOM 0 HZ2 LYS A 19 -2.517 -13.807 6.670 1.00 2.68 H new ATOM 0 HZ3 LYS A 19 -2.305 -13.343 8.290 1.00 2.68 H new ATOM 211 N TYR A 20 -1.432 -11.940 1.647 1.00 0.37 N ATOM 212 CA TYR A 20 -1.797 -11.651 0.258 1.00 0.41 C ATOM 213 C TYR A 20 -3.253 -11.978 -0.005 1.00 0.31 C ATOM 214 O TYR A 20 -3.856 -12.781 0.707 1.00 0.33 O ATOM 215 CB TYR A 20 -0.917 -12.462 -0.704 1.00 0.67 C ATOM 216 CG TYR A 20 -1.051 -13.964 -0.554 1.00 1.13 C ATOM 217 CD1 TYR A 20 -0.299 -14.660 0.384 1.00 1.45 C ATOM 218 CD2 TYR A 20 -1.930 -14.685 -1.352 1.00 1.34 C ATOM 219 CE1 TYR A 20 -0.421 -16.030 0.524 1.00 1.93 C ATOM 220 CE2 TYR A 20 -2.058 -16.055 -1.218 1.00 1.82 C ATOM 221 CZ TYR A 20 -1.302 -16.722 -0.278 1.00 2.10 C ATOM 222 OH TYR A 20 -1.430 -18.087 -0.135 1.00 2.59 O ATOM 0 H TYR A 20 -1.960 -12.703 2.071 1.00 0.37 H new ATOM 0 HA TYR A 20 -1.640 -10.585 0.090 1.00 0.41 H new ATOM 0 HB2 TYR A 20 -1.169 -12.187 -1.728 1.00 0.67 H new ATOM 0 HB3 TYR A 20 0.125 -12.184 -0.547 1.00 0.67 H new ATOM 0 HD1 TYR A 20 0.393 -14.122 1.015 1.00 1.45 H new ATOM 0 HD2 TYR A 20 -2.524 -14.166 -2.090 1.00 1.34 H new ATOM 0 HE1 TYR A 20 0.171 -16.555 1.259 1.00 1.93 H new ATOM 0 HE2 TYR A 20 -2.747 -16.600 -1.847 1.00 1.82 H new ATOM 0 HH TYR A 20 -2.093 -18.422 -0.774 1.00 2.59 H new ATOM 232 N GLU A 21 -3.800 -11.346 -1.041 1.00 0.33 N ATOM 233 CA GLU A 21 -5.170 -11.591 -1.475 1.00 0.32 C ATOM 234 C GLU A 21 -6.164 -11.314 -0.368 1.00 0.28 C ATOM 235 O GLU A 21 -7.163 -12.015 -0.201 1.00 0.30 O ATOM 236 CB GLU A 21 -5.325 -13.017 -1.985 1.00 0.35 C ATOM 237 CG GLU A 21 -4.809 -13.208 -3.399 1.00 0.98 C ATOM 238 CD GLU A 21 -5.466 -14.375 -4.105 1.00 1.16 C ATOM 239 OE1 GLU A 21 -6.674 -14.292 -4.417 1.00 1.53 O ATOM 240 OE2 GLU A 21 -4.775 -15.390 -4.336 1.00 1.73 O ATOM 0 H GLU A 21 -3.306 -10.651 -1.601 1.00 0.33 H new ATOM 0 HA GLU A 21 -5.383 -10.902 -2.292 1.00 0.32 H new ATOM 0 HB2 GLU A 21 -4.793 -13.694 -1.317 1.00 0.35 H new ATOM 0 HB3 GLU A 21 -6.378 -13.296 -1.949 1.00 0.35 H new ATOM 0 HG2 GLU A 21 -4.983 -12.297 -3.972 1.00 0.98 H new ATOM 0 HG3 GLU A 21 -3.731 -13.366 -3.370 1.00 0.98 H new ATOM 247 N PHE A 22 -5.867 -10.284 0.379 1.00 0.26 N ATOM 248 CA PHE A 22 -6.767 -9.770 1.366 1.00 0.26 C ATOM 249 C PHE A 22 -7.335 -8.492 0.821 1.00 0.24 C ATOM 250 O PHE A 22 -6.767 -7.898 -0.100 1.00 0.27 O ATOM 251 CB PHE A 22 -6.066 -9.576 2.708 1.00 0.32 C ATOM 252 CG PHE A 22 -5.802 -10.881 3.401 1.00 1.08 C ATOM 253 CD1 PHE A 22 -6.830 -11.555 4.042 1.00 1.98 C ATOM 254 CD2 PHE A 22 -4.540 -11.446 3.392 1.00 1.15 C ATOM 255 CE1 PHE A 22 -6.601 -12.765 4.665 1.00 2.89 C ATOM 256 CE2 PHE A 22 -4.306 -12.660 4.010 1.00 2.05 C ATOM 257 CZ PHE A 22 -5.337 -13.319 4.647 1.00 2.92 C ATOM 0 H PHE A 22 -4.984 -9.776 0.316 1.00 0.26 H new ATOM 0 HA PHE A 22 -7.575 -10.475 1.564 1.00 0.26 H new ATOM 0 HB2 PHE A 22 -5.123 -9.052 2.552 1.00 0.32 H new ATOM 0 HB3 PHE A 22 -6.680 -8.943 3.349 1.00 0.32 H new ATOM 0 HD1 PHE A 22 -7.822 -11.128 4.054 1.00 1.98 H new ATOM 0 HD2 PHE A 22 -3.729 -10.933 2.897 1.00 1.15 H new ATOM 0 HE1 PHE A 22 -7.409 -13.277 5.166 1.00 2.89 H new ATOM 0 HE2 PHE A 22 -3.316 -13.092 3.994 1.00 2.05 H new ATOM 0 HZ PHE A 22 -5.155 -14.267 5.131 1.00 2.92 H new ATOM 267 N ILE A 23 -8.436 -8.066 1.362 1.00 0.22 N ATOM 268 CA ILE A 23 -9.129 -6.943 0.806 1.00 0.21 C ATOM 269 C ILE A 23 -8.753 -5.730 1.582 1.00 0.19 C ATOM 270 O ILE A 23 -8.708 -5.736 2.809 1.00 0.22 O ATOM 271 CB ILE A 23 -10.656 -7.099 0.859 1.00 0.28 C ATOM 272 CG1 ILE A 23 -11.073 -8.458 0.291 1.00 0.36 C ATOM 273 CG2 ILE A 23 -11.328 -5.966 0.095 1.00 0.36 C ATOM 274 CD1 ILE A 23 -10.593 -8.699 -1.125 1.00 0.84 C ATOM 0 H ILE A 23 -8.873 -8.478 2.186 1.00 0.22 H new ATOM 0 HA ILE A 23 -8.843 -6.864 -0.243 1.00 0.21 H new ATOM 0 HB ILE A 23 -10.978 -7.051 1.899 1.00 0.28 H new ATOM 0 HG12 ILE A 23 -10.685 -9.246 0.936 1.00 0.36 H new ATOM 0 HG13 ILE A 23 -12.160 -8.534 0.315 1.00 0.36 H new ATOM 0 HG21 ILE A 23 -12.410 -6.088 0.140 1.00 0.36 H new ATOM 0 HG22 ILE A 23 -11.052 -5.011 0.543 1.00 0.36 H new ATOM 0 HG23 ILE A 23 -11.004 -5.986 -0.945 1.00 0.36 H new ATOM 0 HD11 ILE A 23 -10.926 -9.681 -1.460 1.00 0.84 H new ATOM 0 HD12 ILE A 23 -11.003 -7.933 -1.783 1.00 0.84 H new ATOM 0 HD13 ILE A 23 -9.504 -8.656 -1.152 1.00 0.84 H new ATOM 286 N LEU A 24 -8.464 -4.701 0.855 1.00 0.18 N ATOM 287 CA LEU A 24 -8.001 -3.485 1.471 1.00 0.19 C ATOM 288 C LEU A 24 -9.142 -2.506 1.596 1.00 0.20 C ATOM 289 O LEU A 24 -9.789 -2.147 0.614 1.00 0.23 O ATOM 290 CB LEU A 24 -6.851 -2.875 0.671 1.00 0.23 C ATOM 291 CG LEU A 24 -6.050 -1.803 1.415 1.00 0.53 C ATOM 292 CD1 LEU A 24 -4.643 -1.695 0.851 1.00 1.32 C ATOM 293 CD2 LEU A 24 -6.735 -0.442 1.367 1.00 1.41 C ATOM 0 H LEU A 24 -8.537 -4.670 -0.162 1.00 0.18 H new ATOM 0 HA LEU A 24 -7.628 -3.719 2.468 1.00 0.19 H new ATOM 0 HB2 LEU A 24 -6.172 -3.673 0.371 1.00 0.23 H new ATOM 0 HB3 LEU A 24 -7.254 -2.439 -0.243 1.00 0.23 H new ATOM 0 HG LEU A 24 -5.995 -2.113 2.459 1.00 0.53 H new ATOM 0 HD11 LEU A 24 -4.091 -0.928 1.394 1.00 1.32 H new ATOM 0 HD12 LEU A 24 -4.134 -2.653 0.958 1.00 1.32 H new ATOM 0 HD13 LEU A 24 -4.694 -1.427 -0.204 1.00 1.32 H new ATOM 0 HD21 LEU A 24 -6.132 0.288 1.907 1.00 1.41 H new ATOM 0 HD22 LEU A 24 -6.844 -0.126 0.330 1.00 1.41 H new ATOM 0 HD23 LEU A 24 -7.719 -0.513 1.830 1.00 1.41 H new ATOM 305 N ASN A 25 -9.379 -2.098 2.823 1.00 0.19 N ATOM 306 CA ASN A 25 -10.381 -1.104 3.132 1.00 0.19 C ATOM 307 C ASN A 25 -9.786 -0.112 4.069 1.00 0.18 C ATOM 308 O ASN A 25 -8.951 -0.464 4.868 1.00 0.22 O ATOM 309 CB ASN A 25 -11.595 -1.759 3.784 1.00 0.29 C ATOM 310 CG ASN A 25 -12.541 -2.366 2.781 1.00 0.92 C ATOM 311 OD1 ASN A 25 -12.319 -3.466 2.277 1.00 1.74 O ATOM 312 ND2 ASN A 25 -13.632 -1.673 2.509 1.00 1.72 N ATOM 0 H ASN A 25 -8.878 -2.449 3.639 1.00 0.19 H new ATOM 0 HA ASN A 25 -10.705 -0.613 2.214 1.00 0.19 H new ATOM 0 HB2 ASN A 25 -11.258 -2.533 4.473 1.00 0.29 H new ATOM 0 HB3 ASN A 25 -12.129 -1.016 4.376 1.00 0.29 H new ATOM 0 HD21 ASN A 25 -14.325 -2.047 1.861 1.00 1.72 H new ATOM 0 HD22 ASN A 25 -13.781 -0.764 2.947 1.00 1.72 H new ATOM 319 N ASP A 26 -10.206 1.114 3.969 1.00 0.16 N ATOM 320 CA ASP A 26 -9.828 2.095 4.942 1.00 0.17 C ATOM 321 C ASP A 26 -10.847 2.122 6.068 1.00 0.18 C ATOM 322 O ASP A 26 -11.772 1.314 6.102 1.00 0.20 O ATOM 323 CB ASP A 26 -9.824 3.496 4.312 1.00 0.19 C ATOM 324 CG ASP A 26 -10.858 3.724 3.239 1.00 0.40 C ATOM 325 OD1 ASP A 26 -11.864 2.998 3.207 1.00 0.66 O ATOM 326 OD2 ASP A 26 -10.635 4.587 2.388 1.00 1.04 O ATOM 0 H ASP A 26 -10.811 1.459 3.223 1.00 0.16 H new ATOM 0 HA ASP A 26 -8.836 1.834 5.312 1.00 0.17 H new ATOM 0 HB2 ASP A 26 -9.976 4.232 5.102 1.00 0.19 H new ATOM 0 HB3 ASP A 26 -8.837 3.683 3.888 1.00 0.19 H new ATOM 331 N ALA A 27 -10.620 3.007 7.025 1.00 0.21 N ATOM 332 CA ALA A 27 -11.583 3.282 8.083 1.00 0.25 C ATOM 333 C ALA A 27 -12.767 4.022 7.497 1.00 0.24 C ATOM 334 O ALA A 27 -13.816 4.153 8.128 1.00 0.28 O ATOM 335 CB ALA A 27 -10.956 4.088 9.209 1.00 0.32 C ATOM 0 H ALA A 27 -9.763 3.556 7.092 1.00 0.21 H new ATOM 0 HA ALA A 27 -11.916 2.335 8.508 1.00 0.25 H new ATOM 0 HB1 ALA A 27 -11.702 4.275 9.981 1.00 0.32 H new ATOM 0 HB2 ALA A 27 -10.123 3.529 9.637 1.00 0.32 H new ATOM 0 HB3 ALA A 27 -10.592 5.038 8.818 1.00 0.32 H new ATOM 341 N LEU A 28 -12.580 4.511 6.274 1.00 0.21 N ATOM 342 CA LEU A 28 -13.704 5.042 5.498 1.00 0.24 C ATOM 343 C LEU A 28 -14.535 3.877 5.010 1.00 0.23 C ATOM 344 O LEU A 28 -15.665 4.020 4.540 1.00 0.29 O ATOM 345 CB LEU A 28 -13.234 5.859 4.297 1.00 0.25 C ATOM 346 CG LEU A 28 -12.563 7.174 4.628 1.00 0.31 C ATOM 347 CD1 LEU A 28 -12.216 7.910 3.345 1.00 0.48 C ATOM 348 CD2 LEU A 28 -13.476 8.020 5.506 1.00 0.48 C ATOM 0 H LEU A 28 -11.677 4.552 5.802 1.00 0.21 H new ATOM 0 HA LEU A 28 -14.285 5.704 6.140 1.00 0.24 H new ATOM 0 HB2 LEU A 28 -12.539 5.252 3.716 1.00 0.25 H new ATOM 0 HB3 LEU A 28 -14.093 6.060 3.657 1.00 0.25 H new ATOM 0 HG LEU A 28 -11.642 6.981 5.178 1.00 0.31 H new ATOM 0 HD11 LEU A 28 -11.733 8.856 3.588 1.00 0.48 H new ATOM 0 HD12 LEU A 28 -11.539 7.300 2.747 1.00 0.48 H new ATOM 0 HD13 LEU A 28 -13.127 8.102 2.778 1.00 0.48 H new ATOM 0 HD21 LEU A 28 -12.984 8.964 5.739 1.00 0.48 H new ATOM 0 HD22 LEU A 28 -14.409 8.217 4.977 1.00 0.48 H new ATOM 0 HD23 LEU A 28 -13.690 7.485 6.431 1.00 0.48 H new ATOM 360 N ASN A 29 -13.901 2.729 5.156 1.00 0.20 N ATOM 361 CA ASN A 29 -14.365 1.443 4.690 1.00 0.23 C ATOM 362 C ASN A 29 -14.743 1.531 3.245 1.00 0.24 C ATOM 363 O ASN A 29 -15.912 1.436 2.885 1.00 0.28 O ATOM 364 CB ASN A 29 -15.571 0.941 5.462 1.00 0.29 C ATOM 365 CG ASN A 29 -15.483 1.169 6.956 1.00 0.60 C ATOM 366 OD1 ASN A 29 -14.872 0.382 7.682 1.00 1.32 O ATOM 367 ND2 ASN A 29 -16.137 2.213 7.430 1.00 1.30 N ATOM 0 H ASN A 29 -12.999 2.669 5.629 1.00 0.20 H new ATOM 0 HA ASN A 29 -13.543 0.743 4.842 1.00 0.23 H new ATOM 0 HB2 ASN A 29 -16.465 1.435 5.081 1.00 0.29 H new ATOM 0 HB3 ASN A 29 -15.692 -0.126 5.274 1.00 0.29 H new ATOM 0 HD21 ASN A 29 -16.150 2.394 8.434 1.00 1.30 H new ATOM 0 HD22 ASN A 29 -16.629 2.839 6.793 1.00 1.30 H new ATOM 374 N GLN A 30 -13.746 1.656 2.415 1.00 0.23 N ATOM 375 CA GLN A 30 -13.940 1.570 1.011 1.00 0.24 C ATOM 376 C GLN A 30 -12.889 0.644 0.480 1.00 0.22 C ATOM 377 O GLN A 30 -11.695 0.916 0.594 1.00 0.28 O ATOM 378 CB GLN A 30 -13.817 2.954 0.382 1.00 0.36 C ATOM 379 CG GLN A 30 -14.641 4.011 1.094 1.00 0.98 C ATOM 380 CD GLN A 30 -16.128 3.917 0.812 1.00 1.41 C ATOM 381 OE1 GLN A 30 -16.547 3.536 -0.279 1.00 2.21 O ATOM 382 NE2 GLN A 30 -16.940 4.257 1.800 1.00 1.84 N ATOM 0 H GLN A 30 -12.781 1.820 2.701 1.00 0.23 H new ATOM 0 HA GLN A 30 -14.934 1.192 0.771 1.00 0.24 H new ATOM 0 HB2 GLN A 30 -12.770 3.256 0.386 1.00 0.36 H new ATOM 0 HB3 GLN A 30 -14.129 2.901 -0.661 1.00 0.36 H new ATOM 0 HG2 GLN A 30 -14.478 3.924 2.168 1.00 0.98 H new ATOM 0 HG3 GLN A 30 -14.285 4.998 0.797 1.00 0.98 H new ATOM 0 HE21 GLN A 30 -16.555 4.569 2.692 1.00 1.84 H new ATOM 0 HE22 GLN A 30 -17.950 4.207 1.670 1.00 1.84 H new ATOM 391 N SER A 31 -13.322 -0.469 -0.057 1.00 0.23 N ATOM 392 CA SER A 31 -12.399 -1.398 -0.623 1.00 0.26 C ATOM 393 C SER A 31 -11.767 -0.736 -1.825 1.00 0.21 C ATOM 394 O SER A 31 -12.451 -0.344 -2.765 1.00 0.21 O ATOM 395 CB SER A 31 -13.148 -2.666 -1.019 1.00 0.36 C ATOM 396 OG SER A 31 -13.826 -3.207 0.094 1.00 1.23 O ATOM 0 H SER A 31 -14.302 -0.745 -0.110 1.00 0.23 H new ATOM 0 HA SER A 31 -11.622 -1.677 0.088 1.00 0.26 H new ATOM 0 HB2 SER A 31 -13.861 -2.442 -1.813 1.00 0.36 H new ATOM 0 HB3 SER A 31 -12.448 -3.400 -1.418 1.00 0.36 H new ATOM 0 HG SER A 31 -13.179 -3.623 0.701 1.00 1.23 H new ATOM 402 N ILE A 32 -10.462 -0.619 -1.798 1.00 0.21 N ATOM 403 CA ILE A 32 -9.772 0.126 -2.818 1.00 0.20 C ATOM 404 C ILE A 32 -9.729 -0.666 -4.135 1.00 0.21 C ATOM 405 O ILE A 32 -8.978 -1.627 -4.267 1.00 0.24 O ATOM 406 CB ILE A 32 -8.340 0.512 -2.379 1.00 0.24 C ATOM 407 CG1 ILE A 32 -7.557 1.116 -3.546 1.00 1.11 C ATOM 408 CG2 ILE A 32 -7.606 -0.690 -1.819 1.00 1.23 C ATOM 409 CD1 ILE A 32 -8.256 2.275 -4.213 1.00 1.72 C ATOM 0 H ILE A 32 -9.860 -1.029 -1.084 1.00 0.21 H new ATOM 0 HA ILE A 32 -10.331 1.048 -2.978 1.00 0.20 H new ATOM 0 HB ILE A 32 -8.422 1.263 -1.593 1.00 0.24 H new ATOM 0 HG12 ILE A 32 -6.584 1.450 -3.185 1.00 1.11 H new ATOM 0 HG13 ILE A 32 -7.372 0.339 -4.288 1.00 1.11 H new ATOM 0 HG21 ILE A 32 -6.601 -0.394 -1.517 1.00 1.23 H new ATOM 0 HG22 ILE A 32 -8.146 -1.076 -0.954 1.00 1.23 H new ATOM 0 HG23 ILE A 32 -7.542 -1.465 -2.582 1.00 1.23 H new ATOM 0 HD11 ILE A 32 -7.640 2.650 -5.030 1.00 1.72 H new ATOM 0 HD12 ILE A 32 -9.217 1.943 -4.606 1.00 1.72 H new ATOM 0 HD13 ILE A 32 -8.417 3.070 -3.485 1.00 1.72 H new ATOM 421 N ILE A 33 -10.566 -0.298 -5.091 1.00 0.21 N ATOM 422 CA ILE A 33 -10.631 -1.034 -6.352 1.00 0.24 C ATOM 423 C ILE A 33 -9.838 -0.300 -7.438 1.00 0.24 C ATOM 424 O ILE A 33 -9.610 0.910 -7.357 1.00 0.24 O ATOM 425 CB ILE A 33 -12.091 -1.207 -6.830 1.00 0.28 C ATOM 426 CG1 ILE A 33 -13.014 -1.518 -5.647 1.00 0.80 C ATOM 427 CG2 ILE A 33 -12.186 -2.313 -7.874 1.00 0.77 C ATOM 428 CD1 ILE A 33 -14.479 -1.614 -6.021 1.00 0.91 C ATOM 0 H ILE A 33 -11.204 0.495 -5.025 1.00 0.21 H new ATOM 0 HA ILE A 33 -10.199 -2.019 -6.176 1.00 0.24 H new ATOM 0 HB ILE A 33 -12.412 -0.270 -7.285 1.00 0.28 H new ATOM 0 HG12 ILE A 33 -12.702 -2.459 -5.193 1.00 0.80 H new ATOM 0 HG13 ILE A 33 -12.892 -0.743 -4.890 1.00 0.80 H new ATOM 0 HG21 ILE A 33 -13.221 -2.420 -8.198 1.00 0.77 H new ATOM 0 HG22 ILE A 33 -11.562 -2.059 -8.731 1.00 0.77 H new ATOM 0 HG23 ILE A 33 -11.843 -3.253 -7.441 1.00 0.77 H new ATOM 0 HD11 ILE A 33 -15.068 -1.836 -5.131 1.00 0.91 H new ATOM 0 HD12 ILE A 33 -14.809 -0.666 -6.447 1.00 0.91 H new ATOM 0 HD13 ILE A 33 -14.616 -2.409 -6.754 1.00 0.91 H new ATOM 440 N ARG A 34 -9.408 -1.047 -8.440 1.00 0.31 N ATOM 441 CA ARG A 34 -8.664 -0.492 -9.560 1.00 0.35 C ATOM 442 C ARG A 34 -9.617 0.154 -10.552 1.00 0.36 C ATOM 443 O ARG A 34 -10.430 -0.524 -11.177 1.00 0.42 O ATOM 444 CB ARG A 34 -7.855 -1.599 -10.240 1.00 0.48 C ATOM 445 CG ARG A 34 -7.187 -1.188 -11.539 1.00 1.04 C ATOM 446 CD ARG A 34 -6.445 -2.360 -12.159 1.00 1.16 C ATOM 447 NE ARG A 34 -5.994 -2.077 -13.519 1.00 1.48 N ATOM 448 CZ ARG A 34 -5.949 -2.993 -14.487 1.00 1.79 C ATOM 449 NH1 ARG A 34 -6.317 -4.246 -14.237 1.00 2.09 N ATOM 450 NH2 ARG A 34 -5.549 -2.659 -15.709 1.00 2.47 N ATOM 0 H ARG A 34 -9.564 -2.053 -8.501 1.00 0.31 H new ATOM 0 HA ARG A 34 -7.979 0.272 -9.192 1.00 0.35 H new ATOM 0 HB2 ARG A 34 -7.089 -1.948 -9.548 1.00 0.48 H new ATOM 0 HB3 ARG A 34 -8.515 -2.444 -10.438 1.00 0.48 H new ATOM 0 HG2 ARG A 34 -7.937 -0.816 -12.237 1.00 1.04 H new ATOM 0 HG3 ARG A 34 -6.492 -0.369 -11.353 1.00 1.04 H new ATOM 0 HD2 ARG A 34 -5.585 -2.611 -11.539 1.00 1.16 H new ATOM 0 HD3 ARG A 34 -7.096 -3.234 -12.170 1.00 1.16 H new ATOM 0 HE ARG A 34 -5.697 -1.127 -13.740 1.00 1.48 H new ATOM 0 HH11 ARG A 34 -6.634 -4.508 -13.304 1.00 2.09 H new ATOM 0 HH12 ARG A 34 -6.282 -4.945 -14.979 1.00 2.09 H new ATOM 0 HH21 ARG A 34 -5.274 -1.698 -15.911 1.00 2.47 H new ATOM 0 HH22 ARG A 34 -5.517 -3.364 -16.445 1.00 2.47 H new ATOM 464 N ALA A 35 -9.515 1.465 -10.689 1.00 0.37 N ATOM 465 CA ALA A 35 -10.346 2.192 -11.634 1.00 0.46 C ATOM 466 C ALA A 35 -9.630 2.245 -12.967 1.00 0.53 C ATOM 467 O ALA A 35 -10.235 2.121 -14.031 1.00 0.63 O ATOM 468 CB ALA A 35 -10.640 3.595 -11.123 1.00 0.54 C ATOM 0 H ALA A 35 -8.866 2.047 -10.159 1.00 0.37 H new ATOM 0 HA ALA A 35 -11.301 1.680 -11.752 1.00 0.46 H new ATOM 0 HB1 ALA A 35 -11.263 4.122 -11.845 1.00 0.54 H new ATOM 0 HB2 ALA A 35 -11.164 3.532 -10.169 1.00 0.54 H new ATOM 0 HB3 ALA A 35 -9.704 4.137 -10.988 1.00 0.54 H new ATOM 474 N ASN A 36 -8.323 2.415 -12.877 1.00 0.53 N ATOM 475 CA ASN A 36 -7.436 2.397 -14.026 1.00 0.66 C ATOM 476 C ASN A 36 -6.114 1.804 -13.586 1.00 0.65 C ATOM 477 O ASN A 36 -5.868 1.661 -12.392 1.00 0.55 O ATOM 478 CB ASN A 36 -7.212 3.810 -14.587 1.00 0.76 C ATOM 479 CG ASN A 36 -8.394 4.326 -15.386 1.00 1.43 C ATOM 480 OD1 ASN A 36 -8.511 4.056 -16.581 1.00 2.25 O ATOM 481 ND2 ASN A 36 -9.262 5.096 -14.746 1.00 1.93 N ATOM 0 H ASN A 36 -7.842 2.572 -11.992 1.00 0.53 H new ATOM 0 HA ASN A 36 -7.887 1.800 -14.819 1.00 0.66 H new ATOM 0 HB2 ASN A 36 -7.011 4.494 -13.763 1.00 0.76 H new ATOM 0 HB3 ASN A 36 -6.326 3.807 -15.221 1.00 0.76 H new ATOM 0 HD21 ASN A 36 -10.061 5.487 -15.245 1.00 1.93 H new ATOM 0 HD22 ASN A 36 -9.131 5.297 -13.755 1.00 1.93 H new ATOM 488 N ASP A 37 -5.269 1.449 -14.534 1.00 0.81 N ATOM 489 CA ASP A 37 -3.952 0.915 -14.210 1.00 0.88 C ATOM 490 C ASP A 37 -3.018 2.027 -13.741 1.00 0.79 C ATOM 491 O ASP A 37 -1.863 1.781 -13.411 1.00 0.88 O ATOM 492 CB ASP A 37 -3.351 0.176 -15.408 1.00 1.10 C ATOM 493 CG ASP A 37 -3.192 1.064 -16.620 1.00 1.76 C ATOM 494 OD1 ASP A 37 -4.211 1.421 -17.242 1.00 2.10 O ATOM 495 OD2 ASP A 37 -2.040 1.424 -16.938 1.00 2.51 O ATOM 0 H ASP A 37 -5.466 1.519 -15.532 1.00 0.81 H new ATOM 0 HA ASP A 37 -4.070 0.200 -13.396 1.00 0.88 H new ATOM 0 HB2 ASP A 37 -2.378 -0.229 -15.129 1.00 1.10 H new ATOM 0 HB3 ASP A 37 -3.988 -0.671 -15.664 1.00 1.10 H new ATOM 500 N GLN A 38 -3.526 3.255 -13.734 1.00 0.68 N ATOM 501 CA GLN A 38 -2.751 4.401 -13.291 1.00 0.60 C ATOM 502 C GLN A 38 -3.430 5.099 -12.114 1.00 0.44 C ATOM 503 O GLN A 38 -2.770 5.757 -11.311 1.00 0.39 O ATOM 504 CB GLN A 38 -2.579 5.397 -14.438 1.00 0.71 C ATOM 505 CG GLN A 38 -1.931 4.808 -15.678 1.00 1.53 C ATOM 506 CD GLN A 38 -1.753 5.833 -16.778 1.00 2.01 C ATOM 507 OE1 GLN A 38 -2.637 6.029 -17.612 1.00 2.57 O ATOM 508 NE2 GLN A 38 -0.610 6.495 -16.793 1.00 2.58 N ATOM 0 H GLN A 38 -4.475 3.479 -14.032 1.00 0.68 H new ATOM 0 HA GLN A 38 -1.774 4.040 -12.970 1.00 0.60 H new ATOM 0 HB2 GLN A 38 -3.556 5.797 -14.707 1.00 0.71 H new ATOM 0 HB3 GLN A 38 -1.976 6.236 -14.090 1.00 0.71 H new ATOM 0 HG2 GLN A 38 -0.960 4.390 -15.414 1.00 1.53 H new ATOM 0 HG3 GLN A 38 -2.542 3.985 -16.048 1.00 1.53 H new ATOM 0 HE21 GLN A 38 0.099 6.305 -16.085 1.00 2.58 H new ATOM 0 HE22 GLN A 38 -0.436 7.196 -17.513 1.00 2.58 H new ATOM 517 N TYR A 39 -4.753 4.961 -12.020 1.00 0.43 N ATOM 518 CA TYR A 39 -5.519 5.638 -10.978 1.00 0.41 C ATOM 519 C TYR A 39 -6.370 4.655 -10.189 1.00 0.34 C ATOM 520 O TYR A 39 -6.904 3.692 -10.742 1.00 0.36 O ATOM 521 CB TYR A 39 -6.409 6.730 -11.570 1.00 0.64 C ATOM 522 CG TYR A 39 -5.643 7.921 -12.094 1.00 0.92 C ATOM 523 CD1 TYR A 39 -4.792 8.640 -11.263 1.00 1.50 C ATOM 524 CD2 TYR A 39 -5.777 8.334 -13.411 1.00 1.31 C ATOM 525 CE1 TYR A 39 -4.093 9.735 -11.732 1.00 2.23 C ATOM 526 CE2 TYR A 39 -5.080 9.428 -13.888 1.00 1.97 C ATOM 527 CZ TYR A 39 -4.241 10.124 -13.045 1.00 2.39 C ATOM 528 OH TYR A 39 -3.551 11.214 -13.518 1.00 3.17 O ATOM 0 H TYR A 39 -5.313 4.388 -12.651 1.00 0.43 H new ATOM 0 HA TYR A 39 -4.800 6.098 -10.300 1.00 0.41 H new ATOM 0 HB2 TYR A 39 -7.000 6.304 -12.381 1.00 0.64 H new ATOM 0 HB3 TYR A 39 -7.111 7.068 -10.807 1.00 0.64 H new ATOM 0 HD1 TYR A 39 -4.675 8.337 -10.233 1.00 1.50 H new ATOM 0 HD2 TYR A 39 -6.436 7.793 -14.074 1.00 1.31 H new ATOM 0 HE1 TYR A 39 -3.435 10.283 -11.074 1.00 2.23 H new ATOM 0 HE2 TYR A 39 -5.192 9.736 -14.917 1.00 1.97 H new ATOM 0 HH TYR A 39 -3.767 11.353 -14.464 1.00 3.17 H new ATOM 538 N LEU A 40 -6.525 4.926 -8.905 1.00 0.31 N ATOM 539 CA LEU A 40 -7.260 4.043 -8.012 1.00 0.28 C ATOM 540 C LEU A 40 -8.301 4.808 -7.204 1.00 0.25 C ATOM 541 O LEU A 40 -8.041 5.907 -6.714 1.00 0.29 O ATOM 542 CB LEU A 40 -6.282 3.332 -7.080 1.00 0.30 C ATOM 543 CG LEU A 40 -6.324 1.807 -7.146 1.00 0.51 C ATOM 544 CD1 LEU A 40 -6.018 1.327 -8.554 1.00 1.21 C ATOM 545 CD2 LEU A 40 -5.337 1.203 -6.161 1.00 1.31 C ATOM 0 H LEU A 40 -6.148 5.759 -8.453 1.00 0.31 H new ATOM 0 HA LEU A 40 -7.790 3.306 -8.616 1.00 0.28 H new ATOM 0 HB2 LEU A 40 -5.271 3.664 -7.317 1.00 0.30 H new ATOM 0 HB3 LEU A 40 -6.488 3.643 -6.056 1.00 0.30 H new ATOM 0 HG LEU A 40 -7.329 1.481 -6.876 1.00 0.51 H new ATOM 0 HD11 LEU A 40 -6.052 0.238 -8.583 1.00 1.21 H new ATOM 0 HD12 LEU A 40 -6.757 1.732 -9.245 1.00 1.21 H new ATOM 0 HD13 LEU A 40 -5.024 1.667 -8.846 1.00 1.21 H new ATOM 0 HD21 LEU A 40 -5.381 0.116 -6.222 1.00 1.31 H new ATOM 0 HD22 LEU A 40 -4.329 1.540 -6.403 1.00 1.31 H new ATOM 0 HD23 LEU A 40 -5.592 1.520 -5.150 1.00 1.31 H new ATOM 557 N THR A 41 -9.485 4.221 -7.089 1.00 0.24 N ATOM 558 CA THR A 41 -10.569 4.801 -6.314 1.00 0.22 C ATOM 559 C THR A 41 -11.123 3.748 -5.357 1.00 0.19 C ATOM 560 O THR A 41 -11.317 2.591 -5.731 1.00 0.21 O ATOM 561 CB THR A 41 -11.695 5.307 -7.238 1.00 0.27 C ATOM 562 OG1 THR A 41 -11.139 6.148 -8.260 1.00 1.36 O ATOM 563 CG2 THR A 41 -12.741 6.084 -6.452 1.00 1.28 C ATOM 0 H THR A 41 -9.719 3.331 -7.530 1.00 0.24 H new ATOM 0 HA THR A 41 -10.182 5.649 -5.750 1.00 0.22 H new ATOM 0 HB THR A 41 -12.179 4.443 -7.692 1.00 0.27 H new ATOM 0 HG1 THR A 41 -11.856 6.467 -8.847 1.00 1.36 H new ATOM 0 HG21 THR A 41 -13.523 6.429 -7.129 1.00 1.28 H new ATOM 0 HG22 THR A 41 -13.179 5.438 -5.691 1.00 1.28 H new ATOM 0 HG23 THR A 41 -12.272 6.943 -5.972 1.00 1.28 H new ATOM 571 N ALA A 42 -11.354 4.152 -4.126 1.00 0.19 N ATOM 572 CA ALA A 42 -11.846 3.247 -3.097 1.00 0.20 C ATOM 573 C ALA A 42 -13.370 3.223 -3.043 1.00 0.20 C ATOM 574 O ALA A 42 -14.027 4.249 -3.202 1.00 0.27 O ATOM 575 CB ALA A 42 -11.268 3.628 -1.747 1.00 0.26 C ATOM 0 H ALA A 42 -11.209 5.110 -3.807 1.00 0.19 H new ATOM 0 HA ALA A 42 -11.517 2.240 -3.354 1.00 0.20 H new ATOM 0 HB1 ALA A 42 -11.643 2.945 -0.985 1.00 0.26 H new ATOM 0 HB2 ALA A 42 -10.180 3.567 -1.786 1.00 0.26 H new ATOM 0 HB3 ALA A 42 -11.565 4.647 -1.498 1.00 0.26 H new ATOM 581 N ALA A 43 -13.918 2.033 -2.838 1.00 0.20 N ATOM 582 CA ALA A 43 -15.369 1.843 -2.761 1.00 0.29 C ATOM 583 C ALA A 43 -15.735 0.676 -1.836 1.00 0.35 C ATOM 584 O ALA A 43 -15.179 -0.413 -1.944 1.00 0.40 O ATOM 585 CB ALA A 43 -15.939 1.608 -4.152 1.00 0.38 C ATOM 0 H ALA A 43 -13.379 1.175 -2.721 1.00 0.20 H new ATOM 0 HA ALA A 43 -15.804 2.750 -2.341 1.00 0.29 H new ATOM 0 HB1 ALA A 43 -17.018 1.468 -4.084 1.00 0.38 H new ATOM 0 HB2 ALA A 43 -15.724 2.470 -4.784 1.00 0.38 H new ATOM 0 HB3 ALA A 43 -15.484 0.718 -4.586 1.00 0.38 H new ATOM 591 N ALA A 44 -16.709 0.912 -0.960 1.00 0.63 N ATOM 592 CA ALA A 44 -17.114 -0.041 0.074 1.00 0.65 C ATOM 593 C ALA A 44 -17.551 -1.397 -0.475 1.00 0.46 C ATOM 594 O ALA A 44 -18.385 -1.489 -1.376 1.00 0.79 O ATOM 595 CB ALA A 44 -18.237 0.556 0.905 1.00 1.13 C ATOM 0 H ALA A 44 -17.246 1.779 -0.947 1.00 0.63 H new ATOM 0 HA ALA A 44 -16.231 -0.225 0.686 1.00 0.65 H new ATOM 0 HB1 ALA A 44 -18.538 -0.155 1.675 1.00 1.13 H new ATOM 0 HB2 ALA A 44 -17.891 1.476 1.376 1.00 1.13 H new ATOM 0 HB3 ALA A 44 -19.089 0.776 0.261 1.00 1.13 H new ATOM 601 N LEU A 45 -16.975 -2.441 0.111 1.00 0.47 N ATOM 602 CA LEU A 45 -17.279 -3.824 -0.216 1.00 0.66 C ATOM 603 C LEU A 45 -18.673 -4.233 0.232 1.00 0.62 C ATOM 604 O LEU A 45 -19.245 -3.670 1.168 1.00 0.88 O ATOM 605 CB LEU A 45 -16.238 -4.786 0.408 1.00 1.23 C ATOM 606 CG LEU A 45 -16.183 -4.923 1.958 1.00 2.25 C ATOM 607 CD1 LEU A 45 -16.155 -3.575 2.662 1.00 2.87 C ATOM 608 CD2 LEU A 45 -17.322 -5.778 2.497 1.00 2.93 C ATOM 0 H LEU A 45 -16.270 -2.344 0.841 1.00 0.47 H new ATOM 0 HA LEU A 45 -17.237 -3.896 -1.303 1.00 0.66 H new ATOM 0 HB2 LEU A 45 -16.415 -5.779 -0.006 1.00 1.23 H new ATOM 0 HB3 LEU A 45 -15.251 -4.471 0.069 1.00 1.23 H new ATOM 0 HG LEU A 45 -15.243 -5.430 2.178 1.00 2.25 H new ATOM 0 HD11 LEU A 45 -16.117 -3.728 3.740 1.00 2.87 H new ATOM 0 HD12 LEU A 45 -15.275 -3.016 2.344 1.00 2.87 H new ATOM 0 HD13 LEU A 45 -17.053 -3.013 2.407 1.00 2.87 H new ATOM 0 HD21 LEU A 45 -17.244 -5.846 3.582 1.00 2.93 H new ATOM 0 HD22 LEU A 45 -18.276 -5.324 2.230 1.00 2.93 H new ATOM 0 HD23 LEU A 45 -17.263 -6.777 2.065 1.00 2.93 H new ATOM 620 N HIS A 46 -19.200 -5.215 -0.468 1.00 0.61 N ATOM 621 CA HIS A 46 -20.415 -5.901 -0.063 1.00 0.80 C ATOM 622 C HIS A 46 -20.260 -7.392 -0.348 1.00 0.76 C ATOM 623 O HIS A 46 -21.010 -8.221 0.167 1.00 0.94 O ATOM 624 CB HIS A 46 -21.663 -5.318 -0.751 1.00 1.06 C ATOM 625 CG HIS A 46 -21.484 -4.962 -2.196 1.00 1.87 C ATOM 626 ND1 HIS A 46 -21.270 -3.670 -2.620 1.00 2.69 N ATOM 627 CD2 HIS A 46 -21.516 -5.722 -3.316 1.00 2.79 C ATOM 628 CE1 HIS A 46 -21.174 -3.649 -3.932 1.00 3.63 C ATOM 629 NE2 HIS A 46 -21.320 -4.878 -4.380 1.00 3.71 N ATOM 0 H HIS A 46 -18.798 -5.564 -1.338 1.00 0.61 H new ATOM 0 HA HIS A 46 -20.564 -5.753 1.007 1.00 0.80 H new ATOM 0 HB2 HIS A 46 -22.475 -6.040 -0.669 1.00 1.06 H new ATOM 0 HB3 HIS A 46 -21.974 -4.425 -0.209 1.00 1.06 H new ATOM 0 HD2 HIS A 46 -21.667 -6.790 -3.363 1.00 2.79 H new ATOM 0 HE1 HIS A 46 -21.004 -2.772 -4.539 1.00 3.63 H new ATOM 0 HE2 HIS A 46 -21.292 -5.158 -5.360 1.00 3.71 H new ATOM 638 N ASN A 47 -19.267 -7.720 -1.175 1.00 0.66 N ATOM 639 CA ASN A 47 -18.829 -9.106 -1.357 1.00 0.71 C ATOM 640 C ASN A 47 -17.611 -9.395 -0.480 1.00 0.76 C ATOM 641 O ASN A 47 -17.102 -10.519 -0.468 1.00 0.88 O ATOM 642 CB ASN A 47 -18.416 -9.346 -2.809 1.00 0.74 C ATOM 643 CG ASN A 47 -18.243 -10.822 -3.136 1.00 1.42 C ATOM 644 OD1 ASN A 47 -18.949 -11.681 -2.607 1.00 2.21 O ATOM 645 ND2 ASN A 47 -17.287 -11.127 -4.001 1.00 1.94 N ATOM 0 H ASN A 47 -18.748 -7.042 -1.732 1.00 0.66 H new ATOM 0 HA ASN A 47 -19.661 -9.756 -1.084 1.00 0.71 H new ATOM 0 HB2 ASN A 47 -19.168 -8.917 -3.472 1.00 0.74 H new ATOM 0 HB3 ASN A 47 -17.481 -8.822 -3.007 1.00 0.74 H new ATOM 0 HD21 ASN A 47 -17.116 -12.101 -4.249 1.00 1.94 H new ATOM 0 HD22 ASN A 47 -16.722 -10.387 -4.419 1.00 1.94 H new ATOM 652 N LEU A 48 -17.162 -8.377 0.263 1.00 0.77 N ATOM 653 CA LEU A 48 -15.853 -8.401 0.929 1.00 0.89 C ATOM 654 C LEU A 48 -14.739 -8.366 -0.120 1.00 0.81 C ATOM 655 O LEU A 48 -14.003 -7.389 -0.221 1.00 0.78 O ATOM 656 CB LEU A 48 -15.722 -9.617 1.856 1.00 1.15 C ATOM 657 CG LEU A 48 -16.622 -9.583 3.095 1.00 1.37 C ATOM 658 CD1 LEU A 48 -16.747 -10.969 3.707 1.00 1.71 C ATOM 659 CD2 LEU A 48 -16.070 -8.607 4.123 1.00 1.66 C ATOM 0 H LEU A 48 -17.691 -7.519 0.419 1.00 0.77 H new ATOM 0 HA LEU A 48 -15.761 -7.515 1.558 1.00 0.89 H new ATOM 0 HB2 LEU A 48 -15.949 -10.517 1.285 1.00 1.15 H new ATOM 0 HB3 LEU A 48 -14.685 -9.698 2.180 1.00 1.15 H new ATOM 0 HG LEU A 48 -17.613 -9.249 2.787 1.00 1.37 H new ATOM 0 HD11 LEU A 48 -17.390 -10.922 4.586 1.00 1.71 H new ATOM 0 HD12 LEU A 48 -17.180 -11.652 2.976 1.00 1.71 H new ATOM 0 HD13 LEU A 48 -15.760 -11.328 3.999 1.00 1.71 H new ATOM 0 HD21 LEU A 48 -16.720 -8.594 4.998 1.00 1.66 H new ATOM 0 HD22 LEU A 48 -15.069 -8.919 4.420 1.00 1.66 H new ATOM 0 HD23 LEU A 48 -16.025 -7.608 3.689 1.00 1.66 H new ATOM 671 N ASP A 49 -14.661 -9.409 -0.928 1.00 0.83 N ATOM 672 CA ASP A 49 -13.724 -9.467 -2.050 1.00 0.83 C ATOM 673 C ASP A 49 -14.292 -8.631 -3.188 1.00 0.75 C ATOM 674 O ASP A 49 -15.032 -9.124 -4.041 1.00 0.83 O ATOM 675 CB ASP A 49 -13.537 -10.920 -2.513 1.00 1.00 C ATOM 676 CG ASP A 49 -12.379 -11.117 -3.482 1.00 1.20 C ATOM 677 OD1 ASP A 49 -12.341 -10.443 -4.532 1.00 1.53 O ATOM 678 OD2 ASP A 49 -11.518 -11.982 -3.207 1.00 1.87 O ATOM 0 H ASP A 49 -15.242 -10.241 -0.830 1.00 0.83 H new ATOM 0 HA ASP A 49 -12.753 -9.079 -1.743 1.00 0.83 H new ATOM 0 HB2 ASP A 49 -13.377 -11.551 -1.639 1.00 1.00 H new ATOM 0 HB3 ASP A 49 -14.457 -11.260 -2.988 1.00 1.00 H new ATOM 683 N GLU A 50 -13.956 -7.358 -3.168 1.00 0.66 N ATOM 684 CA GLU A 50 -14.569 -6.371 -4.042 1.00 0.72 C ATOM 685 C GLU A 50 -13.499 -5.401 -4.512 1.00 0.62 C ATOM 686 O GLU A 50 -13.533 -4.899 -5.635 1.00 0.68 O ATOM 687 CB GLU A 50 -15.632 -5.613 -3.248 1.00 0.94 C ATOM 688 CG GLU A 50 -16.629 -4.851 -4.093 1.00 1.25 C ATOM 689 CD GLU A 50 -17.975 -5.536 -4.113 1.00 1.93 C ATOM 690 OE1 GLU A 50 -18.508 -5.848 -3.027 1.00 2.66 O ATOM 691 OE2 GLU A 50 -18.510 -5.754 -5.227 1.00 2.35 O ATOM 0 H GLU A 50 -13.247 -6.974 -2.543 1.00 0.66 H new ATOM 0 HA GLU A 50 -15.027 -6.856 -4.904 1.00 0.72 H new ATOM 0 HB2 GLU A 50 -16.174 -6.323 -2.623 1.00 0.94 H new ATOM 0 HB3 GLU A 50 -15.134 -4.913 -2.577 1.00 0.94 H new ATOM 0 HG2 GLU A 50 -16.740 -3.839 -3.703 1.00 1.25 H new ATOM 0 HG3 GLU A 50 -16.251 -4.760 -5.111 1.00 1.25 H new ATOM 698 N ALA A 51 -12.537 -5.177 -3.638 1.00 0.52 N ATOM 699 CA ALA A 51 -11.365 -4.380 -3.950 1.00 0.43 C ATOM 700 C ALA A 51 -10.327 -5.211 -4.671 1.00 0.32 C ATOM 701 O ALA A 51 -10.384 -6.443 -4.662 1.00 0.33 O ATOM 702 CB ALA A 51 -10.742 -3.839 -2.681 1.00 0.50 C ATOM 0 H ALA A 51 -12.546 -5.544 -2.686 1.00 0.52 H new ATOM 0 HA ALA A 51 -11.687 -3.558 -4.589 1.00 0.43 H new ATOM 0 HB1 ALA A 51 -9.864 -3.243 -2.932 1.00 0.50 H new ATOM 0 HB2 ALA A 51 -11.466 -3.215 -2.157 1.00 0.50 H new ATOM 0 HB3 ALA A 51 -10.446 -4.668 -2.039 1.00 0.50 H new ATOM 708 N VAL A 52 -9.389 -4.531 -5.300 1.00 0.28 N ATOM 709 CA VAL A 52 -8.210 -5.189 -5.789 1.00 0.26 C ATOM 710 C VAL A 52 -7.394 -5.594 -4.588 1.00 0.22 C ATOM 711 O VAL A 52 -7.198 -4.826 -3.647 1.00 0.23 O ATOM 712 CB VAL A 52 -7.357 -4.333 -6.755 1.00 0.29 C ATOM 713 CG1 VAL A 52 -8.052 -4.200 -8.096 1.00 0.38 C ATOM 714 CG2 VAL A 52 -7.060 -2.959 -6.175 1.00 0.31 C ATOM 0 H VAL A 52 -9.426 -3.528 -5.480 1.00 0.28 H new ATOM 0 HA VAL A 52 -8.524 -6.048 -6.382 1.00 0.26 H new ATOM 0 HB VAL A 52 -6.405 -4.845 -6.897 1.00 0.29 H new ATOM 0 HG11 VAL A 52 -7.440 -3.595 -8.765 1.00 0.38 H new ATOM 0 HG12 VAL A 52 -8.196 -5.189 -8.531 1.00 0.38 H new ATOM 0 HG13 VAL A 52 -9.021 -3.720 -7.958 1.00 0.38 H new ATOM 0 HG21 VAL A 52 -6.459 -2.388 -6.882 1.00 0.31 H new ATOM 0 HG22 VAL A 52 -7.996 -2.433 -5.987 1.00 0.31 H new ATOM 0 HG23 VAL A 52 -6.512 -3.070 -5.240 1.00 0.31 H new ATOM 724 N LYS A 53 -6.967 -6.817 -4.620 1.00 0.22 N ATOM 725 CA LYS A 53 -6.427 -7.480 -3.449 1.00 0.22 C ATOM 726 C LYS A 53 -4.941 -7.317 -3.430 1.00 0.18 C ATOM 727 O LYS A 53 -4.254 -7.627 -4.398 1.00 0.24 O ATOM 728 CB LYS A 53 -6.792 -8.966 -3.497 1.00 0.35 C ATOM 729 CG LYS A 53 -8.238 -9.212 -3.902 1.00 0.78 C ATOM 730 CD LYS A 53 -8.507 -10.679 -4.192 1.00 1.12 C ATOM 731 CE LYS A 53 -8.457 -11.518 -2.931 1.00 1.37 C ATOM 732 NZ LYS A 53 -8.695 -12.958 -3.209 1.00 1.59 N ATOM 0 H LYS A 53 -6.978 -7.397 -5.459 1.00 0.22 H new ATOM 0 HA LYS A 53 -6.846 -7.038 -2.545 1.00 0.22 H new ATOM 0 HB2 LYS A 53 -6.132 -9.474 -4.201 1.00 0.35 H new ATOM 0 HB3 LYS A 53 -6.615 -9.410 -2.517 1.00 0.35 H new ATOM 0 HG2 LYS A 53 -8.900 -8.873 -3.105 1.00 0.78 H new ATOM 0 HG3 LYS A 53 -8.473 -8.619 -4.786 1.00 0.78 H new ATOM 0 HD2 LYS A 53 -9.486 -10.784 -4.660 1.00 1.12 H new ATOM 0 HD3 LYS A 53 -7.771 -11.050 -4.905 1.00 1.12 H new ATOM 0 HE2 LYS A 53 -7.484 -11.397 -2.454 1.00 1.37 H new ATOM 0 HE3 LYS A 53 -9.205 -11.157 -2.226 1.00 1.37 H new ATOM 0 HZ1 LYS A 53 -8.486 -13.515 -2.356 1.00 1.59 H new ATOM 0 HZ2 LYS A 53 -9.689 -13.099 -3.481 1.00 1.59 H new ATOM 0 HZ3 LYS A 53 -8.076 -13.269 -3.985 1.00 1.59 H new ATOM 746 N PHE A 54 -4.453 -6.813 -2.322 1.00 0.18 N ATOM 747 CA PHE A 54 -3.083 -6.486 -2.202 1.00 0.19 C ATOM 748 C PHE A 54 -2.366 -7.577 -1.466 1.00 0.20 C ATOM 749 O PHE A 54 -2.974 -8.471 -0.869 1.00 0.23 O ATOM 750 CB PHE A 54 -2.910 -5.152 -1.469 1.00 0.25 C ATOM 751 CG PHE A 54 -3.316 -3.952 -2.279 1.00 1.22 C ATOM 752 CD1 PHE A 54 -4.641 -3.552 -2.328 1.00 1.57 C ATOM 753 CD2 PHE A 54 -2.378 -3.232 -2.998 1.00 1.95 C ATOM 754 CE1 PHE A 54 -5.024 -2.458 -3.080 1.00 2.60 C ATOM 755 CE2 PHE A 54 -2.755 -2.134 -3.748 1.00 2.98 C ATOM 756 CZ PHE A 54 -4.058 -1.722 -3.763 1.00 3.31 C ATOM 0 H PHE A 54 -5.008 -6.624 -1.487 1.00 0.18 H new ATOM 0 HA PHE A 54 -2.657 -6.386 -3.200 1.00 0.19 H new ATOM 0 HB2 PHE A 54 -3.498 -5.174 -0.552 1.00 0.25 H new ATOM 0 HB3 PHE A 54 -1.866 -5.043 -1.176 1.00 0.25 H new ATOM 0 HD1 PHE A 54 -5.385 -4.102 -1.771 1.00 1.57 H new ATOM 0 HD2 PHE A 54 -1.341 -3.531 -2.973 1.00 1.95 H new ATOM 0 HE1 PHE A 54 -6.065 -2.175 -3.138 1.00 2.60 H new ATOM 0 HE2 PHE A 54 -2.016 -1.599 -4.325 1.00 2.98 H new ATOM 0 HZ PHE A 54 -4.338 -0.829 -4.302 1.00 3.31 H new ATOM 766 N ASP A 55 -1.081 -7.492 -1.546 1.00 0.21 N ATOM 767 CA ASP A 55 -0.196 -8.410 -0.886 1.00 0.22 C ATOM 768 C ASP A 55 0.948 -7.616 -0.328 1.00 0.23 C ATOM 769 O ASP A 55 1.523 -6.766 -1.011 1.00 0.27 O ATOM 770 CB ASP A 55 0.311 -9.457 -1.883 1.00 0.24 C ATOM 771 CG ASP A 55 1.658 -10.059 -1.502 1.00 1.33 C ATOM 772 OD1 ASP A 55 1.683 -11.029 -0.729 1.00 1.89 O ATOM 773 OD2 ASP A 55 2.690 -9.588 -2.029 1.00 1.93 O ATOM 0 H ASP A 55 -0.600 -6.770 -2.082 1.00 0.21 H new ATOM 0 HA ASP A 55 -0.714 -8.937 -0.084 1.00 0.22 H new ATOM 0 HB2 ASP A 55 -0.425 -10.257 -1.963 1.00 0.24 H new ATOM 0 HB3 ASP A 55 0.393 -8.999 -2.869 1.00 0.24 H new ATOM 778 N MET A 56 1.223 -7.856 0.929 1.00 0.24 N ATOM 779 CA MET A 56 2.270 -7.181 1.615 1.00 0.25 C ATOM 780 C MET A 56 3.410 -8.134 1.812 1.00 0.25 C ATOM 781 O MET A 56 3.225 -9.277 2.222 1.00 0.30 O ATOM 782 CB MET A 56 1.780 -6.671 2.968 1.00 0.33 C ATOM 783 CG MET A 56 0.657 -5.651 2.871 1.00 0.97 C ATOM 784 SD MET A 56 -0.089 -5.281 4.470 1.00 1.19 S ATOM 785 CE MET A 56 1.352 -4.779 5.406 1.00 1.85 C ATOM 0 H MET A 56 0.717 -8.532 1.500 1.00 0.24 H new ATOM 0 HA MET A 56 2.597 -6.325 1.025 1.00 0.25 H new ATOM 0 HB2 MET A 56 1.438 -7.518 3.563 1.00 0.33 H new ATOM 0 HB3 MET A 56 2.618 -6.224 3.502 1.00 0.33 H new ATOM 0 HG2 MET A 56 1.045 -4.731 2.434 1.00 0.97 H new ATOM 0 HG3 MET A 56 -0.111 -6.026 2.195 1.00 0.97 H new ATOM 0 HE1 MET A 56 1.106 -3.907 6.012 1.00 1.85 H new ATOM 0 HE2 MET A 56 1.667 -5.596 6.055 1.00 1.85 H new ATOM 0 HE3 MET A 56 2.162 -4.528 4.721 1.00 1.85 H new ATOM 795 N GLY A 57 4.578 -7.661 1.515 1.00 0.26 N ATOM 796 CA GLY A 57 5.762 -8.392 1.793 1.00 0.32 C ATOM 797 C GLY A 57 6.758 -7.436 2.341 1.00 0.31 C ATOM 798 O GLY A 57 6.968 -6.385 1.756 1.00 0.35 O ATOM 0 H GLY A 57 4.733 -6.755 1.072 1.00 0.26 H new ATOM 0 HA2 GLY A 57 5.561 -9.189 2.509 1.00 0.32 H new ATOM 0 HA3 GLY A 57 6.142 -8.865 0.888 1.00 0.32 H new ATOM 802 N ALA A 58 7.362 -7.732 3.452 1.00 0.37 N ATOM 803 CA ALA A 58 8.217 -6.746 4.049 1.00 0.38 C ATOM 804 C ALA A 58 9.567 -6.842 3.390 1.00 0.42 C ATOM 805 O ALA A 58 9.990 -7.915 2.952 1.00 0.61 O ATOM 806 CB ALA A 58 8.313 -6.950 5.554 1.00 0.51 C ATOM 0 H ALA A 58 7.285 -8.618 3.952 1.00 0.37 H new ATOM 0 HA ALA A 58 7.806 -5.748 3.897 1.00 0.38 H new ATOM 0 HB1 ALA A 58 8.966 -6.190 5.983 1.00 0.51 H new ATOM 0 HB2 ALA A 58 7.320 -6.867 5.997 1.00 0.51 H new ATOM 0 HB3 ALA A 58 8.721 -7.939 5.762 1.00 0.51 H new ATOM 812 N TYR A 59 10.229 -5.729 3.246 1.00 0.45 N ATOM 813 CA TYR A 59 11.509 -5.768 2.594 1.00 0.61 C ATOM 814 C TYR A 59 12.538 -5.101 3.464 1.00 0.72 C ATOM 815 O TYR A 59 12.205 -4.209 4.239 1.00 0.81 O ATOM 816 CB TYR A 59 11.416 -5.178 1.176 1.00 0.93 C ATOM 817 CG TYR A 59 11.569 -3.675 0.986 1.00 1.64 C ATOM 818 CD1 TYR A 59 12.775 -3.028 1.241 1.00 2.54 C ATOM 819 CD2 TYR A 59 10.525 -2.920 0.470 1.00 2.01 C ATOM 820 CE1 TYR A 59 12.929 -1.677 1.005 1.00 3.70 C ATOM 821 CE2 TYR A 59 10.677 -1.569 0.217 1.00 3.08 C ATOM 822 CZ TYR A 59 11.879 -0.953 0.490 1.00 3.92 C ATOM 823 OH TYR A 59 12.039 0.390 0.233 1.00 5.11 O ATOM 0 H TYR A 59 9.918 -4.810 3.560 1.00 0.45 H new ATOM 0 HA TYR A 59 11.831 -6.801 2.460 1.00 0.61 H new ATOM 0 HB2 TYR A 59 12.178 -5.665 0.567 1.00 0.93 H new ATOM 0 HB3 TYR A 59 10.448 -5.464 0.764 1.00 0.93 H new ATOM 0 HD1 TYR A 59 13.607 -3.595 1.632 1.00 2.54 H new ATOM 0 HD2 TYR A 59 9.578 -3.396 0.263 1.00 2.01 H new ATOM 0 HE1 TYR A 59 13.868 -1.191 1.223 1.00 3.70 H new ATOM 0 HE2 TYR A 59 9.857 -0.999 -0.193 1.00 3.08 H new ATOM 0 HH TYR A 59 11.464 0.650 -0.517 1.00 5.11 H new ATOM 833 N LYS A 60 13.790 -5.534 3.376 1.00 0.92 N ATOM 834 CA LYS A 60 14.738 -5.074 4.375 1.00 1.13 C ATOM 835 C LYS A 60 16.094 -4.696 3.819 1.00 1.50 C ATOM 836 O LYS A 60 16.743 -5.461 3.112 1.00 1.77 O ATOM 837 CB LYS A 60 14.913 -6.118 5.479 1.00 1.30 C ATOM 838 CG LYS A 60 15.631 -5.577 6.705 1.00 1.66 C ATOM 839 CD LYS A 60 14.820 -4.477 7.373 1.00 2.14 C ATOM 840 CE LYS A 60 15.630 -3.736 8.422 1.00 2.79 C ATOM 841 NZ LYS A 60 16.163 -4.645 9.469 1.00 3.47 N ATOM 0 H LYS A 60 14.156 -6.167 2.665 1.00 0.92 H new ATOM 0 HA LYS A 60 14.303 -4.161 4.781 1.00 1.13 H new ATOM 0 HB2 LYS A 60 13.933 -6.492 5.775 1.00 1.30 H new ATOM 0 HB3 LYS A 60 15.472 -6.966 5.083 1.00 1.30 H new ATOM 0 HG2 LYS A 60 15.806 -6.386 7.414 1.00 1.66 H new ATOM 0 HG3 LYS A 60 16.608 -5.189 6.417 1.00 1.66 H new ATOM 0 HD2 LYS A 60 14.472 -3.772 6.618 1.00 2.14 H new ATOM 0 HD3 LYS A 60 13.934 -4.910 7.837 1.00 2.14 H new ATOM 0 HE2 LYS A 60 16.458 -3.217 7.939 1.00 2.79 H new ATOM 0 HE3 LYS A 60 15.005 -2.974 8.889 1.00 2.79 H new ATOM 0 HZ1 LYS A 60 16.561 -4.082 10.248 1.00 3.47 H new ATOM 0 HZ2 LYS A 60 15.395 -5.244 9.832 1.00 3.47 H new ATOM 0 HZ3 LYS A 60 16.907 -5.246 9.061 1.00 3.47 H new ATOM 855 N SER A 61 16.475 -3.481 4.143 1.00 1.67 N ATOM 856 CA SER A 61 17.850 -3.042 4.112 1.00 2.15 C ATOM 857 C SER A 61 18.041 -2.190 5.355 1.00 2.02 C ATOM 858 O SER A 61 17.066 -1.645 5.859 1.00 1.72 O ATOM 859 CB SER A 61 18.123 -2.238 2.840 1.00 2.67 C ATOM 860 OG SER A 61 17.152 -1.218 2.663 1.00 3.06 O ATOM 0 H SER A 61 15.823 -2.756 4.442 1.00 1.67 H new ATOM 0 HA SER A 61 18.545 -3.881 4.103 1.00 2.15 H new ATOM 0 HB2 SER A 61 19.117 -1.793 2.893 1.00 2.67 H new ATOM 0 HB3 SER A 61 18.117 -2.904 1.977 1.00 2.67 H new ATOM 0 HG SER A 61 17.349 -0.717 1.844 1.00 3.06 H new ATOM 866 N SER A 62 19.252 -2.049 5.862 1.00 2.37 N ATOM 867 CA SER A 62 19.424 -1.263 7.074 1.00 2.25 C ATOM 868 C SER A 62 19.667 0.203 6.738 1.00 2.37 C ATOM 869 O SER A 62 20.572 0.840 7.281 1.00 2.59 O ATOM 870 CB SER A 62 20.583 -1.832 7.895 1.00 2.65 C ATOM 871 OG SER A 62 21.715 -2.079 7.074 1.00 2.99 O ATOM 0 H SER A 62 20.104 -2.451 5.472 1.00 2.37 H new ATOM 0 HA SER A 62 18.510 -1.320 7.666 1.00 2.25 H new ATOM 0 HB2 SER A 62 20.850 -1.133 8.688 1.00 2.65 H new ATOM 0 HB3 SER A 62 20.271 -2.758 8.378 1.00 2.65 H new ATOM 0 HG SER A 62 22.443 -2.441 7.621 1.00 2.99 H new ATOM 877 N LYS A 63 18.857 0.735 5.831 1.00 2.37 N ATOM 878 CA LYS A 63 18.911 2.146 5.516 1.00 2.64 C ATOM 879 C LYS A 63 17.550 2.824 5.675 1.00 2.48 C ATOM 880 O LYS A 63 17.248 3.767 4.937 1.00 2.87 O ATOM 881 CB LYS A 63 19.448 2.354 4.096 1.00 3.20 C ATOM 882 CG LYS A 63 18.637 1.663 3.010 1.00 3.62 C ATOM 883 CD LYS A 63 19.166 1.999 1.623 1.00 4.18 C ATOM 884 CE LYS A 63 20.586 1.497 1.428 1.00 4.77 C ATOM 885 NZ LYS A 63 21.209 2.053 0.199 1.00 5.27 N ATOM 0 H LYS A 63 18.159 0.208 5.306 1.00 2.37 H new ATOM 0 HA LYS A 63 19.591 2.613 6.229 1.00 2.64 H new ATOM 0 HB2 LYS A 63 19.478 3.423 3.885 1.00 3.20 H new ATOM 0 HB3 LYS A 63 20.475 1.991 4.052 1.00 3.20 H new ATOM 0 HG2 LYS A 63 18.668 0.584 3.161 1.00 3.62 H new ATOM 0 HG3 LYS A 63 17.593 1.965 3.086 1.00 3.62 H new ATOM 0 HD2 LYS A 63 18.516 1.556 0.868 1.00 4.18 H new ATOM 0 HD3 LYS A 63 19.138 3.078 1.474 1.00 4.18 H new ATOM 0 HE2 LYS A 63 21.189 1.768 2.295 1.00 4.77 H new ATOM 0 HE3 LYS A 63 20.581 0.408 1.371 1.00 4.77 H new ATOM 0 HZ1 LYS A 63 22.177 1.685 0.104 1.00 5.27 H new ATOM 0 HZ2 LYS A 63 20.649 1.773 -0.631 1.00 5.27 H new ATOM 0 HZ3 LYS A 63 21.238 3.091 0.263 1.00 5.27 H new ATOM 899 N ASP A 64 16.723 2.368 6.617 1.00 2.02 N ATOM 900 CA ASP A 64 15.426 3.016 6.810 1.00 2.02 C ATOM 901 C ASP A 64 15.615 4.278 7.654 1.00 2.36 C ATOM 902 O ASP A 64 16.482 5.103 7.360 1.00 2.81 O ATOM 903 CB ASP A 64 14.464 2.070 7.537 1.00 1.53 C ATOM 904 CG ASP A 64 14.661 0.609 7.179 1.00 1.63 C ATOM 905 OD1 ASP A 64 14.069 0.147 6.185 1.00 1.88 O ATOM 906 OD2 ASP A 64 15.411 -0.079 7.908 1.00 1.89 O ATOM 0 H ASP A 64 16.917 1.582 7.237 1.00 2.02 H new ATOM 0 HA ASP A 64 15.009 3.272 5.836 1.00 2.02 H new ATOM 0 HB2 ASP A 64 14.592 2.192 8.613 1.00 1.53 H new ATOM 0 HB3 ASP A 64 13.439 2.358 7.303 1.00 1.53 H new ATOM 911 N ASP A 65 14.841 4.418 8.727 1.00 2.27 N ATOM 912 CA ASP A 65 15.209 5.317 9.816 1.00 2.65 C ATOM 913 C ASP A 65 15.154 4.568 11.136 1.00 2.35 C ATOM 914 O ASP A 65 16.154 4.075 11.652 1.00 2.28 O ATOM 915 CB ASP A 65 14.268 6.524 9.887 1.00 3.22 C ATOM 916 CG ASP A 65 14.190 7.298 8.592 1.00 3.59 C ATOM 917 OD1 ASP A 65 13.342 6.951 7.751 1.00 4.06 O ATOM 918 OD2 ASP A 65 14.951 8.271 8.425 1.00 3.75 O ATOM 0 H ASP A 65 13.960 3.923 8.865 1.00 2.27 H new ATOM 0 HA ASP A 65 16.220 5.677 9.626 1.00 2.65 H new ATOM 0 HB2 ASP A 65 13.269 6.182 10.158 1.00 3.22 H new ATOM 0 HB3 ASP A 65 14.603 7.191 10.681 1.00 3.22 H new ATOM 923 N ALA A 66 13.933 4.506 11.661 1.00 2.40 N ATOM 924 CA ALA A 66 13.569 3.667 12.791 1.00 2.34 C ATOM 925 C ALA A 66 12.296 2.904 12.447 1.00 2.24 C ATOM 926 O ALA A 66 11.592 2.410 13.325 1.00 2.63 O ATOM 927 CB ALA A 66 13.373 4.507 14.045 1.00 2.98 C ATOM 0 H ALA A 66 13.152 5.054 11.300 1.00 2.40 H new ATOM 0 HA ALA A 66 14.373 2.959 12.993 1.00 2.34 H new ATOM 0 HB1 ALA A 66 13.101 3.859 14.878 1.00 2.98 H new ATOM 0 HB2 ALA A 66 14.299 5.031 14.280 1.00 2.98 H new ATOM 0 HB3 ALA A 66 12.578 5.233 13.876 1.00 2.98 H new ATOM 933 N LYS A 67 12.013 2.808 11.157 1.00 1.96 N ATOM 934 CA LYS A 67 10.702 2.381 10.683 1.00 1.89 C ATOM 935 C LYS A 67 10.845 1.536 9.431 1.00 1.44 C ATOM 936 O LYS A 67 11.690 1.798 8.584 1.00 1.95 O ATOM 937 CB LYS A 67 9.793 3.597 10.434 1.00 2.82 C ATOM 938 CG LYS A 67 10.315 4.614 9.422 1.00 3.45 C ATOM 939 CD LYS A 67 9.305 5.738 9.227 1.00 4.32 C ATOM 940 CE LYS A 67 9.705 6.713 8.124 1.00 5.01 C ATOM 941 NZ LYS A 67 10.916 7.506 8.463 1.00 5.31 N ATOM 0 H LYS A 67 12.678 3.021 10.413 1.00 1.96 H new ATOM 0 HA LYS A 67 10.233 1.768 11.453 1.00 1.89 H new ATOM 0 HB2 LYS A 67 8.822 3.238 10.094 1.00 2.82 H new ATOM 0 HB3 LYS A 67 9.630 4.107 11.384 1.00 2.82 H new ATOM 0 HG2 LYS A 67 11.264 5.025 9.767 1.00 3.45 H new ATOM 0 HG3 LYS A 67 10.509 4.121 8.469 1.00 3.45 H new ATOM 0 HD2 LYS A 67 8.332 5.308 8.989 1.00 4.32 H new ATOM 0 HD3 LYS A 67 9.192 6.284 10.164 1.00 4.32 H new ATOM 0 HE2 LYS A 67 9.886 6.158 7.204 1.00 5.01 H new ATOM 0 HE3 LYS A 67 8.875 7.392 7.928 1.00 5.01 H new ATOM 0 HZ1 LYS A 67 10.764 8.501 8.202 1.00 5.31 H new ATOM 0 HZ2 LYS A 67 11.099 7.440 9.485 1.00 5.31 H new ATOM 0 HZ3 LYS A 67 11.733 7.132 7.940 1.00 5.31 H new ATOM 955 N ILE A 68 9.992 0.534 9.336 1.00 0.88 N ATOM 956 CA ILE A 68 10.187 -0.587 8.443 1.00 0.76 C ATOM 957 C ILE A 68 9.262 -0.492 7.274 1.00 0.43 C ATOM 958 O ILE A 68 8.166 0.064 7.371 1.00 0.37 O ATOM 959 CB ILE A 68 9.959 -1.943 9.136 1.00 0.97 C ATOM 960 CG1 ILE A 68 8.586 -1.981 9.825 1.00 1.07 C ATOM 961 CG2 ILE A 68 11.075 -2.217 10.131 1.00 1.51 C ATOM 962 CD1 ILE A 68 8.252 -3.319 10.452 1.00 1.66 C ATOM 0 H ILE A 68 9.134 0.477 9.885 1.00 0.88 H new ATOM 0 HA ILE A 68 11.225 -0.539 8.115 1.00 0.76 H new ATOM 0 HB ILE A 68 9.972 -2.727 8.379 1.00 0.97 H new ATOM 0 HG12 ILE A 68 8.556 -1.211 10.596 1.00 1.07 H new ATOM 0 HG13 ILE A 68 7.817 -1.731 9.095 1.00 1.07 H new ATOM 0 HG21 ILE A 68 10.903 -3.178 10.615 1.00 1.51 H new ATOM 0 HG22 ILE A 68 12.031 -2.240 9.608 1.00 1.51 H new ATOM 0 HG23 ILE A 68 11.092 -1.430 10.884 1.00 1.51 H new ATOM 0 HD11 ILE A 68 7.268 -3.267 10.918 1.00 1.66 H new ATOM 0 HD12 ILE A 68 8.248 -4.091 9.682 1.00 1.66 H new ATOM 0 HD13 ILE A 68 8.999 -3.563 11.207 1.00 1.66 H new ATOM 974 N THR A 69 9.707 -1.041 6.180 1.00 0.47 N ATOM 975 CA THR A 69 8.986 -0.939 4.959 1.00 0.38 C ATOM 976 C THR A 69 8.378 -2.279 4.562 1.00 0.34 C ATOM 977 O THR A 69 9.003 -3.340 4.676 1.00 0.46 O ATOM 978 CB THR A 69 9.894 -0.424 3.840 1.00 0.55 C ATOM 979 OG1 THR A 69 9.264 -0.638 2.582 1.00 1.50 O ATOM 980 CG2 THR A 69 11.250 -1.110 3.880 1.00 1.23 C ATOM 0 H THR A 69 10.578 -1.569 6.117 1.00 0.47 H new ATOM 0 HA THR A 69 8.174 -0.228 5.113 1.00 0.38 H new ATOM 0 HB THR A 69 10.058 0.644 3.984 1.00 0.55 H new ATOM 0 HG1 THR A 69 9.786 -1.283 2.060 1.00 1.50 H new ATOM 0 HG21 THR A 69 11.876 -0.726 3.074 1.00 1.23 H new ATOM 0 HG22 THR A 69 11.730 -0.912 4.838 1.00 1.23 H new ATOM 0 HG23 THR A 69 11.118 -2.185 3.756 1.00 1.23 H new ATOM 988 N VAL A 70 7.144 -2.202 4.118 1.00 0.27 N ATOM 989 CA VAL A 70 6.416 -3.336 3.606 1.00 0.28 C ATOM 990 C VAL A 70 6.046 -3.018 2.171 1.00 0.26 C ATOM 991 O VAL A 70 6.094 -1.850 1.769 1.00 0.29 O ATOM 992 CB VAL A 70 5.140 -3.627 4.431 1.00 0.33 C ATOM 993 CG1 VAL A 70 5.496 -3.954 5.874 1.00 0.98 C ATOM 994 CG2 VAL A 70 4.169 -2.453 4.376 1.00 1.06 C ATOM 0 H VAL A 70 6.610 -1.333 4.103 1.00 0.27 H new ATOM 0 HA VAL A 70 7.039 -4.228 3.670 1.00 0.28 H new ATOM 0 HB VAL A 70 4.648 -4.494 3.989 1.00 0.33 H new ATOM 0 HG11 VAL A 70 4.585 -4.155 6.437 1.00 0.98 H new ATOM 0 HG12 VAL A 70 6.140 -4.833 5.900 1.00 0.98 H new ATOM 0 HG13 VAL A 70 6.019 -3.108 6.320 1.00 0.98 H new ATOM 0 HG21 VAL A 70 3.282 -2.687 4.965 1.00 1.06 H new ATOM 0 HG22 VAL A 70 4.650 -1.563 4.782 1.00 1.06 H new ATOM 0 HG23 VAL A 70 3.880 -2.268 3.341 1.00 1.06 H new ATOM 1004 N ILE A 71 5.695 -4.037 1.413 1.00 0.25 N ATOM 1005 CA ILE A 71 5.466 -3.896 -0.011 1.00 0.28 C ATOM 1006 C ILE A 71 3.986 -3.982 -0.320 1.00 0.28 C ATOM 1007 O ILE A 71 3.318 -4.905 0.128 1.00 0.33 O ATOM 1008 CB ILE A 71 6.230 -5.003 -0.768 1.00 0.39 C ATOM 1009 CG1 ILE A 71 7.722 -4.658 -0.814 1.00 1.29 C ATOM 1010 CG2 ILE A 71 5.658 -5.223 -2.161 1.00 1.34 C ATOM 1011 CD1 ILE A 71 8.599 -5.780 -1.322 1.00 2.12 C ATOM 0 H ILE A 71 5.561 -4.985 1.766 1.00 0.25 H new ATOM 0 HA ILE A 71 5.829 -2.920 -0.334 1.00 0.28 H new ATOM 0 HB ILE A 71 6.109 -5.944 -0.231 1.00 0.39 H new ATOM 0 HG12 ILE A 71 7.863 -3.784 -1.451 1.00 1.29 H new ATOM 0 HG13 ILE A 71 8.051 -4.379 0.187 1.00 1.29 H new ATOM 0 HG21 ILE A 71 6.220 -6.009 -2.665 1.00 1.34 H new ATOM 0 HG22 ILE A 71 4.612 -5.518 -2.082 1.00 1.34 H new ATOM 0 HG23 ILE A 71 5.732 -4.299 -2.735 1.00 1.34 H new ATOM 0 HD11 ILE A 71 9.640 -5.456 -1.324 1.00 2.12 H new ATOM 0 HD12 ILE A 71 8.491 -6.649 -0.673 1.00 2.12 H new ATOM 0 HD13 ILE A 71 8.300 -6.045 -2.336 1.00 2.12 H new ATOM 1023 N LEU A 72 3.461 -3.003 -1.043 1.00 0.28 N ATOM 1024 CA LEU A 72 2.065 -3.074 -1.462 1.00 0.29 C ATOM 1025 C LEU A 72 1.945 -3.371 -2.961 1.00 0.27 C ATOM 1026 O LEU A 72 2.378 -2.581 -3.798 1.00 0.30 O ATOM 1027 CB LEU A 72 1.320 -1.783 -1.111 1.00 0.33 C ATOM 1028 CG LEU A 72 -0.177 -1.956 -0.826 1.00 0.37 C ATOM 1029 CD1 LEU A 72 -0.389 -2.788 0.429 1.00 0.79 C ATOM 1030 CD2 LEU A 72 -0.857 -0.603 -0.687 1.00 0.88 C ATOM 0 H LEU A 72 3.964 -2.169 -1.347 1.00 0.28 H new ATOM 0 HA LEU A 72 1.603 -3.897 -0.917 1.00 0.29 H new ATOM 0 HB2 LEU A 72 1.792 -1.335 -0.236 1.00 0.33 H new ATOM 0 HB3 LEU A 72 1.439 -1.078 -1.933 1.00 0.33 H new ATOM 0 HG LEU A 72 -0.626 -2.481 -1.669 1.00 0.37 H new ATOM 0 HD11 LEU A 72 -1.457 -2.900 0.615 1.00 0.79 H new ATOM 0 HD12 LEU A 72 0.061 -3.772 0.294 1.00 0.79 H new ATOM 0 HD13 LEU A 72 0.077 -2.290 1.279 1.00 0.79 H new ATOM 0 HD21 LEU A 72 -1.918 -0.748 -0.485 1.00 0.88 H new ATOM 0 HD22 LEU A 72 -0.403 -0.051 0.136 1.00 0.88 H new ATOM 0 HD23 LEU A 72 -0.737 -0.039 -1.612 1.00 0.88 H new ATOM 1042 N ARG A 73 1.354 -4.511 -3.283 1.00 0.24 N ATOM 1043 CA ARG A 73 1.055 -4.880 -4.667 1.00 0.24 C ATOM 1044 C ARG A 73 -0.352 -5.441 -4.739 1.00 0.21 C ATOM 1045 O ARG A 73 -0.835 -5.966 -3.749 1.00 0.24 O ATOM 1046 CB ARG A 73 2.002 -5.975 -5.156 1.00 0.28 C ATOM 1047 CG ARG A 73 1.787 -7.293 -4.428 1.00 0.43 C ATOM 1048 CD ARG A 73 2.179 -8.475 -5.298 1.00 0.58 C ATOM 1049 NE ARG A 73 2.127 -9.726 -4.553 1.00 0.91 N ATOM 1050 CZ ARG A 73 1.621 -10.864 -5.016 1.00 1.04 C ATOM 1051 NH1 ARG A 73 1.131 -10.932 -6.250 1.00 1.27 N ATOM 1052 NH2 ARG A 73 1.592 -11.937 -4.238 1.00 1.67 N ATOM 0 H ARG A 73 1.067 -5.209 -2.597 1.00 0.24 H new ATOM 0 HA ARG A 73 1.166 -3.989 -5.285 1.00 0.24 H new ATOM 0 HB2 ARG A 73 1.858 -6.126 -6.226 1.00 0.28 H new ATOM 0 HB3 ARG A 73 3.033 -5.650 -5.016 1.00 0.28 H new ATOM 0 HG2 ARG A 73 2.375 -7.304 -3.510 1.00 0.43 H new ATOM 0 HG3 ARG A 73 0.740 -7.384 -4.138 1.00 0.43 H new ATOM 0 HD2 ARG A 73 1.510 -8.534 -6.157 1.00 0.58 H new ATOM 0 HD3 ARG A 73 3.186 -8.324 -5.687 1.00 0.58 H new ATOM 0 HE ARG A 73 2.507 -9.728 -3.606 1.00 0.91 H new ATOM 0 HH11 ARG A 73 1.142 -10.107 -6.849 1.00 1.27 H new ATOM 0 HH12 ARG A 73 0.744 -11.810 -6.598 1.00 1.27 H new ATOM 0 HH21 ARG A 73 1.957 -11.887 -3.287 1.00 1.67 H new ATOM 0 HH22 ARG A 73 1.204 -12.812 -4.590 1.00 1.67 H new ATOM 1066 N ILE A 74 -1.015 -5.343 -5.879 1.00 0.22 N ATOM 1067 CA ILE A 74 -2.209 -6.137 -6.086 1.00 0.24 C ATOM 1068 C ILE A 74 -1.794 -7.513 -6.589 1.00 0.27 C ATOM 1069 O ILE A 74 -0.988 -7.634 -7.502 1.00 0.30 O ATOM 1070 CB ILE A 74 -3.243 -5.495 -7.047 1.00 0.31 C ATOM 1071 CG1 ILE A 74 -2.736 -5.419 -8.497 1.00 1.14 C ATOM 1072 CG2 ILE A 74 -3.632 -4.114 -6.545 1.00 1.30 C ATOM 1073 CD1 ILE A 74 -1.666 -4.380 -8.732 1.00 1.81 C ATOM 0 H ILE A 74 -0.754 -4.737 -6.657 1.00 0.22 H new ATOM 0 HA ILE A 74 -2.720 -6.206 -5.126 1.00 0.24 H new ATOM 0 HB ILE A 74 -4.121 -6.140 -7.055 1.00 0.31 H new ATOM 0 HG12 ILE A 74 -2.346 -6.396 -8.784 1.00 1.14 H new ATOM 0 HG13 ILE A 74 -3.580 -5.208 -9.153 1.00 1.14 H new ATOM 0 HG21 ILE A 74 -4.358 -3.671 -7.226 1.00 1.30 H new ATOM 0 HG22 ILE A 74 -4.071 -4.199 -5.551 1.00 1.30 H new ATOM 0 HG23 ILE A 74 -2.746 -3.481 -6.498 1.00 1.30 H new ATOM 0 HD11 ILE A 74 -1.367 -4.396 -9.780 1.00 1.81 H new ATOM 0 HD12 ILE A 74 -2.055 -3.393 -8.480 1.00 1.81 H new ATOM 0 HD13 ILE A 74 -0.802 -4.600 -8.105 1.00 1.81 H new ATOM 1085 N SER A 75 -2.281 -8.542 -5.921 1.00 0.30 N ATOM 1086 CA SER A 75 -1.976 -9.926 -6.260 1.00 0.38 C ATOM 1087 C SER A 75 -2.194 -10.231 -7.745 1.00 0.44 C ATOM 1088 O SER A 75 -1.604 -11.167 -8.284 1.00 0.50 O ATOM 1089 CB SER A 75 -2.821 -10.861 -5.395 1.00 0.47 C ATOM 1090 OG SER A 75 -4.193 -10.503 -5.450 1.00 1.16 O ATOM 0 H SER A 75 -2.905 -8.443 -5.120 1.00 0.30 H new ATOM 0 HA SER A 75 -0.917 -10.089 -6.060 1.00 0.38 H new ATOM 0 HB2 SER A 75 -2.696 -11.889 -5.735 1.00 0.47 H new ATOM 0 HB3 SER A 75 -2.472 -10.822 -4.363 1.00 0.47 H new ATOM 0 HG SER A 75 -4.690 -11.186 -5.947 1.00 1.16 H new ATOM 1096 N LYS A 76 -3.050 -9.448 -8.395 1.00 0.45 N ATOM 1097 CA LYS A 76 -3.512 -9.766 -9.740 1.00 0.54 C ATOM 1098 C LYS A 76 -2.520 -9.335 -10.828 1.00 0.55 C ATOM 1099 O LYS A 76 -2.061 -10.157 -11.623 1.00 0.61 O ATOM 1100 CB LYS A 76 -4.844 -9.053 -9.951 1.00 0.60 C ATOM 1101 CG LYS A 76 -5.877 -9.396 -8.887 1.00 1.21 C ATOM 1102 CD LYS A 76 -7.237 -8.785 -9.186 1.00 1.70 C ATOM 1103 CE LYS A 76 -7.913 -9.473 -10.360 1.00 2.16 C ATOM 1104 NZ LYS A 76 -8.080 -10.932 -10.133 1.00 2.51 N ATOM 0 H LYS A 76 -3.438 -8.587 -8.010 1.00 0.45 H new ATOM 0 HA LYS A 76 -3.613 -10.848 -9.824 1.00 0.54 H new ATOM 0 HB2 LYS A 76 -4.677 -7.976 -9.953 1.00 0.60 H new ATOM 0 HB3 LYS A 76 -5.240 -9.316 -10.932 1.00 0.60 H new ATOM 0 HG2 LYS A 76 -5.976 -10.479 -8.815 1.00 1.21 H new ATOM 0 HG3 LYS A 76 -5.528 -9.043 -7.917 1.00 1.21 H new ATOM 0 HD2 LYS A 76 -7.873 -8.861 -8.304 1.00 1.70 H new ATOM 0 HD3 LYS A 76 -7.120 -7.723 -9.404 1.00 1.70 H new ATOM 0 HE2 LYS A 76 -8.889 -9.019 -10.532 1.00 2.16 H new ATOM 0 HE3 LYS A 76 -7.323 -9.312 -11.262 1.00 2.16 H new ATOM 0 HZ1 LYS A 76 -8.795 -11.306 -10.789 1.00 2.51 H new ATOM 0 HZ2 LYS A 76 -7.174 -11.415 -10.297 1.00 2.51 H new ATOM 0 HZ3 LYS A 76 -8.389 -11.098 -9.154 1.00 2.51 H new ATOM 1118 N THR A 77 -2.190 -8.055 -10.852 1.00 0.51 N ATOM 1119 CA THR A 77 -1.219 -7.515 -11.800 1.00 0.53 C ATOM 1120 C THR A 77 0.005 -7.046 -11.024 1.00 0.47 C ATOM 1121 O THR A 77 -0.047 -6.981 -9.803 1.00 0.46 O ATOM 1122 CB THR A 77 -1.840 -6.338 -12.581 1.00 0.62 C ATOM 1123 OG1 THR A 77 -3.228 -6.605 -12.830 1.00 1.45 O ATOM 1124 CG2 THR A 77 -1.131 -6.119 -13.910 1.00 1.29 C ATOM 0 H THR A 77 -2.584 -7.359 -10.219 1.00 0.51 H new ATOM 0 HA THR A 77 -0.930 -8.284 -12.516 1.00 0.53 H new ATOM 0 HB THR A 77 -1.729 -5.438 -11.977 1.00 0.62 H new ATOM 0 HG1 THR A 77 -3.622 -5.856 -13.325 1.00 1.45 H new ATOM 0 HG21 THR A 77 -1.593 -5.283 -14.435 1.00 1.29 H new ATOM 0 HG22 THR A 77 -0.079 -5.898 -13.729 1.00 1.29 H new ATOM 0 HG23 THR A 77 -1.213 -7.020 -14.519 1.00 1.29 H new ATOM 1132 N GLN A 78 1.106 -6.700 -11.676 1.00 0.50 N ATOM 1133 CA GLN A 78 2.218 -6.168 -10.911 1.00 0.49 C ATOM 1134 C GLN A 78 2.276 -4.653 -11.057 1.00 0.46 C ATOM 1135 O GLN A 78 3.180 -4.090 -11.681 1.00 0.48 O ATOM 1136 CB GLN A 78 3.546 -6.810 -11.340 1.00 0.59 C ATOM 1137 CG GLN A 78 3.652 -8.296 -11.011 1.00 1.49 C ATOM 1138 CD GLN A 78 2.788 -9.169 -11.904 1.00 2.14 C ATOM 1139 OE1 GLN A 78 2.562 -8.855 -13.073 1.00 2.69 O ATOM 1140 NE2 GLN A 78 2.290 -10.265 -11.356 1.00 2.90 N ATOM 0 H GLN A 78 1.250 -6.773 -12.683 1.00 0.50 H new ATOM 0 HA GLN A 78 2.060 -6.412 -9.861 1.00 0.49 H new ATOM 0 HB2 GLN A 78 3.672 -6.676 -12.414 1.00 0.59 H new ATOM 0 HB3 GLN A 78 4.367 -6.282 -10.855 1.00 0.59 H new ATOM 0 HG2 GLN A 78 4.692 -8.609 -11.104 1.00 1.49 H new ATOM 0 HG3 GLN A 78 3.364 -8.453 -9.972 1.00 1.49 H new ATOM 0 HE21 GLN A 78 2.501 -10.490 -10.384 1.00 2.90 H new ATOM 0 HE22 GLN A 78 1.695 -10.885 -11.906 1.00 2.90 H new ATOM 1149 N LEU A 79 1.292 -4.015 -10.439 1.00 0.46 N ATOM 1150 CA LEU A 79 1.286 -2.582 -10.205 1.00 0.45 C ATOM 1151 C LEU A 79 1.686 -2.336 -8.767 1.00 0.42 C ATOM 1152 O LEU A 79 0.995 -2.760 -7.836 1.00 0.54 O ATOM 1153 CB LEU A 79 -0.095 -1.979 -10.492 1.00 0.59 C ATOM 1154 CG LEU A 79 -0.396 -1.632 -11.957 1.00 0.95 C ATOM 1155 CD1 LEU A 79 -0.174 -2.822 -12.878 1.00 1.95 C ATOM 1156 CD2 LEU A 79 -1.825 -1.138 -12.087 1.00 1.61 C ATOM 0 H LEU A 79 0.463 -4.489 -10.081 1.00 0.46 H new ATOM 0 HA LEU A 79 1.993 -2.099 -10.879 1.00 0.45 H new ATOM 0 HB2 LEU A 79 -0.853 -2.680 -10.144 1.00 0.59 H new ATOM 0 HB3 LEU A 79 -0.203 -1.072 -9.897 1.00 0.59 H new ATOM 0 HG LEU A 79 0.295 -0.845 -12.260 1.00 0.95 H new ATOM 0 HD11 LEU A 79 -0.398 -2.534 -13.905 1.00 1.95 H new ATOM 0 HD12 LEU A 79 0.865 -3.146 -12.810 1.00 1.95 H new ATOM 0 HD13 LEU A 79 -0.829 -3.640 -12.579 1.00 1.95 H new ATOM 0 HD21 LEU A 79 -2.032 -0.894 -13.129 1.00 1.61 H new ATOM 0 HD22 LEU A 79 -2.511 -1.917 -11.754 1.00 1.61 H new ATOM 0 HD23 LEU A 79 -1.960 -0.248 -11.472 1.00 1.61 H new ATOM 1168 N TYR A 80 2.804 -1.695 -8.585 1.00 0.34 N ATOM 1169 CA TYR A 80 3.323 -1.450 -7.266 1.00 0.38 C ATOM 1170 C TYR A 80 3.155 0.015 -6.934 1.00 0.34 C ATOM 1171 O TYR A 80 3.013 0.844 -7.818 1.00 0.45 O ATOM 1172 CB TYR A 80 4.777 -1.916 -7.175 1.00 0.60 C ATOM 1173 CG TYR A 80 4.899 -3.429 -7.147 1.00 1.27 C ATOM 1174 CD1 TYR A 80 4.563 -4.191 -8.255 1.00 2.27 C ATOM 1175 CD2 TYR A 80 5.375 -4.092 -6.022 1.00 1.56 C ATOM 1176 CE1 TYR A 80 4.696 -5.567 -8.246 1.00 3.30 C ATOM 1177 CE2 TYR A 80 5.507 -5.468 -6.005 1.00 2.49 C ATOM 1178 CZ TYR A 80 5.078 -6.206 -7.070 1.00 3.33 C ATOM 1179 OH TYR A 80 5.315 -7.570 -7.110 1.00 4.39 O ATOM 0 H TYR A 80 3.381 -1.328 -9.342 1.00 0.34 H new ATOM 0 HA TYR A 80 2.767 -2.024 -6.525 1.00 0.38 H new ATOM 0 HB2 TYR A 80 5.335 -1.525 -8.026 1.00 0.60 H new ATOM 0 HB3 TYR A 80 5.233 -1.501 -6.276 1.00 0.60 H new ATOM 0 HD1 TYR A 80 4.190 -3.701 -9.142 1.00 2.27 H new ATOM 0 HD2 TYR A 80 5.647 -3.522 -5.146 1.00 1.56 H new ATOM 0 HE1 TYR A 80 4.506 -6.140 -9.142 1.00 3.30 H new ATOM 0 HE2 TYR A 80 5.949 -5.958 -5.150 1.00 2.49 H new ATOM 0 HH TYR A 80 5.404 -7.859 -8.042 1.00 4.39 H new ATOM 1189 N VAL A 81 3.113 0.321 -5.666 1.00 0.32 N ATOM 1190 CA VAL A 81 2.833 1.675 -5.223 1.00 0.32 C ATOM 1191 C VAL A 81 4.091 2.537 -5.221 1.00 0.32 C ATOM 1192 O VAL A 81 5.089 2.186 -4.594 1.00 0.36 O ATOM 1193 CB VAL A 81 2.199 1.703 -3.822 1.00 0.36 C ATOM 1194 CG1 VAL A 81 1.688 3.100 -3.497 1.00 0.46 C ATOM 1195 CG2 VAL A 81 1.075 0.684 -3.718 1.00 0.38 C ATOM 0 H VAL A 81 3.269 -0.347 -4.912 1.00 0.32 H new ATOM 0 HA VAL A 81 2.120 2.086 -5.938 1.00 0.32 H new ATOM 0 HB VAL A 81 2.966 1.438 -3.094 1.00 0.36 H new ATOM 0 HG11 VAL A 81 1.242 3.102 -2.502 1.00 0.46 H new ATOM 0 HG12 VAL A 81 2.518 3.806 -3.525 1.00 0.46 H new ATOM 0 HG13 VAL A 81 0.938 3.393 -4.231 1.00 0.46 H new ATOM 0 HG21 VAL A 81 0.641 0.721 -2.719 1.00 0.38 H new ATOM 0 HG22 VAL A 81 0.306 0.913 -4.456 1.00 0.38 H new ATOM 0 HG23 VAL A 81 1.471 -0.314 -3.905 1.00 0.38 H new ATOM 1205 N THR A 82 4.058 3.638 -5.959 1.00 0.32 N ATOM 1206 CA THR A 82 5.094 4.625 -5.884 1.00 0.32 C ATOM 1207 C THR A 82 4.663 5.711 -4.916 1.00 0.31 C ATOM 1208 O THR A 82 3.486 6.040 -4.807 1.00 0.32 O ATOM 1209 CB THR A 82 5.351 5.302 -7.239 1.00 0.32 C ATOM 1210 OG1 THR A 82 4.196 5.228 -8.067 1.00 1.22 O ATOM 1211 CG2 THR A 82 6.532 4.733 -7.988 1.00 1.37 C ATOM 0 H THR A 82 3.312 3.859 -6.618 1.00 0.32 H new ATOM 0 HA THR A 82 6.004 4.118 -5.563 1.00 0.32 H new ATOM 0 HB THR A 82 5.586 6.340 -7.005 1.00 0.32 H new ATOM 0 HG1 THR A 82 4.442 5.443 -8.991 1.00 1.22 H new ATOM 0 HG21 THR A 82 6.651 5.261 -8.934 1.00 1.37 H new ATOM 0 HG22 THR A 82 7.435 4.853 -7.389 1.00 1.37 H new ATOM 0 HG23 THR A 82 6.364 3.674 -8.182 1.00 1.37 H new ATOM 1219 N ALA A 83 5.615 6.239 -4.197 1.00 0.33 N ATOM 1220 CA ALA A 83 5.345 7.306 -3.251 1.00 0.32 C ATOM 1221 C ALA A 83 5.720 8.646 -3.860 1.00 0.27 C ATOM 1222 O ALA A 83 6.874 8.862 -4.235 1.00 0.31 O ATOM 1223 CB ALA A 83 6.105 7.069 -1.956 1.00 0.41 C ATOM 0 H ALA A 83 6.592 5.951 -4.243 1.00 0.33 H new ATOM 0 HA ALA A 83 4.279 7.316 -3.022 1.00 0.32 H new ATOM 0 HB1 ALA A 83 5.893 7.877 -1.256 1.00 0.41 H new ATOM 0 HB2 ALA A 83 5.793 6.120 -1.520 1.00 0.41 H new ATOM 0 HB3 ALA A 83 7.175 7.039 -2.162 1.00 0.41 H new ATOM 1229 N GLN A 84 4.743 9.539 -3.974 1.00 0.25 N ATOM 1230 CA GLN A 84 4.988 10.844 -4.565 1.00 0.26 C ATOM 1231 C GLN A 84 5.318 11.850 -3.467 1.00 0.25 C ATOM 1232 O GLN A 84 6.309 11.685 -2.765 1.00 0.28 O ATOM 1233 CB GLN A 84 3.797 11.317 -5.409 1.00 0.33 C ATOM 1234 CG GLN A 84 4.208 12.007 -6.706 1.00 0.77 C ATOM 1235 CD GLN A 84 5.183 13.153 -6.489 1.00 1.32 C ATOM 1236 OE1 GLN A 84 6.397 12.953 -6.479 1.00 2.05 O ATOM 1237 NE2 GLN A 84 4.659 14.357 -6.326 1.00 2.02 N ATOM 0 H GLN A 84 3.783 9.383 -3.667 1.00 0.25 H new ATOM 0 HA GLN A 84 5.840 10.762 -5.240 1.00 0.26 H new ATOM 0 HB2 GLN A 84 3.167 10.460 -5.646 1.00 0.33 H new ATOM 0 HB3 GLN A 84 3.192 12.004 -4.817 1.00 0.33 H new ATOM 0 HG2 GLN A 84 4.661 11.274 -7.373 1.00 0.77 H new ATOM 0 HG3 GLN A 84 3.317 12.386 -7.207 1.00 0.77 H new ATOM 0 HE21 GLN A 84 3.646 14.479 -6.341 1.00 2.02 H new ATOM 0 HE22 GLN A 84 5.268 15.163 -6.185 1.00 2.02 H new ATOM 1246 N ASP A 85 4.507 12.890 -3.318 1.00 0.24 N ATOM 1247 CA ASP A 85 4.755 13.872 -2.263 1.00 0.28 C ATOM 1248 C ASP A 85 3.455 14.426 -1.697 1.00 0.26 C ATOM 1249 O ASP A 85 2.783 15.230 -2.343 1.00 0.27 O ATOM 1250 CB ASP A 85 5.627 15.015 -2.786 1.00 0.34 C ATOM 1251 CG ASP A 85 6.044 15.974 -1.690 1.00 0.44 C ATOM 1252 OD1 ASP A 85 6.949 15.629 -0.900 1.00 0.53 O ATOM 1253 OD2 ASP A 85 5.464 17.078 -1.608 1.00 0.56 O ATOM 0 H ASP A 85 3.689 13.076 -3.898 1.00 0.24 H new ATOM 0 HA ASP A 85 5.283 13.360 -1.458 1.00 0.28 H new ATOM 0 HB2 ASP A 85 6.517 14.601 -3.260 1.00 0.34 H new ATOM 0 HB3 ASP A 85 5.081 15.562 -3.555 1.00 0.34 H new ATOM 1258 N GLU A 86 3.121 13.976 -0.485 1.00 0.27 N ATOM 1259 CA GLU A 86 1.950 14.436 0.253 1.00 0.29 C ATOM 1260 C GLU A 86 0.720 14.393 -0.644 1.00 0.22 C ATOM 1261 O GLU A 86 0.533 13.393 -1.314 1.00 0.19 O ATOM 1262 CB GLU A 86 2.217 15.792 0.899 1.00 0.40 C ATOM 1263 CG GLU A 86 1.107 16.272 1.824 1.00 0.51 C ATOM 1264 CD GLU A 86 1.567 17.336 2.796 1.00 0.78 C ATOM 1265 OE1 GLU A 86 2.250 16.994 3.782 1.00 1.04 O ATOM 1266 OE2 GLU A 86 1.260 18.526 2.564 1.00 1.62 O ATOM 0 H GLU A 86 3.665 13.273 0.015 1.00 0.27 H new ATOM 0 HA GLU A 86 1.740 13.762 1.083 1.00 0.29 H new ATOM 0 HB2 GLU A 86 3.147 15.736 1.465 1.00 0.40 H new ATOM 0 HB3 GLU A 86 2.366 16.533 0.114 1.00 0.40 H new ATOM 0 HG2 GLU A 86 0.287 16.666 1.224 1.00 0.51 H new ATOM 0 HG3 GLU A 86 0.714 15.422 2.383 1.00 0.51 H new ATOM 1273 N ASP A 87 -0.096 15.448 -0.696 1.00 0.22 N ATOM 1274 CA ASP A 87 -1.327 15.397 -1.471 1.00 0.20 C ATOM 1275 C ASP A 87 -1.015 15.380 -2.958 1.00 0.23 C ATOM 1276 O ASP A 87 -1.061 16.390 -3.659 1.00 0.30 O ATOM 1277 CB ASP A 87 -2.275 16.547 -1.127 1.00 0.28 C ATOM 1278 CG ASP A 87 -3.667 16.317 -1.696 1.00 0.33 C ATOM 1279 OD1 ASP A 87 -4.305 15.303 -1.341 1.00 0.56 O ATOM 1280 OD2 ASP A 87 -4.143 17.155 -2.487 1.00 0.61 O ATOM 0 H ASP A 87 0.073 16.333 -0.217 1.00 0.22 H new ATOM 0 HA ASP A 87 -1.841 14.473 -1.207 1.00 0.20 H new ATOM 0 HB2 ASP A 87 -2.338 16.656 -0.044 1.00 0.28 H new ATOM 0 HB3 ASP A 87 -1.871 17.481 -1.518 1.00 0.28 H new ATOM 1285 N GLN A 88 -0.647 14.201 -3.386 1.00 0.19 N ATOM 1286 CA GLN A 88 -0.485 13.843 -4.769 1.00 0.24 C ATOM 1287 C GLN A 88 -0.717 12.353 -4.798 1.00 0.21 C ATOM 1288 O GLN A 88 -0.002 11.616 -4.120 1.00 0.19 O ATOM 1289 CB GLN A 88 0.925 14.184 -5.261 1.00 0.32 C ATOM 1290 CG GLN A 88 1.102 14.076 -6.768 1.00 1.03 C ATOM 1291 CD GLN A 88 0.286 15.105 -7.528 1.00 1.28 C ATOM 1292 OE1 GLN A 88 -0.850 14.851 -7.926 1.00 1.89 O ATOM 1293 NE2 GLN A 88 0.859 16.278 -7.729 1.00 1.93 N ATOM 0 H GLN A 88 -0.443 13.430 -2.750 1.00 0.19 H new ATOM 0 HA GLN A 88 -1.171 14.384 -5.421 1.00 0.24 H new ATOM 0 HB2 GLN A 88 1.171 15.199 -4.949 1.00 0.32 H new ATOM 0 HB3 GLN A 88 1.638 13.519 -4.774 1.00 0.32 H new ATOM 0 HG2 GLN A 88 2.156 14.199 -7.016 1.00 1.03 H new ATOM 0 HG3 GLN A 88 0.813 13.077 -7.093 1.00 1.03 H new ATOM 0 HE21 GLN A 88 1.803 16.450 -7.383 1.00 1.93 H new ATOM 0 HE22 GLN A 88 0.357 17.011 -8.230 1.00 1.93 H new ATOM 1302 N PRO A 89 -1.710 11.882 -5.549 1.00 0.24 N ATOM 1303 CA PRO A 89 -2.225 10.531 -5.367 1.00 0.24 C ATOM 1304 C PRO A 89 -1.160 9.479 -5.570 1.00 0.21 C ATOM 1305 O PRO A 89 -0.213 9.672 -6.334 1.00 0.22 O ATOM 1306 CB PRO A 89 -3.310 10.409 -6.445 1.00 0.33 C ATOM 1307 CG PRO A 89 -3.676 11.811 -6.785 1.00 0.58 C ATOM 1308 CD PRO A 89 -2.420 12.614 -6.607 1.00 0.33 C ATOM 0 HA PRO A 89 -2.595 10.372 -4.354 1.00 0.24 H new ATOM 0 HB2 PRO A 89 -2.939 9.875 -7.320 1.00 0.33 H new ATOM 0 HB3 PRO A 89 -4.173 9.855 -6.075 1.00 0.33 H new ATOM 0 HG2 PRO A 89 -4.044 11.882 -7.808 1.00 0.58 H new ATOM 0 HG3 PRO A 89 -4.470 12.177 -6.134 1.00 0.58 H new ATOM 0 HD2 PRO A 89 -1.837 12.661 -7.527 1.00 0.33 H new ATOM 0 HD3 PRO A 89 -2.635 13.641 -6.313 1.00 0.33 H new ATOM 1316 N VAL A 90 -1.322 8.371 -4.863 1.00 0.23 N ATOM 1317 CA VAL A 90 -0.383 7.275 -4.965 1.00 0.24 C ATOM 1318 C VAL A 90 -0.372 6.767 -6.398 1.00 0.24 C ATOM 1319 O VAL A 90 -1.422 6.515 -6.995 1.00 0.28 O ATOM 1320 CB VAL A 90 -0.713 6.128 -3.977 1.00 0.36 C ATOM 1321 CG1 VAL A 90 -0.704 6.644 -2.546 1.00 1.31 C ATOM 1322 CG2 VAL A 90 -2.048 5.474 -4.303 1.00 1.10 C ATOM 0 H VAL A 90 -2.094 8.211 -4.216 1.00 0.23 H new ATOM 0 HA VAL A 90 0.607 7.642 -4.694 1.00 0.24 H new ATOM 0 HB VAL A 90 0.059 5.366 -4.081 1.00 0.36 H new ATOM 0 HG11 VAL A 90 -0.938 5.827 -1.863 1.00 1.31 H new ATOM 0 HG12 VAL A 90 0.282 7.044 -2.310 1.00 1.31 H new ATOM 0 HG13 VAL A 90 -1.450 7.431 -2.438 1.00 1.31 H new ATOM 0 HG21 VAL A 90 -2.245 4.674 -3.589 1.00 1.10 H new ATOM 0 HG22 VAL A 90 -2.842 6.218 -4.243 1.00 1.10 H new ATOM 0 HG23 VAL A 90 -2.014 5.060 -5.311 1.00 1.10 H new ATOM 1332 N LEU A 91 0.815 6.648 -6.957 1.00 0.22 N ATOM 1333 CA LEU A 91 0.965 6.402 -8.372 1.00 0.24 C ATOM 1334 C LEU A 91 1.160 4.918 -8.591 1.00 0.26 C ATOM 1335 O LEU A 91 1.748 4.242 -7.753 1.00 0.33 O ATOM 1336 CB LEU A 91 2.155 7.190 -8.931 1.00 0.30 C ATOM 1337 CG LEU A 91 2.139 8.701 -8.662 1.00 0.31 C ATOM 1338 CD1 LEU A 91 3.407 9.345 -9.199 1.00 0.42 C ATOM 1339 CD2 LEU A 91 0.915 9.342 -9.296 1.00 0.34 C ATOM 0 H LEU A 91 1.695 6.719 -6.446 1.00 0.22 H new ATOM 0 HA LEU A 91 0.069 6.733 -8.898 1.00 0.24 H new ATOM 0 HB2 LEU A 91 3.071 6.775 -8.511 1.00 0.30 H new ATOM 0 HB3 LEU A 91 2.198 7.032 -10.009 1.00 0.30 H new ATOM 0 HG LEU A 91 2.094 8.860 -7.585 1.00 0.31 H new ATOM 0 HD11 LEU A 91 3.383 10.417 -9.002 1.00 0.42 H new ATOM 0 HD12 LEU A 91 4.275 8.905 -8.707 1.00 0.42 H new ATOM 0 HD13 LEU A 91 3.474 9.176 -10.274 1.00 0.42 H new ATOM 0 HD21 LEU A 91 0.920 10.413 -9.095 1.00 0.34 H new ATOM 0 HD22 LEU A 91 0.933 9.175 -10.373 1.00 0.34 H new ATOM 0 HD23 LEU A 91 0.013 8.898 -8.875 1.00 0.34 H new ATOM 1351 N LEU A 92 0.615 4.380 -9.662 1.00 0.27 N ATOM 1352 CA LEU A 92 0.756 2.962 -9.888 1.00 0.28 C ATOM 1353 C LEU A 92 1.931 2.711 -10.817 1.00 0.29 C ATOM 1354 O LEU A 92 1.856 2.899 -12.032 1.00 0.31 O ATOM 1355 CB LEU A 92 -0.532 2.372 -10.464 1.00 0.32 C ATOM 1356 CG LEU A 92 -1.753 2.467 -9.541 1.00 0.76 C ATOM 1357 CD1 LEU A 92 -2.975 1.866 -10.213 1.00 1.15 C ATOM 1358 CD2 LEU A 92 -1.480 1.769 -8.216 1.00 1.30 C ATOM 0 H LEU A 92 0.085 4.888 -10.370 1.00 0.27 H new ATOM 0 HA LEU A 92 0.946 2.468 -8.935 1.00 0.28 H new ATOM 0 HB2 LEU A 92 -0.761 2.881 -11.400 1.00 0.32 H new ATOM 0 HB3 LEU A 92 -0.358 1.324 -10.706 1.00 0.32 H new ATOM 0 HG LEU A 92 -1.949 3.520 -9.341 1.00 0.76 H new ATOM 0 HD11 LEU A 92 -3.832 1.942 -9.544 1.00 1.15 H new ATOM 0 HD12 LEU A 92 -3.186 2.407 -11.136 1.00 1.15 H new ATOM 0 HD13 LEU A 92 -2.785 0.817 -10.442 1.00 1.15 H new ATOM 0 HD21 LEU A 92 -2.358 1.848 -7.575 1.00 1.30 H new ATOM 0 HD22 LEU A 92 -1.257 0.718 -8.398 1.00 1.30 H new ATOM 0 HD23 LEU A 92 -0.629 2.241 -7.725 1.00 1.30 H new ATOM 1370 N LYS A 93 3.033 2.317 -10.195 1.00 0.31 N ATOM 1371 CA LYS A 93 4.278 2.060 -10.869 1.00 0.37 C ATOM 1372 C LYS A 93 4.358 0.602 -11.244 1.00 0.38 C ATOM 1373 O LYS A 93 4.219 -0.276 -10.397 1.00 0.39 O ATOM 1374 CB LYS A 93 5.492 2.421 -9.999 1.00 0.46 C ATOM 1375 CG LYS A 93 5.656 1.608 -8.727 1.00 1.29 C ATOM 1376 CD LYS A 93 7.121 1.360 -8.439 1.00 2.11 C ATOM 1377 CE LYS A 93 7.314 0.511 -7.202 1.00 2.85 C ATOM 1378 NZ LYS A 93 8.750 0.250 -6.949 1.00 3.26 N ATOM 0 H LYS A 93 3.078 2.167 -9.187 1.00 0.31 H new ATOM 0 HA LYS A 93 4.303 2.688 -11.760 1.00 0.37 H new ATOM 0 HB2 LYS A 93 6.394 2.306 -10.600 1.00 0.46 H new ATOM 0 HB3 LYS A 93 5.421 3.475 -9.728 1.00 0.46 H new ATOM 0 HG2 LYS A 93 5.200 2.136 -7.890 1.00 1.29 H new ATOM 0 HG3 LYS A 93 5.133 0.657 -8.827 1.00 1.29 H new ATOM 0 HD2 LYS A 93 7.581 0.866 -9.295 1.00 2.11 H new ATOM 0 HD3 LYS A 93 7.632 2.314 -8.309 1.00 2.11 H new ATOM 0 HE2 LYS A 93 6.876 1.015 -6.340 1.00 2.85 H new ATOM 0 HE3 LYS A 93 6.785 -0.435 -7.321 1.00 2.85 H new ATOM 0 HZ1 LYS A 93 8.871 -0.123 -5.986 1.00 3.26 H new ATOM 0 HZ2 LYS A 93 9.103 -0.446 -7.636 1.00 3.26 H new ATOM 0 HZ3 LYS A 93 9.286 1.136 -7.047 1.00 3.26 H new ATOM 1392 N GLU A 94 4.569 0.321 -12.502 1.00 0.43 N ATOM 1393 CA GLU A 94 4.556 -1.049 -12.924 1.00 0.47 C ATOM 1394 C GLU A 94 5.983 -1.554 -12.875 1.00 0.52 C ATOM 1395 O GLU A 94 6.792 -1.360 -13.783 1.00 0.62 O ATOM 1396 CB GLU A 94 3.949 -1.153 -14.330 1.00 0.56 C ATOM 1397 CG GLU A 94 3.788 -2.573 -14.847 1.00 1.38 C ATOM 1398 CD GLU A 94 4.956 -3.021 -15.700 1.00 1.76 C ATOM 1399 OE1 GLU A 94 5.016 -2.624 -16.882 1.00 2.05 O ATOM 1400 OE2 GLU A 94 5.810 -3.779 -15.201 1.00 2.33 O ATOM 0 H GLU A 94 4.748 1.006 -13.236 1.00 0.43 H new ATOM 0 HA GLU A 94 3.939 -1.665 -12.270 1.00 0.47 H new ATOM 0 HB2 GLU A 94 2.972 -0.669 -14.326 1.00 0.56 H new ATOM 0 HB3 GLU A 94 4.578 -0.597 -15.025 1.00 0.56 H new ATOM 0 HG2 GLU A 94 3.679 -3.253 -14.002 1.00 1.38 H new ATOM 0 HG3 GLU A 94 2.870 -2.641 -15.431 1.00 1.38 H new ATOM 1407 N MET A 95 6.271 -2.154 -11.730 1.00 0.50 N ATOM 1408 CA MET A 95 7.553 -2.758 -11.440 1.00 0.59 C ATOM 1409 C MET A 95 7.343 -4.252 -11.273 1.00 0.66 C ATOM 1410 O MET A 95 6.635 -4.689 -10.371 1.00 0.65 O ATOM 1411 CB MET A 95 8.184 -2.132 -10.179 1.00 0.60 C ATOM 1412 CG MET A 95 9.009 -0.889 -10.471 1.00 1.21 C ATOM 1413 SD MET A 95 10.429 -1.217 -11.535 1.00 1.67 S ATOM 1414 CE MET A 95 11.357 -2.365 -10.518 1.00 2.39 C ATOM 0 H MET A 95 5.603 -2.234 -10.963 1.00 0.50 H new ATOM 0 HA MET A 95 8.248 -2.576 -12.260 1.00 0.59 H new ATOM 0 HB2 MET A 95 7.393 -1.877 -9.474 1.00 0.60 H new ATOM 0 HB3 MET A 95 8.817 -2.874 -9.692 1.00 0.60 H new ATOM 0 HG2 MET A 95 8.373 -0.141 -10.944 1.00 1.21 H new ATOM 0 HG3 MET A 95 9.358 -0.462 -9.531 1.00 1.21 H new ATOM 0 HE1 MET A 95 12.322 -2.565 -10.983 1.00 2.39 H new ATOM 0 HE2 MET A 95 11.513 -1.932 -9.530 1.00 2.39 H new ATOM 0 HE3 MET A 95 10.801 -3.297 -10.421 1.00 2.39 H new ATOM 1424 N PRO A 96 7.929 -5.050 -12.160 1.00 0.82 N ATOM 1425 CA PRO A 96 7.626 -6.476 -12.251 1.00 0.95 C ATOM 1426 C PRO A 96 8.159 -7.306 -11.086 1.00 0.93 C ATOM 1427 O PRO A 96 9.341 -7.229 -10.740 1.00 0.98 O ATOM 1428 CB PRO A 96 8.293 -6.892 -13.559 1.00 1.19 C ATOM 1429 CG PRO A 96 9.409 -5.924 -13.743 1.00 1.26 C ATOM 1430 CD PRO A 96 8.931 -4.626 -13.157 1.00 0.99 C ATOM 0 HA PRO A 96 6.550 -6.649 -12.217 1.00 0.95 H new ATOM 0 HB2 PRO A 96 8.663 -7.916 -13.506 1.00 1.19 H new ATOM 0 HB3 PRO A 96 7.591 -6.849 -14.392 1.00 1.19 H new ATOM 0 HG2 PRO A 96 10.312 -6.270 -13.241 1.00 1.26 H new ATOM 0 HG3 PRO A 96 9.655 -5.808 -14.798 1.00 1.26 H new ATOM 0 HD2 PRO A 96 9.746 -4.069 -12.696 1.00 0.99 H new ATOM 0 HD3 PRO A 96 8.493 -3.979 -13.917 1.00 0.99 H new ATOM 1438 N GLU A 97 7.256 -8.104 -10.507 1.00 0.98 N ATOM 1439 CA GLU A 97 7.593 -9.131 -9.525 1.00 1.06 C ATOM 1440 C GLU A 97 8.043 -8.570 -8.170 1.00 0.90 C ATOM 1441 O GLU A 97 8.695 -7.533 -8.075 1.00 0.88 O ATOM 1442 CB GLU A 97 8.654 -10.063 -10.104 1.00 1.32 C ATOM 1443 CG GLU A 97 8.212 -10.740 -11.393 1.00 1.84 C ATOM 1444 CD GLU A 97 9.317 -11.538 -12.045 1.00 2.42 C ATOM 1445 OE1 GLU A 97 10.119 -10.942 -12.792 1.00 3.15 O ATOM 1446 OE2 GLU A 97 9.381 -12.764 -11.826 1.00 2.74 O ATOM 0 H GLU A 97 6.258 -8.051 -10.712 1.00 0.98 H new ATOM 0 HA GLU A 97 6.677 -9.685 -9.321 1.00 1.06 H new ATOM 0 HB2 GLU A 97 9.565 -9.495 -10.293 1.00 1.32 H new ATOM 0 HB3 GLU A 97 8.901 -10.826 -9.366 1.00 1.32 H new ATOM 0 HG2 GLU A 97 7.370 -11.399 -11.181 1.00 1.84 H new ATOM 0 HG3 GLU A 97 7.856 -9.983 -12.092 1.00 1.84 H new ATOM 1453 N ILE A 98 7.659 -9.300 -7.124 1.00 1.08 N ATOM 1454 CA ILE A 98 7.981 -8.960 -5.744 1.00 1.17 C ATOM 1455 C ILE A 98 9.486 -9.109 -5.483 1.00 1.10 C ATOM 1456 O ILE A 98 10.065 -10.184 -5.670 1.00 1.29 O ATOM 1457 CB ILE A 98 7.172 -9.875 -4.782 1.00 1.61 C ATOM 1458 CG1 ILE A 98 7.583 -9.669 -3.323 1.00 2.25 C ATOM 1459 CG2 ILE A 98 7.309 -11.339 -5.174 1.00 2.35 C ATOM 1460 CD1 ILE A 98 6.996 -8.424 -2.706 1.00 3.20 C ATOM 0 H ILE A 98 7.109 -10.154 -7.215 1.00 1.08 H new ATOM 0 HA ILE A 98 7.710 -7.920 -5.565 1.00 1.17 H new ATOM 0 HB ILE A 98 6.124 -9.590 -4.874 1.00 1.61 H new ATOM 0 HG12 ILE A 98 7.272 -10.536 -2.740 1.00 2.25 H new ATOM 0 HG13 ILE A 98 8.670 -9.617 -3.263 1.00 2.25 H new ATOM 0 HG21 ILE A 98 6.733 -11.956 -4.484 1.00 2.35 H new ATOM 0 HG22 ILE A 98 6.934 -11.481 -6.188 1.00 2.35 H new ATOM 0 HG23 ILE A 98 8.358 -11.630 -5.132 1.00 2.35 H new ATOM 0 HD11 ILE A 98 7.328 -8.339 -1.671 1.00 3.20 H new ATOM 0 HD12 ILE A 98 7.327 -7.549 -3.266 1.00 3.20 H new ATOM 0 HD13 ILE A 98 5.908 -8.482 -2.734 1.00 3.20 H new ATOM 1472 N PRO A 99 10.137 -8.010 -5.064 1.00 1.08 N ATOM 1473 CA PRO A 99 11.591 -7.959 -4.892 1.00 1.14 C ATOM 1474 C PRO A 99 12.118 -8.720 -3.670 1.00 1.08 C ATOM 1475 O PRO A 99 11.471 -8.806 -2.628 1.00 1.15 O ATOM 1476 CB PRO A 99 11.879 -6.462 -4.753 1.00 1.38 C ATOM 1477 CG PRO A 99 10.622 -5.880 -4.208 1.00 1.61 C ATOM 1478 CD PRO A 99 9.499 -6.714 -4.758 1.00 1.28 C ATOM 0 HA PRO A 99 12.092 -8.445 -5.730 1.00 1.14 H new ATOM 0 HB2 PRO A 99 12.720 -6.282 -4.084 1.00 1.38 H new ATOM 0 HB3 PRO A 99 12.136 -6.018 -5.715 1.00 1.38 H new ATOM 0 HG2 PRO A 99 10.624 -5.901 -3.118 1.00 1.61 H new ATOM 0 HG3 PRO A 99 10.515 -4.837 -4.507 1.00 1.61 H new ATOM 0 HD2 PRO A 99 8.693 -6.827 -4.033 1.00 1.28 H new ATOM 0 HD3 PRO A 99 9.065 -6.262 -5.650 1.00 1.28 H new ATOM 1486 N LYS A 100 13.315 -9.264 -3.847 1.00 1.10 N ATOM 1487 CA LYS A 100 14.082 -9.964 -2.808 1.00 1.07 C ATOM 1488 C LYS A 100 15.231 -9.064 -2.369 1.00 1.03 C ATOM 1489 O LYS A 100 15.920 -9.296 -1.366 1.00 0.99 O ATOM 1490 CB LYS A 100 14.654 -11.264 -3.377 1.00 1.15 C ATOM 1491 CG LYS A 100 13.608 -12.207 -3.946 1.00 1.99 C ATOM 1492 CD LYS A 100 14.136 -12.946 -5.166 1.00 2.34 C ATOM 1493 CE LYS A 100 15.404 -13.724 -4.858 1.00 3.09 C ATOM 1494 NZ LYS A 100 16.028 -14.261 -6.093 1.00 3.70 N ATOM 0 H LYS A 100 13.800 -9.233 -4.744 1.00 1.10 H new ATOM 0 HA LYS A 100 13.435 -10.196 -1.962 1.00 1.07 H new ATOM 0 HB2 LYS A 100 15.372 -11.020 -4.160 1.00 1.15 H new ATOM 0 HB3 LYS A 100 15.204 -11.781 -2.591 1.00 1.15 H new ATOM 0 HG2 LYS A 100 13.310 -12.926 -3.183 1.00 1.99 H new ATOM 0 HG3 LYS A 100 12.716 -11.643 -4.218 1.00 1.99 H new ATOM 0 HD2 LYS A 100 13.372 -13.630 -5.534 1.00 2.34 H new ATOM 0 HD3 LYS A 100 14.335 -12.231 -5.965 1.00 2.34 H new ATOM 0 HE2 LYS A 100 16.113 -13.076 -4.343 1.00 3.09 H new ATOM 0 HE3 LYS A 100 15.172 -14.545 -4.180 1.00 3.09 H new ATOM 0 HZ1 LYS A 100 16.891 -14.786 -5.846 1.00 3.70 H new ATOM 0 HZ2 LYS A 100 15.359 -14.899 -6.571 1.00 3.70 H new ATOM 0 HZ3 LYS A 100 16.271 -13.475 -6.729 1.00 3.70 H new ATOM 1508 N THR A 101 15.445 -8.085 -3.228 1.00 1.10 N ATOM 1509 CA THR A 101 16.632 -7.284 -3.297 1.00 1.11 C ATOM 1510 C THR A 101 16.245 -5.802 -3.534 1.00 1.16 C ATOM 1511 O THR A 101 15.634 -5.481 -4.555 1.00 1.30 O ATOM 1512 CB THR A 101 17.548 -7.861 -4.412 1.00 1.30 C ATOM 1513 OG1 THR A 101 18.813 -7.209 -4.446 1.00 1.73 O ATOM 1514 CG2 THR A 101 16.894 -7.792 -5.788 1.00 1.92 C ATOM 0 H THR A 101 14.753 -7.821 -3.929 1.00 1.10 H new ATOM 0 HA THR A 101 17.188 -7.314 -2.360 1.00 1.11 H new ATOM 0 HB THR A 101 17.704 -8.910 -4.162 1.00 1.30 H new ATOM 0 HG1 THR A 101 18.694 -6.255 -4.258 1.00 1.73 H new ATOM 0 HG21 THR A 101 17.572 -8.206 -6.534 1.00 1.92 H new ATOM 0 HG22 THR A 101 15.968 -8.367 -5.780 1.00 1.92 H new ATOM 0 HG23 THR A 101 16.674 -6.753 -6.035 1.00 1.92 H new ATOM 1522 N ILE A 102 16.546 -4.896 -2.578 1.00 1.14 N ATOM 1523 CA ILE A 102 16.113 -3.492 -2.734 1.00 1.18 C ATOM 1524 C ILE A 102 17.237 -2.633 -3.251 1.00 1.22 C ATOM 1525 O ILE A 102 18.156 -2.290 -2.533 1.00 1.37 O ATOM 1526 CB ILE A 102 15.580 -2.866 -1.414 1.00 1.31 C ATOM 1527 CG1 ILE A 102 15.460 -1.338 -1.519 1.00 2.08 C ATOM 1528 CG2 ILE A 102 16.460 -3.243 -0.228 1.00 1.98 C ATOM 1529 CD1 ILE A 102 14.364 -0.871 -2.449 1.00 2.69 C ATOM 0 H ILE A 102 17.065 -5.099 -1.724 1.00 1.14 H new ATOM 0 HA ILE A 102 15.294 -3.519 -3.453 1.00 1.18 H new ATOM 0 HB ILE A 102 14.583 -3.274 -1.249 1.00 1.31 H new ATOM 0 HG12 ILE A 102 15.278 -0.929 -0.525 1.00 2.08 H new ATOM 0 HG13 ILE A 102 16.411 -0.932 -1.862 1.00 2.08 H new ATOM 0 HG21 ILE A 102 16.061 -2.790 0.680 1.00 1.98 H new ATOM 0 HG22 ILE A 102 16.475 -4.327 -0.116 1.00 1.98 H new ATOM 0 HG23 ILE A 102 17.474 -2.882 -0.398 1.00 1.98 H new ATOM 0 HD11 ILE A 102 14.343 0.219 -2.469 1.00 2.69 H new ATOM 0 HD12 ILE A 102 14.554 -1.249 -3.454 1.00 2.69 H new ATOM 0 HD13 ILE A 102 13.403 -1.246 -2.096 1.00 2.69 H new ATOM 1541 N THR A 103 17.118 -2.207 -4.478 1.00 1.15 N ATOM 1542 CA THR A 103 18.200 -1.511 -5.106 1.00 1.20 C ATOM 1543 C THR A 103 17.717 -0.166 -5.589 1.00 1.08 C ATOM 1544 O THR A 103 16.900 -0.069 -6.498 1.00 1.05 O ATOM 1545 CB THR A 103 18.816 -2.338 -6.268 1.00 1.39 C ATOM 1546 OG1 THR A 103 19.765 -1.552 -7.005 1.00 1.58 O ATOM 1547 CG2 THR A 103 17.743 -2.869 -7.211 1.00 1.57 C ATOM 0 H THR A 103 16.288 -2.330 -5.058 1.00 1.15 H new ATOM 0 HA THR A 103 18.992 -1.363 -4.372 1.00 1.20 H new ATOM 0 HB THR A 103 19.328 -3.190 -5.821 1.00 1.39 H new ATOM 0 HG1 THR A 103 20.143 -2.091 -7.731 1.00 1.58 H new ATOM 0 HG21 THR A 103 18.212 -3.442 -8.011 1.00 1.57 H new ATOM 0 HG22 THR A 103 17.058 -3.512 -6.658 1.00 1.57 H new ATOM 0 HG23 THR A 103 17.190 -2.034 -7.640 1.00 1.57 H new ATOM 1555 N GLY A 104 18.317 0.850 -4.978 1.00 1.08 N ATOM 1556 CA GLY A 104 17.924 2.255 -5.121 1.00 1.03 C ATOM 1557 C GLY A 104 16.467 2.517 -5.500 1.00 0.92 C ATOM 1558 O GLY A 104 15.662 2.849 -4.636 1.00 0.84 O ATOM 0 H GLY A 104 19.112 0.720 -4.352 1.00 1.08 H new ATOM 0 HA2 GLY A 104 18.129 2.765 -4.180 1.00 1.03 H new ATOM 0 HA3 GLY A 104 18.562 2.713 -5.877 1.00 1.03 H new ATOM 1562 N SER A 105 16.132 2.363 -6.767 1.00 0.96 N ATOM 1563 CA SER A 105 14.892 2.885 -7.341 1.00 0.92 C ATOM 1564 C SER A 105 13.603 2.259 -6.776 1.00 0.81 C ATOM 1565 O SER A 105 12.535 2.833 -6.949 1.00 0.77 O ATOM 1566 CB SER A 105 14.929 2.701 -8.857 1.00 1.05 C ATOM 1567 OG SER A 105 16.195 3.076 -9.383 1.00 1.47 O ATOM 0 H SER A 105 16.716 1.867 -7.440 1.00 0.96 H new ATOM 0 HA SER A 105 14.850 3.938 -7.063 1.00 0.92 H new ATOM 0 HB2 SER A 105 14.721 1.660 -9.106 1.00 1.05 H new ATOM 0 HB3 SER A 105 14.146 3.302 -9.319 1.00 1.05 H new ATOM 0 HG SER A 105 16.196 2.948 -10.355 1.00 1.47 H new ATOM 1573 N GLU A 106 13.681 1.114 -6.101 1.00 0.79 N ATOM 1574 CA GLU A 106 12.481 0.390 -5.676 1.00 0.72 C ATOM 1575 C GLU A 106 11.881 1.053 -4.420 1.00 0.56 C ATOM 1576 O GLU A 106 10.887 0.602 -3.856 1.00 0.51 O ATOM 1577 CB GLU A 106 12.851 -1.083 -5.431 1.00 0.82 C ATOM 1578 CG GLU A 106 11.679 -2.002 -5.119 1.00 1.28 C ATOM 1579 CD GLU A 106 10.538 -1.850 -6.100 1.00 1.74 C ATOM 1580 OE1 GLU A 106 10.796 -1.635 -7.303 1.00 2.11 O ATOM 1581 OE2 GLU A 106 9.371 -1.883 -5.664 1.00 2.39 O ATOM 0 H GLU A 106 14.559 0.667 -5.836 1.00 0.79 H new ATOM 0 HA GLU A 106 11.718 0.428 -6.454 1.00 0.72 H new ATOM 0 HB2 GLU A 106 13.365 -1.463 -6.313 1.00 0.82 H new ATOM 0 HB3 GLU A 106 13.559 -1.130 -4.604 1.00 0.82 H new ATOM 0 HG2 GLU A 106 12.023 -3.036 -5.126 1.00 1.28 H new ATOM 0 HG3 GLU A 106 11.317 -1.793 -4.112 1.00 1.28 H new ATOM 1588 N THR A 107 12.494 2.164 -4.036 1.00 0.55 N ATOM 1589 CA THR A 107 12.142 2.925 -2.855 1.00 0.49 C ATOM 1590 C THR A 107 10.761 3.581 -2.943 1.00 0.37 C ATOM 1591 O THR A 107 10.301 4.167 -1.974 1.00 0.38 O ATOM 1592 CB THR A 107 13.202 4.009 -2.608 1.00 0.62 C ATOM 1593 OG1 THR A 107 13.705 4.488 -3.864 1.00 1.41 O ATOM 1594 CG2 THR A 107 14.343 3.470 -1.754 1.00 1.27 C ATOM 0 H THR A 107 13.272 2.569 -4.556 1.00 0.55 H new ATOM 0 HA THR A 107 12.106 2.217 -2.027 1.00 0.49 H new ATOM 0 HB THR A 107 12.737 4.834 -2.068 1.00 0.62 H new ATOM 0 HG1 THR A 107 14.535 4.016 -4.086 1.00 1.41 H new ATOM 0 HG21 THR A 107 15.080 4.257 -1.593 1.00 1.27 H new ATOM 0 HG22 THR A 107 13.952 3.137 -0.792 1.00 1.27 H new ATOM 0 HG23 THR A 107 14.814 2.630 -2.264 1.00 1.27 H new ATOM 1602 N ASN A 108 10.110 3.534 -4.104 1.00 0.34 N ATOM 1603 CA ASN A 108 8.769 4.032 -4.212 1.00 0.29 C ATOM 1604 C ASN A 108 7.852 3.189 -3.354 1.00 0.25 C ATOM 1605 O ASN A 108 6.897 3.680 -2.759 1.00 0.27 O ATOM 1606 CB ASN A 108 8.317 3.925 -5.661 1.00 0.40 C ATOM 1607 CG ASN A 108 9.459 3.857 -6.649 1.00 0.58 C ATOM 1608 OD1 ASN A 108 9.890 2.769 -7.021 1.00 1.39 O ATOM 1609 ND2 ASN A 108 9.951 5.009 -7.083 1.00 1.22 N ATOM 0 H ASN A 108 10.498 3.156 -4.968 1.00 0.34 H new ATOM 0 HA ASN A 108 8.735 5.070 -3.882 1.00 0.29 H new ATOM 0 HB2 ASN A 108 7.696 3.036 -5.774 1.00 0.40 H new ATOM 0 HB3 ASN A 108 7.690 4.784 -5.902 1.00 0.40 H new ATOM 0 HD21 ASN A 108 10.719 5.015 -7.754 1.00 1.22 H new ATOM 0 HD22 ASN A 108 9.561 5.889 -6.746 1.00 1.22 H new ATOM 1616 N LEU A 109 8.177 1.913 -3.300 1.00 0.25 N ATOM 1617 CA LEU A 109 7.349 0.927 -2.651 1.00 0.26 C ATOM 1618 C LEU A 109 7.714 0.695 -1.181 1.00 0.21 C ATOM 1619 O LEU A 109 7.556 -0.424 -0.682 1.00 0.23 O ATOM 1620 CB LEU A 109 7.506 -0.368 -3.438 1.00 0.41 C ATOM 1621 CG LEU A 109 6.610 -1.530 -3.036 1.00 0.54 C ATOM 1622 CD1 LEU A 109 5.177 -1.275 -3.460 1.00 0.83 C ATOM 1623 CD2 LEU A 109 7.142 -2.800 -3.661 1.00 0.95 C ATOM 0 H LEU A 109 9.030 1.532 -3.709 1.00 0.25 H new ATOM 0 HA LEU A 109 6.319 1.284 -2.643 1.00 0.26 H new ATOM 0 HB2 LEU A 109 7.326 -0.149 -4.491 1.00 0.41 H new ATOM 0 HB3 LEU A 109 8.543 -0.694 -3.353 1.00 0.41 H new ATOM 0 HG LEU A 109 6.615 -1.634 -1.951 1.00 0.54 H new ATOM 0 HD11 LEU A 109 4.554 -2.118 -3.163 1.00 0.83 H new ATOM 0 HD12 LEU A 109 4.812 -0.367 -2.980 1.00 0.83 H new ATOM 0 HD13 LEU A 109 5.134 -1.156 -4.543 1.00 0.83 H new ATOM 0 HD21 LEU A 109 6.506 -3.639 -3.378 1.00 0.95 H new ATOM 0 HD22 LEU A 109 7.146 -2.697 -4.746 1.00 0.95 H new ATOM 0 HD23 LEU A 109 8.158 -2.981 -3.310 1.00 0.95 H new ATOM 1635 N LEU A 110 8.132 1.724 -0.449 1.00 0.20 N ATOM 1636 CA LEU A 110 8.334 1.523 0.974 1.00 0.21 C ATOM 1637 C LEU A 110 7.161 2.066 1.778 1.00 0.23 C ATOM 1638 O LEU A 110 6.696 3.183 1.549 1.00 0.31 O ATOM 1639 CB LEU A 110 9.664 2.135 1.458 1.00 0.28 C ATOM 1640 CG LEU A 110 10.174 3.385 0.727 1.00 0.81 C ATOM 1641 CD1 LEU A 110 9.238 4.569 0.922 1.00 1.71 C ATOM 1642 CD2 LEU A 110 11.573 3.735 1.214 1.00 1.64 C ATOM 0 H LEU A 110 8.329 2.661 -0.800 1.00 0.20 H new ATOM 0 HA LEU A 110 8.391 0.447 1.141 1.00 0.21 H new ATOM 0 HB2 LEU A 110 9.556 2.383 2.514 1.00 0.28 H new ATOM 0 HB3 LEU A 110 10.434 1.366 1.388 1.00 0.28 H new ATOM 0 HG LEU A 110 10.206 3.161 -0.339 1.00 0.81 H new ATOM 0 HD11 LEU A 110 9.632 5.435 0.390 1.00 1.71 H new ATOM 0 HD12 LEU A 110 8.251 4.321 0.531 1.00 1.71 H new ATOM 0 HD13 LEU A 110 9.160 4.800 1.984 1.00 1.71 H new ATOM 0 HD21 LEU A 110 11.929 4.623 0.691 1.00 1.64 H new ATOM 0 HD22 LEU A 110 11.547 3.931 2.286 1.00 1.64 H new ATOM 0 HD23 LEU A 110 12.247 2.902 1.014 1.00 1.64 H new ATOM 1654 N PHE A 111 6.730 1.294 2.769 1.00 0.22 N ATOM 1655 CA PHE A 111 5.538 1.634 3.544 1.00 0.25 C ATOM 1656 C PHE A 111 5.699 1.282 5.017 1.00 0.23 C ATOM 1657 O PHE A 111 5.991 0.140 5.367 1.00 0.27 O ATOM 1658 CB PHE A 111 4.303 0.940 2.960 1.00 0.42 C ATOM 1659 CG PHE A 111 4.130 1.219 1.499 1.00 0.91 C ATOM 1660 CD1 PHE A 111 3.940 2.515 1.052 1.00 1.64 C ATOM 1661 CD2 PHE A 111 4.197 0.197 0.573 1.00 1.18 C ATOM 1662 CE1 PHE A 111 3.824 2.785 -0.296 1.00 2.38 C ATOM 1663 CE2 PHE A 111 4.072 0.460 -0.773 1.00 1.90 C ATOM 1664 CZ PHE A 111 3.888 1.755 -1.207 1.00 2.46 C ATOM 0 H PHE A 111 7.187 0.428 3.056 1.00 0.22 H new ATOM 0 HA PHE A 111 5.402 2.714 3.478 1.00 0.25 H new ATOM 0 HB2 PHE A 111 4.387 -0.136 3.114 1.00 0.42 H new ATOM 0 HB3 PHE A 111 3.415 1.271 3.498 1.00 0.42 H new ATOM 0 HD1 PHE A 111 3.882 3.323 1.766 1.00 1.64 H new ATOM 0 HD2 PHE A 111 4.349 -0.819 0.908 1.00 1.18 H new ATOM 0 HE1 PHE A 111 3.684 3.801 -0.635 1.00 2.38 H new ATOM 0 HE2 PHE A 111 4.118 -0.348 -1.488 1.00 1.90 H new ATOM 0 HZ PHE A 111 3.794 1.962 -2.263 1.00 2.46 H new ATOM 1674 N PHE A 112 5.516 2.283 5.860 1.00 0.21 N ATOM 1675 CA PHE A 112 5.657 2.140 7.311 1.00 0.25 C ATOM 1676 C PHE A 112 4.371 1.620 7.907 1.00 0.25 C ATOM 1677 O PHE A 112 3.360 2.321 7.939 1.00 0.26 O ATOM 1678 CB PHE A 112 6.055 3.455 7.989 1.00 0.30 C ATOM 1679 CG PHE A 112 5.981 3.406 9.491 1.00 0.57 C ATOM 1680 CD1 PHE A 112 6.681 2.445 10.205 1.00 0.79 C ATOM 1681 CD2 PHE A 112 5.200 4.314 10.187 1.00 0.95 C ATOM 1682 CE1 PHE A 112 6.604 2.394 11.584 1.00 1.21 C ATOM 1683 CE2 PHE A 112 5.118 4.267 11.564 1.00 1.43 C ATOM 1684 CZ PHE A 112 5.823 3.305 12.264 1.00 1.50 C ATOM 0 H PHE A 112 5.264 3.226 5.563 1.00 0.21 H new ATOM 0 HA PHE A 112 6.461 1.426 7.490 1.00 0.25 H new ATOM 0 HB2 PHE A 112 7.071 3.714 7.692 1.00 0.30 H new ATOM 0 HB3 PHE A 112 5.405 4.252 7.628 1.00 0.30 H new ATOM 0 HD1 PHE A 112 7.293 1.728 9.678 1.00 0.79 H new ATOM 0 HD2 PHE A 112 4.648 5.068 9.645 1.00 0.95 H new ATOM 0 HE1 PHE A 112 7.155 1.641 12.129 1.00 1.21 H new ATOM 0 HE2 PHE A 112 4.504 4.980 12.094 1.00 1.43 H new ATOM 0 HZ PHE A 112 5.762 3.267 13.342 1.00 1.50 H new ATOM 1694 N TRP A 113 4.415 0.388 8.364 1.00 0.31 N ATOM 1695 CA TRP A 113 3.213 -0.318 8.768 1.00 0.35 C ATOM 1696 C TRP A 113 2.963 -0.116 10.264 1.00 0.33 C ATOM 1697 O TRP A 113 3.637 -0.698 11.114 1.00 0.37 O ATOM 1698 CB TRP A 113 3.436 -1.804 8.428 1.00 0.48 C ATOM 1699 CG TRP A 113 2.378 -2.759 8.892 1.00 1.08 C ATOM 1700 CD1 TRP A 113 1.165 -2.984 8.316 1.00 2.30 C ATOM 1701 CD2 TRP A 113 2.470 -3.663 10.002 1.00 1.17 C ATOM 1702 NE1 TRP A 113 0.484 -3.954 9.011 1.00 3.02 N ATOM 1703 CE2 TRP A 113 1.263 -4.386 10.051 1.00 2.29 C ATOM 1704 CE3 TRP A 113 3.451 -3.923 10.964 1.00 1.12 C ATOM 1705 CZ2 TRP A 113 1.014 -5.350 11.023 1.00 2.67 C ATOM 1706 CZ3 TRP A 113 3.201 -4.881 11.927 1.00 1.47 C ATOM 1707 CH2 TRP A 113 1.991 -5.585 11.951 1.00 2.02 C ATOM 0 H TRP A 113 5.275 -0.151 8.467 1.00 0.31 H new ATOM 0 HA TRP A 113 2.332 0.058 8.247 1.00 0.35 H new ATOM 0 HB2 TRP A 113 3.529 -1.897 7.346 1.00 0.48 H new ATOM 0 HB3 TRP A 113 4.388 -2.114 8.858 1.00 0.48 H new ATOM 0 HD1 TRP A 113 0.792 -2.474 7.440 1.00 2.30 H new ATOM 0 HE1 TRP A 113 -0.451 -4.297 8.788 1.00 3.02 H new ATOM 0 HE3 TRP A 113 4.387 -3.384 10.954 1.00 1.12 H new ATOM 0 HZ2 TRP A 113 0.081 -5.894 11.044 1.00 2.67 H new ATOM 0 HZ3 TRP A 113 3.952 -5.091 12.674 1.00 1.47 H new ATOM 0 HH2 TRP A 113 1.826 -6.328 12.717 1.00 2.02 H new ATOM 1718 N GLU A 114 1.997 0.751 10.558 1.00 0.32 N ATOM 1719 CA GLU A 114 1.557 1.010 11.926 1.00 0.37 C ATOM 1720 C GLU A 114 0.187 0.389 12.172 1.00 0.39 C ATOM 1721 O GLU A 114 -0.823 0.891 11.673 1.00 0.42 O ATOM 1722 CB GLU A 114 1.516 2.513 12.203 1.00 0.43 C ATOM 1723 CG GLU A 114 1.092 2.853 13.623 1.00 0.96 C ATOM 1724 CD GLU A 114 1.172 4.335 13.924 1.00 1.50 C ATOM 1725 OE1 GLU A 114 0.164 5.042 13.718 1.00 1.90 O ATOM 1726 OE2 GLU A 114 2.234 4.790 14.398 1.00 2.32 O ATOM 0 H GLU A 114 1.497 1.294 9.854 1.00 0.32 H new ATOM 0 HA GLU A 114 2.274 0.553 12.608 1.00 0.37 H new ATOM 0 HB2 GLU A 114 2.502 2.937 12.015 1.00 0.43 H new ATOM 0 HB3 GLU A 114 0.827 2.986 11.503 1.00 0.43 H new ATOM 0 HG2 GLU A 114 0.070 2.510 13.784 1.00 0.96 H new ATOM 0 HG3 GLU A 114 1.725 2.310 14.325 1.00 0.96 H new ATOM 1733 N THR A 115 0.139 -0.682 12.948 1.00 0.47 N ATOM 1734 CA THR A 115 -1.104 -1.415 13.146 1.00 0.49 C ATOM 1735 C THR A 115 -1.782 -1.042 14.463 1.00 0.52 C ATOM 1736 O THR A 115 -1.160 -1.067 15.529 1.00 0.64 O ATOM 1737 CB THR A 115 -0.866 -2.944 13.095 1.00 0.67 C ATOM 1738 OG1 THR A 115 -2.086 -3.649 13.367 1.00 1.38 O ATOM 1739 CG2 THR A 115 0.205 -3.369 14.089 1.00 1.39 C ATOM 0 H THR A 115 0.941 -1.063 13.449 1.00 0.47 H new ATOM 0 HA THR A 115 -1.768 -1.132 12.329 1.00 0.49 H new ATOM 0 HB THR A 115 -0.522 -3.193 12.091 1.00 0.67 H new ATOM 0 HG1 THR A 115 -1.921 -4.614 13.330 1.00 1.38 H new ATOM 0 HG21 THR A 115 0.349 -4.448 14.029 1.00 1.39 H new ATOM 0 HG22 THR A 115 1.142 -2.864 13.853 1.00 1.39 H new ATOM 0 HG23 THR A 115 -0.108 -3.100 15.098 1.00 1.39 H new ATOM 1747 N HIS A 116 -3.052 -0.649 14.378 1.00 0.47 N ATOM 1748 CA HIS A 116 -3.861 -0.419 15.569 1.00 0.56 C ATOM 1749 C HIS A 116 -5.212 -1.113 15.435 1.00 0.56 C ATOM 1750 O HIS A 116 -6.144 -0.573 14.834 1.00 0.55 O ATOM 1751 CB HIS A 116 -4.074 1.080 15.815 1.00 0.66 C ATOM 1752 CG HIS A 116 -2.847 1.810 16.269 1.00 1.29 C ATOM 1753 ND1 HIS A 116 -2.466 3.032 15.757 1.00 1.88 N ATOM 1754 CD2 HIS A 116 -1.921 1.492 17.202 1.00 2.27 C ATOM 1755 CE1 HIS A 116 -1.360 3.432 16.354 1.00 2.63 C ATOM 1756 NE2 HIS A 116 -1.009 2.516 17.234 1.00 2.89 N ATOM 0 H HIS A 116 -3.540 -0.484 13.498 1.00 0.47 H new ATOM 0 HA HIS A 116 -3.323 -0.836 16.421 1.00 0.56 H new ATOM 0 HB2 HIS A 116 -4.437 1.539 14.895 1.00 0.66 H new ATOM 0 HB3 HIS A 116 -4.856 1.206 16.564 1.00 0.66 H new ATOM 0 HD2 HIS A 116 -1.903 0.599 17.809 1.00 2.27 H new ATOM 0 HE1 HIS A 116 -0.832 4.353 16.156 1.00 2.63 H new ATOM 0 HE2 HIS A 116 -0.191 2.561 17.841 1.00 2.89 H new ATOM 1765 N GLY A 117 -5.314 -2.297 16.015 1.00 0.64 N ATOM 1766 CA GLY A 117 -6.557 -3.045 15.996 1.00 0.71 C ATOM 1767 C GLY A 117 -6.848 -3.677 14.646 1.00 0.69 C ATOM 1768 O GLY A 117 -6.221 -4.669 14.269 1.00 0.74 O ATOM 0 H GLY A 117 -4.549 -2.760 16.505 1.00 0.64 H new ATOM 0 HA2 GLY A 117 -6.517 -3.826 16.755 1.00 0.71 H new ATOM 0 HA3 GLY A 117 -7.379 -2.381 16.265 1.00 0.71 H new ATOM 1772 N THR A 118 -7.790 -3.097 13.916 1.00 0.66 N ATOM 1773 CA THR A 118 -8.183 -3.612 12.613 1.00 0.69 C ATOM 1774 C THR A 118 -7.609 -2.745 11.494 1.00 0.56 C ATOM 1775 O THR A 118 -7.026 -3.256 10.539 1.00 0.57 O ATOM 1776 CB THR A 118 -9.719 -3.692 12.493 1.00 0.81 C ATOM 1777 OG1 THR A 118 -10.230 -4.606 13.474 1.00 1.60 O ATOM 1778 CG2 THR A 118 -10.144 -4.153 11.106 1.00 1.39 C ATOM 0 H THR A 118 -8.300 -2.263 14.207 1.00 0.66 H new ATOM 0 HA THR A 118 -7.778 -4.619 12.514 1.00 0.69 H new ATOM 0 HB THR A 118 -10.124 -2.694 12.661 1.00 0.81 H new ATOM 0 HG1 THR A 118 -11.206 -4.655 13.398 1.00 1.60 H new ATOM 0 HG21 THR A 118 -11.232 -4.199 11.055 1.00 1.39 H new ATOM 0 HG22 THR A 118 -9.775 -3.449 10.360 1.00 1.39 H new ATOM 0 HG23 THR A 118 -9.730 -5.142 10.908 1.00 1.39 H new ATOM 1786 N LYS A 119 -7.751 -1.435 11.637 1.00 0.50 N ATOM 1787 CA LYS A 119 -7.196 -0.496 10.675 1.00 0.41 C ATOM 1788 C LYS A 119 -5.688 -0.352 10.924 1.00 0.35 C ATOM 1789 O LYS A 119 -5.176 -0.690 11.996 1.00 0.40 O ATOM 1790 CB LYS A 119 -7.889 0.867 10.804 1.00 0.46 C ATOM 1791 CG LYS A 119 -7.728 1.526 12.168 1.00 0.98 C ATOM 1792 CD LYS A 119 -8.511 2.829 12.244 1.00 1.36 C ATOM 1793 CE LYS A 119 -8.325 3.530 13.579 1.00 1.79 C ATOM 1794 NZ LYS A 119 -8.854 2.726 14.712 1.00 2.49 N ATOM 0 H LYS A 119 -8.248 -0.998 12.413 1.00 0.50 H new ATOM 0 HA LYS A 119 -7.362 -0.870 9.665 1.00 0.41 H new ATOM 0 HB2 LYS A 119 -7.492 1.537 10.041 1.00 0.46 H new ATOM 0 HB3 LYS A 119 -8.952 0.742 10.597 1.00 0.46 H new ATOM 0 HG2 LYS A 119 -8.072 0.846 12.947 1.00 0.98 H new ATOM 0 HG3 LYS A 119 -6.673 1.721 12.359 1.00 0.98 H new ATOM 0 HD2 LYS A 119 -8.191 3.491 11.440 1.00 1.36 H new ATOM 0 HD3 LYS A 119 -9.570 2.625 12.087 1.00 1.36 H new ATOM 0 HE2 LYS A 119 -7.265 3.728 13.739 1.00 1.79 H new ATOM 0 HE3 LYS A 119 -8.829 4.496 13.554 1.00 1.79 H new ATOM 0 HZ1 LYS A 119 -8.846 3.301 15.579 1.00 2.49 H new ATOM 0 HZ2 LYS A 119 -9.828 2.429 14.502 1.00 2.49 H new ATOM 0 HZ3 LYS A 119 -8.258 1.885 14.849 1.00 2.49 H new ATOM 1808 N ASN A 120 -4.997 0.149 9.925 1.00 0.30 N ATOM 1809 CA ASN A 120 -3.549 0.224 9.904 1.00 0.28 C ATOM 1810 C ASN A 120 -3.136 1.304 8.909 1.00 0.28 C ATOM 1811 O ASN A 120 -3.836 1.539 7.927 1.00 0.32 O ATOM 1812 CB ASN A 120 -2.989 -1.140 9.482 1.00 0.36 C ATOM 1813 CG ASN A 120 -1.493 -1.135 9.244 1.00 1.26 C ATOM 1814 OD1 ASN A 120 -0.715 -1.444 10.135 1.00 2.08 O ATOM 1815 ND2 ASN A 120 -1.083 -0.791 8.034 1.00 2.07 N ATOM 0 H ASN A 120 -5.434 0.525 9.084 1.00 0.30 H new ATOM 0 HA ASN A 120 -3.157 0.476 10.890 1.00 0.28 H new ATOM 0 HB2 ASN A 120 -3.223 -1.874 10.253 1.00 0.36 H new ATOM 0 HB3 ASN A 120 -3.492 -1.464 8.571 1.00 0.36 H new ATOM 0 HD21 ASN A 120 -0.086 -0.777 7.818 1.00 2.07 H new ATOM 0 HD22 ASN A 120 -1.764 -0.540 7.317 1.00 2.07 H new ATOM 1822 N TYR A 121 -2.009 1.949 9.154 1.00 0.31 N ATOM 1823 CA TYR A 121 -1.556 3.051 8.310 1.00 0.37 C ATOM 1824 C TYR A 121 -0.308 2.649 7.526 1.00 0.30 C ATOM 1825 O TYR A 121 0.387 1.710 7.924 1.00 0.34 O ATOM 1826 CB TYR A 121 -1.241 4.257 9.199 1.00 0.66 C ATOM 1827 CG TYR A 121 -2.361 4.616 10.153 1.00 1.06 C ATOM 1828 CD1 TYR A 121 -2.453 4.024 11.403 1.00 1.46 C ATOM 1829 CD2 TYR A 121 -3.322 5.555 9.801 1.00 1.41 C ATOM 1830 CE1 TYR A 121 -3.468 4.357 12.277 1.00 1.98 C ATOM 1831 CE2 TYR A 121 -4.339 5.895 10.668 1.00 2.01 C ATOM 1832 CZ TYR A 121 -4.426 5.256 11.899 1.00 2.23 C ATOM 1833 OH TYR A 121 -5.418 5.632 12.776 1.00 2.84 O ATOM 0 H TYR A 121 -1.386 1.731 9.932 1.00 0.31 H new ATOM 0 HA TYR A 121 -2.342 3.305 7.598 1.00 0.37 H new ATOM 0 HB2 TYR A 121 -0.339 4.048 9.774 1.00 0.66 H new ATOM 0 HB3 TYR A 121 -1.024 5.118 8.566 1.00 0.66 H new ATOM 0 HD1 TYR A 121 -1.718 3.290 11.698 1.00 1.46 H new ATOM 0 HD2 TYR A 121 -3.272 6.027 8.831 1.00 1.41 H new ATOM 0 HE1 TYR A 121 -3.505 3.908 13.258 1.00 1.98 H new ATOM 0 HE2 TYR A 121 -5.061 6.650 10.393 1.00 2.01 H new ATOM 0 HH TYR A 121 -6.012 6.279 12.341 1.00 2.84 H new ATOM 1843 N PHE A 122 -0.007 3.342 6.419 1.00 0.30 N ATOM 1844 CA PHE A 122 1.265 3.138 5.750 1.00 0.29 C ATOM 1845 C PHE A 122 1.952 4.470 5.526 1.00 0.26 C ATOM 1846 O PHE A 122 1.662 5.165 4.565 1.00 0.32 O ATOM 1847 CB PHE A 122 1.094 2.432 4.405 1.00 0.34 C ATOM 1848 CG PHE A 122 0.511 1.052 4.492 1.00 1.05 C ATOM 1849 CD1 PHE A 122 1.236 0.014 5.050 1.00 1.45 C ATOM 1850 CD2 PHE A 122 -0.771 0.799 4.031 1.00 1.56 C ATOM 1851 CE1 PHE A 122 0.695 -1.252 5.145 1.00 2.18 C ATOM 1852 CE2 PHE A 122 -1.317 -0.464 4.125 1.00 2.27 C ATOM 1853 CZ PHE A 122 -0.553 -1.509 4.623 1.00 2.54 C ATOM 0 H PHE A 122 -0.618 4.032 5.983 1.00 0.30 H new ATOM 0 HA PHE A 122 1.873 2.504 6.395 1.00 0.29 H new ATOM 0 HB2 PHE A 122 0.454 3.043 3.768 1.00 0.34 H new ATOM 0 HB3 PHE A 122 2.066 2.371 3.916 1.00 0.34 H new ATOM 0 HD1 PHE A 122 2.236 0.196 5.415 1.00 1.45 H new ATOM 0 HD2 PHE A 122 -1.349 1.600 3.593 1.00 1.56 H new ATOM 0 HE1 PHE A 122 1.251 -2.042 5.629 1.00 2.18 H new ATOM 0 HE2 PHE A 122 -2.336 -0.639 3.812 1.00 2.27 H new ATOM 0 HZ PHE A 122 -0.935 -2.519 4.601 1.00 2.54 H new ATOM 1863 N THR A 123 2.887 4.807 6.381 1.00 0.22 N ATOM 1864 CA THR A 123 3.606 6.049 6.244 1.00 0.22 C ATOM 1865 C THR A 123 4.816 5.795 5.368 1.00 0.20 C ATOM 1866 O THR A 123 5.469 4.782 5.516 1.00 0.19 O ATOM 1867 CB THR A 123 4.070 6.537 7.628 1.00 0.24 C ATOM 1868 OG1 THR A 123 3.016 6.355 8.581 1.00 0.32 O ATOM 1869 CG2 THR A 123 4.472 8.001 7.589 1.00 0.33 C ATOM 0 H THR A 123 3.168 4.238 7.179 1.00 0.22 H new ATOM 0 HA THR A 123 2.964 6.809 5.800 1.00 0.22 H new ATOM 0 HB THR A 123 4.941 5.951 7.921 1.00 0.24 H new ATOM 0 HG1 THR A 123 2.244 6.901 8.323 1.00 0.32 H new ATOM 0 HG21 THR A 123 4.795 8.316 8.581 1.00 0.33 H new ATOM 0 HG22 THR A 123 5.290 8.135 6.882 1.00 0.33 H new ATOM 0 HG23 THR A 123 3.620 8.604 7.276 1.00 0.33 H new ATOM 1877 N SER A 124 5.122 6.672 4.441 1.00 0.21 N ATOM 1878 CA SER A 124 6.212 6.377 3.542 1.00 0.23 C ATOM 1879 C SER A 124 7.512 6.465 4.311 1.00 0.29 C ATOM 1880 O SER A 124 7.820 7.481 4.930 1.00 0.34 O ATOM 1881 CB SER A 124 6.210 7.317 2.339 1.00 0.26 C ATOM 1882 OG SER A 124 5.049 7.117 1.550 1.00 1.17 O ATOM 0 H SER A 124 4.651 7.564 4.291 1.00 0.21 H new ATOM 0 HA SER A 124 6.094 5.368 3.148 1.00 0.23 H new ATOM 0 HB2 SER A 124 6.251 8.352 2.679 1.00 0.26 H new ATOM 0 HB3 SER A 124 7.101 7.145 1.735 1.00 0.26 H new ATOM 0 HG SER A 124 5.311 6.850 0.644 1.00 1.17 H new ATOM 1888 N VAL A 125 8.265 5.377 4.278 1.00 0.33 N ATOM 1889 CA VAL A 125 9.437 5.238 5.115 1.00 0.43 C ATOM 1890 C VAL A 125 10.560 6.138 4.607 1.00 0.53 C ATOM 1891 O VAL A 125 11.456 6.518 5.361 1.00 0.65 O ATOM 1892 CB VAL A 125 9.872 3.743 5.203 1.00 0.48 C ATOM 1893 CG1 VAL A 125 11.353 3.590 5.526 1.00 0.81 C ATOM 1894 CG2 VAL A 125 9.042 3.027 6.253 1.00 0.47 C ATOM 0 H VAL A 125 8.080 4.575 3.675 1.00 0.33 H new ATOM 0 HA VAL A 125 9.195 5.561 6.127 1.00 0.43 H new ATOM 0 HB VAL A 125 9.703 3.296 4.223 1.00 0.48 H new ATOM 0 HG11 VAL A 125 11.607 2.531 5.577 1.00 0.81 H new ATOM 0 HG12 VAL A 125 11.947 4.069 4.747 1.00 0.81 H new ATOM 0 HG13 VAL A 125 11.567 4.060 6.486 1.00 0.81 H new ATOM 0 HG21 VAL A 125 9.350 1.983 6.310 1.00 0.47 H new ATOM 0 HG22 VAL A 125 9.192 3.503 7.222 1.00 0.47 H new ATOM 0 HG23 VAL A 125 7.988 3.080 5.982 1.00 0.47 H new ATOM 1904 N ALA A 126 10.471 6.532 3.346 1.00 0.53 N ATOM 1905 CA ALA A 126 11.405 7.513 2.810 1.00 0.63 C ATOM 1906 C ALA A 126 11.107 8.911 3.364 1.00 0.63 C ATOM 1907 O ALA A 126 12.015 9.622 3.796 1.00 0.72 O ATOM 1908 CB ALA A 126 11.351 7.520 1.289 1.00 0.68 C ATOM 0 H ALA A 126 9.774 6.195 2.683 1.00 0.53 H new ATOM 0 HA ALA A 126 12.411 7.232 3.122 1.00 0.63 H new ATOM 0 HB1 ALA A 126 12.054 8.258 0.903 1.00 0.68 H new ATOM 0 HB2 ALA A 126 11.617 6.533 0.911 1.00 0.68 H new ATOM 0 HB3 ALA A 126 10.343 7.774 0.962 1.00 0.68 H new ATOM 1914 N HIS A 127 9.837 9.314 3.339 1.00 0.56 N ATOM 1915 CA HIS A 127 9.420 10.580 3.894 1.00 0.58 C ATOM 1916 C HIS A 127 7.978 10.444 4.373 1.00 0.47 C ATOM 1917 O HIS A 127 7.079 10.247 3.568 1.00 0.44 O ATOM 1918 CB HIS A 127 9.550 11.691 2.845 1.00 0.72 C ATOM 1919 CG HIS A 127 9.632 13.074 3.421 1.00 1.15 C ATOM 1920 ND1 HIS A 127 10.822 13.756 3.579 1.00 1.70 N ATOM 1921 CD2 HIS A 127 8.665 13.910 3.864 1.00 1.99 C ATOM 1922 CE1 HIS A 127 10.578 14.950 4.087 1.00 2.29 C ATOM 1923 NE2 HIS A 127 9.278 15.070 4.269 1.00 2.47 N ATOM 0 H HIS A 127 9.078 8.767 2.933 1.00 0.56 H new ATOM 0 HA HIS A 127 10.058 10.849 4.736 1.00 0.58 H new ATOM 0 HB2 HIS A 127 10.441 11.506 2.245 1.00 0.72 H new ATOM 0 HB3 HIS A 127 8.695 11.640 2.171 1.00 0.72 H new ATOM 0 HD2 HIS A 127 7.605 13.703 3.894 1.00 1.99 H new ATOM 0 HE1 HIS A 127 11.319 15.702 4.315 1.00 2.29 H new ATOM 0 HE2 HIS A 127 8.805 15.890 4.648 1.00 2.47 H new ATOM 1932 N PRO A 128 7.761 10.510 5.687 1.00 0.47 N ATOM 1933 CA PRO A 128 6.431 10.480 6.325 1.00 0.43 C ATOM 1934 C PRO A 128 5.333 11.279 5.625 1.00 0.40 C ATOM 1935 O PRO A 128 4.177 10.866 5.626 1.00 0.39 O ATOM 1936 CB PRO A 128 6.724 11.106 7.655 1.00 0.53 C ATOM 1937 CG PRO A 128 8.056 10.564 8.008 1.00 0.79 C ATOM 1938 CD PRO A 128 8.826 10.573 6.713 1.00 0.60 C ATOM 0 HA PRO A 128 6.032 9.466 6.328 1.00 0.43 H new ATOM 0 HB2 PRO A 128 6.738 12.194 7.592 1.00 0.53 H new ATOM 0 HB3 PRO A 128 5.973 10.839 8.398 1.00 0.53 H new ATOM 0 HG2 PRO A 128 8.546 11.177 8.764 1.00 0.79 H new ATOM 0 HG3 PRO A 128 7.978 9.556 8.416 1.00 0.79 H new ATOM 0 HD2 PRO A 128 9.431 11.474 6.611 1.00 0.60 H new ATOM 0 HD3 PRO A 128 9.505 9.723 6.642 1.00 0.60 H new ATOM 1946 N ASN A 129 5.670 12.462 5.114 1.00 0.44 N ATOM 1947 CA ASN A 129 4.666 13.353 4.529 1.00 0.47 C ATOM 1948 C ASN A 129 4.072 12.774 3.261 1.00 0.39 C ATOM 1949 O ASN A 129 3.160 13.334 2.670 1.00 0.44 O ATOM 1950 CB ASN A 129 5.259 14.717 4.231 1.00 0.57 C ATOM 1951 CG ASN A 129 5.398 15.564 5.478 1.00 1.07 C ATOM 1952 OD1 ASN A 129 6.428 15.543 6.150 1.00 1.84 O ATOM 1953 ND2 ASN A 129 4.350 16.306 5.803 1.00 1.44 N ATOM 0 H ASN A 129 6.623 12.825 5.092 1.00 0.44 H new ATOM 0 HA ASN A 129 3.870 13.459 5.266 1.00 0.47 H new ATOM 0 HB2 ASN A 129 6.238 14.593 3.767 1.00 0.57 H new ATOM 0 HB3 ASN A 129 4.628 15.236 3.510 1.00 0.57 H new ATOM 0 HD21 ASN A 129 4.378 16.890 6.639 1.00 1.44 H new ATOM 0 HD22 ASN A 129 3.515 16.294 5.217 1.00 1.44 H new ATOM 1960 N LEU A 130 4.630 11.683 2.822 1.00 0.32 N ATOM 1961 CA LEU A 130 3.958 10.818 1.905 1.00 0.26 C ATOM 1962 C LEU A 130 3.332 9.741 2.769 1.00 0.24 C ATOM 1963 O LEU A 130 4.002 9.140 3.609 1.00 0.26 O ATOM 1964 CB LEU A 130 4.946 10.196 0.905 1.00 0.30 C ATOM 1965 CG LEU A 130 6.315 10.883 0.795 1.00 0.58 C ATOM 1966 CD1 LEU A 130 7.239 10.080 -0.108 1.00 1.38 C ATOM 1967 CD2 LEU A 130 6.181 12.305 0.275 1.00 1.28 C ATOM 0 H LEU A 130 5.563 11.371 3.091 1.00 0.32 H new ATOM 0 HA LEU A 130 3.218 11.356 1.312 1.00 0.26 H new ATOM 0 HB2 LEU A 130 5.106 9.154 1.183 1.00 0.30 H new ATOM 0 HB3 LEU A 130 4.482 10.195 -0.081 1.00 0.30 H new ATOM 0 HG LEU A 130 6.746 10.929 1.795 1.00 0.58 H new ATOM 0 HD11 LEU A 130 8.205 10.579 -0.176 1.00 1.38 H new ATOM 0 HD12 LEU A 130 7.375 9.081 0.307 1.00 1.38 H new ATOM 0 HD13 LEU A 130 6.799 10.003 -1.102 1.00 1.38 H new ATOM 0 HD21 LEU A 130 7.168 12.763 0.209 1.00 1.28 H new ATOM 0 HD22 LEU A 130 5.722 12.289 -0.713 1.00 1.28 H new ATOM 0 HD23 LEU A 130 5.557 12.884 0.956 1.00 1.28 H new ATOM 1979 N PHE A 131 2.081 9.475 2.557 1.00 0.23 N ATOM 1980 CA PHE A 131 1.365 8.556 3.414 1.00 0.27 C ATOM 1981 C PHE A 131 0.231 7.954 2.606 1.00 0.26 C ATOM 1982 O PHE A 131 -0.428 8.665 1.846 1.00 0.26 O ATOM 1983 CB PHE A 131 0.872 9.334 4.644 1.00 0.42 C ATOM 1984 CG PHE A 131 0.569 8.539 5.884 1.00 0.36 C ATOM 1985 CD1 PHE A 131 -0.039 7.301 5.828 1.00 0.63 C ATOM 1986 CD2 PHE A 131 0.881 9.071 7.125 1.00 0.65 C ATOM 1987 CE1 PHE A 131 -0.328 6.606 6.986 1.00 0.97 C ATOM 1988 CE2 PHE A 131 0.598 8.381 8.284 1.00 0.96 C ATOM 1989 CZ PHE A 131 -0.008 7.147 8.214 1.00 1.05 C ATOM 0 H PHE A 131 1.526 9.876 1.801 1.00 0.23 H new ATOM 0 HA PHE A 131 1.993 7.740 3.770 1.00 0.27 H new ATOM 0 HB2 PHE A 131 1.626 10.080 4.897 1.00 0.42 H new ATOM 0 HB3 PHE A 131 -0.030 9.876 4.361 1.00 0.42 H new ATOM 0 HD1 PHE A 131 -0.291 6.872 4.870 1.00 0.63 H new ATOM 0 HD2 PHE A 131 1.353 10.041 7.185 1.00 0.65 H new ATOM 0 HE1 PHE A 131 -0.805 5.639 6.930 1.00 0.97 H new ATOM 0 HE2 PHE A 131 0.851 8.807 9.244 1.00 0.96 H new ATOM 0 HZ PHE A 131 -0.233 6.603 9.120 1.00 1.05 H new ATOM 1999 N ILE A 132 -0.045 6.683 2.806 1.00 0.28 N ATOM 2000 CA ILE A 132 -0.953 5.978 1.947 1.00 0.27 C ATOM 2001 C ILE A 132 -2.354 6.220 2.443 1.00 0.25 C ATOM 2002 O ILE A 132 -2.813 5.655 3.433 1.00 0.32 O ATOM 2003 CB ILE A 132 -0.631 4.459 1.911 1.00 0.34 C ATOM 2004 CG1 ILE A 132 0.469 4.182 0.890 1.00 0.87 C ATOM 2005 CG2 ILE A 132 -1.870 3.624 1.587 1.00 0.80 C ATOM 2006 CD1 ILE A 132 0.668 2.710 0.611 1.00 1.39 C ATOM 0 H ILE A 132 0.351 6.121 3.560 1.00 0.28 H new ATOM 0 HA ILE A 132 -0.851 6.346 0.926 1.00 0.27 H new ATOM 0 HB ILE A 132 -0.287 4.169 2.904 1.00 0.34 H new ATOM 0 HG12 ILE A 132 0.227 4.692 -0.042 1.00 0.87 H new ATOM 0 HG13 ILE A 132 1.406 4.606 1.251 1.00 0.87 H new ATOM 0 HG21 ILE A 132 -1.603 2.567 1.571 1.00 0.80 H new ATOM 0 HG22 ILE A 132 -2.632 3.794 2.347 1.00 0.80 H new ATOM 0 HG23 ILE A 132 -2.259 3.914 0.611 1.00 0.80 H new ATOM 0 HD11 ILE A 132 1.464 2.583 -0.123 1.00 1.39 H new ATOM 0 HD12 ILE A 132 0.941 2.198 1.534 1.00 1.39 H new ATOM 0 HD13 ILE A 132 -0.257 2.285 0.220 1.00 1.39 H new ATOM 2018 N ALA A 133 -2.976 7.140 1.753 1.00 0.22 N ATOM 2019 CA ALA A 133 -4.322 7.563 2.041 1.00 0.23 C ATOM 2020 C ALA A 133 -5.318 6.819 1.194 1.00 0.23 C ATOM 2021 O ALA A 133 -5.003 6.374 0.102 1.00 0.26 O ATOM 2022 CB ALA A 133 -4.444 9.046 1.793 1.00 0.25 C ATOM 0 H ALA A 133 -2.554 7.625 0.961 1.00 0.22 H new ATOM 0 HA ALA A 133 -4.538 7.343 3.087 1.00 0.23 H new ATOM 0 HB1 ALA A 133 -5.462 9.369 2.010 1.00 0.25 H new ATOM 0 HB2 ALA A 133 -3.748 9.581 2.439 1.00 0.25 H new ATOM 0 HB3 ALA A 133 -4.210 9.261 0.750 1.00 0.25 H new ATOM 2028 N THR A 134 -6.516 6.693 1.702 1.00 0.23 N ATOM 2029 CA THR A 134 -7.612 6.130 0.955 1.00 0.25 C ATOM 2030 C THR A 134 -8.798 7.083 1.030 1.00 0.26 C ATOM 2031 O THR A 134 -9.194 7.506 2.117 1.00 0.31 O ATOM 2032 CB THR A 134 -7.957 4.742 1.499 1.00 0.31 C ATOM 2033 OG1 THR A 134 -6.747 4.150 1.964 1.00 0.96 O ATOM 2034 CG2 THR A 134 -8.551 3.864 0.412 1.00 1.01 C ATOM 0 H THR A 134 -6.761 6.979 2.650 1.00 0.23 H new ATOM 0 HA THR A 134 -7.336 6.006 -0.092 1.00 0.25 H new ATOM 0 HB THR A 134 -8.691 4.835 2.299 1.00 0.31 H new ATOM 0 HG1 THR A 134 -6.888 3.777 2.859 1.00 0.96 H new ATOM 0 HG21 THR A 134 -8.787 2.883 0.825 1.00 1.01 H new ATOM 0 HG22 THR A 134 -9.461 4.325 0.029 1.00 1.01 H new ATOM 0 HG23 THR A 134 -7.832 3.752 -0.399 1.00 1.01 H new ATOM 2042 N LYS A 135 -9.305 7.491 -0.117 1.00 0.28 N ATOM 2043 CA LYS A 135 -10.475 8.352 -0.148 1.00 0.31 C ATOM 2044 C LYS A 135 -11.678 7.541 -0.612 1.00 0.40 C ATOM 2045 O LYS A 135 -11.555 6.684 -1.484 1.00 0.47 O ATOM 2046 CB LYS A 135 -10.265 9.560 -1.077 1.00 0.35 C ATOM 2047 CG LYS A 135 -9.075 10.462 -0.733 1.00 0.69 C ATOM 2048 CD LYS A 135 -9.202 11.805 -1.451 1.00 0.76 C ATOM 2049 CE LYS A 135 -7.860 12.414 -1.861 1.00 0.89 C ATOM 2050 NZ LYS A 135 -7.223 13.241 -0.792 1.00 0.63 N ATOM 0 H LYS A 135 -8.931 7.244 -1.033 1.00 0.28 H new ATOM 0 HA LYS A 135 -10.647 8.737 0.857 1.00 0.31 H new ATOM 0 HB2 LYS A 135 -10.138 9.194 -2.096 1.00 0.35 H new ATOM 0 HB3 LYS A 135 -11.171 10.165 -1.067 1.00 0.35 H new ATOM 0 HG2 LYS A 135 -9.030 10.621 0.344 1.00 0.69 H new ATOM 0 HG3 LYS A 135 -8.144 9.974 -1.022 1.00 0.69 H new ATOM 0 HD2 LYS A 135 -9.818 11.674 -2.341 1.00 0.76 H new ATOM 0 HD3 LYS A 135 -9.725 12.506 -0.801 1.00 0.76 H new ATOM 0 HE2 LYS A 135 -7.178 11.612 -2.142 1.00 0.89 H new ATOM 0 HE3 LYS A 135 -8.007 13.032 -2.747 1.00 0.89 H new ATOM 0 HZ1 LYS A 135 -6.476 13.833 -1.209 1.00 0.63 H new ATOM 0 HZ2 LYS A 135 -7.941 13.850 -0.350 1.00 0.63 H new ATOM 0 HZ3 LYS A 135 -6.808 12.617 -0.071 1.00 0.63 H new ATOM 2064 N GLN A 136 -12.837 7.846 -0.051 1.00 0.49 N ATOM 2065 CA GLN A 136 -14.061 7.105 -0.344 1.00 0.63 C ATOM 2066 C GLN A 136 -14.760 7.598 -1.601 1.00 0.58 C ATOM 2067 O GLN A 136 -15.544 6.872 -2.211 1.00 0.69 O ATOM 2068 CB GLN A 136 -15.016 7.110 0.848 1.00 0.82 C ATOM 2069 CG GLN A 136 -15.352 8.470 1.416 1.00 1.05 C ATOM 2070 CD GLN A 136 -16.246 8.347 2.634 1.00 1.14 C ATOM 2071 OE1 GLN A 136 -17.058 9.227 2.917 1.00 1.75 O ATOM 2072 NE2 GLN A 136 -16.098 7.250 3.367 1.00 1.20 N ATOM 0 H GLN A 136 -12.960 8.608 0.616 1.00 0.49 H new ATOM 0 HA GLN A 136 -13.757 6.076 -0.534 1.00 0.63 H new ATOM 0 HB2 GLN A 136 -15.944 6.623 0.548 1.00 0.82 H new ATOM 0 HB3 GLN A 136 -14.580 6.503 1.642 1.00 0.82 H new ATOM 0 HG2 GLN A 136 -14.434 8.992 1.686 1.00 1.05 H new ATOM 0 HG3 GLN A 136 -15.849 9.072 0.656 1.00 1.05 H new ATOM 0 HE21 GLN A 136 -15.413 6.545 3.097 1.00 1.20 H new ATOM 0 HE22 GLN A 136 -16.670 7.113 4.200 1.00 1.20 H new ATOM 2081 N ASP A 137 -14.502 8.840 -1.967 1.00 0.48 N ATOM 2082 CA ASP A 137 -15.207 9.458 -3.091 1.00 0.52 C ATOM 2083 C ASP A 137 -14.232 9.928 -4.153 1.00 0.47 C ATOM 2084 O ASP A 137 -14.545 9.922 -5.343 1.00 0.56 O ATOM 2085 CB ASP A 137 -16.039 10.663 -2.633 1.00 0.63 C ATOM 2086 CG ASP A 137 -17.129 10.306 -1.648 1.00 1.34 C ATOM 2087 OD1 ASP A 137 -18.096 9.623 -2.051 1.00 1.43 O ATOM 2088 OD2 ASP A 137 -17.012 10.671 -0.461 1.00 2.21 O ATOM 0 H ASP A 137 -13.816 9.442 -1.511 1.00 0.48 H new ATOM 0 HA ASP A 137 -15.867 8.696 -3.506 1.00 0.52 H new ATOM 0 HB2 ASP A 137 -15.377 11.400 -2.178 1.00 0.63 H new ATOM 0 HB3 ASP A 137 -16.490 11.136 -3.506 1.00 0.63 H new ATOM 2093 N TYR A 138 -13.057 10.346 -3.723 1.00 0.39 N ATOM 2094 CA TYR A 138 -12.037 10.814 -4.641 1.00 0.38 C ATOM 2095 C TYR A 138 -11.068 9.686 -4.948 1.00 0.32 C ATOM 2096 O TYR A 138 -11.238 8.564 -4.470 1.00 0.31 O ATOM 2097 CB TYR A 138 -11.277 12.009 -4.061 1.00 0.44 C ATOM 2098 CG TYR A 138 -12.133 13.225 -3.787 1.00 0.82 C ATOM 2099 CD1 TYR A 138 -12.361 14.174 -4.775 1.00 0.99 C ATOM 2100 CD2 TYR A 138 -12.726 13.416 -2.544 1.00 1.41 C ATOM 2101 CE1 TYR A 138 -13.153 15.279 -4.533 1.00 1.45 C ATOM 2102 CE2 TYR A 138 -13.517 14.520 -2.294 1.00 1.98 C ATOM 2103 CZ TYR A 138 -13.686 15.472 -3.272 1.00 1.94 C ATOM 2104 OH TYR A 138 -14.525 16.542 -3.051 1.00 2.50 O ATOM 0 H TYR A 138 -12.785 10.371 -2.740 1.00 0.39 H new ATOM 0 HA TYR A 138 -12.526 11.137 -5.560 1.00 0.38 H new ATOM 0 HB2 TYR A 138 -10.797 11.702 -3.132 1.00 0.44 H new ATOM 0 HB3 TYR A 138 -10.482 12.288 -4.753 1.00 0.44 H new ATOM 0 HD1 TYR A 138 -11.911 14.046 -5.749 1.00 0.99 H new ATOM 0 HD2 TYR A 138 -12.565 12.689 -1.761 1.00 1.41 H new ATOM 0 HE1 TYR A 138 -13.355 15.987 -5.323 1.00 1.45 H new ATOM 0 HE2 TYR A 138 -14.001 14.635 -1.335 1.00 1.98 H new ATOM 0 HH TYR A 138 -14.818 16.540 -2.116 1.00 2.50 H new ATOM 2114 N TRP A 139 -10.049 9.981 -5.732 1.00 0.34 N ATOM 2115 CA TRP A 139 -9.001 9.011 -5.984 1.00 0.33 C ATOM 2116 C TRP A 139 -8.154 8.833 -4.728 1.00 0.30 C ATOM 2117 O TRP A 139 -8.100 9.715 -3.865 1.00 0.32 O ATOM 2118 CB TRP A 139 -8.121 9.469 -7.153 1.00 0.40 C ATOM 2119 CG TRP A 139 -8.809 9.413 -8.486 1.00 1.19 C ATOM 2120 CD1 TRP A 139 -8.752 8.390 -9.390 1.00 2.40 C ATOM 2121 CD2 TRP A 139 -9.648 10.419 -9.070 1.00 1.47 C ATOM 2122 NE1 TRP A 139 -9.499 8.701 -10.500 1.00 3.09 N ATOM 2123 CE2 TRP A 139 -10.062 9.938 -10.327 1.00 2.48 C ATOM 2124 CE3 TRP A 139 -10.093 11.679 -8.652 1.00 1.75 C ATOM 2125 CZ2 TRP A 139 -10.895 10.671 -11.168 1.00 2.99 C ATOM 2126 CZ3 TRP A 139 -10.920 12.404 -9.489 1.00 2.37 C ATOM 2127 CH2 TRP A 139 -11.315 11.899 -10.733 1.00 2.74 C ATOM 0 H TRP A 139 -9.925 10.878 -6.202 1.00 0.34 H new ATOM 0 HA TRP A 139 -9.457 8.057 -6.247 1.00 0.33 H new ATOM 0 HB2 TRP A 139 -7.790 10.491 -6.968 1.00 0.40 H new ATOM 0 HB3 TRP A 139 -7.227 8.846 -7.189 1.00 0.40 H new ATOM 0 HD1 TRP A 139 -8.201 7.472 -9.252 1.00 2.40 H new ATOM 0 HE1 TRP A 139 -9.616 8.107 -11.321 1.00 3.09 H new ATOM 0 HE3 TRP A 139 -9.795 12.077 -7.693 1.00 1.75 H new ATOM 0 HZ2 TRP A 139 -11.199 10.284 -12.130 1.00 2.99 H new ATOM 0 HZ3 TRP A 139 -11.268 13.378 -9.177 1.00 2.37 H new ATOM 0 HH2 TRP A 139 -11.964 12.490 -11.362 1.00 2.74 H new ATOM 2138 N VAL A 140 -7.511 7.686 -4.628 1.00 0.30 N ATOM 2139 CA VAL A 140 -6.651 7.379 -3.506 1.00 0.33 C ATOM 2140 C VAL A 140 -5.382 8.209 -3.580 1.00 0.30 C ATOM 2141 O VAL A 140 -4.512 7.977 -4.420 1.00 0.32 O ATOM 2142 CB VAL A 140 -6.338 5.870 -3.468 1.00 0.44 C ATOM 2143 CG1 VAL A 140 -5.101 5.558 -2.642 1.00 1.58 C ATOM 2144 CG2 VAL A 140 -7.538 5.129 -2.913 1.00 1.28 C ATOM 0 H VAL A 140 -7.571 6.942 -5.323 1.00 0.30 H new ATOM 0 HA VAL A 140 -7.166 7.634 -2.580 1.00 0.33 H new ATOM 0 HB VAL A 140 -6.130 5.542 -4.487 1.00 0.44 H new ATOM 0 HG11 VAL A 140 -4.923 4.483 -2.646 1.00 1.58 H new ATOM 0 HG12 VAL A 140 -4.239 6.070 -3.070 1.00 1.58 H new ATOM 0 HG13 VAL A 140 -5.253 5.897 -1.617 1.00 1.58 H new ATOM 0 HG21 VAL A 140 -7.324 4.061 -2.883 1.00 1.28 H new ATOM 0 HG22 VAL A 140 -7.751 5.485 -1.905 1.00 1.28 H new ATOM 0 HG23 VAL A 140 -8.403 5.308 -3.551 1.00 1.28 H new ATOM 2154 N CYS A 141 -5.305 9.206 -2.717 1.00 0.30 N ATOM 2155 CA CYS A 141 -4.213 10.146 -2.766 1.00 0.26 C ATOM 2156 C CYS A 141 -3.201 9.845 -1.666 1.00 0.25 C ATOM 2157 O CYS A 141 -3.153 8.744 -1.122 1.00 0.29 O ATOM 2158 CB CYS A 141 -4.783 11.564 -2.607 1.00 0.33 C ATOM 2159 SG CYS A 141 -3.655 12.913 -3.040 1.00 1.21 S ATOM 0 H CYS A 141 -5.986 9.381 -1.978 1.00 0.30 H new ATOM 0 HA CYS A 141 -3.696 10.064 -3.722 1.00 0.26 H new ATOM 0 HB2 CYS A 141 -5.677 11.649 -3.225 1.00 0.33 H new ATOM 0 HB3 CYS A 141 -5.098 11.696 -1.572 1.00 0.33 H new ATOM 0 HG CYS A 141 -3.912 13.949 -2.298 1.00 1.21 H new ATOM 2165 N LEU A 142 -2.407 10.841 -1.361 1.00 0.21 N ATOM 2166 CA LEU A 142 -1.341 10.758 -0.408 1.00 0.23 C ATOM 2167 C LEU A 142 -1.378 12.040 0.380 1.00 0.24 C ATOM 2168 O LEU A 142 -1.890 13.030 -0.122 1.00 0.23 O ATOM 2169 CB LEU A 142 -0.065 10.603 -1.252 1.00 0.21 C ATOM 2170 CG LEU A 142 1.242 10.326 -0.542 1.00 0.22 C ATOM 2171 CD1 LEU A 142 1.447 8.829 -0.377 1.00 0.23 C ATOM 2172 CD2 LEU A 142 2.397 10.917 -1.328 1.00 0.25 C ATOM 0 H LEU A 142 -2.493 11.763 -1.788 1.00 0.21 H new ATOM 0 HA LEU A 142 -1.403 9.930 0.299 1.00 0.23 H new ATOM 0 HB2 LEU A 142 -0.234 9.794 -1.963 1.00 0.21 H new ATOM 0 HB3 LEU A 142 0.061 11.516 -1.833 1.00 0.21 H new ATOM 0 HG LEU A 142 1.206 10.789 0.444 1.00 0.22 H new ATOM 0 HD11 LEU A 142 2.391 8.645 0.135 1.00 0.23 H new ATOM 0 HD12 LEU A 142 0.629 8.412 0.210 1.00 0.23 H new ATOM 0 HD13 LEU A 142 1.468 8.354 -1.358 1.00 0.23 H new ATOM 0 HD21 LEU A 142 3.333 10.712 -0.809 1.00 0.25 H new ATOM 0 HD22 LEU A 142 2.428 10.470 -2.321 1.00 0.25 H new ATOM 0 HD23 LEU A 142 2.261 11.995 -1.420 1.00 0.25 H new ATOM 2184 N ALA A 143 -0.932 12.023 1.616 1.00 0.34 N ATOM 2185 CA ALA A 143 -0.568 13.243 2.291 1.00 0.33 C ATOM 2186 C ALA A 143 0.141 12.911 3.574 1.00 0.60 C ATOM 2187 O ALA A 143 -0.094 11.878 4.160 1.00 0.91 O ATOM 2188 CB ALA A 143 -1.803 14.089 2.585 1.00 0.38 C ATOM 0 H ALA A 143 -0.813 11.176 2.172 1.00 0.34 H new ATOM 0 HA ALA A 143 0.094 13.818 1.643 1.00 0.33 H new ATOM 0 HB1 ALA A 143 -1.504 15.005 3.095 1.00 0.38 H new ATOM 0 HB2 ALA A 143 -2.303 14.341 1.650 1.00 0.38 H new ATOM 0 HB3 ALA A 143 -2.486 13.526 3.221 1.00 0.38 H new ATOM 2194 N GLY A 144 0.957 13.804 4.041 1.00 0.63 N ATOM 2195 CA GLY A 144 1.402 13.737 5.406 1.00 0.93 C ATOM 2196 C GLY A 144 0.533 14.643 6.198 1.00 0.93 C ATOM 2197 O GLY A 144 0.953 15.243 7.185 1.00 1.13 O ATOM 0 H GLY A 144 1.330 14.587 3.503 1.00 0.63 H new ATOM 0 HA2 GLY A 144 1.337 12.716 5.782 1.00 0.93 H new ATOM 0 HA3 GLY A 144 2.446 14.040 5.485 1.00 0.93 H new ATOM 2201 N GLY A 145 -0.701 14.733 5.744 1.00 0.94 N ATOM 2202 CA GLY A 145 -1.531 15.833 6.165 1.00 1.38 C ATOM 2203 C GLY A 145 -2.982 15.694 5.783 1.00 1.61 C ATOM 2204 O GLY A 145 -3.448 14.588 5.519 1.00 1.48 O ATOM 0 H GLY A 145 -1.139 14.074 5.100 1.00 0.94 H new ATOM 0 HA2 GLY A 145 -1.460 15.933 7.248 1.00 1.38 H new ATOM 0 HA3 GLY A 145 -1.140 16.754 5.733 1.00 1.38 H new ATOM 2208 N PRO A 146 -3.687 16.847 5.782 1.00 2.13 N ATOM 2209 CA PRO A 146 -5.134 17.014 5.666 1.00 2.27 C ATOM 2210 C PRO A 146 -5.959 15.805 5.203 1.00 1.59 C ATOM 2211 O PRO A 146 -5.592 15.102 4.272 1.00 2.15 O ATOM 2212 CB PRO A 146 -5.196 18.147 4.644 1.00 3.57 C ATOM 2213 CG PRO A 146 -4.004 19.006 4.957 1.00 3.98 C ATOM 2214 CD PRO A 146 -3.082 18.183 5.834 1.00 2.93 C ATOM 0 HA PRO A 146 -5.586 17.189 6.642 1.00 2.27 H new ATOM 0 HB2 PRO A 146 -5.152 17.764 3.624 1.00 3.57 H new ATOM 0 HB3 PRO A 146 -6.125 18.710 4.733 1.00 3.57 H new ATOM 0 HG2 PRO A 146 -3.496 19.309 4.041 1.00 3.98 H new ATOM 0 HG3 PRO A 146 -4.310 19.918 5.469 1.00 3.98 H new ATOM 0 HD2 PRO A 146 -2.060 18.179 5.454 1.00 2.93 H new ATOM 0 HD3 PRO A 146 -3.042 18.569 6.853 1.00 2.93 H new ATOM 2222 N PRO A 147 -7.188 15.761 5.765 1.00 1.33 N ATOM 2223 CA PRO A 147 -8.190 14.679 5.809 1.00 1.05 C ATOM 2224 C PRO A 147 -8.070 13.388 4.966 1.00 0.70 C ATOM 2225 O PRO A 147 -9.075 12.689 4.868 1.00 0.86 O ATOM 2226 CB PRO A 147 -9.440 15.455 5.408 1.00 1.57 C ATOM 2227 CG PRO A 147 -9.255 16.809 6.029 1.00 2.12 C ATOM 2228 CD PRO A 147 -7.800 16.913 6.436 1.00 2.10 C ATOM 0 HA PRO A 147 -8.117 14.203 6.787 1.00 1.05 H new ATOM 0 HB2 PRO A 147 -9.534 15.525 4.324 1.00 1.57 H new ATOM 0 HB3 PRO A 147 -10.344 14.969 5.776 1.00 1.57 H new ATOM 0 HG2 PRO A 147 -9.515 17.597 5.322 1.00 2.12 H new ATOM 0 HG3 PRO A 147 -9.907 16.929 6.894 1.00 2.12 H new ATOM 0 HD2 PRO A 147 -7.356 17.853 6.110 1.00 2.10 H new ATOM 0 HD3 PRO A 147 -7.679 16.862 7.518 1.00 2.10 H new ATOM 2236 N SER A 148 -6.941 13.024 4.361 1.00 0.49 N ATOM 2237 CA SER A 148 -6.908 11.775 3.645 1.00 0.43 C ATOM 2238 C SER A 148 -6.892 10.616 4.640 1.00 0.37 C ATOM 2239 O SER A 148 -6.096 10.598 5.581 1.00 0.37 O ATOM 2240 CB SER A 148 -5.702 11.742 2.715 1.00 0.57 C ATOM 2241 OG SER A 148 -5.893 12.605 1.607 1.00 0.64 O ATOM 0 H SER A 148 -6.074 13.561 4.356 1.00 0.49 H new ATOM 0 HA SER A 148 -7.801 11.675 3.028 1.00 0.43 H new ATOM 0 HB2 SER A 148 -4.808 12.039 3.262 1.00 0.57 H new ATOM 0 HB3 SER A 148 -5.537 10.724 2.363 1.00 0.57 H new ATOM 0 HG SER A 148 -5.106 12.569 1.025 1.00 0.64 H new ATOM 2247 N ILE A 149 -7.777 9.648 4.428 1.00 0.37 N ATOM 2248 CA ILE A 149 -7.919 8.541 5.356 1.00 0.32 C ATOM 2249 C ILE A 149 -6.908 7.469 5.044 1.00 0.26 C ATOM 2250 O ILE A 149 -7.093 6.623 4.169 1.00 0.29 O ATOM 2251 CB ILE A 149 -9.351 7.958 5.422 1.00 0.35 C ATOM 2252 CG1 ILE A 149 -10.298 8.955 6.107 1.00 0.57 C ATOM 2253 CG2 ILE A 149 -9.365 6.642 6.188 1.00 0.56 C ATOM 2254 CD1 ILE A 149 -10.617 10.191 5.296 1.00 1.21 C ATOM 0 H ILE A 149 -8.403 9.611 3.624 1.00 0.37 H new ATOM 0 HA ILE A 149 -7.726 8.944 6.350 1.00 0.32 H new ATOM 0 HB ILE A 149 -9.688 7.776 4.402 1.00 0.35 H new ATOM 0 HG12 ILE A 149 -11.231 8.443 6.344 1.00 0.57 H new ATOM 0 HG13 ILE A 149 -9.854 9.264 7.053 1.00 0.57 H new ATOM 0 HG21 ILE A 149 -10.382 6.251 6.221 1.00 0.56 H new ATOM 0 HG22 ILE A 149 -8.716 5.923 5.688 1.00 0.56 H new ATOM 0 HG23 ILE A 149 -9.007 6.809 7.204 1.00 0.56 H new ATOM 0 HD11 ILE A 149 -11.291 10.834 5.862 1.00 1.21 H new ATOM 0 HD12 ILE A 149 -9.696 10.732 5.080 1.00 1.21 H new ATOM 0 HD13 ILE A 149 -11.094 9.899 4.360 1.00 1.21 H new ATOM 2266 N THR A 150 -5.823 7.529 5.763 1.00 0.24 N ATOM 2267 CA THR A 150 -4.705 6.669 5.512 1.00 0.25 C ATOM 2268 C THR A 150 -4.902 5.415 6.325 1.00 0.26 C ATOM 2269 O THR A 150 -3.971 4.846 6.879 1.00 0.34 O ATOM 2270 CB THR A 150 -3.383 7.373 5.921 1.00 0.28 C ATOM 2271 OG1 THR A 150 -3.492 7.885 7.262 1.00 0.53 O ATOM 2272 CG2 THR A 150 -3.070 8.531 4.988 1.00 0.69 C ATOM 0 H THR A 150 -5.690 8.176 6.540 1.00 0.24 H new ATOM 0 HA THR A 150 -4.640 6.428 4.451 1.00 0.25 H new ATOM 0 HB THR A 150 -2.582 6.636 5.861 1.00 0.28 H new ATOM 0 HG1 THR A 150 -2.648 7.738 7.738 1.00 0.53 H new ATOM 0 HG21 THR A 150 -2.139 9.006 5.297 1.00 0.69 H new ATOM 0 HG22 THR A 150 -2.966 8.159 3.969 1.00 0.69 H new ATOM 0 HG23 THR A 150 -3.880 9.259 5.028 1.00 0.69 H new ATOM 2280 N ASP A 151 -6.152 5.004 6.393 1.00 0.25 N ATOM 2281 CA ASP A 151 -6.511 3.812 7.044 1.00 0.25 C ATOM 2282 C ASP A 151 -6.614 2.711 6.031 1.00 0.26 C ATOM 2283 O ASP A 151 -7.001 2.918 4.892 1.00 0.27 O ATOM 2284 CB ASP A 151 -7.808 4.000 7.785 1.00 0.29 C ATOM 2285 CG ASP A 151 -7.647 4.794 9.067 1.00 0.79 C ATOM 2286 OD1 ASP A 151 -6.993 4.298 10.000 1.00 1.25 O ATOM 2287 OD2 ASP A 151 -8.190 5.919 9.149 1.00 1.07 O ATOM 0 H ASP A 151 -6.938 5.511 5.986 1.00 0.25 H new ATOM 0 HA ASP A 151 -5.749 3.542 7.775 1.00 0.25 H new ATOM 0 HB2 ASP A 151 -8.521 4.509 7.136 1.00 0.29 H new ATOM 0 HB3 ASP A 151 -8.231 3.023 8.020 1.00 0.29 H new ATOM 2292 N PHE A 152 -6.217 1.574 6.452 1.00 0.27 N ATOM 2293 CA PHE A 152 -6.514 0.346 5.791 1.00 0.27 C ATOM 2294 C PHE A 152 -6.830 -0.685 6.848 1.00 0.28 C ATOM 2295 O PHE A 152 -6.611 -0.453 8.015 1.00 0.30 O ATOM 2296 CB PHE A 152 -5.362 -0.080 4.877 1.00 0.30 C ATOM 2297 CG PHE A 152 -4.701 -1.395 5.200 1.00 1.46 C ATOM 2298 CD1 PHE A 152 -3.804 -1.486 6.250 1.00 2.11 C ATOM 2299 CD2 PHE A 152 -4.983 -2.538 4.470 1.00 2.12 C ATOM 2300 CE1 PHE A 152 -3.201 -2.687 6.563 1.00 3.33 C ATOM 2301 CE2 PHE A 152 -4.380 -3.741 4.779 1.00 3.35 C ATOM 2302 CZ PHE A 152 -3.473 -3.822 5.766 1.00 3.93 C ATOM 0 H PHE A 152 -5.656 1.458 7.296 1.00 0.27 H new ATOM 0 HA PHE A 152 -7.379 0.461 5.138 1.00 0.27 H new ATOM 0 HB2 PHE A 152 -5.737 -0.128 3.855 1.00 0.30 H new ATOM 0 HB3 PHE A 152 -4.601 0.700 4.901 1.00 0.30 H new ATOM 0 HD1 PHE A 152 -3.573 -0.606 6.832 1.00 2.11 H new ATOM 0 HD2 PHE A 152 -5.683 -2.488 3.649 1.00 2.12 H new ATOM 0 HE1 PHE A 152 -2.530 -2.759 7.406 1.00 3.33 H new ATOM 0 HE2 PHE A 152 -4.641 -4.628 4.220 1.00 3.35 H new ATOM 0 HZ PHE A 152 -2.953 -4.751 5.950 1.00 3.93 H new ATOM 2312 N GLN A 153 -7.344 -1.796 6.423 1.00 0.30 N ATOM 2313 CA GLN A 153 -7.786 -2.850 7.303 1.00 0.33 C ATOM 2314 C GLN A 153 -7.931 -4.108 6.483 1.00 0.38 C ATOM 2315 O GLN A 153 -8.298 -4.034 5.308 1.00 0.44 O ATOM 2316 CB GLN A 153 -9.095 -2.478 8.019 1.00 0.44 C ATOM 2317 CG GLN A 153 -10.218 -2.026 7.102 1.00 0.70 C ATOM 2318 CD GLN A 153 -11.421 -1.510 7.867 1.00 0.63 C ATOM 2319 OE1 GLN A 153 -11.294 -0.985 8.971 1.00 1.27 O ATOM 2320 NE2 GLN A 153 -12.597 -1.649 7.280 1.00 1.20 N ATOM 0 H GLN A 153 -7.474 -2.007 5.434 1.00 0.30 H new ATOM 0 HA GLN A 153 -7.051 -3.009 8.092 1.00 0.33 H new ATOM 0 HB2 GLN A 153 -9.437 -3.340 8.591 1.00 0.44 H new ATOM 0 HB3 GLN A 153 -8.887 -1.683 8.735 1.00 0.44 H new ATOM 0 HG2 GLN A 153 -9.849 -1.242 6.440 1.00 0.70 H new ATOM 0 HG3 GLN A 153 -10.524 -2.859 6.470 1.00 0.70 H new ATOM 0 HE21 GLN A 153 -12.660 -2.091 6.363 1.00 1.20 H new ATOM 0 HE22 GLN A 153 -13.441 -1.315 7.744 1.00 1.20 H new ATOM 2329 N ILE A 154 -7.627 -5.254 7.061 1.00 0.43 N ATOM 2330 CA ILE A 154 -7.614 -6.468 6.285 1.00 0.45 C ATOM 2331 C ILE A 154 -8.974 -7.116 6.385 1.00 0.44 C ATOM 2332 O ILE A 154 -9.418 -7.548 7.449 1.00 0.49 O ATOM 2333 CB ILE A 154 -6.534 -7.454 6.800 1.00 0.56 C ATOM 2334 CG1 ILE A 154 -5.130 -6.972 6.420 1.00 1.14 C ATOM 2335 CG2 ILE A 154 -6.775 -8.860 6.268 1.00 1.53 C ATOM 2336 CD1 ILE A 154 -4.849 -7.022 4.930 1.00 1.63 C ATOM 0 H ILE A 154 -7.391 -5.365 8.047 1.00 0.43 H new ATOM 0 HA ILE A 154 -7.378 -6.222 5.250 1.00 0.45 H new ATOM 0 HB ILE A 154 -6.606 -7.486 7.887 1.00 0.56 H new ATOM 0 HG12 ILE A 154 -5.000 -5.948 6.771 1.00 1.14 H new ATOM 0 HG13 ILE A 154 -4.393 -7.583 6.940 1.00 1.14 H new ATOM 0 HG21 ILE A 154 -6.002 -9.529 6.646 1.00 1.53 H new ATOM 0 HG22 ILE A 154 -7.753 -9.211 6.598 1.00 1.53 H new ATOM 0 HG23 ILE A 154 -6.743 -8.847 5.179 1.00 1.53 H new ATOM 0 HD11 ILE A 154 -3.837 -6.666 4.738 1.00 1.63 H new ATOM 0 HD12 ILE A 154 -4.946 -8.048 4.576 1.00 1.63 H new ATOM 0 HD13 ILE A 154 -5.562 -6.388 4.404 1.00 1.63 H new ATOM 2348 N LEU A 155 -9.629 -7.139 5.244 1.00 0.43 N ATOM 2349 CA LEU A 155 -10.967 -7.661 5.114 1.00 0.44 C ATOM 2350 C LEU A 155 -10.895 -8.970 4.351 1.00 0.57 C ATOM 2351 O LEU A 155 -10.414 -9.006 3.226 1.00 0.67 O ATOM 2352 CB LEU A 155 -11.890 -6.667 4.375 1.00 0.53 C ATOM 2353 CG LEU A 155 -12.091 -5.270 5.010 1.00 0.46 C ATOM 2354 CD1 LEU A 155 -13.526 -4.819 4.797 1.00 0.82 C ATOM 2355 CD2 LEU A 155 -11.770 -5.275 6.499 1.00 0.73 C ATOM 0 H LEU A 155 -9.238 -6.790 4.369 1.00 0.43 H new ATOM 0 HA LEU A 155 -11.388 -7.820 6.107 1.00 0.44 H new ATOM 0 HB2 LEU A 155 -11.495 -6.525 3.369 1.00 0.53 H new ATOM 0 HB3 LEU A 155 -12.870 -7.133 4.270 1.00 0.53 H new ATOM 0 HG LEU A 155 -11.404 -4.577 4.524 1.00 0.46 H new ATOM 0 HD11 LEU A 155 -13.668 -3.835 5.244 1.00 0.82 H new ATOM 0 HD12 LEU A 155 -13.736 -4.766 3.729 1.00 0.82 H new ATOM 0 HD13 LEU A 155 -14.205 -5.532 5.265 1.00 0.82 H new ATOM 0 HD21 LEU A 155 -11.923 -4.276 6.908 1.00 0.73 H new ATOM 0 HD22 LEU A 155 -12.425 -5.981 7.010 1.00 0.73 H new ATOM 0 HD23 LEU A 155 -10.732 -5.572 6.646 1.00 0.73 H new ATOM 2367 N GLU A 156 -11.333 -10.045 4.961 1.00 0.67 N ATOM 2368 CA GLU A 156 -11.288 -11.334 4.305 1.00 0.89 C ATOM 2369 C GLU A 156 -12.547 -11.485 3.464 1.00 0.99 C ATOM 2370 O GLU A 156 -13.552 -10.833 3.732 1.00 0.90 O ATOM 2371 CB GLU A 156 -11.172 -12.449 5.346 1.00 1.04 C ATOM 2372 CG GLU A 156 -10.813 -13.806 4.759 1.00 1.58 C ATOM 2373 CD GLU A 156 -10.539 -14.839 5.828 1.00 2.05 C ATOM 2374 OE1 GLU A 156 -11.509 -15.392 6.383 1.00 2.57 O ATOM 2375 OE2 GLU A 156 -9.354 -15.092 6.128 1.00 2.53 O ATOM 0 H GLU A 156 -11.722 -10.056 5.904 1.00 0.67 H new ATOM 0 HA GLU A 156 -10.415 -11.404 3.657 1.00 0.89 H new ATOM 0 HB2 GLU A 156 -10.416 -12.170 6.080 1.00 1.04 H new ATOM 0 HB3 GLU A 156 -12.118 -12.534 5.880 1.00 1.04 H new ATOM 0 HG2 GLU A 156 -11.628 -14.152 4.123 1.00 1.58 H new ATOM 0 HG3 GLU A 156 -9.934 -13.703 4.123 1.00 1.58 H new ATOM 2382 N ASN A 157 -12.484 -12.332 2.450 1.00 1.23 N ATOM 2383 CA ASN A 157 -13.524 -12.385 1.430 1.00 1.41 C ATOM 2384 C ASN A 157 -14.637 -13.337 1.839 1.00 1.66 C ATOM 2385 O ASN A 157 -14.501 -14.089 2.807 1.00 1.82 O ATOM 2386 CB ASN A 157 -12.935 -12.790 0.071 1.00 1.68 C ATOM 2387 CG ASN A 157 -12.953 -14.283 -0.196 1.00 2.14 C ATOM 2388 OD1 ASN A 157 -12.883 -15.093 0.715 1.00 2.67 O ATOM 2389 ND2 ASN A 157 -13.042 -14.653 -1.462 1.00 2.44 N ATOM 0 H ASN A 157 -11.722 -12.995 2.309 1.00 1.23 H new ATOM 0 HA ASN A 157 -13.951 -11.387 1.332 1.00 1.41 H new ATOM 0 HB2 ASN A 157 -13.491 -12.285 -0.718 1.00 1.68 H new ATOM 0 HB3 ASN A 157 -11.906 -12.435 0.013 1.00 1.68 H new ATOM 0 HD21 ASN A 157 -13.054 -15.644 -1.704 1.00 2.44 H new ATOM 0 HD22 ASN A 157 -13.099 -13.948 -2.197 1.00 2.44 H new ATOM 2396 N GLN A 158 -15.737 -13.278 1.121 1.00 1.77 N ATOM 2397 CA GLN A 158 -16.899 -14.083 1.447 1.00 2.06 C ATOM 2398 C GLN A 158 -16.668 -15.529 1.028 1.00 2.49 C ATOM 2399 O GLN A 158 -16.764 -16.450 1.840 1.00 2.73 O ATOM 2400 CB GLN A 158 -18.142 -13.528 0.748 1.00 2.08 C ATOM 2401 CG GLN A 158 -19.443 -14.118 1.269 1.00 2.54 C ATOM 2402 CD GLN A 158 -19.733 -13.698 2.697 1.00 2.68 C ATOM 2403 OE1 GLN A 158 -19.298 -14.346 3.648 1.00 3.15 O ATOM 2404 NE2 GLN A 158 -20.481 -12.619 2.857 1.00 2.98 N ATOM 0 H GLN A 158 -15.854 -12.679 0.304 1.00 1.77 H new ATOM 0 HA GLN A 158 -17.057 -14.047 2.525 1.00 2.06 H new ATOM 0 HB2 GLN A 158 -18.167 -12.445 0.873 1.00 2.08 H new ATOM 0 HB3 GLN A 158 -18.066 -13.724 -0.322 1.00 2.08 H new ATOM 0 HG2 GLN A 158 -20.265 -13.804 0.626 1.00 2.54 H new ATOM 0 HG3 GLN A 158 -19.394 -15.206 1.215 1.00 2.54 H new ATOM 0 HE21 GLN A 158 -20.822 -12.109 2.042 1.00 2.98 H new ATOM 0 HE22 GLN A 158 -20.717 -12.296 3.796 1.00 2.98 H new ATOM 2413 N ALA A 159 -16.332 -15.707 -0.243 1.00 2.67 N ATOM 2414 CA ALA A 159 -16.072 -17.020 -0.806 1.00 3.14 C ATOM 2415 C ALA A 159 -15.259 -16.878 -2.085 1.00 3.38 C ATOM 2416 O ALA A 159 -14.052 -17.195 -2.069 1.00 3.55 O ATOM 2417 CB ALA A 159 -17.380 -17.751 -1.081 1.00 3.37 C ATOM 2418 OXT ALA A 159 -15.826 -16.410 -3.093 1.00 3.78 O ATOM 0 H ALA A 159 -16.233 -14.943 -0.911 1.00 2.67 H new ATOM 0 HA ALA A 159 -15.500 -17.608 -0.087 1.00 3.14 H new ATOM 0 HB1 ALA A 159 -17.166 -18.733 -1.503 1.00 3.37 H new ATOM 0 HB2 ALA A 159 -17.934 -17.869 -0.150 1.00 3.37 H new ATOM 0 HB3 ALA A 159 -17.977 -17.175 -1.788 1.00 3.37 H new TER 2424 ALA A 159