USER MOD reduce.3.24.130724 H: found=0, std=0, add=647, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 644 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 78 SER OG : rot 96:sc= -0.593 USER MOD Set 1.2: A 83 GLN : amide:sc= 0.437 K(o=-0.16,f=-1.4) USER MOD Set 2.1: A 48 SER OG : rot 160:sc= -1.6! USER MOD Set 2.2: A 67 THR OG1 : rot 45:sc= 0.763 USER MOD Set 2.3: A 69 ASN : amide:sc= -0.673 K(o=-1.5,f=-0.84) USER MOD Set 3.1: A 22 GLN : amide:sc= -1.94! C(o=-2.8!,f=-4.2!) USER MOD Set 3.2: A 24 ASN : amide:sc= -0.877 K(o=-2.8,f=-5.2!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 142:sc= -0.33 (180deg=-1.93!) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 ASN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 15 SER OG : rot 180:sc= 0.0459 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot -89:sc= -0.196 USER MOD Single : A 34 ASN : amide:sc= -0.838 X(o=-0.84,f=-1.2) USER MOD Single : A 35 SER OG : rot 57:sc= 0.0768 USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -0.019 X(o=-0.019,f=-0.26) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0.134 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -0.93 X(o=-0.93,f=-1.2) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot -44:sc= -3.84! USER MOD Single : A 62 HIS : no HD1:sc= -0.0402 K(o=-0.04,f=-0.66) USER MOD Single : A 66 SER OG : rot 180:sc= -0.338 USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 ASN : amide:sc= -0.0153 X(o=-0.015,f=0) USER MOD Single : A 74 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00893) USER MOD Single : A 76 THR OG1 : rot 44:sc= 0.00231 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 92:sc= 0.614 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 13.978 -0.201 -8.665 1.00 20.03 N ATOM 2 CA MET A 1 14.308 0.312 -7.340 1.00 34.10 C ATOM 3 C MET A 1 13.916 -0.688 -6.257 1.00 24.41 C ATOM 4 O MET A 1 12.992 -0.464 -5.476 1.00 14.03 O ATOM 5 CB MET A 1 13.601 1.647 -7.096 1.00 45.15 C ATOM 6 CG MET A 1 12.125 1.629 -7.458 1.00 62.34 C ATOM 7 SD MET A 1 11.192 2.935 -6.637 1.00 64.00 S ATOM 8 CE MET A 1 9.540 2.243 -6.670 1.00 45.51 C ATOM 0 H1 MET A 1 13.633 0.577 -9.262 1.00 20.03 H new ATOM 0 H2 MET A 1 14.827 -0.619 -9.097 1.00 20.03 H new ATOM 0 H3 MET A 1 13.239 -0.928 -8.582 1.00 20.03 H new ATOM 0 HA MET A 1 15.386 0.466 -7.296 1.00 34.10 H new ATOM 0 HB2 MET A 1 13.706 1.917 -6.045 1.00 45.15 H new ATOM 0 HB3 MET A 1 14.099 2.424 -7.676 1.00 45.15 H new ATOM 0 HG2 MET A 1 12.018 1.735 -8.538 1.00 62.34 H new ATOM 0 HG3 MET A 1 11.701 0.661 -7.190 1.00 62.34 H new ATOM 0 HE1 MET A 1 8.845 2.937 -6.197 1.00 45.51 H new ATOM 0 HE2 MET A 1 9.237 2.074 -7.703 1.00 45.51 H new ATOM 0 HE3 MET A 1 9.531 1.296 -6.130 1.00 45.51 H new ATOM 18 N PRO A 2 14.635 -1.820 -6.207 1.00 44.42 N ATOM 19 CA PRO A 2 14.381 -2.877 -5.224 1.00 4.54 C ATOM 20 C PRO A 2 14.764 -2.456 -3.809 1.00 13.33 C ATOM 21 O PRO A 2 15.642 -1.616 -3.617 1.00 4.20 O ATOM 22 CB PRO A 2 15.274 -4.026 -5.699 1.00 51.43 C ATOM 23 CG PRO A 2 16.369 -3.364 -6.462 1.00 2.10 C ATOM 24 CD PRO A 2 15.752 -2.154 -7.107 1.00 41.20 C ATOM 0 HA PRO A 2 13.324 -3.136 -5.168 1.00 4.54 H new ATOM 0 HB2 PRO A 2 15.667 -4.596 -4.857 1.00 51.43 H new ATOM 0 HB3 PRO A 2 14.720 -4.724 -6.327 1.00 51.43 H new ATOM 0 HG2 PRO A 2 17.188 -3.079 -5.801 1.00 2.10 H new ATOM 0 HG3 PRO A 2 16.784 -4.037 -7.212 1.00 2.10 H new ATOM 0 HD2 PRO A 2 16.465 -1.333 -7.185 1.00 41.20 H new ATOM 0 HD3 PRO A 2 15.403 -2.371 -8.117 1.00 41.20 H new ATOM 32 N ALA A 3 14.098 -3.045 -2.821 1.00 23.21 N ATOM 33 CA ALA A 3 14.371 -2.733 -1.423 1.00 54.14 C ATOM 34 C ALA A 3 14.018 -1.284 -1.106 1.00 42.40 C ATOM 35 O ALA A 3 14.667 -0.357 -1.591 1.00 14.11 O ATOM 36 CB ALA A 3 15.831 -3.007 -1.096 1.00 40.22 C ATOM 0 H ALA A 3 13.366 -3.741 -2.963 1.00 23.21 H new ATOM 0 HA ALA A 3 13.746 -3.376 -0.804 1.00 54.14 H new ATOM 0 HB1 ALA A 3 16.020 -2.770 -0.049 1.00 40.22 H new ATOM 0 HB2 ALA A 3 16.053 -4.059 -1.275 1.00 40.22 H new ATOM 0 HB3 ALA A 3 16.468 -2.389 -1.729 1.00 40.22 H new ATOM 42 N ALA A 4 12.987 -1.095 -0.290 1.00 35.54 N ATOM 43 CA ALA A 4 12.549 0.241 0.093 1.00 1.31 C ATOM 44 C ALA A 4 12.927 0.550 1.538 1.00 63.12 C ATOM 45 O ALA A 4 12.440 -0.093 2.469 1.00 42.12 O ATOM 46 CB ALA A 4 11.047 0.381 -0.103 1.00 12.24 C ATOM 0 H ALA A 4 12.439 -1.852 0.119 1.00 35.54 H new ATOM 0 HA ALA A 4 13.057 0.960 -0.550 1.00 1.31 H new ATOM 0 HB1 ALA A 4 10.734 1.384 0.187 1.00 12.24 H new ATOM 0 HB2 ALA A 4 10.800 0.213 -1.151 1.00 12.24 H new ATOM 0 HB3 ALA A 4 10.530 -0.353 0.514 1.00 12.24 H new ATOM 52 N LEU A 5 13.798 1.536 1.718 1.00 4.44 N ATOM 53 CA LEU A 5 14.243 1.930 3.051 1.00 51.21 C ATOM 54 C LEU A 5 15.042 0.811 3.711 1.00 12.23 C ATOM 55 O LEU A 5 15.016 0.653 4.932 1.00 61.41 O ATOM 56 CB LEU A 5 13.041 2.298 3.923 1.00 21.41 C ATOM 57 CG LEU A 5 13.221 3.510 4.838 1.00 60.42 C ATOM 58 CD1 LEU A 5 12.668 4.763 4.178 1.00 51.22 C ATOM 59 CD2 LEU A 5 12.546 3.269 6.180 1.00 2.44 C ATOM 0 H LEU A 5 14.210 2.078 0.958 1.00 4.44 H new ATOM 0 HA LEU A 5 14.890 2.801 2.949 1.00 51.21 H new ATOM 0 HB2 LEU A 5 12.188 2.484 3.271 1.00 21.41 H new ATOM 0 HB3 LEU A 5 12.788 1.436 4.541 1.00 21.41 H new ATOM 0 HG LEU A 5 14.287 3.656 5.011 1.00 60.42 H new ATOM 0 HD11 LEU A 5 12.805 5.615 4.844 1.00 51.22 H new ATOM 0 HD12 LEU A 5 13.197 4.945 3.242 1.00 51.22 H new ATOM 0 HD13 LEU A 5 11.606 4.628 3.974 1.00 51.22 H new ATOM 0 HD21 LEU A 5 12.684 4.141 6.819 1.00 2.44 H new ATOM 0 HD22 LEU A 5 11.481 3.097 6.026 1.00 2.44 H new ATOM 0 HD23 LEU A 5 12.989 2.396 6.658 1.00 2.44 H new ATOM 71 N VAL A 6 15.753 0.038 2.897 1.00 50.35 N ATOM 72 CA VAL A 6 16.563 -1.064 3.402 1.00 74.04 C ATOM 73 C VAL A 6 17.432 -0.616 4.571 1.00 63.41 C ATOM 74 O VAL A 6 18.457 0.038 4.381 1.00 42.43 O ATOM 75 CB VAL A 6 17.465 -1.649 2.299 1.00 43.51 C ATOM 76 CG1 VAL A 6 18.220 -0.539 1.583 1.00 64.12 C ATOM 77 CG2 VAL A 6 18.430 -2.668 2.885 1.00 34.54 C ATOM 0 H VAL A 6 15.785 0.155 1.884 1.00 50.35 H new ATOM 0 HA VAL A 6 15.872 -1.835 3.742 1.00 74.04 H new ATOM 0 HB VAL A 6 16.834 -2.157 1.569 1.00 43.51 H new ATOM 0 HG11 VAL A 6 18.852 -0.971 0.807 1.00 64.12 H new ATOM 0 HG12 VAL A 6 17.509 0.151 1.129 1.00 64.12 H new ATOM 0 HG13 VAL A 6 18.841 -0.001 2.299 1.00 64.12 H new ATOM 0 HG21 VAL A 6 19.060 -3.071 2.092 1.00 34.54 H new ATOM 0 HG22 VAL A 6 19.056 -2.186 3.636 1.00 34.54 H new ATOM 0 HG23 VAL A 6 17.867 -3.478 3.348 1.00 34.54 H new ATOM 87 N SER A 7 17.017 -0.974 5.782 1.00 74.54 N ATOM 88 CA SER A 7 17.756 -0.607 6.983 1.00 10.25 C ATOM 89 C SER A 7 18.579 -1.785 7.497 1.00 54.22 C ATOM 90 O SER A 7 18.036 -2.845 7.811 1.00 40.42 O ATOM 91 CB SER A 7 16.794 -0.128 8.073 1.00 24.40 C ATOM 92 OG SER A 7 17.255 1.072 8.668 1.00 11.41 O ATOM 0 H SER A 7 16.172 -1.518 5.957 1.00 74.54 H new ATOM 0 HA SER A 7 18.437 0.205 6.726 1.00 10.25 H new ATOM 0 HB2 SER A 7 15.804 0.032 7.645 1.00 24.40 H new ATOM 0 HB3 SER A 7 16.691 -0.900 8.836 1.00 24.40 H new ATOM 0 HG SER A 7 16.622 1.358 9.360 1.00 11.41 H new ATOM 98 N ILE A 8 19.890 -1.591 7.579 1.00 5.20 N ATOM 99 CA ILE A 8 20.788 -2.636 8.055 1.00 43.21 C ATOM 100 C ILE A 8 21.488 -2.215 9.343 1.00 40.12 C ATOM 101 O ILE A 8 21.829 -1.046 9.523 1.00 41.15 O ATOM 102 CB ILE A 8 21.852 -2.989 6.998 1.00 15.21 C ATOM 103 CG1 ILE A 8 22.960 -1.935 6.987 1.00 43.45 C ATOM 104 CG2 ILE A 8 21.212 -3.108 5.623 1.00 41.03 C ATOM 105 CD1 ILE A 8 24.171 -2.322 7.807 1.00 51.14 C ATOM 0 H ILE A 8 20.355 -0.720 7.322 1.00 5.20 H new ATOM 0 HA ILE A 8 20.174 -3.515 8.249 1.00 43.21 H new ATOM 0 HB ILE A 8 22.295 -3.951 7.256 1.00 15.21 H new ATOM 0 HG12 ILE A 8 23.270 -1.757 5.957 1.00 43.45 H new ATOM 0 HG13 ILE A 8 22.560 -0.995 7.367 1.00 43.45 H new ATOM 0 HG21 ILE A 8 21.976 -3.358 4.887 1.00 41.03 H new ATOM 0 HG22 ILE A 8 20.455 -3.892 5.641 1.00 41.03 H new ATOM 0 HG23 ILE A 8 20.746 -2.160 5.355 1.00 41.03 H new ATOM 0 HD11 ILE A 8 24.916 -1.528 7.753 1.00 51.14 H new ATOM 0 HD12 ILE A 8 23.875 -2.472 8.845 1.00 51.14 H new ATOM 0 HD13 ILE A 8 24.596 -3.245 7.414 1.00 51.14 H new ATOM 117 N SER A 9 21.700 -3.176 10.236 1.00 64.22 N ATOM 118 CA SER A 9 22.358 -2.905 11.509 1.00 62.43 C ATOM 119 C SER A 9 23.644 -3.716 11.639 1.00 1.00 C ATOM 120 O SER A 9 23.609 -4.935 11.807 1.00 11.05 O ATOM 121 CB SER A 9 21.418 -3.229 12.672 1.00 41.53 C ATOM 122 OG SER A 9 20.167 -2.583 12.511 1.00 50.14 O ATOM 0 H SER A 9 21.426 -4.149 10.102 1.00 64.22 H new ATOM 0 HA SER A 9 22.612 -1.845 11.540 1.00 62.43 H new ATOM 0 HB2 SER A 9 21.269 -4.307 12.734 1.00 41.53 H new ATOM 0 HB3 SER A 9 21.875 -2.916 13.611 1.00 41.53 H new ATOM 0 HG SER A 9 19.584 -2.807 13.266 1.00 50.14 H new ATOM 128 N VAL A 10 24.780 -3.029 11.560 1.00 74.43 N ATOM 129 CA VAL A 10 26.078 -3.684 11.670 1.00 51.24 C ATOM 130 C VAL A 10 26.726 -3.396 13.019 1.00 34.44 C ATOM 131 O VAL A 10 26.737 -2.256 13.484 1.00 63.42 O ATOM 132 CB VAL A 10 27.031 -3.231 10.548 1.00 5.21 C ATOM 133 CG1 VAL A 10 27.372 -1.756 10.700 1.00 72.04 C ATOM 134 CG2 VAL A 10 28.293 -4.080 10.547 1.00 64.22 C ATOM 0 H VAL A 10 24.827 -2.020 11.420 1.00 74.43 H new ATOM 0 HA VAL A 10 25.901 -4.756 11.577 1.00 51.24 H new ATOM 0 HB VAL A 10 26.528 -3.366 9.591 1.00 5.21 H new ATOM 0 HG11 VAL A 10 28.046 -1.454 9.899 1.00 72.04 H new ATOM 0 HG12 VAL A 10 26.458 -1.164 10.648 1.00 72.04 H new ATOM 0 HG13 VAL A 10 27.856 -1.592 11.663 1.00 72.04 H new ATOM 0 HG21 VAL A 10 28.955 -3.746 9.748 1.00 64.22 H new ATOM 0 HG22 VAL A 10 28.801 -3.978 11.506 1.00 64.22 H new ATOM 0 HG23 VAL A 10 28.028 -5.125 10.386 1.00 64.22 H new ATOM 144 N SER A 11 27.265 -4.438 13.645 1.00 74.12 N ATOM 145 CA SER A 11 27.912 -4.299 14.944 1.00 40.41 C ATOM 146 C SER A 11 29.399 -4.625 14.848 1.00 62.54 C ATOM 147 O SER A 11 29.873 -5.637 15.365 1.00 5.24 O ATOM 148 CB SER A 11 27.243 -5.213 15.972 1.00 72.12 C ATOM 149 OG SER A 11 27.674 -4.905 17.286 1.00 41.20 O ATOM 0 H SER A 11 27.266 -5.388 13.273 1.00 74.12 H new ATOM 0 HA SER A 11 27.805 -3.263 15.266 1.00 40.41 H new ATOM 0 HB2 SER A 11 26.160 -5.107 15.907 1.00 72.12 H new ATOM 0 HB3 SER A 11 27.476 -6.253 15.744 1.00 72.12 H new ATOM 0 HG SER A 11 27.231 -5.502 17.924 1.00 41.20 H new ATOM 155 N PRO A 12 30.154 -3.749 14.168 1.00 31.14 N ATOM 156 CA PRO A 12 31.598 -3.922 13.988 1.00 44.43 C ATOM 157 C PRO A 12 32.372 -3.730 15.288 1.00 42.24 C ATOM 158 O PRO A 12 31.913 -3.043 16.201 1.00 74.40 O ATOM 159 CB PRO A 12 31.963 -2.827 12.982 1.00 62.02 C ATOM 160 CG PRO A 12 30.914 -1.785 13.159 1.00 53.31 C ATOM 161 CD PRO A 12 29.655 -2.522 13.525 1.00 63.01 C ATOM 0 HA PRO A 12 31.849 -4.929 13.654 1.00 44.43 H new ATOM 0 HB2 PRO A 12 32.957 -2.425 13.178 1.00 62.02 H new ATOM 0 HB3 PRO A 12 31.970 -3.212 11.962 1.00 62.02 H new ATOM 0 HG2 PRO A 12 31.194 -1.079 13.941 1.00 53.31 H new ATOM 0 HG3 PRO A 12 30.777 -1.210 12.243 1.00 53.31 H new ATOM 0 HD2 PRO A 12 29.030 -1.939 14.202 1.00 63.01 H new ATOM 0 HD3 PRO A 12 29.050 -2.746 12.646 1.00 63.01 H new ATOM 169 N THR A 13 33.551 -4.340 15.365 1.00 34.42 N ATOM 170 CA THR A 13 34.388 -4.237 16.554 1.00 60.45 C ATOM 171 C THR A 13 35.704 -3.535 16.239 1.00 22.45 C ATOM 172 O THR A 13 36.538 -4.060 15.502 1.00 33.13 O ATOM 173 CB THR A 13 34.689 -5.625 17.151 1.00 41.04 C ATOM 174 OG1 THR A 13 33.823 -6.607 16.570 1.00 45.43 O ATOM 175 CG2 THR A 13 34.510 -5.614 18.661 1.00 24.43 C ATOM 0 H THR A 13 33.947 -4.910 14.618 1.00 34.42 H new ATOM 0 HA THR A 13 33.831 -3.649 17.284 1.00 60.45 H new ATOM 0 HB THR A 13 35.725 -5.876 16.925 1.00 41.04 H new ATOM 0 HG1 THR A 13 34.022 -7.487 16.954 1.00 45.43 H new ATOM 0 HG21 THR A 13 34.728 -6.604 19.060 1.00 24.43 H new ATOM 0 HG22 THR A 13 35.191 -4.887 19.103 1.00 24.43 H new ATOM 0 HG23 THR A 13 33.483 -5.343 18.904 1.00 24.43 H new ATOM 183 N ASN A 14 35.885 -2.346 16.804 1.00 14.14 N ATOM 184 CA ASN A 14 37.101 -1.572 16.584 1.00 11.22 C ATOM 185 C ASN A 14 38.166 -1.927 17.617 1.00 64.44 C ATOM 186 O ASN A 14 38.180 -1.386 18.722 1.00 75.00 O ATOM 187 CB ASN A 14 36.795 -0.074 16.646 1.00 40.04 C ATOM 188 CG ASN A 14 35.564 0.298 15.842 1.00 41.22 C ATOM 189 OD1 ASN A 14 34.437 0.184 16.323 1.00 32.40 O ATOM 190 ND2 ASN A 14 35.776 0.747 14.610 1.00 75.42 N ATOM 0 H ASN A 14 35.205 -1.897 17.418 1.00 14.14 H new ATOM 0 HA ASN A 14 37.484 -1.818 15.594 1.00 11.22 H new ATOM 0 HB2 ASN A 14 36.650 0.222 17.685 1.00 40.04 H new ATOM 0 HB3 ASN A 14 37.653 0.485 16.272 1.00 40.04 H new ATOM 0 HD21 ASN A 14 34.987 1.014 14.022 1.00 75.42 H new ATOM 0 HD22 ASN A 14 36.728 0.825 14.252 1.00 75.42 H new ATOM 197 N SER A 15 39.059 -2.841 17.247 1.00 11.34 N ATOM 198 CA SER A 15 40.127 -3.271 18.142 1.00 32.31 C ATOM 199 C SER A 15 41.299 -3.846 17.352 1.00 13.01 C ATOM 200 O SER A 15 41.356 -3.727 16.128 1.00 42.23 O ATOM 201 CB SER A 15 39.603 -4.315 19.131 1.00 51.23 C ATOM 202 OG SER A 15 40.329 -4.274 20.347 1.00 33.42 O ATOM 0 H SER A 15 39.064 -3.297 16.335 1.00 11.34 H new ATOM 0 HA SER A 15 40.477 -2.400 18.696 1.00 32.31 H new ATOM 0 HB2 SER A 15 38.546 -4.135 19.328 1.00 51.23 H new ATOM 0 HB3 SER A 15 39.681 -5.309 18.691 1.00 51.23 H new ATOM 0 HG SER A 15 39.974 -4.949 20.963 1.00 33.42 H new ATOM 208 N THR A 16 42.233 -4.471 18.062 1.00 42.30 N ATOM 209 CA THR A 16 43.405 -5.063 17.429 1.00 31.34 C ATOM 210 C THR A 16 43.280 -6.581 17.352 1.00 13.43 C ATOM 211 O THR A 16 42.567 -7.196 18.146 1.00 43.04 O ATOM 212 CB THR A 16 44.696 -4.704 18.189 1.00 13.03 C ATOM 213 OG1 THR A 16 44.748 -5.417 19.430 1.00 2.22 O ATOM 214 CG2 THR A 16 44.769 -3.208 18.455 1.00 52.14 C ATOM 0 H THR A 16 42.201 -4.580 19.076 1.00 42.30 H new ATOM 0 HA THR A 16 43.460 -4.653 16.420 1.00 31.34 H new ATOM 0 HB THR A 16 45.547 -4.989 17.570 1.00 13.03 H new ATOM 0 HG1 THR A 16 45.572 -5.185 19.906 1.00 2.22 H new ATOM 0 HG21 THR A 16 45.689 -2.979 18.993 1.00 52.14 H new ATOM 0 HG22 THR A 16 44.758 -2.669 17.508 1.00 52.14 H new ATOM 0 HG23 THR A 16 43.912 -2.903 19.056 1.00 52.14 H new ATOM 222 N VAL A 17 43.977 -7.179 16.392 1.00 23.31 N ATOM 223 CA VAL A 17 43.946 -8.626 16.213 1.00 55.24 C ATOM 224 C VAL A 17 45.355 -9.198 16.114 1.00 70.42 C ATOM 225 O VAL A 17 46.293 -8.502 15.729 1.00 5.52 O ATOM 226 CB VAL A 17 43.155 -9.018 14.950 1.00 15.53 C ATOM 227 CG1 VAL A 17 41.731 -8.487 15.026 1.00 40.21 C ATOM 228 CG2 VAL A 17 43.857 -8.506 13.702 1.00 63.43 C ATOM 0 H VAL A 17 44.570 -6.684 15.726 1.00 23.31 H new ATOM 0 HA VAL A 17 43.449 -9.043 17.089 1.00 55.24 H new ATOM 0 HB VAL A 17 43.110 -10.106 14.893 1.00 15.53 H new ATOM 0 HG11 VAL A 17 41.187 -8.773 14.126 1.00 40.21 H new ATOM 0 HG12 VAL A 17 41.232 -8.906 15.900 1.00 40.21 H new ATOM 0 HG13 VAL A 17 41.752 -7.400 15.107 1.00 40.21 H new ATOM 0 HG21 VAL A 17 43.285 -8.792 12.819 1.00 63.43 H new ATOM 0 HG22 VAL A 17 43.935 -7.420 13.748 1.00 63.43 H new ATOM 0 HG23 VAL A 17 44.856 -8.939 13.643 1.00 63.43 H new ATOM 238 N ALA A 18 45.496 -10.473 16.463 1.00 12.24 N ATOM 239 CA ALA A 18 46.790 -11.141 16.412 1.00 45.52 C ATOM 240 C ALA A 18 47.240 -11.356 14.971 1.00 41.33 C ATOM 241 O ALA A 18 46.469 -11.154 14.032 1.00 44.10 O ATOM 242 CB ALA A 18 46.729 -12.469 17.152 1.00 42.35 C ATOM 0 H ALA A 18 44.729 -11.064 16.784 1.00 12.24 H new ATOM 0 HA ALA A 18 47.522 -10.499 16.902 1.00 45.52 H new ATOM 0 HB1 ALA A 18 47.703 -12.957 17.105 1.00 42.35 H new ATOM 0 HB2 ALA A 18 46.461 -12.293 18.194 1.00 42.35 H new ATOM 0 HB3 ALA A 18 45.980 -13.110 16.688 1.00 42.35 H new ATOM 248 N LYS A 19 48.493 -11.766 14.802 1.00 54.24 N ATOM 249 CA LYS A 19 49.046 -12.009 13.475 1.00 60.22 C ATOM 250 C LYS A 19 48.350 -13.188 12.803 1.00 73.32 C ATOM 251 O LYS A 19 48.327 -14.296 13.338 1.00 12.54 O ATOM 252 CB LYS A 19 50.550 -12.277 13.568 1.00 32.02 C ATOM 253 CG LYS A 19 51.224 -12.436 12.217 1.00 64.04 C ATOM 254 CD LYS A 19 52.738 -12.464 12.349 1.00 71.24 C ATOM 255 CE LYS A 19 53.251 -13.877 12.578 1.00 22.43 C ATOM 256 NZ LYS A 19 54.739 -13.937 12.560 1.00 0.13 N ATOM 0 H LYS A 19 49.145 -11.937 15.568 1.00 54.24 H new ATOM 0 HA LYS A 19 48.878 -11.118 12.870 1.00 60.22 H new ATOM 0 HB2 LYS A 19 51.024 -11.457 14.107 1.00 32.02 H new ATOM 0 HB3 LYS A 19 50.714 -13.181 14.155 1.00 32.02 H new ATOM 0 HG2 LYS A 19 50.882 -13.357 11.745 1.00 64.04 H new ATOM 0 HG3 LYS A 19 50.930 -11.615 11.564 1.00 64.04 H new ATOM 0 HD2 LYS A 19 53.191 -12.053 11.447 1.00 71.24 H new ATOM 0 HD3 LYS A 19 53.044 -11.826 13.178 1.00 71.24 H new ATOM 0 HE2 LYS A 19 52.884 -14.246 13.536 1.00 22.43 H new ATOM 0 HE3 LYS A 19 52.852 -14.537 11.808 1.00 22.43 H new ATOM 0 HZ1 LYS A 19 55.049 -14.917 12.720 1.00 0.13 H new ATOM 0 HZ2 LYS A 19 55.089 -13.609 11.637 1.00 0.13 H new ATOM 0 HZ3 LYS A 19 55.120 -13.327 13.311 1.00 0.13 H new ATOM 270 N GLY A 20 47.784 -12.943 11.625 1.00 53.31 N ATOM 271 CA GLY A 20 47.096 -13.994 10.899 1.00 71.32 C ATOM 272 C GLY A 20 45.886 -14.519 11.646 1.00 21.21 C ATOM 273 O GLY A 20 46.022 -15.258 12.623 1.00 44.44 O ATOM 0 H GLY A 20 47.790 -12.035 11.161 1.00 53.31 H new ATOM 0 HA2 GLY A 20 46.782 -13.614 9.927 1.00 71.32 H new ATOM 0 HA3 GLY A 20 47.788 -14.815 10.712 1.00 71.32 H new ATOM 277 N LEU A 21 44.699 -14.137 11.189 1.00 32.10 N ATOM 278 CA LEU A 21 43.459 -14.573 11.822 1.00 12.20 C ATOM 279 C LEU A 21 42.246 -14.019 11.082 1.00 53.31 C ATOM 280 O LEU A 21 42.368 -13.100 10.273 1.00 54.52 O ATOM 281 CB LEU A 21 43.426 -14.127 13.285 1.00 53.42 C ATOM 282 CG LEU A 21 42.862 -15.139 14.283 1.00 44.02 C ATOM 283 CD1 LEU A 21 43.939 -15.578 15.263 1.00 11.22 C ATOM 284 CD2 LEU A 21 41.671 -14.551 15.024 1.00 11.43 C ATOM 0 H LEU A 21 44.569 -13.526 10.383 1.00 32.10 H new ATOM 0 HA LEU A 21 43.421 -15.662 11.780 1.00 12.20 H new ATOM 0 HB2 LEU A 21 44.441 -13.874 13.590 1.00 53.42 H new ATOM 0 HB3 LEU A 21 42.836 -13.213 13.352 1.00 53.42 H new ATOM 0 HG LEU A 21 42.523 -16.015 13.731 1.00 44.02 H new ATOM 0 HD11 LEU A 21 43.520 -16.298 15.966 1.00 11.22 H new ATOM 0 HD12 LEU A 21 44.761 -16.040 14.717 1.00 11.22 H new ATOM 0 HD13 LEU A 21 44.309 -14.711 15.810 1.00 11.22 H new ATOM 0 HD21 LEU A 21 41.283 -15.285 15.730 1.00 11.43 H new ATOM 0 HD22 LEU A 21 41.984 -13.658 15.565 1.00 11.43 H new ATOM 0 HD23 LEU A 21 40.892 -14.288 14.309 1.00 11.43 H new ATOM 296 N GLN A 22 41.077 -14.583 11.367 1.00 75.12 N ATOM 297 CA GLN A 22 39.841 -14.144 10.729 1.00 42.22 C ATOM 298 C GLN A 22 38.802 -13.745 11.771 1.00 31.25 C ATOM 299 O GLN A 22 38.741 -14.327 12.854 1.00 70.11 O ATOM 300 CB GLN A 22 39.283 -15.251 9.833 1.00 64.11 C ATOM 301 CG GLN A 22 39.366 -16.636 10.455 1.00 54.15 C ATOM 302 CD GLN A 22 38.215 -17.531 10.039 1.00 30.32 C ATOM 303 OE1 GLN A 22 38.241 -18.139 8.968 1.00 1.15 O ATOM 304 NE2 GLN A 22 37.196 -17.618 10.887 1.00 42.15 N ATOM 0 H GLN A 22 40.959 -15.345 12.035 1.00 75.12 H new ATOM 0 HA GLN A 22 40.068 -13.271 10.117 1.00 42.22 H new ATOM 0 HB2 GLN A 22 38.242 -15.028 9.600 1.00 64.11 H new ATOM 0 HB3 GLN A 22 39.828 -15.252 8.889 1.00 64.11 H new ATOM 0 HG2 GLN A 22 40.308 -17.104 10.167 1.00 54.15 H new ATOM 0 HG3 GLN A 22 39.375 -16.543 11.541 1.00 54.15 H new ATOM 0 HE21 GLN A 22 37.216 -17.097 11.764 1.00 42.15 H new ATOM 0 HE22 GLN A 22 36.394 -18.206 10.661 1.00 42.15 H new ATOM 313 N GLU A 23 37.987 -12.749 11.437 1.00 21.52 N ATOM 314 CA GLU A 23 36.951 -12.273 12.346 1.00 22.02 C ATOM 315 C GLU A 23 35.586 -12.273 11.664 1.00 44.45 C ATOM 316 O GLU A 23 35.411 -11.671 10.605 1.00 74.21 O ATOM 317 CB GLU A 23 37.286 -10.865 12.843 1.00 53.01 C ATOM 318 CG GLU A 23 37.890 -10.839 14.237 1.00 44.14 C ATOM 319 CD GLU A 23 37.409 -9.660 15.060 1.00 53.14 C ATOM 320 OE1 GLU A 23 36.179 -9.501 15.206 1.00 11.13 O ATOM 321 OE2 GLU A 23 38.263 -8.896 15.557 1.00 35.22 O ATOM 0 H GLU A 23 38.024 -12.257 10.544 1.00 21.52 H new ATOM 0 HA GLU A 23 36.911 -12.952 13.198 1.00 22.02 H new ATOM 0 HB2 GLU A 23 37.982 -10.399 12.146 1.00 53.01 H new ATOM 0 HB3 GLU A 23 36.378 -10.262 12.838 1.00 53.01 H new ATOM 0 HG2 GLU A 23 37.639 -11.765 14.755 1.00 44.14 H new ATOM 0 HG3 GLU A 23 38.976 -10.802 14.157 1.00 44.14 H new ATOM 328 N ASN A 24 34.624 -12.952 12.278 1.00 33.12 N ATOM 329 CA ASN A 24 33.275 -13.032 11.730 1.00 54.41 C ATOM 330 C ASN A 24 32.412 -11.881 12.240 1.00 74.42 C ATOM 331 O ASN A 24 32.492 -11.501 13.408 1.00 31.31 O ATOM 332 CB ASN A 24 32.630 -14.370 12.098 1.00 42.42 C ATOM 333 CG ASN A 24 33.633 -15.507 12.123 1.00 50.14 C ATOM 334 OD1 ASN A 24 34.578 -15.533 11.334 1.00 22.13 O ATOM 335 ND2 ASN A 24 33.430 -16.454 13.031 1.00 64.42 N ATOM 0 H ASN A 24 34.753 -13.455 13.156 1.00 33.12 H new ATOM 0 HA ASN A 24 33.346 -12.957 10.645 1.00 54.41 H new ATOM 0 HB2 ASN A 24 32.156 -14.285 13.076 1.00 42.42 H new ATOM 0 HB3 ASN A 24 31.842 -14.600 11.381 1.00 42.42 H new ATOM 0 HD21 ASN A 24 34.071 -17.245 13.095 1.00 64.42 H new ATOM 0 HD22 ASN A 24 32.633 -16.391 13.664 1.00 64.42 H new ATOM 342 N PHE A 25 31.586 -11.332 11.356 1.00 53.43 N ATOM 343 CA PHE A 25 30.707 -10.224 11.716 1.00 64.54 C ATOM 344 C PHE A 25 29.243 -10.611 11.533 1.00 14.21 C ATOM 345 O PHE A 25 28.928 -11.745 11.171 1.00 52.43 O ATOM 346 CB PHE A 25 31.031 -8.993 10.868 1.00 41.43 C ATOM 347 CG PHE A 25 32.501 -8.695 10.779 1.00 73.55 C ATOM 348 CD1 PHE A 25 33.223 -8.361 11.912 1.00 25.33 C ATOM 349 CD2 PHE A 25 33.159 -8.750 9.561 1.00 42.24 C ATOM 350 CE1 PHE A 25 34.576 -8.088 11.834 1.00 41.32 C ATOM 351 CE2 PHE A 25 34.512 -8.478 9.476 1.00 14.30 C ATOM 352 CZ PHE A 25 35.221 -8.145 10.614 1.00 54.02 C ATOM 0 H PHE A 25 31.506 -11.635 10.385 1.00 53.43 H new ATOM 0 HA PHE A 25 30.873 -9.987 12.767 1.00 64.54 H new ATOM 0 HB2 PHE A 25 30.637 -9.141 9.862 1.00 41.43 H new ATOM 0 HB3 PHE A 25 30.518 -8.128 11.287 1.00 41.43 H new ATOM 0 HD1 PHE A 25 32.723 -8.313 12.868 1.00 25.33 H new ATOM 0 HD2 PHE A 25 32.609 -9.008 8.668 1.00 42.24 H new ATOM 0 HE1 PHE A 25 35.128 -7.830 12.726 1.00 41.32 H new ATOM 0 HE2 PHE A 25 35.014 -8.526 8.521 1.00 14.30 H new ATOM 0 HZ PHE A 25 36.277 -7.930 10.550 1.00 54.02 H new ATOM 362 N LYS A 26 28.350 -9.660 11.788 1.00 41.05 N ATOM 363 CA LYS A 26 26.918 -9.898 11.652 1.00 40.15 C ATOM 364 C LYS A 26 26.205 -8.650 11.141 1.00 1.44 C ATOM 365 O LYS A 26 26.339 -7.569 11.715 1.00 73.11 O ATOM 366 CB LYS A 26 26.321 -10.326 12.994 1.00 5.03 C ATOM 367 CG LYS A 26 25.295 -11.439 12.877 1.00 62.44 C ATOM 368 CD LYS A 26 24.992 -12.064 14.228 1.00 3.23 C ATOM 369 CE LYS A 26 25.375 -13.535 14.261 1.00 62.41 C ATOM 370 NZ LYS A 26 24.775 -14.239 15.428 1.00 21.02 N ATOM 0 H LYS A 26 28.593 -8.717 12.090 1.00 41.05 H new ATOM 0 HA LYS A 26 26.776 -10.699 10.927 1.00 40.15 H new ATOM 0 HB2 LYS A 26 27.126 -10.653 13.652 1.00 5.03 H new ATOM 0 HB3 LYS A 26 25.854 -9.462 13.467 1.00 5.03 H new ATOM 0 HG2 LYS A 26 24.376 -11.044 12.444 1.00 62.44 H new ATOM 0 HG3 LYS A 26 25.665 -12.205 12.196 1.00 62.44 H new ATOM 0 HD2 LYS A 26 25.534 -11.528 15.007 1.00 3.23 H new ATOM 0 HD3 LYS A 26 23.930 -11.959 14.449 1.00 3.23 H new ATOM 0 HE2 LYS A 26 25.048 -14.016 13.339 1.00 62.41 H new ATOM 0 HE3 LYS A 26 26.460 -13.627 14.300 1.00 62.41 H new ATOM 0 HZ1 LYS A 26 25.060 -15.239 15.414 1.00 21.02 H new ATOM 0 HZ2 LYS A 26 25.107 -13.796 16.309 1.00 21.02 H new ATOM 0 HZ3 LYS A 26 23.738 -14.174 15.377 1.00 21.02 H new ATOM 384 N ALA A 27 25.447 -8.807 10.061 1.00 12.43 N ATOM 385 CA ALA A 27 24.710 -7.693 9.477 1.00 42.14 C ATOM 386 C ALA A 27 23.316 -8.127 9.038 1.00 14.13 C ATOM 387 O ALA A 27 23.163 -9.069 8.260 1.00 74.00 O ATOM 388 CB ALA A 27 25.479 -7.112 8.299 1.00 32.00 C ATOM 0 H ALA A 27 25.327 -9.695 9.573 1.00 12.43 H new ATOM 0 HA ALA A 27 24.599 -6.923 10.240 1.00 42.14 H new ATOM 0 HB1 ALA A 27 24.917 -6.281 7.872 1.00 32.00 H new ATOM 0 HB2 ALA A 27 26.451 -6.756 8.639 1.00 32.00 H new ATOM 0 HB3 ALA A 27 25.620 -7.882 7.541 1.00 32.00 H new ATOM 394 N THR A 28 22.299 -7.435 9.543 1.00 2.53 N ATOM 395 CA THR A 28 20.917 -7.750 9.205 1.00 10.43 C ATOM 396 C THR A 28 20.254 -6.592 8.468 1.00 15.24 C ATOM 397 O THR A 28 19.867 -5.595 9.078 1.00 64.24 O ATOM 398 CB THR A 28 20.093 -8.082 10.464 1.00 72.05 C ATOM 399 OG1 THR A 28 20.544 -7.290 11.568 1.00 55.32 O ATOM 400 CG2 THR A 28 20.208 -9.558 10.812 1.00 63.44 C ATOM 0 H THR A 28 22.407 -6.652 10.188 1.00 2.53 H new ATOM 0 HA THR A 28 20.941 -8.624 8.555 1.00 10.43 H new ATOM 0 HB THR A 28 19.047 -7.854 10.257 1.00 72.05 H new ATOM 0 HG1 THR A 28 20.014 -7.506 12.364 1.00 55.32 H new ATOM 0 HG21 THR A 28 19.618 -9.769 11.704 1.00 63.44 H new ATOM 0 HG22 THR A 28 19.836 -10.158 9.981 1.00 63.44 H new ATOM 0 HG23 THR A 28 21.252 -9.807 11.001 1.00 63.44 H new ATOM 408 N GLY A 29 20.123 -6.731 7.152 1.00 4.34 N ATOM 409 CA GLY A 29 19.505 -5.688 6.354 1.00 63.30 C ATOM 410 C GLY A 29 18.146 -6.095 5.821 1.00 31.50 C ATOM 411 O GLY A 29 18.026 -7.085 5.098 1.00 24.35 O ATOM 0 H GLY A 29 20.434 -7.547 6.625 1.00 4.34 H new ATOM 0 HA2 GLY A 29 19.400 -4.787 6.958 1.00 63.30 H new ATOM 0 HA3 GLY A 29 20.159 -5.438 5.519 1.00 63.30 H new ATOM 415 N ILE A 30 17.119 -5.332 6.179 1.00 20.10 N ATOM 416 CA ILE A 30 15.762 -5.620 5.732 1.00 13.41 C ATOM 417 C ILE A 30 15.117 -4.388 5.106 1.00 54.02 C ATOM 418 O ILE A 30 15.247 -3.277 5.619 1.00 2.42 O ATOM 419 CB ILE A 30 14.879 -6.113 6.894 1.00 41.21 C ATOM 420 CG1 ILE A 30 14.612 -4.973 7.879 1.00 31.45 C ATOM 421 CG2 ILE A 30 15.540 -7.287 7.600 1.00 45.00 C ATOM 422 CD1 ILE A 30 13.280 -4.288 7.665 1.00 64.44 C ATOM 0 H ILE A 30 17.201 -4.510 6.777 1.00 20.10 H new ATOM 0 HA ILE A 30 15.837 -6.409 4.983 1.00 13.41 H new ATOM 0 HB ILE A 30 13.924 -6.449 6.489 1.00 41.21 H new ATOM 0 HG12 ILE A 30 14.650 -5.365 8.895 1.00 31.45 H new ATOM 0 HG13 ILE A 30 15.409 -4.235 7.792 1.00 31.45 H new ATOM 0 HG21 ILE A 30 14.904 -7.624 8.419 1.00 45.00 H new ATOM 0 HG22 ILE A 30 15.684 -8.103 6.892 1.00 45.00 H new ATOM 0 HG23 ILE A 30 16.507 -6.976 7.996 1.00 45.00 H new ATOM 0 HD11 ILE A 30 13.159 -3.491 8.399 1.00 64.44 H new ATOM 0 HD12 ILE A 30 13.245 -3.865 6.661 1.00 64.44 H new ATOM 0 HD13 ILE A 30 12.475 -5.014 7.781 1.00 64.44 H new ATOM 434 N PHE A 31 14.418 -4.593 3.994 1.00 64.31 N ATOM 435 CA PHE A 31 13.751 -3.500 3.297 1.00 3.32 C ATOM 436 C PHE A 31 12.235 -3.646 3.381 1.00 32.10 C ATOM 437 O PHE A 31 11.709 -4.758 3.442 1.00 55.13 O ATOM 438 CB PHE A 31 14.191 -3.457 1.832 1.00 14.11 C ATOM 439 CG PHE A 31 14.731 -4.765 1.330 1.00 71.31 C ATOM 440 CD1 PHE A 31 16.058 -5.107 1.537 1.00 73.14 C ATOM 441 CD2 PHE A 31 13.912 -5.654 0.652 1.00 50.54 C ATOM 442 CE1 PHE A 31 16.557 -6.310 1.075 1.00 64.13 C ATOM 443 CE2 PHE A 31 14.406 -6.858 0.188 1.00 60.23 C ATOM 444 CZ PHE A 31 15.730 -7.187 0.401 1.00 63.24 C ATOM 0 H PHE A 31 14.299 -5.507 3.556 1.00 64.31 H new ATOM 0 HA PHE A 31 14.035 -2.566 3.782 1.00 3.32 H new ATOM 0 HB2 PHE A 31 13.342 -3.162 1.215 1.00 14.11 H new ATOM 0 HB3 PHE A 31 14.954 -2.688 1.713 1.00 14.11 H new ATOM 0 HD1 PHE A 31 16.709 -4.426 2.065 1.00 73.14 H new ATOM 0 HD2 PHE A 31 12.875 -5.403 0.484 1.00 50.54 H new ATOM 0 HE1 PHE A 31 17.593 -6.564 1.241 1.00 64.13 H new ATOM 0 HE2 PHE A 31 13.757 -7.541 -0.341 1.00 60.23 H new ATOM 0 HZ PHE A 31 16.118 -8.128 0.041 1.00 63.24 H new ATOM 454 N THR A 32 11.536 -2.515 3.385 1.00 42.14 N ATOM 455 CA THR A 32 10.081 -2.516 3.463 1.00 51.51 C ATOM 456 C THR A 32 9.462 -3.091 2.194 1.00 44.10 C ATOM 457 O THR A 32 8.312 -3.529 2.196 1.00 31.14 O ATOM 458 CB THR A 32 9.530 -1.095 3.691 1.00 70.24 C ATOM 459 OG1 THR A 32 9.807 -0.274 2.551 1.00 52.22 O ATOM 460 CG2 THR A 32 10.144 -0.470 4.934 1.00 13.40 C ATOM 0 H THR A 32 11.955 -1.586 3.335 1.00 42.14 H new ATOM 0 HA THR A 32 9.811 -3.144 4.312 1.00 51.51 H new ATOM 0 HB THR A 32 8.452 -1.165 3.834 1.00 70.24 H new ATOM 0 HG1 THR A 32 10.683 0.152 2.660 1.00 52.22 H new ATOM 0 HG21 THR A 32 9.740 0.533 5.075 1.00 13.40 H new ATOM 0 HG22 THR A 32 9.907 -1.082 5.804 1.00 13.40 H new ATOM 0 HG23 THR A 32 11.226 -0.412 4.815 1.00 13.40 H new ATOM 468 N ASP A 33 10.233 -3.087 1.112 1.00 73.23 N ATOM 469 CA ASP A 33 9.761 -3.611 -0.165 1.00 15.13 C ATOM 470 C ASP A 33 9.836 -5.134 -0.188 1.00 73.33 C ATOM 471 O ASP A 33 9.433 -5.770 -1.161 1.00 61.34 O ATOM 472 CB ASP A 33 10.584 -3.029 -1.315 1.00 20.31 C ATOM 473 CG ASP A 33 9.824 -3.024 -2.627 1.00 32.34 C ATOM 474 OD1 ASP A 33 9.885 -4.039 -3.352 1.00 42.03 O ATOM 475 OD2 ASP A 33 9.167 -2.006 -2.927 1.00 14.00 O ATOM 0 H ASP A 33 11.187 -2.727 1.093 1.00 73.23 H new ATOM 0 HA ASP A 33 8.719 -3.315 -0.289 1.00 15.13 H new ATOM 0 HB2 ASP A 33 10.880 -2.010 -1.066 1.00 20.31 H new ATOM 0 HB3 ASP A 33 11.500 -3.608 -1.431 1.00 20.31 H new ATOM 480 N ASN A 34 10.355 -5.713 0.890 1.00 42.14 N ATOM 481 CA ASN A 34 10.485 -7.162 0.992 1.00 51.12 C ATOM 482 C ASN A 34 11.274 -7.551 2.238 1.00 12.14 C ATOM 483 O ASN A 34 12.502 -7.624 2.210 1.00 22.04 O ATOM 484 CB ASN A 34 11.171 -7.723 -0.255 1.00 43.44 C ATOM 485 CG ASN A 34 10.216 -8.498 -1.142 1.00 50.20 C ATOM 486 OD1 ASN A 34 9.953 -8.108 -2.280 1.00 21.31 O ATOM 487 ND2 ASN A 34 9.691 -9.602 -0.623 1.00 1.41 N ATOM 0 H ASN A 34 10.692 -5.201 1.705 1.00 42.14 H new ATOM 0 HA ASN A 34 9.484 -7.587 1.070 1.00 51.12 H new ATOM 0 HB2 ASN A 34 11.608 -6.903 -0.825 1.00 43.44 H new ATOM 0 HB3 ASN A 34 11.991 -8.374 0.047 1.00 43.44 H new ATOM 0 HD21 ASN A 34 9.041 -10.165 -1.172 1.00 1.41 H new ATOM 0 HD22 ASN A 34 9.938 -9.887 0.325 1.00 1.41 H new ATOM 494 N SER A 35 10.559 -7.800 3.331 1.00 53.02 N ATOM 495 CA SER A 35 11.191 -8.179 4.589 1.00 45.52 C ATOM 496 C SER A 35 12.096 -9.393 4.398 1.00 13.43 C ATOM 497 O SER A 35 11.628 -10.530 4.369 1.00 12.12 O ATOM 498 CB SER A 35 10.129 -8.481 5.648 1.00 44.43 C ATOM 499 OG SER A 35 8.908 -8.876 5.047 1.00 25.51 O ATOM 0 H SER A 35 9.541 -7.746 3.370 1.00 53.02 H new ATOM 0 HA SER A 35 11.802 -7.342 4.927 1.00 45.52 H new ATOM 0 HB2 SER A 35 10.485 -9.271 6.309 1.00 44.43 H new ATOM 0 HB3 SER A 35 9.965 -7.598 6.266 1.00 44.43 H new ATOM 0 HG SER A 35 9.065 -9.649 4.466 1.00 25.51 H new ATOM 505 N ASN A 36 13.394 -9.141 4.269 1.00 43.20 N ATOM 506 CA ASN A 36 14.365 -10.212 4.081 1.00 65.34 C ATOM 507 C ASN A 36 15.700 -9.858 4.730 1.00 15.24 C ATOM 508 O ASN A 36 15.927 -8.712 5.119 1.00 23.44 O ATOM 509 CB ASN A 36 14.569 -10.488 2.589 1.00 1.14 C ATOM 510 CG ASN A 36 14.481 -11.965 2.257 1.00 14.11 C ATOM 511 OD1 ASN A 36 15.482 -12.681 2.289 1.00 14.14 O ATOM 512 ND2 ASN A 36 13.278 -12.428 1.935 1.00 43.31 N ATOM 0 H ASN A 36 13.798 -8.205 4.291 1.00 43.20 H new ATOM 0 HA ASN A 36 13.975 -11.110 4.561 1.00 65.34 H new ATOM 0 HB2 ASN A 36 13.818 -9.944 2.016 1.00 1.14 H new ATOM 0 HB3 ASN A 36 15.543 -10.107 2.282 1.00 1.14 H new ATOM 0 HD21 ASN A 36 13.157 -13.413 1.701 1.00 43.31 H new ATOM 0 HD22 ASN A 36 12.476 -11.798 1.921 1.00 43.31 H new ATOM 519 N SER A 37 16.578 -10.849 4.844 1.00 41.20 N ATOM 520 CA SER A 37 17.889 -10.643 5.449 1.00 14.14 C ATOM 521 C SER A 37 18.879 -10.093 4.427 1.00 12.44 C ATOM 522 O SER A 37 18.630 -10.131 3.222 1.00 31.43 O ATOM 523 CB SER A 37 18.416 -11.955 6.032 1.00 24.24 C ATOM 524 OG SER A 37 17.979 -12.132 7.369 1.00 72.15 O ATOM 0 H SER A 37 16.406 -11.803 4.525 1.00 41.20 H new ATOM 0 HA SER A 37 17.781 -9.914 6.252 1.00 14.14 H new ATOM 0 HB2 SER A 37 18.075 -12.791 5.421 1.00 24.24 H new ATOM 0 HB3 SER A 37 19.505 -11.960 5.999 1.00 24.24 H new ATOM 0 HG SER A 37 18.328 -12.979 7.718 1.00 72.15 H new ATOM 530 N ASP A 38 20.002 -9.581 4.918 1.00 41.51 N ATOM 531 CA ASP A 38 21.032 -9.023 4.049 1.00 54.34 C ATOM 532 C ASP A 38 21.596 -10.092 3.119 1.00 74.34 C ATOM 533 O ASP A 38 22.367 -10.953 3.543 1.00 62.13 O ATOM 534 CB ASP A 38 22.157 -8.410 4.884 1.00 61.15 C ATOM 535 CG ASP A 38 22.328 -6.926 4.625 1.00 32.01 C ATOM 536 OD1 ASP A 38 22.418 -6.537 3.442 1.00 13.21 O ATOM 537 OD2 ASP A 38 22.373 -6.154 5.606 1.00 55.11 O ATOM 0 H ASP A 38 20.223 -9.541 5.913 1.00 41.51 H new ATOM 0 HA ASP A 38 20.575 -8.242 3.441 1.00 54.34 H new ATOM 0 HB2 ASP A 38 21.949 -8.569 5.942 1.00 61.15 H new ATOM 0 HB3 ASP A 38 23.092 -8.925 4.662 1.00 61.15 H new ATOM 542 N ILE A 39 21.205 -10.032 1.850 1.00 35.12 N ATOM 543 CA ILE A 39 21.671 -10.995 0.861 1.00 63.41 C ATOM 544 C ILE A 39 21.135 -10.662 -0.527 1.00 40.31 C ATOM 545 O ILE A 39 21.797 -10.905 -1.536 1.00 63.25 O ATOM 546 CB ILE A 39 21.251 -12.430 1.230 1.00 34.21 C ATOM 547 CG1 ILE A 39 21.888 -13.435 0.268 1.00 33.33 C ATOM 548 CG2 ILE A 39 19.735 -12.559 1.212 1.00 72.02 C ATOM 549 CD1 ILE A 39 21.010 -13.780 -0.914 1.00 50.25 C ATOM 0 H ILE A 39 20.566 -9.326 1.483 1.00 35.12 H new ATOM 0 HA ILE A 39 22.759 -10.935 0.852 1.00 63.41 H new ATOM 0 HB ILE A 39 21.603 -12.648 2.238 1.00 34.21 H new ATOM 0 HG12 ILE A 39 22.831 -13.029 -0.097 1.00 33.33 H new ATOM 0 HG13 ILE A 39 22.124 -14.349 0.814 1.00 33.33 H new ATOM 0 HG21 ILE A 39 19.453 -13.579 1.475 1.00 72.02 H new ATOM 0 HG22 ILE A 39 19.302 -11.866 1.933 1.00 72.02 H new ATOM 0 HG23 ILE A 39 19.362 -12.325 0.215 1.00 72.02 H new ATOM 0 HD11 ILE A 39 21.525 -14.497 -1.553 1.00 50.25 H new ATOM 0 HD12 ILE A 39 20.076 -14.216 -0.559 1.00 50.25 H new ATOM 0 HD13 ILE A 39 20.795 -12.876 -1.483 1.00 50.25 H new ATOM 561 N THR A 40 19.931 -10.100 -0.571 1.00 74.41 N ATOM 562 CA THR A 40 19.305 -9.732 -1.835 1.00 12.03 C ATOM 563 C THR A 40 20.076 -8.612 -2.524 1.00 15.11 C ATOM 564 O THR A 40 20.186 -8.584 -3.750 1.00 34.32 O ATOM 565 CB THR A 40 17.845 -9.285 -1.629 1.00 42.43 C ATOM 566 OG1 THR A 40 17.072 -10.365 -1.096 1.00 20.32 O ATOM 567 CG2 THR A 40 17.233 -8.816 -2.941 1.00 4.42 C ATOM 0 H THR A 40 19.370 -9.890 0.254 1.00 74.41 H new ATOM 0 HA THR A 40 19.319 -10.620 -2.466 1.00 12.03 H new ATOM 0 HB THR A 40 17.839 -8.453 -0.925 1.00 42.43 H new ATOM 0 HG1 THR A 40 16.146 -10.072 -0.967 1.00 20.32 H new ATOM 0 HG21 THR A 40 16.202 -8.505 -2.771 1.00 4.42 H new ATOM 0 HG22 THR A 40 17.806 -7.974 -3.330 1.00 4.42 H new ATOM 0 HG23 THR A 40 17.252 -9.632 -3.663 1.00 4.42 H new ATOM 575 N ASP A 41 20.608 -7.690 -1.729 1.00 32.31 N ATOM 576 CA ASP A 41 21.371 -6.568 -2.263 1.00 54.01 C ATOM 577 C ASP A 41 22.864 -6.881 -2.273 1.00 35.23 C ATOM 578 O ASP A 41 23.640 -6.222 -2.963 1.00 65.21 O ATOM 579 CB ASP A 41 21.107 -5.306 -1.439 1.00 72.55 C ATOM 580 CG ASP A 41 19.880 -4.552 -1.913 1.00 32.23 C ATOM 581 OD1 ASP A 41 19.180 -5.062 -2.813 1.00 42.22 O ATOM 582 OD2 ASP A 41 19.619 -3.453 -1.382 1.00 15.41 O ATOM 0 H ASP A 41 20.525 -7.698 -0.712 1.00 32.31 H new ATOM 0 HA ASP A 41 21.048 -6.397 -3.290 1.00 54.01 H new ATOM 0 HB2 ASP A 41 20.980 -5.579 -0.392 1.00 72.55 H new ATOM 0 HB3 ASP A 41 21.976 -4.651 -1.494 1.00 72.55 H new ATOM 587 N GLN A 42 23.256 -7.890 -1.502 1.00 4.24 N ATOM 588 CA GLN A 42 24.657 -8.288 -1.421 1.00 34.54 C ATOM 589 C GLN A 42 25.538 -7.105 -1.035 1.00 21.10 C ATOM 590 O GLN A 42 26.003 -6.357 -1.895 1.00 71.45 O ATOM 591 CB GLN A 42 25.121 -8.871 -2.756 1.00 71.45 C ATOM 592 CG GLN A 42 26.556 -9.374 -2.735 1.00 54.43 C ATOM 593 CD GLN A 42 27.377 -8.842 -3.893 1.00 60.13 C ATOM 594 OE1 GLN A 42 28.096 -7.852 -3.757 1.00 13.33 O ATOM 595 NE2 GLN A 42 27.275 -9.499 -5.043 1.00 21.44 N ATOM 0 H GLN A 42 22.625 -8.446 -0.925 1.00 4.24 H new ATOM 0 HA GLN A 42 24.748 -9.051 -0.648 1.00 34.54 H new ATOM 0 HB2 GLN A 42 24.461 -9.693 -3.033 1.00 71.45 H new ATOM 0 HB3 GLN A 42 25.023 -8.109 -3.529 1.00 71.45 H new ATOM 0 HG2 GLN A 42 27.026 -9.081 -1.796 1.00 54.43 H new ATOM 0 HG3 GLN A 42 26.556 -10.464 -2.765 1.00 54.43 H new ATOM 0 HE21 GLN A 42 26.667 -10.315 -5.112 1.00 21.44 H new ATOM 0 HE22 GLN A 42 27.805 -9.187 -5.857 1.00 21.44 H new ATOM 604 N VAL A 43 25.764 -6.941 0.265 1.00 41.54 N ATOM 605 CA VAL A 43 26.590 -5.848 0.765 1.00 65.34 C ATOM 606 C VAL A 43 28.054 -6.049 0.388 1.00 71.45 C ATOM 607 O VAL A 43 28.526 -7.180 0.266 1.00 22.33 O ATOM 608 CB VAL A 43 26.480 -5.716 2.295 1.00 14.21 C ATOM 609 CG1 VAL A 43 27.028 -6.958 2.980 1.00 63.20 C ATOM 610 CG2 VAL A 43 27.205 -4.468 2.775 1.00 10.13 C ATOM 0 H VAL A 43 25.387 -7.551 0.990 1.00 41.54 H new ATOM 0 HA VAL A 43 26.220 -4.934 0.301 1.00 65.34 H new ATOM 0 HB VAL A 43 25.427 -5.621 2.559 1.00 14.21 H new ATOM 0 HG11 VAL A 43 26.942 -6.846 4.061 1.00 63.20 H new ATOM 0 HG12 VAL A 43 26.460 -7.831 2.659 1.00 63.20 H new ATOM 0 HG13 VAL A 43 28.076 -7.089 2.712 1.00 63.20 H new ATOM 0 HG21 VAL A 43 27.117 -4.390 3.859 1.00 10.13 H new ATOM 0 HG22 VAL A 43 28.258 -4.530 2.500 1.00 10.13 H new ATOM 0 HG23 VAL A 43 26.760 -3.588 2.311 1.00 10.13 H new ATOM 620 N THR A 44 28.769 -4.944 0.203 1.00 2.03 N ATOM 621 CA THR A 44 30.179 -4.998 -0.161 1.00 4.03 C ATOM 622 C THR A 44 31.070 -4.882 1.071 1.00 10.10 C ATOM 623 O THR A 44 31.104 -3.842 1.728 1.00 12.51 O ATOM 624 CB THR A 44 30.547 -3.879 -1.153 1.00 53.41 C ATOM 625 OG1 THR A 44 29.393 -3.497 -1.910 1.00 72.13 O ATOM 626 CG2 THR A 44 31.651 -4.332 -2.096 1.00 30.21 C ATOM 0 H THR A 44 28.394 -4.000 0.299 1.00 2.03 H new ATOM 0 HA THR A 44 30.345 -5.964 -0.637 1.00 4.03 H new ATOM 0 HB THR A 44 30.907 -3.023 -0.583 1.00 53.41 H new ATOM 0 HG1 THR A 44 29.635 -2.784 -2.537 1.00 72.13 H new ATOM 0 HG21 THR A 44 31.893 -3.525 -2.787 1.00 30.21 H new ATOM 0 HG22 THR A 44 32.538 -4.594 -1.519 1.00 30.21 H new ATOM 0 HG23 THR A 44 31.314 -5.202 -2.659 1.00 30.21 H new ATOM 634 N TRP A 45 31.790 -5.955 1.378 1.00 73.02 N ATOM 635 CA TRP A 45 32.682 -5.972 2.532 1.00 72.44 C ATOM 636 C TRP A 45 34.095 -6.372 2.121 1.00 12.21 C ATOM 637 O TRP A 45 34.299 -7.416 1.501 1.00 4.24 O ATOM 638 CB TRP A 45 32.155 -6.937 3.595 1.00 14.23 C ATOM 639 CG TRP A 45 32.049 -6.319 4.957 1.00 62.41 C ATOM 640 CD1 TRP A 45 32.915 -5.427 5.521 1.00 22.15 C ATOM 641 CD2 TRP A 45 31.020 -6.550 5.925 1.00 21.42 C ATOM 642 NE1 TRP A 45 32.487 -5.089 6.783 1.00 75.45 N ATOM 643 CE2 TRP A 45 31.326 -5.764 7.053 1.00 33.34 C ATOM 644 CE3 TRP A 45 29.869 -7.343 5.948 1.00 4.13 C ATOM 645 CZ2 TRP A 45 30.522 -5.751 8.190 1.00 3.45 C ATOM 646 CZ3 TRP A 45 29.073 -7.328 7.078 1.00 62.43 C ATOM 647 CH2 TRP A 45 29.402 -6.536 8.186 1.00 71.22 C ATOM 0 H TRP A 45 31.774 -6.824 0.844 1.00 73.02 H new ATOM 0 HA TRP A 45 32.716 -4.966 2.949 1.00 72.44 H new ATOM 0 HB2 TRP A 45 31.173 -7.300 3.291 1.00 14.23 H new ATOM 0 HB3 TRP A 45 32.814 -7.804 3.647 1.00 14.23 H new ATOM 0 HD1 TRP A 45 33.806 -5.043 5.046 1.00 22.15 H new ATOM 0 HE1 TRP A 45 32.957 -4.441 7.415 1.00 75.45 H new ATOM 0 HE3 TRP A 45 29.607 -7.956 5.099 1.00 4.13 H new ATOM 0 HZ2 TRP A 45 30.774 -5.142 9.046 1.00 3.45 H new ATOM 0 HZ3 TRP A 45 28.182 -7.937 7.107 1.00 62.43 H new ATOM 0 HH2 TRP A 45 28.759 -6.546 9.054 1.00 71.22 H new ATOM 658 N ASP A 46 35.066 -5.536 2.470 1.00 2.32 N ATOM 659 CA ASP A 46 36.461 -5.803 2.139 1.00 40.03 C ATOM 660 C ASP A 46 37.370 -5.499 3.326 1.00 54.43 C ATOM 661 O ASP A 46 37.119 -4.565 4.088 1.00 24.33 O ATOM 662 CB ASP A 46 36.888 -4.972 0.928 1.00 71.14 C ATOM 663 CG ASP A 46 38.354 -5.156 0.587 1.00 12.21 C ATOM 664 OD1 ASP A 46 38.674 -6.101 -0.163 1.00 62.01 O ATOM 665 OD2 ASP A 46 39.181 -4.355 1.072 1.00 54.34 O ATOM 0 H ASP A 46 34.913 -4.667 2.982 1.00 2.32 H new ATOM 0 HA ASP A 46 36.554 -6.861 1.895 1.00 40.03 H new ATOM 0 HB2 ASP A 46 36.280 -5.251 0.067 1.00 71.14 H new ATOM 0 HB3 ASP A 46 36.694 -3.918 1.128 1.00 71.14 H new ATOM 670 N SER A 47 38.424 -6.293 3.476 1.00 24.21 N ATOM 671 CA SER A 47 39.368 -6.112 4.573 1.00 12.02 C ATOM 672 C SER A 47 40.799 -6.032 4.051 1.00 2.02 C ATOM 673 O SER A 47 41.185 -6.776 3.150 1.00 25.10 O ATOM 674 CB SER A 47 39.242 -7.260 5.577 1.00 42.13 C ATOM 675 OG SER A 47 40.427 -7.401 6.341 1.00 62.11 O ATOM 0 H SER A 47 38.647 -7.068 2.852 1.00 24.21 H new ATOM 0 HA SER A 47 39.130 -5.173 5.074 1.00 12.02 H new ATOM 0 HB2 SER A 47 38.397 -7.076 6.241 1.00 42.13 H new ATOM 0 HB3 SER A 47 39.034 -8.190 5.047 1.00 42.13 H new ATOM 0 HG SER A 47 40.321 -8.140 6.976 1.00 62.11 H new ATOM 681 N SER A 48 41.582 -5.123 4.625 1.00 75.23 N ATOM 682 CA SER A 48 42.969 -4.942 4.216 1.00 45.02 C ATOM 683 C SER A 48 43.060 -4.626 2.726 1.00 70.21 C ATOM 684 O SER A 48 42.049 -4.583 2.027 1.00 75.20 O ATOM 685 CB SER A 48 43.785 -6.197 4.533 1.00 12.01 C ATOM 686 OG SER A 48 44.955 -5.874 5.264 1.00 41.41 O ATOM 0 H SER A 48 41.279 -4.501 5.374 1.00 75.23 H new ATOM 0 HA SER A 48 43.379 -4.100 4.774 1.00 45.02 H new ATOM 0 HB2 SER A 48 43.176 -6.895 5.106 1.00 12.01 H new ATOM 0 HB3 SER A 48 44.059 -6.700 3.606 1.00 12.01 H new ATOM 0 HG SER A 48 45.282 -6.673 5.728 1.00 41.41 H new ATOM 692 N ASN A 49 44.280 -4.406 2.247 1.00 1.12 N ATOM 693 CA ASN A 49 44.504 -4.093 0.840 1.00 23.25 C ATOM 694 C ASN A 49 45.990 -3.891 0.558 1.00 10.02 C ATOM 695 O ASN A 49 46.369 -3.066 -0.274 1.00 62.21 O ATOM 696 CB ASN A 49 43.723 -2.839 0.445 1.00 42.44 C ATOM 697 CG ASN A 49 43.035 -2.986 -0.899 1.00 1.12 C ATOM 698 OD1 ASN A 49 42.337 -3.969 -1.146 1.00 54.15 O ATOM 699 ND2 ASN A 49 43.230 -2.006 -1.774 1.00 24.31 N ATOM 0 H ASN A 49 45.129 -4.439 2.812 1.00 1.12 H new ATOM 0 HA ASN A 49 44.151 -4.935 0.245 1.00 23.25 H new ATOM 0 HB2 ASN A 49 42.977 -2.623 1.210 1.00 42.44 H new ATOM 0 HB3 ASN A 49 44.402 -1.987 0.411 1.00 42.44 H new ATOM 0 HD21 ASN A 49 42.793 -2.050 -2.694 1.00 24.31 H new ATOM 0 HD22 ASN A 49 43.817 -1.210 -1.525 1.00 24.31 H new ATOM 706 N THR A 50 46.828 -4.650 1.257 1.00 63.20 N ATOM 707 CA THR A 50 48.272 -4.555 1.083 1.00 41.23 C ATOM 708 C THR A 50 48.816 -5.763 0.330 1.00 61.35 C ATOM 709 O THR A 50 49.168 -5.667 -0.846 1.00 73.14 O ATOM 710 CB THR A 50 48.995 -4.441 2.438 1.00 42.40 C ATOM 711 OG1 THR A 50 48.387 -5.317 3.393 1.00 21.21 O ATOM 712 CG2 THR A 50 48.953 -3.011 2.955 1.00 14.33 C ATOM 0 H THR A 50 46.531 -5.338 1.949 1.00 63.20 H new ATOM 0 HA THR A 50 48.461 -3.653 0.502 1.00 41.23 H new ATOM 0 HB THR A 50 50.037 -4.728 2.294 1.00 42.40 H new ATOM 0 HG1 THR A 50 48.854 -5.240 4.251 1.00 21.21 H new ATOM 0 HG21 THR A 50 49.470 -2.955 3.913 1.00 14.33 H new ATOM 0 HG22 THR A 50 49.443 -2.351 2.239 1.00 14.33 H new ATOM 0 HG23 THR A 50 47.916 -2.701 3.084 1.00 14.33 H new ATOM 720 N ASP A 51 48.882 -6.900 1.014 1.00 62.14 N ATOM 721 CA ASP A 51 49.382 -8.129 0.408 1.00 1.11 C ATOM 722 C ASP A 51 48.379 -9.266 0.578 1.00 50.40 C ATOM 723 O ASP A 51 47.694 -9.648 -0.371 1.00 35.43 O ATOM 724 CB ASP A 51 50.724 -8.519 1.029 1.00 22.50 C ATOM 725 CG ASP A 51 51.864 -7.649 0.538 1.00 64.42 C ATOM 726 OD1 ASP A 51 52.318 -7.857 -0.607 1.00 23.34 O ATOM 727 OD2 ASP A 51 52.303 -6.761 1.298 1.00 25.02 O ATOM 0 H ASP A 51 48.596 -6.996 1.988 1.00 62.14 H new ATOM 0 HA ASP A 51 49.522 -7.949 -0.658 1.00 1.11 H new ATOM 0 HB2 ASP A 51 50.654 -8.443 2.114 1.00 22.50 H new ATOM 0 HB3 ASP A 51 50.940 -9.562 0.795 1.00 22.50 H new ATOM 732 N ILE A 52 48.299 -9.801 1.791 1.00 24.23 N ATOM 733 CA ILE A 52 47.380 -10.894 2.085 1.00 43.22 C ATOM 734 C ILE A 52 46.053 -10.367 2.621 1.00 64.04 C ATOM 735 O ILE A 52 46.012 -9.685 3.646 1.00 72.33 O ATOM 736 CB ILE A 52 47.981 -11.875 3.108 1.00 21.33 C ATOM 737 CG1 ILE A 52 49.300 -12.449 2.585 1.00 55.33 C ATOM 738 CG2 ILE A 52 46.995 -12.993 3.412 1.00 32.04 C ATOM 739 CD1 ILE A 52 50.502 -11.590 2.907 1.00 23.04 C ATOM 0 H ILE A 52 48.859 -9.496 2.587 1.00 24.23 H new ATOM 0 HA ILE A 52 47.207 -11.422 1.147 1.00 43.22 H new ATOM 0 HB ILE A 52 48.184 -11.333 4.032 1.00 21.33 H new ATOM 0 HG12 ILE A 52 49.449 -13.442 3.010 1.00 55.33 H new ATOM 0 HG13 ILE A 52 49.230 -12.572 1.504 1.00 55.33 H new ATOM 0 HG21 ILE A 52 47.434 -13.678 4.137 1.00 32.04 H new ATOM 0 HG22 ILE A 52 46.079 -12.569 3.823 1.00 32.04 H new ATOM 0 HG23 ILE A 52 46.764 -13.534 2.494 1.00 32.04 H new ATOM 0 HD11 ILE A 52 51.401 -12.058 2.506 1.00 23.04 H new ATOM 0 HD12 ILE A 52 50.375 -10.604 2.459 1.00 23.04 H new ATOM 0 HD13 ILE A 52 50.597 -11.488 3.988 1.00 23.04 H new ATOM 751 N LEU A 53 44.970 -10.689 1.922 1.00 3.41 N ATOM 752 CA LEU A 53 43.640 -10.250 2.328 1.00 13.42 C ATOM 753 C LEU A 53 42.564 -11.155 1.738 1.00 74.31 C ATOM 754 O LEU A 53 42.523 -11.381 0.529 1.00 62.15 O ATOM 755 CB LEU A 53 43.402 -8.804 1.890 1.00 42.54 C ATOM 756 CG LEU A 53 43.379 -8.555 0.381 1.00 2.10 C ATOM 757 CD1 LEU A 53 41.989 -8.133 -0.069 1.00 63.14 C ATOM 758 CD2 LEU A 53 44.408 -7.501 -0.002 1.00 25.34 C ATOM 0 H LEU A 53 44.987 -11.252 1.072 1.00 3.41 H new ATOM 0 HA LEU A 53 43.582 -10.308 3.415 1.00 13.42 H new ATOM 0 HB2 LEU A 53 42.452 -8.471 2.308 1.00 42.54 H new ATOM 0 HB3 LEU A 53 44.180 -8.180 2.329 1.00 42.54 H new ATOM 0 HG LEU A 53 43.636 -9.486 -0.125 1.00 2.10 H new ATOM 0 HD11 LEU A 53 41.992 -7.960 -1.145 1.00 63.14 H new ATOM 0 HD12 LEU A 53 41.274 -8.921 0.170 1.00 63.14 H new ATOM 0 HD13 LEU A 53 41.703 -7.215 0.445 1.00 63.14 H new ATOM 0 HD21 LEU A 53 44.377 -7.337 -1.079 1.00 25.34 H new ATOM 0 HD22 LEU A 53 44.182 -6.568 0.514 1.00 25.34 H new ATOM 0 HD23 LEU A 53 45.403 -7.842 0.285 1.00 25.34 H new ATOM 770 N SER A 54 41.692 -11.670 2.600 1.00 42.33 N ATOM 771 CA SER A 54 40.616 -12.552 2.164 1.00 62.11 C ATOM 772 C SER A 54 39.310 -12.206 2.871 1.00 15.04 C ATOM 773 O SER A 54 39.300 -11.891 4.062 1.00 63.02 O ATOM 774 CB SER A 54 40.984 -14.012 2.434 1.00 24.22 C ATOM 775 OG SER A 54 40.701 -14.826 1.309 1.00 23.23 O ATOM 0 H SER A 54 41.710 -11.491 3.604 1.00 42.33 H new ATOM 0 HA SER A 54 40.477 -12.412 1.092 1.00 62.11 H new ATOM 0 HB2 SER A 54 42.043 -14.084 2.681 1.00 24.22 H new ATOM 0 HB3 SER A 54 40.429 -14.376 3.299 1.00 24.22 H new ATOM 0 HG SER A 54 40.947 -15.754 1.507 1.00 23.23 H new ATOM 781 N ILE A 55 38.209 -12.267 2.130 1.00 14.10 N ATOM 782 CA ILE A 55 36.896 -11.961 2.686 1.00 62.23 C ATOM 783 C ILE A 55 35.822 -12.863 2.087 1.00 40.44 C ATOM 784 O ILE A 55 35.830 -13.143 0.888 1.00 21.00 O ATOM 785 CB ILE A 55 36.510 -10.490 2.442 1.00 25.22 C ATOM 786 CG1 ILE A 55 36.078 -10.287 0.988 1.00 24.54 C ATOM 787 CG2 ILE A 55 37.674 -9.573 2.787 1.00 24.33 C ATOM 788 CD1 ILE A 55 37.167 -10.599 -0.015 1.00 31.35 C ATOM 0 H ILE A 55 38.200 -12.525 1.143 1.00 14.10 H new ATOM 0 HA ILE A 55 36.959 -12.138 3.760 1.00 62.23 H new ATOM 0 HB ILE A 55 35.670 -10.238 3.089 1.00 25.22 H new ATOM 0 HG12 ILE A 55 35.214 -10.919 0.783 1.00 24.54 H new ATOM 0 HG13 ILE A 55 35.757 -9.254 0.854 1.00 24.54 H new ATOM 0 HG21 ILE A 55 37.386 -8.537 2.609 1.00 24.33 H new ATOM 0 HG22 ILE A 55 37.939 -9.701 3.836 1.00 24.33 H new ATOM 0 HG23 ILE A 55 38.532 -9.823 2.163 1.00 24.33 H new ATOM 0 HD11 ILE A 55 36.790 -10.433 -1.024 1.00 31.35 H new ATOM 0 HD12 ILE A 55 38.024 -9.949 0.164 1.00 31.35 H new ATOM 0 HD13 ILE A 55 37.473 -11.640 0.092 1.00 31.35 H new ATOM 800 N SER A 56 34.897 -13.312 2.929 1.00 62.32 N ATOM 801 CA SER A 56 33.816 -14.184 2.483 1.00 5.11 C ATOM 802 C SER A 56 32.457 -13.590 2.840 1.00 3.02 C ATOM 803 O SER A 56 32.094 -13.505 4.012 1.00 14.14 O ATOM 804 CB SER A 56 33.960 -15.572 3.111 1.00 42.41 C ATOM 805 OG SER A 56 34.919 -16.349 2.415 1.00 31.31 O ATOM 0 H SER A 56 34.874 -13.087 3.924 1.00 62.32 H new ATOM 0 HA SER A 56 33.880 -14.275 1.399 1.00 5.11 H new ATOM 0 HB2 SER A 56 34.256 -15.473 4.155 1.00 42.41 H new ATOM 0 HB3 SER A 56 32.997 -16.082 3.099 1.00 42.41 H new ATOM 0 HG SER A 56 34.994 -17.231 2.836 1.00 31.31 H new ATOM 811 N ASN A 57 31.711 -13.180 1.820 1.00 70.34 N ATOM 812 CA ASN A 57 30.392 -12.593 2.025 1.00 73.45 C ATOM 813 C ASN A 57 29.473 -12.895 0.845 1.00 73.33 C ATOM 814 O ASN A 57 29.240 -12.040 -0.009 1.00 2.12 O ATOM 815 CB ASN A 57 30.508 -11.081 2.220 1.00 4.54 C ATOM 816 CG ASN A 57 31.240 -10.404 1.077 1.00 21.31 C ATOM 817 OD1 ASN A 57 30.621 -9.814 0.192 1.00 72.34 O ATOM 818 ND2 ASN A 57 32.565 -10.488 1.091 1.00 3.43 N ATOM 0 H ASN A 57 31.997 -13.243 0.843 1.00 70.34 H new ATOM 0 HA ASN A 57 29.960 -13.036 2.922 1.00 73.45 H new ATOM 0 HB2 ASN A 57 29.510 -10.652 2.313 1.00 4.54 H new ATOM 0 HB3 ASN A 57 31.031 -10.877 3.154 1.00 4.54 H new ATOM 0 HD21 ASN A 57 33.111 -10.053 0.348 1.00 3.43 H new ATOM 0 HD22 ASN A 57 33.036 -10.988 1.845 1.00 3.43 H new ATOM 825 N ALA A 58 28.953 -14.118 0.804 1.00 13.34 N ATOM 826 CA ALA A 58 28.057 -14.532 -0.269 1.00 3.04 C ATOM 827 C ALA A 58 26.761 -15.110 0.290 1.00 4.32 C ATOM 828 O ALA A 58 25.684 -14.890 -0.262 1.00 74.14 O ATOM 829 CB ALA A 58 28.746 -15.548 -1.168 1.00 12.11 C ATOM 0 H ALA A 58 29.137 -14.839 1.502 1.00 13.34 H new ATOM 0 HA ALA A 58 27.806 -13.651 -0.860 1.00 3.04 H new ATOM 0 HB1 ALA A 58 28.066 -15.849 -1.965 1.00 12.11 H new ATOM 0 HB2 ALA A 58 29.640 -15.102 -1.603 1.00 12.11 H new ATOM 0 HB3 ALA A 58 29.026 -16.423 -0.581 1.00 12.11 H new ATOM 835 N SER A 59 26.874 -15.850 1.389 1.00 50.43 N ATOM 836 CA SER A 59 25.711 -16.463 2.020 1.00 42.03 C ATOM 837 C SER A 59 24.649 -15.415 2.336 1.00 12.33 C ATOM 838 O SER A 59 23.457 -15.641 2.128 1.00 14.33 O ATOM 839 CB SER A 59 26.124 -17.190 3.301 1.00 70.33 C ATOM 840 OG SER A 59 27.181 -18.100 3.052 1.00 24.44 O ATOM 0 H SER A 59 27.759 -16.039 1.860 1.00 50.43 H new ATOM 0 HA SER A 59 25.287 -17.185 1.322 1.00 42.03 H new ATOM 0 HB2 SER A 59 26.435 -16.463 4.051 1.00 70.33 H new ATOM 0 HB3 SER A 59 25.268 -17.725 3.711 1.00 70.33 H new ATOM 0 HG SER A 59 27.428 -18.551 3.886 1.00 24.44 H new ATOM 846 N ASP A 60 25.090 -14.268 2.841 1.00 45.25 N ATOM 847 CA ASP A 60 24.179 -13.183 3.186 1.00 40.04 C ATOM 848 C ASP A 60 24.946 -11.981 3.727 1.00 12.44 C ATOM 849 O ASP A 60 25.139 -10.988 3.026 1.00 11.42 O ATOM 850 CB ASP A 60 23.155 -13.658 4.217 1.00 12.45 C ATOM 851 CG ASP A 60 23.683 -14.786 5.081 1.00 60.22 C ATOM 852 OD1 ASP A 60 24.840 -14.690 5.540 1.00 43.13 O ATOM 853 OD2 ASP A 60 22.940 -15.766 5.297 1.00 75.40 O ATOM 0 H ASP A 60 26.073 -14.066 3.021 1.00 45.25 H new ATOM 0 HA ASP A 60 23.655 -12.878 2.280 1.00 40.04 H new ATOM 0 HB2 ASP A 60 22.869 -12.820 4.853 1.00 12.45 H new ATOM 0 HB3 ASP A 60 22.253 -13.990 3.703 1.00 12.45 H new ATOM 858 N SER A 61 25.380 -12.077 4.980 1.00 33.41 N ATOM 859 CA SER A 61 26.121 -10.996 5.618 1.00 41.10 C ATOM 860 C SER A 61 27.277 -11.546 6.448 1.00 1.42 C ATOM 861 O SER A 61 28.443 -11.413 6.075 1.00 41.40 O ATOM 862 CB SER A 61 25.191 -10.165 6.505 1.00 63.44 C ATOM 863 OG SER A 61 25.072 -8.840 6.018 1.00 41.21 O ATOM 0 H SER A 61 25.231 -12.893 5.573 1.00 33.41 H new ATOM 0 HA SER A 61 26.530 -10.358 4.835 1.00 41.10 H new ATOM 0 HB2 SER A 61 24.207 -10.632 6.543 1.00 63.44 H new ATOM 0 HB3 SER A 61 25.575 -10.148 7.525 1.00 63.44 H new ATOM 0 HG SER A 61 25.957 -8.503 5.766 1.00 41.21 H new ATOM 869 N HIS A 62 26.945 -12.164 7.577 1.00 21.10 N ATOM 870 CA HIS A 62 27.955 -12.735 8.461 1.00 33.24 C ATOM 871 C HIS A 62 28.903 -13.646 7.687 1.00 52.21 C ATOM 872 O HIS A 62 28.469 -14.562 6.990 1.00 35.23 O ATOM 873 CB HIS A 62 27.288 -13.518 9.593 1.00 51.10 C ATOM 874 CG HIS A 62 26.211 -14.448 9.125 1.00 41.33 C ATOM 875 ND1 HIS A 62 24.883 -14.085 9.051 1.00 50.43 N ATOM 876 CD2 HIS A 62 26.272 -15.733 8.703 1.00 4.53 C ATOM 877 CE1 HIS A 62 24.174 -15.106 8.606 1.00 74.42 C ATOM 878 NE2 HIS A 62 24.993 -16.119 8.387 1.00 42.22 N ATOM 0 H HIS A 62 25.985 -12.282 7.901 1.00 21.10 H new ATOM 0 HA HIS A 62 28.534 -11.916 8.887 1.00 33.24 H new ATOM 0 HB2 HIS A 62 28.048 -14.093 10.123 1.00 51.10 H new ATOM 0 HB3 HIS A 62 26.863 -12.815 10.309 1.00 51.10 H new ATOM 0 HD2 HIS A 62 27.161 -16.341 8.629 1.00 4.53 H new ATOM 0 HE1 HIS A 62 23.106 -15.112 8.448 1.00 74.42 H new ATOM 0 HE2 HIS A 62 24.720 -17.038 8.040 1.00 42.22 H new ATOM 886 N GLY A 63 30.201 -13.386 7.813 1.00 13.04 N ATOM 887 CA GLY A 63 31.189 -14.190 7.119 1.00 23.11 C ATOM 888 C GLY A 63 32.455 -14.381 7.931 1.00 60.20 C ATOM 889 O GLY A 63 32.429 -14.989 9.002 1.00 13.32 O ATOM 0 H GLY A 63 30.585 -12.633 8.383 1.00 13.04 H new ATOM 0 HA2 GLY A 63 30.761 -15.165 6.885 1.00 23.11 H new ATOM 0 HA3 GLY A 63 31.438 -13.715 6.170 1.00 23.11 H new ATOM 893 N LEU A 64 33.567 -13.864 7.421 1.00 51.43 N ATOM 894 CA LEU A 64 34.850 -13.982 8.105 1.00 51.50 C ATOM 895 C LEU A 64 35.952 -13.277 7.321 1.00 42.13 C ATOM 896 O LEU A 64 36.357 -13.734 6.252 1.00 31.23 O ATOM 897 CB LEU A 64 35.211 -15.455 8.303 1.00 41.31 C ATOM 898 CG LEU A 64 35.104 -16.344 7.064 1.00 61.41 C ATOM 899 CD1 LEU A 64 36.454 -16.962 6.732 1.00 34.22 C ATOM 900 CD2 LEU A 64 34.057 -17.428 7.274 1.00 33.02 C ATOM 0 H LEU A 64 33.606 -13.359 6.536 1.00 51.43 H new ATOM 0 HA LEU A 64 34.760 -13.502 9.080 1.00 51.50 H new ATOM 0 HB2 LEU A 64 36.233 -15.511 8.679 1.00 41.31 H new ATOM 0 HB3 LEU A 64 34.564 -15.866 9.078 1.00 41.31 H new ATOM 0 HG LEU A 64 34.794 -15.725 6.222 1.00 61.41 H new ATOM 0 HD11 LEU A 64 36.358 -17.591 5.847 1.00 34.22 H new ATOM 0 HD12 LEU A 64 37.178 -16.171 6.538 1.00 34.22 H new ATOM 0 HD13 LEU A 64 36.794 -17.567 7.573 1.00 34.22 H new ATOM 0 HD21 LEU A 64 33.994 -18.051 6.382 1.00 33.02 H new ATOM 0 HD22 LEU A 64 34.338 -18.044 8.128 1.00 33.02 H new ATOM 0 HD23 LEU A 64 33.088 -16.966 7.463 1.00 33.02 H new ATOM 912 N ALA A 65 36.435 -12.162 7.860 1.00 71.21 N ATOM 913 CA ALA A 65 37.493 -11.397 7.213 1.00 43.21 C ATOM 914 C ALA A 65 38.860 -11.761 7.782 1.00 45.02 C ATOM 915 O ALA A 65 39.128 -11.547 8.964 1.00 23.41 O ATOM 916 CB ALA A 65 37.236 -9.905 7.367 1.00 73.21 C ATOM 0 H ALA A 65 36.110 -11.769 8.743 1.00 71.21 H new ATOM 0 HA ALA A 65 37.491 -11.647 6.152 1.00 43.21 H new ATOM 0 HB1 ALA A 65 38.034 -9.346 6.879 1.00 73.21 H new ATOM 0 HB2 ALA A 65 36.281 -9.651 6.907 1.00 73.21 H new ATOM 0 HB3 ALA A 65 37.208 -9.648 8.426 1.00 73.21 H new ATOM 922 N SER A 66 39.722 -12.312 6.933 1.00 71.32 N ATOM 923 CA SER A 66 41.060 -12.710 7.353 1.00 64.53 C ATOM 924 C SER A 66 42.122 -11.864 6.657 1.00 1.24 C ATOM 925 O SER A 66 41.895 -11.329 5.571 1.00 32.25 O ATOM 926 CB SER A 66 41.294 -14.192 7.049 1.00 54.31 C ATOM 927 OG SER A 66 42.009 -14.821 8.098 1.00 42.22 O ATOM 0 H SER A 66 39.517 -12.493 5.950 1.00 71.32 H new ATOM 0 HA SER A 66 41.139 -12.550 8.428 1.00 64.53 H new ATOM 0 HB2 SER A 66 40.336 -14.693 6.906 1.00 54.31 H new ATOM 0 HB3 SER A 66 41.848 -14.292 6.116 1.00 54.31 H new ATOM 0 HG SER A 66 42.144 -15.767 7.880 1.00 42.22 H new ATOM 933 N THR A 67 43.285 -11.746 7.292 1.00 54.53 N ATOM 934 CA THR A 67 44.382 -10.964 6.737 1.00 40.54 C ATOM 935 C THR A 67 45.712 -11.355 7.371 1.00 71.04 C ATOM 936 O THR A 67 45.818 -11.473 8.592 1.00 21.31 O ATOM 937 CB THR A 67 44.155 -9.454 6.939 1.00 55.41 C ATOM 938 OG1 THR A 67 45.227 -8.713 6.346 1.00 2.24 O ATOM 939 CG2 THR A 67 44.054 -9.115 8.419 1.00 43.04 C ATOM 0 H THR A 67 43.490 -12.182 8.191 1.00 54.53 H new ATOM 0 HA THR A 67 44.414 -11.179 5.669 1.00 40.54 H new ATOM 0 HB THR A 67 43.216 -9.183 6.456 1.00 55.41 H new ATOM 0 HG1 THR A 67 45.423 -9.076 5.457 1.00 2.24 H new ATOM 0 HG21 THR A 67 43.894 -8.043 8.537 1.00 43.04 H new ATOM 0 HG22 THR A 67 43.218 -9.657 8.860 1.00 43.04 H new ATOM 0 HG23 THR A 67 44.978 -9.401 8.922 1.00 43.04 H new ATOM 947 N LEU A 68 46.725 -11.554 6.534 1.00 34.44 N ATOM 948 CA LEU A 68 48.050 -11.932 7.014 1.00 74.22 C ATOM 949 C LEU A 68 49.089 -10.888 6.621 1.00 42.53 C ATOM 950 O LEU A 68 49.872 -11.095 5.694 1.00 11.55 O ATOM 951 CB LEU A 68 48.446 -13.299 6.453 1.00 50.02 C ATOM 952 CG LEU A 68 49.633 -13.984 7.131 1.00 43.05 C ATOM 953 CD1 LEU A 68 49.343 -14.220 8.605 1.00 44.33 C ATOM 954 CD2 LEU A 68 49.961 -15.296 6.433 1.00 22.11 C ATOM 0 H LEU A 68 46.654 -11.460 5.521 1.00 34.44 H new ATOM 0 HA LEU A 68 48.013 -11.989 8.102 1.00 74.22 H new ATOM 0 HB2 LEU A 68 47.583 -13.961 6.521 1.00 50.02 H new ATOM 0 HB3 LEU A 68 48.676 -13.182 5.394 1.00 50.02 H new ATOM 0 HG LEU A 68 50.500 -13.327 7.053 1.00 43.05 H new ATOM 0 HD11 LEU A 68 50.199 -14.708 9.071 1.00 44.33 H new ATOM 0 HD12 LEU A 68 49.158 -13.265 9.097 1.00 44.33 H new ATOM 0 HD13 LEU A 68 48.464 -14.856 8.706 1.00 44.33 H new ATOM 0 HD21 LEU A 68 50.808 -15.770 6.929 1.00 22.11 H new ATOM 0 HD22 LEU A 68 49.097 -15.959 6.479 1.00 22.11 H new ATOM 0 HD23 LEU A 68 50.213 -15.100 5.391 1.00 22.11 H new ATOM 966 N ASN A 69 49.092 -9.765 7.333 1.00 33.40 N ATOM 967 CA ASN A 69 50.037 -8.689 7.060 1.00 55.45 C ATOM 968 C ASN A 69 50.690 -8.198 8.348 1.00 51.11 C ATOM 969 O ASN A 69 50.325 -8.627 9.442 1.00 1.01 O ATOM 970 CB ASN A 69 49.329 -7.527 6.359 1.00 60.13 C ATOM 971 CG ASN A 69 48.633 -6.599 7.336 1.00 24.52 C ATOM 972 OD1 ASN A 69 48.983 -5.425 7.451 1.00 45.33 O ATOM 973 ND2 ASN A 69 47.642 -7.125 8.047 1.00 43.30 N ATOM 0 H ASN A 69 48.450 -9.577 8.103 1.00 33.40 H new ATOM 0 HA ASN A 69 50.816 -9.080 6.405 1.00 55.45 H new ATOM 0 HB2 ASN A 69 50.056 -6.959 5.778 1.00 60.13 H new ATOM 0 HB3 ASN A 69 48.598 -7.923 5.654 1.00 60.13 H new ATOM 0 HD21 ASN A 69 47.137 -6.550 8.721 1.00 43.30 H new ATOM 0 HD22 ASN A 69 47.386 -8.104 7.918 1.00 43.30 H new ATOM 980 N GLN A 70 51.656 -7.296 8.209 1.00 64.23 N ATOM 981 CA GLN A 70 52.360 -6.747 9.362 1.00 63.44 C ATOM 982 C GLN A 70 52.218 -5.230 9.414 1.00 2.24 C ATOM 983 O GLN A 70 53.118 -4.497 9.005 1.00 31.41 O ATOM 984 CB GLN A 70 53.840 -7.132 9.313 1.00 41.54 C ATOM 985 CG GLN A 70 54.097 -8.601 9.604 1.00 21.12 C ATOM 986 CD GLN A 70 55.561 -8.974 9.479 1.00 3.52 C ATOM 987 OE1 GLN A 70 56.257 -9.148 10.480 1.00 20.11 O ATOM 988 NE2 GLN A 70 56.038 -9.097 8.246 1.00 73.51 N ATOM 0 H GLN A 70 51.969 -6.930 7.310 1.00 64.23 H new ATOM 0 HA GLN A 70 51.913 -7.166 10.263 1.00 63.44 H new ATOM 0 HB2 GLN A 70 54.237 -6.891 8.327 1.00 41.54 H new ATOM 0 HB3 GLN A 70 54.388 -6.526 10.034 1.00 41.54 H new ATOM 0 HG2 GLN A 70 53.752 -8.834 10.611 1.00 21.12 H new ATOM 0 HG3 GLN A 70 53.511 -9.211 8.917 1.00 21.12 H new ATOM 0 HE21 GLN A 70 55.426 -8.944 7.445 1.00 73.51 H new ATOM 0 HE22 GLN A 70 57.017 -9.345 8.100 1.00 73.51 H new ATOM 997 N GLY A 71 51.081 -4.764 9.921 1.00 14.13 N ATOM 998 CA GLY A 71 50.841 -3.336 10.018 1.00 43.23 C ATOM 999 C GLY A 71 49.446 -3.014 10.514 1.00 11.04 C ATOM 1000 O GLY A 71 49.061 -3.420 11.610 1.00 1.32 O ATOM 0 H GLY A 71 50.321 -5.350 10.267 1.00 14.13 H new ATOM 0 HA2 GLY A 71 51.574 -2.893 10.692 1.00 43.23 H new ATOM 0 HA3 GLY A 71 50.990 -2.879 9.040 1.00 43.23 H new ATOM 1004 N ASN A 72 48.686 -2.281 9.707 1.00 43.11 N ATOM 1005 CA ASN A 72 47.326 -1.903 10.072 1.00 51.41 C ATOM 1006 C ASN A 72 46.343 -2.274 8.966 1.00 52.11 C ATOM 1007 O ASN A 72 46.695 -2.290 7.787 1.00 42.35 O ATOM 1008 CB ASN A 72 47.250 -0.401 10.354 1.00 42.42 C ATOM 1009 CG ASN A 72 47.569 0.434 9.129 1.00 53.35 C ATOM 1010 OD1 ASN A 72 46.669 0.868 8.408 1.00 4.13 O ATOM 1011 ND2 ASN A 72 48.854 0.663 8.887 1.00 42.25 N ATOM 0 H ASN A 72 48.989 -1.937 8.796 1.00 43.11 H new ATOM 0 HA ASN A 72 47.054 -2.450 10.975 1.00 51.41 H new ATOM 0 HB2 ASN A 72 46.251 -0.151 10.711 1.00 42.42 H new ATOM 0 HB3 ASN A 72 47.946 -0.149 11.154 1.00 42.42 H new ATOM 0 HD21 ASN A 72 49.129 1.218 8.077 1.00 42.25 H new ATOM 0 HD22 ASN A 72 49.566 0.284 9.511 1.00 42.25 H new ATOM 1018 N VAL A 73 45.107 -2.572 9.355 1.00 2.15 N ATOM 1019 CA VAL A 73 44.072 -2.941 8.398 1.00 71.53 C ATOM 1020 C VAL A 73 42.768 -2.206 8.687 1.00 61.03 C ATOM 1021 O VAL A 73 42.367 -2.061 9.842 1.00 53.15 O ATOM 1022 CB VAL A 73 43.807 -4.459 8.415 1.00 43.32 C ATOM 1023 CG1 VAL A 73 42.694 -4.818 7.443 1.00 52.23 C ATOM 1024 CG2 VAL A 73 45.080 -5.225 8.087 1.00 0.21 C ATOM 0 H VAL A 73 44.799 -2.565 10.327 1.00 2.15 H new ATOM 0 HA VAL A 73 44.437 -2.654 7.412 1.00 71.53 H new ATOM 0 HB VAL A 73 43.487 -4.743 9.417 1.00 43.32 H new ATOM 0 HG11 VAL A 73 42.521 -5.894 7.469 1.00 52.23 H new ATOM 0 HG12 VAL A 73 41.780 -4.297 7.728 1.00 52.23 H new ATOM 0 HG13 VAL A 73 42.982 -4.521 6.435 1.00 52.23 H new ATOM 0 HG21 VAL A 73 44.875 -6.295 8.103 1.00 0.21 H new ATOM 0 HG22 VAL A 73 45.432 -4.938 7.096 1.00 0.21 H new ATOM 0 HG23 VAL A 73 45.846 -4.991 8.826 1.00 0.21 H new ATOM 1034 N LYS A 74 42.110 -1.743 7.630 1.00 75.24 N ATOM 1035 CA LYS A 74 40.849 -1.024 7.768 1.00 50.43 C ATOM 1036 C LYS A 74 39.781 -1.617 6.855 1.00 73.30 C ATOM 1037 O LYS A 74 39.954 -1.678 5.638 1.00 52.14 O ATOM 1038 CB LYS A 74 41.046 0.459 7.443 1.00 61.23 C ATOM 1039 CG LYS A 74 40.737 1.383 8.608 1.00 50.24 C ATOM 1040 CD LYS A 74 41.649 1.111 9.792 1.00 13.33 C ATOM 1041 CE LYS A 74 41.374 2.072 10.939 1.00 35.44 C ATOM 1042 NZ LYS A 74 41.891 3.439 10.655 1.00 63.52 N ATOM 0 H LYS A 74 42.429 -1.853 6.667 1.00 75.24 H new ATOM 0 HA LYS A 74 40.515 -1.123 8.801 1.00 50.43 H new ATOM 0 HB2 LYS A 74 42.077 0.619 7.127 1.00 61.23 H new ATOM 0 HB3 LYS A 74 40.409 0.725 6.600 1.00 61.23 H new ATOM 0 HG2 LYS A 74 40.850 2.420 8.291 1.00 50.24 H new ATOM 0 HG3 LYS A 74 39.698 1.254 8.911 1.00 50.24 H new ATOM 0 HD2 LYS A 74 41.508 0.085 10.133 1.00 13.33 H new ATOM 0 HD3 LYS A 74 42.689 1.203 9.480 1.00 13.33 H new ATOM 0 HE2 LYS A 74 40.301 2.121 11.122 1.00 35.44 H new ATOM 0 HE3 LYS A 74 41.836 1.691 11.850 1.00 35.44 H new ATOM 0 HZ1 LYS A 74 41.744 4.045 11.487 1.00 63.52 H new ATOM 0 HZ2 LYS A 74 42.907 3.388 10.439 1.00 63.52 H new ATOM 0 HZ3 LYS A 74 41.383 3.840 9.841 1.00 63.52 H new ATOM 1056 N VAL A 75 38.675 -2.053 7.451 1.00 63.22 N ATOM 1057 CA VAL A 75 37.578 -2.640 6.691 1.00 13.40 C ATOM 1058 C VAL A 75 36.495 -1.606 6.402 1.00 44.42 C ATOM 1059 O VAL A 75 36.038 -0.900 7.302 1.00 72.33 O ATOM 1060 CB VAL A 75 36.949 -3.829 7.441 1.00 73.03 C ATOM 1061 CG1 VAL A 75 35.781 -4.401 6.651 1.00 11.43 C ATOM 1062 CG2 VAL A 75 37.994 -4.900 7.713 1.00 63.05 C ATOM 0 H VAL A 75 38.515 -2.011 8.458 1.00 63.22 H new ATOM 0 HA VAL A 75 37.999 -2.995 5.750 1.00 13.40 H new ATOM 0 HB VAL A 75 36.569 -3.472 8.399 1.00 73.03 H new ATOM 0 HG11 VAL A 75 35.349 -5.240 7.196 1.00 11.43 H new ATOM 0 HG12 VAL A 75 35.023 -3.630 6.512 1.00 11.43 H new ATOM 0 HG13 VAL A 75 36.133 -4.743 5.678 1.00 11.43 H new ATOM 0 HG21 VAL A 75 37.532 -5.733 8.244 1.00 63.05 H new ATOM 0 HG22 VAL A 75 38.405 -5.255 6.768 1.00 63.05 H new ATOM 0 HG23 VAL A 75 38.795 -4.481 8.322 1.00 63.05 H new ATOM 1072 N THR A 76 36.089 -1.520 5.139 1.00 75.10 N ATOM 1073 CA THR A 76 35.060 -0.572 4.730 1.00 42.11 C ATOM 1074 C THR A 76 33.930 -1.274 3.986 1.00 40.45 C ATOM 1075 O THR A 76 34.166 -1.992 3.015 1.00 73.13 O ATOM 1076 CB THR A 76 35.642 0.535 3.831 1.00 63.04 C ATOM 1077 OG1 THR A 76 36.571 -0.029 2.898 1.00 23.33 O ATOM 1078 CG2 THR A 76 36.337 1.600 4.665 1.00 43.41 C ATOM 0 H THR A 76 36.457 -2.096 4.382 1.00 75.10 H new ATOM 0 HA THR A 76 34.666 -0.121 5.641 1.00 42.11 H new ATOM 0 HB THR A 76 34.820 1.001 3.288 1.00 63.04 H new ATOM 0 HG1 THR A 76 36.199 -0.855 2.524 1.00 23.33 H new ATOM 0 HG21 THR A 76 36.740 2.371 4.008 1.00 43.41 H new ATOM 0 HG22 THR A 76 35.620 2.048 5.354 1.00 43.41 H new ATOM 0 HG23 THR A 76 37.149 1.145 5.232 1.00 43.41 H new ATOM 1086 N ALA A 77 32.702 -1.060 4.447 1.00 70.15 N ATOM 1087 CA ALA A 77 31.535 -1.670 3.822 1.00 32.41 C ATOM 1088 C ALA A 77 30.361 -0.698 3.785 1.00 35.25 C ATOM 1089 O ALA A 77 30.053 -0.044 4.782 1.00 51.34 O ATOM 1090 CB ALA A 77 31.146 -2.943 4.560 1.00 2.12 C ATOM 0 H ALA A 77 32.490 -0.469 5.251 1.00 70.15 H new ATOM 0 HA ALA A 77 31.795 -1.924 2.794 1.00 32.41 H new ATOM 0 HB1 ALA A 77 30.273 -3.388 4.083 1.00 2.12 H new ATOM 0 HB2 ALA A 77 31.976 -3.649 4.530 1.00 2.12 H new ATOM 0 HB3 ALA A 77 30.910 -2.705 5.597 1.00 2.12 H new ATOM 1096 N SER A 78 29.708 -0.608 2.631 1.00 64.43 N ATOM 1097 CA SER A 78 28.570 0.288 2.463 1.00 23.22 C ATOM 1098 C SER A 78 27.464 -0.384 1.656 1.00 34.54 C ATOM 1099 O SER A 78 27.729 -1.066 0.666 1.00 24.20 O ATOM 1100 CB SER A 78 29.009 1.580 1.771 1.00 70.41 C ATOM 1101 OG SER A 78 28.554 2.719 2.481 1.00 25.51 O ATOM 0 H SER A 78 29.948 -1.145 1.798 1.00 64.43 H new ATOM 0 HA SER A 78 28.179 0.528 3.452 1.00 23.22 H new ATOM 0 HB2 SER A 78 30.096 1.605 1.696 1.00 70.41 H new ATOM 0 HB3 SER A 78 28.619 1.602 0.754 1.00 70.41 H new ATOM 0 HG SER A 78 29.264 3.039 3.075 1.00 25.51 H new ATOM 1107 N ILE A 79 26.222 -0.187 2.088 1.00 65.22 N ATOM 1108 CA ILE A 79 25.075 -0.773 1.406 1.00 41.22 C ATOM 1109 C ILE A 79 23.927 0.226 1.305 1.00 60.32 C ATOM 1110 O ILE A 79 23.362 0.642 2.315 1.00 34.31 O ATOM 1111 CB ILE A 79 24.577 -2.039 2.127 1.00 23.14 C ATOM 1112 CG1 ILE A 79 23.312 -2.573 1.452 1.00 25.33 C ATOM 1113 CG2 ILE A 79 24.315 -1.743 3.597 1.00 64.04 C ATOM 1114 CD1 ILE A 79 22.889 -3.936 1.955 1.00 14.40 C ATOM 0 H ILE A 79 25.985 0.374 2.907 1.00 65.22 H new ATOM 0 HA ILE A 79 25.408 -1.043 0.404 1.00 41.22 H new ATOM 0 HB ILE A 79 25.351 -2.804 2.063 1.00 23.14 H new ATOM 0 HG12 ILE A 79 22.498 -1.866 1.613 1.00 25.33 H new ATOM 0 HG13 ILE A 79 23.479 -2.627 0.376 1.00 25.33 H new ATOM 0 HG21 ILE A 79 23.964 -2.648 4.093 1.00 64.04 H new ATOM 0 HG22 ILE A 79 25.237 -1.405 4.070 1.00 64.04 H new ATOM 0 HG23 ILE A 79 23.557 -0.965 3.682 1.00 64.04 H new ATOM 0 HD11 ILE A 79 21.986 -4.252 1.433 1.00 14.40 H new ATOM 0 HD12 ILE A 79 23.686 -4.656 1.769 1.00 14.40 H new ATOM 0 HD13 ILE A 79 22.690 -3.883 3.025 1.00 14.40 H new ATOM 1126 N GLY A 80 23.586 0.605 0.077 1.00 42.41 N ATOM 1127 CA GLY A 80 22.506 1.551 -0.134 1.00 73.00 C ATOM 1128 C GLY A 80 22.699 2.836 0.646 1.00 45.32 C ATOM 1129 O GLY A 80 23.465 3.709 0.238 1.00 22.51 O ATOM 0 H GLY A 80 24.038 0.274 -0.775 1.00 42.41 H new ATOM 0 HA2 GLY A 80 22.433 1.782 -1.197 1.00 73.00 H new ATOM 0 HA3 GLY A 80 21.562 1.091 0.158 1.00 73.00 H new ATOM 1133 N GLY A 81 22.002 2.955 1.772 1.00 73.25 N ATOM 1134 CA GLY A 81 22.113 4.147 2.591 1.00 4.04 C ATOM 1135 C GLY A 81 22.960 3.923 3.828 1.00 23.24 C ATOM 1136 O GLY A 81 23.782 4.767 4.187 1.00 22.42 O ATOM 0 H GLY A 81 21.362 2.246 2.131 1.00 73.25 H new ATOM 0 HA2 GLY A 81 22.547 4.952 1.998 1.00 4.04 H new ATOM 0 HA3 GLY A 81 21.117 4.473 2.890 1.00 4.04 H new ATOM 1140 N ILE A 82 22.759 2.784 4.483 1.00 61.02 N ATOM 1141 CA ILE A 82 23.511 2.452 5.687 1.00 54.41 C ATOM 1142 C ILE A 82 24.865 1.843 5.340 1.00 52.55 C ATOM 1143 O ILE A 82 25.042 1.274 4.263 1.00 33.32 O ATOM 1144 CB ILE A 82 22.733 1.470 6.583 1.00 43.20 C ATOM 1145 CG1 ILE A 82 21.273 1.908 6.710 1.00 11.44 C ATOM 1146 CG2 ILE A 82 23.385 1.375 7.954 1.00 0.14 C ATOM 1147 CD1 ILE A 82 21.107 3.305 7.268 1.00 65.14 C ATOM 0 H ILE A 82 22.082 2.076 4.200 1.00 61.02 H new ATOM 0 HA ILE A 82 23.664 3.384 6.231 1.00 54.41 H new ATOM 0 HB ILE A 82 22.757 0.483 6.122 1.00 43.20 H new ATOM 0 HG12 ILE A 82 20.801 1.859 5.729 1.00 11.44 H new ATOM 0 HG13 ILE A 82 20.745 1.204 7.353 1.00 11.44 H new ATOM 0 HG21 ILE A 82 22.824 0.677 8.576 1.00 0.14 H new ATOM 0 HG22 ILE A 82 24.410 1.021 7.846 1.00 0.14 H new ATOM 0 HG23 ILE A 82 23.388 2.358 8.424 1.00 0.14 H new ATOM 0 HD11 ILE A 82 20.046 3.548 7.330 1.00 65.14 H new ATOM 0 HD12 ILE A 82 21.549 3.354 8.263 1.00 65.14 H new ATOM 0 HD13 ILE A 82 21.606 4.020 6.613 1.00 65.14 H new ATOM 1159 N GLN A 83 25.816 1.967 6.259 1.00 24.12 N ATOM 1160 CA GLN A 83 27.155 1.427 6.050 1.00 13.31 C ATOM 1161 C GLN A 83 27.802 1.048 7.378 1.00 62.22 C ATOM 1162 O GLN A 83 27.367 1.489 8.441 1.00 71.44 O ATOM 1163 CB GLN A 83 28.029 2.445 5.315 1.00 12.13 C ATOM 1164 CG GLN A 83 28.499 3.592 6.196 1.00 72.41 C ATOM 1165 CD GLN A 83 29.260 4.649 5.421 1.00 61.34 C ATOM 1166 OE1 GLN A 83 29.961 4.343 4.455 1.00 14.02 O ATOM 1167 NE2 GLN A 83 29.127 5.902 5.840 1.00 74.42 N ATOM 0 H GLN A 83 25.685 2.436 7.155 1.00 24.12 H new ATOM 0 HA GLN A 83 27.066 0.528 5.440 1.00 13.31 H new ATOM 0 HB2 GLN A 83 28.899 1.934 4.903 1.00 12.13 H new ATOM 0 HB3 GLN A 83 27.469 2.851 4.472 1.00 12.13 H new ATOM 0 HG2 GLN A 83 27.636 4.051 6.679 1.00 72.41 H new ATOM 0 HG3 GLN A 83 29.136 3.199 6.988 1.00 72.41 H new ATOM 0 HE21 GLN A 83 28.536 6.111 6.645 1.00 74.42 H new ATOM 0 HE22 GLN A 83 29.616 6.656 5.357 1.00 74.42 H new ATOM 1176 N GLY A 84 28.845 0.226 7.309 1.00 45.34 N ATOM 1177 CA GLY A 84 29.536 -0.199 8.512 1.00 32.11 C ATOM 1178 C GLY A 84 31.013 -0.445 8.277 1.00 0.42 C ATOM 1179 O GLY A 84 31.412 -0.890 7.201 1.00 33.12 O ATOM 0 H GLY A 84 29.224 -0.153 6.441 1.00 45.34 H new ATOM 0 HA2 GLY A 84 29.416 0.561 9.284 1.00 32.11 H new ATOM 0 HA3 GLY A 84 29.074 -1.112 8.889 1.00 32.11 H new ATOM 1183 N SER A 85 31.828 -0.152 9.286 1.00 53.12 N ATOM 1184 CA SER A 85 33.270 -0.338 9.182 1.00 22.41 C ATOM 1185 C SER A 85 33.860 -0.767 10.522 1.00 24.11 C ATOM 1186 O SER A 85 33.275 -0.526 11.578 1.00 12.32 O ATOM 1187 CB SER A 85 33.940 0.953 8.707 1.00 73.43 C ATOM 1188 OG SER A 85 33.476 1.324 7.420 1.00 20.41 O ATOM 0 H SER A 85 31.514 0.215 10.184 1.00 53.12 H new ATOM 0 HA SER A 85 33.458 -1.126 8.452 1.00 22.41 H new ATOM 0 HB2 SER A 85 33.735 1.755 9.416 1.00 73.43 H new ATOM 0 HB3 SER A 85 35.021 0.818 8.682 1.00 73.43 H new ATOM 0 HG SER A 85 33.918 2.153 7.139 1.00 20.41 H new ATOM 1194 N THR A 86 35.025 -1.406 10.471 1.00 4.44 N ATOM 1195 CA THR A 86 35.696 -1.870 11.679 1.00 13.34 C ATOM 1196 C THR A 86 37.202 -1.656 11.589 1.00 3.20 C ATOM 1197 O THR A 86 37.769 -1.619 10.497 1.00 62.52 O ATOM 1198 CB THR A 86 35.415 -3.362 11.940 1.00 42.25 C ATOM 1199 OG1 THR A 86 36.319 -3.865 12.930 1.00 51.21 O ATOM 1200 CG2 THR A 86 35.557 -4.170 10.659 1.00 61.42 C ATOM 0 H THR A 86 35.523 -1.614 9.606 1.00 4.44 H new ATOM 0 HA THR A 86 35.298 -1.283 12.507 1.00 13.34 H new ATOM 0 HB THR A 86 34.391 -3.459 12.301 1.00 42.25 H new ATOM 0 HG1 THR A 86 35.916 -3.772 13.818 1.00 51.21 H new ATOM 0 HG21 THR A 86 35.354 -5.221 10.867 1.00 61.42 H new ATOM 0 HG22 THR A 86 34.848 -3.803 9.917 1.00 61.42 H new ATOM 0 HG23 THR A 86 36.571 -4.066 10.274 1.00 61.42 H new ATOM 1208 N ASP A 87 37.845 -1.515 12.743 1.00 64.41 N ATOM 1209 CA ASP A 87 39.288 -1.307 12.794 1.00 52.12 C ATOM 1210 C ASP A 87 40.011 -2.598 13.165 1.00 13.35 C ATOM 1211 O ASP A 87 39.699 -3.227 14.176 1.00 34.44 O ATOM 1212 CB ASP A 87 39.630 -0.208 13.801 1.00 44.23 C ATOM 1213 CG ASP A 87 41.089 -0.235 14.214 1.00 72.22 C ATOM 1214 OD1 ASP A 87 41.949 -0.474 13.340 1.00 30.32 O ATOM 1215 OD2 ASP A 87 41.370 -0.017 15.411 1.00 42.35 O ATOM 0 H ASP A 87 37.390 -1.541 13.656 1.00 64.41 H new ATOM 0 HA ASP A 87 39.621 -0.998 11.803 1.00 52.12 H new ATOM 0 HB2 ASP A 87 39.396 0.764 13.367 1.00 44.23 H new ATOM 0 HB3 ASP A 87 39.003 -0.321 14.685 1.00 44.23 H new ATOM 1220 N PHE A 88 40.978 -2.987 12.341 1.00 54.10 N ATOM 1221 CA PHE A 88 41.744 -4.204 12.582 1.00 73.13 C ATOM 1222 C PHE A 88 43.242 -3.914 12.576 1.00 52.05 C ATOM 1223 O PHE A 88 43.810 -3.544 11.548 1.00 2.31 O ATOM 1224 CB PHE A 88 41.413 -5.258 11.523 1.00 34.23 C ATOM 1225 CG PHE A 88 40.220 -6.103 11.871 1.00 42.21 C ATOM 1226 CD1 PHE A 88 38.940 -5.578 11.804 1.00 74.25 C ATOM 1227 CD2 PHE A 88 40.380 -7.421 12.266 1.00 60.43 C ATOM 1228 CE1 PHE A 88 37.840 -6.353 12.122 1.00 1.24 C ATOM 1229 CE2 PHE A 88 39.284 -8.201 12.585 1.00 4.23 C ATOM 1230 CZ PHE A 88 38.013 -7.666 12.515 1.00 40.42 C ATOM 0 H PHE A 88 41.250 -2.477 11.500 1.00 54.10 H new ATOM 0 HA PHE A 88 41.470 -4.587 13.565 1.00 73.13 H new ATOM 0 HB2 PHE A 88 41.230 -4.760 10.571 1.00 34.23 H new ATOM 0 HB3 PHE A 88 42.279 -5.905 11.383 1.00 34.23 H new ATOM 0 HD1 PHE A 88 38.800 -4.551 11.500 1.00 74.25 H new ATOM 0 HD2 PHE A 88 41.372 -7.844 12.325 1.00 60.43 H new ATOM 0 HE1 PHE A 88 36.847 -5.932 12.063 1.00 1.24 H new ATOM 0 HE2 PHE A 88 39.422 -9.228 12.889 1.00 4.23 H new ATOM 0 HZ PHE A 88 37.156 -8.273 12.767 1.00 40.42 H new ATOM 1240 N LYS A 89 43.876 -4.084 13.731 1.00 60.24 N ATOM 1241 CA LYS A 89 45.308 -3.842 13.861 1.00 71.13 C ATOM 1242 C LYS A 89 46.066 -5.152 14.055 1.00 13.52 C ATOM 1243 O LYS A 89 45.962 -5.791 15.102 1.00 10.11 O ATOM 1244 CB LYS A 89 45.582 -2.902 15.037 1.00 63.21 C ATOM 1245 CG LYS A 89 45.550 -1.431 14.660 1.00 25.12 C ATOM 1246 CD LYS A 89 46.658 -0.654 15.352 1.00 60.20 C ATOM 1247 CE LYS A 89 46.142 0.077 16.581 1.00 14.34 C ATOM 1248 NZ LYS A 89 45.535 1.391 16.231 1.00 54.21 N ATOM 0 H LYS A 89 43.420 -4.389 14.591 1.00 60.24 H new ATOM 0 HA LYS A 89 45.657 -3.374 12.941 1.00 71.13 H new ATOM 0 HB2 LYS A 89 44.843 -3.085 15.817 1.00 63.21 H new ATOM 0 HB3 LYS A 89 46.558 -3.139 15.461 1.00 63.21 H new ATOM 0 HG2 LYS A 89 45.653 -1.329 13.580 1.00 25.12 H new ATOM 0 HG3 LYS A 89 44.583 -1.006 14.930 1.00 25.12 H new ATOM 0 HD2 LYS A 89 47.456 -1.337 15.642 1.00 60.20 H new ATOM 0 HD3 LYS A 89 47.090 0.064 14.655 1.00 60.20 H new ATOM 0 HE2 LYS A 89 45.401 -0.542 17.087 1.00 14.34 H new ATOM 0 HE3 LYS A 89 46.962 0.231 17.283 1.00 14.34 H new ATOM 0 HZ1 LYS A 89 45.195 1.858 17.096 1.00 54.21 H new ATOM 0 HZ2 LYS A 89 46.249 1.991 15.771 1.00 54.21 H new ATOM 0 HZ3 LYS A 89 44.736 1.243 15.581 1.00 54.21 H new ATOM 1262 N VAL A 90 46.829 -5.545 13.040 1.00 1.34 N ATOM 1263 CA VAL A 90 47.607 -6.777 13.101 1.00 14.41 C ATOM 1264 C VAL A 90 49.060 -6.492 13.461 1.00 3.23 C ATOM 1265 O VAL A 90 49.830 -5.993 12.639 1.00 33.11 O ATOM 1266 CB VAL A 90 47.560 -7.536 11.762 1.00 62.01 C ATOM 1267 CG1 VAL A 90 48.411 -8.795 11.832 1.00 44.30 C ATOM 1268 CG2 VAL A 90 46.124 -7.874 11.391 1.00 41.42 C ATOM 0 H VAL A 90 46.925 -5.028 12.166 1.00 1.34 H new ATOM 0 HA VAL A 90 47.159 -7.397 13.878 1.00 14.41 H new ATOM 0 HB VAL A 90 47.970 -6.891 10.984 1.00 62.01 H new ATOM 0 HG11 VAL A 90 48.366 -9.318 10.877 1.00 44.30 H new ATOM 0 HG12 VAL A 90 49.444 -8.524 12.049 1.00 44.30 H new ATOM 0 HG13 VAL A 90 48.034 -9.446 12.621 1.00 44.30 H new ATOM 0 HG21 VAL A 90 46.110 -8.410 10.442 1.00 41.42 H new ATOM 0 HG22 VAL A 90 45.685 -8.500 12.168 1.00 41.42 H new ATOM 0 HG23 VAL A 90 45.546 -6.954 11.297 1.00 41.42 H new ATOM 1278 N THR A 91 49.432 -6.812 14.697 1.00 70.41 N ATOM 1279 CA THR A 91 50.793 -6.591 15.167 1.00 5.32 C ATOM 1280 C THR A 91 51.439 -7.896 15.617 1.00 63.32 C ATOM 1281 O THR A 91 50.762 -8.793 16.118 1.00 70.31 O ATOM 1282 CB THR A 91 50.828 -5.586 16.334 1.00 1.30 C ATOM 1283 OG1 THR A 91 49.688 -5.777 17.179 1.00 0.41 O ATOM 1284 CG2 THR A 91 50.848 -4.156 15.816 1.00 52.51 C ATOM 0 H THR A 91 48.809 -7.225 15.390 1.00 70.41 H new ATOM 0 HA THR A 91 51.354 -6.182 14.327 1.00 5.32 H new ATOM 0 HB THR A 91 51.738 -5.760 16.908 1.00 1.30 H new ATOM 0 HG1 THR A 91 49.718 -5.136 17.919 1.00 0.41 H new ATOM 0 HG21 THR A 91 50.873 -3.464 16.658 1.00 52.51 H new ATOM 0 HG22 THR A 91 51.732 -4.006 15.197 1.00 52.51 H new ATOM 0 HG23 THR A 91 49.953 -3.972 15.221 1.00 52.51 H new ATOM 1292 N GLN A 92 52.752 -7.995 15.435 1.00 61.13 N ATOM 1293 CA GLN A 92 53.489 -9.192 15.822 1.00 34.42 C ATOM 1294 C GLN A 92 53.264 -9.516 17.296 1.00 64.34 C ATOM 1295 O GLN A 92 52.603 -10.499 17.632 1.00 23.35 O ATOM 1296 CB GLN A 92 54.983 -9.008 15.550 1.00 75.31 C ATOM 1297 CG GLN A 92 55.641 -7.972 16.446 1.00 1.10 C ATOM 1298 CD GLN A 92 57.151 -7.959 16.311 1.00 0.13 C ATOM 1299 OE1 GLN A 92 57.694 -7.446 15.332 1.00 21.42 O ATOM 1300 NE2 GLN A 92 57.839 -8.524 17.297 1.00 75.01 N ATOM 0 H GLN A 92 53.327 -7.261 15.022 1.00 61.13 H new ATOM 0 HA GLN A 92 53.119 -10.025 15.224 1.00 34.42 H new ATOM 0 HB2 GLN A 92 55.488 -9.965 15.683 1.00 75.31 H new ATOM 0 HB3 GLN A 92 55.121 -8.716 14.509 1.00 75.31 H new ATOM 0 HG2 GLN A 92 55.250 -6.985 16.202 1.00 1.10 H new ATOM 0 HG3 GLN A 92 55.374 -8.173 17.484 1.00 1.10 H new ATOM 0 HE21 GLN A 92 57.348 -8.937 18.090 1.00 75.01 H new ATOM 0 HE22 GLN A 92 58.858 -8.544 17.261 1.00 75.01 H new TER 1309 GLN A 92