USER MOD reduce.3.24.130724 H: found=0, std=0, add=978, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 972 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 33 ASN : amide:sc= 0 X(o=-0.062,f=-0.062) USER MOD Set 1.2: B 31 GLN : amide:sc= -0.0623 X(o=-0.062,f=0) USER MOD Set 2.1: A 31 GLN : amide:sc= -0.0341 X(o=-0.034,f=0) USER MOD Set 2.2: B 33 ASN : amide:sc= 0 X(o=-0.034,f=-0.04) USER MOD Single : A 1 MET CE :methyl 145:sc= -2.87 (180deg=-5.08!) USER MOD Single : A 1 MET N :NH3+ -157:sc= -0.0103 (180deg=-0.279) USER MOD Single : A 3 MET CE :methyl -136:sc= -1.66 (180deg=-3.94!) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.217 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -1.02 K(o=-1,f=-5.1!) USER MOD Single : A 14 GLN :FLIP amide:sc= 0.507 F(o=-0.14,f=0.51) USER MOD Single : A 19 TYR OH : rot -59:sc= 1.14 USER MOD Single : A 20 MET CE :methyl -153:sc= -4.29 (180deg=-5.78!) USER MOD Single : A 22 THR OG1 : rot -20:sc= 0.396 USER MOD Single : A 23 GLN : amide:sc= -0.554 K(o=-0.55,f=-5.1!) USER MOD Single : A 28 THR OG1 : rot 74:sc= 0.137 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 HIS : no HD1:sc= -1.05 X(o=-1.1,f=-1.4) USER MOD Single : A 34 GLN : amide:sc= -0.132 X(o=-0.13,f=-0.57) USER MOD Single : A 35 SER OG : rot 2:sc= 1.14 USER MOD Single : A 43 SER OG : rot 180:sc= 0.0444 USER MOD Single : A 44 GLN : amide:sc= -0.325 X(o=-0.33,f=-0.42) USER MOD Single : A 58 ASN : amide:sc= -0.173 K(o=-0.17,f=-1.8!) USER MOD Single : B 1 MET CE :methyl 145:sc= -2.8 (180deg=-4.88!) USER MOD Single : B 1 MET N :NH3+ -156:sc= -0.0162 (180deg=-0.28) USER MOD Single : B 3 MET CE :methyl -122:sc= -2.1 (180deg=-4.86!) USER MOD Single : B 5 THR OG1 : rot -111:sc= 0.164 USER MOD Single : B 6 SER OG : rot 180:sc= 0 USER MOD Single : B 9 ASN : amide:sc= -0.738 K(o=-0.74,f=-4.5!) USER MOD Single : B 14 GLN : amide:sc= -0.183 X(o=-0.18,f=0.18) USER MOD Single : B 19 TYR OH : rot -58:sc= 1.16 USER MOD Single : B 20 MET CE :methyl -156:sc= -2.97 (180deg=-4.3!) USER MOD Single : B 22 THR OG1 : rot -18:sc= 0.408 USER MOD Single : B 23 GLN : amide:sc= -0.563 K(o=-0.56,f=-4.1!) USER MOD Single : B 28 THR OG1 : rot 71:sc= 0.462 USER MOD Single : B 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 32 HIS : no HD1:sc= -0.829 K(o=-0.83,f=-1.3) USER MOD Single : B 34 GLN : amide:sc= -0.171 X(o=-0.17,f=-0.58) USER MOD Single : B 35 SER OG : rot -2:sc= 1.08 USER MOD Single : B 43 SER OG : rot 180:sc= 0.0612 USER MOD Single : B 44 GLN : amide:sc= -0.301 X(o=-0.3,f=-0.33) USER MOD Single : B 58 ASN : amide:sc= -0.488 K(o=-0.49,f=-1.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.284 -11.071 -4.220 1.00 0.00 N ATOM 2 CA MET A 1 -1.554 -10.226 -5.158 1.00 0.00 C ATOM 3 C MET A 1 -1.676 -10.763 -6.581 1.00 0.00 C ATOM 4 O MET A 1 -1.311 -11.906 -6.857 1.00 0.00 O ATOM 5 CB MET A 1 -0.080 -10.137 -4.758 1.00 0.00 C ATOM 6 CG MET A 1 0.138 -9.576 -3.363 1.00 0.00 C ATOM 7 SD MET A 1 1.265 -8.168 -3.349 1.00 0.00 S ATOM 8 CE MET A 1 0.370 -7.007 -4.378 1.00 0.00 C ATOM 0 H1 MET A 1 -2.523 -10.521 -3.370 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.158 -11.413 -4.668 1.00 0.00 H new ATOM 0 H3 MET A 1 -1.692 -11.883 -3.951 1.00 0.00 H new ATOM 0 HA MET A 1 -1.992 -9.228 -5.126 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.364 -11.131 -4.814 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.446 -9.511 -5.479 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.821 -9.273 -2.944 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.534 -10.360 -2.718 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.533 -5.994 -4.010 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.727 -7.081 -5.405 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.695 -7.238 -4.346 1.00 0.00 H new ATOM 18 N LEU A 2 -2.192 -9.931 -7.480 1.00 0.00 N ATOM 19 CA LEU A 2 -2.362 -10.323 -8.875 1.00 0.00 C ATOM 20 C LEU A 2 -1.573 -9.400 -9.799 1.00 0.00 C ATOM 21 O LEU A 2 -1.804 -8.192 -9.831 1.00 0.00 O ATOM 22 CB LEU A 2 -3.843 -10.299 -9.255 1.00 0.00 C ATOM 23 CG LEU A 2 -4.301 -11.377 -10.238 1.00 0.00 C ATOM 24 CD1 LEU A 2 -5.760 -11.170 -10.615 1.00 0.00 C ATOM 25 CD2 LEU A 2 -3.422 -11.374 -11.480 1.00 0.00 C ATOM 0 H LEU A 2 -2.499 -8.982 -7.268 1.00 0.00 H new ATOM 0 HA LEU A 2 -1.980 -11.337 -8.991 1.00 0.00 H new ATOM 0 HB2 LEU A 2 -4.433 -10.393 -8.343 1.00 0.00 H new ATOM 0 HB3 LEU A 2 -4.072 -9.323 -9.684 1.00 0.00 H new ATOM 0 HG LEU A 2 -4.207 -12.348 -9.753 1.00 0.00 H new ATOM 0 HD11 LEU A 2 -6.069 -11.946 -11.315 1.00 0.00 H new ATOM 0 HD12 LEU A 2 -6.378 -11.223 -9.719 1.00 0.00 H new ATOM 0 HD13 LEU A 2 -5.880 -10.192 -11.081 1.00 0.00 H new ATOM 0 HD21 LEU A 2 -3.762 -12.147 -12.169 1.00 0.00 H new ATOM 0 HD22 LEU A 2 -3.484 -10.401 -11.968 1.00 0.00 H new ATOM 0 HD23 LEU A 2 -2.389 -11.571 -11.195 1.00 0.00 H new ATOM 37 N MET A 3 -0.643 -9.979 -10.551 1.00 0.00 N ATOM 38 CA MET A 3 0.177 -9.209 -11.479 1.00 0.00 C ATOM 39 C MET A 3 -0.694 -8.464 -12.486 1.00 0.00 C ATOM 40 O MET A 3 -1.475 -9.076 -13.216 1.00 0.00 O ATOM 41 CB MET A 3 1.154 -10.129 -12.215 1.00 0.00 C ATOM 42 CG MET A 3 2.525 -9.510 -12.433 1.00 0.00 C ATOM 43 SD MET A 3 3.425 -10.278 -13.793 1.00 0.00 S ATOM 44 CE MET A 3 3.890 -8.835 -14.748 1.00 0.00 C ATOM 0 H MET A 3 -0.438 -10.978 -10.536 1.00 0.00 H new ATOM 0 HA MET A 3 0.742 -8.477 -10.903 1.00 0.00 H new ATOM 0 HB2 MET A 3 1.268 -11.053 -11.648 1.00 0.00 H new ATOM 0 HB3 MET A 3 0.728 -10.399 -13.182 1.00 0.00 H new ATOM 0 HG2 MET A 3 2.411 -8.445 -12.634 1.00 0.00 H new ATOM 0 HG3 MET A 3 3.110 -9.601 -11.518 1.00 0.00 H new ATOM 0 HE1 MET A 3 3.717 -9.028 -15.807 1.00 0.00 H new ATOM 0 HE2 MET A 3 3.291 -7.981 -14.432 1.00 0.00 H new ATOM 0 HE3 MET A 3 4.946 -8.617 -14.587 1.00 0.00 H new ATOM 54 N ILE A 4 -0.556 -7.143 -12.518 1.00 0.00 N ATOM 55 CA ILE A 4 -1.330 -6.317 -13.436 1.00 0.00 C ATOM 56 C ILE A 4 -0.706 -6.308 -14.827 1.00 0.00 C ATOM 57 O ILE A 4 -1.384 -6.551 -15.826 1.00 0.00 O ATOM 58 CB ILE A 4 -1.446 -4.868 -12.927 1.00 0.00 C ATOM 59 CG1 ILE A 4 -2.239 -4.825 -11.620 1.00 0.00 C ATOM 60 CG2 ILE A 4 -2.102 -3.988 -13.981 1.00 0.00 C ATOM 61 CD1 ILE A 4 -3.558 -5.563 -11.689 1.00 0.00 C ATOM 0 H ILE A 4 0.084 -6.622 -11.919 1.00 0.00 H new ATOM 0 HA ILE A 4 -2.327 -6.755 -13.491 1.00 0.00 H new ATOM 0 HB ILE A 4 -0.444 -4.485 -12.734 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -1.633 -5.255 -10.822 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -2.427 -3.785 -11.353 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -2.177 -2.967 -13.607 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -1.500 -3.998 -14.890 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -3.099 -4.368 -14.202 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -4.066 -5.491 -10.727 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -4.183 -5.119 -12.464 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.376 -6.611 -11.925 1.00 0.00 H new ATOM 73 N THR A 5 0.592 -6.026 -14.886 1.00 0.00 N ATOM 74 CA THR A 5 1.309 -5.985 -16.154 1.00 0.00 C ATOM 75 C THR A 5 2.798 -5.748 -15.936 1.00 0.00 C ATOM 76 O THR A 5 3.275 -5.735 -14.801 1.00 0.00 O ATOM 77 CB THR A 5 0.754 -4.884 -17.077 1.00 0.00 C ATOM 78 OG1 THR A 5 1.230 -5.080 -18.414 1.00 0.00 O ATOM 79 CG2 THR A 5 1.168 -3.506 -16.584 1.00 0.00 C ATOM 0 H THR A 5 1.168 -5.823 -14.069 1.00 0.00 H new ATOM 0 HA THR A 5 1.165 -6.955 -16.631 1.00 0.00 H new ATOM 0 HB THR A 5 -0.334 -4.945 -17.066 1.00 0.00 H new ATOM 0 HG1 THR A 5 0.871 -4.377 -18.995 1.00 0.00 H new ATOM 0 HG21 THR A 5 0.765 -2.744 -17.251 1.00 0.00 H new ATOM 0 HG22 THR A 5 0.781 -3.348 -15.577 1.00 0.00 H new ATOM 0 HG23 THR A 5 2.256 -3.436 -16.569 1.00 0.00 H new ATOM 87 N SER A 6 3.529 -5.560 -17.030 1.00 0.00 N ATOM 88 CA SER A 6 4.967 -5.326 -16.959 1.00 0.00 C ATOM 89 C SER A 6 5.377 -4.179 -17.878 1.00 0.00 C ATOM 90 O SER A 6 4.722 -3.911 -18.886 1.00 0.00 O ATOM 91 CB SER A 6 5.731 -6.596 -17.336 1.00 0.00 C ATOM 92 OG SER A 6 5.979 -6.647 -18.731 1.00 0.00 O ATOM 0 H SER A 6 3.149 -5.565 -17.977 1.00 0.00 H new ATOM 0 HA SER A 6 5.216 -5.053 -15.934 1.00 0.00 H new ATOM 0 HB2 SER A 6 6.676 -6.630 -16.794 1.00 0.00 H new ATOM 0 HB3 SER A 6 5.158 -7.472 -17.033 1.00 0.00 H new ATOM 0 HG SER A 6 6.470 -7.467 -18.946 1.00 0.00 H new ATOM 98 N PHE A 7 6.466 -3.506 -17.524 1.00 0.00 N ATOM 99 CA PHE A 7 6.965 -2.387 -18.315 1.00 0.00 C ATOM 100 C PHE A 7 8.480 -2.466 -18.475 1.00 0.00 C ATOM 101 O PHE A 7 9.150 -3.220 -17.769 1.00 0.00 O ATOM 102 CB PHE A 7 6.578 -1.059 -17.661 1.00 0.00 C ATOM 103 CG PHE A 7 5.114 -0.742 -17.769 1.00 0.00 C ATOM 104 CD1 PHE A 7 4.613 -0.090 -18.884 1.00 0.00 C ATOM 105 CD2 PHE A 7 4.238 -1.094 -16.754 1.00 0.00 C ATOM 106 CE1 PHE A 7 3.266 0.203 -18.987 1.00 0.00 C ATOM 107 CE2 PHE A 7 2.891 -0.804 -16.851 1.00 0.00 C ATOM 108 CZ PHE A 7 2.404 -0.153 -17.968 1.00 0.00 C ATOM 0 H PHE A 7 7.021 -3.716 -16.694 1.00 0.00 H new ATOM 0 HA PHE A 7 6.510 -2.443 -19.304 1.00 0.00 H new ATOM 0 HB2 PHE A 7 6.859 -1.086 -16.608 1.00 0.00 H new ATOM 0 HB3 PHE A 7 7.151 -0.255 -18.123 1.00 0.00 H new ATOM 0 HD1 PHE A 7 5.283 0.193 -19.682 1.00 0.00 H new ATOM 0 HD2 PHE A 7 4.613 -1.601 -15.877 1.00 0.00 H new ATOM 0 HE1 PHE A 7 2.888 0.709 -19.863 1.00 0.00 H new ATOM 0 HE2 PHE A 7 2.219 -1.086 -16.054 1.00 0.00 H new ATOM 0 HZ PHE A 7 1.352 0.077 -18.044 1.00 0.00 H new ATOM 118 N ALA A 8 9.013 -1.683 -19.407 1.00 0.00 N ATOM 119 CA ALA A 8 10.448 -1.663 -19.659 1.00 0.00 C ATOM 120 C ALA A 8 11.028 -0.272 -19.421 1.00 0.00 C ATOM 121 O ALA A 8 12.057 0.087 -19.990 1.00 0.00 O ATOM 122 CB ALA A 8 10.742 -2.124 -21.079 1.00 0.00 C ATOM 0 H ALA A 8 8.472 -1.054 -20.000 1.00 0.00 H new ATOM 0 HA ALA A 8 10.924 -2.351 -18.960 1.00 0.00 H new ATOM 0 HB1 ALA A 8 11.818 -2.104 -21.253 1.00 0.00 H new ATOM 0 HB2 ALA A 8 10.371 -3.140 -21.216 1.00 0.00 H new ATOM 0 HB3 ALA A 8 10.248 -1.459 -21.787 1.00 0.00 H new ATOM 128 N ASN A 9 10.358 0.507 -18.578 1.00 0.00 N ATOM 129 CA ASN A 9 10.806 1.859 -18.267 1.00 0.00 C ATOM 130 C ASN A 9 10.294 2.301 -16.899 1.00 0.00 C ATOM 131 O ASN A 9 9.162 2.015 -16.511 1.00 0.00 O ATOM 132 CB ASN A 9 10.330 2.837 -19.342 1.00 0.00 C ATOM 133 CG ASN A 9 11.460 3.312 -20.235 1.00 0.00 C ATOM 134 OD1 ASN A 9 12.608 3.409 -19.801 1.00 0.00 O ATOM 135 ND2 ASN A 9 11.139 3.609 -21.488 1.00 0.00 N ATOM 0 H ASN A 9 9.503 0.225 -18.098 1.00 0.00 H new ATOM 0 HA ASN A 9 11.896 1.857 -18.244 1.00 0.00 H new ATOM 0 HB2 ASN A 9 9.566 2.357 -19.953 1.00 0.00 H new ATOM 0 HB3 ASN A 9 9.862 3.698 -18.864 1.00 0.00 H new ATOM 0 HD21 ASN A 9 11.858 3.933 -22.135 1.00 0.00 H new ATOM 0 HD22 ASN A 9 10.174 3.513 -21.804 1.00 0.00 H new ATOM 142 N PRO A 10 11.147 3.016 -16.151 1.00 0.00 N ATOM 143 CA PRO A 10 10.803 3.514 -14.815 1.00 0.00 C ATOM 144 C PRO A 10 9.760 4.624 -14.862 1.00 0.00 C ATOM 145 O PRO A 10 8.768 4.588 -14.133 1.00 0.00 O ATOM 146 CB PRO A 10 12.134 4.052 -14.284 1.00 0.00 C ATOM 147 CG PRO A 10 12.919 4.394 -15.503 1.00 0.00 C ATOM 148 CD PRO A 10 12.513 3.394 -16.550 1.00 0.00 C ATOM 0 HA PRO A 10 10.362 2.737 -14.191 1.00 0.00 H new ATOM 0 HB2 PRO A 10 11.983 4.927 -13.652 1.00 0.00 H new ATOM 0 HB3 PRO A 10 12.649 3.306 -13.678 1.00 0.00 H new ATOM 0 HG2 PRO A 10 12.706 5.411 -15.832 1.00 0.00 H new ATOM 0 HG3 PRO A 10 13.990 4.340 -15.306 1.00 0.00 H new ATOM 0 HD2 PRO A 10 12.534 3.828 -17.550 1.00 0.00 H new ATOM 0 HD3 PRO A 10 13.181 2.532 -16.563 1.00 0.00 H new ATOM 156 N ARG A 11 9.989 5.610 -15.723 1.00 0.00 N ATOM 157 CA ARG A 11 9.069 6.732 -15.864 1.00 0.00 C ATOM 158 C ARG A 11 7.641 6.239 -16.083 1.00 0.00 C ATOM 159 O ARG A 11 6.701 6.733 -15.461 1.00 0.00 O ATOM 160 CB ARG A 11 9.495 7.626 -17.029 1.00 0.00 C ATOM 161 CG ARG A 11 9.655 6.879 -18.343 1.00 0.00 C ATOM 162 CD ARG A 11 10.568 7.628 -19.302 1.00 0.00 C ATOM 163 NE ARG A 11 11.881 7.889 -18.717 1.00 0.00 N ATOM 164 CZ ARG A 11 12.866 8.500 -19.365 1.00 0.00 C ATOM 165 NH1 ARG A 11 12.688 8.911 -20.613 1.00 0.00 N ATOM 166 NH2 ARG A 11 14.032 8.701 -18.766 1.00 0.00 N ATOM 0 H ARG A 11 10.805 5.655 -16.334 1.00 0.00 H new ATOM 0 HA ARG A 11 9.098 7.312 -14.941 1.00 0.00 H new ATOM 0 HB2 ARG A 11 8.756 8.417 -17.158 1.00 0.00 H new ATOM 0 HB3 ARG A 11 10.439 8.110 -16.778 1.00 0.00 H new ATOM 0 HG2 ARG A 11 10.063 5.886 -18.151 1.00 0.00 H new ATOM 0 HG3 ARG A 11 8.677 6.739 -18.804 1.00 0.00 H new ATOM 0 HD2 ARG A 11 10.688 7.047 -20.217 1.00 0.00 H new ATOM 0 HD3 ARG A 11 10.102 8.573 -19.583 1.00 0.00 H new ATOM 0 HE ARG A 11 12.050 7.585 -17.758 1.00 0.00 H new ATOM 0 HH11 ARG A 11 11.793 8.758 -21.078 1.00 0.00 H new ATOM 0 HH12 ARG A 11 13.446 9.380 -21.108 1.00 0.00 H new ATOM 0 HH21 ARG A 11 14.173 8.386 -17.806 1.00 0.00 H new ATOM 0 HH22 ARG A 11 14.788 9.170 -19.265 1.00 0.00 H new ATOM 180 N VAL A 12 7.487 5.263 -16.971 1.00 0.00 N ATOM 181 CA VAL A 12 6.175 4.703 -17.272 1.00 0.00 C ATOM 182 C VAL A 12 5.578 4.014 -16.050 1.00 0.00 C ATOM 183 O VAL A 12 4.461 4.322 -15.636 1.00 0.00 O ATOM 184 CB VAL A 12 6.249 3.692 -18.432 1.00 0.00 C ATOM 185 CG1 VAL A 12 4.878 3.093 -18.706 1.00 0.00 C ATOM 186 CG2 VAL A 12 6.809 4.356 -19.681 1.00 0.00 C ATOM 0 H VAL A 12 8.255 4.843 -17.495 1.00 0.00 H new ATOM 0 HA VAL A 12 5.535 5.535 -17.565 1.00 0.00 H new ATOM 0 HB VAL A 12 6.921 2.884 -18.145 1.00 0.00 H new ATOM 0 HG11 VAL A 12 4.950 2.381 -19.528 1.00 0.00 H new ATOM 0 HG12 VAL A 12 4.520 2.581 -17.813 1.00 0.00 H new ATOM 0 HG13 VAL A 12 4.181 3.887 -18.973 1.00 0.00 H new ATOM 0 HG21 VAL A 12 6.855 3.628 -20.491 1.00 0.00 H new ATOM 0 HG22 VAL A 12 6.163 5.184 -19.973 1.00 0.00 H new ATOM 0 HG23 VAL A 12 7.811 4.732 -19.475 1.00 0.00 H new ATOM 196 N ALA A 13 6.331 3.082 -15.476 1.00 0.00 N ATOM 197 CA ALA A 13 5.877 2.351 -14.299 1.00 0.00 C ATOM 198 C ALA A 13 5.351 3.303 -13.231 1.00 0.00 C ATOM 199 O ALA A 13 4.213 3.177 -12.782 1.00 0.00 O ATOM 200 CB ALA A 13 7.007 1.498 -13.740 1.00 0.00 C ATOM 0 H ALA A 13 7.258 2.815 -15.807 1.00 0.00 H new ATOM 0 HA ALA A 13 5.058 1.698 -14.600 1.00 0.00 H new ATOM 0 HB1 ALA A 13 6.655 0.958 -12.861 1.00 0.00 H new ATOM 0 HB2 ALA A 13 7.334 0.786 -14.497 1.00 0.00 H new ATOM 0 HB3 ALA A 13 7.843 2.139 -13.460 1.00 0.00 H new ATOM 206 N GLN A 14 6.189 4.254 -12.828 1.00 0.00 N ATOM 207 CA GLN A 14 5.807 5.226 -11.811 1.00 0.00 C ATOM 208 C GLN A 14 4.550 5.983 -12.226 1.00 0.00 C ATOM 209 O GLN A 14 3.603 6.106 -11.449 1.00 0.00 O ATOM 210 CB GLN A 14 6.951 6.210 -11.562 1.00 0.00 C ATOM 211 CG GLN A 14 6.560 7.387 -10.682 1.00 0.00 C ATOM 212 CD GLN A 14 6.071 6.956 -9.314 1.00 0.00 C ATOM 213 OE1 GLN A 14 6.965 6.973 -8.332 1.00 0.00 O flip ATOM 214 NE2 GLN A 14 4.901 6.611 -9.141 1.00 0.00 N flip ATOM 0 H GLN A 14 7.135 4.371 -13.190 1.00 0.00 H new ATOM 0 HA GLN A 14 5.595 4.685 -10.889 1.00 0.00 H new ATOM 0 HB2 GLN A 14 7.781 5.679 -11.096 1.00 0.00 H new ATOM 0 HB3 GLN A 14 7.310 6.587 -12.520 1.00 0.00 H new ATOM 0 HG2 GLN A 14 7.418 8.049 -10.565 1.00 0.00 H new ATOM 0 HG3 GLN A 14 5.779 7.963 -11.178 1.00 0.00 H new ATOM 0 HE21 GLN A 14 4.248 6.613 -9.924 1.00 0.00 H new ATOM 0 HE22 GLN A 14 4.586 6.323 -8.215 1.00 0.00 H new ATOM 223 N ALA A 15 4.549 6.490 -13.455 1.00 0.00 N ATOM 224 CA ALA A 15 3.407 7.233 -13.973 1.00 0.00 C ATOM 225 C ALA A 15 2.119 6.429 -13.835 1.00 0.00 C ATOM 226 O ALA A 15 1.102 6.943 -13.370 1.00 0.00 O ATOM 227 CB ALA A 15 3.642 7.613 -15.428 1.00 0.00 C ATOM 0 H ALA A 15 5.326 6.400 -14.110 1.00 0.00 H new ATOM 0 HA ALA A 15 3.299 8.143 -13.383 1.00 0.00 H new ATOM 0 HB1 ALA A 15 2.782 8.167 -15.803 1.00 0.00 H new ATOM 0 HB2 ALA A 15 4.534 8.234 -15.502 1.00 0.00 H new ATOM 0 HB3 ALA A 15 3.778 6.710 -16.023 1.00 0.00 H new ATOM 233 N PHE A 16 2.170 5.165 -14.243 1.00 0.00 N ATOM 234 CA PHE A 16 1.006 4.290 -14.166 1.00 0.00 C ATOM 235 C PHE A 16 0.494 4.190 -12.732 1.00 0.00 C ATOM 236 O PHE A 16 -0.659 4.514 -12.448 1.00 0.00 O ATOM 237 CB PHE A 16 1.353 2.897 -14.695 1.00 0.00 C ATOM 238 CG PHE A 16 0.963 2.686 -16.130 1.00 0.00 C ATOM 239 CD1 PHE A 16 1.789 3.115 -17.156 1.00 0.00 C ATOM 240 CD2 PHE A 16 -0.228 2.057 -16.453 1.00 0.00 C ATOM 241 CE1 PHE A 16 1.433 2.923 -18.477 1.00 0.00 C ATOM 242 CE2 PHE A 16 -0.590 1.861 -17.772 1.00 0.00 C ATOM 243 CZ PHE A 16 0.242 2.294 -18.786 1.00 0.00 C ATOM 0 H PHE A 16 3.004 4.724 -14.630 1.00 0.00 H new ATOM 0 HA PHE A 16 0.218 4.720 -14.784 1.00 0.00 H new ATOM 0 HB2 PHE A 16 2.426 2.734 -14.591 1.00 0.00 H new ATOM 0 HB3 PHE A 16 0.856 2.149 -14.078 1.00 0.00 H new ATOM 0 HD1 PHE A 16 2.722 3.605 -16.920 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -0.882 1.716 -15.664 1.00 0.00 H new ATOM 0 HE1 PHE A 16 2.085 3.264 -19.268 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -1.522 1.370 -18.010 1.00 0.00 H new ATOM 0 HZ PHE A 16 -0.038 2.141 -19.818 1.00 0.00 H new ATOM 253 N VAL A 17 1.361 3.738 -11.832 1.00 0.00 N ATOM 254 CA VAL A 17 0.999 3.595 -10.427 1.00 0.00 C ATOM 255 C VAL A 17 0.613 4.939 -9.819 1.00 0.00 C ATOM 256 O VAL A 17 -0.077 4.996 -8.801 1.00 0.00 O ATOM 257 CB VAL A 17 2.153 2.986 -9.608 1.00 0.00 C ATOM 258 CG1 VAL A 17 2.525 1.614 -10.148 1.00 0.00 C ATOM 259 CG2 VAL A 17 3.358 3.915 -9.616 1.00 0.00 C ATOM 0 H VAL A 17 2.319 3.465 -12.051 1.00 0.00 H new ATOM 0 HA VAL A 17 0.142 2.922 -10.389 1.00 0.00 H new ATOM 0 HB VAL A 17 1.821 2.866 -8.577 1.00 0.00 H new ATOM 0 HG11 VAL A 17 3.342 1.200 -9.557 1.00 0.00 H new ATOM 0 HG12 VAL A 17 1.661 0.952 -10.087 1.00 0.00 H new ATOM 0 HG13 VAL A 17 2.839 1.705 -11.188 1.00 0.00 H new ATOM 0 HG21 VAL A 17 4.164 3.470 -9.033 1.00 0.00 H new ATOM 0 HG22 VAL A 17 3.693 4.067 -10.642 1.00 0.00 H new ATOM 0 HG23 VAL A 17 3.081 4.874 -9.179 1.00 0.00 H new ATOM 269 N ASP A 18 1.062 6.018 -10.450 1.00 0.00 N ATOM 270 CA ASP A 18 0.762 7.363 -9.973 1.00 0.00 C ATOM 271 C ASP A 18 -0.712 7.697 -10.179 1.00 0.00 C ATOM 272 O ASP A 18 -1.434 7.983 -9.224 1.00 0.00 O ATOM 273 CB ASP A 18 1.636 8.390 -10.694 1.00 0.00 C ATOM 274 CG ASP A 18 1.598 9.752 -10.030 1.00 0.00 C ATOM 275 OD1 ASP A 18 2.385 9.974 -9.086 1.00 0.00 O ATOM 276 OD2 ASP A 18 0.781 10.596 -10.454 1.00 0.00 O ATOM 0 H ASP A 18 1.635 5.988 -11.293 1.00 0.00 H new ATOM 0 HA ASP A 18 0.978 7.399 -8.905 1.00 0.00 H new ATOM 0 HB2 ASP A 18 2.665 8.031 -10.722 1.00 0.00 H new ATOM 0 HB3 ASP A 18 1.303 8.484 -11.728 1.00 0.00 H new ATOM 281 N TYR A 19 -1.152 7.659 -11.432 1.00 0.00 N ATOM 282 CA TYR A 19 -2.539 7.962 -11.764 1.00 0.00 C ATOM 283 C TYR A 19 -3.485 6.944 -11.134 1.00 0.00 C ATOM 284 O TYR A 19 -4.625 7.263 -10.799 1.00 0.00 O ATOM 285 CB TYR A 19 -2.730 7.979 -13.282 1.00 0.00 C ATOM 286 CG TYR A 19 -3.035 6.620 -13.870 1.00 0.00 C ATOM 287 CD1 TYR A 19 -4.299 6.058 -13.752 1.00 0.00 C ATOM 288 CD2 TYR A 19 -2.057 5.899 -14.544 1.00 0.00 C ATOM 289 CE1 TYR A 19 -4.582 4.816 -14.287 1.00 0.00 C ATOM 290 CE2 TYR A 19 -2.331 4.657 -15.084 1.00 0.00 C ATOM 291 CZ TYR A 19 -3.594 4.120 -14.952 1.00 0.00 C ATOM 292 OH TYR A 19 -3.872 2.883 -15.488 1.00 0.00 O ATOM 0 H TYR A 19 -0.568 7.421 -12.234 1.00 0.00 H new ATOM 0 HA TYR A 19 -2.775 8.948 -11.363 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -3.542 8.663 -13.530 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -1.827 8.373 -13.749 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -5.075 6.601 -13.233 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -1.066 6.316 -14.648 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -5.570 4.393 -14.185 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -1.560 4.110 -15.607 1.00 0.00 H new ATOM 0 HH TYR A 19 -4.166 2.277 -14.776 1.00 0.00 H new ATOM 302 N MET A 20 -3.001 5.716 -10.975 1.00 0.00 N ATOM 303 CA MET A 20 -3.802 4.651 -10.382 1.00 0.00 C ATOM 304 C MET A 20 -3.923 4.836 -8.873 1.00 0.00 C ATOM 305 O MET A 20 -4.976 4.584 -8.290 1.00 0.00 O ATOM 306 CB MET A 20 -3.182 3.286 -10.692 1.00 0.00 C ATOM 307 CG MET A 20 -4.209 2.181 -10.878 1.00 0.00 C ATOM 308 SD MET A 20 -4.629 1.906 -12.610 1.00 0.00 S ATOM 309 CE MET A 20 -6.369 2.327 -12.608 1.00 0.00 C ATOM 0 H MET A 20 -2.060 5.434 -11.248 1.00 0.00 H new ATOM 0 HA MET A 20 -4.801 4.697 -10.816 1.00 0.00 H new ATOM 0 HB2 MET A 20 -2.579 3.367 -11.597 1.00 0.00 H new ATOM 0 HB3 MET A 20 -2.506 3.010 -9.882 1.00 0.00 H new ATOM 0 HG2 MET A 20 -3.823 1.256 -10.451 1.00 0.00 H new ATOM 0 HG3 MET A 20 -5.113 2.434 -10.325 1.00 0.00 H new ATOM 0 HE1 MET A 20 -6.875 1.785 -13.407 1.00 0.00 H new ATOM 0 HE2 MET A 20 -6.808 2.053 -11.649 1.00 0.00 H new ATOM 0 HE3 MET A 20 -6.484 3.399 -12.767 1.00 0.00 H new ATOM 319 N ALA A 21 -2.837 5.278 -8.247 1.00 0.00 N ATOM 320 CA ALA A 21 -2.823 5.499 -6.806 1.00 0.00 C ATOM 321 C ALA A 21 -3.737 6.657 -6.419 1.00 0.00 C ATOM 322 O ALA A 21 -4.466 6.582 -5.429 1.00 0.00 O ATOM 323 CB ALA A 21 -1.403 5.762 -6.326 1.00 0.00 C ATOM 0 H ALA A 21 -1.956 5.490 -8.715 1.00 0.00 H new ATOM 0 HA ALA A 21 -3.198 4.597 -6.322 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -1.408 5.925 -5.248 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -0.775 4.903 -6.560 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -1.008 6.647 -6.825 1.00 0.00 H new ATOM 329 N THR A 22 -3.694 7.728 -7.206 1.00 0.00 N ATOM 330 CA THR A 22 -4.516 8.902 -6.944 1.00 0.00 C ATOM 331 C THR A 22 -5.986 8.618 -7.230 1.00 0.00 C ATOM 332 O THR A 22 -6.862 9.396 -6.854 1.00 0.00 O ATOM 333 CB THR A 22 -4.063 10.105 -7.792 1.00 0.00 C ATOM 334 OG1 THR A 22 -4.884 11.243 -7.506 1.00 0.00 O ATOM 335 CG2 THR A 22 -4.139 9.780 -9.277 1.00 0.00 C ATOM 0 H THR A 22 -3.098 7.806 -8.030 1.00 0.00 H new ATOM 0 HA THR A 22 -4.394 9.145 -5.888 1.00 0.00 H new ATOM 0 HB THR A 22 -3.027 10.331 -7.538 1.00 0.00 H new ATOM 0 HG1 THR A 22 -5.728 10.945 -7.107 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.814 10.645 -9.856 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.491 8.932 -9.497 1.00 0.00 H new ATOM 0 HG23 THR A 22 -5.166 9.531 -9.543 1.00 0.00 H new ATOM 343 N GLN A 23 -6.249 7.498 -7.896 1.00 0.00 N ATOM 344 CA GLN A 23 -7.615 7.112 -8.231 1.00 0.00 C ATOM 345 C GLN A 23 -8.212 6.223 -7.146 1.00 0.00 C ATOM 346 O GLN A 23 -9.368 5.811 -7.232 1.00 0.00 O ATOM 347 CB GLN A 23 -7.646 6.385 -9.577 1.00 0.00 C ATOM 348 CG GLN A 23 -7.665 7.322 -10.774 1.00 0.00 C ATOM 349 CD GLN A 23 -8.917 8.176 -10.827 1.00 0.00 C ATOM 350 OE1 GLN A 23 -9.936 7.771 -11.387 1.00 0.00 O ATOM 351 NE2 GLN A 23 -8.846 9.366 -10.241 1.00 0.00 N ATOM 0 H GLN A 23 -5.535 6.843 -8.214 1.00 0.00 H new ATOM 0 HA GLN A 23 -8.215 8.019 -8.302 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -6.775 5.734 -9.649 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -8.527 5.744 -9.614 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -6.789 7.970 -10.737 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -7.590 6.736 -11.690 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -7.981 9.661 -9.789 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -9.657 9.985 -10.243 1.00 0.00 H new ATOM 360 N GLY A 24 -7.414 5.930 -6.123 1.00 0.00 N ATOM 361 CA GLY A 24 -7.881 5.091 -5.035 1.00 0.00 C ATOM 362 C GLY A 24 -7.369 3.668 -5.139 1.00 0.00 C ATOM 363 O GLY A 24 -7.605 2.849 -4.251 1.00 0.00 O ATOM 0 H GLY A 24 -6.453 6.259 -6.029 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -7.561 5.521 -4.086 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -8.971 5.082 -5.029 1.00 0.00 H new ATOM 367 N VAL A 25 -6.667 3.371 -6.229 1.00 0.00 N ATOM 368 CA VAL A 25 -6.121 2.037 -6.446 1.00 0.00 C ATOM 369 C VAL A 25 -4.609 2.024 -6.252 1.00 0.00 C ATOM 370 O VAL A 25 -3.867 2.609 -7.042 1.00 0.00 O ATOM 371 CB VAL A 25 -6.450 1.520 -7.859 1.00 0.00 C ATOM 372 CG1 VAL A 25 -6.176 0.027 -7.959 1.00 0.00 C ATOM 373 CG2 VAL A 25 -7.896 1.830 -8.216 1.00 0.00 C ATOM 0 H VAL A 25 -6.464 4.037 -6.975 1.00 0.00 H new ATOM 0 HA VAL A 25 -6.585 1.381 -5.709 1.00 0.00 H new ATOM 0 HB VAL A 25 -5.805 2.032 -8.574 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -6.414 -0.320 -8.964 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -5.124 -0.165 -7.749 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.793 -0.505 -7.235 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -8.111 1.458 -9.218 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -8.559 1.347 -7.499 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -8.055 2.908 -8.188 1.00 0.00 H new ATOM 383 N ILE A 26 -4.159 1.354 -5.197 1.00 0.00 N ATOM 384 CA ILE A 26 -2.735 1.263 -4.900 1.00 0.00 C ATOM 385 C ILE A 26 -2.067 0.177 -5.736 1.00 0.00 C ATOM 386 O ILE A 26 -2.554 -0.952 -5.811 1.00 0.00 O ATOM 387 CB ILE A 26 -2.489 0.971 -3.408 1.00 0.00 C ATOM 388 CG1 ILE A 26 -3.091 2.080 -2.543 1.00 0.00 C ATOM 389 CG2 ILE A 26 -0.999 0.829 -3.135 1.00 0.00 C ATOM 390 CD1 ILE A 26 -2.520 3.450 -2.833 1.00 0.00 C ATOM 0 H ILE A 26 -4.760 0.866 -4.533 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.298 2.230 -5.150 1.00 0.00 H new ATOM 0 HB ILE A 26 -2.977 0.031 -3.152 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -4.170 2.105 -2.697 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -2.925 1.841 -1.493 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -0.841 0.623 -2.076 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -0.597 0.008 -3.728 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -0.490 1.754 -3.404 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -2.993 4.186 -2.183 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -1.445 3.442 -2.651 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -2.710 3.710 -3.874 1.00 0.00 H new ATOM 402 N LEU A 27 -0.948 0.525 -6.362 1.00 0.00 N ATOM 403 CA LEU A 27 -0.211 -0.421 -7.193 1.00 0.00 C ATOM 404 C LEU A 27 1.237 -0.539 -6.729 1.00 0.00 C ATOM 405 O LEU A 27 1.751 0.337 -6.033 1.00 0.00 O ATOM 406 CB LEU A 27 -0.255 0.014 -8.659 1.00 0.00 C ATOM 407 CG LEU A 27 -1.403 -0.554 -9.493 1.00 0.00 C ATOM 408 CD1 LEU A 27 -1.138 -2.010 -9.843 1.00 0.00 C ATOM 409 CD2 LEU A 27 -2.723 -0.414 -8.750 1.00 0.00 C ATOM 0 H LEU A 27 -0.531 1.455 -6.310 1.00 0.00 H new ATOM 0 HA LEU A 27 -0.685 -1.398 -7.097 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -0.312 1.102 -8.693 1.00 0.00 H new ATOM 0 HB3 LEU A 27 0.686 -0.271 -9.130 1.00 0.00 H new ATOM 0 HG LEU A 27 -1.469 0.015 -10.420 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -1.966 -2.398 -10.437 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -0.214 -2.084 -10.416 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -1.044 -2.593 -8.927 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -3.529 -0.824 -9.359 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -2.669 -0.957 -7.807 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -2.919 0.640 -8.551 1.00 0.00 H new ATOM 421 N THR A 28 1.893 -1.627 -7.121 1.00 0.00 N ATOM 422 CA THR A 28 3.282 -1.860 -6.746 1.00 0.00 C ATOM 423 C THR A 28 4.143 -2.135 -7.973 1.00 0.00 C ATOM 424 O THR A 28 3.719 -2.830 -8.898 1.00 0.00 O ATOM 425 CB THR A 28 3.409 -3.042 -5.767 1.00 0.00 C ATOM 426 OG1 THR A 28 2.139 -3.323 -5.170 1.00 0.00 O ATOM 427 CG2 THR A 28 4.429 -2.737 -4.681 1.00 0.00 C ATOM 0 H THR A 28 1.484 -2.361 -7.699 1.00 0.00 H new ATOM 0 HA THR A 28 3.634 -0.953 -6.255 1.00 0.00 H new ATOM 0 HB THR A 28 3.747 -3.914 -6.327 1.00 0.00 H new ATOM 0 HG1 THR A 28 1.558 -3.759 -5.828 1.00 0.00 H new ATOM 0 HG21 THR A 28 4.502 -3.586 -4.001 1.00 0.00 H new ATOM 0 HG22 THR A 28 5.402 -2.553 -5.137 1.00 0.00 H new ATOM 0 HG23 THR A 28 4.116 -1.853 -4.125 1.00 0.00 H new ATOM 435 N ILE A 29 5.354 -1.588 -7.975 1.00 0.00 N ATOM 436 CA ILE A 29 6.275 -1.778 -9.089 1.00 0.00 C ATOM 437 C ILE A 29 7.520 -2.541 -8.649 1.00 0.00 C ATOM 438 O ILE A 29 8.011 -2.356 -7.536 1.00 0.00 O ATOM 439 CB ILE A 29 6.703 -0.431 -9.701 1.00 0.00 C ATOM 440 CG1 ILE A 29 5.490 0.295 -10.289 1.00 0.00 C ATOM 441 CG2 ILE A 29 7.765 -0.647 -10.768 1.00 0.00 C ATOM 442 CD1 ILE A 29 4.916 -0.382 -11.514 1.00 0.00 C ATOM 0 H ILE A 29 5.720 -1.010 -7.218 1.00 0.00 H new ATOM 0 HA ILE A 29 5.743 -2.358 -9.843 1.00 0.00 H new ATOM 0 HB ILE A 29 7.129 0.190 -8.913 1.00 0.00 H new ATOM 0 HG12 ILE A 29 4.715 0.366 -9.526 1.00 0.00 H new ATOM 0 HG13 ILE A 29 5.777 1.314 -10.548 1.00 0.00 H new ATOM 0 HG21 ILE A 29 8.057 0.314 -11.191 1.00 0.00 H new ATOM 0 HG22 ILE A 29 8.636 -1.127 -10.322 1.00 0.00 H new ATOM 0 HG23 ILE A 29 7.364 -1.284 -11.557 1.00 0.00 H new ATOM 0 HD11 ILE A 29 4.060 0.187 -11.877 1.00 0.00 H new ATOM 0 HD12 ILE A 29 5.677 -0.429 -12.293 1.00 0.00 H new ATOM 0 HD13 ILE A 29 4.597 -1.392 -11.256 1.00 0.00 H new ATOM 454 N GLN A 30 8.025 -3.397 -9.531 1.00 0.00 N ATOM 455 CA GLN A 30 9.213 -4.188 -9.234 1.00 0.00 C ATOM 456 C GLN A 30 10.311 -3.928 -10.260 1.00 0.00 C ATOM 457 O GLN A 30 10.252 -4.426 -11.384 1.00 0.00 O ATOM 458 CB GLN A 30 8.867 -5.677 -9.205 1.00 0.00 C ATOM 459 CG GLN A 30 8.697 -6.236 -7.802 1.00 0.00 C ATOM 460 CD GLN A 30 9.716 -7.308 -7.473 1.00 0.00 C ATOM 461 OE1 GLN A 30 9.620 -8.440 -7.949 1.00 0.00 O ATOM 462 NE2 GLN A 30 10.701 -6.958 -6.653 1.00 0.00 N ATOM 0 H GLN A 30 7.630 -3.561 -10.457 1.00 0.00 H new ATOM 0 HA GLN A 30 9.581 -3.889 -8.252 1.00 0.00 H new ATOM 0 HB2 GLN A 30 7.946 -5.838 -9.765 1.00 0.00 H new ATOM 0 HB3 GLN A 30 9.652 -6.234 -9.716 1.00 0.00 H new ATOM 0 HG2 GLN A 30 8.783 -5.425 -7.079 1.00 0.00 H new ATOM 0 HG3 GLN A 30 7.694 -6.650 -7.699 1.00 0.00 H new ATOM 0 HE21 GLN A 30 10.742 -6.009 -6.281 1.00 0.00 H new ATOM 0 HE22 GLN A 30 11.416 -7.638 -6.395 1.00 0.00 H new ATOM 471 N GLN A 31 11.310 -3.145 -9.866 1.00 0.00 N ATOM 472 CA GLN A 31 12.420 -2.819 -10.753 1.00 0.00 C ATOM 473 C GLN A 31 13.504 -3.891 -10.686 1.00 0.00 C ATOM 474 O GLN A 31 14.008 -4.212 -9.610 1.00 0.00 O ATOM 475 CB GLN A 31 13.011 -1.456 -10.386 1.00 0.00 C ATOM 476 CG GLN A 31 12.867 -0.416 -11.485 1.00 0.00 C ATOM 477 CD GLN A 31 13.429 0.935 -11.086 1.00 0.00 C ATOM 478 OE1 GLN A 31 14.299 1.482 -11.764 1.00 0.00 O ATOM 479 NE2 GLN A 31 12.933 1.480 -9.982 1.00 0.00 N ATOM 0 H GLN A 31 11.373 -2.725 -8.939 1.00 0.00 H new ATOM 0 HA GLN A 31 12.037 -2.779 -11.773 1.00 0.00 H new ATOM 0 HB2 GLN A 31 12.523 -1.089 -9.483 1.00 0.00 H new ATOM 0 HB3 GLN A 31 14.068 -1.579 -10.150 1.00 0.00 H new ATOM 0 HG2 GLN A 31 13.377 -0.767 -12.382 1.00 0.00 H new ATOM 0 HG3 GLN A 31 11.813 -0.306 -11.740 1.00 0.00 H new ATOM 0 HE21 GLN A 31 12.213 0.991 -9.451 1.00 0.00 H new ATOM 0 HE22 GLN A 31 13.272 2.388 -9.665 1.00 0.00 H new ATOM 488 N HIS A 32 13.857 -4.440 -11.844 1.00 0.00 N ATOM 489 CA HIS A 32 14.882 -5.476 -11.916 1.00 0.00 C ATOM 490 C HIS A 32 16.278 -4.861 -11.910 1.00 0.00 C ATOM 491 O HIS A 32 16.434 -3.655 -11.724 1.00 0.00 O ATOM 492 CB HIS A 32 14.691 -6.325 -13.174 1.00 0.00 C ATOM 493 CG HIS A 32 13.325 -6.929 -13.287 1.00 0.00 C ATOM 494 ND1 HIS A 32 12.903 -7.631 -14.396 1.00 0.00 N ATOM 495 CD2 HIS A 32 12.285 -6.934 -12.422 1.00 0.00 C ATOM 496 CE1 HIS A 32 11.661 -8.040 -14.209 1.00 0.00 C ATOM 497 NE2 HIS A 32 11.263 -7.631 -13.018 1.00 0.00 N ATOM 0 H HIS A 32 13.449 -4.186 -12.744 1.00 0.00 H new ATOM 0 HA HIS A 32 14.782 -6.113 -11.038 1.00 0.00 H new ATOM 0 HB2 HIS A 32 14.880 -5.707 -14.052 1.00 0.00 H new ATOM 0 HB3 HIS A 32 15.434 -7.123 -13.180 1.00 0.00 H new ATOM 0 HD2 HIS A 32 12.263 -6.475 -11.445 1.00 0.00 H new ATOM 0 HE1 HIS A 32 11.071 -8.612 -14.911 1.00 0.00 H new ATOM 0 HE2 HIS A 32 10.346 -7.805 -12.608 1.00 0.00 H new ATOM 505 N ASN A 33 17.289 -5.699 -12.115 1.00 0.00 N ATOM 506 CA ASN A 33 18.673 -5.237 -12.131 1.00 0.00 C ATOM 507 C ASN A 33 19.627 -6.389 -12.429 1.00 0.00 C ATOM 508 O ASN A 33 19.878 -7.237 -11.573 1.00 0.00 O ATOM 509 CB ASN A 33 19.034 -4.595 -10.790 1.00 0.00 C ATOM 510 CG ASN A 33 19.571 -3.185 -10.950 1.00 0.00 C ATOM 511 OD1 ASN A 33 20.552 -2.960 -11.658 1.00 0.00 O ATOM 512 ND2 ASN A 33 18.927 -2.229 -10.291 1.00 0.00 N ATOM 0 H ASN A 33 17.177 -6.701 -12.272 1.00 0.00 H new ATOM 0 HA ASN A 33 18.772 -4.492 -12.921 1.00 0.00 H new ATOM 0 HB2 ASN A 33 18.151 -4.574 -10.151 1.00 0.00 H new ATOM 0 HB3 ASN A 33 19.779 -5.210 -10.285 1.00 0.00 H new ATOM 0 HD21 ASN A 33 19.241 -1.261 -10.360 1.00 0.00 H new ATOM 0 HD22 ASN A 33 18.118 -2.462 -9.715 1.00 0.00 H new ATOM 519 N GLN A 34 20.156 -6.412 -13.649 1.00 0.00 N ATOM 520 CA GLN A 34 21.082 -7.460 -14.060 1.00 0.00 C ATOM 521 C GLN A 34 22.323 -6.864 -14.715 1.00 0.00 C ATOM 522 O GLN A 34 22.504 -5.646 -14.731 1.00 0.00 O ATOM 523 CB GLN A 34 20.396 -8.427 -15.026 1.00 0.00 C ATOM 524 CG GLN A 34 19.145 -9.075 -14.453 1.00 0.00 C ATOM 525 CD GLN A 34 19.184 -10.588 -14.529 1.00 0.00 C ATOM 526 OE1 GLN A 34 20.241 -11.202 -14.375 1.00 0.00 O ATOM 527 NE2 GLN A 34 18.030 -11.199 -14.766 1.00 0.00 N ATOM 0 H GLN A 34 19.959 -5.717 -14.369 1.00 0.00 H new ATOM 0 HA GLN A 34 21.391 -8.006 -13.169 1.00 0.00 H new ATOM 0 HB2 GLN A 34 20.132 -7.891 -15.938 1.00 0.00 H new ATOM 0 HB3 GLN A 34 21.103 -9.207 -15.308 1.00 0.00 H new ATOM 0 HG2 GLN A 34 19.026 -8.770 -13.413 1.00 0.00 H new ATOM 0 HG3 GLN A 34 18.272 -8.710 -14.994 1.00 0.00 H new ATOM 0 HE21 GLN A 34 17.178 -10.651 -14.887 1.00 0.00 H new ATOM 0 HE22 GLN A 34 17.995 -12.217 -14.827 1.00 0.00 H new ATOM 536 N SER A 35 23.176 -7.729 -15.255 1.00 0.00 N ATOM 537 CA SER A 35 24.402 -7.287 -15.908 1.00 0.00 C ATOM 538 C SER A 35 24.989 -8.400 -16.771 1.00 0.00 C ATOM 539 O SER A 35 25.616 -9.330 -16.262 1.00 0.00 O ATOM 540 CB SER A 35 25.428 -6.840 -14.865 1.00 0.00 C ATOM 541 OG SER A 35 25.063 -5.597 -14.290 1.00 0.00 O ATOM 0 H SER A 35 23.040 -8.740 -15.253 1.00 0.00 H new ATOM 0 HA SER A 35 24.157 -6.442 -16.552 1.00 0.00 H new ATOM 0 HB2 SER A 35 25.510 -7.596 -14.084 1.00 0.00 H new ATOM 0 HB3 SER A 35 26.410 -6.755 -15.330 1.00 0.00 H new ATOM 0 HG SER A 35 24.211 -5.298 -14.670 1.00 0.00 H new ATOM 547 N ASP A 36 24.782 -8.298 -18.079 1.00 0.00 N ATOM 548 CA ASP A 36 25.291 -9.295 -19.014 1.00 0.00 C ATOM 549 C ASP A 36 26.724 -8.973 -19.425 1.00 0.00 C ATOM 550 O ASP A 36 27.021 -7.862 -19.863 1.00 0.00 O ATOM 551 CB ASP A 36 24.396 -9.367 -20.252 1.00 0.00 C ATOM 552 CG ASP A 36 25.172 -9.712 -21.508 1.00 0.00 C ATOM 553 OD1 ASP A 36 25.961 -10.679 -21.470 1.00 0.00 O ATOM 554 OD2 ASP A 36 24.992 -9.015 -22.528 1.00 0.00 O ATOM 0 H ASP A 36 24.265 -7.535 -18.516 1.00 0.00 H new ATOM 0 HA ASP A 36 25.285 -10.263 -18.514 1.00 0.00 H new ATOM 0 HB2 ASP A 36 23.619 -10.114 -20.092 1.00 0.00 H new ATOM 0 HB3 ASP A 36 23.894 -8.409 -20.390 1.00 0.00 H new ATOM 559 N VAL A 37 27.610 -9.953 -19.278 1.00 0.00 N ATOM 560 CA VAL A 37 29.013 -9.774 -19.634 1.00 0.00 C ATOM 561 C VAL A 37 29.311 -10.362 -21.009 1.00 0.00 C ATOM 562 O VAL A 37 29.120 -11.556 -21.239 1.00 0.00 O ATOM 563 CB VAL A 37 29.943 -10.429 -18.596 1.00 0.00 C ATOM 564 CG1 VAL A 37 31.374 -9.947 -18.781 1.00 0.00 C ATOM 565 CG2 VAL A 37 29.453 -10.141 -17.185 1.00 0.00 C ATOM 0 H VAL A 37 27.381 -10.878 -18.915 1.00 0.00 H new ATOM 0 HA VAL A 37 29.200 -8.700 -19.653 1.00 0.00 H new ATOM 0 HB VAL A 37 29.926 -11.508 -18.749 1.00 0.00 H new ATOM 0 HG11 VAL A 37 32.016 -10.421 -18.039 1.00 0.00 H new ATOM 0 HG12 VAL A 37 31.720 -10.210 -19.781 1.00 0.00 H new ATOM 0 HG13 VAL A 37 31.412 -8.865 -18.656 1.00 0.00 H new ATOM 0 HG21 VAL A 37 30.122 -10.611 -16.464 1.00 0.00 H new ATOM 0 HG22 VAL A 37 29.439 -9.064 -17.018 1.00 0.00 H new ATOM 0 HG23 VAL A 37 28.447 -10.541 -17.061 1.00 0.00 H new ATOM 575 N TRP A 38 29.779 -9.516 -21.919 1.00 0.00 N ATOM 576 CA TRP A 38 30.104 -9.951 -23.272 1.00 0.00 C ATOM 577 C TRP A 38 31.513 -9.517 -23.660 1.00 0.00 C ATOM 578 O TRP A 38 31.946 -8.412 -23.331 1.00 0.00 O ATOM 579 CB TRP A 38 29.091 -9.387 -24.269 1.00 0.00 C ATOM 580 CG TRP A 38 28.427 -8.130 -23.794 1.00 0.00 C ATOM 581 CD1 TRP A 38 27.682 -7.975 -22.660 1.00 0.00 C ATOM 582 CD2 TRP A 38 28.448 -6.853 -24.441 1.00 0.00 C ATOM 583 NE1 TRP A 38 27.238 -6.678 -22.563 1.00 0.00 N ATOM 584 CE2 TRP A 38 27.695 -5.969 -23.643 1.00 0.00 C ATOM 585 CE3 TRP A 38 29.031 -6.369 -25.615 1.00 0.00 C ATOM 586 CZ2 TRP A 38 27.510 -4.632 -23.984 1.00 0.00 C ATOM 587 CZ3 TRP A 38 28.846 -5.042 -25.953 1.00 0.00 C ATOM 588 CH2 TRP A 38 28.092 -4.185 -25.139 1.00 0.00 C ATOM 0 H TRP A 38 29.942 -8.524 -21.744 1.00 0.00 H new ATOM 0 HA TRP A 38 30.060 -11.040 -23.297 1.00 0.00 H new ATOM 0 HB2 TRP A 38 29.595 -9.188 -25.215 1.00 0.00 H new ATOM 0 HB3 TRP A 38 28.328 -10.140 -24.466 1.00 0.00 H new ATOM 0 HD1 TRP A 38 27.473 -8.757 -21.945 1.00 0.00 H new ATOM 0 HE1 TRP A 38 26.662 -6.304 -21.809 1.00 0.00 H new ATOM 0 HE3 TRP A 38 29.616 -7.021 -26.247 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 26.928 -3.971 -23.359 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 29.290 -4.658 -26.860 1.00 0.00 H new ATOM 0 HH2 TRP A 38 27.968 -3.152 -25.429 1.00 0.00 H new ATOM 599 N LEU A 39 32.225 -10.393 -24.361 1.00 0.00 N ATOM 600 CA LEU A 39 33.587 -10.099 -24.795 1.00 0.00 C ATOM 601 C LEU A 39 33.652 -9.931 -26.310 1.00 0.00 C ATOM 602 O LEU A 39 32.820 -10.468 -27.040 1.00 0.00 O ATOM 603 CB LEU A 39 34.535 -11.215 -24.353 1.00 0.00 C ATOM 604 CG LEU A 39 35.961 -11.139 -24.900 1.00 0.00 C ATOM 605 CD1 LEU A 39 36.681 -9.918 -24.348 1.00 0.00 C ATOM 606 CD2 LEU A 39 36.729 -12.410 -24.565 1.00 0.00 C ATOM 0 H LEU A 39 31.882 -11.312 -24.641 1.00 0.00 H new ATOM 0 HA LEU A 39 33.896 -9.162 -24.331 1.00 0.00 H new ATOM 0 HB2 LEU A 39 34.584 -11.213 -23.264 1.00 0.00 H new ATOM 0 HB3 LEU A 39 34.103 -12.171 -24.651 1.00 0.00 H new ATOM 0 HG LEU A 39 35.909 -11.045 -25.985 1.00 0.00 H new ATOM 0 HD11 LEU A 39 37.694 -9.881 -24.749 1.00 0.00 H new ATOM 0 HD12 LEU A 39 36.143 -9.016 -24.639 1.00 0.00 H new ATOM 0 HD13 LEU A 39 36.723 -9.981 -23.261 1.00 0.00 H new ATOM 0 HD21 LEU A 39 37.742 -12.339 -24.962 1.00 0.00 H new ATOM 0 HD22 LEU A 39 36.771 -12.535 -23.483 1.00 0.00 H new ATOM 0 HD23 LEU A 39 36.225 -13.268 -25.010 1.00 0.00 H new ATOM 618 N ALA A 40 34.647 -9.183 -26.775 1.00 0.00 N ATOM 619 CA ALA A 40 34.823 -8.947 -28.202 1.00 0.00 C ATOM 620 C ALA A 40 35.955 -9.801 -28.764 1.00 0.00 C ATOM 621 O ALA A 40 35.928 -10.195 -29.930 1.00 0.00 O ATOM 622 CB ALA A 40 35.091 -7.473 -28.465 1.00 0.00 C ATOM 0 H ALA A 40 35.344 -8.730 -26.184 1.00 0.00 H new ATOM 0 HA ALA A 40 33.901 -9.233 -28.708 1.00 0.00 H new ATOM 0 HB1 ALA A 40 35.220 -7.312 -29.535 1.00 0.00 H new ATOM 0 HB2 ALA A 40 34.248 -6.881 -28.108 1.00 0.00 H new ATOM 0 HB3 ALA A 40 35.997 -7.169 -27.940 1.00 0.00 H new ATOM 628 N ASP A 41 36.948 -10.082 -27.928 1.00 0.00 N ATOM 629 CA ASP A 41 38.090 -10.889 -28.341 1.00 0.00 C ATOM 630 C ASP A 41 37.829 -12.371 -28.087 1.00 0.00 C ATOM 631 O ASP A 41 38.136 -12.889 -27.014 1.00 0.00 O ATOM 632 CB ASP A 41 39.351 -10.446 -27.598 1.00 0.00 C ATOM 633 CG ASP A 41 40.614 -11.033 -28.197 1.00 0.00 C ATOM 634 OD1 ASP A 41 40.624 -12.249 -28.484 1.00 0.00 O ATOM 635 OD2 ASP A 41 41.592 -10.278 -28.379 1.00 0.00 O ATOM 0 H ASP A 41 36.985 -9.763 -26.960 1.00 0.00 H new ATOM 0 HA ASP A 41 38.238 -10.743 -29.411 1.00 0.00 H new ATOM 0 HB2 ASP A 41 39.416 -9.358 -27.616 1.00 0.00 H new ATOM 0 HB3 ASP A 41 39.276 -10.744 -26.552 1.00 0.00 H new ATOM 640 N GLU A 42 37.259 -13.045 -29.081 1.00 0.00 N ATOM 641 CA GLU A 42 36.955 -14.466 -28.963 1.00 0.00 C ATOM 642 C GLU A 42 38.168 -15.242 -28.455 1.00 0.00 C ATOM 643 O GLU A 42 38.046 -16.108 -27.589 1.00 0.00 O ATOM 644 CB GLU A 42 36.506 -15.028 -30.313 1.00 0.00 C ATOM 645 CG GLU A 42 35.273 -14.342 -30.878 1.00 0.00 C ATOM 646 CD GLU A 42 35.237 -14.362 -32.394 1.00 0.00 C ATOM 647 OE1 GLU A 42 36.290 -14.106 -33.015 1.00 0.00 O ATOM 648 OE2 GLU A 42 34.157 -14.634 -32.958 1.00 0.00 O ATOM 0 H GLU A 42 36.999 -12.630 -29.976 1.00 0.00 H new ATOM 0 HA GLU A 42 36.145 -14.579 -28.243 1.00 0.00 H new ATOM 0 HB2 GLU A 42 37.324 -14.932 -31.027 1.00 0.00 H new ATOM 0 HB3 GLU A 42 36.301 -16.093 -30.204 1.00 0.00 H new ATOM 0 HG2 GLU A 42 34.380 -14.832 -30.491 1.00 0.00 H new ATOM 0 HG3 GLU A 42 35.246 -13.309 -30.531 1.00 0.00 H new ATOM 655 N SER A 43 39.337 -14.924 -29.002 1.00 0.00 N ATOM 656 CA SER A 43 40.571 -15.594 -28.609 1.00 0.00 C ATOM 657 C SER A 43 40.785 -15.498 -27.101 1.00 0.00 C ATOM 658 O SER A 43 41.323 -16.415 -26.481 1.00 0.00 O ATOM 659 CB SER A 43 41.765 -14.981 -29.344 1.00 0.00 C ATOM 660 OG SER A 43 41.393 -14.530 -30.634 1.00 0.00 O ATOM 0 H SER A 43 39.455 -14.207 -29.718 1.00 0.00 H new ATOM 0 HA SER A 43 40.486 -16.646 -28.881 1.00 0.00 H new ATOM 0 HB2 SER A 43 42.164 -14.148 -28.765 1.00 0.00 H new ATOM 0 HB3 SER A 43 42.562 -15.720 -29.429 1.00 0.00 H new ATOM 0 HG SER A 43 42.173 -14.141 -31.082 1.00 0.00 H new ATOM 666 N GLN A 44 40.357 -14.383 -26.519 1.00 0.00 N ATOM 667 CA GLN A 44 40.502 -14.167 -25.084 1.00 0.00 C ATOM 668 C GLN A 44 39.312 -14.744 -24.324 1.00 0.00 C ATOM 669 O GLN A 44 39.357 -14.894 -23.104 1.00 0.00 O ATOM 670 CB GLN A 44 40.639 -12.673 -24.783 1.00 0.00 C ATOM 671 CG GLN A 44 41.955 -12.305 -24.118 1.00 0.00 C ATOM 672 CD GLN A 44 43.158 -12.840 -24.869 1.00 0.00 C ATOM 673 OE1 GLN A 44 43.200 -12.809 -26.099 1.00 0.00 O ATOM 674 NE2 GLN A 44 44.145 -13.334 -24.131 1.00 0.00 N ATOM 0 H GLN A 44 39.907 -13.616 -27.018 1.00 0.00 H new ATOM 0 HA GLN A 44 41.405 -14.681 -24.754 1.00 0.00 H new ATOM 0 HB2 GLN A 44 40.542 -12.113 -25.713 1.00 0.00 H new ATOM 0 HB3 GLN A 44 39.817 -12.364 -24.138 1.00 0.00 H new ATOM 0 HG2 GLN A 44 42.030 -11.220 -24.045 1.00 0.00 H new ATOM 0 HG3 GLN A 44 41.965 -12.694 -23.100 1.00 0.00 H new ATOM 0 HE21 GLN A 44 44.068 -13.340 -23.114 1.00 0.00 H new ATOM 0 HE22 GLN A 44 44.981 -13.708 -24.581 1.00 0.00 H new ATOM 683 N ALA A 45 38.249 -15.064 -25.054 1.00 0.00 N ATOM 684 CA ALA A 45 37.048 -15.626 -24.449 1.00 0.00 C ATOM 685 C ALA A 45 37.385 -16.829 -23.574 1.00 0.00 C ATOM 686 O ALA A 45 36.767 -17.041 -22.532 1.00 0.00 O ATOM 687 CB ALA A 45 36.048 -16.019 -25.527 1.00 0.00 C ATOM 0 H ALA A 45 38.195 -14.944 -26.065 1.00 0.00 H new ATOM 0 HA ALA A 45 36.600 -14.862 -23.814 1.00 0.00 H new ATOM 0 HB1 ALA A 45 35.156 -16.437 -25.061 1.00 0.00 H new ATOM 0 HB2 ALA A 45 35.775 -15.138 -26.108 1.00 0.00 H new ATOM 0 HB3 ALA A 45 36.496 -16.763 -26.185 1.00 0.00 H new ATOM 693 N GLU A 46 38.368 -17.613 -24.007 1.00 0.00 N ATOM 694 CA GLU A 46 38.785 -18.795 -23.262 1.00 0.00 C ATOM 695 C GLU A 46 39.409 -18.404 -21.925 1.00 0.00 C ATOM 696 O GLU A 46 39.066 -18.960 -20.882 1.00 0.00 O ATOM 697 CB GLU A 46 39.782 -19.616 -24.082 1.00 0.00 C ATOM 698 CG GLU A 46 39.144 -20.375 -25.233 1.00 0.00 C ATOM 699 CD GLU A 46 39.126 -21.874 -25.005 1.00 0.00 C ATOM 700 OE1 GLU A 46 40.150 -22.416 -24.540 1.00 0.00 O ATOM 701 OE2 GLU A 46 38.087 -22.505 -25.291 1.00 0.00 O ATOM 0 H GLU A 46 38.889 -17.451 -24.869 1.00 0.00 H new ATOM 0 HA GLU A 46 37.900 -19.401 -23.067 1.00 0.00 H new ATOM 0 HB2 GLU A 46 40.549 -18.950 -24.478 1.00 0.00 H new ATOM 0 HB3 GLU A 46 40.284 -20.325 -23.424 1.00 0.00 H new ATOM 0 HG2 GLU A 46 38.123 -20.021 -25.375 1.00 0.00 H new ATOM 0 HG3 GLU A 46 39.688 -20.158 -26.152 1.00 0.00 H new ATOM 708 N ARG A 47 40.328 -17.444 -21.966 1.00 0.00 N ATOM 709 CA ARG A 47 41.001 -16.980 -20.759 1.00 0.00 C ATOM 710 C ARG A 47 39.994 -16.444 -19.747 1.00 0.00 C ATOM 711 O ARG A 47 39.969 -16.872 -18.593 1.00 0.00 O ATOM 712 CB ARG A 47 42.021 -15.893 -21.105 1.00 0.00 C ATOM 713 CG ARG A 47 42.816 -15.401 -19.907 1.00 0.00 C ATOM 714 CD ARG A 47 42.284 -14.073 -19.392 1.00 0.00 C ATOM 715 NE ARG A 47 42.869 -13.711 -18.104 1.00 0.00 N ATOM 716 CZ ARG A 47 44.128 -13.314 -17.954 1.00 0.00 C ATOM 717 NH1 ARG A 47 44.929 -13.228 -19.007 1.00 0.00 N ATOM 718 NH2 ARG A 47 44.588 -13.002 -16.749 1.00 0.00 N ATOM 0 H ARG A 47 40.623 -16.973 -22.821 1.00 0.00 H new ATOM 0 HA ARG A 47 41.521 -17.828 -20.314 1.00 0.00 H new ATOM 0 HB2 ARG A 47 42.711 -16.280 -21.855 1.00 0.00 H new ATOM 0 HB3 ARG A 47 41.500 -15.049 -21.557 1.00 0.00 H new ATOM 0 HG2 ARG A 47 42.774 -16.144 -19.111 1.00 0.00 H new ATOM 0 HG3 ARG A 47 43.864 -15.291 -20.185 1.00 0.00 H new ATOM 0 HD2 ARG A 47 42.498 -13.290 -20.120 1.00 0.00 H new ATOM 0 HD3 ARG A 47 41.200 -14.130 -19.294 1.00 0.00 H new ATOM 0 HE ARG A 47 42.279 -13.766 -17.274 1.00 0.00 H new ATOM 0 HH11 ARG A 47 44.579 -13.467 -19.935 1.00 0.00 H new ATOM 0 HH12 ARG A 47 45.895 -12.923 -18.889 1.00 0.00 H new ATOM 0 HH21 ARG A 47 43.975 -13.067 -15.936 1.00 0.00 H new ATOM 0 HH22 ARG A 47 45.555 -12.697 -16.635 1.00 0.00 H new ATOM 732 N VAL A 48 39.164 -15.503 -20.186 1.00 0.00 N ATOM 733 CA VAL A 48 38.154 -14.908 -19.319 1.00 0.00 C ATOM 734 C VAL A 48 37.221 -15.972 -18.752 1.00 0.00 C ATOM 735 O VAL A 48 36.819 -15.904 -17.590 1.00 0.00 O ATOM 736 CB VAL A 48 37.318 -13.856 -20.071 1.00 0.00 C ATOM 737 CG1 VAL A 48 38.183 -12.669 -20.467 1.00 0.00 C ATOM 738 CG2 VAL A 48 36.657 -14.475 -21.293 1.00 0.00 C ATOM 0 H VAL A 48 39.171 -15.136 -21.138 1.00 0.00 H new ATOM 0 HA VAL A 48 38.686 -14.422 -18.501 1.00 0.00 H new ATOM 0 HB VAL A 48 36.534 -13.497 -19.404 1.00 0.00 H new ATOM 0 HG11 VAL A 48 37.575 -11.936 -20.997 1.00 0.00 H new ATOM 0 HG12 VAL A 48 38.604 -12.211 -19.572 1.00 0.00 H new ATOM 0 HG13 VAL A 48 38.991 -13.008 -21.116 1.00 0.00 H new ATOM 0 HG21 VAL A 48 36.070 -13.717 -21.812 1.00 0.00 H new ATOM 0 HG22 VAL A 48 37.423 -14.863 -21.964 1.00 0.00 H new ATOM 0 HG23 VAL A 48 36.003 -15.289 -20.980 1.00 0.00 H new ATOM 748 N ARG A 49 36.881 -16.955 -19.579 1.00 0.00 N ATOM 749 CA ARG A 49 35.995 -18.034 -19.160 1.00 0.00 C ATOM 750 C ARG A 49 36.577 -18.784 -17.966 1.00 0.00 C ATOM 751 O ARG A 49 35.906 -18.972 -16.951 1.00 0.00 O ATOM 752 CB ARG A 49 35.756 -19.005 -20.318 1.00 0.00 C ATOM 753 CG ARG A 49 34.503 -18.698 -21.122 1.00 0.00 C ATOM 754 CD ARG A 49 34.679 -19.062 -22.588 1.00 0.00 C ATOM 755 NE ARG A 49 33.736 -20.092 -23.014 1.00 0.00 N ATOM 756 CZ ARG A 49 33.439 -20.338 -24.285 1.00 0.00 C ATOM 757 NH1 ARG A 49 34.009 -19.630 -25.251 1.00 0.00 N ATOM 758 NH2 ARG A 49 32.570 -21.292 -24.592 1.00 0.00 N ATOM 0 H ARG A 49 37.206 -17.026 -20.543 1.00 0.00 H new ATOM 0 HA ARG A 49 35.044 -17.593 -18.861 1.00 0.00 H new ATOM 0 HB2 ARG A 49 36.619 -18.983 -20.984 1.00 0.00 H new ATOM 0 HB3 ARG A 49 35.684 -20.018 -19.922 1.00 0.00 H new ATOM 0 HG2 ARG A 49 33.659 -19.250 -20.708 1.00 0.00 H new ATOM 0 HG3 ARG A 49 34.264 -17.638 -21.035 1.00 0.00 H new ATOM 0 HD2 ARG A 49 34.544 -18.171 -23.201 1.00 0.00 H new ATOM 0 HD3 ARG A 49 35.698 -19.412 -22.755 1.00 0.00 H new ATOM 0 HE ARG A 49 33.280 -20.654 -22.295 1.00 0.00 H new ATOM 0 HH11 ARG A 49 34.677 -18.895 -25.018 1.00 0.00 H new ATOM 0 HH12 ARG A 49 33.779 -19.821 -26.226 1.00 0.00 H new ATOM 0 HH21 ARG A 49 32.129 -21.838 -23.852 1.00 0.00 H new ATOM 0 HH22 ARG A 49 32.343 -21.480 -25.568 1.00 0.00 H new ATOM 772 N ALA A 50 37.830 -19.209 -18.094 1.00 0.00 N ATOM 773 CA ALA A 50 38.503 -19.936 -17.025 1.00 0.00 C ATOM 774 C ALA A 50 38.597 -19.090 -15.760 1.00 0.00 C ATOM 775 O ALA A 50 38.108 -19.484 -14.702 1.00 0.00 O ATOM 776 CB ALA A 50 39.889 -20.372 -17.475 1.00 0.00 C ATOM 0 H ALA A 50 38.399 -19.062 -18.928 1.00 0.00 H new ATOM 0 HA ALA A 50 37.912 -20.823 -16.794 1.00 0.00 H new ATOM 0 HB1 ALA A 50 40.380 -20.914 -16.667 1.00 0.00 H new ATOM 0 HB2 ALA A 50 39.801 -21.021 -18.346 1.00 0.00 H new ATOM 0 HB3 ALA A 50 40.480 -19.494 -17.735 1.00 0.00 H new ATOM 782 N GLU A 51 39.229 -17.926 -15.877 1.00 0.00 N ATOM 783 CA GLU A 51 39.387 -17.026 -14.741 1.00 0.00 C ATOM 784 C GLU A 51 38.039 -16.726 -14.093 1.00 0.00 C ATOM 785 O GLU A 51 37.860 -16.917 -12.889 1.00 0.00 O ATOM 786 CB GLU A 51 40.054 -15.722 -15.184 1.00 0.00 C ATOM 787 CG GLU A 51 41.425 -15.921 -15.809 1.00 0.00 C ATOM 788 CD GLU A 51 42.245 -16.976 -15.092 1.00 0.00 C ATOM 789 OE1 GLU A 51 42.850 -16.651 -14.050 1.00 0.00 O ATOM 790 OE2 GLU A 51 42.280 -18.128 -15.575 1.00 0.00 O ATOM 0 H GLU A 51 39.639 -17.585 -16.746 1.00 0.00 H new ATOM 0 HA GLU A 51 40.022 -17.519 -14.005 1.00 0.00 H new ATOM 0 HB2 GLU A 51 39.407 -15.218 -15.902 1.00 0.00 H new ATOM 0 HB3 GLU A 51 40.149 -15.061 -14.322 1.00 0.00 H new ATOM 0 HG2 GLU A 51 41.306 -16.207 -16.854 1.00 0.00 H new ATOM 0 HG3 GLU A 51 41.966 -14.975 -15.797 1.00 0.00 H new ATOM 797 N LEU A 52 37.094 -16.254 -14.898 1.00 0.00 N ATOM 798 CA LEU A 52 35.761 -15.926 -14.404 1.00 0.00 C ATOM 799 C LEU A 52 35.193 -17.070 -13.570 1.00 0.00 C ATOM 800 O LEU A 52 34.722 -16.862 -12.452 1.00 0.00 O ATOM 801 CB LEU A 52 34.824 -15.618 -15.573 1.00 0.00 C ATOM 802 CG LEU A 52 33.365 -15.341 -15.208 1.00 0.00 C ATOM 803 CD1 LEU A 52 32.983 -13.916 -15.580 1.00 0.00 C ATOM 804 CD2 LEU A 52 32.444 -16.338 -15.897 1.00 0.00 C ATOM 0 H LEU A 52 37.226 -16.090 -15.896 1.00 0.00 H new ATOM 0 HA LEU A 52 35.842 -15.044 -13.769 1.00 0.00 H new ATOM 0 HB2 LEU A 52 35.215 -14.752 -16.107 1.00 0.00 H new ATOM 0 HB3 LEU A 52 34.851 -16.459 -16.266 1.00 0.00 H new ATOM 0 HG LEU A 52 33.252 -15.457 -14.130 1.00 0.00 H new ATOM 0 HD11 LEU A 52 31.941 -13.737 -15.313 1.00 0.00 H new ATOM 0 HD12 LEU A 52 33.621 -13.216 -15.041 1.00 0.00 H new ATOM 0 HD13 LEU A 52 33.112 -13.773 -16.653 1.00 0.00 H new ATOM 0 HD21 LEU A 52 31.410 -16.126 -15.626 1.00 0.00 H new ATOM 0 HD22 LEU A 52 32.560 -16.254 -16.978 1.00 0.00 H new ATOM 0 HD23 LEU A 52 32.701 -17.349 -15.582 1.00 0.00 H new ATOM 816 N ALA A 53 35.242 -18.279 -14.121 1.00 0.00 N ATOM 817 CA ALA A 53 34.737 -19.456 -13.426 1.00 0.00 C ATOM 818 C ALA A 53 35.431 -19.640 -12.081 1.00 0.00 C ATOM 819 O ALA A 53 34.792 -19.974 -11.083 1.00 0.00 O ATOM 820 CB ALA A 53 34.917 -20.696 -14.289 1.00 0.00 C ATOM 0 H ALA A 53 35.626 -18.468 -15.047 1.00 0.00 H new ATOM 0 HA ALA A 53 33.673 -19.308 -13.239 1.00 0.00 H new ATOM 0 HB1 ALA A 53 34.535 -21.568 -13.757 1.00 0.00 H new ATOM 0 HB2 ALA A 53 34.369 -20.572 -15.223 1.00 0.00 H new ATOM 0 HB3 ALA A 53 35.976 -20.838 -14.506 1.00 0.00 H new ATOM 826 N ARG A 54 36.741 -19.421 -12.062 1.00 0.00 N ATOM 827 CA ARG A 54 37.522 -19.565 -10.839 1.00 0.00 C ATOM 828 C ARG A 54 37.145 -18.490 -9.824 1.00 0.00 C ATOM 829 O ARG A 54 37.327 -18.668 -8.619 1.00 0.00 O ATOM 830 CB ARG A 54 39.018 -19.485 -11.151 1.00 0.00 C ATOM 831 CG ARG A 54 39.618 -20.808 -11.599 1.00 0.00 C ATOM 832 CD ARG A 54 40.738 -20.598 -12.607 1.00 0.00 C ATOM 833 NE ARG A 54 41.430 -21.845 -12.922 1.00 0.00 N ATOM 834 CZ ARG A 54 42.649 -21.895 -13.448 1.00 0.00 C ATOM 835 NH1 ARG A 54 43.306 -20.775 -13.716 1.00 0.00 N ATOM 836 NH2 ARG A 54 43.213 -23.068 -13.707 1.00 0.00 N ATOM 0 H ARG A 54 37.284 -19.143 -12.879 1.00 0.00 H new ATOM 0 HA ARG A 54 37.300 -20.541 -10.408 1.00 0.00 H new ATOM 0 HB2 ARG A 54 39.179 -18.740 -11.931 1.00 0.00 H new ATOM 0 HB3 ARG A 54 39.548 -19.137 -10.264 1.00 0.00 H new ATOM 0 HG2 ARG A 54 40.003 -21.346 -10.733 1.00 0.00 H new ATOM 0 HG3 ARG A 54 38.840 -21.430 -12.042 1.00 0.00 H new ATOM 0 HD2 ARG A 54 40.327 -20.170 -13.522 1.00 0.00 H new ATOM 0 HD3 ARG A 54 41.453 -19.877 -12.210 1.00 0.00 H new ATOM 0 HE ARG A 54 40.952 -22.725 -12.728 1.00 0.00 H new ATOM 0 HH11 ARG A 54 42.876 -19.872 -13.518 1.00 0.00 H new ATOM 0 HH12 ARG A 54 44.242 -20.817 -14.120 1.00 0.00 H new ATOM 0 HH21 ARG A 54 42.711 -23.932 -13.502 1.00 0.00 H new ATOM 0 HH22 ARG A 54 44.149 -23.106 -14.111 1.00 0.00 H new ATOM 850 N PHE A 55 36.621 -17.374 -10.319 1.00 0.00 N ATOM 851 CA PHE A 55 36.220 -16.269 -9.455 1.00 0.00 C ATOM 852 C PHE A 55 34.798 -16.471 -8.939 1.00 0.00 C ATOM 853 O PHE A 55 34.524 -16.285 -7.752 1.00 0.00 O ATOM 854 CB PHE A 55 36.316 -14.942 -10.211 1.00 0.00 C ATOM 855 CG PHE A 55 36.696 -13.781 -9.337 1.00 0.00 C ATOM 856 CD1 PHE A 55 37.877 -13.799 -8.613 1.00 0.00 C ATOM 857 CD2 PHE A 55 35.871 -12.672 -9.239 1.00 0.00 C ATOM 858 CE1 PHE A 55 38.230 -12.732 -7.808 1.00 0.00 C ATOM 859 CE2 PHE A 55 36.219 -11.602 -8.437 1.00 0.00 C ATOM 860 CZ PHE A 55 37.399 -11.632 -7.719 1.00 0.00 C ATOM 0 H PHE A 55 36.464 -17.210 -11.313 1.00 0.00 H new ATOM 0 HA PHE A 55 36.898 -16.243 -8.602 1.00 0.00 H new ATOM 0 HB2 PHE A 55 37.050 -15.041 -11.010 1.00 0.00 H new ATOM 0 HB3 PHE A 55 35.357 -14.732 -10.684 1.00 0.00 H new ATOM 0 HD1 PHE A 55 38.530 -14.657 -8.678 1.00 0.00 H new ATOM 0 HD2 PHE A 55 34.946 -12.644 -9.796 1.00 0.00 H new ATOM 0 HE1 PHE A 55 39.154 -12.758 -7.250 1.00 0.00 H new ATOM 0 HE2 PHE A 55 35.569 -10.742 -8.371 1.00 0.00 H new ATOM 0 HZ PHE A 55 37.671 -10.798 -7.090 1.00 0.00 H new ATOM 870 N LEU A 56 33.897 -16.852 -9.838 1.00 0.00 N ATOM 871 CA LEU A 56 32.503 -17.079 -9.475 1.00 0.00 C ATOM 872 C LEU A 56 32.390 -18.135 -8.380 1.00 0.00 C ATOM 873 O LEU A 56 31.515 -18.057 -7.518 1.00 0.00 O ATOM 874 CB LEU A 56 31.700 -17.512 -10.702 1.00 0.00 C ATOM 875 CG LEU A 56 30.912 -16.411 -11.413 1.00 0.00 C ATOM 876 CD1 LEU A 56 30.377 -16.912 -12.745 1.00 0.00 C ATOM 877 CD2 LEU A 56 29.774 -15.916 -10.531 1.00 0.00 C ATOM 0 H LEU A 56 34.107 -17.010 -10.824 1.00 0.00 H new ATOM 0 HA LEU A 56 32.096 -16.143 -9.094 1.00 0.00 H new ATOM 0 HB2 LEU A 56 32.386 -17.961 -11.420 1.00 0.00 H new ATOM 0 HB3 LEU A 56 31.002 -18.292 -10.398 1.00 0.00 H new ATOM 0 HG LEU A 56 31.585 -15.576 -11.607 1.00 0.00 H new ATOM 0 HD11 LEU A 56 29.819 -16.115 -13.236 1.00 0.00 H new ATOM 0 HD12 LEU A 56 31.209 -17.217 -13.380 1.00 0.00 H new ATOM 0 HD13 LEU A 56 29.719 -17.764 -12.575 1.00 0.00 H new ATOM 0 HD21 LEU A 56 29.224 -15.133 -11.052 1.00 0.00 H new ATOM 0 HD22 LEU A 56 29.101 -16.744 -10.306 1.00 0.00 H new ATOM 0 HD23 LEU A 56 30.181 -15.517 -9.602 1.00 0.00 H new ATOM 889 N GLU A 57 33.282 -19.119 -8.420 1.00 0.00 N ATOM 890 CA GLU A 57 33.283 -20.190 -7.430 1.00 0.00 C ATOM 891 C GLU A 57 33.910 -19.720 -6.121 1.00 0.00 C ATOM 892 O GLU A 57 33.972 -20.468 -5.146 1.00 0.00 O ATOM 893 CB GLU A 57 34.041 -21.407 -7.963 1.00 0.00 C ATOM 894 CG GLU A 57 35.551 -21.239 -7.948 1.00 0.00 C ATOM 895 CD GLU A 57 36.276 -22.424 -8.555 1.00 0.00 C ATOM 896 OE1 GLU A 57 35.980 -22.770 -9.718 1.00 0.00 O ATOM 897 OE2 GLU A 57 37.141 -23.006 -7.867 1.00 0.00 O ATOM 0 H GLU A 57 34.013 -19.197 -9.127 1.00 0.00 H new ATOM 0 HA GLU A 57 32.248 -20.472 -7.237 1.00 0.00 H new ATOM 0 HB2 GLU A 57 33.775 -22.280 -7.366 1.00 0.00 H new ATOM 0 HB3 GLU A 57 33.716 -21.608 -8.984 1.00 0.00 H new ATOM 0 HG2 GLU A 57 35.818 -20.335 -8.496 1.00 0.00 H new ATOM 0 HG3 GLU A 57 35.887 -21.100 -6.921 1.00 0.00 H new ATOM 904 N ASN A 58 34.375 -18.475 -6.108 1.00 0.00 N ATOM 905 CA ASN A 58 34.999 -17.904 -4.920 1.00 0.00 C ATOM 906 C ASN A 58 34.146 -16.778 -4.344 1.00 0.00 C ATOM 907 O ASN A 58 34.473 -15.597 -4.460 1.00 0.00 O ATOM 908 CB ASN A 58 36.397 -17.380 -5.254 1.00 0.00 C ATOM 909 CG ASN A 58 37.431 -18.488 -5.315 1.00 0.00 C ATOM 910 OD1 ASN A 58 37.258 -19.547 -4.712 1.00 0.00 O ATOM 911 ND2 ASN A 58 38.513 -18.247 -6.046 1.00 0.00 N ATOM 0 H ASN A 58 34.331 -17.842 -6.907 1.00 0.00 H new ATOM 0 HA ASN A 58 35.083 -18.691 -4.171 1.00 0.00 H new ATOM 0 HB2 ASN A 58 36.368 -16.861 -6.212 1.00 0.00 H new ATOM 0 HB3 ASN A 58 36.697 -16.648 -4.504 1.00 0.00 H new ATOM 0 HD21 ASN A 58 39.243 -18.955 -6.125 1.00 0.00 H new ATOM 0 HD22 ASN A 58 38.614 -17.354 -6.529 1.00 0.00 H new ATOM 918 N PRO A 59 33.025 -17.151 -3.709 1.00 0.00 N ATOM 919 CA PRO A 59 32.101 -16.187 -3.102 1.00 0.00 C ATOM 920 C PRO A 59 32.694 -15.515 -1.868 1.00 0.00 C ATOM 921 O PRO A 59 32.364 -15.870 -0.737 1.00 0.00 O ATOM 922 CB PRO A 59 30.896 -17.047 -2.715 1.00 0.00 C ATOM 923 CG PRO A 59 31.449 -18.419 -2.542 1.00 0.00 C ATOM 924 CD PRO A 59 32.572 -18.541 -3.534 1.00 0.00 C ATOM 0 HA PRO A 59 31.858 -15.370 -3.782 1.00 0.00 H new ATOM 0 HB2 PRO A 59 30.433 -16.688 -1.796 1.00 0.00 H new ATOM 0 HB3 PRO A 59 30.129 -17.024 -3.489 1.00 0.00 H new ATOM 0 HG2 PRO A 59 31.809 -18.569 -1.524 1.00 0.00 H new ATOM 0 HG3 PRO A 59 30.684 -19.174 -2.724 1.00 0.00 H new ATOM 0 HD2 PRO A 59 33.372 -19.180 -3.159 1.00 0.00 H new ATOM 0 HD3 PRO A 59 32.232 -18.974 -4.475 1.00 0.00 H new ATOM 932 N ALA A 60 33.570 -14.541 -2.094 1.00 0.00 N ATOM 933 CA ALA A 60 34.206 -13.817 -1.001 1.00 0.00 C ATOM 934 C ALA A 60 34.788 -12.493 -1.484 1.00 0.00 C ATOM 935 O ALA A 60 34.699 -11.477 -0.796 1.00 0.00 O ATOM 936 CB ALA A 60 35.291 -14.672 -0.363 1.00 0.00 C ATOM 0 H ALA A 60 33.855 -14.236 -3.025 1.00 0.00 H new ATOM 0 HA ALA A 60 33.445 -13.597 -0.252 1.00 0.00 H new ATOM 0 HB1 ALA A 60 35.758 -14.119 0.452 1.00 0.00 H new ATOM 0 HB2 ALA A 60 34.849 -15.589 0.027 1.00 0.00 H new ATOM 0 HB3 ALA A 60 36.044 -14.921 -1.110 1.00 0.00 H new ATOM 942 N ASP A 61 35.386 -12.513 -2.671 1.00 0.00 N ATOM 943 CA ASP A 61 35.983 -11.314 -3.246 1.00 0.00 C ATOM 944 C ASP A 61 34.940 -10.498 -4.004 1.00 0.00 C ATOM 945 O ASP A 61 34.579 -9.395 -3.590 1.00 0.00 O ATOM 946 CB ASP A 61 37.133 -11.690 -4.182 1.00 0.00 C ATOM 947 CG ASP A 61 38.431 -11.000 -3.810 1.00 0.00 C ATOM 948 OD1 ASP A 61 38.490 -9.756 -3.904 1.00 0.00 O ATOM 949 OD2 ASP A 61 39.387 -11.705 -3.425 1.00 0.00 O ATOM 0 H ASP A 61 35.470 -13.347 -3.253 1.00 0.00 H new ATOM 0 HA ASP A 61 36.373 -10.705 -2.431 1.00 0.00 H new ATOM 0 HB2 ASP A 61 37.279 -12.770 -4.158 1.00 0.00 H new ATOM 0 HB3 ASP A 61 36.865 -11.427 -5.205 1.00 0.00 H new ATOM 954 N LEU A 62 34.460 -11.045 -5.114 1.00 0.00 N ATOM 955 CA LEU A 62 33.459 -10.368 -5.931 1.00 0.00 C ATOM 956 C LEU A 62 32.272 -9.925 -5.081 1.00 0.00 C ATOM 957 O LEU A 62 31.419 -10.734 -4.721 1.00 0.00 O ATOM 958 CB LEU A 62 32.981 -11.289 -7.055 1.00 0.00 C ATOM 959 CG LEU A 62 32.700 -12.739 -6.661 1.00 0.00 C ATOM 960 CD1 LEU A 62 31.204 -12.976 -6.525 1.00 0.00 C ATOM 961 CD2 LEU A 62 33.303 -13.695 -7.680 1.00 0.00 C ATOM 0 H LEU A 62 34.748 -11.957 -5.470 1.00 0.00 H new ATOM 0 HA LEU A 62 33.921 -9.482 -6.368 1.00 0.00 H new ATOM 0 HB2 LEU A 62 32.071 -10.867 -7.481 1.00 0.00 H new ATOM 0 HB3 LEU A 62 33.733 -11.287 -7.844 1.00 0.00 H new ATOM 0 HG LEU A 62 33.166 -12.929 -5.694 1.00 0.00 H new ATOM 0 HD11 LEU A 62 31.024 -14.014 -6.244 1.00 0.00 H new ATOM 0 HD12 LEU A 62 30.800 -12.317 -5.757 1.00 0.00 H new ATOM 0 HD13 LEU A 62 30.715 -12.768 -7.476 1.00 0.00 H new ATOM 0 HD21 LEU A 62 33.093 -14.723 -7.383 1.00 0.00 H new ATOM 0 HD22 LEU A 62 32.867 -13.504 -8.661 1.00 0.00 H new ATOM 0 HD23 LEU A 62 34.381 -13.544 -7.727 1.00 0.00 H new ATOM 973 N GLU A 63 32.225 -8.634 -4.767 1.00 0.00 N ATOM 974 CA GLU A 63 31.142 -8.084 -3.961 1.00 0.00 C ATOM 975 C GLU A 63 30.919 -6.609 -4.283 1.00 0.00 C ATOM 976 O GLU A 63 31.828 -5.805 -4.085 1.00 0.00 O ATOM 977 CB GLU A 63 31.449 -8.251 -2.471 1.00 0.00 C ATOM 978 CG GLU A 63 31.636 -9.698 -2.047 1.00 0.00 C ATOM 979 CD GLU A 63 31.513 -9.887 -0.547 1.00 0.00 C ATOM 980 OE1 GLU A 63 31.991 -9.010 0.202 1.00 0.00 O ATOM 981 OE2 GLU A 63 30.940 -10.912 -0.124 1.00 0.00 O ATOM 0 H GLU A 63 32.924 -7.950 -5.058 1.00 0.00 H new ATOM 0 HA GLU A 63 30.231 -8.632 -4.201 1.00 0.00 H new ATOM 0 HB2 GLU A 63 32.352 -7.691 -2.230 1.00 0.00 H new ATOM 0 HB3 GLU A 63 30.637 -7.813 -1.890 1.00 0.00 H new ATOM 0 HG2 GLU A 63 30.894 -10.319 -2.550 1.00 0.00 H new ATOM 0 HG3 GLU A 63 32.616 -10.045 -2.374 1.00 0.00 H new TER 988 GLU A 63 ATOM 989 N MET B 1 31.598 -10.719 -31.187 1.00 0.00 N ATOM 990 CA MET B 1 31.225 -10.574 -29.784 1.00 0.00 C ATOM 991 C MET B 1 30.654 -11.878 -29.236 1.00 0.00 C ATOM 992 O MET B 1 29.664 -12.398 -29.751 1.00 0.00 O ATOM 993 CB MET B 1 30.205 -9.446 -29.619 1.00 0.00 C ATOM 994 CG MET B 1 30.707 -8.096 -30.102 1.00 0.00 C ATOM 995 SD MET B 1 30.584 -6.816 -28.839 1.00 0.00 S ATOM 996 CE MET B 1 31.662 -7.484 -27.574 1.00 0.00 C ATOM 0 H1 MET B 1 32.324 -10.015 -31.428 1.00 0.00 H new ATOM 0 H2 MET B 1 31.975 -11.675 -31.349 1.00 0.00 H new ATOM 0 H3 MET B 1 30.761 -10.571 -31.786 1.00 0.00 H new ATOM 0 HA MET B 1 32.123 -10.326 -29.218 1.00 0.00 H new ATOM 0 HB2 MET B 1 29.299 -9.704 -30.167 1.00 0.00 H new ATOM 0 HB3 MET B 1 29.930 -9.367 -28.567 1.00 0.00 H new ATOM 0 HG2 MET B 1 31.746 -8.191 -30.417 1.00 0.00 H new ATOM 0 HG3 MET B 1 30.134 -7.792 -30.978 1.00 0.00 H new ATOM 0 HE1 MET B 1 32.183 -6.669 -27.072 1.00 0.00 H new ATOM 0 HE2 MET B 1 31.069 -8.038 -26.846 1.00 0.00 H new ATOM 0 HE3 MET B 1 32.391 -8.152 -28.033 1.00 0.00 H new ATOM 1006 N LEU B 2 31.283 -12.400 -28.189 1.00 0.00 N ATOM 1007 CA LEU B 2 30.836 -13.644 -27.571 1.00 0.00 C ATOM 1008 C LEU B 2 30.479 -13.425 -26.104 1.00 0.00 C ATOM 1009 O LEU B 2 31.314 -12.996 -25.309 1.00 0.00 O ATOM 1010 CB LEU B 2 31.923 -14.714 -27.689 1.00 0.00 C ATOM 1011 CG LEU B 2 31.434 -16.153 -27.854 1.00 0.00 C ATOM 1012 CD1 LEU B 2 32.604 -17.123 -27.813 1.00 0.00 C ATOM 1013 CD2 LEU B 2 30.416 -16.497 -26.776 1.00 0.00 C ATOM 0 H LEU B 2 32.103 -11.982 -27.750 1.00 0.00 H new ATOM 0 HA LEU B 2 29.943 -13.982 -28.097 1.00 0.00 H new ATOM 0 HB2 LEU B 2 32.557 -14.467 -28.541 1.00 0.00 H new ATOM 0 HB3 LEU B 2 32.551 -14.665 -26.800 1.00 0.00 H new ATOM 0 HG LEU B 2 30.949 -16.242 -28.826 1.00 0.00 H new ATOM 0 HD11 LEU B 2 32.236 -18.142 -27.932 1.00 0.00 H new ATOM 0 HD12 LEU B 2 33.298 -16.891 -28.621 1.00 0.00 H new ATOM 0 HD13 LEU B 2 33.118 -17.032 -26.856 1.00 0.00 H new ATOM 0 HD21 LEU B 2 30.079 -17.525 -26.909 1.00 0.00 H new ATOM 0 HD22 LEU B 2 30.876 -16.390 -25.794 1.00 0.00 H new ATOM 0 HD23 LEU B 2 29.563 -15.823 -26.852 1.00 0.00 H new ATOM 1025 N MET B 3 29.233 -13.726 -25.753 1.00 0.00 N ATOM 1026 CA MET B 3 28.767 -13.565 -24.381 1.00 0.00 C ATOM 1027 C MET B 3 29.621 -14.383 -23.417 1.00 0.00 C ATOM 1028 O MET B 3 29.681 -15.609 -23.514 1.00 0.00 O ATOM 1029 CB MET B 3 27.301 -13.988 -24.265 1.00 0.00 C ATOM 1030 CG MET B 3 26.509 -13.167 -23.260 1.00 0.00 C ATOM 1031 SD MET B 3 25.153 -14.096 -22.519 1.00 0.00 S ATOM 1032 CE MET B 3 25.307 -13.609 -20.802 1.00 0.00 C ATOM 0 H MET B 3 28.529 -14.082 -26.399 1.00 0.00 H new ATOM 0 HA MET B 3 28.857 -12.512 -24.115 1.00 0.00 H new ATOM 0 HB2 MET B 3 26.829 -13.903 -25.244 1.00 0.00 H new ATOM 0 HB3 MET B 3 27.256 -15.039 -23.979 1.00 0.00 H new ATOM 0 HG2 MET B 3 27.178 -12.819 -22.473 1.00 0.00 H new ATOM 0 HG3 MET B 3 26.110 -12.281 -23.754 1.00 0.00 H new ATOM 0 HE1 MET B 3 25.450 -14.495 -20.184 1.00 0.00 H new ATOM 0 HE2 MET B 3 26.164 -12.945 -20.688 1.00 0.00 H new ATOM 0 HE3 MET B 3 24.401 -13.090 -20.488 1.00 0.00 H new ATOM 1042 N ILE B 4 30.279 -13.697 -22.489 1.00 0.00 N ATOM 1043 CA ILE B 4 31.129 -14.360 -21.508 1.00 0.00 C ATOM 1044 C ILE B 4 30.295 -15.005 -20.405 1.00 0.00 C ATOM 1045 O ILE B 4 30.463 -16.185 -20.094 1.00 0.00 O ATOM 1046 CB ILE B 4 32.128 -13.376 -20.871 1.00 0.00 C ATOM 1047 CG1 ILE B 4 33.085 -12.830 -21.932 1.00 0.00 C ATOM 1048 CG2 ILE B 4 32.902 -14.057 -19.752 1.00 0.00 C ATOM 1049 CD1 ILE B 4 33.756 -13.908 -22.754 1.00 0.00 C ATOM 0 H ILE B 4 30.240 -12.682 -22.396 1.00 0.00 H new ATOM 0 HA ILE B 4 31.683 -15.133 -22.041 1.00 0.00 H new ATOM 0 HB ILE B 4 31.572 -12.541 -20.445 1.00 0.00 H new ATOM 0 HG12 ILE B 4 32.535 -12.166 -22.599 1.00 0.00 H new ATOM 0 HG13 ILE B 4 33.851 -12.228 -21.443 1.00 0.00 H new ATOM 0 HG21 ILE B 4 33.604 -13.349 -19.312 1.00 0.00 H new ATOM 0 HG22 ILE B 4 32.207 -14.402 -18.987 1.00 0.00 H new ATOM 0 HG23 ILE B 4 33.450 -14.908 -20.155 1.00 0.00 H new ATOM 0 HD11 ILE B 4 34.420 -13.447 -23.486 1.00 0.00 H new ATOM 0 HD12 ILE B 4 34.334 -14.559 -22.098 1.00 0.00 H new ATOM 0 HD13 ILE B 4 32.998 -14.496 -23.271 1.00 0.00 H new ATOM 1061 N THR B 5 29.394 -14.224 -19.819 1.00 0.00 N ATOM 1062 CA THR B 5 28.533 -14.719 -18.752 1.00 0.00 C ATOM 1063 C THR B 5 27.510 -13.666 -18.338 1.00 0.00 C ATOM 1064 O THR B 5 27.427 -12.597 -18.942 1.00 0.00 O ATOM 1065 CB THR B 5 29.353 -15.135 -17.516 1.00 0.00 C ATOM 1066 OG1 THR B 5 28.545 -15.923 -16.634 1.00 0.00 O ATOM 1067 CG2 THR B 5 29.875 -13.912 -16.776 1.00 0.00 C ATOM 0 H THR B 5 29.241 -13.246 -20.065 1.00 0.00 H new ATOM 0 HA THR B 5 28.013 -15.593 -19.145 1.00 0.00 H new ATOM 0 HB THR B 5 30.204 -15.726 -17.854 1.00 0.00 H new ATOM 0 HG1 THR B 5 28.365 -15.416 -15.815 1.00 0.00 H new ATOM 0 HG21 THR B 5 30.451 -14.231 -15.907 1.00 0.00 H new ATOM 0 HG22 THR B 5 30.513 -13.330 -17.441 1.00 0.00 H new ATOM 0 HG23 THR B 5 29.035 -13.298 -16.450 1.00 0.00 H new ATOM 1075 N SER B 6 26.734 -13.976 -17.305 1.00 0.00 N ATOM 1076 CA SER B 6 25.714 -13.058 -16.812 1.00 0.00 C ATOM 1077 C SER B 6 25.761 -12.959 -15.291 1.00 0.00 C ATOM 1078 O SER B 6 26.184 -13.893 -14.609 1.00 0.00 O ATOM 1079 CB SER B 6 24.325 -13.516 -17.262 1.00 0.00 C ATOM 1080 OG SER B 6 23.745 -14.393 -16.313 1.00 0.00 O ATOM 0 H SER B 6 26.792 -14.856 -16.793 1.00 0.00 H new ATOM 0 HA SER B 6 25.917 -12.072 -17.229 1.00 0.00 H new ATOM 0 HB2 SER B 6 23.680 -12.648 -17.402 1.00 0.00 H new ATOM 0 HB3 SER B 6 24.399 -14.017 -18.227 1.00 0.00 H new ATOM 0 HG SER B 6 22.858 -14.670 -16.623 1.00 0.00 H new ATOM 1086 N PHE B 7 25.323 -11.820 -14.764 1.00 0.00 N ATOM 1087 CA PHE B 7 25.315 -11.597 -13.323 1.00 0.00 C ATOM 1088 C PHE B 7 24.008 -10.945 -12.881 1.00 0.00 C ATOM 1089 O PHE B 7 23.187 -10.552 -13.709 1.00 0.00 O ATOM 1090 CB PHE B 7 26.500 -10.719 -12.916 1.00 0.00 C ATOM 1091 CG PHE B 7 27.824 -11.424 -12.993 1.00 0.00 C ATOM 1092 CD1 PHE B 7 28.288 -12.173 -11.924 1.00 0.00 C ATOM 1093 CD2 PHE B 7 28.604 -11.337 -14.135 1.00 0.00 C ATOM 1094 CE1 PHE B 7 29.506 -12.824 -11.993 1.00 0.00 C ATOM 1095 CE2 PHE B 7 29.822 -11.986 -14.209 1.00 0.00 C ATOM 1096 CZ PHE B 7 30.274 -12.729 -13.136 1.00 0.00 C ATOM 0 H PHE B 7 24.969 -11.037 -15.314 1.00 0.00 H new ATOM 0 HA PHE B 7 25.402 -12.565 -12.829 1.00 0.00 H new ATOM 0 HB2 PHE B 7 26.528 -9.840 -13.559 1.00 0.00 H new ATOM 0 HB3 PHE B 7 26.345 -10.364 -11.897 1.00 0.00 H new ATOM 0 HD1 PHE B 7 27.692 -12.249 -11.027 1.00 0.00 H new ATOM 0 HD2 PHE B 7 28.256 -10.756 -14.976 1.00 0.00 H new ATOM 0 HE1 PHE B 7 29.856 -13.406 -11.153 1.00 0.00 H new ATOM 0 HE2 PHE B 7 30.420 -11.912 -15.105 1.00 0.00 H new ATOM 0 HZ PHE B 7 31.227 -13.235 -13.191 1.00 0.00 H new ATOM 1106 N ALA B 8 23.824 -10.835 -11.569 1.00 0.00 N ATOM 1107 CA ALA B 8 22.618 -10.230 -11.016 1.00 0.00 C ATOM 1108 C ALA B 8 22.965 -9.140 -10.007 1.00 0.00 C ATOM 1109 O ALA B 8 22.185 -8.850 -9.101 1.00 0.00 O ATOM 1110 CB ALA B 8 21.744 -11.293 -10.368 1.00 0.00 C ATOM 0 H ALA B 8 24.494 -11.157 -10.870 1.00 0.00 H new ATOM 0 HA ALA B 8 22.064 -9.769 -11.834 1.00 0.00 H new ATOM 0 HB1 ALA B 8 20.847 -10.827 -9.959 1.00 0.00 H new ATOM 0 HB2 ALA B 8 21.460 -12.035 -11.114 1.00 0.00 H new ATOM 0 HB3 ALA B 8 22.298 -11.780 -9.565 1.00 0.00 H new ATOM 1116 N ASN B 9 24.139 -8.540 -10.171 1.00 0.00 N ATOM 1117 CA ASN B 9 24.589 -7.483 -9.273 1.00 0.00 C ATOM 1118 C ASN B 9 25.592 -6.568 -9.970 1.00 0.00 C ATOM 1119 O ASN B 9 26.439 -7.011 -10.746 1.00 0.00 O ATOM 1120 CB ASN B 9 25.220 -8.086 -8.017 1.00 0.00 C ATOM 1121 CG ASN B 9 24.318 -7.967 -6.803 1.00 0.00 C ATOM 1122 OD1 ASN B 9 23.545 -7.016 -6.681 1.00 0.00 O ATOM 1123 ND2 ASN B 9 24.412 -8.935 -5.899 1.00 0.00 N ATOM 0 H ASN B 9 24.796 -8.768 -10.917 1.00 0.00 H new ATOM 0 HA ASN B 9 23.720 -6.890 -8.986 1.00 0.00 H new ATOM 0 HB2 ASN B 9 25.447 -9.137 -8.196 1.00 0.00 H new ATOM 0 HB3 ASN B 9 26.167 -7.586 -7.813 1.00 0.00 H new ATOM 0 HD21 ASN B 9 23.830 -8.910 -5.062 1.00 0.00 H new ATOM 0 HD22 ASN B 9 25.067 -9.704 -6.042 1.00 0.00 H new ATOM 1130 N PRO B 10 25.495 -5.260 -9.688 1.00 0.00 N ATOM 1131 CA PRO B 10 26.387 -4.255 -10.275 1.00 0.00 C ATOM 1132 C PRO B 10 27.812 -4.365 -9.746 1.00 0.00 C ATOM 1133 O PRO B 10 28.772 -4.375 -10.518 1.00 0.00 O ATOM 1134 CB PRO B 10 25.757 -2.928 -9.845 1.00 0.00 C ATOM 1135 CG PRO B 10 25.003 -3.251 -8.602 1.00 0.00 C ATOM 1136 CD PRO B 10 24.509 -4.662 -8.772 1.00 0.00 C ATOM 0 HA PRO B 10 26.476 -4.370 -11.355 1.00 0.00 H new ATOM 0 HB2 PRO B 10 26.518 -2.170 -9.660 1.00 0.00 H new ATOM 0 HB3 PRO B 10 25.096 -2.535 -10.618 1.00 0.00 H new ATOM 0 HG2 PRO B 10 25.643 -3.165 -7.724 1.00 0.00 H new ATOM 0 HG3 PRO B 10 24.171 -2.561 -8.460 1.00 0.00 H new ATOM 0 HD2 PRO B 10 24.471 -5.192 -7.820 1.00 0.00 H new ATOM 0 HD3 PRO B 10 23.503 -4.688 -9.191 1.00 0.00 H new ATOM 1144 N ARG B 11 27.944 -4.447 -8.426 1.00 0.00 N ATOM 1145 CA ARG B 11 29.254 -4.555 -7.795 1.00 0.00 C ATOM 1146 C ARG B 11 30.048 -5.716 -8.385 1.00 0.00 C ATOM 1147 O ARG B 11 31.242 -5.590 -8.658 1.00 0.00 O ATOM 1148 CB ARG B 11 29.101 -4.743 -6.284 1.00 0.00 C ATOM 1149 CG ARG B 11 28.253 -5.946 -5.903 1.00 0.00 C ATOM 1150 CD ARG B 11 27.448 -5.682 -4.640 1.00 0.00 C ATOM 1151 NE ARG B 11 28.239 -4.998 -3.620 1.00 0.00 N ATOM 1152 CZ ARG B 11 27.716 -4.458 -2.525 1.00 0.00 C ATOM 1153 NH1 ARG B 11 26.409 -4.522 -2.309 1.00 0.00 N ATOM 1154 NH2 ARG B 11 28.501 -3.852 -1.643 1.00 0.00 N ATOM 0 H ARG B 11 27.160 -4.441 -7.773 1.00 0.00 H new ATOM 0 HA ARG B 11 29.799 -3.631 -7.986 1.00 0.00 H new ATOM 0 HB2 ARG B 11 30.090 -4.850 -5.838 1.00 0.00 H new ATOM 0 HB3 ARG B 11 28.654 -3.845 -5.858 1.00 0.00 H new ATOM 0 HG2 ARG B 11 27.577 -6.190 -6.722 1.00 0.00 H new ATOM 0 HG3 ARG B 11 28.896 -6.813 -5.751 1.00 0.00 H new ATOM 0 HD2 ARG B 11 26.574 -5.079 -4.886 1.00 0.00 H new ATOM 0 HD3 ARG B 11 27.080 -6.627 -4.240 1.00 0.00 H new ATOM 0 HE ARG B 11 29.248 -4.931 -3.756 1.00 0.00 H new ATOM 0 HH11 ARG B 11 25.803 -4.987 -2.985 1.00 0.00 H new ATOM 0 HH12 ARG B 11 26.010 -4.106 -1.467 1.00 0.00 H new ATOM 0 HH21 ARG B 11 29.507 -3.801 -1.806 1.00 0.00 H new ATOM 0 HH22 ARG B 11 28.099 -3.438 -0.802 1.00 0.00 H new ATOM 1168 N VAL B 12 29.377 -6.847 -8.580 1.00 0.00 N ATOM 1169 CA VAL B 12 30.020 -8.030 -9.139 1.00 0.00 C ATOM 1170 C VAL B 12 30.407 -7.809 -10.597 1.00 0.00 C ATOM 1171 O VAL B 12 31.564 -7.987 -10.976 1.00 0.00 O ATOM 1172 CB VAL B 12 29.103 -9.264 -9.044 1.00 0.00 C ATOM 1173 CG1 VAL B 12 29.781 -10.481 -9.655 1.00 0.00 C ATOM 1174 CG2 VAL B 12 28.715 -9.529 -7.598 1.00 0.00 C ATOM 0 H VAL B 12 28.389 -6.969 -8.359 1.00 0.00 H new ATOM 0 HA VAL B 12 30.920 -8.209 -8.551 1.00 0.00 H new ATOM 0 HB VAL B 12 28.193 -9.063 -9.609 1.00 0.00 H new ATOM 0 HG11 VAL B 12 29.118 -11.343 -9.579 1.00 0.00 H new ATOM 0 HG12 VAL B 12 30.003 -10.285 -10.704 1.00 0.00 H new ATOM 0 HG13 VAL B 12 30.708 -10.688 -9.120 1.00 0.00 H new ATOM 0 HG21 VAL B 12 28.067 -10.404 -7.550 1.00 0.00 H new ATOM 0 HG22 VAL B 12 29.613 -9.709 -7.007 1.00 0.00 H new ATOM 0 HG23 VAL B 12 28.186 -8.664 -7.199 1.00 0.00 H new ATOM 1184 N ALA B 13 29.431 -7.418 -11.410 1.00 0.00 N ATOM 1185 CA ALA B 13 29.670 -7.170 -12.826 1.00 0.00 C ATOM 1186 C ALA B 13 30.882 -6.267 -13.028 1.00 0.00 C ATOM 1187 O ALA B 13 31.831 -6.634 -13.722 1.00 0.00 O ATOM 1188 CB ALA B 13 28.437 -6.552 -13.469 1.00 0.00 C ATOM 0 H ALA B 13 28.467 -7.266 -11.112 1.00 0.00 H new ATOM 0 HA ALA B 13 29.877 -8.126 -13.307 1.00 0.00 H new ATOM 0 HB1 ALA B 13 28.630 -6.372 -14.527 1.00 0.00 H new ATOM 0 HB2 ALA B 13 27.592 -7.233 -13.365 1.00 0.00 H new ATOM 0 HB3 ALA B 13 28.205 -5.608 -12.977 1.00 0.00 H new ATOM 1194 N GLN B 14 30.844 -5.087 -12.419 1.00 0.00 N ATOM 1195 CA GLN B 14 31.940 -4.132 -12.534 1.00 0.00 C ATOM 1196 C GLN B 14 33.247 -4.741 -12.039 1.00 0.00 C ATOM 1197 O GLN B 14 34.278 -4.649 -12.705 1.00 0.00 O ATOM 1198 CB GLN B 14 31.623 -2.862 -11.742 1.00 0.00 C ATOM 1199 CG GLN B 14 32.802 -1.910 -11.623 1.00 0.00 C ATOM 1200 CD GLN B 14 33.312 -1.440 -12.971 1.00 0.00 C ATOM 1201 OE1 GLN B 14 34.101 -2.125 -13.622 1.00 0.00 O ATOM 1202 NE2 GLN B 14 32.862 -0.266 -13.399 1.00 0.00 N ATOM 0 H GLN B 14 30.066 -4.769 -11.841 1.00 0.00 H new ATOM 0 HA GLN B 14 32.056 -3.876 -13.587 1.00 0.00 H new ATOM 0 HB2 GLN B 14 30.794 -2.342 -12.222 1.00 0.00 H new ATOM 0 HB3 GLN B 14 31.289 -3.141 -10.742 1.00 0.00 H new ATOM 0 HG2 GLN B 14 32.507 -1.045 -11.029 1.00 0.00 H new ATOM 0 HG3 GLN B 14 33.611 -2.405 -11.085 1.00 0.00 H new ATOM 0 HE21 GLN B 14 32.209 0.269 -12.827 1.00 0.00 H new ATOM 0 HE22 GLN B 14 33.170 0.101 -14.300 1.00 0.00 H new ATOM 1211 N ALA B 15 33.197 -5.364 -10.866 1.00 0.00 N ATOM 1212 CA ALA B 15 34.377 -5.990 -10.282 1.00 0.00 C ATOM 1213 C ALA B 15 35.017 -6.972 -11.258 1.00 0.00 C ATOM 1214 O ALA B 15 36.231 -6.961 -11.458 1.00 0.00 O ATOM 1215 CB ALA B 15 34.012 -6.696 -8.984 1.00 0.00 C ATOM 0 H ALA B 15 32.352 -5.449 -10.301 1.00 0.00 H new ATOM 0 HA ALA B 15 35.104 -5.207 -10.065 1.00 0.00 H new ATOM 0 HB1 ALA B 15 34.902 -7.159 -8.559 1.00 0.00 H new ATOM 0 HB2 ALA B 15 33.607 -5.972 -8.277 1.00 0.00 H new ATOM 0 HB3 ALA B 15 33.265 -7.464 -9.185 1.00 0.00 H new ATOM 1221 N PHE B 16 34.192 -7.821 -11.862 1.00 0.00 N ATOM 1222 CA PHE B 16 34.678 -8.811 -12.816 1.00 0.00 C ATOM 1223 C PHE B 16 35.413 -8.137 -13.972 1.00 0.00 C ATOM 1224 O PHE B 16 36.585 -8.417 -14.224 1.00 0.00 O ATOM 1225 CB PHE B 16 33.515 -9.646 -13.354 1.00 0.00 C ATOM 1226 CG PHE B 16 33.354 -10.968 -12.659 1.00 0.00 C ATOM 1227 CD1 PHE B 16 32.617 -11.064 -11.489 1.00 0.00 C ATOM 1228 CD2 PHE B 16 33.938 -12.113 -13.175 1.00 0.00 C ATOM 1229 CE1 PHE B 16 32.468 -12.279 -10.847 1.00 0.00 C ATOM 1230 CE2 PHE B 16 33.792 -13.331 -12.537 1.00 0.00 C ATOM 1231 CZ PHE B 16 33.055 -13.414 -11.372 1.00 0.00 C ATOM 0 H PHE B 16 33.184 -7.843 -11.708 1.00 0.00 H new ATOM 0 HA PHE B 16 35.377 -9.467 -12.297 1.00 0.00 H new ATOM 0 HB2 PHE B 16 32.591 -9.076 -13.252 1.00 0.00 H new ATOM 0 HB3 PHE B 16 33.666 -9.821 -14.419 1.00 0.00 H new ATOM 0 HD1 PHE B 16 32.154 -10.180 -11.075 1.00 0.00 H new ATOM 0 HD2 PHE B 16 34.514 -12.054 -14.086 1.00 0.00 H new ATOM 0 HE1 PHE B 16 31.893 -12.341 -9.935 1.00 0.00 H new ATOM 0 HE2 PHE B 16 34.254 -14.216 -12.949 1.00 0.00 H new ATOM 0 HZ PHE B 16 32.938 -14.364 -10.872 1.00 0.00 H new ATOM 1241 N VAL B 17 34.715 -7.249 -14.672 1.00 0.00 N ATOM 1242 CA VAL B 17 35.299 -6.535 -15.800 1.00 0.00 C ATOM 1243 C VAL B 17 36.482 -5.681 -15.357 1.00 0.00 C ATOM 1244 O VAL B 17 37.338 -5.321 -16.165 1.00 0.00 O ATOM 1245 CB VAL B 17 34.260 -5.633 -16.493 1.00 0.00 C ATOM 1246 CG1 VAL B 17 33.087 -6.459 -16.997 1.00 0.00 C ATOM 1247 CG2 VAL B 17 33.786 -4.542 -15.545 1.00 0.00 C ATOM 0 H VAL B 17 33.743 -7.007 -14.477 1.00 0.00 H new ATOM 0 HA VAL B 17 35.643 -7.289 -16.507 1.00 0.00 H new ATOM 0 HB VAL B 17 34.733 -5.157 -17.352 1.00 0.00 H new ATOM 0 HG11 VAL B 17 32.364 -5.805 -17.483 1.00 0.00 H new ATOM 0 HG12 VAL B 17 33.444 -7.200 -17.712 1.00 0.00 H new ATOM 0 HG13 VAL B 17 32.611 -6.965 -16.157 1.00 0.00 H new ATOM 0 HG21 VAL B 17 33.053 -3.914 -16.051 1.00 0.00 H new ATOM 0 HG22 VAL B 17 33.330 -4.997 -14.666 1.00 0.00 H new ATOM 0 HG23 VAL B 17 34.636 -3.932 -15.238 1.00 0.00 H new ATOM 1257 N ASP B 18 36.523 -5.360 -14.069 1.00 0.00 N ATOM 1258 CA ASP B 18 37.602 -4.549 -13.517 1.00 0.00 C ATOM 1259 C ASP B 18 38.914 -5.328 -13.502 1.00 0.00 C ATOM 1260 O ASP B 18 39.899 -4.917 -14.117 1.00 0.00 O ATOM 1261 CB ASP B 18 37.251 -4.091 -12.101 1.00 0.00 C ATOM 1262 CG ASP B 18 38.202 -3.030 -11.583 1.00 0.00 C ATOM 1263 OD1 ASP B 18 37.968 -1.835 -11.863 1.00 0.00 O ATOM 1264 OD2 ASP B 18 39.181 -3.394 -10.898 1.00 0.00 O ATOM 0 H ASP B 18 35.821 -5.649 -13.387 1.00 0.00 H new ATOM 0 HA ASP B 18 37.727 -3.673 -14.153 1.00 0.00 H new ATOM 0 HB2 ASP B 18 36.234 -3.699 -12.091 1.00 0.00 H new ATOM 0 HB3 ASP B 18 37.269 -4.950 -11.430 1.00 0.00 H new ATOM 1269 N TYR B 19 38.920 -6.453 -12.796 1.00 0.00 N ATOM 1270 CA TYR B 19 40.112 -7.287 -12.698 1.00 0.00 C ATOM 1271 C TYR B 19 40.511 -7.830 -14.067 1.00 0.00 C ATOM 1272 O TYR B 19 41.691 -8.045 -14.342 1.00 0.00 O ATOM 1273 CB TYR B 19 39.871 -8.446 -11.728 1.00 0.00 C ATOM 1274 CG TYR B 19 39.250 -9.661 -12.379 1.00 0.00 C ATOM 1275 CD1 TYR B 19 40.005 -10.504 -13.186 1.00 0.00 C ATOM 1276 CD2 TYR B 19 37.909 -9.967 -12.187 1.00 0.00 C ATOM 1277 CE1 TYR B 19 39.442 -11.615 -13.783 1.00 0.00 C ATOM 1278 CE2 TYR B 19 37.337 -11.077 -12.779 1.00 0.00 C ATOM 1279 CZ TYR B 19 38.108 -11.897 -13.576 1.00 0.00 C ATOM 1280 OH TYR B 19 37.544 -13.004 -14.168 1.00 0.00 O ATOM 0 H TYR B 19 38.113 -6.808 -12.283 1.00 0.00 H new ATOM 0 HA TYR B 19 40.927 -6.669 -12.320 1.00 0.00 H new ATOM 0 HB2 TYR B 19 40.820 -8.732 -11.274 1.00 0.00 H new ATOM 0 HB3 TYR B 19 39.222 -8.105 -10.921 1.00 0.00 H new ATOM 0 HD1 TYR B 19 41.050 -10.286 -13.349 1.00 0.00 H new ATOM 0 HD2 TYR B 19 37.303 -9.326 -11.564 1.00 0.00 H new ATOM 0 HE1 TYR B 19 40.043 -12.259 -14.408 1.00 0.00 H new ATOM 0 HE2 TYR B 19 36.293 -11.301 -12.619 1.00 0.00 H new ATOM 0 HH TYR B 19 37.654 -12.947 -15.140 1.00 0.00 H new ATOM 1290 N MET B 20 39.517 -8.049 -14.922 1.00 0.00 N ATOM 1291 CA MET B 20 39.764 -8.564 -16.264 1.00 0.00 C ATOM 1292 C MET B 20 40.343 -7.479 -17.165 1.00 0.00 C ATOM 1293 O MET B 20 41.214 -7.746 -17.993 1.00 0.00 O ATOM 1294 CB MET B 20 38.469 -9.109 -16.870 1.00 0.00 C ATOM 1295 CG MET B 20 38.683 -10.300 -17.790 1.00 0.00 C ATOM 1296 SD MET B 20 38.398 -11.877 -16.963 1.00 0.00 S ATOM 1297 CE MET B 20 40.004 -12.650 -17.146 1.00 0.00 C ATOM 0 H MET B 20 38.534 -7.878 -14.710 1.00 0.00 H new ATOM 0 HA MET B 20 40.490 -9.373 -16.188 1.00 0.00 H new ATOM 0 HB2 MET B 20 37.794 -9.399 -16.064 1.00 0.00 H new ATOM 0 HB3 MET B 20 37.976 -8.313 -17.428 1.00 0.00 H new ATOM 0 HG2 MET B 20 38.014 -10.217 -18.647 1.00 0.00 H new ATOM 0 HG3 MET B 20 39.701 -10.276 -18.178 1.00 0.00 H new ATOM 0 HE1 MET B 20 39.895 -13.733 -17.089 1.00 0.00 H new ATOM 0 HE2 MET B 20 40.431 -12.378 -18.112 1.00 0.00 H new ATOM 0 HE3 MET B 20 40.665 -12.309 -16.349 1.00 0.00 H new ATOM 1307 N ALA B 21 39.854 -6.254 -16.999 1.00 0.00 N ATOM 1308 CA ALA B 21 40.325 -5.129 -17.797 1.00 0.00 C ATOM 1309 C ALA B 21 41.780 -4.802 -17.480 1.00 0.00 C ATOM 1310 O ALA B 21 42.575 -4.521 -18.378 1.00 0.00 O ATOM 1311 CB ALA B 21 39.445 -3.910 -17.562 1.00 0.00 C ATOM 0 H ALA B 21 39.132 -6.016 -16.319 1.00 0.00 H new ATOM 0 HA ALA B 21 40.264 -5.411 -18.848 1.00 0.00 H new ATOM 0 HB1 ALA B 21 39.808 -3.077 -18.164 1.00 0.00 H new ATOM 0 HB2 ALA B 21 38.418 -4.142 -17.846 1.00 0.00 H new ATOM 0 HB3 ALA B 21 39.477 -3.636 -16.507 1.00 0.00 H new ATOM 1317 N THR B 22 42.125 -4.841 -16.197 1.00 0.00 N ATOM 1318 CA THR B 22 43.484 -4.547 -15.761 1.00 0.00 C ATOM 1319 C THR B 22 44.434 -5.685 -16.118 1.00 0.00 C ATOM 1320 O THR B 22 45.653 -5.531 -16.049 1.00 0.00 O ATOM 1321 CB THR B 22 43.546 -4.299 -14.242 1.00 0.00 C ATOM 1322 OG1 THR B 22 44.891 -4.004 -13.848 1.00 0.00 O ATOM 1323 CG2 THR B 22 43.042 -5.512 -13.475 1.00 0.00 C ATOM 0 H THR B 22 41.481 -5.074 -15.441 1.00 0.00 H new ATOM 0 HA THR B 22 43.794 -3.641 -16.282 1.00 0.00 H new ATOM 0 HB THR B 22 42.905 -3.449 -14.008 1.00 0.00 H new ATOM 0 HG1 THR B 22 45.510 -4.307 -14.545 1.00 0.00 H new ATOM 0 HG21 THR B 22 43.095 -5.313 -12.405 1.00 0.00 H new ATOM 0 HG22 THR B 22 42.009 -5.716 -13.755 1.00 0.00 H new ATOM 0 HG23 THR B 22 43.661 -6.377 -13.715 1.00 0.00 H new ATOM 1331 N GLN B 23 43.867 -6.825 -16.500 1.00 0.00 N ATOM 1332 CA GLN B 23 44.665 -7.988 -16.867 1.00 0.00 C ATOM 1333 C GLN B 23 44.983 -7.981 -18.359 1.00 0.00 C ATOM 1334 O GLN B 23 45.665 -8.872 -18.863 1.00 0.00 O ATOM 1335 CB GLN B 23 43.928 -9.276 -16.497 1.00 0.00 C ATOM 1336 CG GLN B 23 44.103 -9.680 -15.042 1.00 0.00 C ATOM 1337 CD GLN B 23 45.519 -10.118 -14.723 1.00 0.00 C ATOM 1338 OE1 GLN B 23 45.874 -11.284 -14.898 1.00 0.00 O ATOM 1339 NE2 GLN B 23 46.337 -9.184 -14.253 1.00 0.00 N ATOM 0 H GLN B 23 42.859 -6.968 -16.563 1.00 0.00 H new ATOM 0 HA GLN B 23 45.603 -7.943 -16.314 1.00 0.00 H new ATOM 0 HB2 GLN B 23 42.866 -9.150 -16.705 1.00 0.00 H new ATOM 0 HB3 GLN B 23 44.284 -10.085 -17.135 1.00 0.00 H new ATOM 0 HG2 GLN B 23 43.834 -8.840 -14.401 1.00 0.00 H new ATOM 0 HG3 GLN B 23 43.415 -10.492 -14.809 1.00 0.00 H new ATOM 0 HE21 GLN B 23 46.001 -8.230 -14.123 1.00 0.00 H new ATOM 0 HE22 GLN B 23 47.302 -9.421 -14.021 1.00 0.00 H new ATOM 1348 N GLY B 24 44.482 -6.969 -19.061 1.00 0.00 N ATOM 1349 CA GLY B 24 44.722 -6.866 -20.489 1.00 0.00 C ATOM 1350 C GLY B 24 43.533 -7.320 -21.311 1.00 0.00 C ATOM 1351 O GLY B 24 43.544 -7.221 -22.538 1.00 0.00 O ATOM 0 H GLY B 24 43.914 -6.219 -18.667 1.00 0.00 H new ATOM 0 HA2 GLY B 24 44.960 -5.833 -20.741 1.00 0.00 H new ATOM 0 HA3 GLY B 24 45.592 -7.467 -20.752 1.00 0.00 H new ATOM 1355 N VAL B 25 42.504 -7.820 -20.635 1.00 0.00 N ATOM 1356 CA VAL B 25 41.301 -8.292 -21.311 1.00 0.00 C ATOM 1357 C VAL B 25 40.132 -7.342 -21.079 1.00 0.00 C ATOM 1358 O VAL B 25 39.633 -7.218 -19.960 1.00 0.00 O ATOM 1359 CB VAL B 25 40.906 -9.702 -20.835 1.00 0.00 C ATOM 1360 CG1 VAL B 25 39.853 -10.301 -21.755 1.00 0.00 C ATOM 1361 CG2 VAL B 25 42.131 -10.600 -20.757 1.00 0.00 C ATOM 0 H VAL B 25 42.479 -7.909 -19.619 1.00 0.00 H new ATOM 0 HA VAL B 25 41.530 -8.328 -22.376 1.00 0.00 H new ATOM 0 HB VAL B 25 40.478 -9.623 -19.836 1.00 0.00 H new ATOM 0 HG11 VAL B 25 39.586 -11.297 -21.403 1.00 0.00 H new ATOM 0 HG12 VAL B 25 38.966 -9.667 -21.755 1.00 0.00 H new ATOM 0 HG13 VAL B 25 40.251 -10.369 -22.768 1.00 0.00 H new ATOM 0 HG21 VAL B 25 41.834 -11.593 -20.419 1.00 0.00 H new ATOM 0 HG22 VAL B 25 42.591 -10.675 -21.743 1.00 0.00 H new ATOM 0 HG23 VAL B 25 42.848 -10.177 -20.054 1.00 0.00 H new ATOM 1371 N ILE B 26 39.699 -6.674 -22.143 1.00 0.00 N ATOM 1372 CA ILE B 26 38.586 -5.736 -22.054 1.00 0.00 C ATOM 1373 C ILE B 26 37.248 -6.465 -22.096 1.00 0.00 C ATOM 1374 O ILE B 26 37.025 -7.328 -22.947 1.00 0.00 O ATOM 1375 CB ILE B 26 38.630 -4.701 -23.195 1.00 0.00 C ATOM 1376 CG1 ILE B 26 39.935 -3.904 -23.139 1.00 0.00 C ATOM 1377 CG2 ILE B 26 37.430 -3.770 -23.111 1.00 0.00 C ATOM 1378 CD1 ILE B 26 40.137 -3.165 -21.834 1.00 0.00 C ATOM 0 H ILE B 26 40.101 -6.765 -23.076 1.00 0.00 H new ATOM 0 HA ILE B 26 38.685 -5.218 -21.100 1.00 0.00 H new ATOM 0 HB ILE B 26 38.589 -5.229 -24.148 1.00 0.00 H new ATOM 0 HG12 ILE B 26 40.773 -4.583 -23.296 1.00 0.00 H new ATOM 0 HG13 ILE B 26 39.948 -3.186 -23.959 1.00 0.00 H new ATOM 0 HG21 ILE B 26 37.475 -3.045 -23.923 1.00 0.00 H new ATOM 0 HG22 ILE B 26 36.512 -4.352 -23.194 1.00 0.00 H new ATOM 0 HG23 ILE B 26 37.442 -3.246 -22.155 1.00 0.00 H new ATOM 0 HD11 ILE B 26 41.082 -2.622 -21.866 1.00 0.00 H new ATOM 0 HD12 ILE B 26 39.319 -2.461 -21.684 1.00 0.00 H new ATOM 0 HD13 ILE B 26 40.156 -3.879 -21.011 1.00 0.00 H new ATOM 1390 N LEU B 27 36.359 -6.112 -21.174 1.00 0.00 N ATOM 1391 CA LEU B 27 35.040 -6.732 -21.106 1.00 0.00 C ATOM 1392 C LEU B 27 33.940 -5.677 -21.150 1.00 0.00 C ATOM 1393 O LEU B 27 34.183 -4.499 -20.885 1.00 0.00 O ATOM 1394 CB LEU B 27 34.912 -7.566 -19.830 1.00 0.00 C ATOM 1395 CG LEU B 27 35.309 -9.038 -19.947 1.00 0.00 C ATOM 1396 CD1 LEU B 27 34.215 -9.832 -20.644 1.00 0.00 C ATOM 1397 CD2 LEU B 27 36.628 -9.177 -20.693 1.00 0.00 C ATOM 0 H LEU B 27 36.527 -5.400 -20.463 1.00 0.00 H new ATOM 0 HA LEU B 27 34.927 -7.384 -21.972 1.00 0.00 H new ATOM 0 HB2 LEU B 27 35.526 -7.105 -19.056 1.00 0.00 H new ATOM 0 HB3 LEU B 27 33.878 -7.515 -19.489 1.00 0.00 H new ATOM 0 HG LEU B 27 35.438 -9.440 -18.942 1.00 0.00 H new ATOM 0 HD11 LEU B 27 34.515 -10.877 -20.718 1.00 0.00 H new ATOM 0 HD12 LEU B 27 33.291 -9.760 -20.070 1.00 0.00 H new ATOM 0 HD13 LEU B 27 34.054 -9.429 -21.644 1.00 0.00 H new ATOM 0 HD21 LEU B 27 36.895 -10.231 -20.767 1.00 0.00 H new ATOM 0 HD22 LEU B 27 36.526 -8.758 -21.694 1.00 0.00 H new ATOM 0 HD23 LEU B 27 37.409 -8.642 -20.153 1.00 0.00 H new ATOM 1409 N THR B 28 32.727 -6.107 -21.484 1.00 0.00 N ATOM 1410 CA THR B 28 31.589 -5.200 -21.562 1.00 0.00 C ATOM 1411 C THR B 28 30.424 -5.706 -20.720 1.00 0.00 C ATOM 1412 O THR B 28 30.164 -6.909 -20.662 1.00 0.00 O ATOM 1413 CB THR B 28 31.115 -5.016 -23.016 1.00 0.00 C ATOM 1414 OG1 THR B 28 32.115 -5.497 -23.922 1.00 0.00 O ATOM 1415 CG2 THR B 28 30.820 -3.553 -23.309 1.00 0.00 C ATOM 0 H THR B 28 32.508 -7.078 -21.705 1.00 0.00 H new ATOM 0 HA THR B 28 31.924 -4.239 -21.173 1.00 0.00 H new ATOM 0 HB THR B 28 30.197 -5.589 -23.150 1.00 0.00 H new ATOM 0 HG1 THR B 28 32.151 -6.475 -23.880 1.00 0.00 H new ATOM 0 HG21 THR B 28 30.487 -3.449 -24.342 1.00 0.00 H new ATOM 0 HG22 THR B 28 30.038 -3.198 -22.638 1.00 0.00 H new ATOM 0 HG23 THR B 28 31.723 -2.962 -23.158 1.00 0.00 H new ATOM 1423 N ILE B 29 29.725 -4.783 -20.069 1.00 0.00 N ATOM 1424 CA ILE B 29 28.586 -5.137 -19.231 1.00 0.00 C ATOM 1425 C ILE B 29 27.306 -4.482 -19.738 1.00 0.00 C ATOM 1426 O ILE B 29 27.325 -3.350 -20.220 1.00 0.00 O ATOM 1427 CB ILE B 29 28.815 -4.722 -17.765 1.00 0.00 C ATOM 1428 CG1 ILE B 29 30.004 -5.485 -17.176 1.00 0.00 C ATOM 1429 CG2 ILE B 29 27.560 -4.971 -16.942 1.00 0.00 C ATOM 1430 CD1 ILE B 29 29.740 -6.962 -16.985 1.00 0.00 C ATOM 0 H ILE B 29 29.927 -3.784 -20.106 1.00 0.00 H new ATOM 0 HA ILE B 29 28.482 -6.221 -19.282 1.00 0.00 H new ATOM 0 HB ILE B 29 29.040 -3.656 -17.736 1.00 0.00 H new ATOM 0 HG12 ILE B 29 30.866 -5.360 -17.831 1.00 0.00 H new ATOM 0 HG13 ILE B 29 30.268 -5.044 -16.215 1.00 0.00 H new ATOM 0 HG21 ILE B 29 27.737 -4.673 -15.909 1.00 0.00 H new ATOM 0 HG22 ILE B 29 26.735 -4.388 -17.351 1.00 0.00 H new ATOM 0 HG23 ILE B 29 27.307 -6.031 -16.976 1.00 0.00 H new ATOM 0 HD11 ILE B 29 30.625 -7.438 -16.564 1.00 0.00 H new ATOM 0 HD12 ILE B 29 28.898 -7.096 -16.306 1.00 0.00 H new ATOM 0 HD13 ILE B 29 29.506 -7.417 -17.947 1.00 0.00 H new ATOM 1442 N GLN B 30 26.195 -5.203 -19.625 1.00 0.00 N ATOM 1443 CA GLN B 30 24.904 -4.691 -20.072 1.00 0.00 C ATOM 1444 C GLN B 30 23.891 -4.701 -18.933 1.00 0.00 C ATOM 1445 O GLN B 30 23.360 -5.750 -18.571 1.00 0.00 O ATOM 1446 CB GLN B 30 24.380 -5.523 -21.244 1.00 0.00 C ATOM 1447 CG GLN B 30 24.604 -4.874 -22.600 1.00 0.00 C ATOM 1448 CD GLN B 30 23.307 -4.537 -23.307 1.00 0.00 C ATOM 1449 OE1 GLN B 30 22.626 -5.418 -23.833 1.00 0.00 O ATOM 1450 NE2 GLN B 30 22.957 -3.256 -23.325 1.00 0.00 N ATOM 0 H GLN B 30 26.162 -6.142 -19.228 1.00 0.00 H new ATOM 0 HA GLN B 30 25.044 -3.661 -20.400 1.00 0.00 H new ATOM 0 HB2 GLN B 30 24.867 -6.498 -21.233 1.00 0.00 H new ATOM 0 HB3 GLN B 30 23.313 -5.698 -21.106 1.00 0.00 H new ATOM 0 HG2 GLN B 30 25.190 -3.964 -22.471 1.00 0.00 H new ATOM 0 HG3 GLN B 30 25.191 -5.545 -23.227 1.00 0.00 H new ATOM 0 HE21 GLN B 30 23.551 -2.559 -22.876 1.00 0.00 H new ATOM 0 HE22 GLN B 30 22.094 -2.970 -23.787 1.00 0.00 H new ATOM 1459 N GLN B 31 23.628 -3.525 -18.371 1.00 0.00 N ATOM 1460 CA GLN B 31 22.679 -3.399 -17.271 1.00 0.00 C ATOM 1461 C GLN B 31 21.251 -3.289 -17.795 1.00 0.00 C ATOM 1462 O GLN B 31 20.951 -2.444 -18.639 1.00 0.00 O ATOM 1463 CB GLN B 31 23.016 -2.177 -16.416 1.00 0.00 C ATOM 1464 CG GLN B 31 23.415 -2.524 -14.990 1.00 0.00 C ATOM 1465 CD GLN B 31 23.772 -1.300 -14.170 1.00 0.00 C ATOM 1466 OE1 GLN B 31 23.193 -1.058 -13.110 1.00 0.00 O ATOM 1467 NE2 GLN B 31 24.730 -0.520 -14.656 1.00 0.00 N ATOM 0 H GLN B 31 24.059 -2.646 -18.659 1.00 0.00 H new ATOM 0 HA GLN B 31 22.753 -4.296 -16.656 1.00 0.00 H new ATOM 0 HB2 GLN B 31 23.829 -1.626 -16.888 1.00 0.00 H new ATOM 0 HB3 GLN B 31 22.153 -1.512 -16.391 1.00 0.00 H new ATOM 0 HG2 GLN B 31 22.595 -3.054 -14.506 1.00 0.00 H new ATOM 0 HG3 GLN B 31 24.267 -3.204 -15.010 1.00 0.00 H new ATOM 0 HE21 GLN B 31 25.183 -0.758 -15.538 1.00 0.00 H new ATOM 0 HE22 GLN B 31 25.013 0.318 -14.147 1.00 0.00 H new ATOM 1476 N HIS B 32 20.372 -4.149 -17.289 1.00 0.00 N ATOM 1477 CA HIS B 32 18.974 -4.148 -17.706 1.00 0.00 C ATOM 1478 C HIS B 32 18.169 -3.130 -16.904 1.00 0.00 C ATOM 1479 O HIS B 32 18.729 -2.342 -16.143 1.00 0.00 O ATOM 1480 CB HIS B 32 18.369 -5.542 -17.538 1.00 0.00 C ATOM 1481 CG HIS B 32 19.142 -6.618 -18.237 1.00 0.00 C ATOM 1482 ND1 HIS B 32 18.864 -7.961 -18.089 1.00 0.00 N ATOM 1483 CD2 HIS B 32 20.187 -6.544 -19.093 1.00 0.00 C ATOM 1484 CE1 HIS B 32 19.706 -8.666 -18.822 1.00 0.00 C ATOM 1485 NE2 HIS B 32 20.520 -7.830 -19.442 1.00 0.00 N ATOM 0 H HIS B 32 20.603 -4.855 -16.590 1.00 0.00 H new ATOM 0 HA HIS B 32 18.934 -3.868 -18.759 1.00 0.00 H new ATOM 0 HB2 HIS B 32 18.312 -5.779 -16.476 1.00 0.00 H new ATOM 0 HB3 HIS B 32 17.348 -5.534 -17.918 1.00 0.00 H new ATOM 0 HD2 HIS B 32 20.670 -5.641 -19.438 1.00 0.00 H new ATOM 0 HE1 HIS B 32 19.726 -9.743 -18.901 1.00 0.00 H new ATOM 0 HE2 HIS B 32 21.273 -8.096 -20.076 1.00 0.00 H new ATOM 1493 N ASN B 33 16.852 -3.154 -17.080 1.00 0.00 N ATOM 1494 CA ASN B 33 15.969 -2.233 -16.373 1.00 0.00 C ATOM 1495 C ASN B 33 14.511 -2.481 -16.747 1.00 0.00 C ATOM 1496 O ASN B 33 14.083 -2.169 -17.858 1.00 0.00 O ATOM 1497 CB ASN B 33 16.349 -0.785 -16.691 1.00 0.00 C ATOM 1498 CG ASN B 33 16.677 0.014 -15.445 1.00 0.00 C ATOM 1499 OD1 ASN B 33 15.864 0.112 -14.525 1.00 0.00 O ATOM 1500 ND2 ASN B 33 17.872 0.591 -15.409 1.00 0.00 N ATOM 0 H ASN B 33 16.373 -3.801 -17.706 1.00 0.00 H new ATOM 0 HA ASN B 33 16.086 -2.407 -15.303 1.00 0.00 H new ATOM 0 HB2 ASN B 33 17.209 -0.777 -17.361 1.00 0.00 H new ATOM 0 HB3 ASN B 33 15.527 -0.305 -17.221 1.00 0.00 H new ATOM 0 HD21 ASN B 33 18.148 1.142 -14.596 1.00 0.00 H new ATOM 0 HD22 ASN B 33 18.514 0.483 -16.194 1.00 0.00 H new ATOM 1507 N GLN B 34 13.754 -3.045 -15.811 1.00 0.00 N ATOM 1508 CA GLN B 34 12.344 -3.335 -16.042 1.00 0.00 C ATOM 1509 C GLN B 34 11.486 -2.820 -14.891 1.00 0.00 C ATOM 1510 O GLN B 34 11.986 -2.169 -13.975 1.00 0.00 O ATOM 1511 CB GLN B 34 12.134 -4.840 -16.217 1.00 0.00 C ATOM 1512 CG GLN B 34 12.841 -5.417 -17.433 1.00 0.00 C ATOM 1513 CD GLN B 34 11.891 -6.121 -18.382 1.00 0.00 C ATOM 1514 OE1 GLN B 34 10.732 -5.730 -18.520 1.00 0.00 O ATOM 1515 NE2 GLN B 34 12.379 -7.165 -19.041 1.00 0.00 N ATOM 0 H GLN B 34 14.093 -3.310 -14.886 1.00 0.00 H new ATOM 0 HA GLN B 34 12.039 -2.824 -16.955 1.00 0.00 H new ATOM 0 HB2 GLN B 34 12.488 -5.354 -15.323 1.00 0.00 H new ATOM 0 HB3 GLN B 34 11.066 -5.042 -16.298 1.00 0.00 H new ATOM 0 HG2 GLN B 34 13.352 -4.615 -17.966 1.00 0.00 H new ATOM 0 HG3 GLN B 34 13.606 -6.120 -17.104 1.00 0.00 H new ATOM 0 HE21 GLN B 34 13.346 -7.453 -18.895 1.00 0.00 H new ATOM 0 HE22 GLN B 34 11.787 -7.679 -19.693 1.00 0.00 H new ATOM 1524 N SER B 35 10.191 -3.116 -14.946 1.00 0.00 N ATOM 1525 CA SER B 35 9.263 -2.679 -13.910 1.00 0.00 C ATOM 1526 C SER B 35 7.963 -3.476 -13.975 1.00 0.00 C ATOM 1527 O SER B 35 7.102 -3.212 -14.814 1.00 0.00 O ATOM 1528 CB SER B 35 8.967 -1.185 -14.058 1.00 0.00 C ATOM 1529 OG SER B 35 10.099 -0.405 -13.717 1.00 0.00 O ATOM 0 H SER B 35 9.761 -3.656 -15.697 1.00 0.00 H new ATOM 0 HA SER B 35 9.729 -2.855 -12.941 1.00 0.00 H new ATOM 0 HB2 SER B 35 8.669 -0.970 -15.084 1.00 0.00 H new ATOM 0 HB3 SER B 35 8.127 -0.912 -13.419 1.00 0.00 H new ATOM 0 HG SER B 35 10.828 -0.994 -13.430 1.00 0.00 H new ATOM 1535 N ASP B 36 7.829 -4.451 -13.083 1.00 0.00 N ATOM 1536 CA ASP B 36 6.635 -5.286 -13.036 1.00 0.00 C ATOM 1537 C ASP B 36 5.568 -4.659 -12.144 1.00 0.00 C ATOM 1538 O ASP B 36 5.832 -4.310 -10.994 1.00 0.00 O ATOM 1539 CB ASP B 36 6.985 -6.685 -12.528 1.00 0.00 C ATOM 1540 CG ASP B 36 5.797 -7.386 -11.898 1.00 0.00 C ATOM 1541 OD1 ASP B 36 4.684 -7.281 -12.453 1.00 0.00 O ATOM 1542 OD2 ASP B 36 5.981 -8.039 -10.849 1.00 0.00 O ATOM 0 H ASP B 36 8.533 -4.683 -12.382 1.00 0.00 H new ATOM 0 HA ASP B 36 6.237 -5.365 -14.047 1.00 0.00 H new ATOM 0 HB2 ASP B 36 7.360 -7.286 -13.356 1.00 0.00 H new ATOM 0 HB3 ASP B 36 7.790 -6.612 -11.797 1.00 0.00 H new ATOM 1547 N VAL B 37 4.361 -4.518 -12.683 1.00 0.00 N ATOM 1548 CA VAL B 37 3.254 -3.934 -11.937 1.00 0.00 C ATOM 1549 C VAL B 37 2.338 -5.015 -11.374 1.00 0.00 C ATOM 1550 O VAL B 37 1.792 -5.829 -12.118 1.00 0.00 O ATOM 1551 CB VAL B 37 2.423 -2.982 -12.818 1.00 0.00 C ATOM 1552 CG1 VAL B 37 1.515 -2.115 -11.959 1.00 0.00 C ATOM 1553 CG2 VAL B 37 3.336 -2.122 -13.680 1.00 0.00 C ATOM 0 H VAL B 37 4.126 -4.801 -13.634 1.00 0.00 H new ATOM 0 HA VAL B 37 3.692 -3.368 -11.115 1.00 0.00 H new ATOM 0 HB VAL B 37 1.795 -3.580 -13.478 1.00 0.00 H new ATOM 0 HG11 VAL B 37 0.936 -1.449 -12.599 1.00 0.00 H new ATOM 0 HG12 VAL B 37 0.837 -2.751 -11.389 1.00 0.00 H new ATOM 0 HG13 VAL B 37 2.120 -1.523 -11.273 1.00 0.00 H new ATOM 0 HG21 VAL B 37 2.733 -1.455 -14.296 1.00 0.00 H new ATOM 0 HG22 VAL B 37 3.991 -1.531 -13.039 1.00 0.00 H new ATOM 0 HG23 VAL B 37 3.940 -2.763 -14.323 1.00 0.00 H new ATOM 1563 N TRP B 38 2.176 -5.017 -10.056 1.00 0.00 N ATOM 1564 CA TRP B 38 1.326 -5.999 -9.392 1.00 0.00 C ATOM 1565 C TRP B 38 0.339 -5.318 -8.451 1.00 0.00 C ATOM 1566 O TRP B 38 0.689 -4.365 -7.753 1.00 0.00 O ATOM 1567 CB TRP B 38 2.181 -7.003 -8.616 1.00 0.00 C ATOM 1568 CG TRP B 38 3.530 -6.469 -8.241 1.00 0.00 C ATOM 1569 CD1 TRP B 38 4.496 -6.013 -9.092 1.00 0.00 C ATOM 1570 CD2 TRP B 38 4.062 -6.337 -6.919 1.00 0.00 C ATOM 1571 NE1 TRP B 38 5.597 -5.606 -8.378 1.00 0.00 N ATOM 1572 CE2 TRP B 38 5.356 -5.794 -7.043 1.00 0.00 C ATOM 1573 CE3 TRP B 38 3.572 -6.623 -5.642 1.00 0.00 C ATOM 1574 CZ2 TRP B 38 6.163 -5.533 -5.938 1.00 0.00 C ATOM 1575 CZ3 TRP B 38 4.374 -6.365 -4.547 1.00 0.00 C ATOM 1576 CH2 TRP B 38 5.657 -5.824 -4.700 1.00 0.00 C ATOM 0 H TRP B 38 2.622 -4.350 -9.426 1.00 0.00 H new ATOM 0 HA TRP B 38 0.761 -6.530 -10.158 1.00 0.00 H new ATOM 0 HB2 TRP B 38 1.650 -7.298 -7.711 1.00 0.00 H new ATOM 0 HB3 TRP B 38 2.309 -7.903 -9.218 1.00 0.00 H new ATOM 0 HD1 TRP B 38 4.407 -5.978 -10.168 1.00 0.00 H new ATOM 0 HE1 TRP B 38 6.455 -5.225 -8.777 1.00 0.00 H new ATOM 0 HE3 TRP B 38 2.583 -7.039 -5.513 1.00 0.00 H new ATOM 0 HZ2 TRP B 38 7.152 -5.116 -6.054 1.00 0.00 H new ATOM 0 HZ3 TRP B 38 4.005 -6.584 -3.556 1.00 0.00 H new ATOM 0 HH2 TRP B 38 6.259 -5.633 -3.824 1.00 0.00 H new ATOM 1587 N LEU B 39 -0.894 -5.811 -8.436 1.00 0.00 N ATOM 1588 CA LEU B 39 -1.933 -5.249 -7.579 1.00 0.00 C ATOM 1589 C LEU B 39 -2.251 -6.189 -6.421 1.00 0.00 C ATOM 1590 O LEU B 39 -2.037 -7.397 -6.513 1.00 0.00 O ATOM 1591 CB LEU B 39 -3.199 -4.975 -8.391 1.00 0.00 C ATOM 1592 CG LEU B 39 -4.422 -4.517 -7.595 1.00 0.00 C ATOM 1593 CD1 LEU B 39 -4.162 -3.166 -6.947 1.00 0.00 C ATOM 1594 CD2 LEU B 39 -5.649 -4.454 -8.492 1.00 0.00 C ATOM 0 H LEU B 39 -1.199 -6.599 -9.007 1.00 0.00 H new ATOM 0 HA LEU B 39 -1.562 -4.310 -7.169 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -2.970 -4.214 -9.137 1.00 0.00 H new ATOM 0 HB3 LEU B 39 -3.463 -5.883 -8.933 1.00 0.00 H new ATOM 0 HG LEU B 39 -4.611 -5.244 -6.806 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -5.043 -2.856 -6.385 1.00 0.00 H new ATOM 0 HD12 LEU B 39 -3.310 -3.244 -6.272 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -3.946 -2.428 -7.719 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -6.510 -4.126 -7.909 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -5.471 -3.748 -9.303 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -5.847 -5.442 -8.907 1.00 0.00 H new ATOM 1606 N ALA B 40 -2.766 -5.626 -5.333 1.00 0.00 N ATOM 1607 CA ALA B 40 -3.119 -6.415 -4.159 1.00 0.00 C ATOM 1608 C ALA B 40 -4.629 -6.600 -4.055 1.00 0.00 C ATOM 1609 O ALA B 40 -5.105 -7.611 -3.539 1.00 0.00 O ATOM 1610 CB ALA B 40 -2.578 -5.755 -2.898 1.00 0.00 C ATOM 0 H ALA B 40 -2.948 -4.627 -5.240 1.00 0.00 H new ATOM 0 HA ALA B 40 -2.665 -7.401 -4.264 1.00 0.00 H new ATOM 0 HB1 ALA B 40 -2.849 -6.354 -2.029 1.00 0.00 H new ATOM 0 HB2 ALA B 40 -1.493 -5.680 -2.963 1.00 0.00 H new ATOM 0 HB3 ALA B 40 -3.005 -4.757 -2.798 1.00 0.00 H new ATOM 1616 N ASP B 41 -5.376 -5.619 -4.548 1.00 0.00 N ATOM 1617 CA ASP B 41 -6.832 -5.674 -4.511 1.00 0.00 C ATOM 1618 C ASP B 41 -7.385 -6.311 -5.783 1.00 0.00 C ATOM 1619 O ASP B 41 -7.619 -5.627 -6.778 1.00 0.00 O ATOM 1620 CB ASP B 41 -7.413 -4.271 -4.335 1.00 0.00 C ATOM 1621 CG ASP B 41 -8.885 -4.294 -3.972 1.00 0.00 C ATOM 1622 OD1 ASP B 41 -9.642 -5.054 -4.612 1.00 0.00 O ATOM 1623 OD2 ASP B 41 -9.281 -3.552 -3.048 1.00 0.00 O ATOM 0 H ASP B 41 -4.997 -4.775 -4.978 1.00 0.00 H new ATOM 0 HA ASP B 41 -7.125 -6.289 -3.661 1.00 0.00 H new ATOM 0 HB2 ASP B 41 -6.858 -3.746 -3.557 1.00 0.00 H new ATOM 0 HB3 ASP B 41 -7.278 -3.707 -5.258 1.00 0.00 H new ATOM 1628 N GLU B 42 -7.588 -7.624 -5.741 1.00 0.00 N ATOM 1629 CA GLU B 42 -8.110 -8.353 -6.891 1.00 0.00 C ATOM 1630 C GLU B 42 -9.354 -7.667 -7.450 1.00 0.00 C ATOM 1631 O GLU B 42 -9.511 -7.537 -8.664 1.00 0.00 O ATOM 1632 CB GLU B 42 -8.441 -9.795 -6.502 1.00 0.00 C ATOM 1633 CG GLU B 42 -7.260 -10.554 -5.920 1.00 0.00 C ATOM 1634 CD GLU B 42 -7.684 -11.630 -4.940 1.00 0.00 C ATOM 1635 OE1 GLU B 42 -8.581 -11.359 -4.114 1.00 0.00 O ATOM 1636 OE2 GLU B 42 -7.120 -12.743 -4.998 1.00 0.00 O ATOM 0 H GLU B 42 -7.399 -8.204 -4.924 1.00 0.00 H new ATOM 0 HA GLU B 42 -7.341 -8.361 -7.664 1.00 0.00 H new ATOM 0 HB2 GLU B 42 -9.253 -9.789 -5.775 1.00 0.00 H new ATOM 0 HB3 GLU B 42 -8.805 -10.325 -7.382 1.00 0.00 H new ATOM 0 HG2 GLU B 42 -6.691 -11.010 -6.730 1.00 0.00 H new ATOM 0 HG3 GLU B 42 -6.594 -9.852 -5.418 1.00 0.00 H new ATOM 1643 N SER B 43 -10.235 -7.232 -6.555 1.00 0.00 N ATOM 1644 CA SER B 43 -11.467 -6.564 -6.958 1.00 0.00 C ATOM 1645 C SER B 43 -11.168 -5.366 -7.854 1.00 0.00 C ATOM 1646 O SER B 43 -11.942 -5.042 -8.754 1.00 0.00 O ATOM 1647 CB SER B 43 -12.252 -6.110 -5.726 1.00 0.00 C ATOM 1648 OG SER B 43 -12.068 -7.007 -4.644 1.00 0.00 O ATOM 0 H SER B 43 -10.119 -7.330 -5.546 1.00 0.00 H new ATOM 0 HA SER B 43 -12.069 -7.276 -7.522 1.00 0.00 H new ATOM 0 HB2 SER B 43 -11.929 -5.111 -5.433 1.00 0.00 H new ATOM 0 HB3 SER B 43 -13.312 -6.043 -5.971 1.00 0.00 H new ATOM 0 HG SER B 43 -12.579 -6.693 -3.869 1.00 0.00 H new ATOM 1654 N GLN B 44 -10.038 -4.713 -7.600 1.00 0.00 N ATOM 1655 CA GLN B 44 -9.636 -3.550 -8.383 1.00 0.00 C ATOM 1656 C GLN B 44 -8.830 -3.970 -9.607 1.00 0.00 C ATOM 1657 O GLN B 44 -8.618 -3.178 -10.525 1.00 0.00 O ATOM 1658 CB GLN B 44 -8.815 -2.588 -7.522 1.00 0.00 C ATOM 1659 CG GLN B 44 -9.438 -1.208 -7.389 1.00 0.00 C ATOM 1660 CD GLN B 44 -10.891 -1.262 -6.961 1.00 0.00 C ATOM 1661 OE1 GLN B 44 -11.259 -2.028 -6.070 1.00 0.00 O ATOM 1662 NE2 GLN B 44 -11.726 -0.447 -7.595 1.00 0.00 N ATOM 0 H GLN B 44 -9.385 -4.969 -6.859 1.00 0.00 H new ATOM 0 HA GLN B 44 -10.539 -3.042 -8.722 1.00 0.00 H new ATOM 0 HB2 GLN B 44 -8.691 -3.019 -6.528 1.00 0.00 H new ATOM 0 HB3 GLN B 44 -7.819 -2.488 -7.953 1.00 0.00 H new ATOM 0 HG2 GLN B 44 -8.871 -0.626 -6.663 1.00 0.00 H new ATOM 0 HG3 GLN B 44 -9.364 -0.687 -8.343 1.00 0.00 H new ATOM 0 HE21 GLN B 44 -11.377 0.171 -8.327 1.00 0.00 H new ATOM 0 HE22 GLN B 44 -12.716 -0.439 -7.349 1.00 0.00 H new ATOM 1671 N ALA B 45 -8.383 -5.222 -9.614 1.00 0.00 N ATOM 1672 CA ALA B 45 -7.601 -5.748 -10.726 1.00 0.00 C ATOM 1673 C ALA B 45 -8.292 -5.480 -12.058 1.00 0.00 C ATOM 1674 O ALA B 45 -7.639 -5.180 -13.057 1.00 0.00 O ATOM 1675 CB ALA B 45 -7.362 -7.240 -10.544 1.00 0.00 C ATOM 0 H ALA B 45 -8.549 -5.891 -8.862 1.00 0.00 H new ATOM 0 HA ALA B 45 -6.639 -5.236 -10.736 1.00 0.00 H new ATOM 0 HB1 ALA B 45 -6.777 -7.620 -11.382 1.00 0.00 H new ATOM 0 HB2 ALA B 45 -6.818 -7.411 -9.615 1.00 0.00 H new ATOM 0 HB3 ALA B 45 -8.319 -7.760 -10.505 1.00 0.00 H new ATOM 1681 N GLU B 46 -9.617 -5.590 -12.065 1.00 0.00 N ATOM 1682 CA GLU B 46 -10.395 -5.360 -13.276 1.00 0.00 C ATOM 1683 C GLU B 46 -10.313 -3.898 -13.707 1.00 0.00 C ATOM 1684 O GLU B 46 -10.097 -3.597 -14.881 1.00 0.00 O ATOM 1685 CB GLU B 46 -11.856 -5.756 -13.053 1.00 0.00 C ATOM 1686 CG GLU B 46 -12.080 -7.258 -13.004 1.00 0.00 C ATOM 1687 CD GLU B 46 -12.830 -7.776 -14.215 1.00 0.00 C ATOM 1688 OE1 GLU B 46 -13.814 -7.127 -14.626 1.00 0.00 O ATOM 1689 OE2 GLU B 46 -12.433 -8.832 -14.752 1.00 0.00 O ATOM 0 H GLU B 46 -10.173 -5.837 -11.246 1.00 0.00 H new ATOM 0 HA GLU B 46 -9.975 -5.978 -14.069 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -12.205 -5.315 -12.119 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -12.464 -5.333 -13.852 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -11.117 -7.763 -12.935 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -12.637 -7.509 -12.101 1.00 0.00 H new ATOM 1696 N ARG B 47 -10.488 -2.995 -12.749 1.00 0.00 N ATOM 1697 CA ARG B 47 -10.436 -1.565 -13.028 1.00 0.00 C ATOM 1698 C ARG B 47 -9.072 -1.170 -13.587 1.00 0.00 C ATOM 1699 O ARG B 47 -8.979 -0.549 -14.646 1.00 0.00 O ATOM 1700 CB ARG B 47 -10.729 -0.764 -11.758 1.00 0.00 C ATOM 1701 CG ARG B 47 -10.724 0.741 -11.972 1.00 0.00 C ATOM 1702 CD ARG B 47 -9.369 1.346 -11.642 1.00 0.00 C ATOM 1703 NE ARG B 47 -9.309 2.768 -11.969 1.00 0.00 N ATOM 1704 CZ ARG B 47 -9.904 3.713 -11.250 1.00 0.00 C ATOM 1705 NH1 ARG B 47 -10.598 3.389 -10.168 1.00 0.00 N ATOM 1706 NH2 ARG B 47 -9.804 4.986 -11.612 1.00 0.00 N ATOM 0 H ARG B 47 -10.667 -3.228 -11.772 1.00 0.00 H new ATOM 0 HA ARG B 47 -11.196 -1.339 -13.775 1.00 0.00 H new ATOM 0 HB2 ARG B 47 -11.701 -1.063 -11.366 1.00 0.00 H new ATOM 0 HB3 ARG B 47 -9.988 -1.017 -11.000 1.00 0.00 H new ATOM 0 HG2 ARG B 47 -10.980 0.963 -13.008 1.00 0.00 H new ATOM 0 HG3 ARG B 47 -11.491 1.201 -11.348 1.00 0.00 H new ATOM 0 HD2 ARG B 47 -9.160 1.209 -10.581 1.00 0.00 H new ATOM 0 HD3 ARG B 47 -8.592 0.815 -12.191 1.00 0.00 H new ATOM 0 HE ARG B 47 -8.781 3.051 -12.795 1.00 0.00 H new ATOM 0 HH11 ARG B 47 -10.676 2.412 -9.886 1.00 0.00 H new ATOM 0 HH12 ARG B 47 -11.054 4.117 -9.618 1.00 0.00 H new ATOM 0 HH21 ARG B 47 -9.270 5.239 -12.443 1.00 0.00 H new ATOM 0 HH22 ARG B 47 -10.261 5.711 -11.059 1.00 0.00 H new ATOM 1720 N VAL B 48 -8.015 -1.533 -12.868 1.00 0.00 N ATOM 1721 CA VAL B 48 -6.656 -1.218 -13.292 1.00 0.00 C ATOM 1722 C VAL B 48 -6.357 -1.810 -14.665 1.00 0.00 C ATOM 1723 O VAL B 48 -5.684 -1.188 -15.487 1.00 0.00 O ATOM 1724 CB VAL B 48 -5.617 -1.741 -12.282 1.00 0.00 C ATOM 1725 CG1 VAL B 48 -5.761 -1.025 -10.948 1.00 0.00 C ATOM 1726 CG2 VAL B 48 -5.757 -3.246 -12.107 1.00 0.00 C ATOM 0 H VAL B 48 -8.074 -2.046 -11.988 1.00 0.00 H new ATOM 0 HA VAL B 48 -6.585 -0.132 -13.345 1.00 0.00 H new ATOM 0 HB VAL B 48 -4.620 -1.534 -12.672 1.00 0.00 H new ATOM 0 HG11 VAL B 48 -5.019 -1.408 -10.248 1.00 0.00 H new ATOM 0 HG12 VAL B 48 -5.607 0.045 -11.091 1.00 0.00 H new ATOM 0 HG13 VAL B 48 -6.760 -1.198 -10.548 1.00 0.00 H new ATOM 0 HG21 VAL B 48 -5.016 -3.599 -11.390 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -6.757 -3.478 -11.739 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -5.599 -3.740 -13.066 1.00 0.00 H new ATOM 1736 N ARG B 49 -6.863 -3.015 -14.906 1.00 0.00 N ATOM 1737 CA ARG B 49 -6.650 -3.691 -16.180 1.00 0.00 C ATOM 1738 C ARG B 49 -7.205 -2.863 -17.335 1.00 0.00 C ATOM 1739 O ARG B 49 -6.504 -2.588 -18.308 1.00 0.00 O ATOM 1740 CB ARG B 49 -7.309 -5.072 -16.165 1.00 0.00 C ATOM 1741 CG ARG B 49 -6.366 -6.193 -15.760 1.00 0.00 C ATOM 1742 CD ARG B 49 -7.096 -7.287 -14.998 1.00 0.00 C ATOM 1743 NE ARG B 49 -7.072 -8.561 -15.712 1.00 0.00 N ATOM 1744 CZ ARG B 49 -7.315 -9.732 -15.134 1.00 0.00 C ATOM 1745 NH1 ARG B 49 -7.599 -9.790 -13.840 1.00 0.00 N ATOM 1746 NH2 ARG B 49 -7.275 -10.848 -15.851 1.00 0.00 N ATOM 0 H ARG B 49 -7.423 -3.543 -14.236 1.00 0.00 H new ATOM 0 HA ARG B 49 -5.576 -3.810 -16.325 1.00 0.00 H new ATOM 0 HB2 ARG B 49 -8.155 -5.054 -15.478 1.00 0.00 H new ATOM 0 HB3 ARG B 49 -7.709 -5.285 -17.156 1.00 0.00 H new ATOM 0 HG2 ARG B 49 -5.900 -6.617 -16.649 1.00 0.00 H new ATOM 0 HG3 ARG B 49 -5.564 -5.790 -15.141 1.00 0.00 H new ATOM 0 HD2 ARG B 49 -6.638 -7.413 -14.017 1.00 0.00 H new ATOM 0 HD3 ARG B 49 -8.130 -6.984 -14.831 1.00 0.00 H new ATOM 0 HE ARG B 49 -6.857 -8.551 -16.709 1.00 0.00 H new ATOM 0 HH11 ARG B 49 -7.631 -8.934 -13.286 1.00 0.00 H new ATOM 0 HH12 ARG B 49 -7.785 -10.690 -13.399 1.00 0.00 H new ATOM 0 HH21 ARG B 49 -7.058 -10.807 -16.847 1.00 0.00 H new ATOM 0 HH22 ARG B 49 -7.462 -11.747 -15.406 1.00 0.00 H new ATOM 1760 N ALA B 50 -8.469 -2.470 -17.220 1.00 0.00 N ATOM 1761 CA ALA B 50 -9.118 -1.672 -18.254 1.00 0.00 C ATOM 1762 C ALA B 50 -8.393 -0.347 -18.461 1.00 0.00 C ATOM 1763 O ALA B 50 -7.951 -0.037 -19.566 1.00 0.00 O ATOM 1764 CB ALA B 50 -10.576 -1.428 -17.894 1.00 0.00 C ATOM 0 H ALA B 50 -9.064 -2.691 -16.422 1.00 0.00 H new ATOM 0 HA ALA B 50 -9.074 -2.229 -19.190 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -11.048 -0.831 -18.674 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -11.093 -2.383 -17.804 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -10.632 -0.895 -16.945 1.00 0.00 H new ATOM 1770 N GLU B 51 -8.275 0.431 -17.389 1.00 0.00 N ATOM 1771 CA GLU B 51 -7.605 1.725 -17.456 1.00 0.00 C ATOM 1772 C GLU B 51 -6.200 1.580 -18.034 1.00 0.00 C ATOM 1773 O GLU B 51 -5.841 2.256 -18.999 1.00 0.00 O ATOM 1774 CB GLU B 51 -7.532 2.359 -16.065 1.00 0.00 C ATOM 1775 CG GLU B 51 -8.894 2.616 -15.442 1.00 0.00 C ATOM 1776 CD GLU B 51 -9.921 3.083 -16.456 1.00 0.00 C ATOM 1777 OE1 GLU B 51 -9.933 4.290 -16.777 1.00 0.00 O ATOM 1778 OE2 GLU B 51 -10.712 2.240 -16.929 1.00 0.00 O ATOM 0 H GLU B 51 -8.634 0.188 -16.466 1.00 0.00 H new ATOM 0 HA GLU B 51 -8.186 2.373 -18.113 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -6.958 1.707 -15.407 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -6.989 3.302 -16.132 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -9.249 1.703 -14.965 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -8.795 3.367 -14.658 1.00 0.00 H new ATOM 1785 N LEU B 52 -5.409 0.694 -17.438 1.00 0.00 N ATOM 1786 CA LEU B 52 -4.043 0.460 -17.893 1.00 0.00 C ATOM 1787 C LEU B 52 -4.001 0.244 -19.402 1.00 0.00 C ATOM 1788 O LEU B 52 -3.204 0.862 -20.106 1.00 0.00 O ATOM 1789 CB LEU B 52 -3.447 -0.752 -17.175 1.00 0.00 C ATOM 1790 CG LEU B 52 -2.057 -1.190 -17.640 1.00 0.00 C ATOM 1791 CD1 LEU B 52 -1.043 -1.025 -16.519 1.00 0.00 C ATOM 1792 CD2 LEU B 52 -2.088 -2.632 -18.126 1.00 0.00 C ATOM 0 H LEU B 52 -5.690 0.126 -16.639 1.00 0.00 H new ATOM 0 HA LEU B 52 -3.450 1.343 -17.655 1.00 0.00 H new ATOM 0 HB2 LEU B 52 -3.399 -0.530 -16.109 1.00 0.00 H new ATOM 0 HB3 LEU B 52 -4.130 -1.593 -17.295 1.00 0.00 H new ATOM 0 HG LEU B 52 -1.755 -0.553 -18.472 1.00 0.00 H new ATOM 0 HD11 LEU B 52 -0.060 -1.341 -16.868 1.00 0.00 H new ATOM 0 HD12 LEU B 52 -1.001 0.022 -16.217 1.00 0.00 H new ATOM 0 HD13 LEU B 52 -1.340 -1.637 -15.667 1.00 0.00 H new ATOM 0 HD21 LEU B 52 -1.091 -2.927 -18.453 1.00 0.00 H new ATOM 0 HD22 LEU B 52 -2.411 -3.283 -17.314 1.00 0.00 H new ATOM 0 HD23 LEU B 52 -2.784 -2.720 -18.960 1.00 0.00 H new ATOM 1804 N ALA B 53 -4.867 -0.638 -19.892 1.00 0.00 N ATOM 1805 CA ALA B 53 -4.931 -0.932 -21.318 1.00 0.00 C ATOM 1806 C ALA B 53 -5.234 0.325 -22.126 1.00 0.00 C ATOM 1807 O ALA B 53 -4.651 0.548 -23.187 1.00 0.00 O ATOM 1808 CB ALA B 53 -5.980 -2.001 -21.589 1.00 0.00 C ATOM 0 H ALA B 53 -5.533 -1.160 -19.323 1.00 0.00 H new ATOM 0 HA ALA B 53 -3.956 -1.306 -21.630 1.00 0.00 H new ATOM 0 HB1 ALA B 53 -6.018 -2.211 -22.658 1.00 0.00 H new ATOM 0 HB2 ALA B 53 -5.720 -2.911 -21.049 1.00 0.00 H new ATOM 0 HB3 ALA B 53 -6.955 -1.647 -21.254 1.00 0.00 H new ATOM 1814 N ARG B 54 -6.150 1.143 -21.617 1.00 0.00 N ATOM 1815 CA ARG B 54 -6.531 2.378 -22.293 1.00 0.00 C ATOM 1816 C ARG B 54 -5.376 3.375 -22.295 1.00 0.00 C ATOM 1817 O ARG B 54 -5.304 4.255 -23.154 1.00 0.00 O ATOM 1818 CB ARG B 54 -7.754 2.998 -21.614 1.00 0.00 C ATOM 1819 CG ARG B 54 -9.075 2.423 -22.097 1.00 0.00 C ATOM 1820 CD ARG B 54 -10.114 2.406 -20.987 1.00 0.00 C ATOM 1821 NE ARG B 54 -11.428 1.992 -21.473 1.00 0.00 N ATOM 1822 CZ ARG B 54 -12.562 2.247 -20.830 1.00 0.00 C ATOM 1823 NH1 ARG B 54 -12.544 2.909 -19.682 1.00 0.00 N ATOM 1824 NH2 ARG B 54 -13.719 1.838 -21.336 1.00 0.00 N ATOM 0 H ARG B 54 -6.642 0.973 -20.740 1.00 0.00 H new ATOM 0 HA ARG B 54 -6.781 2.136 -23.326 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -7.675 2.850 -20.537 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -7.750 4.074 -21.789 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -9.446 3.014 -22.935 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -8.919 1.409 -22.466 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -9.790 1.728 -20.197 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -10.188 3.399 -20.544 1.00 0.00 H new ATOM 0 HE ARG B 54 -11.477 1.480 -22.354 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -11.657 3.225 -19.289 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -13.417 3.103 -19.191 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -13.738 1.328 -22.219 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -14.590 2.034 -20.842 1.00 0.00 H new ATOM 1838 N PHE B 55 -4.476 3.233 -21.328 1.00 0.00 N ATOM 1839 CA PHE B 55 -3.326 4.122 -21.217 1.00 0.00 C ATOM 1840 C PHE B 55 -2.173 3.631 -22.089 1.00 0.00 C ATOM 1841 O PHE B 55 -1.542 4.412 -22.802 1.00 0.00 O ATOM 1842 CB PHE B 55 -2.871 4.223 -19.760 1.00 0.00 C ATOM 1843 CG PHE B 55 -2.312 5.570 -19.399 1.00 0.00 C ATOM 1844 CD1 PHE B 55 -3.079 6.714 -19.542 1.00 0.00 C ATOM 1845 CD2 PHE B 55 -1.018 5.691 -18.917 1.00 0.00 C ATOM 1846 CE1 PHE B 55 -2.568 7.955 -19.210 1.00 0.00 C ATOM 1847 CE2 PHE B 55 -0.502 6.929 -18.583 1.00 0.00 C ATOM 1848 CZ PHE B 55 -1.277 8.062 -18.731 1.00 0.00 C ATOM 0 H PHE B 55 -4.521 2.510 -20.610 1.00 0.00 H new ATOM 0 HA PHE B 55 -3.627 5.110 -21.565 1.00 0.00 H new ATOM 0 HB2 PHE B 55 -3.716 4.002 -19.108 1.00 0.00 H new ATOM 0 HB3 PHE B 55 -2.114 3.462 -19.570 1.00 0.00 H new ATOM 0 HD1 PHE B 55 -4.089 6.636 -19.917 1.00 0.00 H new ATOM 0 HD2 PHE B 55 -0.406 4.808 -18.801 1.00 0.00 H new ATOM 0 HE1 PHE B 55 -3.177 8.839 -19.325 1.00 0.00 H new ATOM 0 HE2 PHE B 55 0.507 7.010 -18.206 1.00 0.00 H new ATOM 0 HZ PHE B 55 -0.874 9.030 -18.473 1.00 0.00 H new ATOM 1858 N LEU B 56 -1.903 2.332 -22.025 1.00 0.00 N ATOM 1859 CA LEU B 56 -0.826 1.735 -22.808 1.00 0.00 C ATOM 1860 C LEU B 56 -1.027 1.995 -24.297 1.00 0.00 C ATOM 1861 O LEU B 56 -0.062 2.170 -25.041 1.00 0.00 O ATOM 1862 CB LEU B 56 -0.754 0.229 -22.546 1.00 0.00 C ATOM 1863 CG LEU B 56 0.294 -0.226 -21.530 1.00 0.00 C ATOM 1864 CD1 LEU B 56 0.112 -1.699 -21.199 1.00 0.00 C ATOM 1865 CD2 LEU B 56 1.697 0.036 -22.057 1.00 0.00 C ATOM 0 H LEU B 56 -2.415 1.672 -21.439 1.00 0.00 H new ATOM 0 HA LEU B 56 0.113 2.196 -22.501 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -1.733 -0.107 -22.204 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -0.557 -0.275 -23.492 1.00 0.00 H new ATOM 0 HG LEU B 56 0.159 0.350 -20.614 1.00 0.00 H new ATOM 0 HD11 LEU B 56 0.867 -2.005 -20.474 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -0.881 -1.857 -20.778 1.00 0.00 H new ATOM 0 HD13 LEU B 56 0.219 -2.292 -22.107 1.00 0.00 H new ATOM 0 HD21 LEU B 56 2.430 -0.294 -21.321 1.00 0.00 H new ATOM 0 HD22 LEU B 56 1.845 -0.513 -22.987 1.00 0.00 H new ATOM 0 HD23 LEU B 56 1.823 1.103 -22.241 1.00 0.00 H new ATOM 1877 N GLU B 57 -2.285 2.020 -24.724 1.00 0.00 N ATOM 1878 CA GLU B 57 -2.611 2.261 -26.125 1.00 0.00 C ATOM 1879 C GLU B 57 -2.512 3.746 -26.460 1.00 0.00 C ATOM 1880 O GLU B 57 -2.724 4.152 -27.602 1.00 0.00 O ATOM 1881 CB GLU B 57 -4.018 1.749 -26.440 1.00 0.00 C ATOM 1882 CG GLU B 57 -5.124 2.652 -25.921 1.00 0.00 C ATOM 1883 CD GLU B 57 -6.508 2.089 -26.182 1.00 0.00 C ATOM 1884 OE1 GLU B 57 -6.771 0.942 -25.765 1.00 0.00 O ATOM 1885 OE2 GLU B 57 -7.328 2.797 -26.803 1.00 0.00 O ATOM 0 H GLU B 57 -3.095 1.876 -24.121 1.00 0.00 H new ATOM 0 HA GLU B 57 -1.889 1.720 -26.737 1.00 0.00 H new ATOM 0 HB2 GLU B 57 -4.124 1.643 -27.520 1.00 0.00 H new ATOM 0 HB3 GLU B 57 -4.139 0.755 -26.009 1.00 0.00 H new ATOM 0 HG2 GLU B 57 -4.993 2.801 -24.849 1.00 0.00 H new ATOM 0 HG3 GLU B 57 -5.039 3.631 -26.392 1.00 0.00 H new ATOM 1892 N ASN B 58 -2.188 4.553 -25.454 1.00 0.00 N ATOM 1893 CA ASN B 58 -2.061 5.994 -25.641 1.00 0.00 C ATOM 1894 C ASN B 58 -0.613 6.440 -25.463 1.00 0.00 C ATOM 1895 O ASN B 58 -0.244 7.049 -24.459 1.00 0.00 O ATOM 1896 CB ASN B 58 -2.961 6.738 -24.652 1.00 0.00 C ATOM 1897 CG ASN B 58 -4.421 6.701 -25.058 1.00 0.00 C ATOM 1898 OD1 ASN B 58 -4.746 6.546 -26.235 1.00 0.00 O ATOM 1899 ND2 ASN B 58 -5.310 6.844 -24.082 1.00 0.00 N ATOM 0 H ASN B 58 -2.009 4.234 -24.502 1.00 0.00 H new ATOM 0 HA ASN B 58 -2.374 6.233 -26.658 1.00 0.00 H new ATOM 0 HB2 ASN B 58 -2.851 6.296 -23.662 1.00 0.00 H new ATOM 0 HB3 ASN B 58 -2.634 7.775 -24.577 1.00 0.00 H new ATOM 0 HD21 ASN B 58 -6.308 6.828 -24.294 1.00 0.00 H new ATOM 0 HD22 ASN B 58 -4.995 6.970 -23.120 1.00 0.00 H new ATOM 1906 N PRO B 59 0.228 6.131 -26.461 1.00 0.00 N ATOM 1907 CA PRO B 59 1.649 6.491 -26.440 1.00 0.00 C ATOM 1908 C PRO B 59 1.868 7.993 -26.589 1.00 0.00 C ATOM 1909 O PRO B 59 2.210 8.475 -27.668 1.00 0.00 O ATOM 1910 CB PRO B 59 2.222 5.744 -27.647 1.00 0.00 C ATOM 1911 CG PRO B 59 1.065 5.568 -28.568 1.00 0.00 C ATOM 1912 CD PRO B 59 -0.144 5.406 -27.688 1.00 0.00 C ATOM 0 HA PRO B 59 2.123 6.227 -25.495 1.00 0.00 H new ATOM 0 HB2 PRO B 59 3.022 6.312 -28.121 1.00 0.00 H new ATOM 0 HB3 PRO B 59 2.644 4.783 -27.354 1.00 0.00 H new ATOM 0 HG2 PRO B 59 0.956 6.430 -29.226 1.00 0.00 H new ATOM 0 HG3 PRO B 59 1.203 4.695 -29.206 1.00 0.00 H new ATOM 0 HD2 PRO B 59 -1.037 5.828 -28.150 1.00 0.00 H new ATOM 0 HD3 PRO B 59 -0.356 4.356 -27.486 1.00 0.00 H new ATOM 1920 N ALA B 60 1.669 8.726 -25.499 1.00 0.00 N ATOM 1921 CA ALA B 60 1.848 10.173 -25.509 1.00 0.00 C ATOM 1922 C ALA B 60 1.994 10.718 -24.092 1.00 0.00 C ATOM 1923 O ALA B 60 2.821 11.593 -23.836 1.00 0.00 O ATOM 1924 CB ALA B 60 0.680 10.844 -26.216 1.00 0.00 C ATOM 0 H ALA B 60 1.384 8.342 -24.598 1.00 0.00 H new ATOM 0 HA ALA B 60 2.766 10.397 -26.053 1.00 0.00 H new ATOM 0 HB1 ALA B 60 0.827 11.924 -26.216 1.00 0.00 H new ATOM 0 HB2 ALA B 60 0.622 10.486 -27.244 1.00 0.00 H new ATOM 0 HB3 ALA B 60 -0.247 10.604 -25.695 1.00 0.00 H new ATOM 1930 N ASP B 61 1.187 10.195 -23.176 1.00 0.00 N ATOM 1931 CA ASP B 61 1.227 10.628 -21.784 1.00 0.00 C ATOM 1932 C ASP B 61 2.308 9.878 -21.012 1.00 0.00 C ATOM 1933 O ASP B 61 3.301 10.467 -20.584 1.00 0.00 O ATOM 1934 CB ASP B 61 -0.134 10.412 -21.121 1.00 0.00 C ATOM 1935 CG ASP B 61 -0.687 11.683 -20.505 1.00 0.00 C ATOM 1936 OD1 ASP B 61 -0.060 12.205 -19.560 1.00 0.00 O ATOM 1937 OD2 ASP B 61 -1.745 12.155 -20.969 1.00 0.00 O ATOM 0 H ASP B 61 0.497 9.470 -23.372 1.00 0.00 H new ATOM 0 HA ASP B 61 1.466 11.691 -21.767 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -0.839 10.034 -21.861 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -0.042 9.648 -20.349 1.00 0.00 H new ATOM 1942 N LEU B 62 2.107 8.577 -20.837 1.00 0.00 N ATOM 1943 CA LEU B 62 3.065 7.746 -20.115 1.00 0.00 C ATOM 1944 C LEU B 62 4.460 7.875 -20.716 1.00 0.00 C ATOM 1945 O LEU B 62 4.740 7.328 -21.782 1.00 0.00 O ATOM 1946 CB LEU B 62 2.620 6.282 -20.141 1.00 0.00 C ATOM 1947 CG LEU B 62 2.174 5.740 -21.499 1.00 0.00 C ATOM 1948 CD1 LEU B 62 3.252 4.853 -22.101 1.00 0.00 C ATOM 1949 CD2 LEU B 62 0.865 4.975 -21.364 1.00 0.00 C ATOM 0 H LEU B 62 1.290 8.075 -21.185 1.00 0.00 H new ATOM 0 HA LEU B 62 3.102 8.091 -19.082 1.00 0.00 H new ATOM 0 HB2 LEU B 62 3.444 5.666 -19.779 1.00 0.00 H new ATOM 0 HB3 LEU B 62 1.798 6.161 -19.436 1.00 0.00 H new ATOM 0 HG LEU B 62 2.011 6.584 -22.169 1.00 0.00 H new ATOM 0 HD11 LEU B 62 2.916 4.477 -23.067 1.00 0.00 H new ATOM 0 HD12 LEU B 62 4.166 5.431 -22.235 1.00 0.00 H new ATOM 0 HD13 LEU B 62 3.448 4.014 -21.433 1.00 0.00 H new ATOM 0 HD21 LEU B 62 0.563 4.596 -22.340 1.00 0.00 H new ATOM 0 HD22 LEU B 62 1.001 4.140 -20.677 1.00 0.00 H new ATOM 0 HD23 LEU B 62 0.093 5.640 -20.978 1.00 0.00 H new ATOM 1961 N GLU B 63 5.332 8.602 -20.024 1.00 0.00 N ATOM 1962 CA GLU B 63 6.699 8.802 -20.489 1.00 0.00 C ATOM 1963 C GLU B 63 7.647 9.024 -19.314 1.00 0.00 C ATOM 1964 O GLU B 63 7.483 9.968 -18.543 1.00 0.00 O ATOM 1965 CB GLU B 63 6.767 9.994 -21.446 1.00 0.00 C ATOM 1966 CG GLU B 63 5.817 9.881 -22.627 1.00 0.00 C ATOM 1967 CD GLU B 63 6.146 10.862 -23.735 1.00 0.00 C ATOM 1968 OE1 GLU B 63 6.525 12.009 -23.420 1.00 0.00 O ATOM 1969 OE2 GLU B 63 6.024 10.482 -24.919 1.00 0.00 O ATOM 0 H GLU B 63 5.116 9.062 -19.140 1.00 0.00 H new ATOM 0 HA GLU B 63 7.010 7.902 -21.019 1.00 0.00 H new ATOM 0 HB2 GLU B 63 6.540 10.906 -20.894 1.00 0.00 H new ATOM 0 HB3 GLU B 63 7.787 10.092 -21.819 1.00 0.00 H new ATOM 0 HG2 GLU B 63 5.854 8.866 -23.023 1.00 0.00 H new ATOM 0 HG3 GLU B 63 4.796 10.053 -22.285 1.00 0.00 H new TER 1976 GLU B 63