USER MOD reduce.3.24.130724 H: found=0, std=0, add=1057, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1057 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 133 HIS : no HD1:sc= -0.787 K(o=-1.6,f=-0.026) USER MOD Set 1.2: A 134 HIS : no HD1:sc= -0.786 K(o=-1.6,f=-0.026) USER MOD Set 2.1: A 100 MET CE :methyl -141:sc= -0.391 (180deg=-1.17) USER MOD Set 2.2: A 108 THR OG1 : rot 76:sc= 1.25 USER MOD Set 3.1: A 19 TYR OH : rot 180:sc= 0.471 USER MOD Set 3.2: A 102 THR OG1 : rot 140:sc= 0.211 USER MOD Set 4.1: A 1 MET N :NH3+ 168:sc= 1.22 (180deg=0) USER MOD Set 4.2: A 5 SER OG : rot -120:sc= 1.09 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 HIS : no HD1:sc= -0.41 K(o=-0.41,f=0.091) USER MOD Single : A 13 THR OG1 : rot -110:sc= -0.0187 USER MOD Single : A 21 LYS NZ :NH3+ -163:sc= -0.0567 (180deg=-0.357) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 MET CE :methyl 160:sc= -0.095 (180deg=-0.642) USER MOD Single : A 30 SER OG : rot -42:sc= 0.583 USER MOD Single : A 31 HIS : no HD1:sc=-0.000393 X(o=-0.00039,f=-0.42) USER MOD Single : A 32 GLN : amide:sc= -0.585 K(o=-0.59,f=-1.2) USER MOD Single : A 34 SER OG : rot 50:sc= -0.34 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0.0635 USER MOD Single : A 49 LYS NZ :NH3+ -172:sc= 1.22 (180deg=1.11) USER MOD Single : A 52 GLN : amide:sc= -0.382 K(o=-0.38,f=-1) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 157:sc= 0.0715 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 64 ASN : amide:sc= 0.00159 X(o=0.0016,f=0) USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=-0.0097) USER MOD Single : A 70 THR OG1 : rot 26:sc= 0.547 USER MOD Single : A 75 THR OG1 : rot 120:sc= 1.23 USER MOD Single : A 85 GLN : amide:sc= 1.01 K(o=1,f=-6.8!) USER MOD Single : A 94 ASN : amide:sc= -1.44! K(o=-1.4!,f=-0.28) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= -0.467 X(o=-0.47,f=-0.54) USER MOD Single : A 109 TYR OH : rot 180:sc= -0.0339 USER MOD Single : A 110 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 MET CE :methyl -143:sc= -2.22 (180deg=-2.57!) USER MOD Single : A 130 HIS : no HD1:sc= -1.16 K(o=-1.2,f=-0.48) USER MOD Single : A 131 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 132 HIS : no HE2:sc= 0.975 K(o=0.97,f=-6.2!) USER MOD Single : A 135 HIS : no HD1:sc= 0 X(o=0,f=-0.016) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -27.183 -1.160 -25.569 1.00 0.00 N ATOM 2 CA MET A 1 -27.097 -2.588 -25.187 1.00 0.00 C ATOM 3 C MET A 1 -27.694 -2.800 -23.806 1.00 0.00 C ATOM 4 O MET A 1 -28.287 -1.885 -23.234 1.00 0.00 O ATOM 5 CB MET A 1 -25.643 -3.070 -25.211 1.00 0.00 C ATOM 6 CG MET A 1 -25.088 -3.264 -26.613 1.00 0.00 C ATOM 7 SD MET A 1 -23.386 -3.862 -26.615 1.00 0.00 S ATOM 8 CE MET A 1 -23.117 -4.095 -28.371 1.00 0.00 C ATOM 0 H1 MET A 1 -26.598 -0.990 -26.412 1.00 0.00 H new ATOM 0 H2 MET A 1 -28.172 -0.916 -25.778 1.00 0.00 H new ATOM 0 H3 MET A 1 -26.839 -0.570 -24.785 1.00 0.00 H new ATOM 0 HA MET A 1 -27.665 -3.170 -25.912 1.00 0.00 H new ATOM 0 HB2 MET A 1 -25.021 -2.349 -24.680 1.00 0.00 H new ATOM 0 HB3 MET A 1 -25.573 -4.012 -24.668 1.00 0.00 H new ATOM 0 HG2 MET A 1 -25.717 -3.971 -27.153 1.00 0.00 H new ATOM 0 HG3 MET A 1 -25.136 -2.318 -27.152 1.00 0.00 H new ATOM 0 HE1 MET A 1 -22.105 -4.464 -28.538 1.00 0.00 H new ATOM 0 HE2 MET A 1 -23.835 -4.819 -28.756 1.00 0.00 H new ATOM 0 HE3 MET A 1 -23.247 -3.144 -28.888 1.00 0.00 H new ATOM 20 N ALA A 2 -27.537 -4.001 -23.268 1.00 0.00 N ATOM 21 CA ALA A 2 -28.140 -4.336 -21.988 1.00 0.00 C ATOM 22 C ALA A 2 -27.320 -3.805 -20.814 1.00 0.00 C ATOM 23 O ALA A 2 -27.604 -2.734 -20.283 1.00 0.00 O ATOM 24 CB ALA A 2 -28.339 -5.840 -21.870 1.00 0.00 C ATOM 0 H ALA A 2 -27.000 -4.755 -23.696 1.00 0.00 H new ATOM 0 HA ALA A 2 -29.114 -3.849 -21.948 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -28.791 -6.073 -20.906 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -28.994 -6.184 -22.671 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -27.375 -6.342 -21.949 1.00 0.00 H new ATOM 30 N GLN A 3 -26.282 -4.537 -20.429 1.00 0.00 N ATOM 31 CA GLN A 3 -25.557 -4.233 -19.202 1.00 0.00 C ATOM 32 C GLN A 3 -24.308 -3.392 -19.457 1.00 0.00 C ATOM 33 O GLN A 3 -23.534 -3.131 -18.538 1.00 0.00 O ATOM 34 CB GLN A 3 -25.195 -5.528 -18.477 1.00 0.00 C ATOM 35 CG GLN A 3 -26.410 -6.303 -17.988 1.00 0.00 C ATOM 36 CD GLN A 3 -26.043 -7.607 -17.309 1.00 0.00 C ATOM 37 OE1 GLN A 3 -25.815 -7.649 -16.101 1.00 0.00 O ATOM 38 NE2 GLN A 3 -25.986 -8.682 -18.078 1.00 0.00 N ATOM 0 H GLN A 3 -25.925 -5.341 -20.945 1.00 0.00 H new ATOM 0 HA GLN A 3 -26.215 -3.636 -18.571 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -24.614 -6.162 -19.147 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -24.555 -5.293 -17.626 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -26.974 -5.683 -17.292 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -27.066 -6.511 -18.833 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -26.182 -8.606 -19.076 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -25.746 -9.587 -17.673 1.00 0.00 H new ATOM 47 N ARG A 4 -24.103 -2.966 -20.697 1.00 0.00 N ATOM 48 CA ARG A 4 -22.999 -2.061 -21.002 1.00 0.00 C ATOM 49 C ARG A 4 -23.508 -0.637 -21.187 1.00 0.00 C ATOM 50 O ARG A 4 -22.727 0.302 -21.340 1.00 0.00 O ATOM 51 CB ARG A 4 -22.219 -2.513 -22.237 1.00 0.00 C ATOM 52 CG ARG A 4 -21.389 -3.763 -21.999 1.00 0.00 C ATOM 53 CD ARG A 4 -20.366 -3.980 -23.103 1.00 0.00 C ATOM 54 NE ARG A 4 -19.573 -5.187 -22.874 1.00 0.00 N ATOM 55 CZ ARG A 4 -18.240 -5.221 -22.852 1.00 0.00 C ATOM 56 NH1 ARG A 4 -17.532 -4.113 -23.040 1.00 0.00 N ATOM 57 NH2 ARG A 4 -17.614 -6.369 -22.634 1.00 0.00 N ATOM 0 H ARG A 4 -24.677 -3.227 -21.499 1.00 0.00 H new ATOM 0 HA ARG A 4 -22.315 -2.084 -20.153 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -22.919 -2.699 -23.052 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -21.562 -1.705 -22.559 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -20.877 -3.682 -21.040 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -22.047 -4.630 -21.937 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -20.877 -4.057 -24.063 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -19.705 -3.115 -23.162 1.00 0.00 H new ATOM 0 HE ARG A 4 -20.073 -6.062 -22.721 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -18.007 -3.225 -23.203 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -16.513 -4.150 -23.021 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -18.152 -7.223 -22.484 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -16.595 -6.399 -22.617 1.00 0.00 H new ATOM 71 N SER A 5 -24.821 -0.481 -21.160 1.00 0.00 N ATOM 72 CA SER A 5 -25.425 0.833 -21.248 1.00 0.00 C ATOM 73 C SER A 5 -25.846 1.298 -19.857 1.00 0.00 C ATOM 74 O SER A 5 -26.971 1.064 -19.411 1.00 0.00 O ATOM 75 CB SER A 5 -26.607 0.813 -22.215 1.00 0.00 C ATOM 76 OG SER A 5 -26.187 0.396 -23.508 1.00 0.00 O ATOM 0 H SER A 5 -25.487 -1.249 -21.078 1.00 0.00 H new ATOM 0 HA SER A 5 -24.695 1.542 -21.639 1.00 0.00 H new ATOM 0 HB2 SER A 5 -27.378 0.139 -21.842 1.00 0.00 H new ATOM 0 HB3 SER A 5 -27.053 1.806 -22.274 1.00 0.00 H new ATOM 0 HG SER A 5 -26.376 1.105 -24.158 1.00 0.00 H new ATOM 82 N GLU A 6 -24.905 1.924 -19.170 1.00 0.00 N ATOM 83 CA GLU A 6 -25.101 2.379 -17.804 1.00 0.00 C ATOM 84 C GLU A 6 -24.047 3.422 -17.476 1.00 0.00 C ATOM 85 O GLU A 6 -24.361 4.535 -17.055 1.00 0.00 O ATOM 86 CB GLU A 6 -24.997 1.196 -16.833 1.00 0.00 C ATOM 87 CG GLU A 6 -25.163 1.577 -15.371 1.00 0.00 C ATOM 88 CD GLU A 6 -26.501 2.222 -15.085 1.00 0.00 C ATOM 89 OE1 GLU A 6 -27.472 1.491 -14.801 1.00 0.00 O ATOM 90 OE2 GLU A 6 -26.591 3.465 -15.146 1.00 0.00 O ATOM 0 H GLU A 6 -23.980 2.132 -19.546 1.00 0.00 H new ATOM 0 HA GLU A 6 -26.093 2.819 -17.703 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -25.756 0.458 -17.094 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -24.027 0.716 -16.964 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -25.054 0.686 -14.753 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -24.365 2.263 -15.085 1.00 0.00 H new ATOM 97 N ILE A 7 -22.791 3.040 -17.703 1.00 0.00 N ATOM 98 CA ILE A 7 -21.646 3.926 -17.526 1.00 0.00 C ATOM 99 C ILE A 7 -21.432 4.275 -16.050 1.00 0.00 C ATOM 100 O ILE A 7 -21.998 5.237 -15.533 1.00 0.00 O ATOM 101 CB ILE A 7 -21.781 5.222 -18.365 1.00 0.00 C ATOM 102 CG1 ILE A 7 -22.004 4.875 -19.843 1.00 0.00 C ATOM 103 CG2 ILE A 7 -20.542 6.096 -18.206 1.00 0.00 C ATOM 104 CD1 ILE A 7 -22.246 6.083 -20.726 1.00 0.00 C ATOM 0 H ILE A 7 -22.540 2.102 -18.016 1.00 0.00 H new ATOM 0 HA ILE A 7 -20.773 3.381 -17.885 1.00 0.00 H new ATOM 0 HB ILE A 7 -22.643 5.781 -18.002 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -21.134 4.334 -20.215 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -22.857 4.201 -19.924 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -20.656 7.001 -18.803 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -20.419 6.366 -17.157 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -19.663 5.547 -18.544 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -22.395 5.757 -21.755 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -23.134 6.614 -20.381 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -21.384 6.748 -20.677 1.00 0.00 H new ATOM 116 N PRO A 8 -20.626 3.468 -15.348 1.00 0.00 N ATOM 117 CA PRO A 8 -20.231 3.741 -13.970 1.00 0.00 C ATOM 118 C PRO A 8 -18.973 4.602 -13.923 1.00 0.00 C ATOM 119 O PRO A 8 -18.088 4.402 -13.092 1.00 0.00 O ATOM 120 CB PRO A 8 -19.955 2.340 -13.429 1.00 0.00 C ATOM 121 CG PRO A 8 -19.441 1.574 -14.604 1.00 0.00 C ATOM 122 CD PRO A 8 -20.036 2.209 -15.840 1.00 0.00 C ATOM 0 HA PRO A 8 -20.980 4.291 -13.400 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -19.223 2.364 -12.621 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -20.860 1.886 -13.025 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -18.352 1.607 -14.640 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -19.726 0.524 -14.535 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -19.275 2.395 -16.598 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -20.790 1.566 -16.295 1.00 0.00 H new ATOM 130 N HIS A 9 -18.912 5.568 -14.824 1.00 0.00 N ATOM 131 CA HIS A 9 -17.724 6.384 -14.999 1.00 0.00 C ATOM 132 C HIS A 9 -17.945 7.769 -14.401 1.00 0.00 C ATOM 133 O HIS A 9 -18.597 8.619 -15.005 1.00 0.00 O ATOM 134 CB HIS A 9 -17.397 6.485 -16.491 1.00 0.00 C ATOM 135 CG HIS A 9 -15.981 6.861 -16.781 1.00 0.00 C ATOM 136 ND1 HIS A 9 -14.991 5.927 -16.994 1.00 0.00 N ATOM 137 CD2 HIS A 9 -15.392 8.070 -16.911 1.00 0.00 C ATOM 138 CE1 HIS A 9 -13.855 6.548 -17.242 1.00 0.00 C ATOM 139 NE2 HIS A 9 -14.072 7.847 -17.197 1.00 0.00 N ATOM 0 H HIS A 9 -19.680 5.807 -15.451 1.00 0.00 H new ATOM 0 HA HIS A 9 -16.884 5.922 -14.481 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -17.612 5.527 -16.965 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -18.058 7.222 -16.948 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -15.872 9.032 -16.809 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -12.907 6.073 -17.447 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -13.369 8.570 -17.351 1.00 0.00 H new ATOM 148 N PHE A 10 -17.410 7.986 -13.212 1.00 0.00 N ATOM 149 CA PHE A 10 -17.639 9.229 -12.490 1.00 0.00 C ATOM 150 C PHE A 10 -16.461 10.192 -12.650 1.00 0.00 C ATOM 151 O PHE A 10 -15.301 9.777 -12.661 1.00 0.00 O ATOM 152 CB PHE A 10 -17.880 8.940 -11.006 1.00 0.00 C ATOM 153 CG PHE A 10 -19.062 8.051 -10.745 1.00 0.00 C ATOM 154 CD1 PHE A 10 -20.337 8.584 -10.645 1.00 0.00 C ATOM 155 CD2 PHE A 10 -18.898 6.683 -10.594 1.00 0.00 C ATOM 156 CE1 PHE A 10 -21.426 7.769 -10.400 1.00 0.00 C ATOM 157 CE2 PHE A 10 -19.983 5.863 -10.349 1.00 0.00 C ATOM 158 CZ PHE A 10 -21.249 6.407 -10.252 1.00 0.00 C ATOM 0 H PHE A 10 -16.813 7.318 -12.724 1.00 0.00 H new ATOM 0 HA PHE A 10 -18.524 9.704 -12.914 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -16.988 8.475 -10.587 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -18.024 9.884 -10.480 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -20.481 9.648 -10.760 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -17.910 6.253 -10.669 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -22.415 8.197 -10.324 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -19.841 4.799 -10.234 1.00 0.00 H new ATOM 0 HZ PHE A 10 -22.099 5.769 -10.061 1.00 0.00 H new ATOM 168 N PRO A 11 -16.755 11.493 -12.808 1.00 0.00 N ATOM 169 CA PRO A 11 -15.744 12.536 -12.878 1.00 0.00 C ATOM 170 C PRO A 11 -15.430 13.120 -11.502 1.00 0.00 C ATOM 171 O PRO A 11 -16.342 13.410 -10.729 1.00 0.00 O ATOM 172 CB PRO A 11 -16.406 13.582 -13.775 1.00 0.00 C ATOM 173 CG PRO A 11 -17.884 13.404 -13.588 1.00 0.00 C ATOM 174 CD PRO A 11 -18.109 12.052 -12.945 1.00 0.00 C ATOM 0 HA PRO A 11 -14.787 12.174 -13.254 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -16.095 14.589 -13.497 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -16.124 13.438 -14.818 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -18.288 14.198 -12.960 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -18.400 13.462 -14.546 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -18.601 12.147 -11.977 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -18.743 11.416 -13.564 1.00 0.00 H new ATOM 182 N ARG A 12 -14.138 13.304 -11.221 1.00 0.00 N ATOM 183 CA ARG A 12 -13.663 13.776 -9.914 1.00 0.00 C ATOM 184 C ARG A 12 -14.337 13.021 -8.764 1.00 0.00 C ATOM 185 O ARG A 12 -15.356 13.454 -8.222 1.00 0.00 O ATOM 186 CB ARG A 12 -13.865 15.292 -9.756 1.00 0.00 C ATOM 187 CG ARG A 12 -13.499 15.811 -8.370 1.00 0.00 C ATOM 188 CD ARG A 12 -13.629 17.323 -8.268 1.00 0.00 C ATOM 189 NE ARG A 12 -12.467 18.020 -8.826 1.00 0.00 N ATOM 190 CZ ARG A 12 -11.952 19.137 -8.304 1.00 0.00 C ATOM 191 NH1 ARG A 12 -12.512 19.695 -7.235 1.00 0.00 N ATOM 192 NH2 ARG A 12 -10.877 19.695 -8.847 1.00 0.00 N ATOM 0 H ARG A 12 -13.390 13.130 -11.892 1.00 0.00 H new ATOM 0 HA ARG A 12 -12.593 13.571 -9.870 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -13.262 15.811 -10.501 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -14.907 15.536 -9.964 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -14.144 15.342 -7.627 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -12.476 15.520 -8.134 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -14.529 17.644 -8.792 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -13.752 17.605 -7.222 1.00 0.00 H new ATOM 0 HE ARG A 12 -12.027 17.631 -9.660 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -13.337 19.270 -6.811 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -12.117 20.548 -6.839 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -10.441 19.271 -9.666 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -10.487 20.548 -8.445 1.00 0.00 H new ATOM 206 N THR A 13 -13.776 11.880 -8.412 1.00 0.00 N ATOM 207 CA THR A 13 -14.330 11.070 -7.345 1.00 0.00 C ATOM 208 C THR A 13 -13.291 10.828 -6.258 1.00 0.00 C ATOM 209 O THR A 13 -12.344 10.067 -6.447 1.00 0.00 O ATOM 210 CB THR A 13 -14.848 9.726 -7.884 1.00 0.00 C ATOM 211 OG1 THR A 13 -15.730 9.968 -8.986 1.00 0.00 O ATOM 212 CG2 THR A 13 -15.585 8.948 -6.803 1.00 0.00 C ATOM 0 H THR A 13 -12.939 11.494 -8.848 1.00 0.00 H new ATOM 0 HA THR A 13 -15.169 11.617 -6.915 1.00 0.00 H new ATOM 0 HB THR A 13 -13.994 9.131 -8.210 1.00 0.00 H new ATOM 0 HG1 THR A 13 -16.649 9.750 -8.724 1.00 0.00 H new ATOM 0 HG21 THR A 13 -15.940 8.002 -7.213 1.00 0.00 H new ATOM 0 HG22 THR A 13 -14.909 8.752 -5.971 1.00 0.00 H new ATOM 0 HG23 THR A 13 -16.435 9.532 -6.450 1.00 0.00 H new ATOM 220 N ALA A 14 -13.468 11.501 -5.132 1.00 0.00 N ATOM 221 CA ALA A 14 -12.562 11.362 -4.002 1.00 0.00 C ATOM 222 C ALA A 14 -13.281 10.705 -2.833 1.00 0.00 C ATOM 223 O ALA A 14 -12.848 10.796 -1.686 1.00 0.00 O ATOM 224 CB ALA A 14 -12.013 12.723 -3.598 1.00 0.00 C ATOM 0 H ALA A 14 -14.236 12.153 -4.976 1.00 0.00 H new ATOM 0 HA ALA A 14 -11.726 10.727 -4.295 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -11.336 12.606 -2.751 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -11.472 13.161 -4.437 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -12.837 13.379 -3.316 1.00 0.00 H new ATOM 230 N ALA A 15 -14.383 10.037 -3.138 1.00 0.00 N ATOM 231 CA ALA A 15 -15.187 9.379 -2.122 1.00 0.00 C ATOM 232 C ALA A 15 -15.185 7.871 -2.323 1.00 0.00 C ATOM 233 O ALA A 15 -15.634 7.372 -3.354 1.00 0.00 O ATOM 234 CB ALA A 15 -16.610 9.912 -2.153 1.00 0.00 C ATOM 0 H ALA A 15 -14.742 9.937 -4.087 1.00 0.00 H new ATOM 0 HA ALA A 15 -14.750 9.594 -1.147 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -17.203 9.411 -1.387 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -16.601 10.985 -1.961 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -17.048 9.722 -3.133 1.00 0.00 H new ATOM 240 N ILE A 16 -14.665 7.150 -1.341 1.00 0.00 N ATOM 241 CA ILE A 16 -14.634 5.693 -1.397 1.00 0.00 C ATOM 242 C ILE A 16 -15.407 5.109 -0.218 1.00 0.00 C ATOM 243 O ILE A 16 -15.200 5.518 0.926 1.00 0.00 O ATOM 244 CB ILE A 16 -13.184 5.160 -1.384 1.00 0.00 C ATOM 245 CG1 ILE A 16 -12.375 5.795 -2.520 1.00 0.00 C ATOM 246 CG2 ILE A 16 -13.173 3.640 -1.504 1.00 0.00 C ATOM 247 CD1 ILE A 16 -10.909 5.418 -2.517 1.00 0.00 C ATOM 0 H ILE A 16 -14.258 7.549 -0.495 1.00 0.00 H new ATOM 0 HA ILE A 16 -15.102 5.384 -2.331 1.00 0.00 H new ATOM 0 HB ILE A 16 -12.722 5.432 -0.435 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -12.813 5.500 -3.473 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -12.461 6.879 -2.451 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -12.144 3.282 -1.493 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -13.718 3.205 -0.666 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -13.650 3.345 -2.439 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -10.406 5.907 -3.351 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -10.453 5.738 -1.580 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -10.811 4.337 -2.618 1.00 0.00 H new ATOM 259 N ASP A 17 -16.303 4.168 -0.498 1.00 0.00 N ATOM 260 CA ASP A 17 -17.137 3.573 0.541 1.00 0.00 C ATOM 261 C ASP A 17 -17.450 2.119 0.201 1.00 0.00 C ATOM 262 O ASP A 17 -17.418 1.739 -0.969 1.00 0.00 O ATOM 263 CB ASP A 17 -18.440 4.369 0.693 1.00 0.00 C ATOM 264 CG ASP A 17 -19.179 4.051 1.979 1.00 0.00 C ATOM 265 OD1 ASP A 17 -19.986 3.098 1.994 1.00 0.00 O ATOM 266 OD2 ASP A 17 -18.958 4.763 2.979 1.00 0.00 O ATOM 0 H ASP A 17 -16.470 3.801 -1.435 1.00 0.00 H new ATOM 0 HA ASP A 17 -16.592 3.603 1.485 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -18.214 5.435 0.664 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -19.090 4.157 -0.156 1.00 0.00 H new ATOM 271 N ALA A 18 -17.734 1.324 1.236 1.00 0.00 N ATOM 272 CA ALA A 18 -18.110 -0.086 1.092 1.00 0.00 C ATOM 273 C ALA A 18 -17.041 -0.907 0.376 1.00 0.00 C ATOM 274 O ALA A 18 -17.033 -1.017 -0.852 1.00 0.00 O ATOM 275 CB ALA A 18 -19.452 -0.225 0.389 1.00 0.00 C ATOM 0 H ALA A 18 -17.709 1.642 2.205 1.00 0.00 H new ATOM 0 HA ALA A 18 -18.200 -0.488 2.101 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -19.706 -1.281 0.296 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -20.221 0.283 0.970 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -19.391 0.223 -0.603 1.00 0.00 H new ATOM 281 N TYR A 19 -16.144 -1.487 1.158 1.00 0.00 N ATOM 282 CA TYR A 19 -15.085 -2.324 0.620 1.00 0.00 C ATOM 283 C TYR A 19 -15.251 -3.766 1.088 1.00 0.00 C ATOM 284 O TYR A 19 -15.404 -4.026 2.282 1.00 0.00 O ATOM 285 CB TYR A 19 -13.715 -1.781 1.044 1.00 0.00 C ATOM 286 CG TYR A 19 -12.560 -2.722 0.761 1.00 0.00 C ATOM 287 CD1 TYR A 19 -12.221 -3.074 -0.540 1.00 0.00 C ATOM 288 CD2 TYR A 19 -11.812 -3.260 1.802 1.00 0.00 C ATOM 289 CE1 TYR A 19 -11.169 -3.935 -0.794 1.00 0.00 C ATOM 290 CE2 TYR A 19 -10.760 -4.118 1.555 1.00 0.00 C ATOM 291 CZ TYR A 19 -10.442 -4.454 0.257 1.00 0.00 C ATOM 292 OH TYR A 19 -9.387 -5.307 0.009 1.00 0.00 O ATOM 0 H TYR A 19 -16.129 -1.392 2.173 1.00 0.00 H new ATOM 0 HA TYR A 19 -15.149 -2.306 -0.468 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -13.535 -0.837 0.529 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -13.738 -1.562 2.112 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -12.788 -2.669 -1.365 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -12.058 -3.002 2.821 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -10.918 -4.200 -1.810 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -10.188 -4.525 2.376 1.00 0.00 H new ATOM 0 HH TYR A 19 -8.981 -5.581 0.858 1.00 0.00 H new ATOM 302 N GLY A 20 -15.237 -4.694 0.144 1.00 0.00 N ATOM 303 CA GLY A 20 -15.305 -6.099 0.485 1.00 0.00 C ATOM 304 C GLY A 20 -16.417 -6.819 -0.243 1.00 0.00 C ATOM 305 O GLY A 20 -16.176 -7.520 -1.227 1.00 0.00 O ATOM 0 H GLY A 20 -15.180 -4.498 -0.855 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -14.353 -6.574 0.247 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -15.453 -6.202 1.560 1.00 0.00 H new ATOM 309 N LYS A 21 -17.636 -6.633 0.236 1.00 0.00 N ATOM 310 CA LYS A 21 -18.802 -7.293 -0.338 1.00 0.00 C ATOM 311 C LYS A 21 -19.096 -6.737 -1.728 1.00 0.00 C ATOM 312 O LYS A 21 -19.685 -5.665 -1.867 1.00 0.00 O ATOM 313 CB LYS A 21 -20.016 -7.100 0.578 1.00 0.00 C ATOM 314 CG LYS A 21 -21.223 -7.945 0.203 1.00 0.00 C ATOM 315 CD LYS A 21 -20.952 -9.426 0.407 1.00 0.00 C ATOM 316 CE LYS A 21 -22.194 -10.263 0.151 1.00 0.00 C ATOM 317 NZ LYS A 21 -23.300 -9.920 1.086 1.00 0.00 N ATOM 0 H LYS A 21 -17.847 -6.025 1.028 1.00 0.00 H new ATOM 0 HA LYS A 21 -18.593 -8.359 -0.429 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -19.725 -7.337 1.602 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -20.304 -6.049 0.563 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -22.080 -7.645 0.806 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -21.486 -7.763 -0.839 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -20.153 -9.746 -0.262 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -20.602 -9.595 1.425 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -22.527 -10.112 -0.876 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -21.947 -11.320 0.254 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -24.008 -10.682 1.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -22.920 -9.808 2.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -23.746 -9.030 0.784 1.00 0.00 H new ATOM 331 N GLY A 22 -18.662 -7.462 -2.749 1.00 0.00 N ATOM 332 CA GLY A 22 -18.861 -7.019 -4.114 1.00 0.00 C ATOM 333 C GLY A 22 -17.767 -6.077 -4.572 1.00 0.00 C ATOM 334 O GLY A 22 -17.936 -5.342 -5.544 1.00 0.00 O ATOM 0 H GLY A 22 -18.174 -8.353 -2.656 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -18.893 -7.885 -4.775 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -19.826 -6.520 -4.196 1.00 0.00 H new ATOM 338 N GLY A 23 -16.646 -6.095 -3.863 1.00 0.00 N ATOM 339 CA GLY A 23 -15.533 -5.238 -4.212 1.00 0.00 C ATOM 340 C GLY A 23 -15.693 -3.841 -3.655 1.00 0.00 C ATOM 341 O GLY A 23 -15.484 -3.617 -2.461 1.00 0.00 O ATOM 0 H GLY A 23 -16.489 -6.690 -3.050 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -14.608 -5.674 -3.835 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -15.442 -5.187 -5.297 1.00 0.00 H new ATOM 345 N PHE A 24 -16.066 -2.907 -4.518 1.00 0.00 N ATOM 346 CA PHE A 24 -16.292 -1.526 -4.110 1.00 0.00 C ATOM 347 C PHE A 24 -17.717 -1.109 -4.441 1.00 0.00 C ATOM 348 O PHE A 24 -18.101 -1.069 -5.611 1.00 0.00 O ATOM 349 CB PHE A 24 -15.314 -0.581 -4.815 1.00 0.00 C ATOM 350 CG PHE A 24 -13.871 -0.820 -4.476 1.00 0.00 C ATOM 351 CD1 PHE A 24 -13.339 -0.350 -3.287 1.00 0.00 C ATOM 352 CD2 PHE A 24 -13.045 -1.508 -5.351 1.00 0.00 C ATOM 353 CE1 PHE A 24 -12.010 -0.563 -2.976 1.00 0.00 C ATOM 354 CE2 PHE A 24 -11.716 -1.723 -5.045 1.00 0.00 C ATOM 355 CZ PHE A 24 -11.199 -1.250 -3.855 1.00 0.00 C ATOM 0 H PHE A 24 -16.220 -3.081 -5.511 1.00 0.00 H new ATOM 0 HA PHE A 24 -16.131 -1.463 -3.034 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -15.443 -0.681 -5.893 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -15.570 0.447 -4.557 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -13.970 0.189 -2.595 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -13.445 -1.880 -6.282 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -11.606 -0.192 -2.045 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -11.082 -2.260 -5.735 1.00 0.00 H new ATOM 0 HZ PHE A 24 -10.160 -1.418 -3.613 1.00 0.00 H new ATOM 365 N TYR A 25 -18.498 -0.802 -3.419 1.00 0.00 N ATOM 366 CA TYR A 25 -19.873 -0.373 -3.622 1.00 0.00 C ATOM 367 C TYR A 25 -20.005 1.123 -3.368 1.00 0.00 C ATOM 368 O TYR A 25 -20.194 1.564 -2.234 1.00 0.00 O ATOM 369 CB TYR A 25 -20.825 -1.162 -2.717 1.00 0.00 C ATOM 370 CG TYR A 25 -22.264 -0.697 -2.787 1.00 0.00 C ATOM 371 CD1 TYR A 25 -23.020 -0.876 -3.938 1.00 0.00 C ATOM 372 CD2 TYR A 25 -22.867 -0.083 -1.697 1.00 0.00 C ATOM 373 CE1 TYR A 25 -24.335 -0.459 -4.000 1.00 0.00 C ATOM 374 CE2 TYR A 25 -24.179 0.339 -1.751 1.00 0.00 C ATOM 375 CZ TYR A 25 -24.908 0.149 -2.905 1.00 0.00 C ATOM 376 OH TYR A 25 -26.220 0.561 -2.960 1.00 0.00 O ATOM 0 H TYR A 25 -18.205 -0.841 -2.443 1.00 0.00 H new ATOM 0 HA TYR A 25 -20.147 -0.572 -4.658 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -20.780 -2.216 -2.990 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -20.478 -1.085 -1.686 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -22.572 -1.349 -4.799 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -22.299 0.067 -0.791 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -24.911 -0.609 -4.902 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -24.632 0.815 -0.894 1.00 0.00 H new ATOM 0 HH TYR A 25 -26.471 0.969 -2.105 1.00 0.00 H new ATOM 386 N PHE A 26 -19.893 1.901 -4.432 1.00 0.00 N ATOM 387 CA PHE A 26 -19.968 3.347 -4.321 1.00 0.00 C ATOM 388 C PHE A 26 -20.986 3.914 -5.305 1.00 0.00 C ATOM 389 O PHE A 26 -20.828 3.789 -6.520 1.00 0.00 O ATOM 390 CB PHE A 26 -18.581 3.982 -4.531 1.00 0.00 C ATOM 391 CG PHE A 26 -17.941 3.676 -5.861 1.00 0.00 C ATOM 392 CD1 PHE A 26 -17.389 2.430 -6.114 1.00 0.00 C ATOM 393 CD2 PHE A 26 -17.886 4.642 -6.856 1.00 0.00 C ATOM 394 CE1 PHE A 26 -16.799 2.152 -7.331 1.00 0.00 C ATOM 395 CE2 PHE A 26 -17.296 4.368 -8.076 1.00 0.00 C ATOM 396 CZ PHE A 26 -16.753 3.122 -8.313 1.00 0.00 C ATOM 0 H PHE A 26 -19.750 1.555 -5.381 1.00 0.00 H new ATOM 0 HA PHE A 26 -20.302 3.595 -3.314 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -18.672 5.063 -4.428 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -17.917 3.641 -3.737 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -17.421 1.667 -5.350 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -18.309 5.619 -6.675 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -16.374 1.176 -7.515 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -17.260 5.128 -8.842 1.00 0.00 H new ATOM 0 HZ PHE A 26 -16.292 2.905 -9.266 1.00 0.00 H new ATOM 406 N ALA A 27 -22.047 4.500 -4.750 1.00 0.00 N ATOM 407 CA ALA A 27 -23.086 5.189 -5.522 1.00 0.00 C ATOM 408 C ALA A 27 -23.853 4.249 -6.456 1.00 0.00 C ATOM 409 O ALA A 27 -24.971 3.834 -6.149 1.00 0.00 O ATOM 410 CB ALA A 27 -22.493 6.356 -6.304 1.00 0.00 C ATOM 0 H ALA A 27 -22.213 4.511 -3.744 1.00 0.00 H new ATOM 0 HA ALA A 27 -23.807 5.574 -4.801 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -23.281 6.853 -6.870 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -22.041 7.066 -5.611 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -21.733 5.985 -6.991 1.00 0.00 H new ATOM 416 N GLY A 28 -23.241 3.909 -7.583 1.00 0.00 N ATOM 417 CA GLY A 28 -23.924 3.147 -8.609 1.00 0.00 C ATOM 418 C GLY A 28 -24.119 1.688 -8.245 1.00 0.00 C ATOM 419 O GLY A 28 -25.236 1.258 -7.952 1.00 0.00 O ATOM 0 H GLY A 28 -22.275 4.150 -7.805 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -24.897 3.599 -8.800 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -23.356 3.210 -9.537 1.00 0.00 H new ATOM 423 N MET A 29 -23.040 0.922 -8.266 1.00 0.00 N ATOM 424 CA MET A 29 -23.120 -0.513 -8.040 1.00 0.00 C ATOM 425 C MET A 29 -21.865 -1.025 -7.349 1.00 0.00 C ATOM 426 O MET A 29 -20.894 -0.285 -7.182 1.00 0.00 O ATOM 427 CB MET A 29 -23.309 -1.246 -9.373 1.00 0.00 C ATOM 428 CG MET A 29 -22.145 -1.058 -10.337 1.00 0.00 C ATOM 429 SD MET A 29 -22.405 -1.881 -11.922 1.00 0.00 S ATOM 430 CE MET A 29 -23.839 -0.997 -12.535 1.00 0.00 C ATOM 0 H MET A 29 -22.097 1.270 -8.438 1.00 0.00 H new ATOM 0 HA MET A 29 -23.976 -0.707 -7.394 1.00 0.00 H new ATOM 0 HB2 MET A 29 -23.442 -2.310 -9.178 1.00 0.00 H new ATOM 0 HB3 MET A 29 -24.225 -0.892 -9.847 1.00 0.00 H new ATOM 0 HG2 MET A 29 -21.990 0.007 -10.508 1.00 0.00 H new ATOM 0 HG3 MET A 29 -21.234 -1.443 -9.878 1.00 0.00 H new ATOM 0 HE1 MET A 29 -23.911 -1.125 -13.615 1.00 0.00 H new ATOM 0 HE2 MET A 29 -24.739 -1.391 -12.062 1.00 0.00 H new ATOM 0 HE3 MET A 29 -23.741 0.063 -12.301 1.00 0.00 H new ATOM 440 N SER A 30 -21.895 -2.288 -6.948 1.00 0.00 N ATOM 441 CA SER A 30 -20.730 -2.943 -6.378 1.00 0.00 C ATOM 442 C SER A 30 -19.817 -3.415 -7.505 1.00 0.00 C ATOM 443 O SER A 30 -20.158 -4.343 -8.240 1.00 0.00 O ATOM 444 CB SER A 30 -21.167 -4.136 -5.525 1.00 0.00 C ATOM 445 OG SER A 30 -22.289 -3.804 -4.720 1.00 0.00 O ATOM 0 H SER A 30 -22.722 -2.882 -7.008 1.00 0.00 H new ATOM 0 HA SER A 30 -20.191 -2.239 -5.745 1.00 0.00 H new ATOM 0 HB2 SER A 30 -21.415 -4.978 -6.171 1.00 0.00 H new ATOM 0 HB3 SER A 30 -20.341 -4.455 -4.889 1.00 0.00 H new ATOM 0 HG SER A 30 -22.169 -2.907 -4.345 1.00 0.00 H new ATOM 451 N HIS A 31 -18.676 -2.763 -7.668 1.00 0.00 N ATOM 452 CA HIS A 31 -17.778 -3.101 -8.760 1.00 0.00 C ATOM 453 C HIS A 31 -16.737 -4.122 -8.326 1.00 0.00 C ATOM 454 O HIS A 31 -15.777 -3.788 -7.629 1.00 0.00 O ATOM 455 CB HIS A 31 -17.076 -1.857 -9.314 1.00 0.00 C ATOM 456 CG HIS A 31 -16.243 -2.148 -10.529 1.00 0.00 C ATOM 457 ND1 HIS A 31 -14.912 -2.504 -10.468 1.00 0.00 N ATOM 458 CD2 HIS A 31 -16.572 -2.162 -11.842 1.00 0.00 C ATOM 459 CE1 HIS A 31 -14.461 -2.725 -11.691 1.00 0.00 C ATOM 460 NE2 HIS A 31 -15.450 -2.525 -12.544 1.00 0.00 N ATOM 0 H HIS A 31 -18.353 -2.006 -7.066 1.00 0.00 H new ATOM 0 HA HIS A 31 -18.391 -3.537 -9.549 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -17.824 -1.105 -9.564 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -16.441 -1.429 -8.538 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -17.540 -1.930 -12.261 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -13.454 -3.019 -11.949 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -15.390 -2.624 -13.557 1.00 0.00 H new ATOM 469 N GLN A 32 -16.940 -5.361 -8.740 1.00 0.00 N ATOM 470 CA GLN A 32 -15.952 -6.407 -8.537 1.00 0.00 C ATOM 471 C GLN A 32 -14.845 -6.243 -9.574 1.00 0.00 C ATOM 472 O GLN A 32 -15.084 -6.368 -10.775 1.00 0.00 O ATOM 473 CB GLN A 32 -16.624 -7.786 -8.654 1.00 0.00 C ATOM 474 CG GLN A 32 -15.792 -8.960 -8.137 1.00 0.00 C ATOM 475 CD GLN A 32 -14.675 -9.379 -9.078 1.00 0.00 C ATOM 476 OE1 GLN A 32 -13.547 -8.906 -8.976 1.00 0.00 O ATOM 477 NE2 GLN A 32 -14.988 -10.270 -10.007 1.00 0.00 N ATOM 0 H GLN A 32 -17.785 -5.668 -9.221 1.00 0.00 H new ATOM 0 HA GLN A 32 -15.517 -6.330 -7.541 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -17.567 -7.761 -8.108 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -16.867 -7.967 -9.701 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -15.361 -8.691 -7.173 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -16.450 -9.812 -7.966 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -15.937 -10.640 -10.060 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -14.280 -10.586 -10.670 1.00 0.00 H new ATOM 486 N GLY A 33 -13.648 -5.918 -9.109 1.00 0.00 N ATOM 487 CA GLY A 33 -12.528 -5.730 -10.006 1.00 0.00 C ATOM 488 C GLY A 33 -11.636 -4.593 -9.561 1.00 0.00 C ATOM 489 O GLY A 33 -11.871 -3.990 -8.514 1.00 0.00 O ATOM 0 H GLY A 33 -13.432 -5.781 -8.122 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -11.946 -6.650 -10.058 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -12.898 -5.530 -11.012 1.00 0.00 H new ATOM 493 N SER A 34 -10.627 -4.284 -10.355 1.00 0.00 N ATOM 494 CA SER A 34 -9.690 -3.230 -10.008 1.00 0.00 C ATOM 495 C SER A 34 -10.141 -1.896 -10.597 1.00 0.00 C ATOM 496 O SER A 34 -10.661 -1.834 -11.719 1.00 0.00 O ATOM 497 CB SER A 34 -8.286 -3.589 -10.501 1.00 0.00 C ATOM 498 OG SER A 34 -7.328 -2.640 -10.072 1.00 0.00 O ATOM 0 H SER A 34 -10.435 -4.747 -11.243 1.00 0.00 H new ATOM 0 HA SER A 34 -9.663 -3.131 -8.923 1.00 0.00 H new ATOM 0 HB2 SER A 34 -8.011 -4.577 -10.132 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.284 -3.643 -11.590 1.00 0.00 H new ATOM 0 HG SER A 34 -7.424 -2.490 -9.108 1.00 0.00 H new ATOM 504 N LEU A 35 -9.967 -0.840 -9.822 1.00 0.00 N ATOM 505 CA LEU A 35 -10.316 0.502 -10.253 1.00 0.00 C ATOM 506 C LEU A 35 -9.067 1.360 -10.343 1.00 0.00 C ATOM 507 O LEU A 35 -8.292 1.447 -9.389 1.00 0.00 O ATOM 508 CB LEU A 35 -11.314 1.133 -9.279 1.00 0.00 C ATOM 509 CG LEU A 35 -12.691 0.473 -9.238 1.00 0.00 C ATOM 510 CD1 LEU A 35 -13.531 1.071 -8.123 1.00 0.00 C ATOM 511 CD2 LEU A 35 -13.395 0.635 -10.578 1.00 0.00 C ATOM 0 H LEU A 35 -9.581 -0.888 -8.879 1.00 0.00 H new ATOM 0 HA LEU A 35 -10.779 0.442 -11.238 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -10.886 1.105 -8.277 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -11.440 2.183 -9.543 1.00 0.00 H new ATOM 0 HG LEU A 35 -12.561 -0.591 -9.041 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -14.509 0.590 -8.107 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -13.033 0.912 -7.167 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -13.655 2.140 -8.294 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -14.375 0.160 -10.534 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -13.516 1.695 -10.800 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.799 0.166 -11.361 1.00 0.00 H new ATOM 523 N LEU A 36 -8.872 1.990 -11.486 1.00 0.00 N ATOM 524 CA LEU A 36 -7.703 2.817 -11.695 1.00 0.00 C ATOM 525 C LEU A 36 -8.078 4.284 -11.540 1.00 0.00 C ATOM 526 O LEU A 36 -8.591 4.913 -12.470 1.00 0.00 O ATOM 527 CB LEU A 36 -7.098 2.567 -13.080 1.00 0.00 C ATOM 528 CG LEU A 36 -5.569 2.456 -13.122 1.00 0.00 C ATOM 529 CD1 LEU A 36 -5.086 2.315 -14.557 1.00 0.00 C ATOM 530 CD2 LEU A 36 -4.911 3.656 -12.455 1.00 0.00 C ATOM 0 H LEU A 36 -9.508 1.944 -12.282 1.00 0.00 H new ATOM 0 HA LEU A 36 -6.954 2.557 -10.947 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -7.523 1.647 -13.482 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -7.405 3.376 -13.743 1.00 0.00 H new ATOM 0 HG LEU A 36 -5.282 1.563 -12.566 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -3.999 2.237 -14.569 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -5.519 1.418 -15.000 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -5.394 3.188 -15.132 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -3.827 3.549 -12.500 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -5.207 4.568 -12.973 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.227 3.712 -11.413 1.00 0.00 H new ATOM 542 N PHE A 37 -7.851 4.811 -10.352 1.00 0.00 N ATOM 543 CA PHE A 37 -8.104 6.211 -10.084 1.00 0.00 C ATOM 544 C PHE A 37 -6.970 7.048 -10.651 1.00 0.00 C ATOM 545 O PHE A 37 -5.934 7.217 -10.010 1.00 0.00 O ATOM 546 CB PHE A 37 -8.246 6.464 -8.579 1.00 0.00 C ATOM 547 CG PHE A 37 -9.429 5.781 -7.952 1.00 0.00 C ATOM 548 CD1 PHE A 37 -9.353 4.456 -7.552 1.00 0.00 C ATOM 549 CD2 PHE A 37 -10.617 6.467 -7.759 1.00 0.00 C ATOM 550 CE1 PHE A 37 -10.439 3.828 -6.974 1.00 0.00 C ATOM 551 CE2 PHE A 37 -11.707 5.844 -7.180 1.00 0.00 C ATOM 552 CZ PHE A 37 -11.618 4.523 -6.787 1.00 0.00 C ATOM 0 H PHE A 37 -7.490 4.287 -9.555 1.00 0.00 H new ATOM 0 HA PHE A 37 -9.041 6.495 -10.563 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -7.338 6.128 -8.078 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -8.327 7.537 -8.408 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -8.433 3.908 -7.694 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -10.693 7.500 -8.064 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -10.366 2.795 -6.669 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -12.627 6.390 -7.035 1.00 0.00 H new ATOM 0 HZ PHE A 37 -12.468 4.034 -6.334 1.00 0.00 H new ATOM 562 N LEU A 38 -7.155 7.526 -11.870 1.00 0.00 N ATOM 563 CA LEU A 38 -6.145 8.329 -12.529 1.00 0.00 C ATOM 564 C LEU A 38 -6.155 9.741 -11.959 1.00 0.00 C ATOM 565 O LEU A 38 -7.152 10.164 -11.371 1.00 0.00 O ATOM 566 CB LEU A 38 -6.381 8.346 -14.046 1.00 0.00 C ATOM 567 CG LEU A 38 -6.128 7.009 -14.752 1.00 0.00 C ATOM 568 CD1 LEU A 38 -6.433 7.115 -16.237 1.00 0.00 C ATOM 569 CD2 LEU A 38 -4.689 6.562 -14.543 1.00 0.00 C ATOM 0 H LEU A 38 -7.998 7.370 -12.422 1.00 0.00 H new ATOM 0 HA LEU A 38 -5.164 7.890 -12.347 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.410 8.652 -14.236 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.736 9.103 -14.491 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.794 6.265 -14.316 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.246 6.154 -16.716 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.478 7.392 -16.375 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.794 7.875 -16.686 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.526 5.611 -15.051 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -4.012 7.312 -14.952 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.497 6.442 -13.477 1.00 0.00 H new ATOM 581 N PRO A 39 -5.046 10.484 -12.108 1.00 0.00 N ATOM 582 CA PRO A 39 -4.909 11.847 -11.571 1.00 0.00 C ATOM 583 C PRO A 39 -5.787 12.874 -12.291 1.00 0.00 C ATOM 584 O PRO A 39 -5.339 13.985 -12.583 1.00 0.00 O ATOM 585 CB PRO A 39 -3.424 12.176 -11.799 1.00 0.00 C ATOM 586 CG PRO A 39 -2.771 10.875 -12.109 1.00 0.00 C ATOM 587 CD PRO A 39 -3.819 10.048 -12.785 1.00 0.00 C ATOM 0 HA PRO A 39 -5.226 11.891 -10.529 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -3.300 12.883 -12.620 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -2.983 12.635 -10.914 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -1.905 11.016 -12.756 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -2.414 10.389 -11.201 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -3.857 10.237 -13.858 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -3.641 8.980 -12.656 1.00 0.00 H new ATOM 595 N ASP A 40 -7.036 12.504 -12.543 1.00 0.00 N ATOM 596 CA ASP A 40 -8.000 13.375 -13.206 1.00 0.00 C ATOM 597 C ASP A 40 -9.396 12.777 -13.096 1.00 0.00 C ATOM 598 O ASP A 40 -10.318 13.412 -12.583 1.00 0.00 O ATOM 599 CB ASP A 40 -7.642 13.570 -14.684 1.00 0.00 C ATOM 600 CG ASP A 40 -8.577 14.541 -15.386 1.00 0.00 C ATOM 601 OD1 ASP A 40 -8.309 15.765 -15.357 1.00 0.00 O ATOM 602 OD2 ASP A 40 -9.573 14.091 -15.986 1.00 0.00 O ATOM 0 H ASP A 40 -7.411 11.589 -12.293 1.00 0.00 H new ATOM 0 HA ASP A 40 -7.975 14.347 -12.713 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -6.618 13.936 -14.761 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -7.675 12.607 -15.193 1.00 0.00 H new ATOM 607 N ALA A 41 -9.533 11.541 -13.562 1.00 0.00 N ATOM 608 CA ALA A 41 -10.818 10.857 -13.561 1.00 0.00 C ATOM 609 C ALA A 41 -10.659 9.398 -13.151 1.00 0.00 C ATOM 610 O ALA A 41 -9.550 8.859 -13.155 1.00 0.00 O ATOM 611 CB ALA A 41 -11.463 10.950 -14.935 1.00 0.00 C ATOM 0 H ALA A 41 -8.765 10.991 -13.947 1.00 0.00 H new ATOM 0 HA ALA A 41 -11.464 11.346 -12.832 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -12.423 10.435 -14.922 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -11.617 11.997 -15.195 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -10.812 10.485 -15.675 1.00 0.00 H new ATOM 617 N VAL A 42 -11.771 8.765 -12.804 1.00 0.00 N ATOM 618 CA VAL A 42 -11.760 7.371 -12.390 1.00 0.00 C ATOM 619 C VAL A 42 -11.975 6.457 -13.590 1.00 0.00 C ATOM 620 O VAL A 42 -13.010 6.523 -14.255 1.00 0.00 O ATOM 621 CB VAL A 42 -12.853 7.088 -11.338 1.00 0.00 C ATOM 622 CG1 VAL A 42 -12.761 5.655 -10.831 1.00 0.00 C ATOM 623 CG2 VAL A 42 -12.753 8.075 -10.187 1.00 0.00 C ATOM 0 H VAL A 42 -12.695 9.198 -12.801 1.00 0.00 H new ATOM 0 HA VAL A 42 -10.785 7.171 -11.946 1.00 0.00 H new ATOM 0 HB VAL A 42 -13.825 7.214 -11.814 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -13.542 5.480 -10.091 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -12.890 4.965 -11.665 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -11.785 5.493 -10.374 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -13.531 7.860 -9.455 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -11.775 7.985 -9.714 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -12.881 9.089 -10.565 1.00 0.00 H new ATOM 633 N TRP A 43 -10.992 5.619 -13.871 1.00 0.00 N ATOM 634 CA TRP A 43 -11.081 4.676 -14.974 1.00 0.00 C ATOM 635 C TRP A 43 -11.065 3.242 -14.459 1.00 0.00 C ATOM 636 O TRP A 43 -10.919 3.000 -13.260 1.00 0.00 O ATOM 637 CB TRP A 43 -9.931 4.893 -15.962 1.00 0.00 C ATOM 638 CG TRP A 43 -10.138 6.061 -16.882 1.00 0.00 C ATOM 639 CD1 TRP A 43 -10.009 7.386 -16.578 1.00 0.00 C ATOM 640 CD2 TRP A 43 -10.505 6.001 -18.266 1.00 0.00 C ATOM 641 NE1 TRP A 43 -10.280 8.152 -17.687 1.00 0.00 N ATOM 642 CE2 TRP A 43 -10.585 7.325 -18.735 1.00 0.00 C ATOM 643 CE3 TRP A 43 -10.775 4.954 -19.153 1.00 0.00 C ATOM 644 CZ2 TRP A 43 -10.923 7.630 -20.050 1.00 0.00 C ATOM 645 CZ3 TRP A 43 -11.112 5.259 -20.459 1.00 0.00 C ATOM 646 CH2 TRP A 43 -11.182 6.587 -20.897 1.00 0.00 C ATOM 0 H TRP A 43 -10.118 5.572 -13.347 1.00 0.00 H new ATOM 0 HA TRP A 43 -12.024 4.849 -15.492 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -9.007 5.041 -15.403 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -9.801 3.990 -16.559 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -9.734 7.775 -15.609 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -10.258 9.171 -17.723 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -10.721 3.927 -18.824 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -10.979 8.654 -20.390 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -11.325 4.459 -21.153 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -11.446 6.792 -21.924 1.00 0.00 H new ATOM 657 N GLY A 44 -11.220 2.295 -15.370 1.00 0.00 N ATOM 658 CA GLY A 44 -11.221 0.898 -14.992 1.00 0.00 C ATOM 659 C GLY A 44 -9.935 0.206 -15.386 1.00 0.00 C ATOM 660 O GLY A 44 -9.338 0.534 -16.414 1.00 0.00 O ATOM 0 H GLY A 44 -11.345 2.469 -16.367 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -11.363 0.814 -13.915 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -12.064 0.394 -15.465 1.00 0.00 H new ATOM 664 N TRP A 45 -9.507 -0.746 -14.572 1.00 0.00 N ATOM 665 CA TRP A 45 -8.284 -1.486 -14.835 1.00 0.00 C ATOM 666 C TRP A 45 -8.539 -2.972 -14.622 1.00 0.00 C ATOM 667 O TRP A 45 -8.795 -3.411 -13.502 1.00 0.00 O ATOM 668 CB TRP A 45 -7.168 -0.987 -13.912 1.00 0.00 C ATOM 669 CG TRP A 45 -5.796 -1.451 -14.297 1.00 0.00 C ATOM 670 CD1 TRP A 45 -5.247 -1.442 -15.548 1.00 0.00 C ATOM 671 CD2 TRP A 45 -4.788 -1.966 -13.419 1.00 0.00 C ATOM 672 NE1 TRP A 45 -3.965 -1.932 -15.502 1.00 0.00 N ATOM 673 CE2 TRP A 45 -3.660 -2.259 -14.206 1.00 0.00 C ATOM 674 CE3 TRP A 45 -4.732 -2.212 -12.044 1.00 0.00 C ATOM 675 CZ2 TRP A 45 -2.489 -2.783 -13.664 1.00 0.00 C ATOM 676 CZ3 TRP A 45 -3.569 -2.731 -11.506 1.00 0.00 C ATOM 677 CH2 TRP A 45 -2.462 -3.013 -12.316 1.00 0.00 C ATOM 0 H TRP A 45 -9.992 -1.025 -13.719 1.00 0.00 H new ATOM 0 HA TRP A 45 -7.971 -1.328 -15.867 1.00 0.00 H new ATOM 0 HB2 TRP A 45 -7.181 0.103 -13.902 1.00 0.00 H new ATOM 0 HB3 TRP A 45 -7.379 -1.318 -12.895 1.00 0.00 H new ATOM 0 HD1 TRP A 45 -5.748 -1.100 -16.442 1.00 0.00 H new ATOM 0 HE1 TRP A 45 -3.341 -2.036 -16.302 1.00 0.00 H new ATOM 0 HE3 TRP A 45 -5.583 -2.000 -11.413 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 -1.633 -3.000 -14.286 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 -3.513 -2.922 -10.444 1.00 0.00 H new ATOM 0 HH2 TRP A 45 -1.568 -3.421 -11.867 1.00 0.00 H new ATOM 688 N ASP A 46 -8.494 -3.747 -15.695 1.00 0.00 N ATOM 689 CA ASP A 46 -8.839 -5.160 -15.608 1.00 0.00 C ATOM 690 C ASP A 46 -7.651 -5.985 -15.131 1.00 0.00 C ATOM 691 O ASP A 46 -6.969 -6.639 -15.920 1.00 0.00 O ATOM 692 CB ASP A 46 -9.346 -5.698 -16.950 1.00 0.00 C ATOM 693 CG ASP A 46 -10.127 -6.994 -16.795 1.00 0.00 C ATOM 694 OD1 ASP A 46 -9.558 -7.997 -16.323 1.00 0.00 O ATOM 695 OD2 ASP A 46 -11.327 -7.015 -17.146 1.00 0.00 O ATOM 0 H ASP A 46 -8.226 -3.428 -16.626 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.643 -5.250 -14.878 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -9.981 -4.948 -17.423 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -8.499 -5.864 -17.616 1.00 0.00 H new ATOM 700 N VAL A 47 -7.375 -5.891 -13.841 1.00 0.00 N ATOM 701 CA VAL A 47 -6.412 -6.758 -13.182 1.00 0.00 C ATOM 702 C VAL A 47 -6.970 -7.162 -11.826 1.00 0.00 C ATOM 703 O VAL A 47 -6.796 -6.458 -10.834 1.00 0.00 O ATOM 704 CB VAL A 47 -5.025 -6.090 -13.000 1.00 0.00 C ATOM 705 CG1 VAL A 47 -4.070 -7.012 -12.255 1.00 0.00 C ATOM 706 CG2 VAL A 47 -4.427 -5.701 -14.343 1.00 0.00 C ATOM 0 H VAL A 47 -7.813 -5.210 -13.220 1.00 0.00 H new ATOM 0 HA VAL A 47 -6.258 -7.630 -13.818 1.00 0.00 H new ATOM 0 HB VAL A 47 -5.171 -5.186 -12.408 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -3.104 -6.520 -12.140 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -4.479 -7.242 -11.271 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -3.942 -7.936 -12.819 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -3.454 -5.235 -14.187 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -4.307 -6.592 -14.960 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -5.090 -4.997 -14.846 1.00 0.00 H new ATOM 716 N THR A 48 -7.690 -8.270 -11.807 1.00 0.00 N ATOM 717 CA THR A 48 -8.359 -8.725 -10.601 1.00 0.00 C ATOM 718 C THR A 48 -7.423 -9.541 -9.714 1.00 0.00 C ATOM 719 O THR A 48 -7.659 -9.691 -8.518 1.00 0.00 O ATOM 720 CB THR A 48 -9.600 -9.557 -10.960 1.00 0.00 C ATOM 721 OG1 THR A 48 -9.320 -10.364 -12.115 1.00 0.00 O ATOM 722 CG2 THR A 48 -10.794 -8.658 -11.241 1.00 0.00 C ATOM 0 H THR A 48 -7.827 -8.874 -12.618 1.00 0.00 H new ATOM 0 HA THR A 48 -8.667 -7.842 -10.042 1.00 0.00 H new ATOM 0 HB THR A 48 -9.844 -10.198 -10.113 1.00 0.00 H new ATOM 0 HG1 THR A 48 -10.111 -10.896 -12.342 1.00 0.00 H new ATOM 0 HG21 THR A 48 -11.660 -9.271 -11.493 1.00 0.00 H new ATOM 0 HG22 THR A 48 -11.017 -8.062 -10.356 1.00 0.00 H new ATOM 0 HG23 THR A 48 -10.563 -7.996 -12.076 1.00 0.00 H new ATOM 730 N LYS A 49 -6.358 -10.062 -10.303 1.00 0.00 N ATOM 731 CA LYS A 49 -5.378 -10.826 -9.550 1.00 0.00 C ATOM 732 C LYS A 49 -3.997 -10.182 -9.677 1.00 0.00 C ATOM 733 O LYS A 49 -3.430 -10.114 -10.768 1.00 0.00 O ATOM 734 CB LYS A 49 -5.365 -12.289 -10.011 1.00 0.00 C ATOM 735 CG LYS A 49 -6.651 -13.037 -9.668 1.00 0.00 C ATOM 736 CD LYS A 49 -6.550 -14.523 -9.976 1.00 0.00 C ATOM 737 CE LYS A 49 -7.745 -15.298 -9.428 1.00 0.00 C ATOM 738 NZ LYS A 49 -9.003 -15.017 -10.175 1.00 0.00 N ATOM 0 H LYS A 49 -6.151 -9.970 -11.298 1.00 0.00 H new ATOM 0 HA LYS A 49 -5.655 -10.818 -8.496 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -5.209 -12.322 -11.089 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -4.520 -12.801 -9.551 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -6.877 -12.901 -8.610 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -7.480 -12.607 -10.229 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -6.487 -14.667 -11.055 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -5.631 -14.921 -9.547 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -7.532 -16.366 -9.472 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -7.887 -15.045 -8.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -9.805 -15.459 -9.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -9.153 -13.989 -10.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -8.930 -15.406 -11.137 1.00 0.00 H new ATOM 752 N PRO A 50 -3.454 -9.693 -8.546 1.00 0.00 N ATOM 753 CA PRO A 50 -2.212 -8.898 -8.510 1.00 0.00 C ATOM 754 C PRO A 50 -0.995 -9.608 -9.103 1.00 0.00 C ATOM 755 O PRO A 50 -0.052 -8.961 -9.549 1.00 0.00 O ATOM 756 CB PRO A 50 -1.990 -8.642 -7.015 1.00 0.00 C ATOM 757 CG PRO A 50 -3.332 -8.810 -6.393 1.00 0.00 C ATOM 758 CD PRO A 50 -4.023 -9.872 -7.198 1.00 0.00 C ATOM 0 HA PRO A 50 -2.318 -7.998 -9.116 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.270 -9.345 -6.597 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -1.596 -7.641 -6.840 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -3.245 -9.106 -5.348 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -3.893 -7.876 -6.414 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -3.824 -10.869 -6.805 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -5.105 -9.739 -7.196 1.00 0.00 H new ATOM 766 N GLU A 51 -1.016 -10.931 -9.122 1.00 0.00 N ATOM 767 CA GLU A 51 0.118 -11.699 -9.630 1.00 0.00 C ATOM 768 C GLU A 51 0.298 -11.503 -11.138 1.00 0.00 C ATOM 769 O GLU A 51 1.365 -11.782 -11.687 1.00 0.00 O ATOM 770 CB GLU A 51 -0.061 -13.184 -9.313 1.00 0.00 C ATOM 771 CG GLU A 51 -0.080 -13.488 -7.825 1.00 0.00 C ATOM 772 CD GLU A 51 -0.362 -14.946 -7.537 1.00 0.00 C ATOM 773 OE1 GLU A 51 -1.532 -15.358 -7.653 1.00 0.00 O ATOM 774 OE2 GLU A 51 0.584 -15.690 -7.200 1.00 0.00 O ATOM 0 H GLU A 51 -1.799 -11.496 -8.794 1.00 0.00 H new ATOM 0 HA GLU A 51 1.016 -11.332 -9.133 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -0.992 -13.533 -9.759 1.00 0.00 H new ATOM 0 HB3 GLU A 51 0.747 -13.747 -9.781 1.00 0.00 H new ATOM 0 HG2 GLU A 51 0.880 -13.214 -7.389 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -0.838 -12.872 -7.341 1.00 0.00 H new ATOM 781 N GLN A 52 -0.736 -11.000 -11.801 1.00 0.00 N ATOM 782 CA GLN A 52 -0.698 -10.833 -13.248 1.00 0.00 C ATOM 783 C GLN A 52 -0.320 -9.395 -13.626 1.00 0.00 C ATOM 784 O GLN A 52 -0.491 -8.972 -14.771 1.00 0.00 O ATOM 785 CB GLN A 52 -2.054 -11.219 -13.850 1.00 0.00 C ATOM 786 CG GLN A 52 -2.022 -11.455 -15.356 1.00 0.00 C ATOM 787 CD GLN A 52 -1.006 -12.506 -15.768 1.00 0.00 C ATOM 788 OE1 GLN A 52 -0.697 -13.426 -15.010 1.00 0.00 O ATOM 789 NE2 GLN A 52 -0.491 -12.386 -16.983 1.00 0.00 N ATOM 0 H GLN A 52 -1.607 -10.702 -11.362 1.00 0.00 H new ATOM 0 HA GLN A 52 0.068 -11.492 -13.656 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.413 -12.123 -13.359 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -2.774 -10.430 -13.632 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -3.012 -11.763 -15.692 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -1.792 -10.517 -15.861 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -0.772 -11.610 -17.582 1.00 0.00 H new ATOM 0 HE22 GLN A 52 0.187 -13.070 -17.320 1.00 0.00 H new ATOM 798 N ILE A 53 0.204 -8.642 -12.664 1.00 0.00 N ATOM 799 CA ILE A 53 0.704 -7.303 -12.950 1.00 0.00 C ATOM 800 C ILE A 53 1.971 -7.390 -13.798 1.00 0.00 C ATOM 801 O ILE A 53 2.949 -8.038 -13.412 1.00 0.00 O ATOM 802 CB ILE A 53 0.985 -6.494 -11.660 1.00 0.00 C ATOM 803 CG1 ILE A 53 -0.324 -6.229 -10.908 1.00 0.00 C ATOM 804 CG2 ILE A 53 1.682 -5.179 -11.989 1.00 0.00 C ATOM 805 CD1 ILE A 53 -0.140 -5.474 -9.607 1.00 0.00 C ATOM 0 H ILE A 53 0.293 -8.932 -11.690 1.00 0.00 H new ATOM 0 HA ILE A 53 -0.074 -6.775 -13.502 1.00 0.00 H new ATOM 0 HB ILE A 53 1.646 -7.081 -11.022 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -0.995 -5.663 -11.554 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -0.811 -7.181 -10.699 1.00 0.00 H new ATOM 0 HG21 ILE A 53 1.870 -4.627 -11.068 1.00 0.00 H new ATOM 0 HG22 ILE A 53 2.629 -5.384 -12.489 1.00 0.00 H new ATOM 0 HG23 ILE A 53 1.046 -4.585 -12.645 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -1.110 -5.324 -9.133 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.505 -6.048 -8.941 1.00 0.00 H new ATOM 0 HD13 ILE A 53 0.318 -4.506 -9.810 1.00 0.00 H new ATOM 817 N ASP A 54 1.930 -6.753 -14.960 1.00 0.00 N ATOM 818 CA ASP A 54 3.026 -6.799 -15.922 1.00 0.00 C ATOM 819 C ASP A 54 3.056 -5.494 -16.709 1.00 0.00 C ATOM 820 O ASP A 54 2.112 -4.709 -16.621 1.00 0.00 O ATOM 821 CB ASP A 54 2.833 -7.997 -16.865 1.00 0.00 C ATOM 822 CG ASP A 54 3.924 -8.120 -17.910 1.00 0.00 C ATOM 823 OD1 ASP A 54 5.001 -8.666 -17.591 1.00 0.00 O ATOM 824 OD2 ASP A 54 3.712 -7.661 -19.052 1.00 0.00 O ATOM 0 H ASP A 54 1.136 -6.189 -15.264 1.00 0.00 H new ATOM 0 HA ASP A 54 3.976 -6.919 -15.401 1.00 0.00 H new ATOM 0 HB2 ASP A 54 2.800 -8.913 -16.275 1.00 0.00 H new ATOM 0 HB3 ASP A 54 1.869 -7.905 -17.365 1.00 0.00 H new ATOM 829 N ARG A 55 4.124 -5.258 -17.470 1.00 0.00 N ATOM 830 CA ARG A 55 4.240 -4.047 -18.282 1.00 0.00 C ATOM 831 C ARG A 55 3.073 -3.937 -19.258 1.00 0.00 C ATOM 832 O ARG A 55 2.605 -2.841 -19.557 1.00 0.00 O ATOM 833 CB ARG A 55 5.563 -4.029 -19.054 1.00 0.00 C ATOM 834 CG ARG A 55 6.795 -3.970 -18.165 1.00 0.00 C ATOM 835 CD ARG A 55 8.069 -3.811 -18.983 1.00 0.00 C ATOM 836 NE ARG A 55 8.313 -4.959 -19.857 1.00 0.00 N ATOM 837 CZ ARG A 55 8.454 -4.873 -21.182 1.00 0.00 C ATOM 838 NH1 ARG A 55 8.373 -3.692 -21.788 1.00 0.00 N ATOM 839 NH2 ARG A 55 8.681 -5.967 -21.898 1.00 0.00 N ATOM 0 H ARG A 55 4.922 -5.890 -17.541 1.00 0.00 H new ATOM 0 HA ARG A 55 4.218 -3.192 -17.606 1.00 0.00 H new ATOM 0 HB2 ARG A 55 5.620 -4.921 -19.678 1.00 0.00 H new ATOM 0 HB3 ARG A 55 5.569 -3.170 -19.724 1.00 0.00 H new ATOM 0 HG2 ARG A 55 6.702 -3.136 -17.469 1.00 0.00 H new ATOM 0 HG3 ARG A 55 6.857 -4.879 -17.567 1.00 0.00 H new ATOM 0 HD2 ARG A 55 8.001 -2.906 -19.586 1.00 0.00 H new ATOM 0 HD3 ARG A 55 8.917 -3.682 -18.310 1.00 0.00 H new ATOM 0 HE ARG A 55 8.379 -5.882 -19.428 1.00 0.00 H new ATOM 0 HH11 ARG A 55 8.203 -2.848 -21.240 1.00 0.00 H new ATOM 0 HH12 ARG A 55 8.481 -3.630 -22.800 1.00 0.00 H new ATOM 0 HH21 ARG A 55 8.748 -6.874 -21.436 1.00 0.00 H new ATOM 0 HH22 ARG A 55 8.789 -5.901 -22.910 1.00 0.00 H new ATOM 853 N TYR A 56 2.602 -5.083 -19.736 1.00 0.00 N ATOM 854 CA TYR A 56 1.444 -5.135 -20.624 1.00 0.00 C ATOM 855 C TYR A 56 0.197 -4.604 -19.917 1.00 0.00 C ATOM 856 O TYR A 56 -0.560 -3.812 -20.474 1.00 0.00 O ATOM 857 CB TYR A 56 1.221 -6.574 -21.102 1.00 0.00 C ATOM 858 CG TYR A 56 -0.067 -6.782 -21.867 1.00 0.00 C ATOM 859 CD1 TYR A 56 -0.211 -6.326 -23.172 1.00 0.00 C ATOM 860 CD2 TYR A 56 -1.142 -7.438 -21.280 1.00 0.00 C ATOM 861 CE1 TYR A 56 -1.391 -6.517 -23.867 1.00 0.00 C ATOM 862 CE2 TYR A 56 -2.322 -7.631 -21.968 1.00 0.00 C ATOM 863 CZ TYR A 56 -2.443 -7.170 -23.259 1.00 0.00 C ATOM 864 OH TYR A 56 -3.620 -7.363 -23.943 1.00 0.00 O ATOM 0 H TYR A 56 3.007 -5.995 -19.522 1.00 0.00 H new ATOM 0 HA TYR A 56 1.636 -4.501 -21.490 1.00 0.00 H new ATOM 0 HB2 TYR A 56 2.058 -6.868 -21.735 1.00 0.00 H new ATOM 0 HB3 TYR A 56 1.228 -7.237 -20.237 1.00 0.00 H new ATOM 0 HD1 TYR A 56 0.611 -5.815 -23.650 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -1.052 -7.803 -20.268 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -1.488 -6.157 -24.880 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -3.148 -8.142 -21.495 1.00 0.00 H new ATOM 0 HH TYR A 56 -4.257 -7.840 -23.371 1.00 0.00 H new ATOM 874 N SER A 57 -0.004 -5.034 -18.680 1.00 0.00 N ATOM 875 CA SER A 57 -1.146 -4.591 -17.897 1.00 0.00 C ATOM 876 C SER A 57 -0.968 -3.135 -17.465 1.00 0.00 C ATOM 877 O SER A 57 -1.939 -2.389 -17.326 1.00 0.00 O ATOM 878 CB SER A 57 -1.318 -5.494 -16.674 1.00 0.00 C ATOM 879 OG SER A 57 -1.359 -6.862 -17.058 1.00 0.00 O ATOM 0 H SER A 57 0.610 -5.690 -18.197 1.00 0.00 H new ATOM 0 HA SER A 57 -2.042 -4.656 -18.514 1.00 0.00 H new ATOM 0 HB2 SER A 57 -0.495 -5.332 -15.978 1.00 0.00 H new ATOM 0 HB3 SER A 57 -2.236 -5.231 -16.149 1.00 0.00 H new ATOM 0 HG SER A 57 -1.094 -7.423 -16.299 1.00 0.00 H new ATOM 885 N LEU A 58 0.284 -2.731 -17.284 1.00 0.00 N ATOM 886 CA LEU A 58 0.605 -1.379 -16.845 1.00 0.00 C ATOM 887 C LEU A 58 0.711 -0.420 -18.027 1.00 0.00 C ATOM 888 O LEU A 58 1.059 0.747 -17.850 1.00 0.00 O ATOM 889 CB LEU A 58 1.917 -1.372 -16.055 1.00 0.00 C ATOM 890 CG LEU A 58 1.894 -2.146 -14.735 1.00 0.00 C ATOM 891 CD1 LEU A 58 3.273 -2.144 -14.094 1.00 0.00 C ATOM 892 CD2 LEU A 58 0.868 -1.550 -13.785 1.00 0.00 C ATOM 0 H LEU A 58 1.099 -3.326 -17.436 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.207 -1.040 -16.201 1.00 0.00 H new ATOM 0 HB2 LEU A 58 2.703 -1.787 -16.686 1.00 0.00 H new ATOM 0 HB3 LEU A 58 2.189 -0.338 -15.845 1.00 0.00 H new ATOM 0 HG LEU A 58 1.611 -3.177 -14.946 1.00 0.00 H new ATOM 0 HD11 LEU A 58 3.239 -2.699 -13.156 1.00 0.00 H new ATOM 0 HD12 LEU A 58 3.988 -2.615 -14.768 1.00 0.00 H new ATOM 0 HD13 LEU A 58 3.581 -1.117 -13.897 1.00 0.00 H new ATOM 0 HD21 LEU A 58 0.866 -2.113 -12.852 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.122 -0.510 -13.581 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.121 -1.599 -14.240 1.00 0.00 H new ATOM 904 N GLN A 59 0.404 -0.908 -19.226 1.00 0.00 N ATOM 905 CA GLN A 59 0.451 -0.079 -20.430 1.00 0.00 C ATOM 906 C GLN A 59 -0.473 1.128 -20.281 1.00 0.00 C ATOM 907 O GLN A 59 -0.173 2.223 -20.756 1.00 0.00 O ATOM 908 CB GLN A 59 0.041 -0.902 -21.655 1.00 0.00 C ATOM 909 CG GLN A 59 0.136 -0.141 -22.969 1.00 0.00 C ATOM 910 CD GLN A 59 -0.393 -0.936 -24.147 1.00 0.00 C ATOM 911 OE1 GLN A 59 -0.325 -2.166 -24.168 1.00 0.00 O ATOM 912 NE2 GLN A 59 -0.924 -0.239 -25.139 1.00 0.00 N ATOM 0 H GLN A 59 0.120 -1.874 -19.391 1.00 0.00 H new ATOM 0 HA GLN A 59 1.473 0.275 -20.567 1.00 0.00 H new ATOM 0 HB2 GLN A 59 0.673 -1.788 -21.713 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -0.983 -1.249 -21.521 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -0.423 0.791 -22.885 1.00 0.00 H new ATOM 0 HG3 GLN A 59 1.176 0.126 -23.155 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -0.962 0.779 -25.084 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -1.295 -0.720 -25.958 1.00 0.00 H new ATOM 921 N ARG A 60 -1.583 0.916 -19.583 1.00 0.00 N ATOM 922 CA ARG A 60 -2.567 1.968 -19.351 1.00 0.00 C ATOM 923 C ARG A 60 -1.997 3.026 -18.403 1.00 0.00 C ATOM 924 O ARG A 60 -2.459 4.165 -18.368 1.00 0.00 O ATOM 925 CB ARG A 60 -3.842 1.348 -18.770 1.00 0.00 C ATOM 926 CG ARG A 60 -5.092 2.194 -18.951 1.00 0.00 C ATOM 927 CD ARG A 60 -6.349 1.376 -18.681 1.00 0.00 C ATOM 928 NE ARG A 60 -6.421 0.193 -19.546 1.00 0.00 N ATOM 929 CZ ARG A 60 -7.513 -0.557 -19.713 1.00 0.00 C ATOM 930 NH1 ARG A 60 -8.635 -0.276 -19.062 1.00 0.00 N ATOM 931 NH2 ARG A 60 -7.478 -1.603 -20.529 1.00 0.00 N ATOM 0 H ARG A 60 -1.825 0.018 -19.165 1.00 0.00 H new ATOM 0 HA ARG A 60 -2.808 2.457 -20.295 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -4.005 0.377 -19.238 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -3.691 1.168 -17.706 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -5.058 3.049 -18.275 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -5.123 2.591 -19.966 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -6.364 1.065 -17.636 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -7.230 1.998 -18.841 1.00 0.00 H new ATOM 0 HE ARG A 60 -5.579 -0.075 -20.055 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -8.670 0.520 -18.426 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -9.463 -0.856 -19.198 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -6.618 -1.833 -21.027 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -8.311 -2.177 -20.658 1.00 0.00 H new ATOM 945 N VAL A 61 -0.971 2.635 -17.653 1.00 0.00 N ATOM 946 CA VAL A 61 -0.310 3.532 -16.714 1.00 0.00 C ATOM 947 C VAL A 61 0.853 4.251 -17.396 1.00 0.00 C ATOM 948 O VAL A 61 1.007 5.464 -17.257 1.00 0.00 O ATOM 949 CB VAL A 61 0.213 2.764 -15.479 1.00 0.00 C ATOM 950 CG1 VAL A 61 0.879 3.711 -14.490 1.00 0.00 C ATOM 951 CG2 VAL A 61 -0.915 1.994 -14.809 1.00 0.00 C ATOM 0 H VAL A 61 -0.578 1.694 -17.679 1.00 0.00 H new ATOM 0 HA VAL A 61 -1.046 4.264 -16.382 1.00 0.00 H new ATOM 0 HB VAL A 61 0.963 2.049 -15.818 1.00 0.00 H new ATOM 0 HG11 VAL A 61 1.238 3.145 -13.630 1.00 0.00 H new ATOM 0 HG12 VAL A 61 1.719 4.210 -14.973 1.00 0.00 H new ATOM 0 HG13 VAL A 61 0.157 4.457 -14.158 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -0.526 1.460 -13.942 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -1.691 2.690 -14.489 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.338 1.280 -15.515 1.00 0.00 H new ATOM 961 N PHE A 62 1.656 3.494 -18.149 1.00 0.00 N ATOM 962 CA PHE A 62 2.797 4.057 -18.879 1.00 0.00 C ATOM 963 C PHE A 62 2.357 5.188 -19.803 1.00 0.00 C ATOM 964 O PHE A 62 3.067 6.181 -19.970 1.00 0.00 O ATOM 965 CB PHE A 62 3.504 2.981 -19.711 1.00 0.00 C ATOM 966 CG PHE A 62 4.364 2.038 -18.919 1.00 0.00 C ATOM 967 CD1 PHE A 62 5.551 2.473 -18.353 1.00 0.00 C ATOM 968 CD2 PHE A 62 3.997 0.711 -18.758 1.00 0.00 C ATOM 969 CE1 PHE A 62 6.354 1.605 -17.640 1.00 0.00 C ATOM 970 CE2 PHE A 62 4.795 -0.162 -18.043 1.00 0.00 C ATOM 971 CZ PHE A 62 5.975 0.286 -17.484 1.00 0.00 C ATOM 0 H PHE A 62 1.537 2.488 -18.270 1.00 0.00 H new ATOM 0 HA PHE A 62 3.489 4.451 -18.135 1.00 0.00 H new ATOM 0 HB2 PHE A 62 2.751 2.402 -20.246 1.00 0.00 H new ATOM 0 HB3 PHE A 62 4.123 3.471 -20.463 1.00 0.00 H new ATOM 0 HD1 PHE A 62 5.852 3.503 -18.471 1.00 0.00 H new ATOM 0 HD2 PHE A 62 3.076 0.355 -19.197 1.00 0.00 H new ATOM 0 HE1 PHE A 62 7.278 1.957 -17.205 1.00 0.00 H new ATOM 0 HE2 PHE A 62 4.496 -1.193 -17.922 1.00 0.00 H new ATOM 0 HZ PHE A 62 6.601 -0.394 -16.925 1.00 0.00 H new ATOM 981 N ASP A 63 1.181 5.029 -20.396 1.00 0.00 N ATOM 982 CA ASP A 63 0.654 6.006 -21.344 1.00 0.00 C ATOM 983 C ASP A 63 0.416 7.361 -20.677 1.00 0.00 C ATOM 984 O ASP A 63 0.470 8.403 -21.329 1.00 0.00 O ATOM 985 CB ASP A 63 -0.650 5.490 -21.956 1.00 0.00 C ATOM 986 CG ASP A 63 -1.165 6.387 -23.064 1.00 0.00 C ATOM 987 OD1 ASP A 63 -0.672 6.265 -24.207 1.00 0.00 O ATOM 988 OD2 ASP A 63 -2.059 7.214 -22.803 1.00 0.00 O ATOM 0 H ASP A 63 0.570 4.228 -20.237 1.00 0.00 H new ATOM 0 HA ASP A 63 1.396 6.144 -22.130 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -0.491 4.486 -22.350 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -1.407 5.410 -21.176 1.00 0.00 H new ATOM 993 N ASN A 64 0.187 7.345 -19.371 1.00 0.00 N ATOM 994 CA ASN A 64 -0.124 8.563 -18.633 1.00 0.00 C ATOM 995 C ASN A 64 0.922 8.828 -17.555 1.00 0.00 C ATOM 996 O ASN A 64 0.630 9.456 -16.537 1.00 0.00 O ATOM 997 CB ASN A 64 -1.518 8.461 -17.999 1.00 0.00 C ATOM 998 CG ASN A 64 -2.631 8.455 -19.031 1.00 0.00 C ATOM 999 OD1 ASN A 64 -3.125 9.509 -19.433 1.00 0.00 O ATOM 1000 ND2 ASN A 64 -3.047 7.271 -19.460 1.00 0.00 N ATOM 0 H ASN A 64 0.211 6.501 -18.799 1.00 0.00 H new ATOM 0 HA ASN A 64 -0.114 9.397 -19.335 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -1.576 7.550 -17.403 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -1.665 9.298 -17.317 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -3.800 7.213 -20.146 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -2.614 6.419 -19.104 1.00 0.00 H new ATOM 1007 N ALA A 65 2.149 8.380 -17.807 1.00 0.00 N ATOM 1008 CA ALA A 65 3.239 8.503 -16.836 1.00 0.00 C ATOM 1009 C ALA A 65 3.522 9.959 -16.465 1.00 0.00 C ATOM 1010 O ALA A 65 3.939 10.248 -15.347 1.00 0.00 O ATOM 1011 CB ALA A 65 4.499 7.844 -17.376 1.00 0.00 C ATOM 0 H ALA A 65 2.417 7.926 -18.680 1.00 0.00 H new ATOM 0 HA ALA A 65 2.923 7.992 -15.926 1.00 0.00 H new ATOM 0 HB1 ALA A 65 5.302 7.942 -16.646 1.00 0.00 H new ATOM 0 HB2 ALA A 65 4.305 6.788 -17.563 1.00 0.00 H new ATOM 0 HB3 ALA A 65 4.793 8.330 -18.306 1.00 0.00 H new ATOM 1017 N ASN A 66 3.300 10.870 -17.406 1.00 0.00 N ATOM 1018 CA ASN A 66 3.501 12.300 -17.160 1.00 0.00 C ATOM 1019 C ASN A 66 2.548 12.812 -16.079 1.00 0.00 C ATOM 1020 O ASN A 66 2.899 13.680 -15.278 1.00 0.00 O ATOM 1021 CB ASN A 66 3.303 13.089 -18.460 1.00 0.00 C ATOM 1022 CG ASN A 66 3.374 14.594 -18.263 1.00 0.00 C ATOM 1023 OD1 ASN A 66 2.355 15.256 -18.063 1.00 0.00 O ATOM 1024 ND2 ASN A 66 4.576 15.147 -18.327 1.00 0.00 N ATOM 0 H ASN A 66 2.980 10.647 -18.349 1.00 0.00 H new ATOM 0 HA ASN A 66 4.521 12.446 -16.806 1.00 0.00 H new ATOM 0 HB2 ASN A 66 4.063 12.787 -19.180 1.00 0.00 H new ATOM 0 HB3 ASN A 66 2.336 12.831 -18.891 1.00 0.00 H new ATOM 0 HD21 ASN A 66 4.681 16.155 -18.209 1.00 0.00 H new ATOM 0 HD22 ASN A 66 5.397 14.565 -18.494 1.00 0.00 H new ATOM 1031 N ALA A 67 1.348 12.253 -16.047 1.00 0.00 N ATOM 1032 CA ALA A 67 0.340 12.677 -15.090 1.00 0.00 C ATOM 1033 C ALA A 67 0.459 11.893 -13.789 1.00 0.00 C ATOM 1034 O ALA A 67 0.039 12.361 -12.732 1.00 0.00 O ATOM 1035 CB ALA A 67 -1.052 12.509 -15.682 1.00 0.00 C ATOM 0 H ALA A 67 1.049 11.505 -16.673 1.00 0.00 H new ATOM 0 HA ALA A 67 0.504 13.731 -14.867 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -1.798 12.830 -14.955 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -1.140 13.115 -16.584 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.217 11.461 -15.932 1.00 0.00 H new ATOM 1041 N ILE A 68 1.043 10.707 -13.871 1.00 0.00 N ATOM 1042 CA ILE A 68 1.156 9.831 -12.715 1.00 0.00 C ATOM 1043 C ILE A 68 2.561 9.875 -12.122 1.00 0.00 C ATOM 1044 O ILE A 68 3.481 9.232 -12.626 1.00 0.00 O ATOM 1045 CB ILE A 68 0.806 8.370 -13.077 1.00 0.00 C ATOM 1046 CG1 ILE A 68 -0.593 8.298 -13.694 1.00 0.00 C ATOM 1047 CG2 ILE A 68 0.894 7.479 -11.842 1.00 0.00 C ATOM 1048 CD1 ILE A 68 -0.975 6.916 -14.178 1.00 0.00 C ATOM 0 H ILE A 68 1.447 10.329 -14.728 1.00 0.00 H new ATOM 0 HA ILE A 68 0.443 10.194 -11.975 1.00 0.00 H new ATOM 0 HB ILE A 68 1.527 8.010 -13.811 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -1.323 8.629 -12.956 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -0.647 8.994 -14.531 1.00 0.00 H new ATOM 0 HG21 ILE A 68 0.644 6.454 -12.115 1.00 0.00 H new ATOM 0 HG22 ILE A 68 1.907 7.512 -11.441 1.00 0.00 H new ATOM 0 HG23 ILE A 68 0.193 7.834 -11.086 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -1.979 6.944 -14.602 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -0.268 6.589 -14.940 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -0.954 6.219 -13.341 1.00 0.00 H new ATOM 1060 N ASP A 69 2.722 10.652 -11.062 1.00 0.00 N ATOM 1061 CA ASP A 69 3.973 10.666 -10.317 1.00 0.00 C ATOM 1062 C ASP A 69 3.937 9.582 -9.259 1.00 0.00 C ATOM 1063 O ASP A 69 4.811 8.714 -9.199 1.00 0.00 O ATOM 1064 CB ASP A 69 4.198 12.023 -9.646 1.00 0.00 C ATOM 1065 CG ASP A 69 5.395 12.022 -8.710 1.00 0.00 C ATOM 1066 OD1 ASP A 69 5.230 11.650 -7.528 1.00 0.00 O ATOM 1067 OD2 ASP A 69 6.506 12.397 -9.149 1.00 0.00 O ATOM 0 H ASP A 69 2.005 11.280 -10.698 1.00 0.00 H new ATOM 0 HA ASP A 69 4.792 10.486 -11.013 1.00 0.00 H new ATOM 0 HB2 ASP A 69 4.342 12.784 -10.413 1.00 0.00 H new ATOM 0 HB3 ASP A 69 3.304 12.300 -9.087 1.00 0.00 H new ATOM 1072 N THR A 70 2.904 9.627 -8.436 1.00 0.00 N ATOM 1073 CA THR A 70 2.759 8.663 -7.364 1.00 0.00 C ATOM 1074 C THR A 70 1.657 7.659 -7.690 1.00 0.00 C ATOM 1075 O THR A 70 0.503 8.034 -7.891 1.00 0.00 O ATOM 1076 CB THR A 70 2.456 9.364 -6.024 1.00 0.00 C ATOM 1077 OG1 THR A 70 3.498 10.305 -5.722 1.00 0.00 O ATOM 1078 CG2 THR A 70 2.343 8.355 -4.888 1.00 0.00 C ATOM 0 H THR A 70 2.157 10.319 -8.490 1.00 0.00 H new ATOM 0 HA THR A 70 3.704 8.129 -7.266 1.00 0.00 H new ATOM 0 HB THR A 70 1.503 9.883 -6.122 1.00 0.00 H new ATOM 0 HG1 THR A 70 3.925 10.598 -6.554 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.129 8.879 -3.956 1.00 0.00 H new ATOM 0 HG22 THR A 70 1.537 7.653 -5.103 1.00 0.00 H new ATOM 0 HG23 THR A 70 3.282 7.810 -4.791 1.00 0.00 H new ATOM 1086 N LEU A 71 2.026 6.388 -7.759 1.00 0.00 N ATOM 1087 CA LEU A 71 1.072 5.330 -8.050 1.00 0.00 C ATOM 1088 C LEU A 71 0.883 4.438 -6.830 1.00 0.00 C ATOM 1089 O LEU A 71 1.767 3.656 -6.476 1.00 0.00 O ATOM 1090 CB LEU A 71 1.544 4.496 -9.246 1.00 0.00 C ATOM 1091 CG LEU A 71 0.615 3.349 -9.654 1.00 0.00 C ATOM 1092 CD1 LEU A 71 -0.741 3.881 -10.090 1.00 0.00 C ATOM 1093 CD2 LEU A 71 1.247 2.527 -10.766 1.00 0.00 C ATOM 0 H LEU A 71 2.983 6.065 -7.617 1.00 0.00 H new ATOM 0 HA LEU A 71 0.115 5.788 -8.301 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.672 5.159 -10.102 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.525 4.082 -9.014 1.00 0.00 H new ATOM 0 HG LEU A 71 0.465 2.705 -8.787 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.384 3.048 -10.375 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.199 4.428 -9.266 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.613 4.549 -10.942 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.575 1.715 -11.045 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.427 3.164 -11.632 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.193 2.112 -10.419 1.00 0.00 H new ATOM 1105 N ILE A 72 -0.262 4.574 -6.185 1.00 0.00 N ATOM 1106 CA ILE A 72 -0.582 3.770 -5.018 1.00 0.00 C ATOM 1107 C ILE A 72 -1.394 2.553 -5.438 1.00 0.00 C ATOM 1108 O ILE A 72 -2.423 2.683 -6.097 1.00 0.00 O ATOM 1109 CB ILE A 72 -1.382 4.580 -3.973 1.00 0.00 C ATOM 1110 CG1 ILE A 72 -0.631 5.862 -3.601 1.00 0.00 C ATOM 1111 CG2 ILE A 72 -1.642 3.736 -2.731 1.00 0.00 C ATOM 1112 CD1 ILE A 72 -1.394 6.759 -2.649 1.00 0.00 C ATOM 0 H ILE A 72 -0.990 5.237 -6.451 1.00 0.00 H new ATOM 0 HA ILE A 72 0.357 3.456 -4.563 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.342 4.856 -4.410 1.00 0.00 H new ATOM 0 HG12 ILE A 72 0.324 5.595 -3.148 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -0.408 6.419 -4.511 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.206 4.321 -2.005 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -2.214 2.850 -3.006 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -0.692 3.432 -2.292 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.800 7.647 -2.431 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.337 7.057 -3.107 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.594 6.220 -1.723 1.00 0.00 H new ATOM 1124 N VAL A 73 -0.922 1.374 -5.076 1.00 0.00 N ATOM 1125 CA VAL A 73 -1.610 0.142 -5.421 1.00 0.00 C ATOM 1126 C VAL A 73 -2.155 -0.532 -4.170 1.00 0.00 C ATOM 1127 O VAL A 73 -1.440 -0.695 -3.183 1.00 0.00 O ATOM 1128 CB VAL A 73 -0.682 -0.838 -6.173 1.00 0.00 C ATOM 1129 CG1 VAL A 73 -1.412 -2.132 -6.509 1.00 0.00 C ATOM 1130 CG2 VAL A 73 -0.141 -0.192 -7.438 1.00 0.00 C ATOM 0 H VAL A 73 -0.063 1.243 -4.542 1.00 0.00 H new ATOM 0 HA VAL A 73 -2.436 0.406 -6.081 1.00 0.00 H new ATOM 0 HB VAL A 73 0.155 -1.081 -5.518 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -0.736 -2.804 -7.038 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.751 -2.608 -5.589 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -2.272 -1.911 -7.141 1.00 0.00 H new ATOM 0 HG21 VAL A 73 0.511 -0.896 -7.956 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -0.970 0.082 -8.090 1.00 0.00 H new ATOM 0 HG23 VAL A 73 0.425 0.702 -7.177 1.00 0.00 H new ATOM 1140 N GLY A 74 -3.427 -0.901 -4.214 1.00 0.00 N ATOM 1141 CA GLY A 74 -4.042 -1.596 -3.105 1.00 0.00 C ATOM 1142 C GLY A 74 -4.375 -3.026 -3.464 1.00 0.00 C ATOM 1143 O GLY A 74 -5.377 -3.283 -4.128 1.00 0.00 O ATOM 0 H GLY A 74 -4.047 -0.729 -5.005 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -3.369 -1.582 -2.247 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -4.951 -1.074 -2.806 1.00 0.00 H new ATOM 1147 N THR A 75 -3.531 -3.951 -3.030 1.00 0.00 N ATOM 1148 CA THR A 75 -3.687 -5.361 -3.360 1.00 0.00 C ATOM 1149 C THR A 75 -4.873 -5.987 -2.628 1.00 0.00 C ATOM 1150 O THR A 75 -5.623 -6.780 -3.197 1.00 0.00 O ATOM 1151 CB THR A 75 -2.408 -6.134 -3.012 1.00 0.00 C ATOM 1152 OG1 THR A 75 -1.995 -5.795 -1.682 1.00 0.00 O ATOM 1153 CG2 THR A 75 -1.292 -5.815 -3.995 1.00 0.00 C ATOM 0 H THR A 75 -2.723 -3.747 -2.442 1.00 0.00 H new ATOM 0 HA THR A 75 -3.876 -5.424 -4.432 1.00 0.00 H new ATOM 0 HB THR A 75 -2.620 -7.201 -3.074 1.00 0.00 H new ATOM 0 HG1 THR A 75 -1.975 -6.604 -1.129 1.00 0.00 H new ATOM 0 HG21 THR A 75 -0.398 -6.376 -3.725 1.00 0.00 H new ATOM 0 HG22 THR A 75 -1.604 -6.092 -5.002 1.00 0.00 H new ATOM 0 HG23 THR A 75 -1.074 -4.748 -3.964 1.00 0.00 H new ATOM 1161 N GLY A 76 -5.017 -5.653 -1.355 1.00 0.00 N ATOM 1162 CA GLY A 76 -6.163 -6.111 -0.595 1.00 0.00 C ATOM 1163 C GLY A 76 -5.877 -7.357 0.213 1.00 0.00 C ATOM 1164 O GLY A 76 -6.011 -7.346 1.437 1.00 0.00 O ATOM 0 H GLY A 76 -4.361 -5.072 -0.833 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -6.488 -5.316 0.076 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -6.989 -6.309 -1.278 1.00 0.00 H new ATOM 1168 N ALA A 77 -5.493 -8.428 -0.473 1.00 0.00 N ATOM 1169 CA ALA A 77 -5.208 -9.702 0.182 1.00 0.00 C ATOM 1170 C ALA A 77 -4.059 -9.557 1.174 1.00 0.00 C ATOM 1171 O ALA A 77 -4.252 -9.664 2.386 1.00 0.00 O ATOM 1172 CB ALA A 77 -4.887 -10.767 -0.857 1.00 0.00 C ATOM 0 H ALA A 77 -5.371 -8.440 -1.486 1.00 0.00 H new ATOM 0 HA ALA A 77 -6.095 -10.010 0.736 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -4.676 -11.712 -0.356 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -5.739 -10.892 -1.525 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -4.015 -10.460 -1.435 1.00 0.00 H new ATOM 1178 N ASP A 78 -2.872 -9.312 0.648 1.00 0.00 N ATOM 1179 CA ASP A 78 -1.693 -9.063 1.463 1.00 0.00 C ATOM 1180 C ASP A 78 -0.756 -8.150 0.693 1.00 0.00 C ATOM 1181 O ASP A 78 -1.005 -7.864 -0.479 1.00 0.00 O ATOM 1182 CB ASP A 78 -0.980 -10.370 1.835 1.00 0.00 C ATOM 1183 CG ASP A 78 -0.347 -11.072 0.647 1.00 0.00 C ATOM 1184 OD1 ASP A 78 0.814 -10.753 0.310 1.00 0.00 O ATOM 1185 OD2 ASP A 78 -0.993 -11.970 0.067 1.00 0.00 O ATOM 0 H ASP A 78 -2.697 -9.280 -0.356 1.00 0.00 H new ATOM 0 HA ASP A 78 -1.999 -8.587 2.395 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -0.208 -10.156 2.574 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -1.695 -11.044 2.307 1.00 0.00 H new ATOM 1190 N VAL A 79 0.306 -7.686 1.333 1.00 0.00 N ATOM 1191 CA VAL A 79 1.244 -6.790 0.675 1.00 0.00 C ATOM 1192 C VAL A 79 2.097 -7.559 -0.328 1.00 0.00 C ATOM 1193 O VAL A 79 3.118 -8.152 0.026 1.00 0.00 O ATOM 1194 CB VAL A 79 2.160 -6.063 1.686 1.00 0.00 C ATOM 1195 CG1 VAL A 79 3.064 -5.066 0.974 1.00 0.00 C ATOM 1196 CG2 VAL A 79 1.333 -5.368 2.757 1.00 0.00 C ATOM 0 H VAL A 79 0.539 -7.913 2.300 1.00 0.00 H new ATOM 0 HA VAL A 79 0.655 -6.035 0.154 1.00 0.00 H new ATOM 0 HB VAL A 79 2.790 -6.808 2.171 1.00 0.00 H new ATOM 0 HG11 VAL A 79 3.700 -4.566 1.704 1.00 0.00 H new ATOM 0 HG12 VAL A 79 3.687 -5.592 0.250 1.00 0.00 H new ATOM 0 HG13 VAL A 79 2.453 -4.326 0.457 1.00 0.00 H new ATOM 0 HG21 VAL A 79 1.997 -4.863 3.458 1.00 0.00 H new ATOM 0 HG22 VAL A 79 0.674 -4.636 2.290 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.735 -6.106 3.291 1.00 0.00 H new ATOM 1206 N TRP A 80 1.647 -7.571 -1.574 1.00 0.00 N ATOM 1207 CA TRP A 80 2.358 -8.247 -2.645 1.00 0.00 C ATOM 1208 C TRP A 80 3.369 -7.299 -3.268 1.00 0.00 C ATOM 1209 O TRP A 80 3.000 -6.306 -3.893 1.00 0.00 O ATOM 1210 CB TRP A 80 1.368 -8.750 -3.702 1.00 0.00 C ATOM 1211 CG TRP A 80 2.010 -9.526 -4.812 1.00 0.00 C ATOM 1212 CD1 TRP A 80 2.395 -10.834 -4.780 1.00 0.00 C ATOM 1213 CD2 TRP A 80 2.337 -9.044 -6.121 1.00 0.00 C ATOM 1214 NE1 TRP A 80 2.943 -11.195 -5.986 1.00 0.00 N ATOM 1215 CE2 TRP A 80 2.920 -10.113 -6.827 1.00 0.00 C ATOM 1216 CE3 TRP A 80 2.195 -7.811 -6.764 1.00 0.00 C ATOM 1217 CZ2 TRP A 80 3.359 -9.986 -8.141 1.00 0.00 C ATOM 1218 CZ3 TRP A 80 2.631 -7.687 -8.069 1.00 0.00 C ATOM 1219 CH2 TRP A 80 3.207 -8.769 -8.746 1.00 0.00 C ATOM 0 H TRP A 80 0.784 -7.115 -1.868 1.00 0.00 H new ATOM 0 HA TRP A 80 2.889 -9.107 -2.236 1.00 0.00 H new ATOM 0 HB2 TRP A 80 0.621 -9.378 -3.217 1.00 0.00 H new ATOM 0 HB3 TRP A 80 0.839 -7.896 -4.126 1.00 0.00 H new ATOM 0 HD1 TRP A 80 2.285 -11.490 -3.930 1.00 0.00 H new ATOM 0 HE1 TRP A 80 3.308 -12.119 -6.218 1.00 0.00 H new ATOM 0 HE3 TRP A 80 1.752 -6.971 -6.250 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 3.804 -10.819 -8.665 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 2.526 -6.739 -8.576 1.00 0.00 H new ATOM 0 HH2 TRP A 80 3.538 -8.640 -9.766 1.00 0.00 H new ATOM 1230 N ILE A 81 4.642 -7.596 -3.080 1.00 0.00 N ATOM 1231 CA ILE A 81 5.698 -6.739 -3.588 1.00 0.00 C ATOM 1232 C ILE A 81 6.146 -7.207 -4.968 1.00 0.00 C ATOM 1233 O ILE A 81 6.661 -8.317 -5.124 1.00 0.00 O ATOM 1234 CB ILE A 81 6.910 -6.700 -2.634 1.00 0.00 C ATOM 1235 CG1 ILE A 81 6.452 -6.362 -1.210 1.00 0.00 C ATOM 1236 CG2 ILE A 81 7.931 -5.679 -3.121 1.00 0.00 C ATOM 1237 CD1 ILE A 81 7.570 -6.371 -0.189 1.00 0.00 C ATOM 0 H ILE A 81 4.969 -8.423 -2.580 1.00 0.00 H new ATOM 0 HA ILE A 81 5.291 -5.731 -3.661 1.00 0.00 H new ATOM 0 HB ILE A 81 7.381 -7.683 -2.623 1.00 0.00 H new ATOM 0 HG12 ILE A 81 5.984 -5.378 -1.213 1.00 0.00 H new ATOM 0 HG13 ILE A 81 5.688 -7.077 -0.905 1.00 0.00 H new ATOM 0 HG21 ILE A 81 8.781 -5.661 -2.439 1.00 0.00 H new ATOM 0 HG22 ILE A 81 8.272 -5.953 -4.119 1.00 0.00 H new ATOM 0 HG23 ILE A 81 7.471 -4.691 -3.153 1.00 0.00 H new ATOM 0 HD11 ILE A 81 7.168 -6.123 0.793 1.00 0.00 H new ATOM 0 HD12 ILE A 81 8.024 -7.361 -0.155 1.00 0.00 H new ATOM 0 HD13 ILE A 81 8.324 -5.635 -0.469 1.00 0.00 H new ATOM 1249 N ALA A 82 5.932 -6.354 -5.961 1.00 0.00 N ATOM 1250 CA ALA A 82 6.297 -6.655 -7.339 1.00 0.00 C ATOM 1251 C ALA A 82 7.811 -6.804 -7.491 1.00 0.00 C ATOM 1252 O ALA A 82 8.578 -6.176 -6.758 1.00 0.00 O ATOM 1253 CB ALA A 82 5.772 -5.563 -8.264 1.00 0.00 C ATOM 0 H ALA A 82 5.502 -5.438 -5.835 1.00 0.00 H new ATOM 0 HA ALA A 82 5.842 -7.606 -7.615 1.00 0.00 H new ATOM 0 HB1 ALA A 82 6.048 -5.794 -9.293 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.686 -5.509 -8.183 1.00 0.00 H new ATOM 0 HB3 ALA A 82 6.206 -4.605 -7.978 1.00 0.00 H new ATOM 1259 N PRO A 83 8.256 -7.660 -8.431 1.00 0.00 N ATOM 1260 CA PRO A 83 9.683 -7.866 -8.715 1.00 0.00 C ATOM 1261 C PRO A 83 10.410 -6.563 -9.042 1.00 0.00 C ATOM 1262 O PRO A 83 9.806 -5.614 -9.561 1.00 0.00 O ATOM 1263 CB PRO A 83 9.676 -8.791 -9.934 1.00 0.00 C ATOM 1264 CG PRO A 83 8.369 -9.497 -9.865 1.00 0.00 C ATOM 1265 CD PRO A 83 7.399 -8.512 -9.276 1.00 0.00 C ATOM 0 HA PRO A 83 10.210 -8.276 -7.853 1.00 0.00 H new ATOM 0 HB2 PRO A 83 9.772 -8.225 -10.861 1.00 0.00 H new ATOM 0 HB3 PRO A 83 10.508 -9.494 -9.902 1.00 0.00 H new ATOM 0 HG2 PRO A 83 8.046 -9.819 -10.855 1.00 0.00 H new ATOM 0 HG3 PRO A 83 8.441 -10.392 -9.247 1.00 0.00 H new ATOM 0 HD2 PRO A 83 6.893 -7.934 -10.049 1.00 0.00 H new ATOM 0 HD3 PRO A 83 6.625 -9.009 -8.692 1.00 0.00 H new ATOM 1273 N ARG A 84 11.709 -6.528 -8.759 1.00 0.00 N ATOM 1274 CA ARG A 84 12.496 -5.312 -8.924 1.00 0.00 C ATOM 1275 C ARG A 84 12.509 -4.850 -10.376 1.00 0.00 C ATOM 1276 O ARG A 84 12.385 -3.663 -10.640 1.00 0.00 O ATOM 1277 CB ARG A 84 13.935 -5.515 -8.440 1.00 0.00 C ATOM 1278 CG ARG A 84 14.793 -4.264 -8.570 1.00 0.00 C ATOM 1279 CD ARG A 84 16.240 -4.529 -8.194 1.00 0.00 C ATOM 1280 NE ARG A 84 17.062 -3.324 -8.302 1.00 0.00 N ATOM 1281 CZ ARG A 84 18.258 -3.181 -7.736 1.00 0.00 C ATOM 1282 NH1 ARG A 84 18.810 -4.195 -7.078 1.00 0.00 N ATOM 1283 NH2 ARG A 84 18.910 -2.030 -7.855 1.00 0.00 N ATOM 0 H ARG A 84 12.238 -7.329 -8.414 1.00 0.00 H new ATOM 0 HA ARG A 84 12.022 -4.542 -8.316 1.00 0.00 H new ATOM 0 HB2 ARG A 84 13.920 -5.831 -7.397 1.00 0.00 H new ATOM 0 HB3 ARG A 84 14.393 -6.323 -9.011 1.00 0.00 H new ATOM 0 HG2 ARG A 84 14.746 -3.896 -9.595 1.00 0.00 H new ATOM 0 HG3 ARG A 84 14.390 -3.479 -7.931 1.00 0.00 H new ATOM 0 HD2 ARG A 84 16.286 -4.909 -7.174 1.00 0.00 H new ATOM 0 HD3 ARG A 84 16.647 -5.305 -8.842 1.00 0.00 H new ATOM 0 HE ARG A 84 16.695 -2.543 -8.846 1.00 0.00 H new ATOM 0 HH11 ARG A 84 18.317 -5.085 -7.006 1.00 0.00 H new ATOM 0 HH12 ARG A 84 19.727 -4.083 -6.645 1.00 0.00 H new ATOM 0 HH21 ARG A 84 18.494 -1.260 -8.379 1.00 0.00 H new ATOM 0 HH22 ARG A 84 19.827 -1.916 -7.423 1.00 0.00 H new ATOM 1297 N GLN A 85 12.646 -5.790 -11.307 1.00 0.00 N ATOM 1298 CA GLN A 85 12.698 -5.461 -12.730 1.00 0.00 C ATOM 1299 C GLN A 85 11.512 -4.586 -13.128 1.00 0.00 C ATOM 1300 O GLN A 85 11.672 -3.568 -13.802 1.00 0.00 O ATOM 1301 CB GLN A 85 12.709 -6.729 -13.596 1.00 0.00 C ATOM 1302 CG GLN A 85 13.915 -7.637 -13.377 1.00 0.00 C ATOM 1303 CD GLN A 85 13.705 -8.663 -12.276 1.00 0.00 C ATOM 1304 OE1 GLN A 85 12.974 -8.430 -11.312 1.00 0.00 O ATOM 1305 NE2 GLN A 85 14.340 -9.813 -12.419 1.00 0.00 N ATOM 0 H GLN A 85 12.723 -6.786 -11.102 1.00 0.00 H new ATOM 0 HA GLN A 85 13.624 -4.912 -12.901 1.00 0.00 H new ATOM 0 HB2 GLN A 85 11.801 -7.298 -13.395 1.00 0.00 H new ATOM 0 HB3 GLN A 85 12.677 -6.437 -14.646 1.00 0.00 H new ATOM 0 HG2 GLN A 85 14.144 -8.156 -14.308 1.00 0.00 H new ATOM 0 HG3 GLN A 85 14.782 -7.024 -13.132 1.00 0.00 H new ATOM 0 HE21 GLN A 85 14.937 -9.968 -13.231 1.00 0.00 H new ATOM 0 HE22 GLN A 85 14.233 -10.545 -11.717 1.00 0.00 H new ATOM 1314 N LEU A 86 10.331 -4.977 -12.673 1.00 0.00 N ATOM 1315 CA LEU A 86 9.106 -4.260 -12.995 1.00 0.00 C ATOM 1316 C LEU A 86 9.030 -2.937 -12.234 1.00 0.00 C ATOM 1317 O LEU A 86 8.743 -1.888 -12.817 1.00 0.00 O ATOM 1318 CB LEU A 86 7.893 -5.133 -12.662 1.00 0.00 C ATOM 1319 CG LEU A 86 6.533 -4.542 -13.037 1.00 0.00 C ATOM 1320 CD1 LEU A 86 6.435 -4.334 -14.539 1.00 0.00 C ATOM 1321 CD2 LEU A 86 5.413 -5.448 -12.551 1.00 0.00 C ATOM 0 H LEU A 86 10.195 -5.792 -12.076 1.00 0.00 H new ATOM 0 HA LEU A 86 9.106 -4.036 -14.062 1.00 0.00 H new ATOM 0 HB2 LEU A 86 8.006 -6.091 -13.170 1.00 0.00 H new ATOM 0 HB3 LEU A 86 7.898 -5.338 -11.591 1.00 0.00 H new ATOM 0 HG LEU A 86 6.432 -3.572 -12.551 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.460 -3.913 -14.785 1.00 0.00 H new ATOM 0 HD12 LEU A 86 7.218 -3.649 -14.863 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.556 -5.291 -15.047 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.451 -5.016 -12.824 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.514 -6.430 -13.012 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.471 -5.549 -11.467 1.00 0.00 H new ATOM 1333 N ARG A 87 9.309 -2.985 -10.935 1.00 0.00 N ATOM 1334 CA ARG A 87 9.192 -1.802 -10.088 1.00 0.00 C ATOM 1335 C ARG A 87 10.232 -0.749 -10.467 1.00 0.00 C ATOM 1336 O ARG A 87 9.946 0.453 -10.482 1.00 0.00 O ATOM 1337 CB ARG A 87 9.355 -2.178 -8.614 1.00 0.00 C ATOM 1338 CG ARG A 87 8.849 -1.099 -7.672 1.00 0.00 C ATOM 1339 CD ARG A 87 8.949 -1.518 -6.215 1.00 0.00 C ATOM 1340 NE ARG A 87 8.268 -0.566 -5.339 1.00 0.00 N ATOM 1341 CZ ARG A 87 8.354 -0.568 -4.011 1.00 0.00 C ATOM 1342 NH1 ARG A 87 9.143 -1.432 -3.385 1.00 0.00 N ATOM 1343 NH2 ARG A 87 7.657 0.313 -3.310 1.00 0.00 N ATOM 0 H ARG A 87 9.616 -3.826 -10.447 1.00 0.00 H new ATOM 0 HA ARG A 87 8.198 -1.382 -10.243 1.00 0.00 H new ATOM 0 HB2 ARG A 87 8.817 -3.106 -8.419 1.00 0.00 H new ATOM 0 HB3 ARG A 87 10.408 -2.370 -8.407 1.00 0.00 H new ATOM 0 HG2 ARG A 87 9.423 -0.186 -7.826 1.00 0.00 H new ATOM 0 HG3 ARG A 87 7.811 -0.867 -7.911 1.00 0.00 H new ATOM 0 HD2 ARG A 87 8.512 -2.508 -6.089 1.00 0.00 H new ATOM 0 HD3 ARG A 87 9.998 -1.594 -5.928 1.00 0.00 H new ATOM 0 HE ARG A 87 7.687 0.149 -5.776 1.00 0.00 H new ATOM 0 HH11 ARG A 87 9.691 -2.104 -3.922 1.00 0.00 H new ATOM 0 HH12 ARG A 87 9.201 -1.424 -2.367 1.00 0.00 H new ATOM 0 HH21 ARG A 87 7.059 0.987 -3.788 1.00 0.00 H new ATOM 0 HH22 ARG A 87 7.718 0.317 -2.292 1.00 0.00 H new ATOM 1357 N GLU A 88 11.433 -1.212 -10.777 1.00 0.00 N ATOM 1358 CA GLU A 88 12.539 -0.334 -11.126 1.00 0.00 C ATOM 1359 C GLU A 88 12.321 0.278 -12.502 1.00 0.00 C ATOM 1360 O GLU A 88 12.747 1.399 -12.760 1.00 0.00 O ATOM 1361 CB GLU A 88 13.853 -1.115 -11.083 1.00 0.00 C ATOM 1362 CG GLU A 88 15.093 -0.269 -11.296 1.00 0.00 C ATOM 1363 CD GLU A 88 16.360 -1.076 -11.136 1.00 0.00 C ATOM 1364 OE1 GLU A 88 16.846 -1.200 -9.995 1.00 0.00 O ATOM 1365 OE2 GLU A 88 16.869 -1.604 -12.149 1.00 0.00 O ATOM 0 H GLU A 88 11.668 -2.204 -10.794 1.00 0.00 H new ATOM 0 HA GLU A 88 12.590 0.478 -10.401 1.00 0.00 H new ATOM 0 HB2 GLU A 88 13.932 -1.617 -10.118 1.00 0.00 H new ATOM 0 HB3 GLU A 88 13.824 -1.893 -11.846 1.00 0.00 H new ATOM 0 HG2 GLU A 88 15.066 0.170 -12.293 1.00 0.00 H new ATOM 0 HG3 GLU A 88 15.096 0.556 -10.584 1.00 0.00 H new ATOM 1372 N ALA A 89 11.647 -0.457 -13.381 1.00 0.00 N ATOM 1373 CA ALA A 89 11.310 0.062 -14.701 1.00 0.00 C ATOM 1374 C ALA A 89 10.386 1.266 -14.573 1.00 0.00 C ATOM 1375 O ALA A 89 10.551 2.269 -15.271 1.00 0.00 O ATOM 1376 CB ALA A 89 10.661 -1.020 -15.552 1.00 0.00 C ATOM 0 H ALA A 89 11.325 -1.409 -13.204 1.00 0.00 H new ATOM 0 HA ALA A 89 12.229 0.379 -15.194 1.00 0.00 H new ATOM 0 HB1 ALA A 89 10.417 -0.613 -16.533 1.00 0.00 H new ATOM 0 HB2 ALA A 89 11.352 -1.856 -15.667 1.00 0.00 H new ATOM 0 HB3 ALA A 89 9.749 -1.367 -15.066 1.00 0.00 H new ATOM 1382 N LEU A 90 9.424 1.162 -13.661 1.00 0.00 N ATOM 1383 CA LEU A 90 8.490 2.250 -13.391 1.00 0.00 C ATOM 1384 C LEU A 90 9.221 3.473 -12.844 1.00 0.00 C ATOM 1385 O LEU A 90 9.025 4.595 -13.321 1.00 0.00 O ATOM 1386 CB LEU A 90 7.424 1.797 -12.389 1.00 0.00 C ATOM 1387 CG LEU A 90 6.515 0.664 -12.868 1.00 0.00 C ATOM 1388 CD1 LEU A 90 5.612 0.198 -11.739 1.00 0.00 C ATOM 1389 CD2 LEU A 90 5.683 1.114 -14.057 1.00 0.00 C ATOM 0 H LEU A 90 9.270 0.329 -13.093 1.00 0.00 H new ATOM 0 HA LEU A 90 8.010 2.523 -14.331 1.00 0.00 H new ATOM 0 HB2 LEU A 90 7.922 1.478 -11.473 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.803 2.655 -12.132 1.00 0.00 H new ATOM 0 HG LEU A 90 7.142 -0.171 -13.181 1.00 0.00 H new ATOM 0 HD11 LEU A 90 4.971 -0.608 -12.095 1.00 0.00 H new ATOM 0 HD12 LEU A 90 6.222 -0.162 -10.910 1.00 0.00 H new ATOM 0 HD13 LEU A 90 4.994 1.030 -11.400 1.00 0.00 H new ATOM 0 HD21 LEU A 90 5.043 0.295 -14.384 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.065 1.964 -13.768 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.343 1.406 -14.873 1.00 0.00 H new ATOM 1401 N ARG A 91 10.080 3.249 -11.854 1.00 0.00 N ATOM 1402 CA ARG A 91 10.796 4.342 -11.206 1.00 0.00 C ATOM 1403 C ARG A 91 11.910 4.868 -12.109 1.00 0.00 C ATOM 1404 O ARG A 91 12.375 5.996 -11.949 1.00 0.00 O ATOM 1405 CB ARG A 91 11.363 3.893 -9.854 1.00 0.00 C ATOM 1406 CG ARG A 91 11.941 5.036 -9.034 1.00 0.00 C ATOM 1407 CD ARG A 91 12.307 4.603 -7.622 1.00 0.00 C ATOM 1408 NE ARG A 91 13.377 3.605 -7.595 1.00 0.00 N ATOM 1409 CZ ARG A 91 14.663 3.900 -7.399 1.00 0.00 C ATOM 1410 NH1 ARG A 91 15.053 5.165 -7.315 1.00 0.00 N ATOM 1411 NH2 ARG A 91 15.567 2.936 -7.298 1.00 0.00 N ATOM 0 H ARG A 91 10.296 2.323 -11.484 1.00 0.00 H new ATOM 0 HA ARG A 91 10.090 5.153 -11.027 1.00 0.00 H new ATOM 0 HB2 ARG A 91 10.574 3.407 -9.281 1.00 0.00 H new ATOM 0 HB3 ARG A 91 12.140 3.147 -10.023 1.00 0.00 H new ATOM 0 HG2 ARG A 91 12.827 5.427 -9.533 1.00 0.00 H new ATOM 0 HG3 ARG A 91 11.217 5.849 -8.987 1.00 0.00 H new ATOM 0 HD2 ARG A 91 12.616 5.476 -7.048 1.00 0.00 H new ATOM 0 HD3 ARG A 91 11.423 4.195 -7.131 1.00 0.00 H new ATOM 0 HE ARG A 91 13.125 2.627 -7.734 1.00 0.00 H new ATOM 0 HH11 ARG A 91 14.369 5.916 -7.400 1.00 0.00 H new ATOM 0 HH12 ARG A 91 16.037 5.386 -7.165 1.00 0.00 H new ATOM 0 HH21 ARG A 91 15.281 1.959 -7.370 1.00 0.00 H new ATOM 0 HH22 ARG A 91 16.548 3.171 -7.148 1.00 0.00 H new ATOM 1425 N GLY A 92 12.329 4.042 -13.059 1.00 0.00 N ATOM 1426 CA GLY A 92 13.308 4.464 -14.041 1.00 0.00 C ATOM 1427 C GLY A 92 12.745 5.507 -14.981 1.00 0.00 C ATOM 1428 O GLY A 92 13.488 6.268 -15.599 1.00 0.00 O ATOM 0 H GLY A 92 12.005 3.081 -13.167 1.00 0.00 H new ATOM 0 HA2 GLY A 92 14.183 4.868 -13.532 1.00 0.00 H new ATOM 0 HA3 GLY A 92 13.643 3.600 -14.615 1.00 0.00 H new ATOM 1432 N VAL A 93 11.423 5.529 -15.103 1.00 0.00 N ATOM 1433 CA VAL A 93 10.749 6.563 -15.865 1.00 0.00 C ATOM 1434 C VAL A 93 10.502 7.768 -14.965 1.00 0.00 C ATOM 1435 O VAL A 93 11.266 8.734 -14.990 1.00 0.00 O ATOM 1436 CB VAL A 93 9.408 6.067 -16.455 1.00 0.00 C ATOM 1437 CG1 VAL A 93 8.761 7.142 -17.318 1.00 0.00 C ATOM 1438 CG2 VAL A 93 9.614 4.793 -17.260 1.00 0.00 C ATOM 0 H VAL A 93 10.800 4.840 -14.682 1.00 0.00 H new ATOM 0 HA VAL A 93 11.391 6.840 -16.701 1.00 0.00 H new ATOM 0 HB VAL A 93 8.737 5.847 -15.625 1.00 0.00 H new ATOM 0 HG11 VAL A 93 7.820 6.768 -17.721 1.00 0.00 H new ATOM 0 HG12 VAL A 93 8.570 8.028 -16.713 1.00 0.00 H new ATOM 0 HG13 VAL A 93 9.430 7.401 -18.139 1.00 0.00 H new ATOM 0 HG21 VAL A 93 8.659 4.461 -17.666 1.00 0.00 H new ATOM 0 HG22 VAL A 93 10.308 4.987 -18.078 1.00 0.00 H new ATOM 0 HG23 VAL A 93 10.023 4.016 -16.614 1.00 0.00 H new ATOM 1448 N ASN A 94 9.457 7.683 -14.149 1.00 0.00 N ATOM 1449 CA ASN A 94 9.137 8.735 -13.184 1.00 0.00 C ATOM 1450 C ASN A 94 7.953 8.313 -12.309 1.00 0.00 C ATOM 1451 O ASN A 94 7.284 9.147 -11.704 1.00 0.00 O ATOM 1452 CB ASN A 94 8.800 10.046 -13.912 1.00 0.00 C ATOM 1453 CG ASN A 94 8.821 11.262 -12.999 1.00 0.00 C ATOM 1454 OD1 ASN A 94 8.026 12.189 -13.163 1.00 0.00 O ATOM 1455 ND2 ASN A 94 9.743 11.284 -12.047 1.00 0.00 N ATOM 0 H ASN A 94 8.812 6.893 -14.135 1.00 0.00 H new ATOM 0 HA ASN A 94 10.009 8.895 -12.550 1.00 0.00 H new ATOM 0 HB2 ASN A 94 9.512 10.197 -14.723 1.00 0.00 H new ATOM 0 HB3 ASN A 94 7.813 9.958 -14.366 1.00 0.00 H new ATOM 0 HD21 ASN A 94 9.811 12.086 -11.421 1.00 0.00 H new ATOM 0 HD22 ASN A 94 10.385 10.498 -11.940 1.00 0.00 H new ATOM 1462 N VAL A 95 7.710 7.010 -12.222 1.00 0.00 N ATOM 1463 CA VAL A 95 6.538 6.510 -11.518 1.00 0.00 C ATOM 1464 C VAL A 95 6.938 5.801 -10.230 1.00 0.00 C ATOM 1465 O VAL A 95 7.632 4.781 -10.258 1.00 0.00 O ATOM 1466 CB VAL A 95 5.720 5.541 -12.400 1.00 0.00 C ATOM 1467 CG1 VAL A 95 4.460 5.086 -11.680 1.00 0.00 C ATOM 1468 CG2 VAL A 95 5.372 6.190 -13.733 1.00 0.00 C ATOM 0 H VAL A 95 8.304 6.287 -12.627 1.00 0.00 H new ATOM 0 HA VAL A 95 5.918 7.373 -11.277 1.00 0.00 H new ATOM 0 HB VAL A 95 6.334 4.662 -12.597 1.00 0.00 H new ATOM 0 HG11 VAL A 95 3.901 4.405 -12.321 1.00 0.00 H new ATOM 0 HG12 VAL A 95 4.733 4.574 -10.757 1.00 0.00 H new ATOM 0 HG13 VAL A 95 3.842 5.953 -11.445 1.00 0.00 H new ATOM 0 HG21 VAL A 95 4.796 5.491 -14.339 1.00 0.00 H new ATOM 0 HG22 VAL A 95 4.782 7.089 -13.557 1.00 0.00 H new ATOM 0 HG23 VAL A 95 6.289 6.455 -14.259 1.00 0.00 H new ATOM 1478 N VAL A 96 6.510 6.351 -9.104 1.00 0.00 N ATOM 1479 CA VAL A 96 6.776 5.744 -7.810 1.00 0.00 C ATOM 1480 C VAL A 96 5.692 4.727 -7.473 1.00 0.00 C ATOM 1481 O VAL A 96 4.539 5.091 -7.235 1.00 0.00 O ATOM 1482 CB VAL A 96 6.855 6.802 -6.688 1.00 0.00 C ATOM 1483 CG1 VAL A 96 7.127 6.145 -5.342 1.00 0.00 C ATOM 1484 CG2 VAL A 96 7.925 7.837 -7.003 1.00 0.00 C ATOM 0 H VAL A 96 5.976 7.219 -9.061 1.00 0.00 H new ATOM 0 HA VAL A 96 7.743 5.245 -7.876 1.00 0.00 H new ATOM 0 HB VAL A 96 5.891 7.308 -6.631 1.00 0.00 H new ATOM 0 HG11 VAL A 96 7.178 6.910 -4.567 1.00 0.00 H new ATOM 0 HG12 VAL A 96 6.323 5.446 -5.109 1.00 0.00 H new ATOM 0 HG13 VAL A 96 8.074 5.607 -5.384 1.00 0.00 H new ATOM 0 HG21 VAL A 96 7.966 8.574 -6.201 1.00 0.00 H new ATOM 0 HG22 VAL A 96 8.893 7.344 -7.092 1.00 0.00 H new ATOM 0 HG23 VAL A 96 7.684 8.335 -7.942 1.00 0.00 H new ATOM 1494 N LEU A 97 6.061 3.453 -7.482 1.00 0.00 N ATOM 1495 CA LEU A 97 5.125 2.381 -7.185 1.00 0.00 C ATOM 1496 C LEU A 97 5.039 2.145 -5.681 1.00 0.00 C ATOM 1497 O LEU A 97 5.969 1.608 -5.072 1.00 0.00 O ATOM 1498 CB LEU A 97 5.549 1.091 -7.892 1.00 0.00 C ATOM 1499 CG LEU A 97 4.591 -0.090 -7.721 1.00 0.00 C ATOM 1500 CD1 LEU A 97 3.259 0.202 -8.393 1.00 0.00 C ATOM 1501 CD2 LEU A 97 5.206 -1.364 -8.282 1.00 0.00 C ATOM 0 H LEU A 97 7.008 3.137 -7.693 1.00 0.00 H new ATOM 0 HA LEU A 97 4.141 2.677 -7.549 1.00 0.00 H new ATOM 0 HB2 LEU A 97 5.659 1.298 -8.956 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.531 0.798 -7.521 1.00 0.00 H new ATOM 0 HG LEU A 97 4.413 -0.236 -6.656 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.591 -0.649 -8.261 1.00 0.00 H new ATOM 0 HD12 LEU A 97 2.811 1.088 -7.943 1.00 0.00 H new ATOM 0 HD13 LEU A 97 3.419 0.376 -9.457 1.00 0.00 H new ATOM 0 HD21 LEU A 97 4.510 -2.192 -8.151 1.00 0.00 H new ATOM 0 HD22 LEU A 97 5.415 -1.230 -9.343 1.00 0.00 H new ATOM 0 HD23 LEU A 97 6.134 -1.583 -7.754 1.00 0.00 H new ATOM 1513 N ASP A 98 3.930 2.554 -5.092 1.00 0.00 N ATOM 1514 CA ASP A 98 3.699 2.359 -3.668 1.00 0.00 C ATOM 1515 C ASP A 98 2.627 1.295 -3.469 1.00 0.00 C ATOM 1516 O ASP A 98 1.437 1.552 -3.646 1.00 0.00 O ATOM 1517 CB ASP A 98 3.281 3.682 -3.018 1.00 0.00 C ATOM 1518 CG ASP A 98 3.247 3.613 -1.504 1.00 0.00 C ATOM 1519 OD1 ASP A 98 4.309 3.368 -0.892 1.00 0.00 O ATOM 1520 OD2 ASP A 98 2.173 3.847 -0.917 1.00 0.00 O ATOM 0 H ASP A 98 3.169 3.027 -5.580 1.00 0.00 H new ATOM 0 HA ASP A 98 4.620 2.022 -3.191 1.00 0.00 H new ATOM 0 HB2 ASP A 98 3.973 4.466 -3.325 1.00 0.00 H new ATOM 0 HB3 ASP A 98 2.295 3.966 -3.386 1.00 0.00 H new ATOM 1525 N THR A 99 3.058 0.088 -3.138 1.00 0.00 N ATOM 1526 CA THR A 99 2.152 -1.048 -3.060 1.00 0.00 C ATOM 1527 C THR A 99 1.799 -1.387 -1.612 1.00 0.00 C ATOM 1528 O THR A 99 2.673 -1.706 -0.805 1.00 0.00 O ATOM 1529 CB THR A 99 2.781 -2.280 -3.739 1.00 0.00 C ATOM 1530 OG1 THR A 99 3.373 -1.890 -4.985 1.00 0.00 O ATOM 1531 CG2 THR A 99 1.737 -3.356 -3.991 1.00 0.00 C ATOM 0 H THR A 99 4.030 -0.131 -2.919 1.00 0.00 H new ATOM 0 HA THR A 99 1.235 -0.772 -3.580 1.00 0.00 H new ATOM 0 HB THR A 99 3.543 -2.687 -3.075 1.00 0.00 H new ATOM 0 HG1 THR A 99 3.774 -2.673 -5.416 1.00 0.00 H new ATOM 0 HG21 THR A 99 2.207 -4.214 -4.471 1.00 0.00 H new ATOM 0 HG22 THR A 99 1.298 -3.666 -3.043 1.00 0.00 H new ATOM 0 HG23 THR A 99 0.956 -2.960 -4.640 1.00 0.00 H new ATOM 1539 N MET A 100 0.512 -1.307 -1.295 1.00 0.00 N ATOM 1540 CA MET A 100 0.013 -1.639 0.035 1.00 0.00 C ATOM 1541 C MET A 100 -1.290 -2.418 -0.084 1.00 0.00 C ATOM 1542 O MET A 100 -1.697 -2.800 -1.180 1.00 0.00 O ATOM 1543 CB MET A 100 -0.236 -0.369 0.859 1.00 0.00 C ATOM 1544 CG MET A 100 1.019 0.419 1.196 1.00 0.00 C ATOM 1545 SD MET A 100 0.658 1.900 2.160 1.00 0.00 S ATOM 1546 CE MET A 100 -0.387 2.801 1.017 1.00 0.00 C ATOM 0 H MET A 100 -0.213 -1.012 -1.949 1.00 0.00 H new ATOM 0 HA MET A 100 0.766 -2.245 0.539 1.00 0.00 H new ATOM 0 HB2 MET A 100 -0.919 0.278 0.309 1.00 0.00 H new ATOM 0 HB3 MET A 100 -0.737 -0.645 1.787 1.00 0.00 H new ATOM 0 HG2 MET A 100 1.706 -0.217 1.754 1.00 0.00 H new ATOM 0 HG3 MET A 100 1.526 0.703 0.274 1.00 0.00 H new ATOM 0 HE1 MET A 100 -0.151 3.864 1.068 1.00 0.00 H new ATOM 0 HE2 MET A 100 -0.214 2.439 0.003 1.00 0.00 H new ATOM 0 HE3 MET A 100 -1.433 2.649 1.283 1.00 0.00 H new ATOM 1556 N GLN A 101 -1.943 -2.654 1.044 1.00 0.00 N ATOM 1557 CA GLN A 101 -3.261 -3.268 1.038 1.00 0.00 C ATOM 1558 C GLN A 101 -4.307 -2.198 0.747 1.00 0.00 C ATOM 1559 O GLN A 101 -4.033 -1.011 0.917 1.00 0.00 O ATOM 1560 CB GLN A 101 -3.546 -3.948 2.377 1.00 0.00 C ATOM 1561 CG GLN A 101 -2.537 -5.030 2.729 1.00 0.00 C ATOM 1562 CD GLN A 101 -2.841 -5.710 4.049 1.00 0.00 C ATOM 1563 OE1 GLN A 101 -3.998 -5.833 4.450 1.00 0.00 O ATOM 1564 NE2 GLN A 101 -1.800 -6.159 4.734 1.00 0.00 N ATOM 0 H GLN A 101 -1.583 -2.430 1.972 1.00 0.00 H new ATOM 0 HA GLN A 101 -3.299 -4.033 0.262 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.551 -3.195 3.165 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -4.544 -4.386 2.349 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -2.521 -5.777 1.936 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -1.540 -4.591 2.773 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -0.856 -6.037 4.366 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -1.942 -6.627 5.629 1.00 0.00 H new ATOM 1573 N THR A 102 -5.493 -2.609 0.315 1.00 0.00 N ATOM 1574 CA THR A 102 -6.524 -1.661 -0.090 1.00 0.00 C ATOM 1575 C THR A 102 -6.874 -0.689 1.038 1.00 0.00 C ATOM 1576 O THR A 102 -7.069 0.496 0.792 1.00 0.00 O ATOM 1577 CB THR A 102 -7.801 -2.387 -0.546 1.00 0.00 C ATOM 1578 OG1 THR A 102 -7.453 -3.543 -1.320 1.00 0.00 O ATOM 1579 CG2 THR A 102 -8.674 -1.464 -1.379 1.00 0.00 C ATOM 0 H THR A 102 -5.764 -3.589 0.236 1.00 0.00 H new ATOM 0 HA THR A 102 -6.114 -1.095 -0.926 1.00 0.00 H new ATOM 0 HB THR A 102 -8.358 -2.693 0.339 1.00 0.00 H new ATOM 0 HG1 THR A 102 -8.044 -4.287 -1.080 1.00 0.00 H new ATOM 0 HG21 THR A 102 -9.572 -1.997 -1.692 1.00 0.00 H new ATOM 0 HG22 THR A 102 -8.956 -0.595 -0.784 1.00 0.00 H new ATOM 0 HG23 THR A 102 -8.121 -1.137 -2.260 1.00 0.00 H new ATOM 1587 N GLY A 103 -6.929 -1.197 2.268 1.00 0.00 N ATOM 1588 CA GLY A 103 -7.260 -0.361 3.418 1.00 0.00 C ATOM 1589 C GLY A 103 -6.381 0.877 3.527 1.00 0.00 C ATOM 1590 O GLY A 103 -6.862 1.998 3.331 1.00 0.00 O ATOM 0 H GLY A 103 -6.750 -2.176 2.492 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -8.303 -0.054 3.348 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -7.162 -0.951 4.329 1.00 0.00 H new ATOM 1594 N PRO A 104 -5.082 0.706 3.843 1.00 0.00 N ATOM 1595 CA PRO A 104 -4.128 1.820 3.923 1.00 0.00 C ATOM 1596 C PRO A 104 -4.032 2.608 2.616 1.00 0.00 C ATOM 1597 O PRO A 104 -3.808 3.820 2.632 1.00 0.00 O ATOM 1598 CB PRO A 104 -2.786 1.144 4.238 1.00 0.00 C ATOM 1599 CG PRO A 104 -2.990 -0.302 3.940 1.00 0.00 C ATOM 1600 CD PRO A 104 -4.445 -0.574 4.183 1.00 0.00 C ATOM 0 HA PRO A 104 -4.434 2.549 4.674 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -1.984 1.561 3.629 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -2.506 1.294 5.281 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -2.717 -0.530 2.910 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -2.365 -0.924 4.580 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -4.814 -1.387 3.557 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -4.635 -0.857 5.218 1.00 0.00 H new ATOM 1608 N ALA A 105 -4.204 1.923 1.490 1.00 0.00 N ATOM 1609 CA ALA A 105 -4.165 2.575 0.187 1.00 0.00 C ATOM 1610 C ALA A 105 -5.287 3.599 0.059 1.00 0.00 C ATOM 1611 O ALA A 105 -5.050 4.746 -0.324 1.00 0.00 O ATOM 1612 CB ALA A 105 -4.252 1.546 -0.930 1.00 0.00 C ATOM 0 H ALA A 105 -4.372 0.917 1.454 1.00 0.00 H new ATOM 0 HA ALA A 105 -3.214 3.100 0.099 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -4.221 2.053 -1.895 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -3.411 0.856 -0.856 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -5.186 0.991 -0.841 1.00 0.00 H new ATOM 1618 N ILE A 106 -6.506 3.182 0.404 1.00 0.00 N ATOM 1619 CA ILE A 106 -7.660 4.074 0.385 1.00 0.00 C ATOM 1620 C ILE A 106 -7.414 5.273 1.291 1.00 0.00 C ATOM 1621 O ILE A 106 -7.601 6.414 0.882 1.00 0.00 O ATOM 1622 CB ILE A 106 -8.952 3.351 0.834 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -9.341 2.270 -0.178 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -10.094 4.346 1.015 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -10.540 1.446 0.241 1.00 0.00 C ATOM 0 H ILE A 106 -6.717 2.229 0.700 1.00 0.00 H new ATOM 0 HA ILE A 106 -7.795 4.408 -0.644 1.00 0.00 H new ATOM 0 HB ILE A 106 -8.759 2.874 1.795 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -9.553 2.742 -1.137 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -8.491 1.606 -0.331 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -10.992 3.815 1.331 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -9.821 5.080 1.773 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -10.286 4.855 0.070 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -10.756 0.701 -0.525 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -10.325 0.944 1.184 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -11.404 2.098 0.366 1.00 0.00 H new ATOM 1637 N ARG A 107 -6.966 4.999 2.512 1.00 0.00 N ATOM 1638 CA ARG A 107 -6.698 6.047 3.493 1.00 0.00 C ATOM 1639 C ARG A 107 -5.697 7.067 2.947 1.00 0.00 C ATOM 1640 O ARG A 107 -5.948 8.273 2.967 1.00 0.00 O ATOM 1641 CB ARG A 107 -6.165 5.428 4.788 1.00 0.00 C ATOM 1642 CG ARG A 107 -5.841 6.445 5.872 1.00 0.00 C ATOM 1643 CD ARG A 107 -5.209 5.781 7.084 1.00 0.00 C ATOM 1644 NE ARG A 107 -4.792 6.757 8.090 1.00 0.00 N ATOM 1645 CZ ARG A 107 -3.525 6.944 8.458 1.00 0.00 C ATOM 1646 NH1 ARG A 107 -2.556 6.222 7.911 1.00 0.00 N ATOM 1647 NH2 ARG A 107 -3.220 7.851 9.378 1.00 0.00 N ATOM 0 H ARG A 107 -6.780 4.054 2.848 1.00 0.00 H new ATOM 0 HA ARG A 107 -7.633 6.567 3.702 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -6.903 4.724 5.173 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -5.266 4.855 4.562 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -5.163 7.200 5.474 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -6.752 6.962 6.172 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -5.921 5.085 7.528 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -4.346 5.196 6.767 1.00 0.00 H new ATOM 0 HE ARG A 107 -5.512 7.327 8.535 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -2.779 5.520 7.205 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -1.588 6.369 8.196 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -3.957 8.410 9.808 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -2.248 7.989 9.655 1.00 0.00 H new ATOM 1661 N THR A 108 -4.573 6.570 2.444 1.00 0.00 N ATOM 1662 CA THR A 108 -3.514 7.427 1.929 1.00 0.00 C ATOM 1663 C THR A 108 -4.004 8.258 0.743 1.00 0.00 C ATOM 1664 O THR A 108 -3.778 9.469 0.686 1.00 0.00 O ATOM 1665 CB THR A 108 -2.292 6.589 1.506 1.00 0.00 C ATOM 1666 OG1 THR A 108 -1.919 5.708 2.572 1.00 0.00 O ATOM 1667 CG2 THR A 108 -1.112 7.483 1.148 1.00 0.00 C ATOM 0 H THR A 108 -4.372 5.572 2.382 1.00 0.00 H new ATOM 0 HA THR A 108 -3.221 8.105 2.731 1.00 0.00 H new ATOM 0 HB THR A 108 -2.564 6.009 0.624 1.00 0.00 H new ATOM 0 HG1 THR A 108 -2.553 4.962 2.617 1.00 0.00 H new ATOM 0 HG21 THR A 108 -0.264 6.865 0.853 1.00 0.00 H new ATOM 0 HG22 THR A 108 -1.389 8.137 0.321 1.00 0.00 H new ATOM 0 HG23 THR A 108 -0.838 8.087 2.013 1.00 0.00 H new ATOM 1675 N TYR A 109 -4.694 7.610 -0.187 1.00 0.00 N ATOM 1676 CA TYR A 109 -5.195 8.289 -1.375 1.00 0.00 C ATOM 1677 C TYR A 109 -6.273 9.302 -1.009 1.00 0.00 C ATOM 1678 O TYR A 109 -6.242 10.439 -1.473 1.00 0.00 O ATOM 1679 CB TYR A 109 -5.744 7.273 -2.382 1.00 0.00 C ATOM 1680 CG TYR A 109 -6.332 7.904 -3.627 1.00 0.00 C ATOM 1681 CD1 TYR A 109 -5.517 8.516 -4.572 1.00 0.00 C ATOM 1682 CD2 TYR A 109 -7.702 7.881 -3.859 1.00 0.00 C ATOM 1683 CE1 TYR A 109 -6.050 9.089 -5.711 1.00 0.00 C ATOM 1684 CE2 TYR A 109 -8.242 8.451 -4.997 1.00 0.00 C ATOM 1685 CZ TYR A 109 -7.412 9.053 -5.919 1.00 0.00 C ATOM 1686 OH TYR A 109 -7.947 9.621 -7.052 1.00 0.00 O ATOM 0 H TYR A 109 -4.919 6.616 -0.142 1.00 0.00 H new ATOM 0 HA TYR A 109 -4.363 8.824 -1.834 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -4.942 6.595 -2.674 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -6.510 6.670 -1.895 1.00 0.00 H new ATOM 0 HD1 TYR A 109 -4.449 8.544 -4.413 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -8.355 7.410 -3.139 1.00 0.00 H new ATOM 0 HE1 TYR A 109 -5.403 9.563 -6.434 1.00 0.00 H new ATOM 0 HE2 TYR A 109 -9.309 8.425 -5.163 1.00 0.00 H new ATOM 0 HH TYR A 109 -8.920 9.508 -7.046 1.00 0.00 H new ATOM 1696 N ASN A 110 -7.206 8.885 -0.156 1.00 0.00 N ATOM 1697 CA ASN A 110 -8.343 9.720 0.234 1.00 0.00 C ATOM 1698 C ASN A 110 -7.872 11.032 0.855 1.00 0.00 C ATOM 1699 O ASN A 110 -8.528 12.064 0.725 1.00 0.00 O ATOM 1700 CB ASN A 110 -9.237 8.960 1.223 1.00 0.00 C ATOM 1701 CG ASN A 110 -10.599 9.605 1.414 1.00 0.00 C ATOM 1702 OD1 ASN A 110 -11.548 9.302 0.694 1.00 0.00 O ATOM 1703 ND2 ASN A 110 -10.715 10.482 2.397 1.00 0.00 N ATOM 0 H ASN A 110 -7.197 7.964 0.283 1.00 0.00 H new ATOM 0 HA ASN A 110 -8.917 9.955 -0.662 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -9.372 7.938 0.869 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -8.732 8.900 2.187 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -11.613 10.930 2.577 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -9.906 10.710 2.975 1.00 0.00 H new ATOM 1710 N ILE A 111 -6.728 10.986 1.526 1.00 0.00 N ATOM 1711 CA ILE A 111 -6.150 12.181 2.123 1.00 0.00 C ATOM 1712 C ILE A 111 -5.330 12.966 1.100 1.00 0.00 C ATOM 1713 O ILE A 111 -5.565 14.155 0.885 1.00 0.00 O ATOM 1714 CB ILE A 111 -5.249 11.833 3.330 1.00 0.00 C ATOM 1715 CG1 ILE A 111 -6.068 11.142 4.425 1.00 0.00 C ATOM 1716 CG2 ILE A 111 -4.574 13.088 3.875 1.00 0.00 C ATOM 1717 CD1 ILE A 111 -5.243 10.690 5.612 1.00 0.00 C ATOM 0 H ILE A 111 -6.184 10.135 1.670 1.00 0.00 H new ATOM 0 HA ILE A 111 -6.982 12.795 2.467 1.00 0.00 H new ATOM 0 HB ILE A 111 -4.472 11.146 2.995 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -6.843 11.826 4.772 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -6.574 10.277 3.996 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -3.944 12.823 4.724 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -3.961 13.539 3.095 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -5.334 13.800 4.196 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -5.892 10.210 6.345 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -4.485 9.981 5.279 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -4.758 11.553 6.068 1.00 0.00 H new ATOM 1729 N MET A 112 -4.392 12.288 0.445 1.00 0.00 N ATOM 1730 CA MET A 112 -3.412 12.961 -0.406 1.00 0.00 C ATOM 1731 C MET A 112 -4.036 13.482 -1.705 1.00 0.00 C ATOM 1732 O MET A 112 -3.452 14.322 -2.390 1.00 0.00 O ATOM 1733 CB MET A 112 -2.236 12.025 -0.701 1.00 0.00 C ATOM 1734 CG MET A 112 -1.049 12.718 -1.357 1.00 0.00 C ATOM 1735 SD MET A 112 0.449 11.709 -1.338 1.00 0.00 S ATOM 1736 CE MET A 112 -0.092 10.269 -2.253 1.00 0.00 C ATOM 0 H MET A 112 -4.289 11.274 0.486 1.00 0.00 H new ATOM 0 HA MET A 112 -3.044 13.830 0.139 1.00 0.00 H new ATOM 0 HB2 MET A 112 -1.907 11.565 0.231 1.00 0.00 H new ATOM 0 HB3 MET A 112 -2.579 11.219 -1.350 1.00 0.00 H new ATOM 0 HG2 MET A 112 -1.302 12.964 -2.388 1.00 0.00 H new ATOM 0 HG3 MET A 112 -0.854 13.659 -0.843 1.00 0.00 H new ATOM 0 HE1 MET A 112 0.355 9.374 -1.821 1.00 0.00 H new ATOM 0 HE2 MET A 112 -1.178 10.193 -2.202 1.00 0.00 H new ATOM 0 HE3 MET A 112 0.217 10.362 -3.294 1.00 0.00 H new ATOM 1746 N ILE A 113 -5.227 12.997 -2.043 1.00 0.00 N ATOM 1747 CA ILE A 113 -5.946 13.520 -3.201 1.00 0.00 C ATOM 1748 C ILE A 113 -6.528 14.895 -2.867 1.00 0.00 C ATOM 1749 O ILE A 113 -6.870 15.676 -3.754 1.00 0.00 O ATOM 1750 CB ILE A 113 -7.077 12.565 -3.668 1.00 0.00 C ATOM 1751 CG1 ILE A 113 -7.614 12.986 -5.040 1.00 0.00 C ATOM 1752 CG2 ILE A 113 -8.211 12.526 -2.651 1.00 0.00 C ATOM 1753 CD1 ILE A 113 -6.576 12.938 -6.141 1.00 0.00 C ATOM 0 H ILE A 113 -5.710 12.253 -1.540 1.00 0.00 H new ATOM 0 HA ILE A 113 -5.234 13.606 -4.022 1.00 0.00 H new ATOM 0 HB ILE A 113 -6.653 11.564 -3.752 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -8.447 12.336 -5.309 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -8.010 13.999 -4.970 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -8.991 11.850 -3.001 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -7.829 12.173 -1.693 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -8.626 13.527 -2.530 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -7.029 13.249 -7.082 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -5.753 13.609 -5.895 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -6.197 11.921 -6.240 1.00 0.00 H new ATOM 1765 N GLY A 114 -6.612 15.186 -1.570 1.00 0.00 N ATOM 1766 CA GLY A 114 -7.105 16.473 -1.122 1.00 0.00 C ATOM 1767 C GLY A 114 -6.106 17.578 -1.385 1.00 0.00 C ATOM 1768 O GLY A 114 -6.458 18.758 -1.393 1.00 0.00 O ATOM 0 H GLY A 114 -6.345 14.548 -0.820 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -8.042 16.701 -1.631 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -7.324 16.427 -0.055 1.00 0.00 H new ATOM 1772 N GLU A 115 -4.852 17.190 -1.594 1.00 0.00 N ATOM 1773 CA GLU A 115 -3.804 18.133 -1.950 1.00 0.00 C ATOM 1774 C GLU A 115 -4.108 18.769 -3.301 1.00 0.00 C ATOM 1775 O GLU A 115 -4.448 19.952 -3.372 1.00 0.00 O ATOM 1776 CB GLU A 115 -2.440 17.436 -1.977 1.00 0.00 C ATOM 1777 CG GLU A 115 -1.738 17.394 -0.626 1.00 0.00 C ATOM 1778 CD GLU A 115 -2.644 16.961 0.508 1.00 0.00 C ATOM 1779 OE1 GLU A 115 -2.761 15.746 0.750 1.00 0.00 O ATOM 1780 OE2 GLU A 115 -3.229 17.843 1.174 1.00 0.00 O ATOM 0 H GLU A 115 -4.538 16.222 -1.522 1.00 0.00 H new ATOM 0 HA GLU A 115 -3.770 18.919 -1.195 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -2.572 16.416 -2.338 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -1.797 17.947 -2.693 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -0.891 16.711 -0.686 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -1.335 18.382 -0.403 1.00 0.00 H new ATOM 1787 N ARG A 116 -4.012 17.980 -4.365 1.00 0.00 N ATOM 1788 CA ARG A 116 -4.351 18.464 -5.697 1.00 0.00 C ATOM 1789 C ARG A 116 -4.547 17.315 -6.688 1.00 0.00 C ATOM 1790 O ARG A 116 -5.684 16.996 -7.031 1.00 0.00 O ATOM 1791 CB ARG A 116 -3.314 19.481 -6.200 1.00 0.00 C ATOM 1792 CG ARG A 116 -1.863 19.030 -6.106 1.00 0.00 C ATOM 1793 CD ARG A 116 -0.911 20.197 -6.324 1.00 0.00 C ATOM 1794 NE ARG A 116 -0.909 21.120 -5.186 1.00 0.00 N ATOM 1795 CZ ARG A 116 -1.533 22.299 -5.170 1.00 0.00 C ATOM 1796 NH1 ARG A 116 -2.239 22.705 -6.217 1.00 0.00 N ATOM 1797 NH2 ARG A 116 -1.453 23.076 -4.097 1.00 0.00 N ATOM 0 H ARG A 116 -3.704 17.008 -4.332 1.00 0.00 H new ATOM 0 HA ARG A 116 -5.307 18.981 -5.622 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -3.537 19.718 -7.240 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -3.428 20.404 -5.631 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -1.680 18.585 -5.128 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -1.671 18.256 -6.849 1.00 0.00 H new ATOM 0 HD2 ARG A 116 0.098 19.817 -6.485 1.00 0.00 H new ATOM 0 HD3 ARG A 116 -1.197 20.735 -7.228 1.00 0.00 H new ATOM 0 HE ARG A 116 -0.396 20.842 -4.349 1.00 0.00 H new ATOM 0 HH11 ARG A 116 -2.309 22.114 -7.045 1.00 0.00 H new ATOM 0 HH12 ARG A 116 -2.712 23.608 -6.194 1.00 0.00 H new ATOM 0 HH21 ARG A 116 -0.915 22.771 -3.286 1.00 0.00 H new ATOM 0 HH22 ARG A 116 -1.930 23.978 -4.084 1.00 0.00 H new ATOM 1811 N ARG A 117 -3.457 16.679 -7.126 1.00 0.00 N ATOM 1812 CA ARG A 117 -3.534 15.628 -8.141 1.00 0.00 C ATOM 1813 C ARG A 117 -2.143 15.086 -8.482 1.00 0.00 C ATOM 1814 O ARG A 117 -1.185 15.325 -7.751 1.00 0.00 O ATOM 1815 CB ARG A 117 -4.222 16.154 -9.413 1.00 0.00 C ATOM 1816 CG ARG A 117 -3.518 17.336 -10.066 1.00 0.00 C ATOM 1817 CD ARG A 117 -4.369 17.950 -11.168 1.00 0.00 C ATOM 1818 NE ARG A 117 -4.762 16.965 -12.176 1.00 0.00 N ATOM 1819 CZ ARG A 117 -5.631 17.204 -13.160 1.00 0.00 C ATOM 1820 NH1 ARG A 117 -6.178 18.403 -13.300 1.00 0.00 N ATOM 1821 NH2 ARG A 117 -5.947 16.234 -14.006 1.00 0.00 N ATOM 0 H ARG A 117 -2.513 16.874 -6.793 1.00 0.00 H new ATOM 0 HA ARG A 117 -4.128 14.812 -7.730 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -4.290 15.342 -10.137 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -5.242 16.446 -9.165 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -3.296 18.091 -9.312 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -2.564 17.010 -10.480 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -5.262 18.395 -10.730 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -3.814 18.756 -11.647 1.00 0.00 H new ATOM 0 HE ARG A 117 -4.345 16.036 -12.123 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -5.936 19.153 -12.652 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -6.841 18.576 -14.055 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -5.527 15.310 -13.903 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -6.611 16.411 -14.760 1.00 0.00 H new ATOM 1835 N ARG A 118 -2.073 14.340 -9.592 1.00 0.00 N ATOM 1836 CA ARG A 118 -0.838 13.717 -10.100 1.00 0.00 C ATOM 1837 C ARG A 118 -0.460 12.489 -9.261 1.00 0.00 C ATOM 1838 O ARG A 118 0.640 11.914 -9.353 1.00 0.00 O ATOM 1839 CB ARG A 118 0.298 14.755 -10.264 1.00 0.00 C ATOM 1840 CG ARG A 118 1.484 14.620 -9.322 1.00 0.00 C ATOM 1841 CD ARG A 118 2.675 15.406 -9.852 1.00 0.00 C ATOM 1842 NE ARG A 118 3.001 15.019 -11.230 1.00 0.00 N ATOM 1843 CZ ARG A 118 4.236 14.787 -11.673 1.00 0.00 C ATOM 1844 NH1 ARG A 118 5.280 14.995 -10.879 1.00 0.00 N ATOM 1845 NH2 ARG A 118 4.425 14.364 -12.921 1.00 0.00 N ATOM 0 H ARG A 118 -2.887 14.147 -10.175 1.00 0.00 H new ATOM 0 HA ARG A 118 -1.020 13.341 -11.107 1.00 0.00 H new ATOM 0 HB2 ARG A 118 0.668 14.697 -11.288 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -0.128 15.750 -10.135 1.00 0.00 H new ATOM 0 HG2 ARG A 118 1.212 14.983 -8.331 1.00 0.00 H new ATOM 0 HG3 ARG A 118 1.753 13.569 -9.214 1.00 0.00 H new ATOM 0 HD2 ARG A 118 2.455 16.473 -9.814 1.00 0.00 H new ATOM 0 HD3 ARG A 118 3.540 15.236 -9.210 1.00 0.00 H new ATOM 0 HE ARG A 118 2.231 14.921 -11.892 1.00 0.00 H new ATOM 0 HH11 ARG A 118 5.138 15.333 -9.927 1.00 0.00 H new ATOM 0 HH12 ARG A 118 6.224 14.817 -11.221 1.00 0.00 H new ATOM 0 HH21 ARG A 118 3.625 14.218 -13.537 1.00 0.00 H new ATOM 0 HH22 ARG A 118 5.370 14.186 -13.262 1.00 0.00 H new ATOM 1859 N VAL A 119 -1.443 12.049 -8.506 1.00 0.00 N ATOM 1860 CA VAL A 119 -1.367 10.805 -7.769 1.00 0.00 C ATOM 1861 C VAL A 119 -2.446 9.860 -8.289 1.00 0.00 C ATOM 1862 O VAL A 119 -3.592 10.264 -8.483 1.00 0.00 O ATOM 1863 CB VAL A 119 -1.530 11.025 -6.243 1.00 0.00 C ATOM 1864 CG1 VAL A 119 -2.812 11.785 -5.926 1.00 0.00 C ATOM 1865 CG2 VAL A 119 -1.497 9.697 -5.501 1.00 0.00 C ATOM 0 H VAL A 119 -2.324 12.548 -8.385 1.00 0.00 H new ATOM 0 HA VAL A 119 -0.380 10.369 -7.922 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.690 11.631 -5.904 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -2.896 11.923 -4.848 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -2.788 12.759 -6.415 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -3.670 11.218 -6.287 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -1.613 9.875 -4.432 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -2.310 9.063 -5.854 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -0.544 9.201 -5.685 1.00 0.00 H new ATOM 1875 N ALA A 120 -2.068 8.624 -8.555 1.00 0.00 N ATOM 1876 CA ALA A 120 -3.000 7.641 -9.074 1.00 0.00 C ATOM 1877 C ALA A 120 -3.139 6.484 -8.101 1.00 0.00 C ATOM 1878 O ALA A 120 -2.187 6.136 -7.403 1.00 0.00 O ATOM 1879 CB ALA A 120 -2.545 7.145 -10.437 1.00 0.00 C ATOM 0 H ALA A 120 -1.119 8.276 -8.420 1.00 0.00 H new ATOM 0 HA ALA A 120 -3.976 8.112 -9.191 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.255 6.408 -10.812 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -2.493 7.984 -11.131 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -1.560 6.686 -10.347 1.00 0.00 H new ATOM 1885 N ALA A 121 -4.322 5.897 -8.052 1.00 0.00 N ATOM 1886 CA ALA A 121 -4.583 4.797 -7.142 1.00 0.00 C ATOM 1887 C ALA A 121 -5.164 3.605 -7.882 1.00 0.00 C ATOM 1888 O ALA A 121 -6.264 3.674 -8.427 1.00 0.00 O ATOM 1889 CB ALA A 121 -5.524 5.236 -6.034 1.00 0.00 C ATOM 0 H ALA A 121 -5.117 6.164 -8.632 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.634 4.495 -6.698 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.709 4.399 -5.361 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -5.072 6.057 -5.477 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -6.467 5.568 -6.468 1.00 0.00 H new ATOM 1895 N ALA A 122 -4.413 2.521 -7.909 1.00 0.00 N ATOM 1896 CA ALA A 122 -4.891 1.280 -8.484 1.00 0.00 C ATOM 1897 C ALA A 122 -5.419 0.385 -7.375 1.00 0.00 C ATOM 1898 O ALA A 122 -4.658 -0.320 -6.708 1.00 0.00 O ATOM 1899 CB ALA A 122 -3.783 0.585 -9.264 1.00 0.00 C ATOM 0 H ALA A 122 -3.464 2.476 -7.537 1.00 0.00 H new ATOM 0 HA ALA A 122 -5.699 1.495 -9.183 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -4.164 -0.345 -9.687 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -3.441 1.236 -10.068 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -2.950 0.365 -8.596 1.00 0.00 H new ATOM 1905 N LEU A 123 -6.720 0.443 -7.154 1.00 0.00 N ATOM 1906 CA LEU A 123 -7.335 -0.302 -6.071 1.00 0.00 C ATOM 1907 C LEU A 123 -7.940 -1.593 -6.589 1.00 0.00 C ATOM 1908 O LEU A 123 -8.958 -1.585 -7.281 1.00 0.00 O ATOM 1909 CB LEU A 123 -8.399 0.542 -5.369 1.00 0.00 C ATOM 1910 CG LEU A 123 -7.873 1.792 -4.659 1.00 0.00 C ATOM 1911 CD1 LEU A 123 -9.007 2.525 -3.964 1.00 0.00 C ATOM 1912 CD2 LEU A 123 -6.787 1.421 -3.660 1.00 0.00 C ATOM 0 H LEU A 123 -7.371 0.998 -7.710 1.00 0.00 H new ATOM 0 HA LEU A 123 -6.560 -0.549 -5.345 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -9.142 0.847 -6.105 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -8.912 -0.083 -4.638 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.440 2.456 -5.407 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -8.615 3.411 -3.464 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -9.753 2.824 -4.701 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -9.468 1.867 -3.227 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.425 2.322 -3.165 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -7.195 0.737 -2.916 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -5.962 0.938 -4.183 1.00 0.00 H new ATOM 1924 N ILE A 124 -7.296 -2.698 -6.257 1.00 0.00 N ATOM 1925 CA ILE A 124 -7.752 -4.004 -6.687 1.00 0.00 C ATOM 1926 C ILE A 124 -8.713 -4.588 -5.665 1.00 0.00 C ATOM 1927 O ILE A 124 -8.353 -4.791 -4.503 1.00 0.00 O ATOM 1928 CB ILE A 124 -6.567 -4.977 -6.884 1.00 0.00 C ATOM 1929 CG1 ILE A 124 -5.545 -4.384 -7.861 1.00 0.00 C ATOM 1930 CG2 ILE A 124 -7.065 -6.327 -7.384 1.00 0.00 C ATOM 1931 CD1 ILE A 124 -4.314 -5.244 -8.052 1.00 0.00 C ATOM 0 H ILE A 124 -6.450 -2.714 -5.687 1.00 0.00 H new ATOM 0 HA ILE A 124 -8.261 -3.877 -7.642 1.00 0.00 H new ATOM 0 HB ILE A 124 -6.077 -5.126 -5.922 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -6.025 -4.233 -8.828 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -5.239 -3.402 -7.501 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.218 -7.000 -7.518 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -7.756 -6.752 -6.656 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -7.578 -6.195 -8.337 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -3.638 -4.760 -8.756 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -3.809 -5.374 -7.095 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -4.608 -6.218 -8.443 1.00 0.00 H new ATOM 1943 N ALA A 125 -9.945 -4.819 -6.084 1.00 0.00 N ATOM 1944 CA ALA A 125 -10.895 -5.528 -5.255 1.00 0.00 C ATOM 1945 C ALA A 125 -10.640 -7.017 -5.371 1.00 0.00 C ATOM 1946 O ALA A 125 -10.558 -7.549 -6.480 1.00 0.00 O ATOM 1947 CB ALA A 125 -12.322 -5.195 -5.657 1.00 0.00 C ATOM 0 H ALA A 125 -10.307 -4.526 -6.991 1.00 0.00 H new ATOM 0 HA ALA A 125 -10.766 -5.218 -4.218 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -13.017 -5.741 -5.019 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -12.491 -4.124 -5.545 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -12.483 -5.481 -6.696 1.00 0.00 H new ATOM 1953 N VAL A 126 -10.497 -7.682 -4.236 1.00 0.00 N ATOM 1954 CA VAL A 126 -10.214 -9.105 -4.224 1.00 0.00 C ATOM 1955 C VAL A 126 -11.373 -9.890 -4.825 1.00 0.00 C ATOM 1956 O VAL A 126 -12.519 -9.771 -4.380 1.00 0.00 O ATOM 1957 CB VAL A 126 -9.901 -9.618 -2.802 1.00 0.00 C ATOM 1958 CG1 VAL A 126 -8.552 -9.095 -2.335 1.00 0.00 C ATOM 1959 CG2 VAL A 126 -10.989 -9.209 -1.818 1.00 0.00 C ATOM 0 H VAL A 126 -10.573 -7.258 -3.312 1.00 0.00 H new ATOM 0 HA VAL A 126 -9.325 -9.262 -4.836 1.00 0.00 H new ATOM 0 HB VAL A 126 -9.867 -10.707 -2.839 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -8.346 -9.466 -1.331 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -7.773 -9.439 -3.016 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -8.569 -8.005 -2.323 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -10.741 -9.584 -0.825 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -11.062 -8.122 -1.787 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -11.944 -9.628 -2.136 1.00 0.00 H new ATOM 1969 N PRO A 127 -11.092 -10.678 -5.872 1.00 0.00 N ATOM 1970 CA PRO A 127 -12.114 -11.446 -6.574 1.00 0.00 C ATOM 1971 C PRO A 127 -12.741 -12.515 -5.690 1.00 0.00 C ATOM 1972 O PRO A 127 -12.192 -13.606 -5.516 1.00 0.00 O ATOM 1973 CB PRO A 127 -11.363 -12.080 -7.750 1.00 0.00 C ATOM 1974 CG PRO A 127 -9.926 -12.059 -7.354 1.00 0.00 C ATOM 1975 CD PRO A 127 -9.753 -10.867 -6.454 1.00 0.00 C ATOM 0 HA PRO A 127 -12.946 -10.816 -6.889 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -11.706 -13.098 -7.933 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -11.526 -11.518 -8.670 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -9.652 -12.979 -6.838 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -9.282 -11.981 -8.230 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -9.003 -11.051 -5.684 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -9.430 -9.987 -7.011 1.00 0.00 H new ATOM 1983 N LEU A 128 -13.875 -12.173 -5.098 1.00 0.00 N ATOM 1984 CA LEU A 128 -14.643 -13.117 -4.311 1.00 0.00 C ATOM 1985 C LEU A 128 -15.420 -14.017 -5.264 1.00 0.00 C ATOM 1986 O LEU A 128 -16.534 -13.695 -5.680 1.00 0.00 O ATOM 1987 CB LEU A 128 -15.574 -12.361 -3.346 1.00 0.00 C ATOM 1988 CG LEU A 128 -16.178 -13.182 -2.200 1.00 0.00 C ATOM 1989 CD1 LEU A 128 -16.492 -12.279 -1.017 1.00 0.00 C ATOM 1990 CD2 LEU A 128 -17.445 -13.894 -2.647 1.00 0.00 C ATOM 0 H LEU A 128 -14.284 -11.240 -5.150 1.00 0.00 H new ATOM 0 HA LEU A 128 -13.985 -13.737 -3.702 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -15.017 -11.530 -2.914 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -16.391 -11.931 -3.926 1.00 0.00 H new ATOM 0 HG LEU A 128 -15.445 -13.932 -1.901 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -16.920 -12.873 -0.210 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -15.575 -11.802 -0.670 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -17.206 -11.514 -1.323 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -17.852 -14.469 -1.815 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -18.180 -13.158 -2.974 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -17.212 -14.566 -3.473 1.00 0.00 H new ATOM 2002 N GLU A 129 -14.794 -15.115 -5.649 1.00 0.00 N ATOM 2003 CA GLU A 129 -15.345 -15.997 -6.665 1.00 0.00 C ATOM 2004 C GLU A 129 -15.638 -17.380 -6.093 1.00 0.00 C ATOM 2005 O GLU A 129 -16.559 -18.063 -6.540 1.00 0.00 O ATOM 2006 CB GLU A 129 -14.367 -16.098 -7.839 1.00 0.00 C ATOM 2007 CG GLU A 129 -12.946 -16.427 -7.407 1.00 0.00 C ATOM 2008 CD GLU A 129 -11.965 -16.490 -8.557 1.00 0.00 C ATOM 2009 OE1 GLU A 129 -11.928 -17.523 -9.253 1.00 0.00 O ATOM 2010 OE2 GLU A 129 -11.198 -15.523 -8.747 1.00 0.00 O ATOM 0 H GLU A 129 -13.897 -15.419 -5.271 1.00 0.00 H new ATOM 0 HA GLU A 129 -16.288 -15.579 -7.016 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -14.717 -16.865 -8.530 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -14.365 -15.154 -8.384 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -12.609 -15.676 -6.693 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -12.945 -17.385 -6.886 1.00 0.00 H new ATOM 2017 N HIS A 130 -14.857 -17.790 -5.102 1.00 0.00 N ATOM 2018 CA HIS A 130 -15.026 -19.101 -4.494 1.00 0.00 C ATOM 2019 C HIS A 130 -15.171 -18.969 -2.984 1.00 0.00 C ATOM 2020 O HIS A 130 -15.259 -17.862 -2.451 1.00 0.00 O ATOM 2021 CB HIS A 130 -13.835 -20.013 -4.818 1.00 0.00 C ATOM 2022 CG HIS A 130 -13.586 -20.205 -6.284 1.00 0.00 C ATOM 2023 ND1 HIS A 130 -14.489 -20.808 -7.132 1.00 0.00 N ATOM 2024 CD2 HIS A 130 -12.527 -19.860 -7.052 1.00 0.00 C ATOM 2025 CE1 HIS A 130 -13.996 -20.824 -8.356 1.00 0.00 C ATOM 2026 NE2 HIS A 130 -12.808 -20.255 -8.333 1.00 0.00 N ATOM 0 H HIS A 130 -14.101 -17.233 -4.703 1.00 0.00 H new ATOM 0 HA HIS A 130 -15.931 -19.548 -4.906 1.00 0.00 H new ATOM 0 HB2 HIS A 130 -12.938 -19.596 -4.361 1.00 0.00 H new ATOM 0 HB3 HIS A 130 -14.003 -20.987 -4.359 1.00 0.00 H new ATOM 0 HD2 HIS A 130 -11.627 -19.365 -6.717 1.00 0.00 H new ATOM 0 HE1 HIS A 130 -14.484 -21.234 -9.228 1.00 0.00 H new ATOM 0 HE2 HIS A 130 -12.196 -20.129 -9.139 1.00 0.00 H new ATOM 2035 N HIS A 131 -15.198 -20.102 -2.299 1.00 0.00 N ATOM 2036 CA HIS A 131 -15.267 -20.122 -0.845 1.00 0.00 C ATOM 2037 C HIS A 131 -14.060 -20.871 -0.297 1.00 0.00 C ATOM 2038 O HIS A 131 -13.312 -21.482 -1.060 1.00 0.00 O ATOM 2039 CB HIS A 131 -16.561 -20.794 -0.372 1.00 0.00 C ATOM 2040 CG HIS A 131 -17.812 -20.114 -0.840 1.00 0.00 C ATOM 2041 ND1 HIS A 131 -18.585 -20.595 -1.873 1.00 0.00 N ATOM 2042 CD2 HIS A 131 -18.434 -18.994 -0.401 1.00 0.00 C ATOM 2043 CE1 HIS A 131 -19.625 -19.803 -2.051 1.00 0.00 C ATOM 2044 NE2 HIS A 131 -19.559 -18.822 -1.169 1.00 0.00 N ATOM 0 H HIS A 131 -15.173 -21.026 -2.730 1.00 0.00 H new ATOM 0 HA HIS A 131 -15.263 -19.097 -0.475 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -16.570 -21.827 -0.721 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -16.564 -20.826 0.718 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -18.106 -18.354 0.405 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -20.399 -19.935 -2.792 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -20.233 -18.062 -1.074 1.00 0.00 H new ATOM 2053 N HIS A 132 -13.864 -20.831 1.011 1.00 0.00 N ATOM 2054 CA HIS A 132 -12.736 -21.525 1.623 1.00 0.00 C ATOM 2055 C HIS A 132 -13.162 -22.887 2.155 1.00 0.00 C ATOM 2056 O HIS A 132 -12.411 -23.854 2.053 1.00 0.00 O ATOM 2057 CB HIS A 132 -12.108 -20.690 2.744 1.00 0.00 C ATOM 2058 CG HIS A 132 -11.073 -19.713 2.264 1.00 0.00 C ATOM 2059 ND1 HIS A 132 -9.769 -20.072 2.014 1.00 0.00 N ATOM 2060 CD2 HIS A 132 -11.151 -18.388 1.995 1.00 0.00 C ATOM 2061 CE1 HIS A 132 -9.087 -19.017 1.616 1.00 0.00 C ATOM 2062 NE2 HIS A 132 -9.900 -17.979 1.594 1.00 0.00 N ATOM 0 H HIS A 132 -14.464 -20.331 1.667 1.00 0.00 H new ATOM 0 HA HIS A 132 -11.983 -21.673 0.849 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -12.896 -20.145 3.263 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -11.651 -21.361 3.472 1.00 0.00 H new ATOM 0 HD1 HIS A 132 -9.388 -21.012 2.120 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -12.031 -17.768 2.080 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -8.040 -19.005 1.352 1.00 0.00 H new ATOM 2071 N HIS A 133 -14.369 -22.944 2.723 1.00 0.00 N ATOM 2072 CA HIS A 133 -14.949 -24.183 3.260 1.00 0.00 C ATOM 2073 C HIS A 133 -14.222 -24.626 4.534 1.00 0.00 C ATOM 2074 O HIS A 133 -14.827 -24.711 5.602 1.00 0.00 O ATOM 2075 CB HIS A 133 -14.936 -25.298 2.202 1.00 0.00 C ATOM 2076 CG HIS A 133 -15.737 -26.511 2.577 1.00 0.00 C ATOM 2077 ND1 HIS A 133 -17.084 -26.465 2.847 1.00 0.00 N ATOM 2078 CD2 HIS A 133 -15.375 -27.807 2.712 1.00 0.00 C ATOM 2079 CE1 HIS A 133 -17.517 -27.676 3.130 1.00 0.00 C ATOM 2080 NE2 HIS A 133 -16.503 -28.513 3.054 1.00 0.00 N ATOM 0 H HIS A 133 -14.976 -22.131 2.825 1.00 0.00 H new ATOM 0 HA HIS A 133 -15.987 -23.980 3.523 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -15.321 -24.898 1.264 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -13.904 -25.599 2.021 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -14.383 -28.212 2.576 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -18.534 -27.939 3.382 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -16.548 -29.518 3.221 1.00 0.00 H new ATOM 2089 N HIS A 134 -12.930 -24.906 4.418 1.00 0.00 N ATOM 2090 CA HIS A 134 -12.107 -25.230 5.579 1.00 0.00 C ATOM 2091 C HIS A 134 -10.693 -24.682 5.397 1.00 0.00 C ATOM 2092 O HIS A 134 -10.028 -24.320 6.366 1.00 0.00 O ATOM 2093 CB HIS A 134 -12.075 -26.747 5.854 1.00 0.00 C ATOM 2094 CG HIS A 134 -11.397 -27.575 4.801 1.00 0.00 C ATOM 2095 ND1 HIS A 134 -10.065 -27.920 4.858 1.00 0.00 N ATOM 2096 CD2 HIS A 134 -11.880 -28.151 3.675 1.00 0.00 C ATOM 2097 CE1 HIS A 134 -9.760 -28.669 3.817 1.00 0.00 C ATOM 2098 NE2 HIS A 134 -10.843 -28.825 3.084 1.00 0.00 N ATOM 0 H HIS A 134 -12.428 -24.916 3.530 1.00 0.00 H new ATOM 0 HA HIS A 134 -12.559 -24.754 6.449 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -11.572 -26.917 6.806 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -13.100 -27.101 5.967 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -12.895 -28.091 3.310 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -8.787 -29.084 3.602 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -10.901 -29.360 2.218 1.00 0.00 H new ATOM 2107 N HIS A 135 -10.246 -24.609 4.147 1.00 0.00 N ATOM 2108 CA HIS A 135 -8.933 -24.066 3.833 1.00 0.00 C ATOM 2109 C HIS A 135 -8.859 -23.716 2.353 1.00 0.00 C ATOM 2110 O HIS A 135 -8.583 -24.618 1.543 1.00 0.00 O ATOM 2111 CB HIS A 135 -7.828 -25.065 4.202 1.00 0.00 C ATOM 2112 CG HIS A 135 -6.447 -24.580 3.876 1.00 0.00 C ATOM 2113 ND1 HIS A 135 -5.550 -25.313 3.136 1.00 0.00 N ATOM 2114 CD2 HIS A 135 -5.820 -23.421 4.183 1.00 0.00 C ATOM 2115 CE1 HIS A 135 -4.431 -24.629 3.001 1.00 0.00 C ATOM 2116 NE2 HIS A 135 -4.566 -23.471 3.625 1.00 0.00 N ATOM 2117 OXT HIS A 135 -9.092 -22.543 2.010 1.00 0.00 O ATOM 0 H HIS A 135 -10.777 -24.921 3.334 1.00 0.00 H new ATOM 0 HA HIS A 135 -8.781 -23.161 4.421 1.00 0.00 H new ATOM 0 HB2 HIS A 135 -7.886 -25.280 5.269 1.00 0.00 H new ATOM 0 HB3 HIS A 135 -8.008 -26.003 3.677 1.00 0.00 H new ATOM 0 HD2 HIS A 135 -6.230 -22.606 4.761 1.00 0.00 H new ATOM 0 HE1 HIS A 135 -3.551 -24.959 2.469 1.00 0.00 H new ATOM 0 HE2 HIS A 135 -3.858 -22.739 3.682 1.00 0.00 H new TER 2126 HIS A 135