USER MOD reduce.3.24.130724 H: found=0, std=0, add=1037, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1036 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 28 TYR OH : rot 180:sc= -1.7! USER MOD Set 1.2: A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 20 ASN : amide:sc= -1.72 K(o=-3.4,f=-8.4!) USER MOD Set 2.2: A 24 ASN :FLIP amide:sc= -1.65 F(o=-6.2!,f=-3.4) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -176:sc= -0.0965 (180deg=-0.171) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 ASN : amide:sc= -4.21! C(o=-4.2!,f=-5.7!) USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN : amide:sc= -0.014 X(o=-0.014,f=0) USER MOD Single : A 13 TYR OH : rot 30:sc= -1.22! USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 ASN :FLIP amide:sc= -1.63! F(o=-2.3,f=-1.6!) USER MOD Single : A 38 GLN :FLIP amide:sc= -1.88 F(o=-3!,f=-1.9) USER MOD Single : A 44 THR OG1 : rot 84:sc= 1.26 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 MET CE :methyl -105:sc= -1.44 (180deg=-4.02!) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 MET CE :methyl -102:sc= -8.96! (180deg=-14.1!) USER MOD Single : A 67 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0179) USER MOD Single : A 69 MET CE :methyl -127:sc= -10.3! (180deg=-17.5!) USER MOD Single : A 70 LYS NZ :NH3+ -164:sc= 0.0164 (180deg=-0.349) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 MET CE :methyl 140:sc= -8.35! (180deg=-9.03!) USER MOD Single : A 82 THR OG1 : rot -46:sc= 0.329 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= -1.68! C(o=-1.7!,f=-5.7!) USER MOD Single : A 93 SER OG : rot 109:sc= 0.967 USER MOD Single : A 94 LYS NZ :NH3+ 139:sc= -0.297 (180deg=-1.82!) USER MOD Single : A 100 THR OG1 : rot 180:sc= -0.484 USER MOD Single : A 101 HIS : no HE2:sc= -33! C(o=-33!,f=-41!) USER MOD Single : A 104 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0147) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot 165:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -0.905 K(o=-0.9,f=-5.6!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.236 -19.957 -0.946 1.00 0.00 N ATOM 2 CA MET A 1 8.189 -18.869 -1.303 1.00 0.00 C ATOM 3 C MET A 1 7.583 -17.516 -0.923 1.00 0.00 C ATOM 4 O MET A 1 8.248 -16.500 -0.944 1.00 0.00 O ATOM 5 CB MET A 1 8.460 -18.903 -2.809 1.00 0.00 C ATOM 6 CG MET A 1 9.967 -18.832 -3.058 1.00 0.00 C ATOM 7 SD MET A 1 10.362 -19.671 -4.612 1.00 0.00 S ATOM 8 CE MET A 1 12.156 -19.443 -4.545 1.00 0.00 C ATOM 0 H1 MET A 1 7.674 -20.880 -1.141 1.00 0.00 H new ATOM 0 H2 MET A 1 6.999 -19.893 0.065 1.00 0.00 H new ATOM 0 H3 MET A 1 6.369 -19.859 -1.512 1.00 0.00 H new ATOM 0 HA MET A 1 9.125 -19.012 -0.762 1.00 0.00 H new ATOM 0 HB2 MET A 1 8.052 -19.816 -3.242 1.00 0.00 H new ATOM 0 HB3 MET A 1 7.960 -18.067 -3.298 1.00 0.00 H new ATOM 0 HG2 MET A 1 10.291 -17.792 -3.101 1.00 0.00 H new ATOM 0 HG3 MET A 1 10.505 -19.299 -2.233 1.00 0.00 H new ATOM 0 HE1 MET A 1 12.613 -19.894 -5.426 1.00 0.00 H new ATOM 0 HE2 MET A 1 12.387 -18.378 -4.521 1.00 0.00 H new ATOM 0 HE3 MET A 1 12.550 -19.920 -3.647 1.00 0.00 H new ATOM 20 N MET A 2 6.325 -17.495 -0.577 1.00 0.00 N ATOM 21 CA MET A 2 5.679 -16.207 -0.196 1.00 0.00 C ATOM 22 C MET A 2 5.643 -15.276 -1.410 1.00 0.00 C ATOM 23 O MET A 2 6.523 -15.299 -2.248 1.00 0.00 O ATOM 24 CB MET A 2 6.479 -15.548 0.929 1.00 0.00 C ATOM 25 CG MET A 2 5.684 -15.626 2.235 1.00 0.00 C ATOM 26 SD MET A 2 6.711 -16.380 3.521 1.00 0.00 S ATOM 27 CE MET A 2 5.417 -16.540 4.777 1.00 0.00 C ATOM 0 H MET A 2 5.717 -18.313 -0.542 1.00 0.00 H new ATOM 0 HA MET A 2 4.662 -16.398 0.146 1.00 0.00 H new ATOM 0 HB2 MET A 2 7.441 -16.047 1.046 1.00 0.00 H new ATOM 0 HB3 MET A 2 6.688 -14.508 0.680 1.00 0.00 H new ATOM 0 HG2 MET A 2 5.371 -14.628 2.543 1.00 0.00 H new ATOM 0 HG3 MET A 2 4.778 -16.213 2.087 1.00 0.00 H new ATOM 0 HE1 MET A 2 5.836 -16.992 5.676 1.00 0.00 H new ATOM 0 HE2 MET A 2 5.020 -15.554 5.018 1.00 0.00 H new ATOM 0 HE3 MET A 2 4.614 -17.171 4.394 1.00 0.00 H new ATOM 37 N ASN A 3 4.633 -14.456 -1.510 1.00 0.00 N ATOM 38 CA ASN A 3 4.542 -13.525 -2.671 1.00 0.00 C ATOM 39 C ASN A 3 3.630 -12.350 -2.312 1.00 0.00 C ATOM 40 O ASN A 3 3.551 -11.939 -1.171 1.00 0.00 O ATOM 41 CB ASN A 3 3.966 -14.269 -3.877 1.00 0.00 C ATOM 42 CG ASN A 3 4.764 -15.552 -4.116 1.00 0.00 C ATOM 43 OD1 ASN A 3 4.512 -16.563 -3.491 1.00 0.00 O ATOM 44 ND2 ASN A 3 5.724 -15.553 -5.001 1.00 0.00 N ATOM 0 H ASN A 3 3.868 -14.390 -0.839 1.00 0.00 H new ATOM 0 HA ASN A 3 5.536 -13.151 -2.916 1.00 0.00 H new ATOM 0 HB2 ASN A 3 2.917 -14.508 -3.703 1.00 0.00 H new ATOM 0 HB3 ASN A 3 4.005 -13.634 -4.762 1.00 0.00 H new ATOM 0 HD21 ASN A 3 6.263 -16.403 -5.168 1.00 0.00 H new ATOM 0 HD22 ASN A 3 5.935 -14.704 -5.525 1.00 0.00 H new ATOM 51 N GLU A 4 2.940 -11.805 -3.276 1.00 0.00 N ATOM 52 CA GLU A 4 2.034 -10.659 -2.988 1.00 0.00 C ATOM 53 C GLU A 4 2.867 -9.433 -2.610 1.00 0.00 C ATOM 54 O GLU A 4 2.651 -8.817 -1.585 1.00 0.00 O ATOM 55 CB GLU A 4 1.103 -11.022 -1.829 1.00 0.00 C ATOM 56 CG GLU A 4 0.776 -12.515 -1.884 1.00 0.00 C ATOM 57 CD GLU A 4 -0.712 -12.723 -1.595 1.00 0.00 C ATOM 58 OE1 GLU A 4 -1.503 -11.917 -2.055 1.00 0.00 O ATOM 59 OE2 GLU A 4 -1.035 -13.685 -0.918 1.00 0.00 O ATOM 0 H GLU A 4 2.965 -12.104 -4.251 1.00 0.00 H new ATOM 0 HA GLU A 4 1.439 -10.435 -3.874 1.00 0.00 H new ATOM 0 HB2 GLU A 4 1.577 -10.778 -0.878 1.00 0.00 H new ATOM 0 HB3 GLU A 4 0.186 -10.436 -1.888 1.00 0.00 H new ATOM 0 HG2 GLU A 4 1.026 -12.917 -2.866 1.00 0.00 H new ATOM 0 HG3 GLU A 4 1.378 -13.057 -1.155 1.00 0.00 H new ATOM 66 N LYS A 5 3.816 -9.074 -3.429 1.00 0.00 N ATOM 67 CA LYS A 5 4.662 -7.888 -3.116 1.00 0.00 C ATOM 68 C LYS A 5 4.105 -6.660 -3.841 1.00 0.00 C ATOM 69 O LYS A 5 3.688 -6.736 -4.980 1.00 0.00 O ATOM 70 CB LYS A 5 6.097 -8.147 -3.581 1.00 0.00 C ATOM 71 CG LYS A 5 6.778 -9.121 -2.616 1.00 0.00 C ATOM 72 CD LYS A 5 7.757 -10.005 -3.391 1.00 0.00 C ATOM 73 CE LYS A 5 7.035 -11.265 -3.872 1.00 0.00 C ATOM 74 NZ LYS A 5 7.612 -11.701 -5.175 1.00 0.00 N ATOM 0 H LYS A 5 4.043 -9.551 -4.302 1.00 0.00 H new ATOM 0 HA LYS A 5 4.655 -7.710 -2.041 1.00 0.00 H new ATOM 0 HB2 LYS A 5 6.095 -8.560 -4.590 1.00 0.00 H new ATOM 0 HB3 LYS A 5 6.652 -7.210 -3.621 1.00 0.00 H new ATOM 0 HG2 LYS A 5 7.306 -8.570 -1.838 1.00 0.00 H new ATOM 0 HG3 LYS A 5 6.031 -9.738 -2.117 1.00 0.00 H new ATOM 0 HD2 LYS A 5 8.162 -9.458 -4.242 1.00 0.00 H new ATOM 0 HD3 LYS A 5 8.600 -10.276 -2.756 1.00 0.00 H new ATOM 0 HE2 LYS A 5 7.136 -12.060 -3.133 1.00 0.00 H new ATOM 0 HE3 LYS A 5 5.969 -11.067 -3.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 7.122 -12.558 -5.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 7.493 -10.944 -5.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 8.624 -11.906 -5.055 1.00 0.00 H new ATOM 88 N ILE A 6 4.094 -5.529 -3.190 1.00 0.00 N ATOM 89 CA ILE A 6 3.563 -4.300 -3.843 1.00 0.00 C ATOM 90 C ILE A 6 4.284 -3.072 -3.282 1.00 0.00 C ATOM 91 O ILE A 6 4.790 -3.087 -2.178 1.00 0.00 O ATOM 92 CB ILE A 6 2.064 -4.181 -3.564 1.00 0.00 C ATOM 93 CG1 ILE A 6 1.337 -5.385 -4.165 1.00 0.00 C ATOM 94 CG2 ILE A 6 1.526 -2.896 -4.196 1.00 0.00 C ATOM 95 CD1 ILE A 6 -0.150 -5.312 -3.813 1.00 0.00 C ATOM 0 H ILE A 6 4.430 -5.403 -2.235 1.00 0.00 H new ATOM 0 HA ILE A 6 3.729 -4.360 -4.919 1.00 0.00 H new ATOM 0 HB ILE A 6 1.897 -4.154 -2.487 1.00 0.00 H new ATOM 0 HG12 ILE A 6 1.465 -5.397 -5.247 1.00 0.00 H new ATOM 0 HG13 ILE A 6 1.767 -6.311 -3.783 1.00 0.00 H new ATOM 0 HG21 ILE A 6 0.458 -2.812 -3.997 1.00 0.00 H new ATOM 0 HG22 ILE A 6 2.043 -2.037 -3.770 1.00 0.00 H new ATOM 0 HG23 ILE A 6 1.693 -2.922 -5.273 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -0.668 -6.170 -4.241 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -0.268 -5.321 -2.729 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -0.575 -4.393 -4.217 1.00 0.00 H new ATOM 107 N LEU A 7 4.332 -2.006 -4.034 1.00 0.00 N ATOM 108 CA LEU A 7 5.019 -0.778 -3.543 1.00 0.00 C ATOM 109 C LEU A 7 4.216 0.455 -3.963 1.00 0.00 C ATOM 110 O LEU A 7 3.886 0.627 -5.120 1.00 0.00 O ATOM 111 CB LEU A 7 6.423 -0.702 -4.145 1.00 0.00 C ATOM 112 CG LEU A 7 7.185 0.465 -3.514 1.00 0.00 C ATOM 113 CD1 LEU A 7 8.416 -0.067 -2.778 1.00 0.00 C ATOM 114 CD2 LEU A 7 7.629 1.435 -4.611 1.00 0.00 C ATOM 0 H LEU A 7 3.925 -1.933 -4.967 1.00 0.00 H new ATOM 0 HA LEU A 7 5.093 -0.812 -2.456 1.00 0.00 H new ATOM 0 HB2 LEU A 7 6.957 -1.636 -3.970 1.00 0.00 H new ATOM 0 HB3 LEU A 7 6.361 -0.568 -5.225 1.00 0.00 H new ATOM 0 HG LEU A 7 6.536 0.984 -2.809 1.00 0.00 H new ATOM 0 HD11 LEU A 7 8.959 0.765 -2.329 1.00 0.00 H new ATOM 0 HD12 LEU A 7 8.102 -0.760 -1.997 1.00 0.00 H new ATOM 0 HD13 LEU A 7 9.066 -0.585 -3.483 1.00 0.00 H new ATOM 0 HD21 LEU A 7 8.172 2.267 -4.163 1.00 0.00 H new ATOM 0 HD22 LEU A 7 8.278 0.915 -5.315 1.00 0.00 H new ATOM 0 HD23 LEU A 7 6.753 1.815 -5.137 1.00 0.00 H new ATOM 126 N ILE A 8 3.898 1.314 -3.034 1.00 0.00 N ATOM 127 CA ILE A 8 3.115 2.533 -3.384 1.00 0.00 C ATOM 128 C ILE A 8 4.073 3.685 -3.691 1.00 0.00 C ATOM 129 O ILE A 8 4.874 4.078 -2.865 1.00 0.00 O ATOM 130 CB ILE A 8 2.215 2.916 -2.209 1.00 0.00 C ATOM 131 CG1 ILE A 8 1.528 1.661 -1.665 1.00 0.00 C ATOM 132 CG2 ILE A 8 1.155 3.913 -2.683 1.00 0.00 C ATOM 133 CD1 ILE A 8 0.520 2.055 -0.584 1.00 0.00 C ATOM 0 H ILE A 8 4.146 1.225 -2.049 1.00 0.00 H new ATOM 0 HA ILE A 8 2.500 2.330 -4.261 1.00 0.00 H new ATOM 0 HB ILE A 8 2.816 3.372 -1.422 1.00 0.00 H new ATOM 0 HG12 ILE A 8 1.022 1.132 -2.473 1.00 0.00 H new ATOM 0 HG13 ILE A 8 2.270 0.978 -1.252 1.00 0.00 H new ATOM 0 HG21 ILE A 8 0.513 4.187 -1.846 1.00 0.00 H new ATOM 0 HG22 ILE A 8 1.644 4.806 -3.072 1.00 0.00 H new ATOM 0 HG23 ILE A 8 0.552 3.457 -3.469 1.00 0.00 H new ATOM 0 HD11 ILE A 8 0.032 1.160 -0.198 1.00 0.00 H new ATOM 0 HD12 ILE A 8 1.038 2.565 0.228 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -0.229 2.721 -1.011 1.00 0.00 H new ATOM 145 N VAL A 9 4.000 4.231 -4.875 1.00 0.00 N ATOM 146 CA VAL A 9 4.906 5.358 -5.233 1.00 0.00 C ATOM 147 C VAL A 9 4.131 6.675 -5.169 1.00 0.00 C ATOM 148 O VAL A 9 3.365 7.002 -6.055 1.00 0.00 O ATOM 149 CB VAL A 9 5.441 5.152 -6.652 1.00 0.00 C ATOM 150 CG1 VAL A 9 6.705 5.991 -6.847 1.00 0.00 C ATOM 151 CG2 VAL A 9 5.775 3.673 -6.859 1.00 0.00 C ATOM 0 H VAL A 9 3.352 3.945 -5.609 1.00 0.00 H new ATOM 0 HA VAL A 9 5.739 5.391 -4.531 1.00 0.00 H new ATOM 0 HB VAL A 9 4.685 5.460 -7.374 1.00 0.00 H new ATOM 0 HG11 VAL A 9 7.087 5.845 -7.858 1.00 0.00 H new ATOM 0 HG12 VAL A 9 6.469 7.045 -6.697 1.00 0.00 H new ATOM 0 HG13 VAL A 9 7.461 5.682 -6.125 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.156 3.524 -7.869 1.00 0.00 H new ATOM 0 HG22 VAL A 9 6.532 3.366 -6.137 1.00 0.00 H new ATOM 0 HG23 VAL A 9 4.875 3.074 -6.719 1.00 0.00 H new ATOM 161 N ASP A 10 4.323 7.437 -4.127 1.00 0.00 N ATOM 162 CA ASP A 10 3.598 8.733 -4.007 1.00 0.00 C ATOM 163 C ASP A 10 4.301 9.616 -2.973 1.00 0.00 C ATOM 164 O ASP A 10 4.667 9.165 -1.905 1.00 0.00 O ATOM 165 CB ASP A 10 2.158 8.472 -3.560 1.00 0.00 C ATOM 166 CG ASP A 10 1.500 9.794 -3.158 1.00 0.00 C ATOM 167 OD1 ASP A 10 1.681 10.764 -3.874 1.00 0.00 O ATOM 168 OD2 ASP A 10 0.828 9.812 -2.140 1.00 0.00 O ATOM 0 H ASP A 10 4.951 7.218 -3.354 1.00 0.00 H new ATOM 0 HA ASP A 10 3.593 9.238 -4.973 1.00 0.00 H new ATOM 0 HB2 ASP A 10 1.595 8.004 -4.367 1.00 0.00 H new ATOM 0 HB3 ASP A 10 2.147 7.778 -2.720 1.00 0.00 H new ATOM 173 N ASP A 11 4.493 10.869 -3.281 1.00 0.00 N ATOM 174 CA ASP A 11 5.172 11.777 -2.314 1.00 0.00 C ATOM 175 C ASP A 11 4.122 12.596 -1.561 1.00 0.00 C ATOM 176 O ASP A 11 4.283 12.913 -0.400 1.00 0.00 O ATOM 177 CB ASP A 11 6.109 12.720 -3.072 1.00 0.00 C ATOM 178 CG ASP A 11 5.283 13.754 -3.839 1.00 0.00 C ATOM 179 OD1 ASP A 11 4.369 13.351 -4.541 1.00 0.00 O ATOM 180 OD2 ASP A 11 5.578 14.931 -3.712 1.00 0.00 O ATOM 0 H ASP A 11 4.209 11.303 -4.159 1.00 0.00 H new ATOM 0 HA ASP A 11 5.749 11.186 -1.603 1.00 0.00 H new ATOM 0 HB2 ASP A 11 6.780 13.221 -2.374 1.00 0.00 H new ATOM 0 HB3 ASP A 11 6.732 12.152 -3.763 1.00 0.00 H new ATOM 185 N GLN A 12 3.048 12.942 -2.216 1.00 0.00 N ATOM 186 CA GLN A 12 1.988 13.741 -1.540 1.00 0.00 C ATOM 187 C GLN A 12 1.230 12.851 -0.552 1.00 0.00 C ATOM 188 O GLN A 12 0.455 11.998 -0.938 1.00 0.00 O ATOM 189 CB GLN A 12 1.018 14.288 -2.588 1.00 0.00 C ATOM 190 CG GLN A 12 0.077 15.303 -1.933 1.00 0.00 C ATOM 191 CD GLN A 12 0.610 16.717 -2.166 1.00 0.00 C ATOM 192 OE1 GLN A 12 1.053 17.371 -1.243 1.00 0.00 O ATOM 193 NE2 GLN A 12 0.585 17.222 -3.369 1.00 0.00 N ATOM 0 H GLN A 12 2.859 12.706 -3.190 1.00 0.00 H new ATOM 0 HA GLN A 12 2.444 14.571 -1.001 1.00 0.00 H new ATOM 0 HB2 GLN A 12 1.571 14.760 -3.400 1.00 0.00 H new ATOM 0 HB3 GLN A 12 0.442 13.473 -3.027 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -0.925 15.207 -2.350 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -0.002 15.104 -0.864 1.00 0.00 H new ATOM 0 HE21 GLN A 12 0.213 16.674 -4.145 1.00 0.00 H new ATOM 0 HE22 GLN A 12 0.937 18.165 -3.534 1.00 0.00 H new ATOM 202 N TYR A 13 1.450 13.043 0.720 1.00 0.00 N ATOM 203 CA TYR A 13 0.745 12.209 1.737 1.00 0.00 C ATOM 204 C TYR A 13 -0.726 12.056 1.345 1.00 0.00 C ATOM 205 O TYR A 13 -1.293 12.898 0.677 1.00 0.00 O ATOM 206 CB TYR A 13 0.846 12.889 3.105 1.00 0.00 C ATOM 207 CG TYR A 13 -0.112 12.233 4.072 1.00 0.00 C ATOM 208 CD1 TYR A 13 -1.446 12.653 4.127 1.00 0.00 C ATOM 209 CD2 TYR A 13 0.335 11.207 4.913 1.00 0.00 C ATOM 210 CE1 TYR A 13 -2.334 12.047 5.023 1.00 0.00 C ATOM 211 CE2 TYR A 13 -0.554 10.602 5.810 1.00 0.00 C ATOM 212 CZ TYR A 13 -1.888 11.021 5.865 1.00 0.00 C ATOM 213 OH TYR A 13 -2.764 10.424 6.749 1.00 0.00 O ATOM 0 H TYR A 13 2.088 13.742 1.100 1.00 0.00 H new ATOM 0 HA TYR A 13 1.207 11.223 1.785 1.00 0.00 H new ATOM 0 HB2 TYR A 13 1.866 12.817 3.483 1.00 0.00 H new ATOM 0 HB3 TYR A 13 0.615 13.950 3.012 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -1.790 13.445 3.478 1.00 0.00 H new ATOM 0 HD2 TYR A 13 1.364 10.882 4.870 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -3.363 12.371 5.065 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -0.210 9.811 6.460 1.00 0.00 H new ATOM 0 HH TYR A 13 -3.671 10.448 6.378 1.00 0.00 H new ATOM 223 N GLY A 14 -1.351 10.986 1.760 1.00 0.00 N ATOM 224 CA GLY A 14 -2.786 10.779 1.415 1.00 0.00 C ATOM 225 C GLY A 14 -2.955 9.428 0.717 1.00 0.00 C ATOM 226 O GLY A 14 -3.451 8.480 1.292 1.00 0.00 O ATOM 0 H GLY A 14 -0.929 10.247 2.323 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -3.396 10.812 2.318 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -3.134 11.582 0.765 1.00 0.00 H new ATOM 230 N ILE A 15 -2.550 9.333 -0.519 1.00 0.00 N ATOM 231 CA ILE A 15 -2.689 8.043 -1.253 1.00 0.00 C ATOM 232 C ILE A 15 -1.838 6.972 -0.565 1.00 0.00 C ATOM 233 O ILE A 15 -2.016 5.791 -0.783 1.00 0.00 O ATOM 234 CB ILE A 15 -2.218 8.228 -2.698 1.00 0.00 C ATOM 235 CG1 ILE A 15 -3.276 9.010 -3.480 1.00 0.00 C ATOM 236 CG2 ILE A 15 -2.012 6.860 -3.354 1.00 0.00 C ATOM 237 CD1 ILE A 15 -2.587 9.960 -4.460 1.00 0.00 C ATOM 0 H ILE A 15 -2.129 10.093 -1.053 1.00 0.00 H new ATOM 0 HA ILE A 15 -3.733 7.730 -1.251 1.00 0.00 H new ATOM 0 HB ILE A 15 -1.276 8.777 -2.703 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -3.927 8.322 -4.020 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -3.908 9.574 -2.794 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -1.677 6.996 -4.382 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -1.260 6.300 -2.798 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -2.952 6.309 -3.349 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.340 10.517 -5.017 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -1.955 10.656 -3.909 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.974 9.385 -5.154 1.00 0.00 H new ATOM 249 N ARG A 16 -0.915 7.376 0.264 1.00 0.00 N ATOM 250 CA ARG A 16 -0.055 6.381 0.963 1.00 0.00 C ATOM 251 C ARG A 16 -0.843 5.749 2.113 1.00 0.00 C ATOM 252 O ARG A 16 -0.585 4.631 2.515 1.00 0.00 O ATOM 253 CB ARG A 16 1.186 7.081 1.521 1.00 0.00 C ATOM 254 CG ARG A 16 1.787 7.991 0.448 1.00 0.00 C ATOM 255 CD ARG A 16 2.887 7.239 -0.303 1.00 0.00 C ATOM 256 NE ARG A 16 4.049 7.021 0.605 1.00 0.00 N ATOM 257 CZ ARG A 16 4.784 8.030 0.986 1.00 0.00 C ATOM 258 NH1 ARG A 16 4.507 9.238 0.573 1.00 0.00 N ATOM 259 NH2 ARG A 16 5.799 7.832 1.782 1.00 0.00 N ATOM 0 H ARG A 16 -0.720 8.352 0.487 1.00 0.00 H new ATOM 0 HA ARG A 16 0.251 5.606 0.260 1.00 0.00 H new ATOM 0 HB2 ARG A 16 0.921 7.666 2.402 1.00 0.00 H new ATOM 0 HB3 ARG A 16 1.921 6.342 1.839 1.00 0.00 H new ATOM 0 HG2 ARG A 16 1.011 8.312 -0.248 1.00 0.00 H new ATOM 0 HG3 ARG A 16 2.196 8.891 0.907 1.00 0.00 H new ATOM 0 HD2 ARG A 16 2.508 6.282 -0.662 1.00 0.00 H new ATOM 0 HD3 ARG A 16 3.198 7.808 -1.179 1.00 0.00 H new ATOM 0 HE ARG A 16 4.270 6.080 0.930 1.00 0.00 H new ATOM 0 HH11 ARG A 16 3.714 9.395 -0.049 1.00 0.00 H new ATOM 0 HH12 ARG A 16 5.084 10.024 0.873 1.00 0.00 H new ATOM 0 HH21 ARG A 16 6.017 6.890 2.106 1.00 0.00 H new ATOM 0 HH22 ARG A 16 6.374 8.620 2.081 1.00 0.00 H new ATOM 273 N ILE A 17 -1.800 6.456 2.647 1.00 0.00 N ATOM 274 CA ILE A 17 -2.603 5.898 3.771 1.00 0.00 C ATOM 275 C ILE A 17 -3.817 5.153 3.214 1.00 0.00 C ATOM 276 O ILE A 17 -4.195 4.108 3.705 1.00 0.00 O ATOM 277 CB ILE A 17 -3.075 7.041 4.673 1.00 0.00 C ATOM 278 CG1 ILE A 17 -1.917 8.014 4.908 1.00 0.00 C ATOM 279 CG2 ILE A 17 -3.544 6.474 6.013 1.00 0.00 C ATOM 280 CD1 ILE A 17 -0.667 7.232 5.315 1.00 0.00 C ATOM 0 H ILE A 17 -2.061 7.397 2.353 1.00 0.00 H new ATOM 0 HA ILE A 17 -1.989 5.207 4.348 1.00 0.00 H new ATOM 0 HB ILE A 17 -3.901 7.566 4.193 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -1.721 8.588 4.002 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -2.181 8.729 5.687 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -3.880 7.288 6.655 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -4.368 5.780 5.846 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -2.719 5.949 6.495 1.00 0.00 H new ATOM 0 HD11 ILE A 17 0.157 7.925 5.482 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -0.867 6.678 6.232 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -0.399 6.535 4.521 1.00 0.00 H new ATOM 292 N LEU A 18 -4.434 5.684 2.194 1.00 0.00 N ATOM 293 CA LEU A 18 -5.625 5.005 1.608 1.00 0.00 C ATOM 294 C LEU A 18 -5.209 3.655 1.020 1.00 0.00 C ATOM 295 O LEU A 18 -5.716 2.619 1.401 1.00 0.00 O ATOM 296 CB LEU A 18 -6.218 5.882 0.503 1.00 0.00 C ATOM 297 CG LEU A 18 -7.567 6.439 0.962 1.00 0.00 C ATOM 298 CD1 LEU A 18 -7.357 7.346 2.176 1.00 0.00 C ATOM 299 CD2 LEU A 18 -8.197 7.247 -0.174 1.00 0.00 C ATOM 0 H LEU A 18 -4.165 6.558 1.741 1.00 0.00 H new ATOM 0 HA LEU A 18 -6.371 4.845 2.387 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -5.536 6.699 0.268 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -6.345 5.300 -0.410 1.00 0.00 H new ATOM 0 HG LEU A 18 -8.228 5.615 1.233 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -8.318 7.743 2.504 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -6.907 6.772 2.986 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.697 8.170 1.905 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -9.158 7.644 0.152 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -7.537 8.071 -0.444 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -8.346 6.602 -1.040 1.00 0.00 H new ATOM 311 N LEU A 19 -4.290 3.659 0.094 1.00 0.00 N ATOM 312 CA LEU A 19 -3.845 2.376 -0.519 1.00 0.00 C ATOM 313 C LEU A 19 -3.307 1.448 0.573 1.00 0.00 C ATOM 314 O LEU A 19 -3.238 0.247 0.401 1.00 0.00 O ATOM 315 CB LEU A 19 -2.740 2.654 -1.541 1.00 0.00 C ATOM 316 CG LEU A 19 -3.207 3.731 -2.521 1.00 0.00 C ATOM 317 CD1 LEU A 19 -2.138 3.941 -3.595 1.00 0.00 C ATOM 318 CD2 LEU A 19 -4.512 3.286 -3.183 1.00 0.00 C ATOM 0 H LEU A 19 -3.828 4.495 -0.264 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.690 1.900 -1.017 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -1.833 2.980 -1.032 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -2.491 1.740 -2.081 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.371 4.665 -1.983 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -2.470 4.709 -4.294 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.207 4.257 -3.125 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -1.974 3.007 -4.133 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.846 4.053 -3.882 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.347 2.352 -3.721 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -5.275 3.135 -2.419 1.00 0.00 H new ATOM 330 N ASN A 20 -2.924 1.994 1.694 1.00 0.00 N ATOM 331 CA ASN A 20 -2.390 1.141 2.794 1.00 0.00 C ATOM 332 C ASN A 20 -3.544 0.412 3.483 1.00 0.00 C ATOM 333 O ASN A 20 -3.697 -0.787 3.356 1.00 0.00 O ATOM 334 CB ASN A 20 -1.661 2.021 3.812 1.00 0.00 C ATOM 335 CG ASN A 20 -1.231 1.169 5.007 1.00 0.00 C ATOM 336 OD1 ASN A 20 -1.035 -0.024 4.879 1.00 0.00 O ATOM 337 ND2 ASN A 20 -1.075 1.734 6.173 1.00 0.00 N ATOM 0 H ASN A 20 -2.957 2.993 1.896 1.00 0.00 H new ATOM 0 HA ASN A 20 -1.695 0.409 2.381 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -0.789 2.485 3.350 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -2.313 2.829 4.144 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -0.789 1.175 6.977 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -1.239 2.735 6.281 1.00 0.00 H new ATOM 344 N GLU A 21 -4.356 1.124 4.215 1.00 0.00 N ATOM 345 CA GLU A 21 -5.499 0.470 4.915 1.00 0.00 C ATOM 346 C GLU A 21 -6.224 -0.467 3.949 1.00 0.00 C ATOM 347 O GLU A 21 -6.600 -1.568 4.301 1.00 0.00 O ATOM 348 CB GLU A 21 -6.471 1.542 5.413 1.00 0.00 C ATOM 349 CG GLU A 21 -7.251 1.006 6.615 1.00 0.00 C ATOM 350 CD GLU A 21 -8.086 2.132 7.226 1.00 0.00 C ATOM 351 OE1 GLU A 21 -9.019 2.571 6.574 1.00 0.00 O ATOM 352 OE2 GLU A 21 -7.779 2.535 8.335 1.00 0.00 O ATOM 0 H GLU A 21 -4.278 2.131 4.359 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.124 -0.104 5.762 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -5.924 2.442 5.693 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.159 1.823 4.616 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -7.899 0.186 6.305 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -6.563 0.605 7.359 1.00 0.00 H new ATOM 359 N VAL A 22 -6.430 -0.040 2.732 1.00 0.00 N ATOM 360 CA VAL A 22 -7.134 -0.907 1.747 1.00 0.00 C ATOM 361 C VAL A 22 -6.362 -2.216 1.571 1.00 0.00 C ATOM 362 O VAL A 22 -6.897 -3.293 1.751 1.00 0.00 O ATOM 363 CB VAL A 22 -7.221 -0.183 0.402 1.00 0.00 C ATOM 364 CG1 VAL A 22 -7.940 -1.074 -0.613 1.00 0.00 C ATOM 365 CG2 VAL A 22 -8.003 1.121 0.577 1.00 0.00 C ATOM 0 H VAL A 22 -6.141 0.872 2.379 1.00 0.00 H new ATOM 0 HA VAL A 22 -8.138 -1.125 2.110 1.00 0.00 H new ATOM 0 HB VAL A 22 -6.216 0.038 0.043 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -8.002 -0.558 -1.571 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -7.386 -2.004 -0.737 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -8.945 -1.296 -0.255 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -8.066 1.639 -0.380 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -9.008 0.897 0.936 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -7.493 1.757 1.300 1.00 0.00 H new ATOM 375 N PHE A 23 -5.108 -2.135 1.218 1.00 0.00 N ATOM 376 CA PHE A 23 -4.306 -3.376 1.031 1.00 0.00 C ATOM 377 C PHE A 23 -3.885 -3.929 2.395 1.00 0.00 C ATOM 378 O PHE A 23 -3.176 -4.910 2.485 1.00 0.00 O ATOM 379 CB PHE A 23 -3.059 -3.055 0.203 1.00 0.00 C ATOM 380 CG PHE A 23 -3.474 -2.580 -1.169 1.00 0.00 C ATOM 381 CD1 PHE A 23 -4.392 -3.325 -1.920 1.00 0.00 C ATOM 382 CD2 PHE A 23 -2.942 -1.394 -1.690 1.00 0.00 C ATOM 383 CE1 PHE A 23 -4.778 -2.884 -3.191 1.00 0.00 C ATOM 384 CE2 PHE A 23 -3.328 -0.954 -2.962 1.00 0.00 C ATOM 385 CZ PHE A 23 -4.246 -1.698 -3.712 1.00 0.00 C ATOM 0 H PHE A 23 -4.605 -1.263 1.051 1.00 0.00 H new ATOM 0 HA PHE A 23 -4.908 -4.121 0.511 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -2.466 -2.288 0.701 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -2.428 -3.940 0.118 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -4.802 -4.240 -1.518 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -2.234 -0.819 -1.111 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -5.486 -3.458 -3.770 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -2.917 -0.040 -3.365 1.00 0.00 H new ATOM 0 HZ PHE A 23 -4.544 -1.357 -4.693 1.00 0.00 H new ATOM 395 N ASN A 24 -4.318 -3.307 3.458 1.00 0.00 N ATOM 396 CA ASN A 24 -3.943 -3.801 4.813 1.00 0.00 C ATOM 397 C ASN A 24 -4.985 -4.811 5.294 1.00 0.00 C ATOM 398 O ASN A 24 -4.656 -5.873 5.785 1.00 0.00 O ATOM 399 CB ASN A 24 -3.886 -2.623 5.787 1.00 0.00 C ATOM 400 CG ASN A 24 -2.426 -2.257 6.062 1.00 0.00 C ATOM 401 OD1 ASN A 24 -1.542 -2.393 5.112 1.00 0.00 O flip ATOM 402 ND2 ASN A 24 -2.085 -1.842 7.152 1.00 0.00 N flip ATOM 0 H ASN A 24 -4.914 -2.479 3.447 1.00 0.00 H new ATOM 0 HA ASN A 24 -2.966 -4.282 4.767 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -4.414 -1.766 5.369 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -4.388 -2.883 6.719 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -2.775 -1.735 7.896 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -1.109 -1.601 7.323 1.00 0.00 H new ATOM 409 N LYS A 25 -6.242 -4.490 5.157 1.00 0.00 N ATOM 410 CA LYS A 25 -7.306 -5.433 5.606 1.00 0.00 C ATOM 411 C LYS A 25 -7.561 -6.472 4.512 1.00 0.00 C ATOM 412 O LYS A 25 -8.105 -7.530 4.762 1.00 0.00 O ATOM 413 CB LYS A 25 -8.594 -4.655 5.882 1.00 0.00 C ATOM 414 CG LYS A 25 -9.524 -5.500 6.755 1.00 0.00 C ATOM 415 CD LYS A 25 -10.547 -6.214 5.869 1.00 0.00 C ATOM 416 CE LYS A 25 -11.949 -6.020 6.448 1.00 0.00 C ATOM 417 NZ LYS A 25 -12.883 -5.610 5.361 1.00 0.00 N ATOM 0 H LYS A 25 -6.579 -3.616 4.754 1.00 0.00 H new ATOM 0 HA LYS A 25 -6.984 -5.937 6.517 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.363 -3.715 6.382 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.088 -4.404 4.943 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -8.945 -6.230 7.321 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.035 -4.866 7.480 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -10.503 -5.819 4.854 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.312 -7.276 5.807 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -12.295 -6.945 6.909 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.929 -5.261 7.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.837 -5.478 5.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -12.555 -4.717 4.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.910 -6.348 4.629 1.00 0.00 H new ATOM 431 N GLU A 26 -7.173 -6.179 3.302 1.00 0.00 N ATOM 432 CA GLU A 26 -7.394 -7.150 2.193 1.00 0.00 C ATOM 433 C GLU A 26 -6.336 -8.253 2.263 1.00 0.00 C ATOM 434 O GLU A 26 -6.580 -9.384 1.893 1.00 0.00 O ATOM 435 CB GLU A 26 -7.287 -6.424 0.851 1.00 0.00 C ATOM 436 CG GLU A 26 -8.477 -6.803 -0.032 1.00 0.00 C ATOM 437 CD GLU A 26 -9.089 -5.537 -0.635 1.00 0.00 C ATOM 438 OE1 GLU A 26 -8.640 -5.131 -1.694 1.00 0.00 O ATOM 439 OE2 GLU A 26 -9.998 -4.994 -0.027 1.00 0.00 O ATOM 0 H GLU A 26 -6.713 -5.310 3.033 1.00 0.00 H new ATOM 0 HA GLU A 26 -8.386 -7.592 2.288 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -7.267 -5.346 1.010 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -6.354 -6.690 0.355 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -8.154 -7.477 -0.825 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -9.224 -7.337 0.556 1.00 0.00 H new ATOM 446 N GLY A 27 -5.163 -7.933 2.736 1.00 0.00 N ATOM 447 CA GLY A 27 -4.090 -8.963 2.828 1.00 0.00 C ATOM 448 C GLY A 27 -3.096 -8.770 1.683 1.00 0.00 C ATOM 449 O GLY A 27 -3.119 -9.485 0.700 1.00 0.00 O ATOM 0 H GLY A 27 -4.901 -7.003 3.063 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -3.577 -8.884 3.786 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -4.525 -9.961 2.781 1.00 0.00 H new ATOM 453 N TYR A 28 -2.220 -7.810 1.799 1.00 0.00 N ATOM 454 CA TYR A 28 -1.225 -7.572 0.716 1.00 0.00 C ATOM 455 C TYR A 28 0.005 -6.873 1.297 1.00 0.00 C ATOM 456 O TYR A 28 -0.098 -6.036 2.171 1.00 0.00 O ATOM 457 CB TYR A 28 -1.850 -6.686 -0.364 1.00 0.00 C ATOM 458 CG TYR A 28 -2.931 -7.455 -1.085 1.00 0.00 C ATOM 459 CD1 TYR A 28 -4.243 -7.441 -0.598 1.00 0.00 C ATOM 460 CD2 TYR A 28 -2.619 -8.183 -2.239 1.00 0.00 C ATOM 461 CE1 TYR A 28 -5.244 -8.155 -1.267 1.00 0.00 C ATOM 462 CE2 TYR A 28 -3.621 -8.896 -2.908 1.00 0.00 C ATOM 463 CZ TYR A 28 -4.934 -8.882 -2.422 1.00 0.00 C ATOM 464 OH TYR A 28 -5.922 -9.584 -3.082 1.00 0.00 O ATOM 0 H TYR A 28 -2.150 -7.180 2.598 1.00 0.00 H new ATOM 0 HA TYR A 28 -0.929 -8.526 0.279 1.00 0.00 H new ATOM 0 HB2 TYR A 28 -2.268 -5.786 0.087 1.00 0.00 H new ATOM 0 HB3 TYR A 28 -1.086 -6.363 -1.071 1.00 0.00 H new ATOM 0 HD1 TYR A 28 -4.483 -6.880 0.293 1.00 0.00 H new ATOM 0 HD2 TYR A 28 -1.606 -8.195 -2.613 1.00 0.00 H new ATOM 0 HE1 TYR A 28 -6.257 -8.145 -0.891 1.00 0.00 H new ATOM 0 HE2 TYR A 28 -3.381 -9.457 -3.799 1.00 0.00 H new ATOM 0 HH TYR A 28 -5.538 -10.032 -3.864 1.00 0.00 H new ATOM 474 N GLN A 29 1.172 -7.209 0.817 1.00 0.00 N ATOM 475 CA GLN A 29 2.407 -6.562 1.340 1.00 0.00 C ATOM 476 C GLN A 29 2.713 -5.311 0.515 1.00 0.00 C ATOM 477 O GLN A 29 3.534 -5.331 -0.380 1.00 0.00 O ATOM 478 CB GLN A 29 3.579 -7.541 1.236 1.00 0.00 C ATOM 479 CG GLN A 29 3.180 -8.882 1.855 1.00 0.00 C ATOM 480 CD GLN A 29 3.757 -8.985 3.267 1.00 0.00 C ATOM 481 OE1 GLN A 29 3.111 -8.618 4.229 1.00 0.00 O ATOM 482 NE2 GLN A 29 4.957 -9.473 3.435 1.00 0.00 N ATOM 0 H GLN A 29 1.322 -7.904 0.085 1.00 0.00 H new ATOM 0 HA GLN A 29 2.259 -6.283 2.383 1.00 0.00 H new ATOM 0 HB2 GLN A 29 3.859 -7.679 0.192 1.00 0.00 H new ATOM 0 HB3 GLN A 29 4.451 -7.137 1.749 1.00 0.00 H new ATOM 0 HG2 GLN A 29 2.094 -8.971 1.887 1.00 0.00 H new ATOM 0 HG3 GLN A 29 3.549 -9.703 1.239 1.00 0.00 H new ATOM 0 HE21 GLN A 29 5.500 -9.781 2.628 1.00 0.00 H new ATOM 0 HE22 GLN A 29 5.351 -9.546 4.373 1.00 0.00 H new ATOM 491 N THR A 30 2.057 -4.221 0.808 1.00 0.00 N ATOM 492 CA THR A 30 2.310 -2.971 0.038 1.00 0.00 C ATOM 493 C THR A 30 3.430 -2.174 0.710 1.00 0.00 C ATOM 494 O THR A 30 3.579 -2.191 1.916 1.00 0.00 O ATOM 495 CB THR A 30 1.033 -2.128 0.002 1.00 0.00 C ATOM 496 OG1 THR A 30 0.898 -1.424 1.230 1.00 0.00 O ATOM 497 CG2 THR A 30 -0.178 -3.041 -0.200 1.00 0.00 C ATOM 0 H THR A 30 1.358 -4.143 1.546 1.00 0.00 H new ATOM 0 HA THR A 30 2.607 -3.225 -0.980 1.00 0.00 H new ATOM 0 HB THR A 30 1.090 -1.416 -0.822 1.00 0.00 H new ATOM 0 HG1 THR A 30 0.082 -0.882 1.208 1.00 0.00 H new ATOM 0 HG21 THR A 30 -1.087 -2.440 -0.225 1.00 0.00 H new ATOM 0 HG22 THR A 30 -0.074 -3.581 -1.141 1.00 0.00 H new ATOM 0 HG23 THR A 30 -0.238 -3.754 0.623 1.00 0.00 H new ATOM 505 N PHE A 31 4.217 -1.474 -0.060 1.00 0.00 N ATOM 506 CA PHE A 31 5.326 -0.677 0.535 1.00 0.00 C ATOM 507 C PHE A 31 5.020 0.815 0.385 1.00 0.00 C ATOM 508 O PHE A 31 3.909 1.201 0.080 1.00 0.00 O ATOM 509 CB PHE A 31 6.635 -1.004 -0.188 1.00 0.00 C ATOM 510 CG PHE A 31 6.812 -2.502 -0.260 1.00 0.00 C ATOM 511 CD1 PHE A 31 6.527 -3.293 0.859 1.00 0.00 C ATOM 512 CD2 PHE A 31 7.259 -3.097 -1.445 1.00 0.00 C ATOM 513 CE1 PHE A 31 6.691 -4.682 0.792 1.00 0.00 C ATOM 514 CE2 PHE A 31 7.423 -4.486 -1.511 1.00 0.00 C ATOM 515 CZ PHE A 31 7.139 -5.278 -0.393 1.00 0.00 C ATOM 0 H PHE A 31 4.140 -1.420 -1.076 1.00 0.00 H new ATOM 0 HA PHE A 31 5.423 -0.924 1.592 1.00 0.00 H new ATOM 0 HB2 PHE A 31 6.624 -0.580 -1.192 1.00 0.00 H new ATOM 0 HB3 PHE A 31 7.476 -0.553 0.339 1.00 0.00 H new ATOM 0 HD1 PHE A 31 6.181 -2.833 1.773 1.00 0.00 H new ATOM 0 HD2 PHE A 31 7.477 -2.485 -2.308 1.00 0.00 H new ATOM 0 HE1 PHE A 31 6.472 -5.294 1.655 1.00 0.00 H new ATOM 0 HE2 PHE A 31 7.769 -4.946 -2.425 1.00 0.00 H new ATOM 0 HZ PHE A 31 7.265 -6.349 -0.444 1.00 0.00 H new ATOM 525 N GLN A 32 5.996 1.655 0.597 1.00 0.00 N ATOM 526 CA GLN A 32 5.757 3.119 0.467 1.00 0.00 C ATOM 527 C GLN A 32 6.998 3.788 -0.130 1.00 0.00 C ATOM 528 O GLN A 32 8.117 3.453 0.204 1.00 0.00 O ATOM 529 CB GLN A 32 5.471 3.713 1.847 1.00 0.00 C ATOM 530 CG GLN A 32 4.264 3.007 2.467 1.00 0.00 C ATOM 531 CD GLN A 32 3.636 3.906 3.532 1.00 0.00 C ATOM 532 OE1 GLN A 32 4.307 4.345 4.445 1.00 0.00 O ATOM 533 NE2 GLN A 32 2.366 4.200 3.456 1.00 0.00 N ATOM 0 H GLN A 32 6.947 1.391 0.854 1.00 0.00 H new ATOM 0 HA GLN A 32 4.902 3.291 -0.187 1.00 0.00 H new ATOM 0 HB2 GLN A 32 6.343 3.599 2.491 1.00 0.00 H new ATOM 0 HB3 GLN A 32 5.276 4.782 1.761 1.00 0.00 H new ATOM 0 HG2 GLN A 32 3.531 2.773 1.695 1.00 0.00 H new ATOM 0 HG3 GLN A 32 4.572 2.060 2.911 1.00 0.00 H new ATOM 0 HE21 GLN A 32 1.802 3.832 2.690 1.00 0.00 H new ATOM 0 HE22 GLN A 32 1.938 4.798 4.163 1.00 0.00 H new ATOM 542 N ALA A 33 6.808 4.734 -1.010 1.00 0.00 N ATOM 543 CA ALA A 33 7.975 5.424 -1.626 1.00 0.00 C ATOM 544 C ALA A 33 7.562 6.832 -2.060 1.00 0.00 C ATOM 545 O ALA A 33 6.452 7.264 -1.823 1.00 0.00 O ATOM 546 CB ALA A 33 8.448 4.633 -2.847 1.00 0.00 C ATOM 0 H ALA A 33 5.895 5.058 -1.328 1.00 0.00 H new ATOM 0 HA ALA A 33 8.785 5.490 -0.899 1.00 0.00 H new ATOM 0 HB1 ALA A 33 9.302 5.137 -3.299 1.00 0.00 H new ATOM 0 HB2 ALA A 33 8.740 3.629 -2.539 1.00 0.00 H new ATOM 0 HB3 ALA A 33 7.639 4.568 -3.574 1.00 0.00 H new ATOM 552 N ALA A 34 8.447 7.552 -2.694 1.00 0.00 N ATOM 553 CA ALA A 34 8.102 8.931 -3.141 1.00 0.00 C ATOM 554 C ALA A 34 8.795 9.225 -4.474 1.00 0.00 C ATOM 555 O ALA A 34 8.154 9.465 -5.477 1.00 0.00 O ATOM 556 CB ALA A 34 8.571 9.940 -2.090 1.00 0.00 C ATOM 0 H ALA A 34 9.393 7.245 -2.921 1.00 0.00 H new ATOM 0 HA ALA A 34 7.022 9.012 -3.267 1.00 0.00 H new ATOM 0 HB1 ALA A 34 8.319 10.949 -2.416 1.00 0.00 H new ATOM 0 HB2 ALA A 34 8.078 9.732 -1.140 1.00 0.00 H new ATOM 0 HB3 ALA A 34 9.651 9.859 -1.964 1.00 0.00 H new ATOM 562 N ASN A 35 10.100 9.208 -4.493 1.00 0.00 N ATOM 563 CA ASN A 35 10.827 9.486 -5.764 1.00 0.00 C ATOM 564 C ASN A 35 11.057 8.174 -6.516 1.00 0.00 C ATOM 565 O ASN A 35 11.283 7.137 -5.924 1.00 0.00 O ATOM 566 CB ASN A 35 12.175 10.148 -5.459 1.00 0.00 C ATOM 567 CG ASN A 35 12.810 9.493 -4.230 1.00 0.00 C ATOM 568 OD1 ASN A 35 13.747 8.600 -4.394 1.00 0.00 O flip ATOM 569 ND2 ASN A 35 12.454 9.800 -3.109 1.00 0.00 N flip ATOM 0 H ASN A 35 10.693 9.014 -3.686 1.00 0.00 H new ATOM 0 HA ASN A 35 10.231 10.159 -6.380 1.00 0.00 H new ATOM 0 HB2 ASN A 35 12.840 10.052 -6.317 1.00 0.00 H new ATOM 0 HB3 ASN A 35 12.035 11.214 -5.282 1.00 0.00 H new ATOM 0 HD21 ASN A 35 11.722 10.498 -2.980 1.00 0.00 H new ATOM 0 HD22 ASN A 35 12.888 9.360 -2.298 1.00 0.00 H new ATOM 576 N GLY A 36 10.998 8.210 -7.819 1.00 0.00 N ATOM 577 CA GLY A 36 11.209 6.966 -8.611 1.00 0.00 C ATOM 578 C GLY A 36 12.462 6.243 -8.114 1.00 0.00 C ATOM 579 O GLY A 36 12.507 5.031 -8.054 1.00 0.00 O ATOM 0 H GLY A 36 10.813 9.048 -8.370 1.00 0.00 H new ATOM 0 HA2 GLY A 36 10.341 6.314 -8.519 1.00 0.00 H new ATOM 0 HA3 GLY A 36 11.314 7.210 -9.668 1.00 0.00 H new ATOM 583 N LEU A 37 13.481 6.976 -7.757 1.00 0.00 N ATOM 584 CA LEU A 37 14.730 6.327 -7.266 1.00 0.00 C ATOM 585 C LEU A 37 14.388 5.338 -6.149 1.00 0.00 C ATOM 586 O LEU A 37 14.857 4.217 -6.135 1.00 0.00 O ATOM 587 CB LEU A 37 15.681 7.397 -6.725 1.00 0.00 C ATOM 588 CG LEU A 37 17.051 7.244 -7.388 1.00 0.00 C ATOM 589 CD1 LEU A 37 17.551 5.810 -7.201 1.00 0.00 C ATOM 590 CD2 LEU A 37 16.930 7.550 -8.882 1.00 0.00 C ATOM 0 H LEU A 37 13.503 7.995 -7.784 1.00 0.00 H new ATOM 0 HA LEU A 37 15.209 5.795 -8.088 1.00 0.00 H new ATOM 0 HB2 LEU A 37 15.278 8.390 -6.923 1.00 0.00 H new ATOM 0 HB3 LEU A 37 15.776 7.301 -5.643 1.00 0.00 H new ATOM 0 HG LEU A 37 17.756 7.937 -6.930 1.00 0.00 H new ATOM 0 HD11 LEU A 37 18.527 5.701 -7.673 1.00 0.00 H new ATOM 0 HD12 LEU A 37 17.636 5.590 -6.137 1.00 0.00 H new ATOM 0 HD13 LEU A 37 16.846 5.116 -7.660 1.00 0.00 H new ATOM 0 HD21 LEU A 37 17.906 7.441 -9.356 1.00 0.00 H new ATOM 0 HD22 LEU A 37 16.225 6.856 -9.340 1.00 0.00 H new ATOM 0 HD23 LEU A 37 16.573 8.571 -9.017 1.00 0.00 H new ATOM 602 N GLN A 38 13.576 5.743 -5.213 1.00 0.00 N ATOM 603 CA GLN A 38 13.206 4.826 -4.098 1.00 0.00 C ATOM 604 C GLN A 38 12.416 3.640 -4.652 1.00 0.00 C ATOM 605 O GLN A 38 12.486 2.541 -4.139 1.00 0.00 O ATOM 606 CB GLN A 38 12.346 5.581 -3.082 1.00 0.00 C ATOM 607 CG GLN A 38 12.127 4.704 -1.847 1.00 0.00 C ATOM 608 CD GLN A 38 13.481 4.287 -1.272 1.00 0.00 C ATOM 609 OE1 GLN A 38 14.536 5.011 -1.526 1.00 0.00 O flip ATOM 610 NE2 GLN A 38 13.581 3.290 -0.584 1.00 0.00 N flip ATOM 0 H GLN A 38 13.152 6.670 -5.171 1.00 0.00 H new ATOM 0 HA GLN A 38 14.111 4.463 -3.611 1.00 0.00 H new ATOM 0 HB2 GLN A 38 12.834 6.513 -2.797 1.00 0.00 H new ATOM 0 HB3 GLN A 38 11.387 5.847 -3.527 1.00 0.00 H new ATOM 0 HG2 GLN A 38 11.554 5.250 -1.097 1.00 0.00 H new ATOM 0 HG3 GLN A 38 11.545 3.821 -2.113 1.00 0.00 H new ATOM 0 HE21 GLN A 38 12.757 2.723 -0.385 1.00 0.00 H new ATOM 0 HE22 GLN A 38 14.489 3.020 -0.206 1.00 0.00 H new ATOM 619 N ALA A 39 11.664 3.852 -5.696 1.00 0.00 N ATOM 620 CA ALA A 39 10.870 2.735 -6.282 1.00 0.00 C ATOM 621 C ALA A 39 11.818 1.689 -6.874 1.00 0.00 C ATOM 622 O ALA A 39 11.573 0.503 -6.797 1.00 0.00 O ATOM 623 CB ALA A 39 9.959 3.280 -7.383 1.00 0.00 C ATOM 0 H ALA A 39 11.565 4.750 -6.169 1.00 0.00 H new ATOM 0 HA ALA A 39 10.263 2.274 -5.503 1.00 0.00 H new ATOM 0 HB1 ALA A 39 9.378 2.464 -7.812 1.00 0.00 H new ATOM 0 HB2 ALA A 39 9.283 4.024 -6.961 1.00 0.00 H new ATOM 0 HB3 ALA A 39 10.566 3.742 -8.162 1.00 0.00 H new ATOM 629 N LEU A 40 12.898 2.121 -7.466 1.00 0.00 N ATOM 630 CA LEU A 40 13.858 1.151 -8.064 1.00 0.00 C ATOM 631 C LEU A 40 14.637 0.448 -6.950 1.00 0.00 C ATOM 632 O LEU A 40 14.907 -0.734 -7.020 1.00 0.00 O ATOM 633 CB LEU A 40 14.834 1.896 -8.977 1.00 0.00 C ATOM 634 CG LEU A 40 14.095 2.386 -10.222 1.00 0.00 C ATOM 635 CD1 LEU A 40 14.789 3.634 -10.771 1.00 0.00 C ATOM 636 CD2 LEU A 40 14.109 1.286 -11.287 1.00 0.00 C ATOM 0 H LEU A 40 13.157 3.103 -7.561 1.00 0.00 H new ATOM 0 HA LEU A 40 13.309 0.410 -8.645 1.00 0.00 H new ATOM 0 HB2 LEU A 40 15.273 2.741 -8.446 1.00 0.00 H new ATOM 0 HB3 LEU A 40 15.655 1.238 -9.264 1.00 0.00 H new ATOM 0 HG LEU A 40 13.065 2.629 -9.961 1.00 0.00 H new ATOM 0 HD11 LEU A 40 14.261 3.983 -11.659 1.00 0.00 H new ATOM 0 HD12 LEU A 40 14.782 4.417 -10.013 1.00 0.00 H new ATOM 0 HD13 LEU A 40 15.819 3.392 -11.033 1.00 0.00 H new ATOM 0 HD21 LEU A 40 13.582 1.633 -12.176 1.00 0.00 H new ATOM 0 HD22 LEU A 40 15.140 1.044 -11.547 1.00 0.00 H new ATOM 0 HD23 LEU A 40 13.615 0.396 -10.897 1.00 0.00 H new ATOM 648 N ASP A 41 15.000 1.166 -5.922 1.00 0.00 N ATOM 649 CA ASP A 41 15.760 0.537 -4.807 1.00 0.00 C ATOM 650 C ASP A 41 14.914 -0.569 -4.173 1.00 0.00 C ATOM 651 O ASP A 41 15.336 -1.703 -4.067 1.00 0.00 O ATOM 652 CB ASP A 41 16.088 1.596 -3.752 1.00 0.00 C ATOM 653 CG ASP A 41 17.561 1.993 -3.869 1.00 0.00 C ATOM 654 OD1 ASP A 41 18.362 1.134 -4.198 1.00 0.00 O ATOM 655 OD2 ASP A 41 17.863 3.150 -3.625 1.00 0.00 O ATOM 0 H ASP A 41 14.803 2.160 -5.807 1.00 0.00 H new ATOM 0 HA ASP A 41 16.685 0.110 -5.194 1.00 0.00 H new ATOM 0 HB2 ASP A 41 15.452 2.471 -3.890 1.00 0.00 H new ATOM 0 HB3 ASP A 41 15.883 1.207 -2.755 1.00 0.00 H new ATOM 660 N ILE A 42 13.721 -0.248 -3.752 1.00 0.00 N ATOM 661 CA ILE A 42 12.849 -1.282 -3.127 1.00 0.00 C ATOM 662 C ILE A 42 12.537 -2.373 -4.152 1.00 0.00 C ATOM 663 O ILE A 42 12.367 -3.526 -3.814 1.00 0.00 O ATOM 664 CB ILE A 42 11.545 -0.633 -2.659 1.00 0.00 C ATOM 665 CG1 ILE A 42 11.852 0.402 -1.574 1.00 0.00 C ATOM 666 CG2 ILE A 42 10.618 -1.708 -2.088 1.00 0.00 C ATOM 667 CD1 ILE A 42 10.788 1.501 -1.601 1.00 0.00 C ATOM 0 H ILE A 42 13.313 0.685 -3.814 1.00 0.00 H new ATOM 0 HA ILE A 42 13.362 -1.723 -2.273 1.00 0.00 H new ATOM 0 HB ILE A 42 11.059 -0.143 -3.503 1.00 0.00 H new ATOM 0 HG12 ILE A 42 11.871 -0.077 -0.595 1.00 0.00 H new ATOM 0 HG13 ILE A 42 12.840 0.833 -1.737 1.00 0.00 H new ATOM 0 HG21 ILE A 42 9.688 -1.247 -1.754 1.00 0.00 H new ATOM 0 HG22 ILE A 42 10.400 -2.447 -2.859 1.00 0.00 H new ATOM 0 HG23 ILE A 42 11.104 -2.197 -1.244 1.00 0.00 H new ATOM 0 HD11 ILE A 42 11.007 2.238 -0.828 1.00 0.00 H new ATOM 0 HD12 ILE A 42 10.791 1.986 -2.577 1.00 0.00 H new ATOM 0 HD13 ILE A 42 9.807 1.062 -1.417 1.00 0.00 H new ATOM 679 N VAL A 43 12.460 -2.017 -5.406 1.00 0.00 N ATOM 680 CA VAL A 43 12.159 -3.037 -6.450 1.00 0.00 C ATOM 681 C VAL A 43 13.358 -3.977 -6.602 1.00 0.00 C ATOM 682 O VAL A 43 13.216 -5.125 -6.972 1.00 0.00 O ATOM 683 CB VAL A 43 11.884 -2.337 -7.784 1.00 0.00 C ATOM 684 CG1 VAL A 43 11.887 -3.368 -8.914 1.00 0.00 C ATOM 685 CG2 VAL A 43 10.517 -1.652 -7.724 1.00 0.00 C ATOM 0 H VAL A 43 12.592 -1.066 -5.751 1.00 0.00 H new ATOM 0 HA VAL A 43 11.281 -3.612 -6.156 1.00 0.00 H new ATOM 0 HB VAL A 43 12.659 -1.593 -7.971 1.00 0.00 H new ATOM 0 HG11 VAL A 43 11.691 -2.868 -9.863 1.00 0.00 H new ATOM 0 HG12 VAL A 43 12.859 -3.859 -8.956 1.00 0.00 H new ATOM 0 HG13 VAL A 43 11.113 -4.112 -8.729 1.00 0.00 H new ATOM 0 HG21 VAL A 43 10.318 -1.153 -8.672 1.00 0.00 H new ATOM 0 HG22 VAL A 43 9.744 -2.398 -7.538 1.00 0.00 H new ATOM 0 HG23 VAL A 43 10.513 -0.917 -6.919 1.00 0.00 H new ATOM 695 N THR A 44 14.538 -3.497 -6.321 1.00 0.00 N ATOM 696 CA THR A 44 15.745 -4.362 -6.450 1.00 0.00 C ATOM 697 C THR A 44 16.007 -5.075 -5.122 1.00 0.00 C ATOM 698 O THR A 44 16.754 -6.031 -5.057 1.00 0.00 O ATOM 699 CB THR A 44 16.954 -3.496 -6.811 1.00 0.00 C ATOM 700 OG1 THR A 44 16.560 -2.505 -7.751 1.00 0.00 O ATOM 701 CG2 THR A 44 18.047 -4.373 -7.420 1.00 0.00 C ATOM 0 H THR A 44 14.719 -2.543 -6.008 1.00 0.00 H new ATOM 0 HA THR A 44 15.580 -5.103 -7.233 1.00 0.00 H new ATOM 0 HB THR A 44 17.338 -3.013 -5.912 1.00 0.00 H new ATOM 0 HG1 THR A 44 16.177 -1.738 -7.276 1.00 0.00 H new ATOM 0 HG21 THR A 44 18.908 -3.756 -7.677 1.00 0.00 H new ATOM 0 HG22 THR A 44 18.348 -5.133 -6.699 1.00 0.00 H new ATOM 0 HG23 THR A 44 17.666 -4.857 -8.319 1.00 0.00 H new ATOM 709 N LYS A 45 15.402 -4.615 -4.060 1.00 0.00 N ATOM 710 CA LYS A 45 15.622 -5.266 -2.737 1.00 0.00 C ATOM 711 C LYS A 45 14.610 -6.396 -2.543 1.00 0.00 C ATOM 712 O LYS A 45 14.972 -7.545 -2.380 1.00 0.00 O ATOM 713 CB LYS A 45 15.448 -4.229 -1.625 1.00 0.00 C ATOM 714 CG LYS A 45 16.822 -3.746 -1.156 1.00 0.00 C ATOM 715 CD LYS A 45 16.659 -2.874 0.090 1.00 0.00 C ATOM 716 CE LYS A 45 17.427 -3.499 1.255 1.00 0.00 C ATOM 717 NZ LYS A 45 18.630 -2.674 1.558 1.00 0.00 N ATOM 0 H LYS A 45 14.766 -3.818 -4.052 1.00 0.00 H new ATOM 0 HA LYS A 45 16.631 -5.676 -2.700 1.00 0.00 H new ATOM 0 HB2 LYS A 45 14.859 -3.387 -1.988 1.00 0.00 H new ATOM 0 HB3 LYS A 45 14.900 -4.665 -0.790 1.00 0.00 H new ATOM 0 HG2 LYS A 45 17.463 -4.599 -0.934 1.00 0.00 H new ATOM 0 HG3 LYS A 45 17.310 -3.179 -1.949 1.00 0.00 H new ATOM 0 HD2 LYS A 45 17.030 -1.868 -0.106 1.00 0.00 H new ATOM 0 HD3 LYS A 45 15.604 -2.780 0.345 1.00 0.00 H new ATOM 0 HE2 LYS A 45 16.786 -3.563 2.134 1.00 0.00 H new ATOM 0 HE3 LYS A 45 17.725 -4.517 1.003 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 19.152 -3.099 2.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 19.244 -2.635 0.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 18.334 -1.711 1.816 1.00 0.00 H new ATOM 731 N GLU A 46 13.343 -6.082 -2.552 1.00 0.00 N ATOM 732 CA GLU A 46 12.311 -7.140 -2.363 1.00 0.00 C ATOM 733 C GLU A 46 11.916 -7.722 -3.722 1.00 0.00 C ATOM 734 O GLU A 46 11.562 -8.878 -3.834 1.00 0.00 O ATOM 735 CB GLU A 46 11.077 -6.534 -1.691 1.00 0.00 C ATOM 736 CG GLU A 46 11.515 -5.659 -0.515 1.00 0.00 C ATOM 737 CD GLU A 46 11.137 -6.345 0.800 1.00 0.00 C ATOM 738 OE1 GLU A 46 11.593 -7.455 1.019 1.00 0.00 O ATOM 739 OE2 GLU A 46 10.399 -5.748 1.566 1.00 0.00 O ATOM 0 H GLU A 46 12.978 -5.138 -2.682 1.00 0.00 H new ATOM 0 HA GLU A 46 12.717 -7.932 -1.734 1.00 0.00 H new ATOM 0 HB2 GLU A 46 10.513 -5.940 -2.410 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.414 -7.326 -1.342 1.00 0.00 H new ATOM 0 HG2 GLU A 46 12.591 -5.491 -0.554 1.00 0.00 H new ATOM 0 HG3 GLU A 46 11.038 -4.681 -0.578 1.00 0.00 H new ATOM 746 N ARG A 47 11.975 -6.929 -4.758 1.00 0.00 N ATOM 747 CA ARG A 47 11.602 -7.439 -6.107 1.00 0.00 C ATOM 748 C ARG A 47 10.109 -7.780 -6.132 1.00 0.00 C ATOM 749 O ARG A 47 9.740 -8.933 -6.225 1.00 0.00 O ATOM 750 CB ARG A 47 12.417 -8.697 -6.419 1.00 0.00 C ATOM 751 CG ARG A 47 13.560 -8.342 -7.372 1.00 0.00 C ATOM 752 CD ARG A 47 14.326 -9.613 -7.747 1.00 0.00 C ATOM 753 NE ARG A 47 14.814 -10.283 -6.508 1.00 0.00 N ATOM 754 CZ ARG A 47 15.733 -11.208 -6.581 1.00 0.00 C ATOM 755 NH1 ARG A 47 16.230 -11.551 -7.740 1.00 0.00 N ATOM 756 NH2 ARG A 47 16.157 -11.792 -5.494 1.00 0.00 N ATOM 0 H ARG A 47 12.265 -5.952 -4.728 1.00 0.00 H new ATOM 0 HA ARG A 47 11.811 -6.674 -6.854 1.00 0.00 H new ATOM 0 HB2 ARG A 47 12.816 -9.122 -5.498 1.00 0.00 H new ATOM 0 HB3 ARG A 47 11.777 -9.456 -6.869 1.00 0.00 H new ATOM 0 HG2 ARG A 47 13.165 -7.865 -8.269 1.00 0.00 H new ATOM 0 HG3 ARG A 47 14.232 -7.626 -6.900 1.00 0.00 H new ATOM 0 HD2 ARG A 47 13.679 -10.288 -8.308 1.00 0.00 H new ATOM 0 HD3 ARG A 47 15.167 -9.366 -8.395 1.00 0.00 H new ATOM 0 HE ARG A 47 14.429 -10.018 -5.601 1.00 0.00 H new ATOM 0 HH11 ARG A 47 15.900 -11.096 -8.591 1.00 0.00 H new ATOM 0 HH12 ARG A 47 16.948 -12.274 -7.793 1.00 0.00 H new ATOM 0 HH21 ARG A 47 15.771 -11.526 -4.588 1.00 0.00 H new ATOM 0 HH22 ARG A 47 16.875 -12.515 -5.550 1.00 0.00 H new ATOM 770 N PRO A 48 9.295 -6.758 -6.050 1.00 0.00 N ATOM 771 CA PRO A 48 7.829 -6.907 -6.062 1.00 0.00 C ATOM 772 C PRO A 48 7.330 -7.149 -7.489 1.00 0.00 C ATOM 773 O PRO A 48 8.099 -7.430 -8.387 1.00 0.00 O ATOM 774 CB PRO A 48 7.327 -5.563 -5.528 1.00 0.00 C ATOM 775 CG PRO A 48 8.465 -4.543 -5.775 1.00 0.00 C ATOM 776 CD PRO A 48 9.760 -5.360 -5.938 1.00 0.00 C ATOM 0 HA PRO A 48 7.478 -7.752 -5.470 1.00 0.00 H new ATOM 0 HB2 PRO A 48 6.414 -5.258 -6.040 1.00 0.00 H new ATOM 0 HB3 PRO A 48 7.090 -5.631 -4.466 1.00 0.00 H new ATOM 0 HG2 PRO A 48 8.266 -3.949 -6.667 1.00 0.00 H new ATOM 0 HG3 PRO A 48 8.549 -3.846 -4.941 1.00 0.00 H new ATOM 0 HD2 PRO A 48 10.316 -5.053 -6.824 1.00 0.00 H new ATOM 0 HD3 PRO A 48 10.424 -5.228 -5.084 1.00 0.00 H new ATOM 784 N ASP A 49 6.047 -7.043 -7.704 1.00 0.00 N ATOM 785 CA ASP A 49 5.500 -7.267 -9.071 1.00 0.00 C ATOM 786 C ASP A 49 4.364 -6.277 -9.334 1.00 0.00 C ATOM 787 O ASP A 49 3.634 -6.396 -10.298 1.00 0.00 O ATOM 788 CB ASP A 49 4.966 -8.696 -9.180 1.00 0.00 C ATOM 789 CG ASP A 49 5.120 -9.192 -10.618 1.00 0.00 C ATOM 790 OD1 ASP A 49 6.182 -8.989 -11.183 1.00 0.00 O ATOM 791 OD2 ASP A 49 4.174 -9.766 -11.131 1.00 0.00 O ATOM 0 H ASP A 49 5.355 -6.811 -6.992 1.00 0.00 H new ATOM 0 HA ASP A 49 6.290 -7.118 -9.807 1.00 0.00 H new ATOM 0 HB2 ASP A 49 5.509 -9.351 -8.498 1.00 0.00 H new ATOM 0 HB3 ASP A 49 3.917 -8.727 -8.884 1.00 0.00 H new ATOM 796 N LEU A 50 4.208 -5.299 -8.484 1.00 0.00 N ATOM 797 CA LEU A 50 3.117 -4.303 -8.687 1.00 0.00 C ATOM 798 C LEU A 50 3.575 -2.933 -8.182 1.00 0.00 C ATOM 799 O LEU A 50 3.748 -2.722 -6.998 1.00 0.00 O ATOM 800 CB LEU A 50 1.874 -4.742 -7.911 1.00 0.00 C ATOM 801 CG LEU A 50 0.676 -3.898 -8.345 1.00 0.00 C ATOM 802 CD1 LEU A 50 -0.048 -4.594 -9.499 1.00 0.00 C ATOM 803 CD2 LEU A 50 -0.286 -3.734 -7.166 1.00 0.00 C ATOM 0 H LEU A 50 4.788 -5.146 -7.659 1.00 0.00 H new ATOM 0 HA LEU A 50 2.879 -4.238 -9.749 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.673 -5.798 -8.093 1.00 0.00 H new ATOM 0 HB3 LEU A 50 2.043 -4.629 -6.840 1.00 0.00 H new ATOM 0 HG LEU A 50 1.022 -2.918 -8.672 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -0.902 -3.992 -9.808 1.00 0.00 H new ATOM 0 HD12 LEU A 50 0.636 -4.712 -10.339 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.394 -5.575 -9.173 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -1.141 -3.132 -7.475 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -0.632 -4.715 -6.839 1.00 0.00 H new ATOM 0 HD23 LEU A 50 0.228 -3.238 -6.343 1.00 0.00 H new ATOM 815 N VAL A 51 3.771 -1.998 -9.072 1.00 0.00 N ATOM 816 CA VAL A 51 4.215 -0.642 -8.642 1.00 0.00 C ATOM 817 C VAL A 51 3.067 0.353 -8.838 1.00 0.00 C ATOM 818 O VAL A 51 2.376 0.328 -9.837 1.00 0.00 O ATOM 819 CB VAL A 51 5.416 -0.208 -9.485 1.00 0.00 C ATOM 820 CG1 VAL A 51 6.129 0.956 -8.796 1.00 0.00 C ATOM 821 CG2 VAL A 51 6.385 -1.383 -9.631 1.00 0.00 C ATOM 0 H VAL A 51 3.643 -2.115 -10.077 1.00 0.00 H new ATOM 0 HA VAL A 51 4.500 -0.667 -7.590 1.00 0.00 H new ATOM 0 HB VAL A 51 5.074 0.108 -10.470 1.00 0.00 H new ATOM 0 HG11 VAL A 51 6.985 1.265 -9.396 1.00 0.00 H new ATOM 0 HG12 VAL A 51 5.439 1.793 -8.689 1.00 0.00 H new ATOM 0 HG13 VAL A 51 6.472 0.641 -7.811 1.00 0.00 H new ATOM 0 HG21 VAL A 51 7.241 -1.076 -10.231 1.00 0.00 H new ATOM 0 HG22 VAL A 51 6.727 -1.697 -8.645 1.00 0.00 H new ATOM 0 HG23 VAL A 51 5.878 -2.214 -10.121 1.00 0.00 H new ATOM 831 N LEU A 52 2.859 1.227 -7.893 1.00 0.00 N ATOM 832 CA LEU A 52 1.756 2.220 -8.026 1.00 0.00 C ATOM 833 C LEU A 52 2.337 3.590 -8.379 1.00 0.00 C ATOM 834 O LEU A 52 2.783 4.326 -7.520 1.00 0.00 O ATOM 835 CB LEU A 52 0.994 2.315 -6.704 1.00 0.00 C ATOM 836 CG LEU A 52 0.345 0.966 -6.390 1.00 0.00 C ATOM 837 CD1 LEU A 52 0.816 0.479 -5.020 1.00 0.00 C ATOM 838 CD2 LEU A 52 -1.177 1.126 -6.377 1.00 0.00 C ATOM 0 H LEU A 52 3.405 1.297 -7.034 1.00 0.00 H new ATOM 0 HA LEU A 52 1.076 1.901 -8.816 1.00 0.00 H new ATOM 0 HB2 LEU A 52 1.673 2.599 -5.900 1.00 0.00 H new ATOM 0 HB3 LEU A 52 0.232 3.091 -6.767 1.00 0.00 H new ATOM 0 HG LEU A 52 0.630 0.240 -7.151 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.353 -0.482 -4.797 1.00 0.00 H new ATOM 0 HD12 LEU A 52 1.900 0.367 -5.027 1.00 0.00 H new ATOM 0 HD13 LEU A 52 0.531 1.205 -4.258 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -1.642 0.166 -6.153 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -1.460 1.852 -5.615 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -1.515 1.474 -7.353 1.00 0.00 H new ATOM 850 N LEU A 53 2.334 3.940 -9.635 1.00 0.00 N ATOM 851 CA LEU A 53 2.882 5.263 -10.043 1.00 0.00 C ATOM 852 C LEU A 53 1.747 6.288 -10.095 1.00 0.00 C ATOM 853 O LEU A 53 0.800 6.141 -10.842 1.00 0.00 O ATOM 854 CB LEU A 53 3.525 5.144 -11.427 1.00 0.00 C ATOM 855 CG LEU A 53 5.042 5.274 -11.300 1.00 0.00 C ATOM 856 CD1 LEU A 53 5.542 4.360 -10.180 1.00 0.00 C ATOM 857 CD2 LEU A 53 5.700 4.866 -12.620 1.00 0.00 C ATOM 0 H LEU A 53 1.975 3.366 -10.398 1.00 0.00 H new ATOM 0 HA LEU A 53 3.632 5.585 -9.321 1.00 0.00 H new ATOM 0 HB2 LEU A 53 3.268 4.185 -11.877 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.137 5.920 -12.087 1.00 0.00 H new ATOM 0 HG LEU A 53 5.299 6.307 -11.068 1.00 0.00 H new ATOM 0 HD11 LEU A 53 6.624 4.453 -10.090 1.00 0.00 H new ATOM 0 HD12 LEU A 53 5.074 4.648 -9.239 1.00 0.00 H new ATOM 0 HD13 LEU A 53 5.285 3.326 -10.412 1.00 0.00 H new ATOM 0 HD21 LEU A 53 6.782 4.958 -12.531 1.00 0.00 H new ATOM 0 HD22 LEU A 53 5.442 3.833 -12.851 1.00 0.00 H new ATOM 0 HD23 LEU A 53 5.345 5.516 -13.420 1.00 0.00 H new ATOM 869 N ASP A 54 1.829 7.324 -9.306 1.00 0.00 N ATOM 870 CA ASP A 54 0.749 8.350 -9.317 1.00 0.00 C ATOM 871 C ASP A 54 1.180 9.542 -10.171 1.00 0.00 C ATOM 872 O ASP A 54 0.424 10.466 -10.394 1.00 0.00 O ATOM 873 CB ASP A 54 0.476 8.820 -7.886 1.00 0.00 C ATOM 874 CG ASP A 54 -0.912 9.458 -7.814 1.00 0.00 C ATOM 875 OD1 ASP A 54 -1.387 9.915 -8.840 1.00 0.00 O ATOM 876 OD2 ASP A 54 -1.477 9.480 -6.733 1.00 0.00 O ATOM 0 H ASP A 54 2.595 7.504 -8.656 1.00 0.00 H new ATOM 0 HA ASP A 54 -0.158 7.914 -9.737 1.00 0.00 H new ATOM 0 HB2 ASP A 54 0.537 7.977 -7.197 1.00 0.00 H new ATOM 0 HB3 ASP A 54 1.235 9.539 -7.577 1.00 0.00 H new ATOM 881 N MET A 55 2.390 9.527 -10.647 1.00 0.00 N ATOM 882 CA MET A 55 2.882 10.657 -11.486 1.00 0.00 C ATOM 883 C MET A 55 2.674 11.982 -10.745 1.00 0.00 C ATOM 884 O MET A 55 2.711 13.044 -11.334 1.00 0.00 O ATOM 885 CB MET A 55 2.107 10.686 -12.806 1.00 0.00 C ATOM 886 CG MET A 55 1.865 9.255 -13.292 1.00 0.00 C ATOM 887 SD MET A 55 2.377 9.112 -15.022 1.00 0.00 S ATOM 888 CE MET A 55 3.830 8.070 -14.743 1.00 0.00 C ATOM 0 H MET A 55 3.065 8.778 -10.492 1.00 0.00 H new ATOM 0 HA MET A 55 3.944 10.520 -11.687 1.00 0.00 H new ATOM 0 HB2 MET A 55 1.156 11.200 -12.669 1.00 0.00 H new ATOM 0 HB3 MET A 55 2.667 11.245 -13.556 1.00 0.00 H new ATOM 0 HG2 MET A 55 2.425 8.551 -12.676 1.00 0.00 H new ATOM 0 HG3 MET A 55 0.810 8.999 -13.191 1.00 0.00 H new ATOM 0 HE1 MET A 55 4.734 8.670 -14.849 1.00 0.00 H new ATOM 0 HE2 MET A 55 3.789 7.650 -13.738 1.00 0.00 H new ATOM 0 HE3 MET A 55 3.844 7.262 -15.474 1.00 0.00 H new ATOM 898 N LYS A 56 2.459 11.933 -9.458 1.00 0.00 N ATOM 899 CA LYS A 56 2.253 13.192 -8.687 1.00 0.00 C ATOM 900 C LYS A 56 3.600 13.691 -8.163 1.00 0.00 C ATOM 901 O LYS A 56 3.876 14.875 -8.159 1.00 0.00 O ATOM 902 CB LYS A 56 1.315 12.921 -7.509 1.00 0.00 C ATOM 903 CG LYS A 56 -0.121 12.793 -8.020 1.00 0.00 C ATOM 904 CD LYS A 56 -0.735 14.186 -8.174 1.00 0.00 C ATOM 905 CE LYS A 56 -2.257 14.091 -8.045 1.00 0.00 C ATOM 906 NZ LYS A 56 -2.876 14.170 -9.399 1.00 0.00 N ATOM 0 H LYS A 56 2.417 11.075 -8.907 1.00 0.00 H new ATOM 0 HA LYS A 56 1.811 13.949 -9.335 1.00 0.00 H new ATOM 0 HB2 LYS A 56 1.613 12.006 -6.996 1.00 0.00 H new ATOM 0 HB3 LYS A 56 1.383 13.731 -6.782 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.132 12.271 -8.977 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -0.714 12.198 -7.325 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -0.336 14.857 -7.413 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -0.467 14.608 -9.143 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -2.534 13.155 -7.561 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -2.630 14.898 -7.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -3.910 14.106 -9.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -2.622 15.075 -9.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -2.528 13.385 -9.986 1.00 0.00 H new ATOM 920 N ILE A 57 4.438 12.797 -7.717 1.00 0.00 N ATOM 921 CA ILE A 57 5.768 13.210 -7.188 1.00 0.00 C ATOM 922 C ILE A 57 6.373 14.282 -8.104 1.00 0.00 C ATOM 923 O ILE A 57 6.731 13.997 -9.228 1.00 0.00 O ATOM 924 CB ILE A 57 6.694 11.994 -7.151 1.00 0.00 C ATOM 925 CG1 ILE A 57 6.032 10.879 -6.336 1.00 0.00 C ATOM 926 CG2 ILE A 57 8.020 12.383 -6.496 1.00 0.00 C ATOM 927 CD1 ILE A 57 6.147 9.554 -7.094 1.00 0.00 C ATOM 0 H ILE A 57 4.258 11.793 -7.696 1.00 0.00 H new ATOM 0 HA ILE A 57 5.652 13.615 -6.183 1.00 0.00 H new ATOM 0 HB ILE A 57 6.879 11.645 -8.167 1.00 0.00 H new ATOM 0 HG12 ILE A 57 6.510 10.794 -5.360 1.00 0.00 H new ATOM 0 HG13 ILE A 57 4.984 11.118 -6.157 1.00 0.00 H new ATOM 0 HG21 ILE A 57 8.681 11.516 -6.469 1.00 0.00 H new ATOM 0 HG22 ILE A 57 8.490 13.180 -7.072 1.00 0.00 H new ATOM 0 HG23 ILE A 57 7.836 12.730 -5.479 1.00 0.00 H new ATOM 0 HD11 ILE A 57 5.676 8.761 -6.514 1.00 0.00 H new ATOM 0 HD12 ILE A 57 5.648 9.643 -8.059 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.199 9.314 -7.250 1.00 0.00 H new ATOM 939 N PRO A 58 6.471 15.487 -7.596 1.00 0.00 N ATOM 940 CA PRO A 58 7.033 16.620 -8.353 1.00 0.00 C ATOM 941 C PRO A 58 8.561 16.528 -8.395 1.00 0.00 C ATOM 942 O PRO A 58 9.169 15.785 -7.649 1.00 0.00 O ATOM 943 CB PRO A 58 6.577 17.847 -7.560 1.00 0.00 C ATOM 944 CG PRO A 58 6.278 17.351 -6.125 1.00 0.00 C ATOM 945 CD PRO A 58 6.037 15.834 -6.226 1.00 0.00 C ATOM 0 HA PRO A 58 6.704 16.648 -9.392 1.00 0.00 H new ATOM 0 HB2 PRO A 58 7.351 18.615 -7.553 1.00 0.00 H new ATOM 0 HB3 PRO A 58 5.690 18.293 -8.010 1.00 0.00 H new ATOM 0 HG2 PRO A 58 7.113 17.567 -5.458 1.00 0.00 H new ATOM 0 HG3 PRO A 58 5.403 17.856 -5.715 1.00 0.00 H new ATOM 0 HD2 PRO A 58 6.611 15.289 -5.477 1.00 0.00 H new ATOM 0 HD3 PRO A 58 4.988 15.586 -6.066 1.00 0.00 H new ATOM 953 N GLY A 59 9.187 17.275 -9.261 1.00 0.00 N ATOM 954 CA GLY A 59 10.674 17.228 -9.353 1.00 0.00 C ATOM 955 C GLY A 59 11.081 16.338 -10.528 1.00 0.00 C ATOM 956 O GLY A 59 11.970 16.666 -11.289 1.00 0.00 O ATOM 0 H GLY A 59 8.733 17.917 -9.910 1.00 0.00 H new ATOM 0 HA2 GLY A 59 11.073 18.233 -9.488 1.00 0.00 H new ATOM 0 HA3 GLY A 59 11.095 16.840 -8.425 1.00 0.00 H new ATOM 960 N MET A 60 10.434 15.215 -10.683 1.00 0.00 N ATOM 961 CA MET A 60 10.781 14.304 -11.810 1.00 0.00 C ATOM 962 C MET A 60 9.592 13.385 -12.103 1.00 0.00 C ATOM 963 O MET A 60 8.734 13.179 -11.267 1.00 0.00 O ATOM 964 CB MET A 60 12.012 13.469 -11.437 1.00 0.00 C ATOM 965 CG MET A 60 11.606 12.303 -10.529 1.00 0.00 C ATOM 966 SD MET A 60 10.824 12.945 -9.028 1.00 0.00 S ATOM 967 CE MET A 60 9.651 11.588 -8.788 1.00 0.00 C ATOM 0 H MET A 60 9.680 14.889 -10.078 1.00 0.00 H new ATOM 0 HA MET A 60 11.009 14.891 -12.700 1.00 0.00 H new ATOM 0 HB2 MET A 60 12.489 13.087 -12.340 1.00 0.00 H new ATOM 0 HB3 MET A 60 12.746 14.096 -10.930 1.00 0.00 H new ATOM 0 HG2 MET A 60 10.918 11.642 -11.055 1.00 0.00 H new ATOM 0 HG3 MET A 60 12.482 11.709 -10.269 1.00 0.00 H new ATOM 0 HE1 MET A 60 8.662 11.898 -9.126 1.00 0.00 H new ATOM 0 HE2 MET A 60 9.976 10.721 -9.363 1.00 0.00 H new ATOM 0 HE3 MET A 60 9.608 11.327 -7.731 1.00 0.00 H new ATOM 977 N ASP A 61 9.532 12.829 -13.282 1.00 0.00 N ATOM 978 CA ASP A 61 8.397 11.926 -13.622 1.00 0.00 C ATOM 979 C ASP A 61 8.746 10.493 -13.215 1.00 0.00 C ATOM 980 O ASP A 61 9.897 10.109 -13.182 1.00 0.00 O ATOM 981 CB ASP A 61 8.136 11.980 -15.129 1.00 0.00 C ATOM 982 CG ASP A 61 7.401 13.276 -15.474 1.00 0.00 C ATOM 983 OD1 ASP A 61 8.071 14.266 -15.721 1.00 0.00 O ATOM 984 OD2 ASP A 61 6.181 13.257 -15.487 1.00 0.00 O ATOM 0 H ASP A 61 10.219 12.961 -14.024 1.00 0.00 H new ATOM 0 HA ASP A 61 7.503 12.248 -13.087 1.00 0.00 H new ATOM 0 HB2 ASP A 61 9.079 11.928 -15.674 1.00 0.00 H new ATOM 0 HB3 ASP A 61 7.542 11.120 -15.437 1.00 0.00 H new ATOM 989 N GLY A 62 7.758 9.698 -12.907 1.00 0.00 N ATOM 990 CA GLY A 62 8.033 8.290 -12.503 1.00 0.00 C ATOM 991 C GLY A 62 8.027 7.391 -13.741 1.00 0.00 C ATOM 992 O GLY A 62 8.153 6.186 -13.645 1.00 0.00 O ATOM 0 H GLY A 62 6.773 9.962 -12.918 1.00 0.00 H new ATOM 0 HA2 GLY A 62 8.998 8.227 -12.000 1.00 0.00 H new ATOM 0 HA3 GLY A 62 7.280 7.951 -11.791 1.00 0.00 H new ATOM 996 N ILE A 63 7.883 7.965 -14.906 1.00 0.00 N ATOM 997 CA ILE A 63 7.871 7.139 -16.146 1.00 0.00 C ATOM 998 C ILE A 63 9.192 6.378 -16.262 1.00 0.00 C ATOM 999 O ILE A 63 9.213 5.178 -16.452 1.00 0.00 O ATOM 1000 CB ILE A 63 7.695 8.050 -17.362 1.00 0.00 C ATOM 1001 CG1 ILE A 63 6.257 8.571 -17.403 1.00 0.00 C ATOM 1002 CG2 ILE A 63 7.987 7.260 -18.639 1.00 0.00 C ATOM 1003 CD1 ILE A 63 5.303 7.410 -17.692 1.00 0.00 C ATOM 0 H ILE A 63 7.773 8.969 -15.051 1.00 0.00 H new ATOM 0 HA ILE A 63 7.046 6.428 -16.104 1.00 0.00 H new ATOM 0 HB ILE A 63 8.385 8.890 -17.289 1.00 0.00 H new ATOM 0 HG12 ILE A 63 6.001 9.038 -16.452 1.00 0.00 H new ATOM 0 HG13 ILE A 63 6.158 9.337 -18.172 1.00 0.00 H new ATOM 0 HG21 ILE A 63 7.861 7.909 -19.505 1.00 0.00 H new ATOM 0 HG22 ILE A 63 9.011 6.887 -18.610 1.00 0.00 H new ATOM 0 HG23 ILE A 63 7.297 6.419 -18.713 1.00 0.00 H new ATOM 0 HD11 ILE A 63 4.278 7.780 -17.721 1.00 0.00 H new ATOM 0 HD12 ILE A 63 5.555 6.963 -18.653 1.00 0.00 H new ATOM 0 HD13 ILE A 63 5.395 6.659 -16.907 1.00 0.00 H new ATOM 1015 N GLU A 64 10.296 7.063 -16.146 1.00 0.00 N ATOM 1016 CA GLU A 64 11.613 6.374 -16.247 1.00 0.00 C ATOM 1017 C GLU A 64 11.644 5.192 -15.276 1.00 0.00 C ATOM 1018 O GLU A 64 12.388 4.249 -15.453 1.00 0.00 O ATOM 1019 CB GLU A 64 12.732 7.356 -15.893 1.00 0.00 C ATOM 1020 CG GLU A 64 12.451 8.708 -16.552 1.00 0.00 C ATOM 1021 CD GLU A 64 13.774 9.430 -16.820 1.00 0.00 C ATOM 1022 OE1 GLU A 64 14.583 9.499 -15.909 1.00 0.00 O ATOM 1023 OE2 GLU A 64 13.954 9.899 -17.931 1.00 0.00 O ATOM 0 H GLU A 64 10.343 8.069 -15.986 1.00 0.00 H new ATOM 0 HA GLU A 64 11.758 6.012 -17.265 1.00 0.00 H new ATOM 0 HB2 GLU A 64 12.799 7.473 -14.811 1.00 0.00 H new ATOM 0 HB3 GLU A 64 13.692 6.967 -16.231 1.00 0.00 H new ATOM 0 HG2 GLU A 64 11.908 8.563 -17.486 1.00 0.00 H new ATOM 0 HG3 GLU A 64 11.818 9.315 -15.905 1.00 0.00 H new ATOM 1030 N ILE A 65 10.839 5.238 -14.249 1.00 0.00 N ATOM 1031 CA ILE A 65 10.820 4.118 -13.266 1.00 0.00 C ATOM 1032 C ILE A 65 10.164 2.891 -13.904 1.00 0.00 C ATOM 1033 O ILE A 65 10.797 1.874 -14.107 1.00 0.00 O ATOM 1034 CB ILE A 65 10.024 4.538 -12.030 1.00 0.00 C ATOM 1035 CG1 ILE A 65 10.418 5.963 -11.631 1.00 0.00 C ATOM 1036 CG2 ILE A 65 10.333 3.583 -10.875 1.00 0.00 C ATOM 1037 CD1 ILE A 65 11.944 6.084 -11.605 1.00 0.00 C ATOM 0 H ILE A 65 10.194 6.003 -14.049 1.00 0.00 H new ATOM 0 HA ILE A 65 11.841 3.873 -12.974 1.00 0.00 H new ATOM 0 HB ILE A 65 8.958 4.503 -12.255 1.00 0.00 H new ATOM 0 HG12 ILE A 65 9.998 6.679 -12.338 1.00 0.00 H new ATOM 0 HG13 ILE A 65 10.007 6.204 -10.651 1.00 0.00 H new ATOM 0 HG21 ILE A 65 9.766 3.882 -9.994 1.00 0.00 H new ATOM 0 HG22 ILE A 65 10.055 2.568 -11.158 1.00 0.00 H new ATOM 0 HG23 ILE A 65 11.399 3.618 -10.649 1.00 0.00 H new ATOM 0 HD11 ILE A 65 12.224 7.098 -11.321 1.00 0.00 H new ATOM 0 HD12 ILE A 65 12.353 5.379 -10.881 1.00 0.00 H new ATOM 0 HD13 ILE A 65 12.344 5.861 -12.594 1.00 0.00 H new ATOM 1049 N LEU A 66 8.901 2.978 -14.222 1.00 0.00 N ATOM 1050 CA LEU A 66 8.213 1.813 -14.847 1.00 0.00 C ATOM 1051 C LEU A 66 9.078 1.268 -15.984 1.00 0.00 C ATOM 1052 O LEU A 66 9.040 0.095 -16.299 1.00 0.00 O ATOM 1053 CB LEU A 66 6.854 2.254 -15.398 1.00 0.00 C ATOM 1054 CG LEU A 66 7.060 3.104 -16.653 1.00 0.00 C ATOM 1055 CD1 LEU A 66 6.711 2.278 -17.892 1.00 0.00 C ATOM 1056 CD2 LEU A 66 6.149 4.333 -16.588 1.00 0.00 C ATOM 0 H LEU A 66 8.318 3.802 -14.077 1.00 0.00 H new ATOM 0 HA LEU A 66 8.060 1.034 -14.100 1.00 0.00 H new ATOM 0 HB2 LEU A 66 6.245 1.381 -15.634 1.00 0.00 H new ATOM 0 HB3 LEU A 66 6.313 2.826 -14.644 1.00 0.00 H new ATOM 0 HG LEU A 66 8.101 3.423 -16.710 1.00 0.00 H new ATOM 0 HD11 LEU A 66 6.858 2.884 -18.786 1.00 0.00 H new ATOM 0 HD12 LEU A 66 7.356 1.401 -17.938 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.670 1.960 -17.836 1.00 0.00 H new ATOM 0 HD21 LEU A 66 6.294 4.941 -17.481 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.109 4.012 -16.532 1.00 0.00 H new ATOM 0 HD23 LEU A 66 6.395 4.922 -15.705 1.00 0.00 H new ATOM 1068 N LYS A 67 9.862 2.109 -16.600 1.00 0.00 N ATOM 1069 CA LYS A 67 10.732 1.638 -17.714 1.00 0.00 C ATOM 1070 C LYS A 67 11.801 0.698 -17.156 1.00 0.00 C ATOM 1071 O LYS A 67 11.895 -0.450 -17.543 1.00 0.00 O ATOM 1072 CB LYS A 67 11.406 2.842 -18.378 1.00 0.00 C ATOM 1073 CG LYS A 67 12.501 2.354 -19.329 1.00 0.00 C ATOM 1074 CD LYS A 67 11.864 1.589 -20.492 1.00 0.00 C ATOM 1075 CE LYS A 67 12.754 1.710 -21.730 1.00 0.00 C ATOM 1076 NZ LYS A 67 12.863 0.380 -22.394 1.00 0.00 N ATOM 0 H LYS A 67 9.938 3.102 -16.380 1.00 0.00 H new ATOM 0 HA LYS A 67 10.129 1.108 -18.451 1.00 0.00 H new ATOM 0 HB2 LYS A 67 10.669 3.429 -18.926 1.00 0.00 H new ATOM 0 HB3 LYS A 67 11.834 3.497 -17.619 1.00 0.00 H new ATOM 0 HG2 LYS A 67 13.073 3.201 -19.707 1.00 0.00 H new ATOM 0 HG3 LYS A 67 13.200 1.710 -18.796 1.00 0.00 H new ATOM 0 HD2 LYS A 67 11.735 0.540 -20.224 1.00 0.00 H new ATOM 0 HD3 LYS A 67 10.872 1.988 -20.704 1.00 0.00 H new ATOM 0 HE2 LYS A 67 12.336 2.441 -22.422 1.00 0.00 H new ATOM 0 HE3 LYS A 67 13.743 2.069 -21.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 13.338 0.489 -23.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 13.416 -0.264 -21.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 11.912 -0.014 -22.540 1.00 0.00 H new ATOM 1090 N ARG A 68 12.606 1.174 -16.245 1.00 0.00 N ATOM 1091 CA ARG A 68 13.665 0.304 -15.661 1.00 0.00 C ATOM 1092 C ARG A 68 13.035 -1.002 -15.173 1.00 0.00 C ATOM 1093 O ARG A 68 13.681 -2.029 -15.109 1.00 0.00 O ATOM 1094 CB ARG A 68 14.325 1.024 -14.483 1.00 0.00 C ATOM 1095 CG ARG A 68 15.021 2.291 -14.983 1.00 0.00 C ATOM 1096 CD ARG A 68 16.380 2.432 -14.298 1.00 0.00 C ATOM 1097 NE ARG A 68 17.193 3.459 -15.009 1.00 0.00 N ATOM 1098 CZ ARG A 68 17.782 3.163 -16.137 1.00 0.00 C ATOM 1099 NH1 ARG A 68 17.663 1.966 -16.647 1.00 0.00 N ATOM 1100 NH2 ARG A 68 18.492 4.066 -16.757 1.00 0.00 N ATOM 0 H ARG A 68 12.576 2.126 -15.881 1.00 0.00 H new ATOM 0 HA ARG A 68 14.417 0.085 -16.419 1.00 0.00 H new ATOM 0 HB2 ARG A 68 13.576 1.280 -13.734 1.00 0.00 H new ATOM 0 HB3 ARG A 68 15.047 0.366 -14.000 1.00 0.00 H new ATOM 0 HG2 ARG A 68 15.150 2.245 -16.064 1.00 0.00 H new ATOM 0 HG3 ARG A 68 14.404 3.164 -14.773 1.00 0.00 H new ATOM 0 HD2 ARG A 68 16.245 2.718 -13.255 1.00 0.00 H new ATOM 0 HD3 ARG A 68 16.901 1.475 -14.301 1.00 0.00 H new ATOM 0 HE ARG A 68 17.290 4.395 -14.614 1.00 0.00 H new ATOM 0 HH11 ARG A 68 17.109 1.259 -16.164 1.00 0.00 H new ATOM 0 HH12 ARG A 68 18.124 1.739 -17.528 1.00 0.00 H new ATOM 0 HH21 ARG A 68 18.586 5.001 -16.361 1.00 0.00 H new ATOM 0 HH22 ARG A 68 18.952 3.836 -17.638 1.00 0.00 H new ATOM 1114 N MET A 69 11.777 -0.970 -14.829 1.00 0.00 N ATOM 1115 CA MET A 69 11.105 -2.210 -14.346 1.00 0.00 C ATOM 1116 C MET A 69 10.853 -3.147 -15.529 1.00 0.00 C ATOM 1117 O MET A 69 11.006 -4.348 -15.427 1.00 0.00 O ATOM 1118 CB MET A 69 9.772 -1.847 -13.690 1.00 0.00 C ATOM 1119 CG MET A 69 10.001 -0.763 -12.635 1.00 0.00 C ATOM 1120 SD MET A 69 9.004 -1.129 -11.168 1.00 0.00 S ATOM 1121 CE MET A 69 8.311 0.527 -10.945 1.00 0.00 C ATOM 0 H MET A 69 11.185 -0.140 -14.861 1.00 0.00 H new ATOM 0 HA MET A 69 11.744 -2.708 -13.617 1.00 0.00 H new ATOM 0 HB2 MET A 69 9.068 -1.493 -14.443 1.00 0.00 H new ATOM 0 HB3 MET A 69 9.329 -2.730 -13.229 1.00 0.00 H new ATOM 0 HG2 MET A 69 11.057 -0.717 -12.368 1.00 0.00 H new ATOM 0 HG3 MET A 69 9.731 0.214 -13.037 1.00 0.00 H new ATOM 0 HE1 MET A 69 8.493 0.863 -9.924 1.00 0.00 H new ATOM 0 HE2 MET A 69 8.785 1.217 -11.644 1.00 0.00 H new ATOM 0 HE3 MET A 69 7.238 0.501 -11.133 1.00 0.00 H new ATOM 1131 N LYS A 70 10.469 -2.606 -16.654 1.00 0.00 N ATOM 1132 CA LYS A 70 10.209 -3.468 -17.843 1.00 0.00 C ATOM 1133 C LYS A 70 11.532 -4.041 -18.350 1.00 0.00 C ATOM 1134 O LYS A 70 11.569 -5.072 -18.993 1.00 0.00 O ATOM 1135 CB LYS A 70 9.560 -2.633 -18.950 1.00 0.00 C ATOM 1136 CG LYS A 70 8.439 -1.777 -18.358 1.00 0.00 C ATOM 1137 CD LYS A 70 7.087 -2.431 -18.652 1.00 0.00 C ATOM 1138 CE LYS A 70 6.611 -3.196 -17.416 1.00 0.00 C ATOM 1139 NZ LYS A 70 6.582 -4.655 -17.716 1.00 0.00 N ATOM 0 H LYS A 70 10.324 -1.607 -16.801 1.00 0.00 H new ATOM 0 HA LYS A 70 9.540 -4.281 -17.563 1.00 0.00 H new ATOM 0 HB2 LYS A 70 10.307 -1.995 -19.423 1.00 0.00 H new ATOM 0 HB3 LYS A 70 9.161 -3.287 -19.726 1.00 0.00 H new ATOM 0 HG2 LYS A 70 8.577 -1.671 -17.282 1.00 0.00 H new ATOM 0 HG3 LYS A 70 8.470 -0.774 -18.783 1.00 0.00 H new ATOM 0 HD2 LYS A 70 6.355 -1.671 -18.927 1.00 0.00 H new ATOM 0 HD3 LYS A 70 7.176 -3.109 -19.501 1.00 0.00 H new ATOM 0 HE2 LYS A 70 7.276 -3.000 -16.575 1.00 0.00 H new ATOM 0 HE3 LYS A 70 5.618 -2.854 -17.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 6.015 -5.146 -16.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 6.159 -4.808 -18.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 7.552 -5.030 -17.708 1.00 0.00 H new ATOM 1153 N VAL A 71 12.619 -3.378 -18.069 1.00 0.00 N ATOM 1154 CA VAL A 71 13.941 -3.880 -18.535 1.00 0.00 C ATOM 1155 C VAL A 71 14.540 -4.804 -17.473 1.00 0.00 C ATOM 1156 O VAL A 71 15.337 -5.672 -17.770 1.00 0.00 O ATOM 1157 CB VAL A 71 14.880 -2.694 -18.771 1.00 0.00 C ATOM 1158 CG1 VAL A 71 16.022 -3.122 -19.693 1.00 0.00 C ATOM 1159 CG2 VAL A 71 14.100 -1.550 -19.424 1.00 0.00 C ATOM 0 H VAL A 71 12.649 -2.509 -17.536 1.00 0.00 H new ATOM 0 HA VAL A 71 13.813 -4.434 -19.465 1.00 0.00 H new ATOM 0 HB VAL A 71 15.289 -2.359 -17.818 1.00 0.00 H new ATOM 0 HG11 VAL A 71 16.690 -2.277 -19.861 1.00 0.00 H new ATOM 0 HG12 VAL A 71 16.577 -3.938 -19.230 1.00 0.00 H new ATOM 0 HG13 VAL A 71 15.614 -3.457 -20.647 1.00 0.00 H new ATOM 0 HG21 VAL A 71 14.767 -0.705 -19.593 1.00 0.00 H new ATOM 0 HG22 VAL A 71 13.691 -1.886 -20.377 1.00 0.00 H new ATOM 0 HG23 VAL A 71 13.285 -1.244 -18.768 1.00 0.00 H new ATOM 1169 N ILE A 72 14.159 -4.627 -16.237 1.00 0.00 N ATOM 1170 CA ILE A 72 14.705 -5.497 -15.158 1.00 0.00 C ATOM 1171 C ILE A 72 13.819 -6.734 -15.005 1.00 0.00 C ATOM 1172 O ILE A 72 14.211 -7.723 -14.417 1.00 0.00 O ATOM 1173 CB ILE A 72 14.729 -4.721 -13.840 1.00 0.00 C ATOM 1174 CG1 ILE A 72 15.599 -3.472 -14.000 1.00 0.00 C ATOM 1175 CG2 ILE A 72 15.309 -5.607 -12.736 1.00 0.00 C ATOM 1176 CD1 ILE A 72 15.143 -2.402 -13.007 1.00 0.00 C ATOM 0 H ILE A 72 13.494 -3.918 -15.929 1.00 0.00 H new ATOM 0 HA ILE A 72 15.718 -5.805 -15.417 1.00 0.00 H new ATOM 0 HB ILE A 72 13.714 -4.426 -13.574 1.00 0.00 H new ATOM 0 HG12 ILE A 72 16.646 -3.721 -13.827 1.00 0.00 H new ATOM 0 HG13 ILE A 72 15.525 -3.093 -15.019 1.00 0.00 H new ATOM 0 HG21 ILE A 72 15.326 -5.054 -11.797 1.00 0.00 H new ATOM 0 HG22 ILE A 72 14.691 -6.497 -12.622 1.00 0.00 H new ATOM 0 HG23 ILE A 72 16.324 -5.902 -13.002 1.00 0.00 H new ATOM 0 HD11 ILE A 72 15.762 -1.512 -13.121 1.00 0.00 H new ATOM 0 HD12 ILE A 72 14.101 -2.146 -13.201 1.00 0.00 H new ATOM 0 HD13 ILE A 72 15.240 -2.784 -11.991 1.00 0.00 H new ATOM 1188 N ASP A 73 12.625 -6.687 -15.530 1.00 0.00 N ATOM 1189 CA ASP A 73 11.714 -7.861 -15.415 1.00 0.00 C ATOM 1190 C ASP A 73 10.486 -7.642 -16.299 1.00 0.00 C ATOM 1191 O ASP A 73 9.711 -6.730 -16.088 1.00 0.00 O ATOM 1192 CB ASP A 73 11.272 -8.022 -13.958 1.00 0.00 C ATOM 1193 CG ASP A 73 11.544 -9.456 -13.499 1.00 0.00 C ATOM 1194 OD1 ASP A 73 11.146 -10.368 -14.203 1.00 0.00 O ATOM 1195 OD2 ASP A 73 12.145 -9.616 -12.449 1.00 0.00 O ATOM 0 H ASP A 73 12.241 -5.887 -16.033 1.00 0.00 H new ATOM 0 HA ASP A 73 12.238 -8.761 -15.738 1.00 0.00 H new ATOM 0 HB2 ASP A 73 11.810 -7.317 -13.324 1.00 0.00 H new ATOM 0 HB3 ASP A 73 10.211 -7.793 -13.861 1.00 0.00 H new ATOM 1200 N GLU A 74 10.301 -8.471 -17.290 1.00 0.00 N ATOM 1201 CA GLU A 74 9.122 -8.309 -18.187 1.00 0.00 C ATOM 1202 C GLU A 74 7.861 -8.784 -17.462 1.00 0.00 C ATOM 1203 O GLU A 74 6.758 -8.402 -17.800 1.00 0.00 O ATOM 1204 CB GLU A 74 9.327 -9.143 -19.454 1.00 0.00 C ATOM 1205 CG GLU A 74 10.194 -8.364 -20.444 1.00 0.00 C ATOM 1206 CD GLU A 74 9.296 -7.629 -21.441 1.00 0.00 C ATOM 1207 OE1 GLU A 74 8.555 -8.297 -22.144 1.00 0.00 O ATOM 1208 OE2 GLU A 74 9.365 -6.412 -21.485 1.00 0.00 O ATOM 0 H GLU A 74 10.915 -9.253 -17.517 1.00 0.00 H new ATOM 0 HA GLU A 74 9.012 -7.259 -18.457 1.00 0.00 H new ATOM 0 HB2 GLU A 74 9.804 -10.091 -19.205 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.364 -9.380 -19.906 1.00 0.00 H new ATOM 0 HG2 GLU A 74 10.823 -7.651 -19.910 1.00 0.00 H new ATOM 0 HG3 GLU A 74 10.862 -9.044 -20.973 1.00 0.00 H new ATOM 1215 N ASN A 75 8.015 -9.615 -16.468 1.00 0.00 N ATOM 1216 CA ASN A 75 6.825 -10.114 -15.722 1.00 0.00 C ATOM 1217 C ASN A 75 6.519 -9.169 -14.558 1.00 0.00 C ATOM 1218 O ASN A 75 6.230 -9.597 -13.459 1.00 0.00 O ATOM 1219 CB ASN A 75 7.114 -11.515 -15.180 1.00 0.00 C ATOM 1220 CG ASN A 75 7.469 -12.448 -16.338 1.00 0.00 C ATOM 1221 OD1 ASN A 75 6.647 -12.716 -17.191 1.00 0.00 O ATOM 1222 ND2 ASN A 75 8.669 -12.957 -16.406 1.00 0.00 N ATOM 0 H ASN A 75 8.913 -9.970 -16.140 1.00 0.00 H new ATOM 0 HA ASN A 75 5.966 -10.154 -16.392 1.00 0.00 H new ATOM 0 HB2 ASN A 75 7.936 -11.477 -14.465 1.00 0.00 H new ATOM 0 HB3 ASN A 75 6.244 -11.896 -14.646 1.00 0.00 H new ATOM 0 HD21 ASN A 75 8.916 -13.580 -17.175 1.00 0.00 H new ATOM 0 HD22 ASN A 75 9.360 -12.732 -15.690 1.00 0.00 H new ATOM 1229 N ILE A 76 6.582 -7.887 -14.792 1.00 0.00 N ATOM 1230 CA ILE A 76 6.295 -6.916 -13.699 1.00 0.00 C ATOM 1231 C ILE A 76 5.067 -6.080 -14.066 1.00 0.00 C ATOM 1232 O ILE A 76 4.827 -5.788 -15.221 1.00 0.00 O ATOM 1233 CB ILE A 76 7.501 -5.994 -13.506 1.00 0.00 C ATOM 1234 CG1 ILE A 76 7.202 -4.993 -12.386 1.00 0.00 C ATOM 1235 CG2 ILE A 76 7.778 -5.236 -14.804 1.00 0.00 C ATOM 1236 CD1 ILE A 76 8.147 -5.245 -11.210 1.00 0.00 C ATOM 0 H ILE A 76 6.820 -7.470 -15.692 1.00 0.00 H new ATOM 0 HA ILE A 76 6.100 -7.459 -12.774 1.00 0.00 H new ATOM 0 HB ILE A 76 8.374 -6.590 -13.240 1.00 0.00 H new ATOM 0 HG12 ILE A 76 7.324 -3.974 -12.753 1.00 0.00 H new ATOM 0 HG13 ILE A 76 6.166 -5.093 -12.062 1.00 0.00 H new ATOM 0 HG21 ILE A 76 8.637 -4.580 -14.666 1.00 0.00 H new ATOM 0 HG22 ILE A 76 7.990 -5.947 -15.603 1.00 0.00 H new ATOM 0 HG23 ILE A 76 6.905 -4.640 -15.071 1.00 0.00 H new ATOM 0 HD11 ILE A 76 7.934 -4.533 -10.413 1.00 0.00 H new ATOM 0 HD12 ILE A 76 8.003 -6.259 -10.838 1.00 0.00 H new ATOM 0 HD13 ILE A 76 9.179 -5.123 -11.540 1.00 0.00 H new ATOM 1248 N ARG A 77 4.287 -5.696 -13.094 1.00 0.00 N ATOM 1249 CA ARG A 77 3.075 -4.879 -13.389 1.00 0.00 C ATOM 1250 C ARG A 77 3.226 -3.494 -12.757 1.00 0.00 C ATOM 1251 O ARG A 77 4.041 -3.287 -11.880 1.00 0.00 O ATOM 1252 CB ARG A 77 1.841 -5.573 -12.807 1.00 0.00 C ATOM 1253 CG ARG A 77 1.444 -6.747 -13.703 1.00 0.00 C ATOM 1254 CD ARG A 77 0.850 -7.866 -12.846 1.00 0.00 C ATOM 1255 NE ARG A 77 0.640 -9.078 -13.689 1.00 0.00 N ATOM 1256 CZ ARG A 77 0.434 -10.240 -13.127 1.00 0.00 C ATOM 1257 NH1 ARG A 77 0.410 -10.346 -11.826 1.00 0.00 N ATOM 1258 NH2 ARG A 77 0.250 -11.298 -13.869 1.00 0.00 N ATOM 0 H ARG A 77 4.436 -5.912 -12.108 1.00 0.00 H new ATOM 0 HA ARG A 77 2.960 -4.775 -14.468 1.00 0.00 H new ATOM 0 HB2 ARG A 77 2.052 -5.927 -11.798 1.00 0.00 H new ATOM 0 HB3 ARG A 77 1.015 -4.865 -12.730 1.00 0.00 H new ATOM 0 HG2 ARG A 77 0.718 -6.421 -14.448 1.00 0.00 H new ATOM 0 HG3 ARG A 77 2.315 -7.114 -14.246 1.00 0.00 H new ATOM 0 HD2 ARG A 77 1.519 -8.098 -12.017 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -0.096 -7.543 -12.412 1.00 0.00 H new ATOM 0 HE ARG A 77 0.657 -9.000 -14.706 1.00 0.00 H new ATOM 0 HH11 ARG A 77 0.552 -9.520 -11.244 1.00 0.00 H new ATOM 0 HH12 ARG A 77 0.249 -11.255 -11.391 1.00 0.00 H new ATOM 0 HH21 ARG A 77 0.267 -11.217 -14.886 1.00 0.00 H new ATOM 0 HH22 ARG A 77 0.089 -12.206 -13.432 1.00 0.00 H new ATOM 1272 N VAL A 78 2.447 -2.543 -13.196 1.00 0.00 N ATOM 1273 CA VAL A 78 2.549 -1.173 -12.620 1.00 0.00 C ATOM 1274 C VAL A 78 1.258 -0.401 -12.903 1.00 0.00 C ATOM 1275 O VAL A 78 0.955 -0.070 -14.032 1.00 0.00 O ATOM 1276 CB VAL A 78 3.730 -0.438 -13.257 1.00 0.00 C ATOM 1277 CG1 VAL A 78 3.738 1.019 -12.790 1.00 0.00 C ATOM 1278 CG2 VAL A 78 5.037 -1.115 -12.836 1.00 0.00 C ATOM 0 H VAL A 78 1.745 -2.656 -13.928 1.00 0.00 H new ATOM 0 HA VAL A 78 2.702 -1.244 -11.543 1.00 0.00 H new ATOM 0 HB VAL A 78 3.635 -0.470 -14.342 1.00 0.00 H new ATOM 0 HG11 VAL A 78 4.580 1.542 -13.244 1.00 0.00 H new ATOM 0 HG12 VAL A 78 2.807 1.502 -13.088 1.00 0.00 H new ATOM 0 HG13 VAL A 78 3.833 1.053 -11.705 1.00 0.00 H new ATOM 0 HG21 VAL A 78 5.880 -0.593 -13.289 1.00 0.00 H new ATOM 0 HG22 VAL A 78 5.131 -1.082 -11.751 1.00 0.00 H new ATOM 0 HG23 VAL A 78 5.033 -2.153 -13.168 1.00 0.00 H new ATOM 1288 N ILE A 79 0.495 -0.109 -11.885 1.00 0.00 N ATOM 1289 CA ILE A 79 -0.774 0.643 -12.094 1.00 0.00 C ATOM 1290 C ILE A 79 -0.514 2.140 -11.909 1.00 0.00 C ATOM 1291 O ILE A 79 0.126 2.554 -10.962 1.00 0.00 O ATOM 1292 CB ILE A 79 -1.817 0.178 -11.076 1.00 0.00 C ATOM 1293 CG1 ILE A 79 -1.799 -1.348 -10.991 1.00 0.00 C ATOM 1294 CG2 ILE A 79 -3.205 0.651 -11.512 1.00 0.00 C ATOM 1295 CD1 ILE A 79 -2.398 -1.929 -12.268 1.00 0.00 C ATOM 0 H ILE A 79 0.696 -0.359 -10.917 1.00 0.00 H new ATOM 0 HA ILE A 79 -1.144 0.459 -13.103 1.00 0.00 H new ATOM 0 HB ILE A 79 -1.583 0.599 -10.098 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -0.777 -1.705 -10.859 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -2.368 -1.683 -10.123 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -3.947 0.319 -10.786 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -3.217 1.739 -11.571 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -3.442 0.232 -12.490 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -2.387 -3.018 -12.212 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -3.425 -1.581 -12.379 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -1.810 -1.604 -13.126 1.00 0.00 H new ATOM 1307 N ILE A 80 -1.002 2.956 -12.804 1.00 0.00 N ATOM 1308 CA ILE A 80 -0.775 4.425 -12.671 1.00 0.00 C ATOM 1309 C ILE A 80 -1.978 5.064 -11.974 1.00 0.00 C ATOM 1310 O ILE A 80 -2.987 4.428 -11.747 1.00 0.00 O ATOM 1311 CB ILE A 80 -0.597 5.055 -14.056 1.00 0.00 C ATOM 1312 CG1 ILE A 80 -0.079 4.004 -15.044 1.00 0.00 C ATOM 1313 CG2 ILE A 80 0.407 6.207 -13.959 1.00 0.00 C ATOM 1314 CD1 ILE A 80 0.445 4.691 -16.308 1.00 0.00 C ATOM 0 H ILE A 80 -1.546 2.671 -13.619 1.00 0.00 H new ATOM 0 HA ILE A 80 0.126 4.595 -12.082 1.00 0.00 H new ATOM 0 HB ILE A 80 -1.557 5.432 -14.409 1.00 0.00 H new ATOM 0 HG12 ILE A 80 0.716 3.418 -14.582 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -0.878 3.309 -15.302 1.00 0.00 H new ATOM 0 HG21 ILE A 80 0.538 6.659 -14.942 1.00 0.00 H new ATOM 0 HG22 ILE A 80 0.034 6.957 -13.261 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.365 5.826 -13.605 1.00 0.00 H new ATOM 0 HD11 ILE A 80 0.812 3.938 -17.006 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -0.361 5.257 -16.775 1.00 0.00 H new ATOM 0 HD13 ILE A 80 1.258 5.368 -16.044 1.00 0.00 H new ATOM 1326 N MET A 81 -1.878 6.320 -11.632 1.00 0.00 N ATOM 1327 CA MET A 81 -3.014 7.000 -10.949 1.00 0.00 C ATOM 1328 C MET A 81 -3.056 8.471 -11.371 1.00 0.00 C ATOM 1329 O MET A 81 -2.905 9.363 -10.560 1.00 0.00 O ATOM 1330 CB MET A 81 -2.828 6.909 -9.434 1.00 0.00 C ATOM 1331 CG MET A 81 -2.510 5.464 -9.044 1.00 0.00 C ATOM 1332 SD MET A 81 -2.119 5.387 -7.278 1.00 0.00 S ATOM 1333 CE MET A 81 -0.366 5.813 -7.416 1.00 0.00 C ATOM 0 H MET A 81 -1.058 6.904 -11.796 1.00 0.00 H new ATOM 0 HA MET A 81 -3.949 6.515 -11.229 1.00 0.00 H new ATOM 0 HB2 MET A 81 -2.021 7.569 -9.116 1.00 0.00 H new ATOM 0 HB3 MET A 81 -3.732 7.243 -8.925 1.00 0.00 H new ATOM 0 HG2 MET A 81 -3.361 4.820 -9.267 1.00 0.00 H new ATOM 0 HG3 MET A 81 -1.668 5.095 -9.630 1.00 0.00 H new ATOM 0 HE1 MET A 81 -0.089 6.482 -6.601 1.00 0.00 H new ATOM 0 HE2 MET A 81 0.235 4.905 -7.361 1.00 0.00 H new ATOM 0 HE3 MET A 81 -0.186 6.309 -8.370 1.00 0.00 H new ATOM 1343 N THR A 82 -3.262 8.730 -12.633 1.00 0.00 N ATOM 1344 CA THR A 82 -3.315 10.143 -13.106 1.00 0.00 C ATOM 1345 C THR A 82 -3.789 10.177 -14.561 1.00 0.00 C ATOM 1346 O THR A 82 -3.393 11.027 -15.333 1.00 0.00 O ATOM 1347 CB THR A 82 -1.919 10.765 -13.010 1.00 0.00 C ATOM 1348 OG1 THR A 82 -2.017 12.171 -13.190 1.00 0.00 O ATOM 1349 CG2 THR A 82 -1.018 10.172 -14.094 1.00 0.00 C ATOM 0 H THR A 82 -3.396 8.025 -13.357 1.00 0.00 H new ATOM 0 HA THR A 82 -4.009 10.709 -12.485 1.00 0.00 H new ATOM 0 HB THR A 82 -1.492 10.552 -12.030 1.00 0.00 H new ATOM 0 HG1 THR A 82 -2.596 12.363 -13.957 1.00 0.00 H new ATOM 0 HG21 THR A 82 -0.025 10.616 -14.024 1.00 0.00 H new ATOM 0 HG22 THR A 82 -0.944 9.093 -13.956 1.00 0.00 H new ATOM 0 HG23 THR A 82 -1.442 10.384 -15.076 1.00 0.00 H new ATOM 1357 N ALA A 83 -4.635 9.260 -14.940 1.00 0.00 N ATOM 1358 CA ALA A 83 -5.132 9.240 -16.345 1.00 0.00 C ATOM 1359 C ALA A 83 -5.545 10.654 -16.760 1.00 0.00 C ATOM 1360 O ALA A 83 -4.838 11.332 -17.479 1.00 0.00 O ATOM 1361 CB ALA A 83 -6.339 8.305 -16.446 1.00 0.00 C ATOM 0 H ALA A 83 -5.004 8.524 -14.338 1.00 0.00 H new ATOM 0 HA ALA A 83 -4.341 8.884 -17.005 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -6.703 8.290 -17.473 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -6.045 7.298 -16.151 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -7.130 8.660 -15.786 1.00 0.00 H new ATOM 1367 N TYR A 84 -6.686 11.104 -16.314 1.00 0.00 N ATOM 1368 CA TYR A 84 -7.143 12.473 -16.684 1.00 0.00 C ATOM 1369 C TYR A 84 -5.992 13.462 -16.495 1.00 0.00 C ATOM 1370 O TYR A 84 -5.704 13.893 -15.395 1.00 0.00 O ATOM 1371 CB TYR A 84 -8.316 12.878 -15.789 1.00 0.00 C ATOM 1372 CG TYR A 84 -8.704 14.307 -16.084 1.00 0.00 C ATOM 1373 CD1 TYR A 84 -8.517 14.833 -17.367 1.00 0.00 C ATOM 1374 CD2 TYR A 84 -9.250 15.106 -15.072 1.00 0.00 C ATOM 1375 CE1 TYR A 84 -8.877 16.157 -17.640 1.00 0.00 C ATOM 1376 CE2 TYR A 84 -9.610 16.431 -15.345 1.00 0.00 C ATOM 1377 CZ TYR A 84 -9.424 16.957 -16.629 1.00 0.00 C ATOM 1378 OH TYR A 84 -9.778 18.263 -16.898 1.00 0.00 O ATOM 0 H TYR A 84 -7.321 10.583 -15.710 1.00 0.00 H new ATOM 0 HA TYR A 84 -7.462 12.481 -17.726 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -9.165 12.216 -15.962 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -8.040 12.774 -14.740 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -8.095 14.217 -18.147 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -9.393 14.700 -14.081 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -8.733 16.562 -18.631 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -10.031 17.048 -14.565 1.00 0.00 H new ATOM 0 HH TYR A 84 -10.143 18.677 -16.088 1.00 0.00 H new ATOM 1388 N GLY A 85 -5.330 13.827 -17.559 1.00 0.00 N ATOM 1389 CA GLY A 85 -4.198 14.790 -17.439 1.00 0.00 C ATOM 1390 C GLY A 85 -3.047 14.338 -18.339 1.00 0.00 C ATOM 1391 O GLY A 85 -2.830 14.880 -19.404 1.00 0.00 O ATOM 0 H GLY A 85 -5.524 13.500 -18.506 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -4.525 15.790 -17.724 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -3.863 14.847 -16.403 1.00 0.00 H new ATOM 1395 N GLU A 86 -2.304 13.351 -17.918 1.00 0.00 N ATOM 1396 CA GLU A 86 -1.167 12.866 -18.750 1.00 0.00 C ATOM 1397 C GLU A 86 -1.692 11.924 -19.835 1.00 0.00 C ATOM 1398 O GLU A 86 -2.675 11.234 -19.649 1.00 0.00 O ATOM 1399 CB GLU A 86 -0.170 12.117 -17.863 1.00 0.00 C ATOM 1400 CG GLU A 86 1.168 12.859 -17.859 1.00 0.00 C ATOM 1401 CD GLU A 86 2.014 12.380 -16.678 1.00 0.00 C ATOM 1402 OE1 GLU A 86 2.504 11.264 -16.739 1.00 0.00 O ATOM 1403 OE2 GLU A 86 2.160 13.138 -15.733 1.00 0.00 O ATOM 0 H GLU A 86 -2.435 12.860 -17.034 1.00 0.00 H new ATOM 0 HA GLU A 86 -0.671 13.717 -19.218 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -0.558 12.039 -16.847 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -0.033 11.100 -18.230 1.00 0.00 H new ATOM 0 HG2 GLU A 86 1.697 12.681 -18.795 1.00 0.00 H new ATOM 0 HG3 GLU A 86 1.000 13.934 -17.787 1.00 0.00 H new ATOM 1410 N LEU A 87 -1.046 11.892 -20.969 1.00 0.00 N ATOM 1411 CA LEU A 87 -1.510 10.994 -22.065 1.00 0.00 C ATOM 1412 C LEU A 87 -0.366 10.767 -23.057 1.00 0.00 C ATOM 1413 O LEU A 87 -0.583 10.423 -24.202 1.00 0.00 O ATOM 1414 CB LEU A 87 -2.694 11.645 -22.784 1.00 0.00 C ATOM 1415 CG LEU A 87 -3.687 10.567 -23.225 1.00 0.00 C ATOM 1416 CD1 LEU A 87 -3.035 9.669 -24.276 1.00 0.00 C ATOM 1417 CD2 LEU A 87 -4.098 9.724 -22.016 1.00 0.00 C ATOM 0 H LEU A 87 -0.218 12.448 -21.184 1.00 0.00 H new ATOM 0 HA LEU A 87 -1.820 10.036 -21.648 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -3.186 12.358 -22.122 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.342 12.205 -23.650 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.570 11.042 -23.653 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.743 8.902 -24.589 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.746 10.269 -25.139 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.151 9.194 -23.851 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.805 8.957 -22.331 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -3.216 9.250 -21.586 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.566 10.364 -21.268 1.00 0.00 H new ATOM 1429 N ASP A 88 0.853 10.951 -22.627 1.00 0.00 N ATOM 1430 CA ASP A 88 2.008 10.738 -23.544 1.00 0.00 C ATOM 1431 C ASP A 88 2.530 9.312 -23.369 1.00 0.00 C ATOM 1432 O ASP A 88 2.191 8.420 -24.122 1.00 0.00 O ATOM 1433 CB ASP A 88 3.120 11.734 -23.207 1.00 0.00 C ATOM 1434 CG ASP A 88 2.843 13.065 -23.909 1.00 0.00 C ATOM 1435 OD1 ASP A 88 1.814 13.169 -24.554 1.00 0.00 O ATOM 1436 OD2 ASP A 88 3.667 13.957 -23.791 1.00 0.00 O ATOM 0 H ASP A 88 1.098 11.240 -21.680 1.00 0.00 H new ATOM 0 HA ASP A 88 1.690 10.889 -24.576 1.00 0.00 H new ATOM 0 HB2 ASP A 88 3.174 11.884 -22.129 1.00 0.00 H new ATOM 0 HB3 ASP A 88 4.085 11.338 -23.523 1.00 0.00 H new ATOM 1441 N MET A 89 3.344 9.085 -22.375 1.00 0.00 N ATOM 1442 CA MET A 89 3.876 7.712 -22.146 1.00 0.00 C ATOM 1443 C MET A 89 2.848 6.901 -21.352 1.00 0.00 C ATOM 1444 O MET A 89 3.114 5.797 -20.920 1.00 0.00 O ATOM 1445 CB MET A 89 5.183 7.796 -21.355 1.00 0.00 C ATOM 1446 CG MET A 89 6.351 7.387 -22.255 1.00 0.00 C ATOM 1447 SD MET A 89 7.399 6.198 -21.380 1.00 0.00 S ATOM 1448 CE MET A 89 8.559 5.880 -22.732 1.00 0.00 C ATOM 0 H MET A 89 3.664 9.791 -21.712 1.00 0.00 H new ATOM 0 HA MET A 89 4.065 7.227 -23.104 1.00 0.00 H new ATOM 0 HB2 MET A 89 5.332 8.811 -20.986 1.00 0.00 H new ATOM 0 HB3 MET A 89 5.136 7.143 -20.483 1.00 0.00 H new ATOM 0 HG2 MET A 89 5.976 6.946 -23.179 1.00 0.00 H new ATOM 0 HG3 MET A 89 6.934 8.265 -22.534 1.00 0.00 H new ATOM 0 HE1 MET A 89 9.309 5.159 -22.406 1.00 0.00 H new ATOM 0 HE2 MET A 89 8.018 5.479 -23.589 1.00 0.00 H new ATOM 0 HE3 MET A 89 9.050 6.811 -23.016 1.00 0.00 H new ATOM 1458 N ILE A 90 1.675 7.441 -21.163 1.00 0.00 N ATOM 1459 CA ILE A 90 0.622 6.702 -20.401 1.00 0.00 C ATOM 1460 C ILE A 90 -0.215 5.872 -21.384 1.00 0.00 C ATOM 1461 O ILE A 90 -0.284 4.663 -21.285 1.00 0.00 O ATOM 1462 CB ILE A 90 -0.268 7.700 -19.616 1.00 0.00 C ATOM 1463 CG1 ILE A 90 -1.730 7.230 -19.593 1.00 0.00 C ATOM 1464 CG2 ILE A 90 -0.211 9.086 -20.258 1.00 0.00 C ATOM 1465 CD1 ILE A 90 -2.545 8.143 -18.677 1.00 0.00 C ATOM 0 H ILE A 90 1.398 8.362 -21.502 1.00 0.00 H new ATOM 0 HA ILE A 90 1.088 6.032 -19.678 1.00 0.00 H new ATOM 0 HB ILE A 90 0.113 7.748 -18.596 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -2.144 7.245 -20.601 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -1.786 6.200 -19.241 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -0.841 9.774 -19.695 1.00 0.00 H new ATOM 0 HG22 ILE A 90 0.817 9.448 -20.252 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -0.568 9.026 -21.286 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -3.583 7.810 -18.661 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -2.136 8.105 -17.668 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -2.499 9.167 -19.049 1.00 0.00 H new ATOM 1477 N GLN A 91 -0.851 6.510 -22.326 1.00 0.00 N ATOM 1478 CA GLN A 91 -1.681 5.754 -23.307 1.00 0.00 C ATOM 1479 C GLN A 91 -0.838 4.649 -23.945 1.00 0.00 C ATOM 1480 O GLN A 91 -1.321 3.568 -24.220 1.00 0.00 O ATOM 1481 CB GLN A 91 -2.181 6.707 -24.395 1.00 0.00 C ATOM 1482 CG GLN A 91 -2.770 5.899 -25.553 1.00 0.00 C ATOM 1483 CD GLN A 91 -3.981 5.106 -25.057 1.00 0.00 C ATOM 1484 OE1 GLN A 91 -4.319 5.156 -23.892 1.00 0.00 O ATOM 1485 NE2 GLN A 91 -4.651 4.369 -25.901 1.00 0.00 N ATOM 0 H GLN A 91 -0.833 7.521 -22.460 1.00 0.00 H new ATOM 0 HA GLN A 91 -2.534 5.309 -22.794 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -2.936 7.379 -23.986 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -1.361 7.329 -24.753 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -3.065 6.566 -26.363 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -2.018 5.221 -25.957 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -4.366 4.328 -26.880 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -5.459 3.835 -25.582 1.00 0.00 H new ATOM 1494 N GLU A 92 0.419 4.907 -24.180 1.00 0.00 N ATOM 1495 CA GLU A 92 1.289 3.868 -24.800 1.00 0.00 C ATOM 1496 C GLU A 92 1.935 3.021 -23.701 1.00 0.00 C ATOM 1497 O GLU A 92 2.429 1.939 -23.948 1.00 0.00 O ATOM 1498 CB GLU A 92 2.381 4.546 -25.630 1.00 0.00 C ATOM 1499 CG GLU A 92 1.949 4.600 -27.097 1.00 0.00 C ATOM 1500 CD GLU A 92 2.970 5.403 -27.902 1.00 0.00 C ATOM 1501 OE1 GLU A 92 3.183 6.557 -27.568 1.00 0.00 O ATOM 1502 OE2 GLU A 92 3.524 4.852 -28.838 1.00 0.00 O ATOM 0 H GLU A 92 0.881 5.792 -23.970 1.00 0.00 H new ATOM 0 HA GLU A 92 0.687 3.228 -25.445 1.00 0.00 H new ATOM 0 HB2 GLU A 92 2.563 5.554 -25.256 1.00 0.00 H new ATOM 0 HB3 GLU A 92 3.318 3.997 -25.536 1.00 0.00 H new ATOM 0 HG2 GLU A 92 1.866 3.591 -27.500 1.00 0.00 H new ATOM 0 HG3 GLU A 92 0.964 5.058 -27.180 1.00 0.00 H new ATOM 1509 N SER A 93 1.935 3.505 -22.490 1.00 0.00 N ATOM 1510 CA SER A 93 2.548 2.728 -21.377 1.00 0.00 C ATOM 1511 C SER A 93 1.867 1.362 -21.272 1.00 0.00 C ATOM 1512 O SER A 93 2.385 0.445 -20.665 1.00 0.00 O ATOM 1513 CB SER A 93 2.368 3.489 -20.064 1.00 0.00 C ATOM 1514 OG SER A 93 3.639 3.908 -19.586 1.00 0.00 O ATOM 0 H SER A 93 1.537 4.405 -22.223 1.00 0.00 H new ATOM 0 HA SER A 93 3.611 2.590 -21.574 1.00 0.00 H new ATOM 0 HB2 SER A 93 1.721 4.353 -20.217 1.00 0.00 H new ATOM 0 HB3 SER A 93 1.881 2.853 -19.325 1.00 0.00 H new ATOM 0 HG SER A 93 3.719 4.880 -19.678 1.00 0.00 H new ATOM 1520 N LYS A 94 0.710 1.219 -21.856 1.00 0.00 N ATOM 1521 CA LYS A 94 -0.004 -0.088 -21.787 1.00 0.00 C ATOM 1522 C LYS A 94 0.840 -1.168 -22.468 1.00 0.00 C ATOM 1523 O LYS A 94 1.327 -2.082 -21.834 1.00 0.00 O ATOM 1524 CB LYS A 94 -1.354 0.029 -22.496 1.00 0.00 C ATOM 1525 CG LYS A 94 -2.412 -0.751 -21.713 1.00 0.00 C ATOM 1526 CD LYS A 94 -3.270 0.223 -20.903 1.00 0.00 C ATOM 1527 CE LYS A 94 -4.423 0.733 -21.770 1.00 0.00 C ATOM 1528 NZ LYS A 94 -5.209 -0.426 -22.280 1.00 0.00 N ATOM 0 H LYS A 94 0.227 1.950 -22.378 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.165 -0.358 -20.743 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.645 1.076 -22.576 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.278 -0.360 -23.512 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -3.039 -1.322 -22.398 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -1.932 -1.469 -21.048 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -3.661 -0.273 -20.015 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -2.662 1.060 -20.559 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -5.065 1.394 -21.188 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -4.035 1.318 -22.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -6.224 -0.204 -22.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -4.941 -0.621 -23.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -5.011 -1.263 -21.696 1.00 0.00 H new ATOM 1542 N GLU A 95 1.016 -1.070 -23.758 1.00 0.00 N ATOM 1543 CA GLU A 95 1.826 -2.091 -24.479 1.00 0.00 C ATOM 1544 C GLU A 95 3.225 -2.166 -23.860 1.00 0.00 C ATOM 1545 O GLU A 95 3.842 -3.211 -23.824 1.00 0.00 O ATOM 1546 CB GLU A 95 1.942 -1.703 -25.954 1.00 0.00 C ATOM 1547 CG GLU A 95 0.555 -1.363 -26.504 1.00 0.00 C ATOM 1548 CD GLU A 95 -0.436 -2.460 -26.107 1.00 0.00 C ATOM 1549 OE1 GLU A 95 -0.031 -3.610 -26.069 1.00 0.00 O ATOM 1550 OE2 GLU A 95 -1.582 -2.131 -25.849 1.00 0.00 O ATOM 0 H GLU A 95 0.634 -0.327 -24.343 1.00 0.00 H new ATOM 0 HA GLU A 95 1.340 -3.063 -24.396 1.00 0.00 H new ATOM 0 HB2 GLU A 95 2.608 -0.847 -26.064 1.00 0.00 H new ATOM 0 HB3 GLU A 95 2.379 -2.523 -26.523 1.00 0.00 H new ATOM 0 HG2 GLU A 95 0.224 -0.401 -26.114 1.00 0.00 H new ATOM 0 HG3 GLU A 95 0.595 -1.270 -27.589 1.00 0.00 H new ATOM 1557 N LEU A 96 3.728 -1.065 -23.374 1.00 0.00 N ATOM 1558 CA LEU A 96 5.085 -1.075 -22.760 1.00 0.00 C ATOM 1559 C LEU A 96 5.071 -1.952 -21.506 1.00 0.00 C ATOM 1560 O LEU A 96 6.046 -2.598 -21.178 1.00 0.00 O ATOM 1561 CB LEU A 96 5.483 0.353 -22.380 1.00 0.00 C ATOM 1562 CG LEU A 96 5.950 1.102 -23.628 1.00 0.00 C ATOM 1563 CD1 LEU A 96 5.402 2.530 -23.604 1.00 0.00 C ATOM 1564 CD2 LEU A 96 7.480 1.145 -23.652 1.00 0.00 C ATOM 0 H LEU A 96 3.258 -0.160 -23.376 1.00 0.00 H new ATOM 0 HA LEU A 96 5.805 -1.475 -23.475 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.636 0.870 -21.928 1.00 0.00 H new ATOM 0 HB3 LEU A 96 6.279 0.334 -21.635 1.00 0.00 H new ATOM 0 HG LEU A 96 5.584 0.588 -24.517 1.00 0.00 H new ATOM 0 HD11 LEU A 96 5.736 3.063 -24.494 1.00 0.00 H new ATOM 0 HD12 LEU A 96 4.313 2.501 -23.585 1.00 0.00 H new ATOM 0 HD13 LEU A 96 5.767 3.045 -22.715 1.00 0.00 H new ATOM 0 HD21 LEU A 96 7.815 1.679 -24.541 1.00 0.00 H new ATOM 0 HD22 LEU A 96 7.844 1.659 -22.762 1.00 0.00 H new ATOM 0 HD23 LEU A 96 7.872 0.128 -23.670 1.00 0.00 H new ATOM 1576 N GLY A 97 3.972 -1.980 -20.803 1.00 0.00 N ATOM 1577 CA GLY A 97 3.897 -2.817 -19.571 1.00 0.00 C ATOM 1578 C GLY A 97 3.119 -2.066 -18.489 1.00 0.00 C ATOM 1579 O GLY A 97 3.470 -2.093 -17.326 1.00 0.00 O ATOM 0 H GLY A 97 3.124 -1.460 -21.028 1.00 0.00 H new ATOM 0 HA2 GLY A 97 3.408 -3.766 -19.793 1.00 0.00 H new ATOM 0 HA3 GLY A 97 4.901 -3.051 -19.216 1.00 0.00 H new ATOM 1583 N ALA A 98 2.062 -1.398 -18.861 1.00 0.00 N ATOM 1584 CA ALA A 98 1.262 -0.648 -17.853 1.00 0.00 C ATOM 1585 C ALA A 98 -0.113 -1.304 -17.705 1.00 0.00 C ATOM 1586 O ALA A 98 -0.985 -1.131 -18.535 1.00 0.00 O ATOM 1587 CB ALA A 98 1.089 0.801 -18.312 1.00 0.00 C ATOM 0 H ALA A 98 1.718 -1.339 -19.819 1.00 0.00 H new ATOM 0 HA ALA A 98 1.779 -0.664 -16.894 1.00 0.00 H new ATOM 0 HB1 ALA A 98 0.503 1.349 -17.574 1.00 0.00 H new ATOM 0 HB2 ALA A 98 2.068 1.268 -18.418 1.00 0.00 H new ATOM 0 HB3 ALA A 98 0.572 0.819 -19.271 1.00 0.00 H new ATOM 1593 N LEU A 99 -0.314 -2.054 -16.658 1.00 0.00 N ATOM 1594 CA LEU A 99 -1.632 -2.720 -16.458 1.00 0.00 C ATOM 1595 C LEU A 99 -2.755 -1.729 -16.769 1.00 0.00 C ATOM 1596 O LEU A 99 -3.290 -1.703 -17.860 1.00 0.00 O ATOM 1597 CB LEU A 99 -1.754 -3.187 -15.007 1.00 0.00 C ATOM 1598 CG LEU A 99 -0.979 -4.493 -14.822 1.00 0.00 C ATOM 1599 CD1 LEU A 99 -1.219 -5.033 -13.411 1.00 0.00 C ATOM 1600 CD2 LEU A 99 -1.462 -5.521 -15.848 1.00 0.00 C ATOM 0 H LEU A 99 0.378 -2.235 -15.931 1.00 0.00 H new ATOM 0 HA LEU A 99 -1.709 -3.580 -17.124 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -1.365 -2.423 -14.334 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -2.803 -3.335 -14.749 1.00 0.00 H new ATOM 0 HG LEU A 99 0.086 -4.307 -14.965 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -0.667 -5.964 -13.279 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -0.878 -4.301 -12.679 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -2.284 -5.219 -13.269 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -0.911 -6.452 -15.717 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -2.526 -5.706 -15.704 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -1.293 -5.138 -16.854 1.00 0.00 H new ATOM 1612 N THR A 100 -3.116 -0.911 -15.818 1.00 0.00 N ATOM 1613 CA THR A 100 -4.203 0.079 -16.060 1.00 0.00 C ATOM 1614 C THR A 100 -3.745 1.461 -15.594 1.00 0.00 C ATOM 1615 O THR A 100 -2.710 1.607 -14.974 1.00 0.00 O ATOM 1616 CB THR A 100 -5.453 -0.337 -15.278 1.00 0.00 C ATOM 1617 OG1 THR A 100 -6.400 0.723 -15.308 1.00 0.00 O ATOM 1618 CG2 THR A 100 -5.073 -0.644 -13.830 1.00 0.00 C ATOM 0 H THR A 100 -2.705 -0.886 -14.885 1.00 0.00 H new ATOM 0 HA THR A 100 -4.435 0.114 -17.124 1.00 0.00 H new ATOM 0 HB THR A 100 -5.888 -1.228 -15.732 1.00 0.00 H new ATOM 0 HG1 THR A 100 -7.202 0.459 -14.810 1.00 0.00 H new ATOM 0 HG21 THR A 100 -5.963 -0.940 -13.275 1.00 0.00 H new ATOM 0 HG22 THR A 100 -4.346 -1.456 -13.809 1.00 0.00 H new ATOM 0 HG23 THR A 100 -4.638 0.244 -13.372 1.00 0.00 H new ATOM 1626 N HIS A 101 -4.507 2.479 -15.887 1.00 0.00 N ATOM 1627 CA HIS A 101 -4.114 3.851 -15.460 1.00 0.00 C ATOM 1628 C HIS A 101 -5.301 4.526 -14.768 1.00 0.00 C ATOM 1629 O HIS A 101 -6.143 5.128 -15.406 1.00 0.00 O ATOM 1630 CB HIS A 101 -3.707 4.668 -16.689 1.00 0.00 C ATOM 1631 CG HIS A 101 -3.025 5.932 -16.245 1.00 0.00 C ATOM 1632 ND1 HIS A 101 -1.804 6.335 -16.763 1.00 0.00 N ATOM 1633 CD2 HIS A 101 -3.380 6.894 -15.332 1.00 0.00 C ATOM 1634 CE1 HIS A 101 -1.471 7.493 -16.163 1.00 0.00 C ATOM 1635 NE2 HIS A 101 -2.397 7.878 -15.281 1.00 0.00 N ATOM 0 H HIS A 101 -5.385 2.420 -16.404 1.00 0.00 H new ATOM 0 HA HIS A 101 -3.274 3.793 -14.768 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -3.039 4.084 -17.322 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -4.586 4.907 -17.288 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -1.257 5.843 -17.470 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -4.285 6.888 -14.743 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -0.565 8.044 -16.370 1.00 0.00 H new ATOM 1643 N PHE A 102 -5.377 4.430 -13.469 1.00 0.00 N ATOM 1644 CA PHE A 102 -6.512 5.065 -12.740 1.00 0.00 C ATOM 1645 C PHE A 102 -6.331 6.584 -12.732 1.00 0.00 C ATOM 1646 O PHE A 102 -5.232 7.088 -12.850 1.00 0.00 O ATOM 1647 CB PHE A 102 -6.548 4.548 -11.300 1.00 0.00 C ATOM 1648 CG PHE A 102 -7.204 3.188 -11.267 1.00 0.00 C ATOM 1649 CD1 PHE A 102 -8.384 2.963 -11.986 1.00 0.00 C ATOM 1650 CD2 PHE A 102 -6.634 2.154 -10.517 1.00 0.00 C ATOM 1651 CE1 PHE A 102 -8.993 1.702 -11.955 1.00 0.00 C ATOM 1652 CE2 PHE A 102 -7.242 0.894 -10.485 1.00 0.00 C ATOM 1653 CZ PHE A 102 -8.422 0.668 -11.204 1.00 0.00 C ATOM 0 H PHE A 102 -4.703 3.940 -12.881 1.00 0.00 H new ATOM 0 HA PHE A 102 -7.448 4.814 -13.240 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -5.536 4.485 -10.900 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -7.098 5.244 -10.667 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -8.825 3.762 -12.564 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -5.724 2.328 -9.962 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -9.903 1.528 -12.510 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -6.801 0.096 -9.906 1.00 0.00 H new ATOM 0 HZ PHE A 102 -8.892 -0.304 -11.179 1.00 0.00 H new ATOM 1663 N ALA A 103 -7.402 7.317 -12.592 1.00 0.00 N ATOM 1664 CA ALA A 103 -7.292 8.803 -12.576 1.00 0.00 C ATOM 1665 C ALA A 103 -7.916 9.347 -11.288 1.00 0.00 C ATOM 1666 O ALA A 103 -7.890 8.707 -10.256 1.00 0.00 O ATOM 1667 CB ALA A 103 -8.029 9.382 -13.785 1.00 0.00 C ATOM 0 H ALA A 103 -8.348 6.951 -12.488 1.00 0.00 H new ATOM 0 HA ALA A 103 -6.241 9.090 -12.620 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -7.949 10.469 -13.774 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -7.584 8.995 -14.702 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.080 9.095 -13.742 1.00 0.00 H new ATOM 1673 N LYS A 104 -8.477 10.525 -11.341 1.00 0.00 N ATOM 1674 CA LYS A 104 -9.102 11.108 -10.121 1.00 0.00 C ATOM 1675 C LYS A 104 -10.623 10.937 -10.192 1.00 0.00 C ATOM 1676 O LYS A 104 -11.172 10.726 -11.256 1.00 0.00 O ATOM 1677 CB LYS A 104 -8.762 12.598 -10.037 1.00 0.00 C ATOM 1678 CG LYS A 104 -8.828 13.217 -11.434 1.00 0.00 C ATOM 1679 CD LYS A 104 -8.861 14.742 -11.316 1.00 0.00 C ATOM 1680 CE LYS A 104 -10.271 15.193 -10.929 1.00 0.00 C ATOM 1681 NZ LYS A 104 -10.239 15.817 -9.576 1.00 0.00 N ATOM 0 H LYS A 104 -8.529 11.108 -12.176 1.00 0.00 H new ATOM 0 HA LYS A 104 -8.720 10.596 -9.238 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -9.460 13.104 -9.370 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -7.766 12.731 -9.616 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -7.965 12.906 -12.022 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -9.715 12.863 -11.959 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -8.143 15.075 -10.567 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -8.569 15.197 -12.262 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -10.650 15.906 -11.661 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -10.951 14.341 -10.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -11.212 15.969 -9.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -9.740 15.188 -8.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -9.743 16.730 -9.626 1.00 0.00 H new ATOM 1695 N PRO A 105 -11.257 11.033 -9.050 1.00 0.00 N ATOM 1696 CA PRO A 105 -10.578 11.289 -7.766 1.00 0.00 C ATOM 1697 C PRO A 105 -9.948 10.006 -7.216 1.00 0.00 C ATOM 1698 O PRO A 105 -9.524 9.951 -6.079 1.00 0.00 O ATOM 1699 CB PRO A 105 -11.707 11.773 -6.854 1.00 0.00 C ATOM 1700 CG PRO A 105 -13.023 11.231 -7.465 1.00 0.00 C ATOM 1701 CD PRO A 105 -12.723 10.902 -8.940 1.00 0.00 C ATOM 0 HA PRO A 105 -9.764 12.008 -7.854 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -11.570 11.405 -5.837 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -11.723 12.862 -6.800 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -13.361 10.343 -6.931 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -13.819 11.971 -7.388 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -13.053 9.896 -9.199 1.00 0.00 H new ATOM 0 HD3 PRO A 105 -13.236 11.589 -9.613 1.00 0.00 H new ATOM 1709 N PHE A 106 -9.882 8.977 -8.012 1.00 0.00 N ATOM 1710 CA PHE A 106 -9.279 7.705 -7.534 1.00 0.00 C ATOM 1711 C PHE A 106 -10.264 6.984 -6.612 1.00 0.00 C ATOM 1712 O PHE A 106 -10.385 7.302 -5.447 1.00 0.00 O ATOM 1713 CB PHE A 106 -7.989 8.007 -6.766 1.00 0.00 C ATOM 1714 CG PHE A 106 -6.986 6.906 -7.012 1.00 0.00 C ATOM 1715 CD1 PHE A 106 -6.427 6.740 -8.285 1.00 0.00 C ATOM 1716 CD2 PHE A 106 -6.614 6.051 -5.967 1.00 0.00 C ATOM 1717 CE1 PHE A 106 -5.496 5.720 -8.513 1.00 0.00 C ATOM 1718 CE2 PHE A 106 -5.683 5.031 -6.196 1.00 0.00 C ATOM 1719 CZ PHE A 106 -5.123 4.866 -7.469 1.00 0.00 C ATOM 0 H PHE A 106 -10.220 8.963 -8.974 1.00 0.00 H new ATOM 0 HA PHE A 106 -9.053 7.069 -8.390 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -7.579 8.965 -7.086 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -8.199 8.090 -5.700 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -6.714 7.399 -9.091 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -7.045 6.179 -4.985 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -5.065 5.592 -9.495 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -5.396 4.371 -5.391 1.00 0.00 H new ATOM 0 HZ PHE A 106 -4.404 4.080 -7.645 1.00 0.00 H new ATOM 1729 N ASP A 107 -10.969 6.012 -7.125 1.00 0.00 N ATOM 1730 CA ASP A 107 -11.944 5.272 -6.277 1.00 0.00 C ATOM 1731 C ASP A 107 -11.243 4.080 -5.623 1.00 0.00 C ATOM 1732 O ASP A 107 -10.820 3.157 -6.288 1.00 0.00 O ATOM 1733 CB ASP A 107 -13.098 4.768 -7.147 1.00 0.00 C ATOM 1734 CG ASP A 107 -13.974 3.816 -6.333 1.00 0.00 C ATOM 1735 OD1 ASP A 107 -13.977 3.937 -5.118 1.00 0.00 O ATOM 1736 OD2 ASP A 107 -14.626 2.980 -6.936 1.00 0.00 O ATOM 0 H ASP A 107 -10.911 5.699 -8.094 1.00 0.00 H new ATOM 0 HA ASP A 107 -12.334 5.936 -5.506 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -13.692 5.609 -7.505 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -12.707 4.257 -8.027 1.00 0.00 H new ATOM 1741 N ILE A 108 -11.115 4.093 -4.325 1.00 0.00 N ATOM 1742 CA ILE A 108 -10.440 2.959 -3.631 1.00 0.00 C ATOM 1743 C ILE A 108 -10.989 1.634 -4.166 1.00 0.00 C ATOM 1744 O ILE A 108 -10.257 0.684 -4.367 1.00 0.00 O ATOM 1745 CB ILE A 108 -10.702 3.053 -2.127 1.00 0.00 C ATOM 1746 CG1 ILE A 108 -9.880 4.203 -1.540 1.00 0.00 C ATOM 1747 CG2 ILE A 108 -10.296 1.743 -1.451 1.00 0.00 C ATOM 1748 CD1 ILE A 108 -8.406 4.014 -1.904 1.00 0.00 C ATOM 0 H ILE A 108 -11.448 4.839 -3.715 1.00 0.00 H new ATOM 0 HA ILE A 108 -9.367 3.007 -3.815 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.763 3.235 -1.955 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -10.241 5.156 -1.925 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -9.997 4.232 -0.457 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -10.484 1.813 -0.380 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -10.879 0.922 -1.869 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -9.235 1.559 -1.622 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -7.820 4.833 -1.486 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -8.049 3.068 -1.497 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -8.297 4.007 -2.989 1.00 0.00 H new ATOM 1760 N ASP A 109 -12.270 1.562 -4.398 1.00 0.00 N ATOM 1761 CA ASP A 109 -12.863 0.297 -4.918 1.00 0.00 C ATOM 1762 C ASP A 109 -12.261 -0.025 -6.288 1.00 0.00 C ATOM 1763 O ASP A 109 -11.939 -1.159 -6.584 1.00 0.00 O ATOM 1764 CB ASP A 109 -14.378 0.461 -5.052 1.00 0.00 C ATOM 1765 CG ASP A 109 -15.017 0.468 -3.663 1.00 0.00 C ATOM 1766 OD1 ASP A 109 -14.364 0.030 -2.729 1.00 0.00 O ATOM 1767 OD2 ASP A 109 -16.148 0.912 -3.555 1.00 0.00 O ATOM 0 H ASP A 109 -12.932 2.324 -4.250 1.00 0.00 H new ATOM 0 HA ASP A 109 -12.645 -0.517 -4.226 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -14.609 1.389 -5.574 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -14.791 -0.352 -5.649 1.00 0.00 H new ATOM 1772 N GLU A 110 -12.107 0.963 -7.126 1.00 0.00 N ATOM 1773 CA GLU A 110 -11.528 0.712 -8.477 1.00 0.00 C ATOM 1774 C GLU A 110 -10.060 0.302 -8.336 1.00 0.00 C ATOM 1775 O GLU A 110 -9.529 -0.423 -9.154 1.00 0.00 O ATOM 1776 CB GLU A 110 -11.623 1.988 -9.317 1.00 0.00 C ATOM 1777 CG GLU A 110 -11.557 1.627 -10.802 1.00 0.00 C ATOM 1778 CD GLU A 110 -12.963 1.313 -11.315 1.00 0.00 C ATOM 1779 OE1 GLU A 110 -13.867 2.070 -11.007 1.00 0.00 O ATOM 1780 OE2 GLU A 110 -13.111 0.319 -12.007 1.00 0.00 O ATOM 0 H GLU A 110 -12.357 1.933 -6.934 1.00 0.00 H new ATOM 0 HA GLU A 110 -12.083 -0.088 -8.967 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -12.555 2.511 -9.100 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -10.810 2.667 -9.060 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -11.128 2.453 -11.369 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -10.904 0.766 -10.949 1.00 0.00 H new ATOM 1787 N ILE A 111 -9.402 0.758 -7.307 1.00 0.00 N ATOM 1788 CA ILE A 111 -7.970 0.393 -7.116 1.00 0.00 C ATOM 1789 C ILE A 111 -7.865 -1.091 -6.760 1.00 0.00 C ATOM 1790 O ILE A 111 -7.244 -1.865 -7.461 1.00 0.00 O ATOM 1791 CB ILE A 111 -7.378 1.231 -5.981 1.00 0.00 C ATOM 1792 CG1 ILE A 111 -7.692 2.710 -6.221 1.00 0.00 C ATOM 1793 CG2 ILE A 111 -5.863 1.034 -5.937 1.00 0.00 C ATOM 1794 CD1 ILE A 111 -7.298 3.093 -7.649 1.00 0.00 C ATOM 0 H ILE A 111 -9.794 1.368 -6.589 1.00 0.00 H new ATOM 0 HA ILE A 111 -7.420 0.586 -8.037 1.00 0.00 H new ATOM 0 HB ILE A 111 -7.813 0.915 -5.033 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -8.754 2.897 -6.064 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -7.150 3.328 -5.505 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -5.442 1.631 -5.128 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -5.638 -0.019 -5.766 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -5.427 1.349 -6.885 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -7.522 4.146 -7.818 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -6.231 2.922 -7.790 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -7.860 2.484 -8.357 1.00 0.00 H new ATOM 1806 N ARG A 112 -8.468 -1.494 -5.675 1.00 0.00 N ATOM 1807 CA ARG A 112 -8.403 -2.927 -5.275 1.00 0.00 C ATOM 1808 C ARG A 112 -9.107 -3.785 -6.328 1.00 0.00 C ATOM 1809 O ARG A 112 -8.885 -4.977 -6.421 1.00 0.00 O ATOM 1810 CB ARG A 112 -9.096 -3.110 -3.922 1.00 0.00 C ATOM 1811 CG ARG A 112 -10.411 -2.330 -3.912 1.00 0.00 C ATOM 1812 CD ARG A 112 -11.359 -2.939 -2.878 1.00 0.00 C ATOM 1813 NE ARG A 112 -12.713 -3.098 -3.479 1.00 0.00 N ATOM 1814 CZ ARG A 112 -13.708 -3.530 -2.750 1.00 0.00 C ATOM 1815 NH1 ARG A 112 -13.521 -3.825 -1.492 1.00 0.00 N ATOM 1816 NH2 ARG A 112 -14.892 -3.667 -3.282 1.00 0.00 N ATOM 0 H ARG A 112 -9.003 -0.892 -5.049 1.00 0.00 H new ATOM 0 HA ARG A 112 -7.360 -3.234 -5.195 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -9.287 -4.168 -3.739 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -8.447 -2.760 -3.119 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -10.223 -1.283 -3.676 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -10.869 -2.356 -4.901 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -10.980 -3.906 -2.547 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -11.413 -2.299 -1.997 1.00 0.00 H new ATOM 0 HE ARG A 112 -12.864 -2.869 -4.462 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -12.596 -3.719 -1.075 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -14.300 -4.162 -0.926 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -15.039 -3.437 -4.265 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -15.670 -4.004 -2.715 1.00 0.00 H new ATOM 1830 N ASP A 113 -9.952 -3.190 -7.123 1.00 0.00 N ATOM 1831 CA ASP A 113 -10.668 -3.975 -8.170 1.00 0.00 C ATOM 1832 C ASP A 113 -9.691 -4.346 -9.286 1.00 0.00 C ATOM 1833 O ASP A 113 -9.548 -5.500 -9.640 1.00 0.00 O ATOM 1834 CB ASP A 113 -11.806 -3.132 -8.749 1.00 0.00 C ATOM 1835 CG ASP A 113 -13.003 -3.166 -7.797 1.00 0.00 C ATOM 1836 OD1 ASP A 113 -13.123 -4.132 -7.062 1.00 0.00 O ATOM 1837 OD2 ASP A 113 -13.780 -2.224 -7.818 1.00 0.00 O ATOM 0 H ASP A 113 -10.178 -2.196 -7.094 1.00 0.00 H new ATOM 0 HA ASP A 113 -11.076 -4.884 -7.728 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -11.473 -2.104 -8.895 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -12.095 -3.516 -9.727 1.00 0.00 H new ATOM 1842 N ALA A 114 -9.015 -3.378 -9.843 1.00 0.00 N ATOM 1843 CA ALA A 114 -8.048 -3.677 -10.936 1.00 0.00 C ATOM 1844 C ALA A 114 -6.945 -4.593 -10.404 1.00 0.00 C ATOM 1845 O ALA A 114 -6.683 -5.647 -10.948 1.00 0.00 O ATOM 1846 CB ALA A 114 -7.428 -2.371 -11.437 1.00 0.00 C ATOM 0 H ALA A 114 -9.091 -2.393 -9.588 1.00 0.00 H new ATOM 0 HA ALA A 114 -8.567 -4.172 -11.756 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -6.720 -2.588 -12.237 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -8.214 -1.717 -11.815 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -6.908 -1.877 -10.616 1.00 0.00 H new ATOM 1852 N VAL A 115 -6.294 -4.200 -9.343 1.00 0.00 N ATOM 1853 CA VAL A 115 -5.209 -5.049 -8.778 1.00 0.00 C ATOM 1854 C VAL A 115 -5.734 -6.469 -8.558 1.00 0.00 C ATOM 1855 O VAL A 115 -5.148 -7.434 -9.005 1.00 0.00 O ATOM 1856 CB VAL A 115 -4.746 -4.463 -7.442 1.00 0.00 C ATOM 1857 CG1 VAL A 115 -3.834 -5.465 -6.733 1.00 0.00 C ATOM 1858 CG2 VAL A 115 -3.978 -3.164 -7.695 1.00 0.00 C ATOM 0 H VAL A 115 -6.467 -3.328 -8.844 1.00 0.00 H new ATOM 0 HA VAL A 115 -4.370 -5.076 -9.473 1.00 0.00 H new ATOM 0 HB VAL A 115 -5.614 -4.257 -6.815 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -3.505 -5.047 -5.782 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -4.381 -6.391 -6.553 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -2.966 -5.672 -7.358 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -3.648 -2.746 -6.744 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -3.110 -3.370 -8.322 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -4.628 -2.449 -8.200 1.00 0.00 H new ATOM 1868 N LYS A 116 -6.836 -6.604 -7.872 1.00 0.00 N ATOM 1869 CA LYS A 116 -7.396 -7.962 -7.624 1.00 0.00 C ATOM 1870 C LYS A 116 -7.536 -8.706 -8.955 1.00 0.00 C ATOM 1871 O LYS A 116 -7.344 -9.903 -9.030 1.00 0.00 O ATOM 1872 CB LYS A 116 -8.771 -7.834 -6.965 1.00 0.00 C ATOM 1873 CG LYS A 116 -8.602 -7.733 -5.449 1.00 0.00 C ATOM 1874 CD LYS A 116 -9.204 -8.973 -4.783 1.00 0.00 C ATOM 1875 CE LYS A 116 -10.110 -8.545 -3.626 1.00 0.00 C ATOM 1876 NZ LYS A 116 -9.758 -9.325 -2.407 1.00 0.00 N ATOM 0 H LYS A 116 -7.372 -5.833 -7.473 1.00 0.00 H new ATOM 0 HA LYS A 116 -6.727 -8.516 -6.965 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -9.287 -6.952 -7.344 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -9.388 -8.697 -7.216 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -7.545 -7.648 -5.195 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -9.092 -6.833 -5.077 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -9.775 -9.549 -5.512 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -8.410 -9.623 -4.415 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -9.994 -7.478 -3.434 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -11.155 -8.710 -3.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -10.373 -9.035 -1.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -9.890 -10.340 -2.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -8.765 -9.146 -2.155 1.00 0.00 H new ATOM 1890 N LYS A 117 -7.869 -8.006 -10.004 1.00 0.00 N ATOM 1891 CA LYS A 117 -8.020 -8.674 -11.327 1.00 0.00 C ATOM 1892 C LYS A 117 -6.646 -9.116 -11.835 1.00 0.00 C ATOM 1893 O LYS A 117 -6.510 -10.137 -12.478 1.00 0.00 O ATOM 1894 CB LYS A 117 -8.642 -7.695 -12.325 1.00 0.00 C ATOM 1895 CG LYS A 117 -9.950 -8.277 -12.865 1.00 0.00 C ATOM 1896 CD LYS A 117 -9.647 -9.208 -14.040 1.00 0.00 C ATOM 1897 CE LYS A 117 -10.591 -10.411 -13.996 1.00 0.00 C ATOM 1898 NZ LYS A 117 -10.025 -11.452 -13.091 1.00 0.00 N ATOM 0 H LYS A 117 -8.043 -7.001 -10.002 1.00 0.00 H new ATOM 0 HA LYS A 117 -8.666 -9.545 -11.222 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -8.831 -6.737 -11.841 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -7.949 -7.507 -13.145 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -10.469 -8.824 -12.078 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -10.613 -7.473 -13.185 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -9.767 -8.673 -14.982 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -8.611 -9.544 -13.994 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -11.575 -10.102 -13.643 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -10.725 -10.819 -14.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -10.666 -12.271 -13.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -9.095 -11.753 -13.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -9.919 -11.059 -12.134 1.00 0.00 H new ATOM 1912 N TYR A 118 -5.626 -8.353 -11.552 1.00 0.00 N ATOM 1913 CA TYR A 118 -4.262 -8.730 -12.018 1.00 0.00 C ATOM 1914 C TYR A 118 -3.593 -9.624 -10.972 1.00 0.00 C ATOM 1915 O TYR A 118 -3.463 -10.818 -11.153 1.00 0.00 O ATOM 1916 CB TYR A 118 -3.424 -7.466 -12.221 1.00 0.00 C ATOM 1917 CG TYR A 118 -4.161 -6.512 -13.131 1.00 0.00 C ATOM 1918 CD1 TYR A 118 -4.272 -6.793 -14.498 1.00 0.00 C ATOM 1919 CD2 TYR A 118 -4.731 -5.346 -12.607 1.00 0.00 C ATOM 1920 CE1 TYR A 118 -4.955 -5.909 -15.341 1.00 0.00 C ATOM 1921 CE2 TYR A 118 -5.414 -4.461 -13.451 1.00 0.00 C ATOM 1922 CZ TYR A 118 -5.526 -4.743 -14.818 1.00 0.00 C ATOM 1923 OH TYR A 118 -6.199 -3.871 -15.649 1.00 0.00 O ATOM 0 H TYR A 118 -5.678 -7.485 -11.018 1.00 0.00 H new ATOM 0 HA TYR A 118 -4.338 -9.271 -12.962 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -3.227 -6.990 -11.261 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -2.457 -7.724 -12.653 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -3.831 -7.692 -14.902 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -4.644 -5.129 -11.553 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -5.042 -6.127 -16.395 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -5.854 -3.561 -13.047 1.00 0.00 H new ATOM 0 HH TYR A 118 -6.732 -3.250 -15.109 1.00 0.00 H new ATOM 1933 N LEU A 119 -3.167 -9.054 -9.878 1.00 0.00 N ATOM 1934 CA LEU A 119 -2.507 -9.870 -8.819 1.00 0.00 C ATOM 1935 C LEU A 119 -3.566 -10.380 -7.833 1.00 0.00 C ATOM 1936 O LEU A 119 -4.157 -9.601 -7.111 1.00 0.00 O ATOM 1937 CB LEU A 119 -1.496 -9.001 -8.068 1.00 0.00 C ATOM 1938 CG LEU A 119 -0.520 -9.897 -7.304 1.00 0.00 C ATOM 1939 CD1 LEU A 119 0.797 -9.151 -7.090 1.00 0.00 C ATOM 1940 CD2 LEU A 119 -1.124 -10.264 -5.947 1.00 0.00 C ATOM 0 H LEU A 119 -3.247 -8.058 -9.672 1.00 0.00 H new ATOM 0 HA LEU A 119 -1.996 -10.717 -9.277 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -0.952 -8.369 -8.770 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -2.014 -8.337 -7.376 1.00 0.00 H new ATOM 0 HG LEU A 119 -0.333 -10.805 -7.878 1.00 0.00 H new ATOM 0 HD11 LEU A 119 1.493 -9.790 -6.545 1.00 0.00 H new ATOM 0 HD12 LEU A 119 1.227 -8.887 -8.056 1.00 0.00 H new ATOM 0 HD13 LEU A 119 0.612 -8.243 -6.515 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -0.430 -10.903 -5.401 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -1.309 -9.356 -5.374 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -2.064 -10.795 -6.099 1.00 0.00 H new ATOM 1952 N PRO A 120 -3.779 -11.674 -7.829 1.00 0.00 N ATOM 1953 CA PRO A 120 -4.765 -12.309 -6.936 1.00 0.00 C ATOM 1954 C PRO A 120 -4.200 -12.429 -5.517 1.00 0.00 C ATOM 1955 O PRO A 120 -3.202 -11.821 -5.183 1.00 0.00 O ATOM 1956 CB PRO A 120 -4.977 -13.692 -7.558 1.00 0.00 C ATOM 1957 CG PRO A 120 -3.719 -13.984 -8.410 1.00 0.00 C ATOM 1958 CD PRO A 120 -3.063 -12.622 -8.707 1.00 0.00 C ATOM 0 HA PRO A 120 -5.691 -11.742 -6.848 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -5.107 -14.450 -6.785 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -5.876 -13.707 -8.174 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -3.031 -14.637 -7.873 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -3.987 -14.495 -9.335 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -1.995 -12.638 -8.488 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -3.169 -12.350 -9.757 1.00 0.00 H new ATOM 1966 N LEU A 121 -4.829 -13.208 -4.681 1.00 0.00 N ATOM 1967 CA LEU A 121 -4.326 -13.365 -3.286 1.00 0.00 C ATOM 1968 C LEU A 121 -4.114 -14.849 -2.986 1.00 0.00 C ATOM 1969 O LEU A 121 -3.903 -15.240 -1.854 1.00 0.00 O ATOM 1970 CB LEU A 121 -5.351 -12.787 -2.308 1.00 0.00 C ATOM 1971 CG LEU A 121 -4.669 -11.757 -1.406 1.00 0.00 C ATOM 1972 CD1 LEU A 121 -5.729 -10.999 -0.605 1.00 0.00 C ATOM 1973 CD2 LEU A 121 -3.719 -12.472 -0.442 1.00 0.00 C ATOM 0 H LEU A 121 -5.669 -13.743 -4.903 1.00 0.00 H new ATOM 0 HA LEU A 121 -3.380 -12.834 -3.177 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -6.170 -12.321 -2.856 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -5.784 -13.585 -1.705 1.00 0.00 H new ATOM 0 HG LEU A 121 -4.105 -11.055 -2.020 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -5.243 -10.265 0.038 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -6.407 -10.490 -1.290 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -6.293 -11.702 0.008 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -3.233 -11.738 0.201 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -4.284 -13.174 0.171 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -2.963 -13.013 -1.011 1.00 0.00 H new ATOM 1985 N LYS A 122 -4.166 -15.682 -3.989 1.00 0.00 N ATOM 1986 CA LYS A 122 -3.967 -17.141 -3.758 1.00 0.00 C ATOM 1987 C LYS A 122 -3.203 -17.744 -4.939 1.00 0.00 C ATOM 1988 O LYS A 122 -3.568 -17.564 -6.084 1.00 0.00 O ATOM 1989 CB LYS A 122 -5.329 -17.827 -3.628 1.00 0.00 C ATOM 1990 CG LYS A 122 -5.845 -17.670 -2.195 1.00 0.00 C ATOM 1991 CD LYS A 122 -5.063 -18.600 -1.265 1.00 0.00 C ATOM 1992 CE LYS A 122 -5.760 -19.960 -1.198 1.00 0.00 C ATOM 1993 NZ LYS A 122 -5.246 -20.725 -0.027 1.00 0.00 N ATOM 0 H LYS A 122 -4.338 -15.415 -4.958 1.00 0.00 H new ATOM 0 HA LYS A 122 -3.396 -17.290 -2.841 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -6.037 -17.389 -4.331 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -5.241 -18.884 -3.881 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -5.735 -16.636 -1.869 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -6.908 -17.906 -2.152 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -4.042 -18.720 -1.628 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -4.997 -18.164 -0.268 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -6.838 -19.824 -1.112 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -5.581 -20.518 -2.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -5.720 -21.650 0.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -4.221 -20.866 -0.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -5.438 -20.194 0.846 1.00 0.00 H new ATOM 2007 N SER A 123 -2.146 -18.459 -4.669 1.00 0.00 N ATOM 2008 CA SER A 123 -1.360 -19.073 -5.776 1.00 0.00 C ATOM 2009 C SER A 123 -1.038 -18.007 -6.826 1.00 0.00 C ATOM 2010 O SER A 123 -0.891 -16.841 -6.515 1.00 0.00 O ATOM 2011 CB SER A 123 -2.178 -20.193 -6.422 1.00 0.00 C ATOM 2012 OG SER A 123 -1.312 -21.265 -6.771 1.00 0.00 O ATOM 0 H SER A 123 -1.793 -18.645 -3.730 1.00 0.00 H new ATOM 0 HA SER A 123 -0.432 -19.483 -5.378 1.00 0.00 H new ATOM 0 HB2 SER A 123 -2.947 -20.541 -5.733 1.00 0.00 H new ATOM 0 HB3 SER A 123 -2.690 -19.820 -7.309 1.00 0.00 H new ATOM 0 HG SER A 123 -1.833 -21.985 -7.184 1.00 0.00 H new ATOM 2018 N ASN A 124 -0.927 -18.397 -8.066 1.00 0.00 N ATOM 2019 CA ASN A 124 -0.614 -17.405 -9.134 1.00 0.00 C ATOM 2020 C ASN A 124 -0.966 -17.998 -10.499 1.00 0.00 C ATOM 2021 O ASN A 124 -0.337 -17.613 -11.470 1.00 0.00 O ATOM 2022 CB ASN A 124 0.878 -17.066 -9.093 1.00 0.00 C ATOM 2023 CG ASN A 124 1.697 -18.340 -9.314 1.00 0.00 C ATOM 2024 OD1 ASN A 124 1.298 -19.411 -8.901 1.00 0.00 O ATOM 2025 ND2 ASN A 124 2.834 -18.267 -9.950 1.00 0.00 N ATOM 2026 OXT ASN A 124 -1.860 -18.827 -10.551 1.00 0.00 O ATOM 0 H ASN A 124 -1.039 -19.359 -8.386 1.00 0.00 H new ATOM 0 HA ASN A 124 -1.197 -16.498 -8.971 1.00 0.00 H new ATOM 0 HB2 ASN A 124 1.116 -16.330 -9.861 1.00 0.00 H new ATOM 0 HB3 ASN A 124 1.134 -16.618 -8.133 1.00 0.00 H new ATOM 0 HD21 ASN A 124 3.389 -19.109 -10.101 1.00 0.00 H new ATOM 0 HD22 ASN A 124 3.168 -17.368 -10.296 1.00 0.00 H new TER 2033 ASN A 124