USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1104 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 32 TYR OH : rot 90:sc= -0.763 USER MOD Set 1.2: A 34 SER OG : rot 109:sc= -1.92! USER MOD Set 1.3: A 36 HIS : no HD1:sc= -5.39! C(o=-28!,f=-23!) USER MOD Set 1.4: A 45 THR OG1 : rot -159:sc= -4.57! USER MOD Set 1.5: A 79 TYR OH : rot 96:sc= 1.15 USER MOD Set 1.6: A 84 HIS : no HE2:sc= -16.3! C(o=-28!,f=-26!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 8 LYS NZ :NH3+ -152:sc= -0.0453 (180deg=-0.451) USER MOD Single : A 11 LYS NZ :NH3+ -117:sc= -0.379 (180deg=-1.56) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 ASN : amide:sc= -2.42! K(o=-2.4!,f=-0.2) USER MOD Single : A 15 CYS SG : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 20 ASN : amide:sc= -9.76! C(o=-9.8!,f=-4.4!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ -158:sc= -0.0162 (180deg=-0.25) USER MOD Single : A 38 CYS SG : rot 72:sc= -2.98! USER MOD Single : A 41 CYS SG : rot 82:sc= -2.04! USER MOD Single : A 51 MET CE :methyl 154:sc= -2.71 (180deg=-4.19!) USER MOD Single : A 52 TYR OH : rot 127:sc= -2.42 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot -52:sc= 0.0661 USER MOD Single : A 68 SER OG : rot -40:sc= -6.37! USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 127:sc= 1.46 USER MOD Single : A 76 MET CE :methyl -116:sc= -1.16 (180deg=-6.11!) USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 MET CE :methyl 166:sc= -0.561 (180deg=-1.12) USER MOD Single : A 81 MET CE :methyl -171:sc= -0.0102 (180deg=-0.0152) USER MOD Single : A 83 SER OG : rot 72:sc= 0.379! USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot -48:sc= -4.69! USER MOD Single : A 98 SER OG : rot 180:sc= -0.653 USER MOD Single : A 99 ASN : amide:sc= -0.0175 X(o=-0.017,f=-0.16) USER MOD Single : A 101 THR OG1 : rot -84:sc= 0.0199 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 61:sc= 0.573! USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 176:sc= -1.19 (180deg=-1.58!) USER MOD Single : A 120 THR OG1 : rot 180:sc= -0.0599 USER MOD Single : A 123 SER OG : rot 120:sc= -1.2 USER MOD Single : A 124 MET CE :methyl 154:sc= -12.3! (180deg=-15.9!) USER MOD Single : A 125 ASN : amide:sc= -6.1! K(o=-6.1!,f=-1.4) USER MOD Single : A 131 GLN : amide:sc= -12! C(o=-12!,f=-22!) USER MOD Single : A 132 SER OG : rot 56:sc= 0.14! USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 140 ASN : amide:sc= -1.75 K(o=-1.8,f=0.13) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 100.340 -12.274 9.056 1.00 0.00 N ATOM 2 CA MET A 1 100.088 -13.510 8.261 1.00 0.00 C ATOM 3 C MET A 1 99.984 -13.146 6.783 1.00 0.00 C ATOM 4 O MET A 1 98.931 -13.307 6.167 1.00 0.00 O ATOM 5 CB MET A 1 98.783 -14.157 8.731 1.00 0.00 C ATOM 6 CG MET A 1 98.785 -15.640 8.354 1.00 0.00 C ATOM 7 SD MET A 1 99.118 -16.638 9.827 1.00 0.00 S ATOM 8 CE MET A 1 100.313 -17.767 9.072 1.00 0.00 C ATOM 0 H1 MET A 1 100.411 -12.518 10.064 1.00 0.00 H new ATOM 0 H2 MET A 1 101.229 -11.835 8.742 1.00 0.00 H new ATOM 0 H3 MET A 1 99.556 -11.606 8.917 1.00 0.00 H new ATOM 0 HA MET A 1 100.909 -14.214 8.401 1.00 0.00 H new ATOM 0 HB2 MET A 1 98.677 -14.045 9.810 1.00 0.00 H new ATOM 0 HB3 MET A 1 97.930 -13.655 8.273 1.00 0.00 H new ATOM 0 HG2 MET A 1 97.823 -15.918 7.924 1.00 0.00 H new ATOM 0 HG3 MET A 1 99.542 -15.832 7.593 1.00 0.00 H new ATOM 0 HE1 MET A 1 100.658 -18.484 9.817 1.00 0.00 H new ATOM 0 HE2 MET A 1 99.839 -18.300 8.248 1.00 0.00 H new ATOM 0 HE3 MET A 1 101.163 -17.198 8.695 1.00 0.00 H new ATOM 20 N GLU A 2 101.085 -12.657 6.220 1.00 0.00 N ATOM 21 CA GLU A 2 101.107 -12.275 4.813 1.00 0.00 C ATOM 22 C GLU A 2 102.543 -12.150 4.315 1.00 0.00 C ATOM 23 O GLU A 2 103.488 -12.179 5.102 1.00 0.00 O ATOM 24 CB GLU A 2 100.380 -10.942 4.622 1.00 0.00 C ATOM 25 CG GLU A 2 100.101 -10.312 5.989 1.00 0.00 C ATOM 26 CD GLU A 2 99.773 -8.832 5.823 1.00 0.00 C ATOM 27 OE1 GLU A 2 98.902 -8.524 5.027 1.00 0.00 O ATOM 28 OE2 GLU A 2 100.399 -8.028 6.495 1.00 0.00 O ATOM 0 H GLU A 2 101.967 -12.517 6.713 1.00 0.00 H new ATOM 0 HA GLU A 2 100.601 -13.050 4.237 1.00 0.00 H new ATOM 0 HB2 GLU A 2 100.986 -10.269 4.016 1.00 0.00 H new ATOM 0 HB3 GLU A 2 99.445 -11.099 4.085 1.00 0.00 H new ATOM 0 HG2 GLU A 2 99.270 -10.825 6.473 1.00 0.00 H new ATOM 0 HG3 GLU A 2 100.969 -10.430 6.637 1.00 0.00 H new ATOM 35 N PHE A 3 102.699 -12.013 3.002 1.00 0.00 N ATOM 36 CA PHE A 3 104.025 -11.885 2.409 1.00 0.00 C ATOM 37 C PHE A 3 104.394 -10.415 2.231 1.00 0.00 C ATOM 38 O PHE A 3 103.651 -9.524 2.641 1.00 0.00 O ATOM 39 CB PHE A 3 104.062 -12.592 1.053 1.00 0.00 C ATOM 40 CG PHE A 3 102.756 -13.316 0.827 1.00 0.00 C ATOM 41 CD1 PHE A 3 101.618 -12.602 0.434 1.00 0.00 C ATOM 42 CD2 PHE A 3 102.685 -14.702 1.011 1.00 0.00 C ATOM 43 CE1 PHE A 3 100.408 -13.273 0.225 1.00 0.00 C ATOM 44 CE2 PHE A 3 101.474 -15.373 0.802 1.00 0.00 C ATOM 45 CZ PHE A 3 100.336 -14.660 0.409 1.00 0.00 C ATOM 0 H PHE A 3 101.930 -11.988 2.333 1.00 0.00 H new ATOM 0 HA PHE A 3 104.748 -12.350 3.079 1.00 0.00 H new ATOM 0 HB2 PHE A 3 104.230 -11.867 0.257 1.00 0.00 H new ATOM 0 HB3 PHE A 3 104.892 -13.298 1.022 1.00 0.00 H new ATOM 0 HD1 PHE A 3 101.674 -11.533 0.292 1.00 0.00 H new ATOM 0 HD2 PHE A 3 103.563 -15.253 1.314 1.00 0.00 H new ATOM 0 HE1 PHE A 3 99.530 -12.722 -0.078 1.00 0.00 H new ATOM 0 HE2 PHE A 3 101.418 -16.442 0.944 1.00 0.00 H new ATOM 0 HZ PHE A 3 99.403 -15.179 0.248 1.00 0.00 H new ATOM 55 N ILE A 4 105.546 -10.171 1.615 1.00 0.00 N ATOM 56 CA ILE A 4 106.004 -8.806 1.385 1.00 0.00 C ATOM 57 C ILE A 4 104.932 -7.993 0.668 1.00 0.00 C ATOM 58 O ILE A 4 104.573 -6.900 1.102 1.00 0.00 O ATOM 59 CB ILE A 4 107.283 -8.817 0.544 1.00 0.00 C ATOM 60 CG1 ILE A 4 107.315 -10.081 -0.317 1.00 0.00 C ATOM 61 CG2 ILE A 4 108.504 -8.799 1.466 1.00 0.00 C ATOM 62 CD1 ILE A 4 107.962 -9.765 -1.667 1.00 0.00 C ATOM 0 H ILE A 4 106.175 -10.895 1.268 1.00 0.00 H new ATOM 0 HA ILE A 4 106.208 -8.346 2.352 1.00 0.00 H new ATOM 0 HB ILE A 4 107.301 -7.937 -0.098 1.00 0.00 H new ATOM 0 HG12 ILE A 4 107.875 -10.866 0.192 1.00 0.00 H new ATOM 0 HG13 ILE A 4 106.303 -10.457 -0.466 1.00 0.00 H new ATOM 0 HG21 ILE A 4 109.414 -8.807 0.865 1.00 0.00 H new ATOM 0 HG22 ILE A 4 108.483 -7.899 2.080 1.00 0.00 H new ATOM 0 HG23 ILE A 4 108.487 -9.678 2.110 1.00 0.00 H new ATOM 0 HD11 ILE A 4 107.984 -10.666 -2.280 1.00 0.00 H new ATOM 0 HD12 ILE A 4 107.383 -8.994 -2.176 1.00 0.00 H new ATOM 0 HD13 ILE A 4 108.980 -9.409 -1.508 1.00 0.00 H new ATOM 74 N GLN A 5 104.428 -8.538 -0.431 1.00 0.00 N ATOM 75 CA GLN A 5 103.398 -7.859 -1.208 1.00 0.00 C ATOM 76 C GLN A 5 102.478 -7.056 -0.295 1.00 0.00 C ATOM 77 O GLN A 5 101.784 -7.616 0.553 1.00 0.00 O ATOM 78 CB GLN A 5 102.576 -8.883 -1.992 1.00 0.00 C ATOM 79 CG GLN A 5 103.507 -9.945 -2.579 1.00 0.00 C ATOM 80 CD GLN A 5 103.153 -10.199 -4.040 1.00 0.00 C ATOM 81 OE1 GLN A 5 103.954 -9.916 -4.932 1.00 0.00 O ATOM 82 NE2 GLN A 5 101.995 -10.718 -4.341 1.00 0.00 N ATOM 0 H GLN A 5 104.713 -9.444 -0.804 1.00 0.00 H new ATOM 0 HA GLN A 5 103.886 -7.176 -1.903 1.00 0.00 H new ATOM 0 HB2 GLN A 5 101.840 -9.351 -1.338 1.00 0.00 H new ATOM 0 HB3 GLN A 5 102.024 -8.387 -2.790 1.00 0.00 H new ATOM 0 HG2 GLN A 5 104.543 -9.616 -2.499 1.00 0.00 H new ATOM 0 HG3 GLN A 5 103.421 -10.870 -2.009 1.00 0.00 H new ATOM 0 HE21 GLN A 5 101.333 -10.952 -3.601 1.00 0.00 H new ATOM 0 HE22 GLN A 5 101.751 -10.890 -5.316 1.00 0.00 H new ATOM 91 N GLY A 6 102.476 -5.738 -0.478 1.00 0.00 N ATOM 92 CA GLY A 6 101.637 -4.865 0.335 1.00 0.00 C ATOM 93 C GLY A 6 102.479 -3.836 1.080 1.00 0.00 C ATOM 94 O GLY A 6 101.944 -2.960 1.763 1.00 0.00 O ATOM 0 H GLY A 6 103.041 -5.255 -1.176 1.00 0.00 H new ATOM 0 HA2 GLY A 6 100.913 -4.356 -0.301 1.00 0.00 H new ATOM 0 HA3 GLY A 6 101.070 -5.462 1.049 1.00 0.00 H new ATOM 98 N ILE A 7 103.797 -3.947 0.950 1.00 0.00 N ATOM 99 CA ILE A 7 104.701 -3.027 1.615 1.00 0.00 C ATOM 100 C ILE A 7 105.222 -1.980 0.635 1.00 0.00 C ATOM 101 O ILE A 7 104.922 -2.028 -0.558 1.00 0.00 O ATOM 102 CB ILE A 7 105.873 -3.806 2.203 1.00 0.00 C ATOM 103 CG1 ILE A 7 106.583 -4.575 1.086 1.00 0.00 C ATOM 104 CG2 ILE A 7 105.356 -4.790 3.255 1.00 0.00 C ATOM 105 CD1 ILE A 7 107.742 -5.379 1.675 1.00 0.00 C ATOM 0 H ILE A 7 104.258 -4.665 0.391 1.00 0.00 H new ATOM 0 HA ILE A 7 104.159 -2.517 2.411 1.00 0.00 H new ATOM 0 HB ILE A 7 106.574 -3.114 2.670 1.00 0.00 H new ATOM 0 HG12 ILE A 7 105.881 -5.242 0.587 1.00 0.00 H new ATOM 0 HG13 ILE A 7 106.954 -3.881 0.332 1.00 0.00 H new ATOM 0 HG21 ILE A 7 106.194 -5.347 3.675 1.00 0.00 H new ATOM 0 HG22 ILE A 7 104.850 -4.241 4.049 1.00 0.00 H new ATOM 0 HG23 ILE A 7 104.655 -5.484 2.791 1.00 0.00 H new ATOM 0 HD11 ILE A 7 108.247 -5.926 0.879 1.00 0.00 H new ATOM 0 HD12 ILE A 7 108.449 -4.701 2.154 1.00 0.00 H new ATOM 0 HD13 ILE A 7 107.358 -6.084 2.413 1.00 0.00 H new ATOM 117 N LYS A 8 106.006 -1.039 1.148 1.00 0.00 N ATOM 118 CA LYS A 8 106.568 0.016 0.313 1.00 0.00 C ATOM 119 C LYS A 8 107.883 -0.440 -0.312 1.00 0.00 C ATOM 120 O LYS A 8 108.433 -1.476 0.063 1.00 0.00 O ATOM 121 CB LYS A 8 106.808 1.274 1.150 1.00 0.00 C ATOM 122 CG LYS A 8 105.493 1.714 1.797 1.00 0.00 C ATOM 123 CD LYS A 8 105.100 0.716 2.887 1.00 0.00 C ATOM 124 CE LYS A 8 104.407 1.455 4.033 1.00 0.00 C ATOM 125 NZ LYS A 8 105.408 2.274 4.773 1.00 0.00 N ATOM 0 H LYS A 8 106.266 -0.985 2.133 1.00 0.00 H new ATOM 0 HA LYS A 8 105.858 0.240 -0.483 1.00 0.00 H new ATOM 0 HB2 LYS A 8 107.555 1.076 1.918 1.00 0.00 H new ATOM 0 HB3 LYS A 8 107.202 2.073 0.521 1.00 0.00 H new ATOM 0 HG2 LYS A 8 105.602 2.711 2.224 1.00 0.00 H new ATOM 0 HG3 LYS A 8 104.707 1.774 1.044 1.00 0.00 H new ATOM 0 HD2 LYS A 8 104.435 -0.044 2.476 1.00 0.00 H new ATOM 0 HD3 LYS A 8 105.985 0.199 3.257 1.00 0.00 H new ATOM 0 HE2 LYS A 8 103.616 2.095 3.642 1.00 0.00 H new ATOM 0 HE3 LYS A 8 103.935 0.741 4.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 105.104 2.385 5.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 106.333 1.799 4.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 105.487 3.211 4.328 1.00 0.00 H new ATOM 139 N LEU A 9 108.385 0.344 -1.260 1.00 0.00 N ATOM 140 CA LEU A 9 109.641 0.015 -1.926 1.00 0.00 C ATOM 141 C LEU A 9 110.256 1.265 -2.546 1.00 0.00 C ATOM 142 O LEU A 9 109.564 2.259 -2.764 1.00 0.00 O ATOM 143 CB LEU A 9 109.405 -1.034 -3.013 1.00 0.00 C ATOM 144 CG LEU A 9 110.284 -2.255 -2.736 1.00 0.00 C ATOM 145 CD1 LEU A 9 109.683 -3.070 -1.590 1.00 0.00 C ATOM 146 CD2 LEU A 9 110.363 -3.124 -3.993 1.00 0.00 C ATOM 0 H LEU A 9 107.946 1.206 -1.583 1.00 0.00 H new ATOM 0 HA LEU A 9 110.329 -0.389 -1.183 1.00 0.00 H new ATOM 0 HB2 LEU A 9 108.355 -1.325 -3.032 1.00 0.00 H new ATOM 0 HB3 LEU A 9 109.639 -0.618 -3.993 1.00 0.00 H new ATOM 0 HG LEU A 9 111.285 -1.924 -2.459 1.00 0.00 H new ATOM 0 HD11 LEU A 9 110.310 -3.940 -1.394 1.00 0.00 H new ATOM 0 HD12 LEU A 9 109.629 -2.452 -0.694 1.00 0.00 H new ATOM 0 HD13 LEU A 9 108.681 -3.400 -1.865 1.00 0.00 H new ATOM 0 HD21 LEU A 9 110.989 -3.994 -3.795 1.00 0.00 H new ATOM 0 HD22 LEU A 9 109.362 -3.453 -4.271 1.00 0.00 H new ATOM 0 HD23 LEU A 9 110.794 -2.545 -4.809 1.00 0.00 H new ATOM 158 N VAL A 10 111.556 1.219 -2.823 1.00 0.00 N ATOM 159 CA VAL A 10 112.229 2.371 -3.411 1.00 0.00 C ATOM 160 C VAL A 10 112.792 2.031 -4.787 1.00 0.00 C ATOM 161 O VAL A 10 113.417 0.988 -4.975 1.00 0.00 O ATOM 162 CB VAL A 10 113.362 2.837 -2.496 1.00 0.00 C ATOM 163 CG1 VAL A 10 114.198 3.895 -3.218 1.00 0.00 C ATOM 164 CG2 VAL A 10 112.770 3.440 -1.220 1.00 0.00 C ATOM 0 H VAL A 10 112.155 0.411 -2.653 1.00 0.00 H new ATOM 0 HA VAL A 10 111.497 3.171 -3.523 1.00 0.00 H new ATOM 0 HB VAL A 10 113.994 1.987 -2.238 1.00 0.00 H new ATOM 0 HG11 VAL A 10 115.006 4.228 -2.566 1.00 0.00 H new ATOM 0 HG12 VAL A 10 114.619 3.467 -4.128 1.00 0.00 H new ATOM 0 HG13 VAL A 10 113.566 4.745 -3.475 1.00 0.00 H new ATOM 0 HG21 VAL A 10 113.577 3.773 -0.567 1.00 0.00 H new ATOM 0 HG22 VAL A 10 112.138 4.290 -1.478 1.00 0.00 H new ATOM 0 HG23 VAL A 10 112.173 2.687 -0.705 1.00 0.00 H new ATOM 174 N LYS A 11 112.567 2.926 -5.745 1.00 0.00 N ATOM 175 CA LYS A 11 113.060 2.722 -7.102 1.00 0.00 C ATOM 176 C LYS A 11 114.389 3.445 -7.295 1.00 0.00 C ATOM 177 O LYS A 11 114.600 4.531 -6.748 1.00 0.00 O ATOM 178 CB LYS A 11 112.040 3.240 -8.120 1.00 0.00 C ATOM 179 CG LYS A 11 110.893 3.943 -7.391 1.00 0.00 C ATOM 180 CD LYS A 11 110.001 4.655 -8.411 1.00 0.00 C ATOM 181 CE LYS A 11 109.302 3.617 -9.291 1.00 0.00 C ATOM 182 NZ LYS A 11 110.099 3.400 -10.530 1.00 0.00 N ATOM 0 H LYS A 11 112.050 3.794 -5.607 1.00 0.00 H new ATOM 0 HA LYS A 11 113.209 1.654 -7.258 1.00 0.00 H new ATOM 0 HB2 LYS A 11 112.521 3.931 -8.812 1.00 0.00 H new ATOM 0 HB3 LYS A 11 111.653 2.412 -8.714 1.00 0.00 H new ATOM 0 HG2 LYS A 11 110.309 3.218 -6.825 1.00 0.00 H new ATOM 0 HG3 LYS A 11 111.290 4.662 -6.674 1.00 0.00 H new ATOM 0 HD2 LYS A 11 109.261 5.269 -7.897 1.00 0.00 H new ATOM 0 HD3 LYS A 11 110.599 5.326 -9.027 1.00 0.00 H new ATOM 0 HE2 LYS A 11 109.192 2.679 -8.748 1.00 0.00 H new ATOM 0 HE3 LYS A 11 108.298 3.957 -9.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 109.540 3.690 -11.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 110.970 3.966 -10.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 110.344 2.393 -10.613 1.00 0.00 H new ATOM 196 N LYS A 12 115.281 2.836 -8.071 1.00 0.00 N ATOM 197 CA LYS A 12 116.591 3.424 -8.326 1.00 0.00 C ATOM 198 C LYS A 12 116.470 4.922 -8.575 1.00 0.00 C ATOM 199 O LYS A 12 117.424 5.674 -8.371 1.00 0.00 O ATOM 200 CB LYS A 12 117.236 2.754 -9.540 1.00 0.00 C ATOM 201 CG LYS A 12 116.211 2.649 -10.672 1.00 0.00 C ATOM 202 CD LYS A 12 116.879 2.054 -11.913 1.00 0.00 C ATOM 203 CE LYS A 12 116.653 0.542 -11.938 1.00 0.00 C ATOM 204 NZ LYS A 12 115.447 0.232 -12.756 1.00 0.00 N ATOM 0 H LYS A 12 115.121 1.940 -8.532 1.00 0.00 H new ATOM 0 HA LYS A 12 117.216 3.264 -7.447 1.00 0.00 H new ATOM 0 HB2 LYS A 12 118.100 3.331 -9.870 1.00 0.00 H new ATOM 0 HB3 LYS A 12 117.599 1.762 -9.271 1.00 0.00 H new ATOM 0 HG2 LYS A 12 115.374 2.024 -10.362 1.00 0.00 H new ATOM 0 HG3 LYS A 12 115.805 3.634 -10.902 1.00 0.00 H new ATOM 0 HD2 LYS A 12 116.468 2.509 -12.814 1.00 0.00 H new ATOM 0 HD3 LYS A 12 117.947 2.273 -11.905 1.00 0.00 H new ATOM 0 HE2 LYS A 12 117.526 0.040 -12.354 1.00 0.00 H new ATOM 0 HE3 LYS A 12 116.523 0.166 -10.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 115.294 -0.797 -12.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 114.616 0.699 -12.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 115.588 0.577 -13.727 1.00 0.00 H new ATOM 218 N ASN A 13 115.292 5.353 -9.009 1.00 0.00 N ATOM 219 CA ASN A 13 115.063 6.768 -9.273 1.00 0.00 C ATOM 220 C ASN A 13 114.896 7.524 -7.960 1.00 0.00 C ATOM 221 O ASN A 13 114.287 8.594 -7.919 1.00 0.00 O ATOM 222 CB ASN A 13 113.808 6.945 -10.130 1.00 0.00 C ATOM 223 CG ASN A 13 113.843 8.298 -10.833 1.00 0.00 C ATOM 224 OD1 ASN A 13 112.944 8.619 -11.610 1.00 0.00 O ATOM 225 ND2 ASN A 13 114.835 9.116 -10.604 1.00 0.00 N ATOM 0 H ASN A 13 114.488 4.750 -9.184 1.00 0.00 H new ATOM 0 HA ASN A 13 115.923 7.168 -9.810 1.00 0.00 H new ATOM 0 HB2 ASN A 13 113.745 6.144 -10.867 1.00 0.00 H new ATOM 0 HB3 ASN A 13 112.918 6.874 -9.505 1.00 0.00 H new ATOM 0 HD21 ASN A 13 114.866 10.023 -11.069 1.00 0.00 H new ATOM 0 HD22 ASN A 13 115.579 8.848 -9.960 1.00 0.00 H new ATOM 232 N ARG A 14 115.439 6.957 -6.887 1.00 0.00 N ATOM 233 CA ARG A 14 115.343 7.581 -5.574 1.00 0.00 C ATOM 234 C ARG A 14 113.889 7.897 -5.247 1.00 0.00 C ATOM 235 O ARG A 14 113.595 8.871 -4.554 1.00 0.00 O ATOM 236 CB ARG A 14 116.170 8.869 -5.545 1.00 0.00 C ATOM 237 CG ARG A 14 117.321 8.716 -4.549 1.00 0.00 C ATOM 238 CD ARG A 14 118.193 9.973 -4.579 1.00 0.00 C ATOM 239 NE ARG A 14 118.119 10.606 -5.891 1.00 0.00 N ATOM 240 CZ ARG A 14 118.260 11.921 -6.029 1.00 0.00 C ATOM 241 NH1 ARG A 14 118.466 12.668 -4.979 1.00 0.00 N ATOM 242 NH2 ARG A 14 118.191 12.464 -7.213 1.00 0.00 N ATOM 0 H ARG A 14 115.947 6.072 -6.901 1.00 0.00 H new ATOM 0 HA ARG A 14 115.732 6.888 -4.828 1.00 0.00 H new ATOM 0 HB2 ARG A 14 116.562 9.084 -6.539 1.00 0.00 H new ATOM 0 HB3 ARG A 14 115.540 9.712 -5.261 1.00 0.00 H new ATOM 0 HG2 ARG A 14 116.928 8.557 -3.545 1.00 0.00 H new ATOM 0 HG3 ARG A 14 117.919 7.840 -4.800 1.00 0.00 H new ATOM 0 HD2 ARG A 14 117.863 10.672 -3.811 1.00 0.00 H new ATOM 0 HD3 ARG A 14 119.227 9.713 -4.350 1.00 0.00 H new ATOM 0 HE ARG A 14 117.956 10.030 -6.717 1.00 0.00 H new ATOM 0 HH11 ARG A 14 118.519 12.243 -4.053 1.00 0.00 H new ATOM 0 HH12 ARG A 14 118.574 13.677 -5.084 1.00 0.00 H new ATOM 0 HH21 ARG A 14 118.029 11.880 -8.033 1.00 0.00 H new ATOM 0 HH22 ARG A 14 118.299 13.473 -7.319 1.00 0.00 H new ATOM 256 N CYS A 15 112.982 7.070 -5.758 1.00 0.00 N ATOM 257 CA CYS A 15 111.559 7.273 -5.520 1.00 0.00 C ATOM 258 C CYS A 15 110.975 6.119 -4.713 1.00 0.00 C ATOM 259 O CYS A 15 111.640 5.111 -4.483 1.00 0.00 O ATOM 260 CB CYS A 15 110.818 7.393 -6.853 1.00 0.00 C ATOM 261 SG CYS A 15 110.779 9.127 -7.368 1.00 0.00 S ATOM 0 H CYS A 15 113.206 6.259 -6.335 1.00 0.00 H new ATOM 0 HA CYS A 15 111.436 8.194 -4.951 1.00 0.00 H new ATOM 0 HB2 CYS A 15 111.314 6.788 -7.612 1.00 0.00 H new ATOM 0 HB3 CYS A 15 109.803 7.009 -6.753 1.00 0.00 H new ATOM 0 HG CYS A 15 110.151 9.229 -8.502 1.00 0.00 H new ATOM 267 N GLU A 16 109.726 6.275 -4.283 1.00 0.00 N ATOM 268 CA GLU A 16 109.061 5.242 -3.503 1.00 0.00 C ATOM 269 C GLU A 16 107.847 4.701 -4.253 1.00 0.00 C ATOM 270 O GLU A 16 107.250 5.400 -5.072 1.00 0.00 O ATOM 271 CB GLU A 16 108.619 5.806 -2.152 1.00 0.00 C ATOM 272 CG GLU A 16 107.520 6.847 -2.368 1.00 0.00 C ATOM 273 CD GLU A 16 106.216 6.369 -1.738 1.00 0.00 C ATOM 274 OE1 GLU A 16 105.594 5.488 -2.309 1.00 0.00 O ATOM 275 OE2 GLU A 16 105.861 6.889 -0.694 1.00 0.00 O ATOM 0 H GLU A 16 109.158 7.103 -4.462 1.00 0.00 H new ATOM 0 HA GLU A 16 109.767 4.427 -3.341 1.00 0.00 H new ATOM 0 HB2 GLU A 16 108.253 5.003 -1.513 1.00 0.00 H new ATOM 0 HB3 GLU A 16 109.468 6.259 -1.640 1.00 0.00 H new ATOM 0 HG2 GLU A 16 107.818 7.799 -1.928 1.00 0.00 H new ATOM 0 HG3 GLU A 16 107.376 7.020 -3.435 1.00 0.00 H new ATOM 282 N VAL A 17 107.489 3.453 -3.968 1.00 0.00 N ATOM 283 CA VAL A 17 106.345 2.828 -4.625 1.00 0.00 C ATOM 284 C VAL A 17 105.793 1.686 -3.777 1.00 0.00 C ATOM 285 O VAL A 17 106.394 1.293 -2.777 1.00 0.00 O ATOM 286 CB VAL A 17 106.758 2.286 -5.993 1.00 0.00 C ATOM 287 CG1 VAL A 17 107.121 3.449 -6.916 1.00 0.00 C ATOM 288 CG2 VAL A 17 107.970 1.369 -5.829 1.00 0.00 C ATOM 0 H VAL A 17 107.969 2.858 -3.293 1.00 0.00 H new ATOM 0 HA VAL A 17 105.570 3.584 -4.749 1.00 0.00 H new ATOM 0 HB VAL A 17 105.930 1.725 -6.427 1.00 0.00 H new ATOM 0 HG11 VAL A 17 107.415 3.061 -7.891 1.00 0.00 H new ATOM 0 HG12 VAL A 17 106.258 4.105 -7.032 1.00 0.00 H new ATOM 0 HG13 VAL A 17 107.949 4.011 -6.484 1.00 0.00 H new ATOM 0 HG21 VAL A 17 108.267 0.981 -6.803 1.00 0.00 H new ATOM 0 HG22 VAL A 17 108.796 1.932 -5.396 1.00 0.00 H new ATOM 0 HG23 VAL A 17 107.712 0.539 -5.171 1.00 0.00 H new ATOM 298 N ASN A 18 104.645 1.155 -4.187 1.00 0.00 N ATOM 299 CA ASN A 18 104.018 0.056 -3.465 1.00 0.00 C ATOM 300 C ASN A 18 104.463 -1.286 -4.038 1.00 0.00 C ATOM 301 O ASN A 18 104.026 -1.687 -5.117 1.00 0.00 O ATOM 302 CB ASN A 18 102.494 0.172 -3.556 1.00 0.00 C ATOM 303 CG ASN A 18 101.937 0.749 -2.259 1.00 0.00 C ATOM 304 OD1 ASN A 18 102.086 0.146 -1.196 1.00 0.00 O ATOM 305 ND2 ASN A 18 101.300 1.888 -2.282 1.00 0.00 N ATOM 0 H ASN A 18 104.133 1.467 -5.012 1.00 0.00 H new ATOM 0 HA ASN A 18 104.325 0.112 -2.421 1.00 0.00 H new ATOM 0 HB2 ASN A 18 102.219 0.811 -4.395 1.00 0.00 H new ATOM 0 HB3 ASN A 18 102.057 -0.809 -3.745 1.00 0.00 H new ATOM 0 HD21 ASN A 18 100.925 2.280 -1.418 1.00 0.00 H new ATOM 0 HD22 ASN A 18 101.178 2.386 -3.164 1.00 0.00 H new ATOM 312 N ALA A 19 105.335 -1.975 -3.308 1.00 0.00 N ATOM 313 CA ALA A 19 105.836 -3.272 -3.751 1.00 0.00 C ATOM 314 C ALA A 19 104.713 -4.113 -4.349 1.00 0.00 C ATOM 315 O ALA A 19 104.959 -5.012 -5.152 1.00 0.00 O ATOM 316 CB ALA A 19 106.464 -4.020 -2.572 1.00 0.00 C ATOM 0 H ALA A 19 105.708 -1.659 -2.412 1.00 0.00 H new ATOM 0 HA ALA A 19 106.590 -3.102 -4.519 1.00 0.00 H new ATOM 0 HB1 ALA A 19 106.835 -4.987 -2.911 1.00 0.00 H new ATOM 0 HB2 ALA A 19 107.290 -3.435 -2.169 1.00 0.00 H new ATOM 0 HB3 ALA A 19 105.714 -4.171 -1.796 1.00 0.00 H new ATOM 322 N ASN A 20 103.480 -3.819 -3.953 1.00 0.00 N ATOM 323 CA ASN A 20 102.330 -4.559 -4.455 1.00 0.00 C ATOM 324 C ASN A 20 102.404 -4.692 -5.970 1.00 0.00 C ATOM 325 O ASN A 20 102.383 -5.798 -6.511 1.00 0.00 O ATOM 326 CB ASN A 20 101.039 -3.836 -4.070 1.00 0.00 C ATOM 327 CG ASN A 20 100.252 -4.669 -3.065 1.00 0.00 C ATOM 328 OD1 ASN A 20 99.025 -4.582 -3.010 1.00 0.00 O ATOM 329 ND2 ASN A 20 100.887 -5.479 -2.263 1.00 0.00 N ATOM 0 H ASN A 20 103.252 -3.078 -3.290 1.00 0.00 H new ATOM 0 HA ASN A 20 102.337 -5.554 -4.011 1.00 0.00 H new ATOM 0 HB2 ASN A 20 101.273 -2.861 -3.642 1.00 0.00 H new ATOM 0 HB3 ASN A 20 100.434 -3.657 -4.959 1.00 0.00 H new ATOM 0 HD21 ASN A 20 100.367 -6.041 -1.589 1.00 0.00 H new ATOM 0 HD22 ASN A 20 101.903 -5.550 -2.310 1.00 0.00 H new ATOM 336 N GLU A 21 102.488 -3.555 -6.645 1.00 0.00 N ATOM 337 CA GLU A 21 102.562 -3.544 -8.101 1.00 0.00 C ATOM 338 C GLU A 21 104.011 -3.443 -8.563 1.00 0.00 C ATOM 339 O GLU A 21 104.355 -3.874 -9.664 1.00 0.00 O ATOM 340 CB GLU A 21 101.763 -2.364 -8.656 1.00 0.00 C ATOM 341 CG GLU A 21 100.318 -2.447 -8.161 1.00 0.00 C ATOM 342 CD GLU A 21 99.387 -1.751 -9.148 1.00 0.00 C ATOM 343 OE1 GLU A 21 99.043 -2.369 -10.143 1.00 0.00 O ATOM 344 OE2 GLU A 21 99.032 -0.612 -8.896 1.00 0.00 O ATOM 0 H GLU A 21 102.507 -2.632 -6.212 1.00 0.00 H new ATOM 0 HA GLU A 21 102.138 -4.476 -8.475 1.00 0.00 H new ATOM 0 HB2 GLU A 21 102.214 -1.424 -8.338 1.00 0.00 H new ATOM 0 HB3 GLU A 21 101.786 -2.376 -9.746 1.00 0.00 H new ATOM 0 HG2 GLU A 21 100.024 -3.490 -8.045 1.00 0.00 H new ATOM 0 HG3 GLU A 21 100.234 -1.981 -7.179 1.00 0.00 H new ATOM 351 N ALA A 22 104.855 -2.864 -7.717 1.00 0.00 N ATOM 352 CA ALA A 22 106.265 -2.703 -8.049 1.00 0.00 C ATOM 353 C ALA A 22 106.934 -4.058 -8.275 1.00 0.00 C ATOM 354 O ALA A 22 107.919 -4.157 -9.006 1.00 0.00 O ATOM 355 CB ALA A 22 106.978 -1.960 -6.920 1.00 0.00 C ATOM 0 H ALA A 22 104.590 -2.500 -6.802 1.00 0.00 H new ATOM 0 HA ALA A 22 106.336 -2.127 -8.972 1.00 0.00 H new ATOM 0 HB1 ALA A 22 108.032 -1.841 -7.171 1.00 0.00 H new ATOM 0 HB2 ALA A 22 106.524 -0.978 -6.787 1.00 0.00 H new ATOM 0 HB3 ALA A 22 106.887 -2.530 -5.995 1.00 0.00 H new ATOM 361 N LEU A 23 106.399 -5.097 -7.643 1.00 0.00 N ATOM 362 CA LEU A 23 106.964 -6.435 -7.787 1.00 0.00 C ATOM 363 C LEU A 23 106.439 -7.116 -9.047 1.00 0.00 C ATOM 364 O LEU A 23 106.398 -8.343 -9.124 1.00 0.00 O ATOM 365 CB LEU A 23 106.616 -7.289 -6.565 1.00 0.00 C ATOM 366 CG LEU A 23 107.883 -7.552 -5.749 1.00 0.00 C ATOM 367 CD1 LEU A 23 108.502 -6.220 -5.322 1.00 0.00 C ATOM 368 CD2 LEU A 23 107.528 -8.370 -4.507 1.00 0.00 C ATOM 0 H LEU A 23 105.584 -5.041 -7.032 1.00 0.00 H new ATOM 0 HA LEU A 23 108.047 -6.336 -7.867 1.00 0.00 H new ATOM 0 HB2 LEU A 23 105.874 -6.779 -5.951 1.00 0.00 H new ATOM 0 HB3 LEU A 23 106.172 -8.233 -6.882 1.00 0.00 H new ATOM 0 HG LEU A 23 108.598 -8.106 -6.358 1.00 0.00 H new ATOM 0 HD11 LEU A 23 109.405 -6.408 -4.741 1.00 0.00 H new ATOM 0 HD12 LEU A 23 108.755 -5.636 -6.207 1.00 0.00 H new ATOM 0 HD13 LEU A 23 107.788 -5.665 -4.714 1.00 0.00 H new ATOM 0 HD21 LEU A 23 108.430 -8.558 -3.925 1.00 0.00 H new ATOM 0 HD22 LEU A 23 106.813 -7.816 -3.899 1.00 0.00 H new ATOM 0 HD23 LEU A 23 107.088 -9.320 -4.810 1.00 0.00 H new ATOM 380 N LYS A 24 106.041 -6.311 -10.030 1.00 0.00 N ATOM 381 CA LYS A 24 105.521 -6.848 -11.285 1.00 0.00 C ATOM 382 C LYS A 24 105.827 -8.338 -11.402 1.00 0.00 C ATOM 383 O LYS A 24 105.075 -9.174 -10.903 1.00 0.00 O ATOM 384 CB LYS A 24 106.139 -6.100 -12.468 1.00 0.00 C ATOM 385 CG LYS A 24 105.647 -6.717 -13.778 1.00 0.00 C ATOM 386 CD LYS A 24 106.043 -5.815 -14.948 1.00 0.00 C ATOM 387 CE LYS A 24 107.517 -6.037 -15.291 1.00 0.00 C ATOM 388 NZ LYS A 24 107.904 -5.145 -16.420 1.00 0.00 N ATOM 0 H LYS A 24 106.068 -5.292 -9.983 1.00 0.00 H new ATOM 0 HA LYS A 24 104.439 -6.713 -11.295 1.00 0.00 H new ATOM 0 HB2 LYS A 24 105.867 -5.045 -12.426 1.00 0.00 H new ATOM 0 HB3 LYS A 24 107.227 -6.151 -12.416 1.00 0.00 H new ATOM 0 HG2 LYS A 24 106.077 -7.710 -13.909 1.00 0.00 H new ATOM 0 HG3 LYS A 24 104.564 -6.840 -13.750 1.00 0.00 H new ATOM 0 HD2 LYS A 24 105.420 -6.033 -15.816 1.00 0.00 H new ATOM 0 HD3 LYS A 24 105.873 -4.770 -14.689 1.00 0.00 H new ATOM 0 HE2 LYS A 24 108.139 -5.830 -14.420 1.00 0.00 H new ATOM 0 HE3 LYS A 24 107.685 -7.079 -15.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 108.906 -5.296 -16.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 107.318 -5.363 -17.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 107.758 -4.153 -16.144 1.00 0.00 H new ATOM 402 N ASP A 25 106.938 -8.665 -12.056 1.00 0.00 N ATOM 403 CA ASP A 25 107.330 -10.063 -12.219 1.00 0.00 C ATOM 404 C ASP A 25 106.225 -10.856 -12.900 1.00 0.00 C ATOM 405 O ASP A 25 106.384 -11.312 -14.033 1.00 0.00 O ATOM 406 CB ASP A 25 107.621 -10.680 -10.852 1.00 0.00 C ATOM 407 CG ASP A 25 108.867 -10.045 -10.250 1.00 0.00 C ATOM 408 OD1 ASP A 25 109.951 -10.497 -10.576 1.00 0.00 O ATOM 409 OD2 ASP A 25 108.718 -9.117 -9.474 1.00 0.00 O ATOM 0 H ASP A 25 107.577 -7.991 -12.478 1.00 0.00 H new ATOM 0 HA ASP A 25 108.225 -10.098 -12.840 1.00 0.00 H new ATOM 0 HB2 ASP A 25 106.770 -10.531 -10.188 1.00 0.00 H new ATOM 0 HB3 ASP A 25 107.763 -11.756 -10.952 1.00 0.00 H new ATOM 414 N LYS A 26 105.110 -11.033 -12.201 1.00 0.00 N ATOM 415 CA LYS A 26 104.001 -11.791 -12.757 1.00 0.00 C ATOM 416 C LYS A 26 104.537 -13.042 -13.438 1.00 0.00 C ATOM 417 O LYS A 26 103.824 -13.717 -14.179 1.00 0.00 O ATOM 418 CB LYS A 26 103.234 -10.938 -13.770 1.00 0.00 C ATOM 419 CG LYS A 26 102.298 -9.982 -13.027 1.00 0.00 C ATOM 420 CD LYS A 26 101.205 -9.493 -13.980 1.00 0.00 C ATOM 421 CE LYS A 26 100.015 -8.977 -13.169 1.00 0.00 C ATOM 422 NZ LYS A 26 99.256 -10.133 -12.613 1.00 0.00 N ATOM 0 H LYS A 26 104.953 -10.667 -11.262 1.00 0.00 H new ATOM 0 HA LYS A 26 103.322 -12.075 -11.953 1.00 0.00 H new ATOM 0 HB2 LYS A 26 103.932 -10.373 -14.388 1.00 0.00 H new ATOM 0 HB3 LYS A 26 102.660 -11.578 -14.440 1.00 0.00 H new ATOM 0 HG2 LYS A 26 101.850 -10.487 -12.171 1.00 0.00 H new ATOM 0 HG3 LYS A 26 102.861 -9.134 -12.637 1.00 0.00 H new ATOM 0 HD2 LYS A 26 101.593 -8.701 -14.620 1.00 0.00 H new ATOM 0 HD3 LYS A 26 100.888 -10.305 -14.634 1.00 0.00 H new ATOM 0 HE2 LYS A 26 100.363 -8.334 -12.361 1.00 0.00 H new ATOM 0 HE3 LYS A 26 99.365 -8.371 -13.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 98.283 -9.837 -12.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 99.234 -10.903 -13.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 99.720 -10.467 -11.744 1.00 0.00 H new ATOM 436 N ASP A 27 105.810 -13.336 -13.182 1.00 0.00 N ATOM 437 CA ASP A 27 106.449 -14.502 -13.776 1.00 0.00 C ATOM 438 C ASP A 27 107.426 -15.151 -12.797 1.00 0.00 C ATOM 439 O ASP A 27 107.158 -16.232 -12.273 1.00 0.00 O ATOM 440 CB ASP A 27 107.197 -14.094 -15.046 1.00 0.00 C ATOM 441 CG ASP A 27 106.268 -13.314 -15.971 1.00 0.00 C ATOM 442 OD1 ASP A 27 105.092 -13.638 -16.006 1.00 0.00 O ATOM 443 OD2 ASP A 27 106.746 -12.405 -16.630 1.00 0.00 O ATOM 0 H ASP A 27 106.414 -12.786 -12.571 1.00 0.00 H new ATOM 0 HA ASP A 27 105.672 -15.226 -14.022 1.00 0.00 H new ATOM 0 HB2 ASP A 27 108.063 -13.484 -14.788 1.00 0.00 H new ATOM 0 HB3 ASP A 27 107.573 -14.980 -15.557 1.00 0.00 H new ATOM 448 N ILE A 28 108.569 -14.504 -12.572 1.00 0.00 N ATOM 449 CA ILE A 28 109.580 -15.056 -11.674 1.00 0.00 C ATOM 450 C ILE A 28 110.212 -13.972 -10.802 1.00 0.00 C ATOM 451 O ILE A 28 110.223 -12.795 -11.163 1.00 0.00 O ATOM 452 CB ILE A 28 110.662 -15.737 -12.510 1.00 0.00 C ATOM 453 CG1 ILE A 28 110.057 -16.972 -13.181 1.00 0.00 C ATOM 454 CG2 ILE A 28 111.843 -16.137 -11.619 1.00 0.00 C ATOM 455 CD1 ILE A 28 110.980 -18.179 -12.993 1.00 0.00 C ATOM 0 H ILE A 28 108.815 -13.608 -12.994 1.00 0.00 H new ATOM 0 HA ILE A 28 109.098 -15.775 -11.011 1.00 0.00 H new ATOM 0 HB ILE A 28 111.030 -15.050 -13.272 1.00 0.00 H new ATOM 0 HG12 ILE A 28 109.077 -17.184 -12.754 1.00 0.00 H new ATOM 0 HG13 ILE A 28 109.907 -16.781 -14.244 1.00 0.00 H new ATOM 0 HG21 ILE A 28 112.608 -16.622 -12.225 1.00 0.00 H new ATOM 0 HG22 ILE A 28 112.262 -15.247 -11.149 1.00 0.00 H new ATOM 0 HG23 ILE A 28 111.500 -16.827 -10.848 1.00 0.00 H new ATOM 0 HD11 ILE A 28 110.540 -19.052 -13.474 1.00 0.00 H new ATOM 0 HD12 ILE A 28 111.951 -17.968 -13.442 1.00 0.00 H new ATOM 0 HD13 ILE A 28 111.108 -18.377 -11.929 1.00 0.00 H new ATOM 467 N ILE A 29 110.744 -14.384 -9.653 1.00 0.00 N ATOM 468 CA ILE A 29 111.386 -13.451 -8.729 1.00 0.00 C ATOM 469 C ILE A 29 112.715 -14.021 -8.238 1.00 0.00 C ATOM 470 O ILE A 29 112.880 -15.236 -8.142 1.00 0.00 O ATOM 471 CB ILE A 29 110.471 -13.184 -7.528 1.00 0.00 C ATOM 472 CG1 ILE A 29 109.501 -12.045 -7.857 1.00 0.00 C ATOM 473 CG2 ILE A 29 111.318 -12.788 -6.317 1.00 0.00 C ATOM 474 CD1 ILE A 29 108.215 -12.623 -8.451 1.00 0.00 C ATOM 0 H ILE A 29 110.743 -15.355 -9.340 1.00 0.00 H new ATOM 0 HA ILE A 29 111.571 -12.516 -9.257 1.00 0.00 H new ATOM 0 HB ILE A 29 109.906 -14.089 -7.302 1.00 0.00 H new ATOM 0 HG12 ILE A 29 109.274 -11.475 -6.956 1.00 0.00 H new ATOM 0 HG13 ILE A 29 109.961 -11.354 -8.563 1.00 0.00 H new ATOM 0 HG21 ILE A 29 110.667 -12.598 -5.464 1.00 0.00 H new ATOM 0 HG22 ILE A 29 112.007 -13.597 -6.075 1.00 0.00 H new ATOM 0 HG23 ILE A 29 111.884 -11.886 -6.549 1.00 0.00 H new ATOM 0 HD11 ILE A 29 107.525 -11.812 -8.685 1.00 0.00 H new ATOM 0 HD12 ILE A 29 108.450 -13.173 -9.362 1.00 0.00 H new ATOM 0 HD13 ILE A 29 107.752 -13.296 -7.730 1.00 0.00 H new ATOM 486 N GLY A 30 113.658 -13.136 -7.926 1.00 0.00 N ATOM 487 CA GLY A 30 114.967 -13.569 -7.444 1.00 0.00 C ATOM 488 C GLY A 30 115.477 -12.647 -6.341 1.00 0.00 C ATOM 489 O GLY A 30 115.667 -11.452 -6.560 1.00 0.00 O ATOM 0 H GLY A 30 113.543 -12.125 -7.997 1.00 0.00 H new ATOM 0 HA2 GLY A 30 114.900 -14.590 -7.067 1.00 0.00 H new ATOM 0 HA3 GLY A 30 115.677 -13.580 -8.271 1.00 0.00 H new ATOM 493 N PHE A 31 115.700 -13.209 -5.156 1.00 0.00 N ATOM 494 CA PHE A 31 116.192 -12.423 -4.030 1.00 0.00 C ATOM 495 C PHE A 31 117.714 -12.493 -3.951 1.00 0.00 C ATOM 496 O PHE A 31 118.290 -13.579 -3.885 1.00 0.00 O ATOM 497 CB PHE A 31 115.601 -12.946 -2.717 1.00 0.00 C ATOM 498 CG PHE A 31 114.103 -12.765 -2.706 1.00 0.00 C ATOM 499 CD1 PHE A 31 113.289 -13.606 -3.475 1.00 0.00 C ATOM 500 CD2 PHE A 31 113.525 -11.766 -1.913 1.00 0.00 C ATOM 501 CE1 PHE A 31 111.898 -13.446 -3.452 1.00 0.00 C ATOM 502 CE2 PHE A 31 112.134 -11.607 -1.889 1.00 0.00 C ATOM 503 CZ PHE A 31 111.321 -12.448 -2.659 1.00 0.00 C ATOM 0 H PHE A 31 115.549 -14.197 -4.952 1.00 0.00 H new ATOM 0 HA PHE A 31 115.885 -11.388 -4.183 1.00 0.00 H new ATOM 0 HB2 PHE A 31 115.847 -14.001 -2.595 1.00 0.00 H new ATOM 0 HB3 PHE A 31 116.044 -12.415 -1.874 1.00 0.00 H new ATOM 0 HD1 PHE A 31 113.734 -14.378 -4.086 1.00 0.00 H new ATOM 0 HD2 PHE A 31 114.153 -11.118 -1.319 1.00 0.00 H new ATOM 0 HE1 PHE A 31 111.270 -14.093 -4.047 1.00 0.00 H new ATOM 0 HE2 PHE A 31 111.689 -10.836 -1.277 1.00 0.00 H new ATOM 0 HZ PHE A 31 110.248 -12.326 -2.641 1.00 0.00 H new ATOM 513 N TYR A 32 118.360 -11.332 -3.947 1.00 0.00 N ATOM 514 CA TYR A 32 119.816 -11.285 -3.863 1.00 0.00 C ATOM 515 C TYR A 32 120.251 -10.956 -2.438 1.00 0.00 C ATOM 516 O TYR A 32 119.846 -9.936 -1.880 1.00 0.00 O ATOM 517 CB TYR A 32 120.363 -10.227 -4.824 1.00 0.00 C ATOM 518 CG TYR A 32 121.872 -10.281 -4.826 1.00 0.00 C ATOM 519 CD1 TYR A 32 122.531 -11.428 -5.281 1.00 0.00 C ATOM 520 CD2 TYR A 32 122.612 -9.182 -4.371 1.00 0.00 C ATOM 521 CE1 TYR A 32 123.930 -11.478 -5.283 1.00 0.00 C ATOM 522 CE2 TYR A 32 124.011 -9.232 -4.372 1.00 0.00 C ATOM 523 CZ TYR A 32 124.670 -10.380 -4.829 1.00 0.00 C ATOM 524 OH TYR A 32 126.049 -10.429 -4.830 1.00 0.00 O ATOM 0 H TYR A 32 117.905 -10.420 -4.000 1.00 0.00 H new ATOM 0 HA TYR A 32 120.213 -12.262 -4.140 1.00 0.00 H new ATOM 0 HB2 TYR A 32 119.981 -10.402 -5.830 1.00 0.00 H new ATOM 0 HB3 TYR A 32 120.024 -9.236 -4.522 1.00 0.00 H new ATOM 0 HD1 TYR A 32 121.960 -12.275 -5.631 1.00 0.00 H new ATOM 0 HD2 TYR A 32 122.103 -8.296 -4.020 1.00 0.00 H new ATOM 0 HE1 TYR A 32 124.438 -12.364 -5.635 1.00 0.00 H new ATOM 0 HE2 TYR A 32 124.582 -8.385 -4.020 1.00 0.00 H new ATOM 0 HH TYR A 32 126.388 -10.095 -5.687 1.00 0.00 H new ATOM 534 N PHE A 33 121.073 -11.822 -1.849 1.00 0.00 N ATOM 535 CA PHE A 33 121.543 -11.601 -0.485 1.00 0.00 C ATOM 536 C PHE A 33 123.052 -11.394 -0.460 1.00 0.00 C ATOM 537 O PHE A 33 123.821 -12.314 -0.748 1.00 0.00 O ATOM 538 CB PHE A 33 121.180 -12.802 0.392 1.00 0.00 C ATOM 539 CG PHE A 33 119.700 -13.071 0.284 1.00 0.00 C ATOM 540 CD1 PHE A 33 118.784 -12.048 0.547 1.00 0.00 C ATOM 541 CD2 PHE A 33 119.243 -14.341 -0.083 1.00 0.00 C ATOM 542 CE1 PHE A 33 117.410 -12.293 0.444 1.00 0.00 C ATOM 543 CE2 PHE A 33 117.869 -14.587 -0.189 1.00 0.00 C ATOM 544 CZ PHE A 33 116.953 -13.562 0.075 1.00 0.00 C ATOM 0 H PHE A 33 121.423 -12.673 -2.289 1.00 0.00 H new ATOM 0 HA PHE A 33 121.059 -10.704 -0.098 1.00 0.00 H new ATOM 0 HB2 PHE A 33 121.744 -13.680 0.078 1.00 0.00 H new ATOM 0 HB3 PHE A 33 121.450 -12.604 1.429 1.00 0.00 H new ATOM 0 HD1 PHE A 33 119.137 -11.067 0.830 1.00 0.00 H new ATOM 0 HD2 PHE A 33 119.950 -15.132 -0.285 1.00 0.00 H new ATOM 0 HE1 PHE A 33 116.703 -11.503 0.649 1.00 0.00 H new ATOM 0 HE2 PHE A 33 117.516 -15.567 -0.474 1.00 0.00 H new ATOM 0 HZ PHE A 33 115.893 -13.751 -0.006 1.00 0.00 H new ATOM 554 N SER A 34 123.468 -10.181 -0.108 1.00 0.00 N ATOM 555 CA SER A 34 124.887 -9.856 -0.043 1.00 0.00 C ATOM 556 C SER A 34 125.111 -8.370 -0.308 1.00 0.00 C ATOM 557 O SER A 34 125.235 -7.949 -1.457 1.00 0.00 O ATOM 558 CB SER A 34 125.659 -10.680 -1.072 1.00 0.00 C ATOM 559 OG SER A 34 124.854 -10.860 -2.230 1.00 0.00 O ATOM 0 H SER A 34 122.845 -9.411 0.135 1.00 0.00 H new ATOM 0 HA SER A 34 125.248 -10.093 0.958 1.00 0.00 H new ATOM 0 HB2 SER A 34 126.588 -10.175 -1.336 1.00 0.00 H new ATOM 0 HB3 SER A 34 125.931 -11.648 -0.650 1.00 0.00 H new ATOM 0 HG SER A 34 125.212 -10.319 -2.965 1.00 0.00 H new ATOM 565 N ALA A 35 125.163 -7.583 0.762 1.00 0.00 N ATOM 566 CA ALA A 35 125.377 -6.146 0.626 1.00 0.00 C ATOM 567 C ALA A 35 126.245 -5.854 -0.591 1.00 0.00 C ATOM 568 O ALA A 35 125.930 -4.982 -1.400 1.00 0.00 O ATOM 569 CB ALA A 35 126.052 -5.597 1.883 1.00 0.00 C ATOM 0 H ALA A 35 125.061 -7.911 1.723 1.00 0.00 H new ATOM 0 HA ALA A 35 124.410 -5.661 0.496 1.00 0.00 H new ATOM 0 HB1 ALA A 35 126.208 -4.524 1.773 1.00 0.00 H new ATOM 0 HB2 ALA A 35 125.417 -5.784 2.749 1.00 0.00 H new ATOM 0 HB3 ALA A 35 127.013 -6.091 2.025 1.00 0.00 H new ATOM 575 N HIS A 36 127.334 -6.599 -0.713 1.00 0.00 N ATOM 576 CA HIS A 36 128.248 -6.429 -1.835 1.00 0.00 C ATOM 577 C HIS A 36 128.918 -5.058 -1.797 1.00 0.00 C ATOM 578 O HIS A 36 129.978 -4.866 -2.393 1.00 0.00 O ATOM 579 CB HIS A 36 127.491 -6.589 -3.155 1.00 0.00 C ATOM 580 CG HIS A 36 128.291 -7.453 -4.091 1.00 0.00 C ATOM 581 ND1 HIS A 36 129.199 -6.922 -4.992 1.00 0.00 N ATOM 582 CD2 HIS A 36 128.332 -8.813 -4.274 1.00 0.00 C ATOM 583 CE1 HIS A 36 129.744 -7.948 -5.672 1.00 0.00 C ATOM 584 NE2 HIS A 36 129.250 -9.123 -5.273 1.00 0.00 N ATOM 0 H HIS A 36 127.607 -7.326 -0.051 1.00 0.00 H new ATOM 0 HA HIS A 36 129.020 -7.194 -1.758 1.00 0.00 H new ATOM 0 HB2 HIS A 36 126.514 -7.038 -2.974 1.00 0.00 H new ATOM 0 HB3 HIS A 36 127.315 -5.612 -3.606 1.00 0.00 H new ATOM 0 HD2 HIS A 36 127.742 -9.533 -3.726 1.00 0.00 H new ATOM 0 HE1 HIS A 36 130.489 -7.835 -6.445 1.00 0.00 H new ATOM 0 HE2 HIS A 36 129.493 -10.049 -5.625 1.00 0.00 H new ATOM 593 N TRP A 37 128.301 -4.106 -1.103 1.00 0.00 N ATOM 594 CA TRP A 37 128.870 -2.768 -1.020 1.00 0.00 C ATOM 595 C TRP A 37 129.775 -2.642 0.202 1.00 0.00 C ATOM 596 O TRP A 37 130.913 -2.184 0.095 1.00 0.00 O ATOM 597 CB TRP A 37 127.751 -1.727 -0.969 1.00 0.00 C ATOM 598 CG TRP A 37 127.449 -1.363 0.448 1.00 0.00 C ATOM 599 CD1 TRP A 37 126.384 -1.805 1.153 1.00 0.00 C ATOM 600 CD2 TRP A 37 128.197 -0.486 1.339 1.00 0.00 C ATOM 601 NE1 TRP A 37 126.426 -1.251 2.418 1.00 0.00 N ATOM 602 CE2 TRP A 37 127.526 -0.434 2.583 1.00 0.00 C ATOM 603 CE3 TRP A 37 129.378 0.262 1.192 1.00 0.00 C ATOM 604 CZ2 TRP A 37 128.008 0.331 3.642 1.00 0.00 C ATOM 605 CZ3 TRP A 37 129.868 1.035 2.257 1.00 0.00 C ATOM 606 CH2 TRP A 37 129.184 1.068 3.481 1.00 0.00 C ATOM 0 H TRP A 37 127.423 -4.233 -0.599 1.00 0.00 H new ATOM 0 HA TRP A 37 129.475 -2.590 -1.909 1.00 0.00 H new ATOM 0 HB2 TRP A 37 128.046 -0.838 -1.526 1.00 0.00 H new ATOM 0 HB3 TRP A 37 126.856 -2.121 -1.450 1.00 0.00 H new ATOM 0 HD1 TRP A 37 125.625 -2.480 0.787 1.00 0.00 H new ATOM 0 HE1 TRP A 37 125.729 -1.425 3.142 1.00 0.00 H new ATOM 0 HE3 TRP A 37 129.912 0.242 0.254 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 127.476 0.354 4.582 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 130.776 1.607 2.133 1.00 0.00 H new ATOM 0 HH2 TRP A 37 129.566 1.662 4.298 1.00 0.00 H new ATOM 617 N CYS A 38 129.273 -3.060 1.360 1.00 0.00 N ATOM 618 CA CYS A 38 130.065 -2.996 2.582 1.00 0.00 C ATOM 619 C CYS A 38 131.110 -4.107 2.591 1.00 0.00 C ATOM 620 O CYS A 38 132.291 -3.864 2.836 1.00 0.00 O ATOM 621 CB CYS A 38 129.158 -3.131 3.808 1.00 0.00 C ATOM 622 SG CYS A 38 129.393 -1.702 4.893 1.00 0.00 S ATOM 0 H CYS A 38 128.334 -3.442 1.477 1.00 0.00 H new ATOM 0 HA CYS A 38 130.570 -2.031 2.618 1.00 0.00 H new ATOM 0 HB2 CYS A 38 128.115 -3.197 3.497 1.00 0.00 H new ATOM 0 HB3 CYS A 38 129.389 -4.051 4.345 1.00 0.00 H new ATOM 0 HG CYS A 38 128.866 -0.648 4.343 1.00 0.00 H new ATOM 628 N PRO A 39 130.691 -5.316 2.324 1.00 0.00 N ATOM 629 CA PRO A 39 131.587 -6.501 2.291 1.00 0.00 C ATOM 630 C PRO A 39 132.215 -6.711 0.912 1.00 0.00 C ATOM 631 O PRO A 39 131.521 -7.032 -0.052 1.00 0.00 O ATOM 632 CB PRO A 39 130.638 -7.646 2.635 1.00 0.00 C ATOM 633 CG PRO A 39 129.301 -7.226 2.109 1.00 0.00 C ATOM 634 CD PRO A 39 129.302 -5.692 2.026 1.00 0.00 C ATOM 0 HA PRO A 39 132.434 -6.407 2.971 1.00 0.00 H new ATOM 0 HB2 PRO A 39 130.965 -8.579 2.176 1.00 0.00 H new ATOM 0 HB3 PRO A 39 130.601 -7.816 3.711 1.00 0.00 H new ATOM 0 HG2 PRO A 39 129.120 -7.663 1.127 1.00 0.00 H new ATOM 0 HG3 PRO A 39 128.503 -7.574 2.765 1.00 0.00 H new ATOM 0 HD2 PRO A 39 128.999 -5.346 1.038 1.00 0.00 H new ATOM 0 HD3 PRO A 39 128.608 -5.254 2.743 1.00 0.00 H new ATOM 642 N PRO A 40 133.506 -6.539 0.805 1.00 0.00 N ATOM 643 CA PRO A 40 134.238 -6.716 -0.483 1.00 0.00 C ATOM 644 C PRO A 40 133.880 -8.030 -1.174 1.00 0.00 C ATOM 645 O PRO A 40 133.522 -9.009 -0.519 1.00 0.00 O ATOM 646 CB PRO A 40 135.711 -6.701 -0.070 1.00 0.00 C ATOM 647 CG PRO A 40 135.758 -5.944 1.217 1.00 0.00 C ATOM 648 CD PRO A 40 134.408 -6.157 1.903 1.00 0.00 C ATOM 0 HA PRO A 40 133.986 -5.939 -1.205 1.00 0.00 H new ATOM 0 HB2 PRO A 40 136.093 -7.714 0.057 1.00 0.00 H new ATOM 0 HB3 PRO A 40 136.327 -6.221 -0.830 1.00 0.00 H new ATOM 0 HG2 PRO A 40 136.573 -6.302 1.847 1.00 0.00 H new ATOM 0 HG3 PRO A 40 135.937 -4.884 1.036 1.00 0.00 H new ATOM 0 HD2 PRO A 40 134.465 -6.937 2.662 1.00 0.00 H new ATOM 0 HD3 PRO A 40 134.067 -5.250 2.403 1.00 0.00 H new ATOM 656 N CYS A 41 133.981 -8.044 -2.500 1.00 0.00 N ATOM 657 CA CYS A 41 133.665 -9.242 -3.271 1.00 0.00 C ATOM 658 C CYS A 41 133.271 -8.873 -4.698 1.00 0.00 C ATOM 659 O CYS A 41 132.286 -9.383 -5.233 1.00 0.00 O ATOM 660 CB CYS A 41 132.520 -10.007 -2.604 1.00 0.00 C ATOM 661 SG CYS A 41 133.201 -11.303 -1.538 1.00 0.00 S ATOM 0 H CYS A 41 134.277 -7.245 -3.060 1.00 0.00 H new ATOM 0 HA CYS A 41 134.552 -9.874 -3.304 1.00 0.00 H new ATOM 0 HB2 CYS A 41 131.905 -9.324 -2.017 1.00 0.00 H new ATOM 0 HB3 CYS A 41 131.872 -10.448 -3.362 1.00 0.00 H new ATOM 0 HG CYS A 41 133.540 -10.789 -0.393 1.00 0.00 H new ATOM 667 N ARG A 42 134.045 -7.982 -5.309 1.00 0.00 N ATOM 668 CA ARG A 42 133.768 -7.547 -6.674 1.00 0.00 C ATOM 669 C ARG A 42 134.304 -8.556 -7.686 1.00 0.00 C ATOM 670 O ARG A 42 135.303 -9.231 -7.438 1.00 0.00 O ATOM 671 CB ARG A 42 134.411 -6.182 -6.925 1.00 0.00 C ATOM 672 CG ARG A 42 133.708 -5.121 -6.074 1.00 0.00 C ATOM 673 CD ARG A 42 132.334 -4.811 -6.673 1.00 0.00 C ATOM 674 NE ARG A 42 132.208 -3.383 -6.932 1.00 0.00 N ATOM 675 CZ ARG A 42 132.783 -2.822 -7.991 1.00 0.00 C ATOM 676 NH1 ARG A 42 133.475 -3.554 -8.820 1.00 0.00 N ATOM 677 NH2 ARG A 42 132.655 -1.541 -8.203 1.00 0.00 N ATOM 0 H ARG A 42 134.865 -7.549 -4.884 1.00 0.00 H new ATOM 0 HA ARG A 42 132.687 -7.472 -6.796 1.00 0.00 H new ATOM 0 HB2 ARG A 42 135.472 -6.217 -6.678 1.00 0.00 H new ATOM 0 HB3 ARG A 42 134.338 -5.923 -7.981 1.00 0.00 H new ATOM 0 HG2 ARG A 42 133.598 -5.476 -5.050 1.00 0.00 H new ATOM 0 HG3 ARG A 42 134.311 -4.214 -6.034 1.00 0.00 H new ATOM 0 HD2 ARG A 42 132.199 -5.369 -7.599 1.00 0.00 H new ATOM 0 HD3 ARG A 42 131.550 -5.134 -5.989 1.00 0.00 H new ATOM 0 HE ARG A 42 131.669 -2.803 -6.289 1.00 0.00 H new ATOM 0 HH11 ARG A 42 133.574 -4.556 -8.655 1.00 0.00 H new ATOM 0 HH12 ARG A 42 133.917 -3.125 -9.633 1.00 0.00 H new ATOM 0 HH21 ARG A 42 132.113 -0.969 -7.556 1.00 0.00 H new ATOM 0 HH22 ARG A 42 133.097 -1.112 -9.016 1.00 0.00 H new ATOM 691 N GLY A 43 133.633 -8.647 -8.831 1.00 0.00 N ATOM 692 CA GLY A 43 134.047 -9.570 -9.883 1.00 0.00 C ATOM 693 C GLY A 43 132.918 -10.530 -10.249 1.00 0.00 C ATOM 694 O GLY A 43 132.753 -10.891 -11.414 1.00 0.00 O ATOM 0 H GLY A 43 132.804 -8.096 -9.053 1.00 0.00 H new ATOM 0 HA2 GLY A 43 134.350 -9.007 -10.766 1.00 0.00 H new ATOM 0 HA3 GLY A 43 134.917 -10.137 -9.552 1.00 0.00 H new ATOM 698 N PHE A 44 132.142 -10.933 -9.250 1.00 0.00 N ATOM 699 CA PHE A 44 131.027 -11.844 -9.483 1.00 0.00 C ATOM 700 C PHE A 44 129.779 -11.065 -9.886 1.00 0.00 C ATOM 701 O PHE A 44 129.089 -11.419 -10.842 1.00 0.00 O ATOM 702 CB PHE A 44 130.739 -12.653 -8.217 1.00 0.00 C ATOM 703 CG PHE A 44 130.162 -13.996 -8.595 1.00 0.00 C ATOM 704 CD1 PHE A 44 130.892 -14.866 -9.413 1.00 0.00 C ATOM 705 CD2 PHE A 44 128.898 -14.371 -8.127 1.00 0.00 C ATOM 706 CE1 PHE A 44 130.357 -16.111 -9.764 1.00 0.00 C ATOM 707 CE2 PHE A 44 128.362 -15.617 -8.477 1.00 0.00 C ATOM 708 CZ PHE A 44 129.093 -16.486 -9.296 1.00 0.00 C ATOM 0 H PHE A 44 132.262 -10.647 -8.278 1.00 0.00 H new ATOM 0 HA PHE A 44 131.298 -12.522 -10.292 1.00 0.00 H new ATOM 0 HB2 PHE A 44 131.656 -12.788 -7.643 1.00 0.00 H new ATOM 0 HB3 PHE A 44 130.040 -12.112 -7.579 1.00 0.00 H new ATOM 0 HD1 PHE A 44 131.868 -14.577 -9.773 1.00 0.00 H new ATOM 0 HD2 PHE A 44 128.335 -13.699 -7.496 1.00 0.00 H new ATOM 0 HE1 PHE A 44 130.920 -16.782 -10.396 1.00 0.00 H new ATOM 0 HE2 PHE A 44 127.386 -15.907 -8.116 1.00 0.00 H new ATOM 0 HZ PHE A 44 128.681 -17.447 -9.567 1.00 0.00 H new ATOM 718 N THR A 45 129.501 -10.003 -9.142 1.00 0.00 N ATOM 719 CA THR A 45 128.334 -9.168 -9.411 1.00 0.00 C ATOM 720 C THR A 45 128.192 -8.889 -10.906 1.00 0.00 C ATOM 721 O THR A 45 127.167 -9.209 -11.508 1.00 0.00 O ATOM 722 CB THR A 45 128.449 -7.848 -8.645 1.00 0.00 C ATOM 723 OG1 THR A 45 127.936 -8.020 -7.331 1.00 0.00 O ATOM 724 CG2 THR A 45 127.649 -6.761 -9.366 1.00 0.00 C ATOM 0 H THR A 45 130.065 -9.698 -8.349 1.00 0.00 H new ATOM 0 HA THR A 45 127.446 -9.705 -9.077 1.00 0.00 H new ATOM 0 HB THR A 45 129.496 -7.550 -8.594 1.00 0.00 H new ATOM 0 HG1 THR A 45 127.696 -7.147 -6.957 1.00 0.00 H new ATOM 0 HG21 THR A 45 127.733 -5.823 -8.817 1.00 0.00 H new ATOM 0 HG22 THR A 45 128.042 -6.629 -10.374 1.00 0.00 H new ATOM 0 HG23 THR A 45 126.601 -7.056 -9.421 1.00 0.00 H new ATOM 732 N PRO A 46 129.188 -8.298 -11.510 1.00 0.00 N ATOM 733 CA PRO A 46 129.165 -7.965 -12.961 1.00 0.00 C ATOM 734 C PRO A 46 128.663 -9.127 -13.814 1.00 0.00 C ATOM 735 O PRO A 46 128.364 -8.955 -14.996 1.00 0.00 O ATOM 736 CB PRO A 46 130.626 -7.624 -13.300 1.00 0.00 C ATOM 737 CG PRO A 46 131.425 -7.869 -12.056 1.00 0.00 C ATOM 738 CD PRO A 46 130.444 -7.878 -10.887 1.00 0.00 C ATOM 0 HA PRO A 46 128.480 -7.144 -13.171 1.00 0.00 H new ATOM 0 HB2 PRO A 46 130.988 -8.244 -14.121 1.00 0.00 H new ATOM 0 HB3 PRO A 46 130.717 -6.586 -13.620 1.00 0.00 H new ATOM 0 HG2 PRO A 46 131.956 -8.819 -12.120 1.00 0.00 H new ATOM 0 HG3 PRO A 46 132.177 -7.091 -11.922 1.00 0.00 H new ATOM 0 HD2 PRO A 46 130.756 -8.569 -10.104 1.00 0.00 H new ATOM 0 HD3 PRO A 46 130.356 -6.894 -10.427 1.00 0.00 H new ATOM 746 N ILE A 47 128.566 -10.306 -13.209 1.00 0.00 N ATOM 747 CA ILE A 47 128.089 -11.478 -13.931 1.00 0.00 C ATOM 748 C ILE A 47 126.566 -11.526 -13.906 1.00 0.00 C ATOM 749 O ILE A 47 125.918 -11.739 -14.936 1.00 0.00 O ATOM 750 CB ILE A 47 128.653 -12.750 -13.300 1.00 0.00 C ATOM 751 CG1 ILE A 47 130.183 -12.658 -13.259 1.00 0.00 C ATOM 752 CG2 ILE A 47 128.233 -13.959 -14.135 1.00 0.00 C ATOM 753 CD1 ILE A 47 130.790 -14.040 -13.511 1.00 0.00 C ATOM 0 H ILE A 47 128.808 -10.474 -12.233 1.00 0.00 H new ATOM 0 HA ILE A 47 128.427 -11.411 -14.965 1.00 0.00 H new ATOM 0 HB ILE A 47 128.268 -12.860 -12.286 1.00 0.00 H new ATOM 0 HG12 ILE A 47 130.535 -11.953 -14.012 1.00 0.00 H new ATOM 0 HG13 ILE A 47 130.508 -12.278 -12.290 1.00 0.00 H new ATOM 0 HG21 ILE A 47 128.634 -14.868 -13.687 1.00 0.00 H new ATOM 0 HG22 ILE A 47 127.145 -14.019 -14.166 1.00 0.00 H new ATOM 0 HG23 ILE A 47 128.620 -13.853 -15.149 1.00 0.00 H new ATOM 0 HD11 ILE A 47 131.877 -13.971 -13.481 1.00 0.00 H new ATOM 0 HD12 ILE A 47 130.449 -14.733 -12.742 1.00 0.00 H new ATOM 0 HD13 ILE A 47 130.476 -14.402 -14.490 1.00 0.00 H new ATOM 765 N LEU A 48 125.995 -11.309 -12.727 1.00 0.00 N ATOM 766 CA LEU A 48 124.552 -11.316 -12.592 1.00 0.00 C ATOM 767 C LEU A 48 123.967 -10.143 -13.372 1.00 0.00 C ATOM 768 O LEU A 48 122.883 -10.238 -13.944 1.00 0.00 O ATOM 769 CB LEU A 48 124.166 -11.238 -11.110 1.00 0.00 C ATOM 770 CG LEU A 48 123.213 -10.069 -10.874 1.00 0.00 C ATOM 771 CD1 LEU A 48 121.917 -10.294 -11.655 1.00 0.00 C ATOM 772 CD2 LEU A 48 122.892 -9.972 -9.381 1.00 0.00 C ATOM 0 H LEU A 48 126.506 -11.128 -11.863 1.00 0.00 H new ATOM 0 HA LEU A 48 124.147 -12.243 -12.999 1.00 0.00 H new ATOM 0 HB2 LEU A 48 123.693 -12.170 -10.800 1.00 0.00 H new ATOM 0 HB3 LEU A 48 125.061 -11.116 -10.500 1.00 0.00 H new ATOM 0 HG LEU A 48 123.683 -9.146 -11.212 1.00 0.00 H new ATOM 0 HD11 LEU A 48 121.239 -9.458 -11.484 1.00 0.00 H new ATOM 0 HD12 LEU A 48 122.142 -10.367 -12.719 1.00 0.00 H new ATOM 0 HD13 LEU A 48 121.445 -11.218 -11.319 1.00 0.00 H new ATOM 0 HD21 LEU A 48 122.212 -9.138 -9.209 1.00 0.00 H new ATOM 0 HD22 LEU A 48 122.423 -10.898 -9.049 1.00 0.00 H new ATOM 0 HD23 LEU A 48 123.813 -9.811 -8.821 1.00 0.00 H new ATOM 784 N ALA A 49 124.709 -9.041 -13.412 1.00 0.00 N ATOM 785 CA ALA A 49 124.259 -7.867 -14.147 1.00 0.00 C ATOM 786 C ALA A 49 124.237 -8.174 -15.640 1.00 0.00 C ATOM 787 O ALA A 49 123.569 -7.493 -16.420 1.00 0.00 O ATOM 788 CB ALA A 49 125.193 -6.688 -13.875 1.00 0.00 C ATOM 0 H ALA A 49 125.613 -8.937 -12.950 1.00 0.00 H new ATOM 0 HA ALA A 49 123.254 -7.605 -13.818 1.00 0.00 H new ATOM 0 HB1 ALA A 49 124.848 -5.815 -14.429 1.00 0.00 H new ATOM 0 HB2 ALA A 49 125.194 -6.463 -12.808 1.00 0.00 H new ATOM 0 HB3 ALA A 49 126.204 -6.944 -14.193 1.00 0.00 H new ATOM 794 N ASP A 50 124.962 -9.215 -16.029 1.00 0.00 N ATOM 795 CA ASP A 50 125.010 -9.613 -17.426 1.00 0.00 C ATOM 796 C ASP A 50 123.796 -10.465 -17.768 1.00 0.00 C ATOM 797 O ASP A 50 123.225 -10.343 -18.852 1.00 0.00 O ATOM 798 CB ASP A 50 126.292 -10.402 -17.704 1.00 0.00 C ATOM 799 CG ASP A 50 127.205 -9.604 -18.630 1.00 0.00 C ATOM 800 OD1 ASP A 50 127.734 -8.599 -18.185 1.00 0.00 O ATOM 801 OD2 ASP A 50 127.361 -10.010 -19.770 1.00 0.00 O ATOM 0 H ASP A 50 125.520 -9.794 -15.401 1.00 0.00 H new ATOM 0 HA ASP A 50 125.002 -8.717 -18.047 1.00 0.00 H new ATOM 0 HB2 ASP A 50 126.807 -10.616 -16.768 1.00 0.00 H new ATOM 0 HB3 ASP A 50 126.047 -11.361 -18.160 1.00 0.00 H new ATOM 806 N MET A 51 123.404 -11.328 -16.835 1.00 0.00 N ATOM 807 CA MET A 51 122.250 -12.191 -17.060 1.00 0.00 C ATOM 808 C MET A 51 120.951 -11.399 -16.972 1.00 0.00 C ATOM 809 O MET A 51 120.035 -11.610 -17.769 1.00 0.00 O ATOM 810 CB MET A 51 122.238 -13.342 -16.048 1.00 0.00 C ATOM 811 CG MET A 51 121.770 -12.838 -14.682 1.00 0.00 C ATOM 812 SD MET A 51 121.405 -14.250 -13.617 1.00 0.00 S ATOM 813 CE MET A 51 119.768 -14.594 -14.297 1.00 0.00 C ATOM 0 H MET A 51 123.860 -11.447 -15.930 1.00 0.00 H new ATOM 0 HA MET A 51 122.329 -12.606 -18.065 1.00 0.00 H new ATOM 0 HB2 MET A 51 121.578 -14.136 -16.397 1.00 0.00 H new ATOM 0 HB3 MET A 51 123.236 -13.772 -15.963 1.00 0.00 H new ATOM 0 HG2 MET A 51 122.541 -12.215 -14.228 1.00 0.00 H new ATOM 0 HG3 MET A 51 120.883 -12.215 -14.796 1.00 0.00 H new ATOM 0 HE1 MET A 51 119.527 -15.647 -14.151 1.00 0.00 H new ATOM 0 HE2 MET A 51 119.026 -13.979 -13.788 1.00 0.00 H new ATOM 0 HE3 MET A 51 119.761 -14.364 -15.362 1.00 0.00 H new ATOM 823 N TYR A 52 120.870 -10.486 -16.011 1.00 0.00 N ATOM 824 CA TYR A 52 119.665 -9.680 -15.861 1.00 0.00 C ATOM 825 C TYR A 52 119.623 -8.606 -16.939 1.00 0.00 C ATOM 826 O TYR A 52 118.549 -8.184 -17.366 1.00 0.00 O ATOM 827 CB TYR A 52 119.608 -9.042 -14.468 1.00 0.00 C ATOM 828 CG TYR A 52 120.026 -7.594 -14.550 1.00 0.00 C ATOM 829 CD1 TYR A 52 121.254 -7.264 -15.123 1.00 0.00 C ATOM 830 CD2 TYR A 52 119.189 -6.586 -14.057 1.00 0.00 C ATOM 831 CE1 TYR A 52 121.653 -5.925 -15.206 1.00 0.00 C ATOM 832 CE2 TYR A 52 119.586 -5.246 -14.140 1.00 0.00 C ATOM 833 CZ TYR A 52 120.817 -4.915 -14.715 1.00 0.00 C ATOM 834 OH TYR A 52 121.209 -3.595 -14.798 1.00 0.00 O ATOM 0 H TYR A 52 121.609 -10.288 -15.336 1.00 0.00 H new ATOM 0 HA TYR A 52 118.796 -10.328 -15.972 1.00 0.00 H new ATOM 0 HB2 TYR A 52 118.598 -9.116 -14.065 1.00 0.00 H new ATOM 0 HB3 TYR A 52 120.264 -9.581 -13.784 1.00 0.00 H new ATOM 0 HD1 TYR A 52 121.898 -8.043 -15.503 1.00 0.00 H new ATOM 0 HD2 TYR A 52 118.238 -6.842 -13.613 1.00 0.00 H new ATOM 0 HE1 TYR A 52 122.605 -5.671 -15.648 1.00 0.00 H new ATOM 0 HE2 TYR A 52 118.941 -4.468 -13.760 1.00 0.00 H new ATOM 0 HH TYR A 52 120.502 -3.070 -15.229 1.00 0.00 H new ATOM 844 N SER A 53 120.799 -8.171 -17.391 1.00 0.00 N ATOM 845 CA SER A 53 120.865 -7.156 -18.430 1.00 0.00 C ATOM 846 C SER A 53 120.350 -7.722 -19.744 1.00 0.00 C ATOM 847 O SER A 53 119.638 -7.045 -20.486 1.00 0.00 O ATOM 848 CB SER A 53 122.303 -6.667 -18.604 1.00 0.00 C ATOM 849 OG SER A 53 122.432 -6.024 -19.866 1.00 0.00 O ATOM 0 H SER A 53 121.704 -8.503 -17.057 1.00 0.00 H new ATOM 0 HA SER A 53 120.240 -6.313 -18.134 1.00 0.00 H new ATOM 0 HB2 SER A 53 122.564 -5.976 -17.803 1.00 0.00 H new ATOM 0 HB3 SER A 53 122.995 -7.507 -18.538 1.00 0.00 H new ATOM 0 HG SER A 53 123.353 -5.708 -19.980 1.00 0.00 H new ATOM 855 N GLU A 54 120.697 -8.975 -20.021 1.00 0.00 N ATOM 856 CA GLU A 54 120.240 -9.617 -21.242 1.00 0.00 C ATOM 857 C GLU A 54 118.756 -9.935 -21.117 1.00 0.00 C ATOM 858 O GLU A 54 117.964 -9.641 -22.015 1.00 0.00 O ATOM 859 CB GLU A 54 121.044 -10.898 -21.489 1.00 0.00 C ATOM 860 CG GLU A 54 120.101 -12.056 -21.820 1.00 0.00 C ATOM 861 CD GLU A 54 119.260 -11.711 -23.045 1.00 0.00 C ATOM 862 OE1 GLU A 54 119.799 -11.110 -23.960 1.00 0.00 O ATOM 863 OE2 GLU A 54 118.088 -12.054 -23.050 1.00 0.00 O ATOM 0 H GLU A 54 121.285 -9.557 -19.424 1.00 0.00 H new ATOM 0 HA GLU A 54 120.391 -8.947 -22.088 1.00 0.00 H new ATOM 0 HB2 GLU A 54 121.745 -10.744 -22.309 1.00 0.00 H new ATOM 0 HB3 GLU A 54 121.635 -11.141 -20.606 1.00 0.00 H new ATOM 0 HG2 GLU A 54 120.677 -12.962 -22.008 1.00 0.00 H new ATOM 0 HG3 GLU A 54 119.452 -12.261 -20.969 1.00 0.00 H new ATOM 870 N LEU A 55 118.386 -10.523 -19.986 1.00 0.00 N ATOM 871 CA LEU A 55 116.995 -10.864 -19.739 1.00 0.00 C ATOM 872 C LEU A 55 116.128 -9.614 -19.808 1.00 0.00 C ATOM 873 O LEU A 55 115.031 -9.645 -20.360 1.00 0.00 O ATOM 874 CB LEU A 55 116.846 -11.519 -18.364 1.00 0.00 C ATOM 875 CG LEU A 55 116.850 -13.039 -18.519 1.00 0.00 C ATOM 876 CD1 LEU A 55 116.738 -13.695 -17.141 1.00 0.00 C ATOM 877 CD2 LEU A 55 115.659 -13.470 -19.382 1.00 0.00 C ATOM 0 H LEU A 55 119.026 -10.771 -19.232 1.00 0.00 H new ATOM 0 HA LEU A 55 116.669 -11.568 -20.505 1.00 0.00 H new ATOM 0 HB2 LEU A 55 117.661 -11.208 -17.711 1.00 0.00 H new ATOM 0 HB3 LEU A 55 115.918 -11.193 -17.893 1.00 0.00 H new ATOM 0 HG LEU A 55 117.779 -13.349 -18.997 1.00 0.00 H new ATOM 0 HD11 LEU A 55 116.741 -14.779 -17.253 1.00 0.00 H new ATOM 0 HD12 LEU A 55 117.584 -13.392 -16.524 1.00 0.00 H new ATOM 0 HD13 LEU A 55 115.810 -13.382 -16.663 1.00 0.00 H new ATOM 0 HD21 LEU A 55 115.663 -14.554 -19.492 1.00 0.00 H new ATOM 0 HD22 LEU A 55 114.731 -13.157 -18.904 1.00 0.00 H new ATOM 0 HD23 LEU A 55 115.735 -13.005 -20.365 1.00 0.00 H new ATOM 889 N VAL A 56 116.631 -8.509 -19.256 1.00 0.00 N ATOM 890 CA VAL A 56 115.883 -7.257 -19.278 1.00 0.00 C ATOM 891 C VAL A 56 115.631 -6.840 -20.714 1.00 0.00 C ATOM 892 O VAL A 56 114.505 -6.510 -21.089 1.00 0.00 O ATOM 893 CB VAL A 56 116.659 -6.165 -18.540 1.00 0.00 C ATOM 894 CG1 VAL A 56 115.946 -4.824 -18.718 1.00 0.00 C ATOM 895 CG2 VAL A 56 116.724 -6.509 -17.050 1.00 0.00 C ATOM 0 H VAL A 56 117.540 -8.457 -18.795 1.00 0.00 H new ATOM 0 HA VAL A 56 114.927 -7.403 -18.775 1.00 0.00 H new ATOM 0 HB VAL A 56 117.668 -6.098 -18.946 1.00 0.00 H new ATOM 0 HG11 VAL A 56 116.499 -4.045 -18.192 1.00 0.00 H new ATOM 0 HG12 VAL A 56 115.893 -4.578 -19.779 1.00 0.00 H new ATOM 0 HG13 VAL A 56 114.937 -4.891 -18.310 1.00 0.00 H new ATOM 0 HG21 VAL A 56 117.277 -5.732 -16.521 1.00 0.00 H new ATOM 0 HG22 VAL A 56 115.713 -6.574 -16.647 1.00 0.00 H new ATOM 0 HG23 VAL A 56 117.229 -7.466 -16.919 1.00 0.00 H new ATOM 905 N ASP A 57 116.676 -6.887 -21.519 1.00 0.00 N ATOM 906 CA ASP A 57 116.549 -6.545 -22.922 1.00 0.00 C ATOM 907 C ASP A 57 115.422 -7.367 -23.528 1.00 0.00 C ATOM 908 O ASP A 57 114.713 -6.917 -24.428 1.00 0.00 O ATOM 909 CB ASP A 57 117.858 -6.851 -23.642 1.00 0.00 C ATOM 910 CG ASP A 57 117.942 -6.057 -24.941 1.00 0.00 C ATOM 911 OD1 ASP A 57 117.870 -4.841 -24.876 1.00 0.00 O ATOM 912 OD2 ASP A 57 118.076 -6.677 -25.984 1.00 0.00 O ATOM 0 H ASP A 57 117.616 -7.157 -21.228 1.00 0.00 H new ATOM 0 HA ASP A 57 116.326 -5.483 -23.028 1.00 0.00 H new ATOM 0 HB2 ASP A 57 118.702 -6.601 -22.999 1.00 0.00 H new ATOM 0 HB3 ASP A 57 117.924 -7.918 -23.854 1.00 0.00 H new ATOM 917 N ASP A 58 115.266 -8.579 -23.006 1.00 0.00 N ATOM 918 CA ASP A 58 114.222 -9.482 -23.469 1.00 0.00 C ATOM 919 C ASP A 58 112.970 -9.310 -22.626 1.00 0.00 C ATOM 920 O ASP A 58 112.129 -10.206 -22.551 1.00 0.00 O ATOM 921 CB ASP A 58 114.707 -10.928 -23.364 1.00 0.00 C ATOM 922 CG ASP A 58 114.894 -11.521 -24.756 1.00 0.00 C ATOM 923 OD1 ASP A 58 113.907 -11.651 -25.461 1.00 0.00 O ATOM 924 OD2 ASP A 58 116.022 -11.837 -25.097 1.00 0.00 O ATOM 0 H ASP A 58 115.851 -8.958 -22.261 1.00 0.00 H new ATOM 0 HA ASP A 58 113.990 -9.248 -24.508 1.00 0.00 H new ATOM 0 HB2 ASP A 58 115.648 -10.965 -22.815 1.00 0.00 H new ATOM 0 HB3 ASP A 58 113.986 -11.521 -22.801 1.00 0.00 H new ATOM 929 N SER A 59 112.865 -8.161 -21.978 1.00 0.00 N ATOM 930 CA SER A 59 111.722 -7.886 -21.118 1.00 0.00 C ATOM 931 C SER A 59 111.812 -8.755 -19.873 1.00 0.00 C ATOM 932 O SER A 59 110.809 -9.051 -19.225 1.00 0.00 O ATOM 933 CB SER A 59 110.417 -8.175 -21.861 1.00 0.00 C ATOM 934 OG SER A 59 109.352 -7.476 -21.229 1.00 0.00 O ATOM 0 H SER A 59 113.551 -7.408 -22.029 1.00 0.00 H new ATOM 0 HA SER A 59 111.733 -6.834 -20.832 1.00 0.00 H new ATOM 0 HB2 SER A 59 110.502 -7.866 -22.903 1.00 0.00 H new ATOM 0 HB3 SER A 59 110.215 -9.246 -21.861 1.00 0.00 H new ATOM 0 HG SER A 59 109.349 -7.682 -20.271 1.00 0.00 H new ATOM 940 N ALA A 60 113.039 -9.154 -19.561 1.00 0.00 N ATOM 941 CA ALA A 60 113.315 -9.995 -18.402 1.00 0.00 C ATOM 942 C ALA A 60 112.026 -10.467 -17.736 1.00 0.00 C ATOM 943 O ALA A 60 111.276 -9.668 -17.175 1.00 0.00 O ATOM 944 CB ALA A 60 114.155 -9.216 -17.395 1.00 0.00 C ATOM 0 H ALA A 60 113.868 -8.905 -20.101 1.00 0.00 H new ATOM 0 HA ALA A 60 113.861 -10.874 -18.743 1.00 0.00 H new ATOM 0 HB1 ALA A 60 114.361 -9.845 -16.529 1.00 0.00 H new ATOM 0 HB2 ALA A 60 115.095 -8.918 -17.859 1.00 0.00 H new ATOM 0 HB3 ALA A 60 113.610 -8.327 -17.077 1.00 0.00 H new ATOM 950 N PRO A 61 111.761 -11.745 -17.788 1.00 0.00 N ATOM 951 CA PRO A 61 110.542 -12.345 -17.179 1.00 0.00 C ATOM 952 C PRO A 61 110.700 -12.586 -15.681 1.00 0.00 C ATOM 953 O PRO A 61 110.223 -13.590 -15.153 1.00 0.00 O ATOM 954 CB PRO A 61 110.401 -13.668 -17.929 1.00 0.00 C ATOM 955 CG PRO A 61 111.795 -14.061 -18.293 1.00 0.00 C ATOM 956 CD PRO A 61 112.599 -12.767 -18.437 1.00 0.00 C ATOM 0 HA PRO A 61 109.672 -11.694 -17.265 1.00 0.00 H new ATOM 0 HB2 PRO A 61 109.928 -14.426 -17.305 1.00 0.00 H new ATOM 0 HB3 PRO A 61 109.779 -13.553 -18.817 1.00 0.00 H new ATOM 0 HG2 PRO A 61 112.229 -14.701 -17.525 1.00 0.00 H new ATOM 0 HG3 PRO A 61 111.806 -14.628 -19.224 1.00 0.00 H new ATOM 0 HD2 PRO A 61 113.573 -12.848 -17.955 1.00 0.00 H new ATOM 0 HD3 PRO A 61 112.781 -12.526 -19.484 1.00 0.00 H new ATOM 964 N PHE A 62 111.362 -11.659 -14.998 1.00 0.00 N ATOM 965 CA PHE A 62 111.556 -11.794 -13.562 1.00 0.00 C ATOM 966 C PHE A 62 112.161 -10.528 -12.957 1.00 0.00 C ATOM 967 O PHE A 62 112.834 -9.758 -13.640 1.00 0.00 O ATOM 968 CB PHE A 62 112.437 -13.008 -13.278 1.00 0.00 C ATOM 969 CG PHE A 62 113.880 -12.597 -13.166 1.00 0.00 C ATOM 970 CD1 PHE A 62 114.448 -11.754 -14.126 1.00 0.00 C ATOM 971 CD2 PHE A 62 114.655 -13.075 -12.105 1.00 0.00 C ATOM 972 CE1 PHE A 62 115.793 -11.389 -14.024 1.00 0.00 C ATOM 973 CE2 PHE A 62 115.999 -12.710 -12.001 1.00 0.00 C ATOM 974 CZ PHE A 62 116.571 -11.866 -12.961 1.00 0.00 C ATOM 0 H PHE A 62 111.768 -10.818 -15.409 1.00 0.00 H new ATOM 0 HA PHE A 62 110.583 -11.940 -13.093 1.00 0.00 H new ATOM 0 HB2 PHE A 62 112.117 -13.489 -12.354 1.00 0.00 H new ATOM 0 HB3 PHE A 62 112.323 -13.742 -14.075 1.00 0.00 H new ATOM 0 HD1 PHE A 62 113.848 -11.386 -14.945 1.00 0.00 H new ATOM 0 HD2 PHE A 62 114.214 -13.727 -11.365 1.00 0.00 H new ATOM 0 HE1 PHE A 62 116.233 -10.739 -14.765 1.00 0.00 H new ATOM 0 HE2 PHE A 62 116.597 -13.078 -11.181 1.00 0.00 H new ATOM 0 HZ PHE A 62 117.610 -11.583 -12.882 1.00 0.00 H new ATOM 984 N GLU A 63 111.896 -10.320 -11.670 1.00 0.00 N ATOM 985 CA GLU A 63 112.394 -9.144 -10.960 1.00 0.00 C ATOM 986 C GLU A 63 113.388 -9.539 -9.873 1.00 0.00 C ATOM 987 O GLU A 63 113.283 -10.612 -9.279 1.00 0.00 O ATOM 988 CB GLU A 63 111.221 -8.394 -10.324 1.00 0.00 C ATOM 989 CG GLU A 63 111.662 -6.978 -9.954 1.00 0.00 C ATOM 990 CD GLU A 63 111.313 -6.687 -8.499 1.00 0.00 C ATOM 991 OE1 GLU A 63 111.696 -7.474 -7.649 1.00 0.00 O ATOM 992 OE2 GLU A 63 110.667 -5.681 -8.255 1.00 0.00 O ATOM 0 H GLU A 63 111.338 -10.952 -11.096 1.00 0.00 H new ATOM 0 HA GLU A 63 112.903 -8.502 -11.679 1.00 0.00 H new ATOM 0 HB2 GLU A 63 110.381 -8.355 -11.018 1.00 0.00 H new ATOM 0 HB3 GLU A 63 110.876 -8.923 -9.435 1.00 0.00 H new ATOM 0 HG2 GLU A 63 112.736 -6.871 -10.107 1.00 0.00 H new ATOM 0 HG3 GLU A 63 111.173 -6.254 -10.606 1.00 0.00 H new ATOM 999 N ILE A 64 114.348 -8.658 -9.618 1.00 0.00 N ATOM 1000 CA ILE A 64 115.356 -8.913 -8.596 1.00 0.00 C ATOM 1001 C ILE A 64 115.050 -8.118 -7.332 1.00 0.00 C ATOM 1002 O ILE A 64 114.826 -6.909 -7.383 1.00 0.00 O ATOM 1003 CB ILE A 64 116.746 -8.528 -9.119 1.00 0.00 C ATOM 1004 CG1 ILE A 64 117.593 -9.790 -9.296 1.00 0.00 C ATOM 1005 CG2 ILE A 64 117.440 -7.596 -8.121 1.00 0.00 C ATOM 1006 CD1 ILE A 64 117.058 -10.606 -10.472 1.00 0.00 C ATOM 0 H ILE A 64 114.450 -7.766 -10.102 1.00 0.00 H new ATOM 0 HA ILE A 64 115.340 -9.976 -8.357 1.00 0.00 H new ATOM 0 HB ILE A 64 116.636 -8.018 -10.076 1.00 0.00 H new ATOM 0 HG12 ILE A 64 118.634 -9.520 -9.472 1.00 0.00 H new ATOM 0 HG13 ILE A 64 117.568 -10.387 -8.385 1.00 0.00 H new ATOM 0 HG21 ILE A 64 118.426 -7.327 -8.499 1.00 0.00 H new ATOM 0 HG22 ILE A 64 116.843 -6.693 -7.990 1.00 0.00 H new ATOM 0 HG23 ILE A 64 117.545 -8.103 -7.162 1.00 0.00 H new ATOM 0 HD11 ILE A 64 117.663 -11.504 -10.596 1.00 0.00 H new ATOM 0 HD12 ILE A 64 116.023 -10.889 -10.278 1.00 0.00 H new ATOM 0 HD13 ILE A 64 117.106 -10.008 -11.382 1.00 0.00 H new ATOM 1018 N ILE A 65 115.061 -8.805 -6.197 1.00 0.00 N ATOM 1019 CA ILE A 65 114.805 -8.154 -4.920 1.00 0.00 C ATOM 1020 C ILE A 65 116.122 -7.662 -4.332 1.00 0.00 C ATOM 1021 O ILE A 65 117.120 -8.387 -4.342 1.00 0.00 O ATOM 1022 CB ILE A 65 114.137 -9.137 -3.955 1.00 0.00 C ATOM 1023 CG1 ILE A 65 113.262 -10.113 -4.747 1.00 0.00 C ATOM 1024 CG2 ILE A 65 113.267 -8.372 -2.958 1.00 0.00 C ATOM 1025 CD1 ILE A 65 112.114 -9.348 -5.410 1.00 0.00 C ATOM 0 H ILE A 65 115.243 -9.807 -6.135 1.00 0.00 H new ATOM 0 HA ILE A 65 114.137 -7.306 -5.074 1.00 0.00 H new ATOM 0 HB ILE A 65 114.906 -9.689 -3.414 1.00 0.00 H new ATOM 0 HG12 ILE A 65 113.859 -10.621 -5.504 1.00 0.00 H new ATOM 0 HG13 ILE A 65 112.865 -10.882 -4.084 1.00 0.00 H new ATOM 0 HG21 ILE A 65 112.794 -9.076 -2.273 1.00 0.00 H new ATOM 0 HG22 ILE A 65 113.887 -7.677 -2.392 1.00 0.00 H new ATOM 0 HG23 ILE A 65 112.499 -7.817 -3.496 1.00 0.00 H new ATOM 0 HD11 ILE A 65 111.491 -10.043 -5.974 1.00 0.00 H new ATOM 0 HD12 ILE A 65 111.511 -8.860 -4.644 1.00 0.00 H new ATOM 0 HD13 ILE A 65 112.521 -8.595 -6.085 1.00 0.00 H new ATOM 1037 N PHE A 66 116.128 -6.433 -3.827 1.00 0.00 N ATOM 1038 CA PHE A 66 117.344 -5.873 -3.252 1.00 0.00 C ATOM 1039 C PHE A 66 117.325 -5.973 -1.731 1.00 0.00 C ATOM 1040 O PHE A 66 116.638 -5.208 -1.055 1.00 0.00 O ATOM 1041 CB PHE A 66 117.492 -4.412 -3.670 1.00 0.00 C ATOM 1042 CG PHE A 66 118.957 -4.079 -3.823 1.00 0.00 C ATOM 1043 CD1 PHE A 66 119.789 -4.041 -2.698 1.00 0.00 C ATOM 1044 CD2 PHE A 66 119.484 -3.811 -5.093 1.00 0.00 C ATOM 1045 CE1 PHE A 66 121.148 -3.733 -2.842 1.00 0.00 C ATOM 1046 CE2 PHE A 66 120.842 -3.503 -5.236 1.00 0.00 C ATOM 1047 CZ PHE A 66 121.674 -3.464 -4.110 1.00 0.00 C ATOM 0 H PHE A 66 115.317 -5.814 -3.804 1.00 0.00 H new ATOM 0 HA PHE A 66 118.193 -6.447 -3.625 1.00 0.00 H new ATOM 0 HB2 PHE A 66 116.968 -4.236 -4.609 1.00 0.00 H new ATOM 0 HB3 PHE A 66 117.036 -3.761 -2.924 1.00 0.00 H new ATOM 0 HD1 PHE A 66 119.383 -4.249 -1.719 1.00 0.00 H new ATOM 0 HD2 PHE A 66 118.843 -3.842 -5.961 1.00 0.00 H new ATOM 0 HE1 PHE A 66 121.790 -3.703 -1.974 1.00 0.00 H new ATOM 0 HE2 PHE A 66 121.248 -3.295 -6.215 1.00 0.00 H new ATOM 0 HZ PHE A 66 122.722 -3.226 -4.221 1.00 0.00 H new ATOM 1057 N VAL A 67 118.095 -6.918 -1.203 1.00 0.00 N ATOM 1058 CA VAL A 67 118.176 -7.112 0.238 1.00 0.00 C ATOM 1059 C VAL A 67 119.634 -7.069 0.680 1.00 0.00 C ATOM 1060 O VAL A 67 120.496 -6.590 -0.057 1.00 0.00 O ATOM 1061 CB VAL A 67 117.555 -8.456 0.625 1.00 0.00 C ATOM 1062 CG1 VAL A 67 116.618 -8.266 1.819 1.00 0.00 C ATOM 1063 CG2 VAL A 67 116.760 -9.015 -0.559 1.00 0.00 C ATOM 0 H VAL A 67 118.670 -7.559 -1.750 1.00 0.00 H new ATOM 0 HA VAL A 67 117.625 -6.314 0.735 1.00 0.00 H new ATOM 0 HB VAL A 67 118.349 -9.153 0.893 1.00 0.00 H new ATOM 0 HG11 VAL A 67 116.177 -9.225 2.092 1.00 0.00 H new ATOM 0 HG12 VAL A 67 117.182 -7.872 2.665 1.00 0.00 H new ATOM 0 HG13 VAL A 67 115.826 -7.566 1.552 1.00 0.00 H new ATOM 0 HG21 VAL A 67 116.319 -9.972 -0.281 1.00 0.00 H new ATOM 0 HG22 VAL A 67 115.969 -8.315 -0.829 1.00 0.00 H new ATOM 0 HG23 VAL A 67 117.426 -9.156 -1.410 1.00 0.00 H new ATOM 1073 N SER A 68 119.914 -7.572 1.878 1.00 0.00 N ATOM 1074 CA SER A 68 121.284 -7.573 2.377 1.00 0.00 C ATOM 1075 C SER A 68 121.643 -6.210 2.955 1.00 0.00 C ATOM 1076 O SER A 68 121.109 -5.188 2.530 1.00 0.00 O ATOM 1077 CB SER A 68 122.249 -7.919 1.244 1.00 0.00 C ATOM 1078 OG SER A 68 123.210 -8.856 1.716 1.00 0.00 O ATOM 0 H SER A 68 119.225 -7.977 2.511 1.00 0.00 H new ATOM 0 HA SER A 68 121.365 -8.322 3.165 1.00 0.00 H new ATOM 0 HB2 SER A 68 121.701 -8.336 0.399 1.00 0.00 H new ATOM 0 HB3 SER A 68 122.747 -7.018 0.887 1.00 0.00 H new ATOM 0 HG SER A 68 123.480 -8.617 2.627 1.00 0.00 H new ATOM 1084 N SER A 69 122.539 -6.202 3.936 1.00 0.00 N ATOM 1085 CA SER A 69 122.955 -4.957 4.572 1.00 0.00 C ATOM 1086 C SER A 69 123.325 -3.898 3.531 1.00 0.00 C ATOM 1087 O SER A 69 124.492 -3.537 3.389 1.00 0.00 O ATOM 1088 CB SER A 69 124.156 -5.216 5.482 1.00 0.00 C ATOM 1089 OG SER A 69 123.705 -5.376 6.820 1.00 0.00 O ATOM 0 H SER A 69 122.989 -7.039 4.307 1.00 0.00 H new ATOM 0 HA SER A 69 122.117 -4.583 5.160 1.00 0.00 H new ATOM 0 HB2 SER A 69 124.688 -6.110 5.156 1.00 0.00 H new ATOM 0 HB3 SER A 69 124.860 -4.386 5.420 1.00 0.00 H new ATOM 0 HG SER A 69 124.472 -5.544 7.406 1.00 0.00 H new ATOM 1095 N ASP A 70 122.320 -3.396 2.819 1.00 0.00 N ATOM 1096 CA ASP A 70 122.545 -2.365 1.808 1.00 0.00 C ATOM 1097 C ASP A 70 122.107 -1.014 2.347 1.00 0.00 C ATOM 1098 O ASP A 70 122.001 -0.040 1.603 1.00 0.00 O ATOM 1099 CB ASP A 70 121.763 -2.668 0.530 1.00 0.00 C ATOM 1100 CG ASP A 70 121.456 -4.157 0.434 1.00 0.00 C ATOM 1101 OD1 ASP A 70 122.381 -4.919 0.204 1.00 0.00 O ATOM 1102 OD2 ASP A 70 120.301 -4.514 0.590 1.00 0.00 O ATOM 0 H ASP A 70 121.347 -3.684 2.922 1.00 0.00 H new ATOM 0 HA ASP A 70 123.609 -2.349 1.573 1.00 0.00 H new ATOM 0 HB2 ASP A 70 120.834 -2.098 0.521 1.00 0.00 H new ATOM 0 HB3 ASP A 70 122.339 -2.352 -0.340 1.00 0.00 H new ATOM 1107 N ARG A 71 121.831 -0.979 3.644 1.00 0.00 N ATOM 1108 CA ARG A 71 121.380 0.244 4.301 1.00 0.00 C ATOM 1109 C ARG A 71 121.988 1.481 3.647 1.00 0.00 C ATOM 1110 O ARG A 71 121.554 2.602 3.910 1.00 0.00 O ATOM 1111 CB ARG A 71 121.763 0.210 5.782 1.00 0.00 C ATOM 1112 CG ARG A 71 123.244 -0.147 5.920 1.00 0.00 C ATOM 1113 CD ARG A 71 124.100 1.043 5.484 1.00 0.00 C ATOM 1114 NE ARG A 71 125.259 1.178 6.359 1.00 0.00 N ATOM 1115 CZ ARG A 71 125.766 2.372 6.650 1.00 0.00 C ATOM 1116 NH1 ARG A 71 125.225 3.449 6.150 1.00 0.00 N ATOM 1117 NH2 ARG A 71 126.803 2.467 7.437 1.00 0.00 N ATOM 0 H ARG A 71 121.911 -1.785 4.264 1.00 0.00 H new ATOM 0 HA ARG A 71 120.296 0.300 4.200 1.00 0.00 H new ATOM 0 HB2 ARG A 71 121.568 1.179 6.241 1.00 0.00 H new ATOM 0 HB3 ARG A 71 121.151 -0.522 6.310 1.00 0.00 H new ATOM 0 HG2 ARG A 71 123.470 -0.412 6.953 1.00 0.00 H new ATOM 0 HG3 ARG A 71 123.477 -1.019 5.309 1.00 0.00 H new ATOM 0 HD2 ARG A 71 124.427 0.906 4.453 1.00 0.00 H new ATOM 0 HD3 ARG A 71 123.506 1.957 5.511 1.00 0.00 H new ATOM 0 HE ARG A 71 125.688 0.342 6.755 1.00 0.00 H new ATOM 0 HH11 ARG A 71 124.414 3.374 5.536 1.00 0.00 H new ATOM 0 HH12 ARG A 71 125.613 4.365 6.373 1.00 0.00 H new ATOM 0 HH21 ARG A 71 127.225 1.625 7.829 1.00 0.00 H new ATOM 0 HH22 ARG A 71 127.192 3.383 7.660 1.00 0.00 H new ATOM 1131 N SER A 72 122.980 1.279 2.786 1.00 0.00 N ATOM 1132 CA SER A 72 123.605 2.403 2.107 1.00 0.00 C ATOM 1133 C SER A 72 122.719 2.864 0.956 1.00 0.00 C ATOM 1134 O SER A 72 122.548 2.149 -0.032 1.00 0.00 O ATOM 1135 CB SER A 72 124.977 1.995 1.570 1.00 0.00 C ATOM 1136 OG SER A 72 125.982 2.416 2.484 1.00 0.00 O ATOM 0 H SER A 72 123.362 0.364 2.546 1.00 0.00 H new ATOM 0 HA SER A 72 123.731 3.221 2.817 1.00 0.00 H new ATOM 0 HB2 SER A 72 125.021 0.914 1.435 1.00 0.00 H new ATOM 0 HB3 SER A 72 125.146 2.445 0.592 1.00 0.00 H new ATOM 0 HG SER A 72 126.547 1.652 2.724 1.00 0.00 H new ATOM 1142 N GLU A 73 122.149 4.057 1.091 1.00 0.00 N ATOM 1143 CA GLU A 73 121.276 4.591 0.054 1.00 0.00 C ATOM 1144 C GLU A 73 122.052 4.804 -1.236 1.00 0.00 C ATOM 1145 O GLU A 73 121.489 4.744 -2.328 1.00 0.00 O ATOM 1146 CB GLU A 73 120.664 5.916 0.513 1.00 0.00 C ATOM 1147 CG GLU A 73 121.719 7.021 0.430 1.00 0.00 C ATOM 1148 CD GLU A 73 121.234 8.262 1.173 1.00 0.00 C ATOM 1149 OE1 GLU A 73 121.144 8.203 2.388 1.00 0.00 O ATOM 1150 OE2 GLU A 73 120.960 9.252 0.515 1.00 0.00 O ATOM 0 H GLU A 73 122.274 4.666 1.899 1.00 0.00 H new ATOM 0 HA GLU A 73 120.478 3.872 -0.130 1.00 0.00 H new ATOM 0 HB2 GLU A 73 119.807 6.169 -0.112 1.00 0.00 H new ATOM 0 HB3 GLU A 73 120.297 5.825 1.535 1.00 0.00 H new ATOM 0 HG2 GLU A 73 122.657 6.672 0.861 1.00 0.00 H new ATOM 0 HG3 GLU A 73 121.919 7.266 -0.613 1.00 0.00 H new ATOM 1157 N ASP A 74 123.351 5.043 -1.104 1.00 0.00 N ATOM 1158 CA ASP A 74 124.189 5.251 -2.275 1.00 0.00 C ATOM 1159 C ASP A 74 124.521 3.914 -2.915 1.00 0.00 C ATOM 1160 O ASP A 74 124.338 3.730 -4.118 1.00 0.00 O ATOM 1161 CB ASP A 74 125.479 5.975 -1.882 1.00 0.00 C ATOM 1162 CG ASP A 74 125.368 6.500 -0.455 1.00 0.00 C ATOM 1163 OD1 ASP A 74 125.611 5.729 0.460 1.00 0.00 O ATOM 1164 OD2 ASP A 74 125.041 7.665 -0.296 1.00 0.00 O ATOM 0 H ASP A 74 123.840 5.097 -0.211 1.00 0.00 H new ATOM 0 HA ASP A 74 123.646 5.867 -2.992 1.00 0.00 H new ATOM 0 HB2 ASP A 74 126.327 5.295 -1.963 1.00 0.00 H new ATOM 0 HB3 ASP A 74 125.666 6.801 -2.569 1.00 0.00 H new ATOM 1169 N ASP A 75 124.993 2.974 -2.104 1.00 0.00 N ATOM 1170 CA ASP A 75 125.322 1.654 -2.614 1.00 0.00 C ATOM 1171 C ASP A 75 124.078 1.021 -3.218 1.00 0.00 C ATOM 1172 O ASP A 75 124.164 0.179 -4.111 1.00 0.00 O ATOM 1173 CB ASP A 75 125.853 0.768 -1.487 1.00 0.00 C ATOM 1174 CG ASP A 75 127.151 1.346 -0.936 1.00 0.00 C ATOM 1175 OD1 ASP A 75 128.104 1.438 -1.693 1.00 0.00 O ATOM 1176 OD2 ASP A 75 127.175 1.689 0.234 1.00 0.00 O ATOM 0 H ASP A 75 125.154 3.101 -1.105 1.00 0.00 H new ATOM 0 HA ASP A 75 126.093 1.750 -3.378 1.00 0.00 H new ATOM 0 HB2 ASP A 75 125.112 0.694 -0.691 1.00 0.00 H new ATOM 0 HB3 ASP A 75 126.024 -0.243 -1.858 1.00 0.00 H new ATOM 1181 N MET A 76 122.919 1.447 -2.725 1.00 0.00 N ATOM 1182 CA MET A 76 121.655 0.930 -3.223 1.00 0.00 C ATOM 1183 C MET A 76 121.414 1.424 -4.644 1.00 0.00 C ATOM 1184 O MET A 76 121.356 0.632 -5.584 1.00 0.00 O ATOM 1185 CB MET A 76 120.512 1.390 -2.317 1.00 0.00 C ATOM 1186 CG MET A 76 119.324 0.436 -2.461 1.00 0.00 C ATOM 1187 SD MET A 76 119.062 -0.440 -0.899 1.00 0.00 S ATOM 1188 CE MET A 76 118.908 1.021 0.158 1.00 0.00 C ATOM 0 H MET A 76 122.832 2.144 -1.986 1.00 0.00 H new ATOM 0 HA MET A 76 121.695 -0.159 -3.226 1.00 0.00 H new ATOM 0 HB2 MET A 76 120.846 1.417 -1.280 1.00 0.00 H new ATOM 0 HB3 MET A 76 120.211 2.404 -2.581 1.00 0.00 H new ATOM 0 HG2 MET A 76 118.427 0.993 -2.733 1.00 0.00 H new ATOM 0 HG3 MET A 76 119.512 -0.277 -3.263 1.00 0.00 H new ATOM 0 HE1 MET A 76 119.728 1.039 0.876 1.00 0.00 H new ATOM 0 HE2 MET A 76 118.945 1.920 -0.457 1.00 0.00 H new ATOM 0 HE3 MET A 76 117.959 0.985 0.692 1.00 0.00 H new ATOM 1198 N PHE A 77 121.268 2.738 -4.792 1.00 0.00 N ATOM 1199 CA PHE A 77 121.027 3.321 -6.105 1.00 0.00 C ATOM 1200 C PHE A 77 122.251 3.167 -7.002 1.00 0.00 C ATOM 1201 O PHE A 77 122.147 3.252 -8.225 1.00 0.00 O ATOM 1202 CB PHE A 77 120.681 4.804 -5.956 1.00 0.00 C ATOM 1203 CG PHE A 77 119.949 5.018 -4.652 1.00 0.00 C ATOM 1204 CD1 PHE A 77 119.099 4.023 -4.154 1.00 0.00 C ATOM 1205 CD2 PHE A 77 120.122 6.211 -3.939 1.00 0.00 C ATOM 1206 CE1 PHE A 77 118.421 4.221 -2.946 1.00 0.00 C ATOM 1207 CE2 PHE A 77 119.442 6.410 -2.731 1.00 0.00 C ATOM 1208 CZ PHE A 77 118.593 5.415 -2.234 1.00 0.00 C ATOM 0 H PHE A 77 121.312 3.411 -4.027 1.00 0.00 H new ATOM 0 HA PHE A 77 120.192 2.794 -6.567 1.00 0.00 H new ATOM 0 HB2 PHE A 77 121.590 5.405 -5.979 1.00 0.00 H new ATOM 0 HB3 PHE A 77 120.062 5.130 -6.792 1.00 0.00 H new ATOM 0 HD1 PHE A 77 118.967 3.102 -4.703 1.00 0.00 H new ATOM 0 HD2 PHE A 77 120.780 6.978 -4.321 1.00 0.00 H new ATOM 0 HE1 PHE A 77 117.765 3.453 -2.563 1.00 0.00 H new ATOM 0 HE2 PHE A 77 119.573 7.331 -2.183 1.00 0.00 H new ATOM 0 HZ PHE A 77 118.070 5.568 -1.301 1.00 0.00 H new ATOM 1218 N GLN A 78 123.409 2.935 -6.391 1.00 0.00 N ATOM 1219 CA GLN A 78 124.639 2.768 -7.156 1.00 0.00 C ATOM 1220 C GLN A 78 124.680 1.390 -7.799 1.00 0.00 C ATOM 1221 O GLN A 78 124.816 1.265 -9.017 1.00 0.00 O ATOM 1222 CB GLN A 78 125.855 2.949 -6.244 1.00 0.00 C ATOM 1223 CG GLN A 78 127.134 2.872 -7.079 1.00 0.00 C ATOM 1224 CD GLN A 78 128.349 3.128 -6.192 1.00 0.00 C ATOM 1225 OE1 GLN A 78 128.768 4.274 -6.028 1.00 0.00 O ATOM 1226 NE2 GLN A 78 128.942 2.124 -5.608 1.00 0.00 N ATOM 0 H GLN A 78 123.521 2.859 -5.380 1.00 0.00 H new ATOM 0 HA GLN A 78 124.664 3.525 -7.940 1.00 0.00 H new ATOM 0 HB2 GLN A 78 125.799 3.910 -5.732 1.00 0.00 H new ATOM 0 HB3 GLN A 78 125.864 2.178 -5.474 1.00 0.00 H new ATOM 0 HG2 GLN A 78 127.215 1.891 -7.547 1.00 0.00 H new ATOM 0 HG3 GLN A 78 127.099 3.607 -7.883 1.00 0.00 H new ATOM 0 HE21 GLN A 78 128.593 1.175 -5.745 1.00 0.00 H new ATOM 0 HE22 GLN A 78 129.755 2.287 -5.014 1.00 0.00 H new ATOM 1235 N TYR A 79 124.553 0.359 -6.976 1.00 0.00 N ATOM 1236 CA TYR A 79 124.568 -1.009 -7.477 1.00 0.00 C ATOM 1237 C TYR A 79 123.392 -1.228 -8.420 1.00 0.00 C ATOM 1238 O TYR A 79 123.443 -2.076 -9.311 1.00 0.00 O ATOM 1239 CB TYR A 79 124.487 -1.997 -6.312 1.00 0.00 C ATOM 1240 CG TYR A 79 125.881 -2.387 -5.884 1.00 0.00 C ATOM 1241 CD1 TYR A 79 126.594 -1.571 -4.998 1.00 0.00 C ATOM 1242 CD2 TYR A 79 126.461 -3.563 -6.374 1.00 0.00 C ATOM 1243 CE1 TYR A 79 127.888 -1.932 -4.601 1.00 0.00 C ATOM 1244 CE2 TYR A 79 127.754 -3.924 -5.976 1.00 0.00 C ATOM 1245 CZ TYR A 79 128.468 -3.108 -5.091 1.00 0.00 C ATOM 1246 OH TYR A 79 129.742 -3.464 -4.700 1.00 0.00 O ATOM 0 H TYR A 79 124.439 0.442 -5.966 1.00 0.00 H new ATOM 0 HA TYR A 79 125.499 -1.175 -8.019 1.00 0.00 H new ATOM 0 HB2 TYR A 79 123.951 -1.547 -5.476 1.00 0.00 H new ATOM 0 HB3 TYR A 79 123.926 -2.882 -6.611 1.00 0.00 H new ATOM 0 HD1 TYR A 79 126.147 -0.663 -4.621 1.00 0.00 H new ATOM 0 HD2 TYR A 79 125.911 -4.192 -7.059 1.00 0.00 H new ATOM 0 HE1 TYR A 79 128.438 -1.303 -3.917 1.00 0.00 H new ATOM 0 HE2 TYR A 79 128.201 -4.833 -6.352 1.00 0.00 H new ATOM 0 HH TYR A 79 129.690 -4.093 -3.951 1.00 0.00 H new ATOM 1256 N MET A 80 122.332 -0.450 -8.218 1.00 0.00 N ATOM 1257 CA MET A 80 121.146 -0.556 -9.056 1.00 0.00 C ATOM 1258 C MET A 80 121.344 0.210 -10.360 1.00 0.00 C ATOM 1259 O MET A 80 121.134 -0.331 -11.446 1.00 0.00 O ATOM 1260 CB MET A 80 119.930 0.001 -8.314 1.00 0.00 C ATOM 1261 CG MET A 80 119.652 -0.851 -7.074 1.00 0.00 C ATOM 1262 SD MET A 80 118.861 0.169 -5.805 1.00 0.00 S ATOM 1263 CE MET A 80 117.170 0.041 -6.435 1.00 0.00 C ATOM 0 H MET A 80 122.272 0.257 -7.485 1.00 0.00 H new ATOM 0 HA MET A 80 120.979 -1.608 -9.286 1.00 0.00 H new ATOM 0 HB2 MET A 80 120.111 1.036 -8.024 1.00 0.00 H new ATOM 0 HB3 MET A 80 119.060 0.002 -8.970 1.00 0.00 H new ATOM 0 HG2 MET A 80 119.008 -1.691 -7.334 1.00 0.00 H new ATOM 0 HG3 MET A 80 120.583 -1.269 -6.691 1.00 0.00 H new ATOM 0 HE1 MET A 80 116.471 0.388 -5.674 1.00 0.00 H new ATOM 0 HE2 MET A 80 117.067 0.656 -7.329 1.00 0.00 H new ATOM 0 HE3 MET A 80 116.951 -0.998 -6.682 1.00 0.00 H new ATOM 1273 N MET A 81 121.747 1.472 -10.244 1.00 0.00 N ATOM 1274 CA MET A 81 121.967 2.302 -11.423 1.00 0.00 C ATOM 1275 C MET A 81 123.153 1.787 -12.232 1.00 0.00 C ATOM 1276 O MET A 81 123.254 2.041 -13.432 1.00 0.00 O ATOM 1277 CB MET A 81 122.226 3.750 -11.003 1.00 0.00 C ATOM 1278 CG MET A 81 120.921 4.384 -10.517 1.00 0.00 C ATOM 1279 SD MET A 81 120.553 5.849 -11.515 1.00 0.00 S ATOM 1280 CE MET A 81 118.781 5.546 -11.719 1.00 0.00 C ATOM 0 H MET A 81 121.926 1.938 -9.355 1.00 0.00 H new ATOM 0 HA MET A 81 121.072 2.257 -12.044 1.00 0.00 H new ATOM 0 HB2 MET A 81 122.974 3.781 -10.211 1.00 0.00 H new ATOM 0 HB3 MET A 81 122.627 4.317 -11.843 1.00 0.00 H new ATOM 0 HG2 MET A 81 120.105 3.665 -10.592 1.00 0.00 H new ATOM 0 HG3 MET A 81 121.007 4.659 -9.466 1.00 0.00 H new ATOM 0 HE1 MET A 81 118.372 6.251 -12.443 1.00 0.00 H new ATOM 0 HE2 MET A 81 118.625 4.528 -12.075 1.00 0.00 H new ATOM 0 HE3 MET A 81 118.277 5.677 -10.761 1.00 0.00 H new ATOM 1290 N GLU A 82 124.049 1.064 -11.568 1.00 0.00 N ATOM 1291 CA GLU A 82 125.224 0.521 -12.239 1.00 0.00 C ATOM 1292 C GLU A 82 124.824 -0.553 -13.242 1.00 0.00 C ATOM 1293 O GLU A 82 125.149 -0.464 -14.426 1.00 0.00 O ATOM 1294 CB GLU A 82 126.187 -0.072 -11.208 1.00 0.00 C ATOM 1295 CG GLU A 82 127.268 0.955 -10.868 1.00 0.00 C ATOM 1296 CD GLU A 82 128.363 0.301 -10.033 1.00 0.00 C ATOM 1297 OE1 GLU A 82 128.384 -0.917 -9.968 1.00 0.00 O ATOM 1298 OE2 GLU A 82 129.167 1.027 -9.472 1.00 0.00 O ATOM 0 H GLU A 82 123.985 0.842 -10.574 1.00 0.00 H new ATOM 0 HA GLU A 82 125.718 1.332 -12.774 1.00 0.00 H new ATOM 0 HB2 GLU A 82 125.643 -0.354 -10.307 1.00 0.00 H new ATOM 0 HB3 GLU A 82 126.644 -0.980 -11.602 1.00 0.00 H new ATOM 0 HG2 GLU A 82 127.693 1.365 -11.784 1.00 0.00 H new ATOM 0 HG3 GLU A 82 126.830 1.789 -10.319 1.00 0.00 H new ATOM 1305 N SER A 83 124.121 -1.570 -12.758 1.00 0.00 N ATOM 1306 CA SER A 83 123.687 -2.662 -13.628 1.00 0.00 C ATOM 1307 C SER A 83 123.161 -3.867 -12.836 1.00 0.00 C ATOM 1308 O SER A 83 122.833 -4.895 -13.424 1.00 0.00 O ATOM 1309 CB SER A 83 124.851 -3.108 -14.513 1.00 0.00 C ATOM 1310 OG SER A 83 124.908 -2.281 -15.667 1.00 0.00 O ATOM 0 H SER A 83 123.841 -1.664 -11.782 1.00 0.00 H new ATOM 0 HA SER A 83 122.867 -2.284 -14.238 1.00 0.00 H new ATOM 0 HB2 SER A 83 125.788 -3.045 -13.960 1.00 0.00 H new ATOM 0 HB3 SER A 83 124.722 -4.150 -14.805 1.00 0.00 H new ATOM 0 HG SER A 83 125.223 -1.388 -15.414 1.00 0.00 H new ATOM 1316 N HIS A 84 123.085 -3.753 -11.513 1.00 0.00 N ATOM 1317 CA HIS A 84 122.598 -4.858 -10.694 1.00 0.00 C ATOM 1318 C HIS A 84 121.097 -4.723 -10.449 1.00 0.00 C ATOM 1319 O HIS A 84 120.639 -3.743 -9.861 1.00 0.00 O ATOM 1320 CB HIS A 84 123.337 -4.877 -9.354 1.00 0.00 C ATOM 1321 CG HIS A 84 123.897 -6.250 -9.103 1.00 0.00 C ATOM 1322 ND1 HIS A 84 123.988 -6.788 -7.828 1.00 0.00 N ATOM 1323 CD2 HIS A 84 124.403 -7.207 -9.950 1.00 0.00 C ATOM 1324 CE1 HIS A 84 124.529 -8.014 -7.943 1.00 0.00 C ATOM 1325 NE2 HIS A 84 124.801 -8.320 -9.214 1.00 0.00 N ATOM 0 H HIS A 84 123.351 -2.918 -10.991 1.00 0.00 H new ATOM 0 HA HIS A 84 122.784 -5.791 -11.226 1.00 0.00 H new ATOM 0 HB2 HIS A 84 124.141 -4.141 -9.361 1.00 0.00 H new ATOM 0 HB3 HIS A 84 122.657 -4.598 -8.549 1.00 0.00 H new ATOM 0 HD1 HIS A 84 123.698 -6.336 -6.961 1.00 0.00 H new ATOM 0 HD2 HIS A 84 124.480 -7.110 -11.023 1.00 0.00 H new ATOM 0 HE1 HIS A 84 124.720 -8.672 -7.108 1.00 0.00 H new ATOM 1334 N GLY A 85 120.335 -5.715 -10.904 1.00 0.00 N ATOM 1335 CA GLY A 85 118.886 -5.697 -10.728 1.00 0.00 C ATOM 1336 C GLY A 85 118.269 -4.488 -11.420 1.00 0.00 C ATOM 1337 O GLY A 85 118.680 -3.351 -11.183 1.00 0.00 O ATOM 0 H GLY A 85 120.694 -6.535 -11.393 1.00 0.00 H new ATOM 0 HA2 GLY A 85 118.455 -6.612 -11.134 1.00 0.00 H new ATOM 0 HA3 GLY A 85 118.645 -5.675 -9.665 1.00 0.00 H new ATOM 1341 N ASP A 86 117.284 -4.733 -12.283 1.00 0.00 N ATOM 1342 CA ASP A 86 116.635 -3.644 -13.002 1.00 0.00 C ATOM 1343 C ASP A 86 115.176 -3.494 -12.577 1.00 0.00 C ATOM 1344 O ASP A 86 114.268 -3.618 -13.399 1.00 0.00 O ATOM 1345 CB ASP A 86 116.705 -3.899 -14.511 1.00 0.00 C ATOM 1346 CG ASP A 86 117.693 -2.934 -15.157 1.00 0.00 C ATOM 1347 OD1 ASP A 86 117.784 -1.810 -14.692 1.00 0.00 O ATOM 1348 OD2 ASP A 86 118.345 -3.333 -16.109 1.00 0.00 O ATOM 0 H ASP A 86 116.924 -5.663 -12.498 1.00 0.00 H new ATOM 0 HA ASP A 86 117.161 -2.720 -12.760 1.00 0.00 H new ATOM 0 HB2 ASP A 86 117.012 -4.928 -14.701 1.00 0.00 H new ATOM 0 HB3 ASP A 86 115.718 -3.774 -14.956 1.00 0.00 H new ATOM 1353 N TRP A 87 114.948 -3.221 -11.294 1.00 0.00 N ATOM 1354 CA TRP A 87 113.583 -3.054 -10.807 1.00 0.00 C ATOM 1355 C TRP A 87 113.536 -2.217 -9.531 1.00 0.00 C ATOM 1356 O TRP A 87 113.723 -1.002 -9.569 1.00 0.00 O ATOM 1357 CB TRP A 87 112.948 -4.420 -10.553 1.00 0.00 C ATOM 1358 CG TRP A 87 112.955 -5.194 -11.830 1.00 0.00 C ATOM 1359 CD1 TRP A 87 111.982 -5.160 -12.769 1.00 0.00 C ATOM 1360 CD2 TRP A 87 113.974 -6.100 -12.329 1.00 0.00 C ATOM 1361 NE1 TRP A 87 112.344 -5.989 -13.815 1.00 0.00 N ATOM 1362 CE2 TRP A 87 113.565 -6.590 -13.590 1.00 0.00 C ATOM 1363 CE3 TRP A 87 115.203 -6.539 -11.813 1.00 0.00 C ATOM 1364 CZ2 TRP A 87 114.353 -7.484 -14.314 1.00 0.00 C ATOM 1365 CZ3 TRP A 87 115.999 -7.437 -12.537 1.00 0.00 C ATOM 1366 CH2 TRP A 87 115.576 -7.907 -13.785 1.00 0.00 C ATOM 0 H TRP A 87 115.675 -3.113 -10.587 1.00 0.00 H new ATOM 0 HA TRP A 87 113.020 -2.524 -11.576 1.00 0.00 H new ATOM 0 HB2 TRP A 87 113.501 -4.957 -9.782 1.00 0.00 H new ATOM 0 HB3 TRP A 87 111.928 -4.301 -10.188 1.00 0.00 H new ATOM 0 HD1 TRP A 87 111.072 -4.581 -12.711 1.00 0.00 H new ATOM 0 HE1 TRP A 87 111.778 -6.138 -14.650 1.00 0.00 H new ATOM 0 HE3 TRP A 87 115.538 -6.182 -10.850 1.00 0.00 H new ATOM 0 HZ2 TRP A 87 114.021 -7.847 -15.276 1.00 0.00 H new ATOM 0 HZ3 TRP A 87 116.943 -7.768 -12.130 1.00 0.00 H new ATOM 0 HH2 TRP A 87 116.194 -8.597 -14.340 1.00 0.00 H new ATOM 1377 N LEU A 88 113.247 -2.869 -8.409 1.00 0.00 N ATOM 1378 CA LEU A 88 113.135 -2.159 -7.139 1.00 0.00 C ATOM 1379 C LEU A 88 114.043 -2.744 -6.063 1.00 0.00 C ATOM 1380 O LEU A 88 114.716 -3.755 -6.263 1.00 0.00 O ATOM 1381 CB LEU A 88 111.685 -2.206 -6.662 1.00 0.00 C ATOM 1382 CG LEU A 88 110.778 -1.652 -7.762 1.00 0.00 C ATOM 1383 CD1 LEU A 88 109.775 -2.724 -8.193 1.00 0.00 C ATOM 1384 CD2 LEU A 88 110.023 -0.432 -7.232 1.00 0.00 C ATOM 0 H LEU A 88 113.088 -3.875 -8.352 1.00 0.00 H new ATOM 0 HA LEU A 88 113.452 -1.130 -7.308 1.00 0.00 H new ATOM 0 HB2 LEU A 88 111.401 -3.231 -6.421 1.00 0.00 H new ATOM 0 HB3 LEU A 88 111.570 -1.621 -5.750 1.00 0.00 H new ATOM 0 HG LEU A 88 111.386 -1.362 -8.619 1.00 0.00 H new ATOM 0 HD11 LEU A 88 109.131 -2.325 -8.977 1.00 0.00 H new ATOM 0 HD12 LEU A 88 110.312 -3.593 -8.572 1.00 0.00 H new ATOM 0 HD13 LEU A 88 109.167 -3.018 -7.338 1.00 0.00 H new ATOM 0 HD21 LEU A 88 109.376 -0.036 -8.015 1.00 0.00 H new ATOM 0 HD22 LEU A 88 109.417 -0.723 -6.374 1.00 0.00 H new ATOM 0 HD23 LEU A 88 110.737 0.334 -6.929 1.00 0.00 H new ATOM 1396 N ALA A 89 114.034 -2.074 -4.919 1.00 0.00 N ATOM 1397 CA ALA A 89 114.834 -2.480 -3.773 1.00 0.00 C ATOM 1398 C ALA A 89 114.048 -2.250 -2.488 1.00 0.00 C ATOM 1399 O ALA A 89 113.616 -1.131 -2.211 1.00 0.00 O ATOM 1400 CB ALA A 89 116.133 -1.671 -3.730 1.00 0.00 C ATOM 0 H ALA A 89 113.474 -1.237 -4.760 1.00 0.00 H new ATOM 0 HA ALA A 89 115.074 -3.539 -3.866 1.00 0.00 H new ATOM 0 HB1 ALA A 89 116.726 -1.981 -2.870 1.00 0.00 H new ATOM 0 HB2 ALA A 89 116.701 -1.846 -4.644 1.00 0.00 H new ATOM 0 HB3 ALA A 89 115.898 -0.610 -3.646 1.00 0.00 H new ATOM 1406 N ILE A 90 113.865 -3.307 -1.706 1.00 0.00 N ATOM 1407 CA ILE A 90 113.128 -3.185 -0.456 1.00 0.00 C ATOM 1408 C ILE A 90 113.942 -2.411 0.564 1.00 0.00 C ATOM 1409 O ILE A 90 114.990 -2.876 1.013 1.00 0.00 O ATOM 1410 CB ILE A 90 112.823 -4.560 0.123 1.00 0.00 C ATOM 1411 CG1 ILE A 90 112.707 -5.582 -1.013 1.00 0.00 C ATOM 1412 CG2 ILE A 90 111.510 -4.498 0.910 1.00 0.00 C ATOM 1413 CD1 ILE A 90 111.632 -6.618 -0.672 1.00 0.00 C ATOM 0 H ILE A 90 114.211 -4.244 -1.911 1.00 0.00 H new ATOM 0 HA ILE A 90 112.198 -2.659 -0.670 1.00 0.00 H new ATOM 0 HB ILE A 90 113.628 -4.864 0.791 1.00 0.00 H new ATOM 0 HG12 ILE A 90 112.455 -5.076 -1.945 1.00 0.00 H new ATOM 0 HG13 ILE A 90 113.666 -6.077 -1.168 1.00 0.00 H new ATOM 0 HG21 ILE A 90 111.288 -5.481 1.326 1.00 0.00 H new ATOM 0 HG22 ILE A 90 111.605 -3.774 1.720 1.00 0.00 H new ATOM 0 HG23 ILE A 90 110.701 -4.195 0.245 1.00 0.00 H new ATOM 0 HD11 ILE A 90 111.554 -7.342 -1.483 1.00 0.00 H new ATOM 0 HD12 ILE A 90 111.903 -7.133 0.250 1.00 0.00 H new ATOM 0 HD13 ILE A 90 110.673 -6.117 -0.539 1.00 0.00 H new ATOM 1425 N PRO A 91 113.486 -1.256 0.947 1.00 0.00 N ATOM 1426 CA PRO A 91 114.200 -0.432 1.943 1.00 0.00 C ATOM 1427 C PRO A 91 114.629 -1.268 3.146 1.00 0.00 C ATOM 1428 O PRO A 91 113.795 -1.702 3.937 1.00 0.00 O ATOM 1429 CB PRO A 91 113.180 0.635 2.343 1.00 0.00 C ATOM 1430 CG PRO A 91 112.238 0.741 1.189 1.00 0.00 C ATOM 1431 CD PRO A 91 112.254 -0.611 0.472 1.00 0.00 C ATOM 0 HA PRO A 91 115.119 -0.001 1.546 1.00 0.00 H new ATOM 0 HB2 PRO A 91 112.653 0.352 3.254 1.00 0.00 H new ATOM 0 HB3 PRO A 91 113.668 1.590 2.540 1.00 0.00 H new ATOM 0 HG2 PRO A 91 111.232 0.983 1.533 1.00 0.00 H new ATOM 0 HG3 PRO A 91 112.544 1.539 0.513 1.00 0.00 H new ATOM 0 HD2 PRO A 91 111.373 -1.204 0.720 1.00 0.00 H new ATOM 0 HD3 PRO A 91 112.261 -0.488 -0.611 1.00 0.00 H new ATOM 1439 N TYR A 92 115.932 -1.504 3.268 1.00 0.00 N ATOM 1440 CA TYR A 92 116.457 -2.303 4.370 1.00 0.00 C ATOM 1441 C TYR A 92 115.569 -2.161 5.600 1.00 0.00 C ATOM 1442 O TYR A 92 115.510 -3.055 6.444 1.00 0.00 O ATOM 1443 CB TYR A 92 117.884 -1.862 4.710 1.00 0.00 C ATOM 1444 CG TYR A 92 117.973 -0.356 4.678 1.00 0.00 C ATOM 1445 CD1 TYR A 92 118.001 0.319 3.450 1.00 0.00 C ATOM 1446 CD2 TYR A 92 118.031 0.368 5.874 1.00 0.00 C ATOM 1447 CE1 TYR A 92 118.087 1.715 3.421 1.00 0.00 C ATOM 1448 CE2 TYR A 92 118.117 1.764 5.845 1.00 0.00 C ATOM 1449 CZ TYR A 92 118.145 2.439 4.618 1.00 0.00 C ATOM 1450 OH TYR A 92 118.230 3.815 4.589 1.00 0.00 O ATOM 0 H TYR A 92 116.640 -1.156 2.621 1.00 0.00 H new ATOM 0 HA TYR A 92 116.469 -3.348 4.062 1.00 0.00 H new ATOM 0 HB2 TYR A 92 118.164 -2.231 5.697 1.00 0.00 H new ATOM 0 HB3 TYR A 92 118.587 -2.293 3.997 1.00 0.00 H new ATOM 0 HD1 TYR A 92 117.956 -0.239 2.526 1.00 0.00 H new ATOM 0 HD2 TYR A 92 118.009 -0.152 6.821 1.00 0.00 H new ATOM 0 HE1 TYR A 92 118.109 2.235 2.475 1.00 0.00 H new ATOM 0 HE2 TYR A 92 118.162 2.321 6.769 1.00 0.00 H new ATOM 0 HH TYR A 92 118.260 4.160 5.506 1.00 0.00 H new ATOM 1460 N ARG A 93 114.873 -1.035 5.687 1.00 0.00 N ATOM 1461 CA ARG A 93 113.979 -0.786 6.812 1.00 0.00 C ATOM 1462 C ARG A 93 112.605 -1.385 6.537 1.00 0.00 C ATOM 1463 O ARG A 93 111.603 -0.972 7.118 1.00 0.00 O ATOM 1464 CB ARG A 93 113.848 0.718 7.062 1.00 0.00 C ATOM 1465 CG ARG A 93 114.946 1.175 8.023 1.00 0.00 C ATOM 1466 CD ARG A 93 114.672 2.613 8.465 1.00 0.00 C ATOM 1467 NE ARG A 93 115.518 2.962 9.601 1.00 0.00 N ATOM 1468 CZ ARG A 93 115.751 4.231 9.921 1.00 0.00 C ATOM 1469 NH1 ARG A 93 115.217 5.190 9.214 1.00 0.00 N ATOM 1470 NH2 ARG A 93 116.511 4.518 10.942 1.00 0.00 N ATOM 0 H ARG A 93 114.909 -0.284 4.998 1.00 0.00 H new ATOM 0 HA ARG A 93 114.400 -1.258 7.700 1.00 0.00 H new ATOM 0 HB2 ARG A 93 113.925 1.262 6.120 1.00 0.00 H new ATOM 0 HB3 ARG A 93 112.867 0.943 7.481 1.00 0.00 H new ATOM 0 HG2 ARG A 93 114.981 0.517 8.891 1.00 0.00 H new ATOM 0 HG3 ARG A 93 115.919 1.112 7.536 1.00 0.00 H new ATOM 0 HD2 ARG A 93 114.861 3.297 7.638 1.00 0.00 H new ATOM 0 HD3 ARG A 93 113.622 2.724 8.737 1.00 0.00 H new ATOM 0 HE ARG A 93 115.938 2.219 10.160 1.00 0.00 H new ATOM 0 HH11 ARG A 93 114.622 4.965 8.417 1.00 0.00 H new ATOM 0 HH12 ARG A 93 115.395 6.164 9.459 1.00 0.00 H new ATOM 0 HH21 ARG A 93 116.927 3.768 11.495 1.00 0.00 H new ATOM 0 HH22 ARG A 93 116.689 5.492 11.187 1.00 0.00 H new ATOM 1484 N SER A 94 112.578 -2.358 5.637 1.00 0.00 N ATOM 1485 CA SER A 94 111.335 -3.019 5.265 1.00 0.00 C ATOM 1486 C SER A 94 111.244 -4.402 5.901 1.00 0.00 C ATOM 1487 O SER A 94 111.208 -5.413 5.201 1.00 0.00 O ATOM 1488 CB SER A 94 111.253 -3.151 3.746 1.00 0.00 C ATOM 1489 OG SER A 94 112.554 -3.398 3.227 1.00 0.00 O ATOM 0 H SER A 94 113.404 -2.707 5.150 1.00 0.00 H new ATOM 0 HA SER A 94 110.504 -2.413 5.627 1.00 0.00 H new ATOM 0 HB2 SER A 94 110.580 -3.965 3.476 1.00 0.00 H new ATOM 0 HB3 SER A 94 110.842 -2.240 3.311 1.00 0.00 H new ATOM 0 HG SER A 94 113.189 -2.763 3.619 1.00 0.00 H new ATOM 1495 N GLY A 95 111.208 -4.436 7.230 1.00 0.00 N ATOM 1496 CA GLY A 95 111.119 -5.697 7.963 1.00 0.00 C ATOM 1497 C GLY A 95 110.871 -6.881 7.028 1.00 0.00 C ATOM 1498 O GLY A 95 111.702 -7.783 6.926 1.00 0.00 O ATOM 0 H GLY A 95 111.239 -3.606 7.822 1.00 0.00 H new ATOM 0 HA2 GLY A 95 112.042 -5.860 8.519 1.00 0.00 H new ATOM 0 HA3 GLY A 95 110.313 -5.636 8.694 1.00 0.00 H new ATOM 1502 N PRO A 96 109.752 -6.893 6.350 1.00 0.00 N ATOM 1503 CA PRO A 96 109.395 -7.989 5.406 1.00 0.00 C ATOM 1504 C PRO A 96 110.602 -8.505 4.624 1.00 0.00 C ATOM 1505 O PRO A 96 110.613 -9.650 4.172 1.00 0.00 O ATOM 1506 CB PRO A 96 108.379 -7.326 4.481 1.00 0.00 C ATOM 1507 CG PRO A 96 107.703 -6.286 5.317 1.00 0.00 C ATOM 1508 CD PRO A 96 108.694 -5.870 6.411 1.00 0.00 C ATOM 0 HA PRO A 96 109.010 -8.870 5.919 1.00 0.00 H new ATOM 0 HB2 PRO A 96 108.868 -6.878 3.616 1.00 0.00 H new ATOM 0 HB3 PRO A 96 107.661 -8.052 4.100 1.00 0.00 H new ATOM 0 HG2 PRO A 96 107.419 -5.428 4.708 1.00 0.00 H new ATOM 0 HG3 PRO A 96 106.787 -6.681 5.757 1.00 0.00 H new ATOM 0 HD2 PRO A 96 109.094 -4.873 6.228 1.00 0.00 H new ATOM 0 HD3 PRO A 96 108.218 -5.847 7.391 1.00 0.00 H new ATOM 1516 N ALA A 97 111.619 -7.663 4.477 1.00 0.00 N ATOM 1517 CA ALA A 97 112.826 -8.055 3.761 1.00 0.00 C ATOM 1518 C ALA A 97 113.695 -8.936 4.651 1.00 0.00 C ATOM 1519 O ALA A 97 114.179 -9.987 4.227 1.00 0.00 O ATOM 1520 CB ALA A 97 113.611 -6.813 3.337 1.00 0.00 C ATOM 0 H ALA A 97 111.632 -6.711 4.842 1.00 0.00 H new ATOM 0 HA ALA A 97 112.542 -8.616 2.871 1.00 0.00 H new ATOM 0 HB1 ALA A 97 114.511 -7.116 2.803 1.00 0.00 H new ATOM 0 HB2 ALA A 97 112.992 -6.197 2.685 1.00 0.00 H new ATOM 0 HB3 ALA A 97 113.890 -6.239 4.221 1.00 0.00 H new ATOM 1526 N SER A 98 113.873 -8.508 5.895 1.00 0.00 N ATOM 1527 CA SER A 98 114.667 -9.281 6.838 1.00 0.00 C ATOM 1528 C SER A 98 113.934 -10.573 7.161 1.00 0.00 C ATOM 1529 O SER A 98 114.406 -11.665 6.844 1.00 0.00 O ATOM 1530 CB SER A 98 114.895 -8.479 8.121 1.00 0.00 C ATOM 1531 OG SER A 98 114.441 -9.237 9.234 1.00 0.00 O ATOM 0 H SER A 98 113.484 -7.642 6.269 1.00 0.00 H new ATOM 0 HA SER A 98 115.636 -9.508 6.394 1.00 0.00 H new ATOM 0 HB2 SER A 98 115.953 -8.244 8.234 1.00 0.00 H new ATOM 0 HB3 SER A 98 114.361 -7.530 8.070 1.00 0.00 H new ATOM 0 HG SER A 98 114.587 -8.727 10.058 1.00 0.00 H new ATOM 1537 N ASN A 99 112.768 -10.438 7.779 1.00 0.00 N ATOM 1538 CA ASN A 99 111.965 -11.600 8.125 1.00 0.00 C ATOM 1539 C ASN A 99 111.912 -12.555 6.940 1.00 0.00 C ATOM 1540 O ASN A 99 111.854 -13.772 7.110 1.00 0.00 O ATOM 1541 CB ASN A 99 110.548 -11.167 8.505 1.00 0.00 C ATOM 1542 CG ASN A 99 110.336 -11.334 10.005 1.00 0.00 C ATOM 1543 OD1 ASN A 99 111.202 -10.968 10.800 1.00 0.00 O ATOM 1544 ND2 ASN A 99 109.229 -11.870 10.442 1.00 0.00 N ATOM 0 H ASN A 99 112.361 -9.542 8.049 1.00 0.00 H new ATOM 0 HA ASN A 99 112.419 -12.105 8.977 1.00 0.00 H new ATOM 0 HB2 ASN A 99 110.388 -10.127 8.220 1.00 0.00 H new ATOM 0 HB3 ASN A 99 109.818 -11.763 7.958 1.00 0.00 H new ATOM 0 HD21 ASN A 99 109.080 -11.986 11.444 1.00 0.00 H new ATOM 0 HD22 ASN A 99 108.513 -12.172 9.781 1.00 0.00 H new ATOM 1551 N VAL A 100 111.947 -11.988 5.737 1.00 0.00 N ATOM 1552 CA VAL A 100 111.918 -12.789 4.520 1.00 0.00 C ATOM 1553 C VAL A 100 113.126 -13.720 4.486 1.00 0.00 C ATOM 1554 O VAL A 100 112.988 -14.934 4.338 1.00 0.00 O ATOM 1555 CB VAL A 100 111.934 -11.868 3.294 1.00 0.00 C ATOM 1556 CG1 VAL A 100 112.823 -12.466 2.201 1.00 0.00 C ATOM 1557 CG2 VAL A 100 110.510 -11.708 2.758 1.00 0.00 C ATOM 0 H VAL A 100 111.995 -10.981 5.581 1.00 0.00 H new ATOM 0 HA VAL A 100 111.007 -13.387 4.505 1.00 0.00 H new ATOM 0 HB VAL A 100 112.330 -10.895 3.585 1.00 0.00 H new ATOM 0 HG11 VAL A 100 112.828 -11.805 1.334 1.00 0.00 H new ATOM 0 HG12 VAL A 100 113.839 -12.577 2.579 1.00 0.00 H new ATOM 0 HG13 VAL A 100 112.435 -13.442 1.910 1.00 0.00 H new ATOM 0 HG21 VAL A 100 110.521 -11.053 1.887 1.00 0.00 H new ATOM 0 HG22 VAL A 100 110.116 -12.684 2.474 1.00 0.00 H new ATOM 0 HG23 VAL A 100 109.877 -11.272 3.531 1.00 0.00 H new ATOM 1567 N THR A 101 114.308 -13.136 4.642 1.00 0.00 N ATOM 1568 CA THR A 101 115.545 -13.909 4.647 1.00 0.00 C ATOM 1569 C THR A 101 115.568 -14.857 5.829 1.00 0.00 C ATOM 1570 O THR A 101 115.890 -16.038 5.703 1.00 0.00 O ATOM 1571 CB THR A 101 116.737 -12.967 4.781 1.00 0.00 C ATOM 1572 OG1 THR A 101 116.513 -11.802 4.001 1.00 0.00 O ATOM 1573 CG2 THR A 101 118.006 -13.674 4.303 1.00 0.00 C ATOM 0 H THR A 101 114.437 -12.132 4.767 1.00 0.00 H new ATOM 0 HA THR A 101 115.600 -14.472 3.715 1.00 0.00 H new ATOM 0 HB THR A 101 116.857 -12.682 5.826 1.00 0.00 H new ATOM 0 HG1 THR A 101 116.780 -11.973 3.074 1.00 0.00 H new ATOM 0 HG21 THR A 101 118.857 -12.999 4.399 1.00 0.00 H new ATOM 0 HG22 THR A 101 118.177 -14.563 4.910 1.00 0.00 H new ATOM 0 HG23 THR A 101 117.890 -13.964 3.259 1.00 0.00 H new ATOM 1581 N ALA A 102 115.230 -14.308 6.981 1.00 0.00 N ATOM 1582 CA ALA A 102 115.211 -15.069 8.213 1.00 0.00 C ATOM 1583 C ALA A 102 114.070 -16.079 8.200 1.00 0.00 C ATOM 1584 O ALA A 102 114.101 -17.075 8.924 1.00 0.00 O ATOM 1585 CB ALA A 102 115.062 -14.106 9.384 1.00 0.00 C ATOM 0 H ALA A 102 114.963 -13.329 7.087 1.00 0.00 H new ATOM 0 HA ALA A 102 116.144 -15.623 8.314 1.00 0.00 H new ATOM 0 HB1 ALA A 102 115.046 -14.668 10.318 1.00 0.00 H new ATOM 0 HB2 ALA A 102 115.902 -13.411 9.393 1.00 0.00 H new ATOM 0 HB3 ALA A 102 114.131 -13.549 9.281 1.00 0.00 H new ATOM 1591 N LYS A 103 113.069 -15.824 7.363 1.00 0.00 N ATOM 1592 CA LYS A 103 111.931 -16.727 7.255 1.00 0.00 C ATOM 1593 C LYS A 103 112.314 -17.959 6.442 1.00 0.00 C ATOM 1594 O LYS A 103 111.846 -19.064 6.711 1.00 0.00 O ATOM 1595 CB LYS A 103 110.752 -16.019 6.583 1.00 0.00 C ATOM 1596 CG LYS A 103 109.971 -15.221 7.630 1.00 0.00 C ATOM 1597 CD LYS A 103 108.697 -15.981 8.006 1.00 0.00 C ATOM 1598 CE LYS A 103 107.996 -15.263 9.161 1.00 0.00 C ATOM 1599 NZ LYS A 103 106.905 -14.404 8.622 1.00 0.00 N ATOM 0 H LYS A 103 113.023 -15.006 6.755 1.00 0.00 H new ATOM 0 HA LYS A 103 111.638 -17.034 8.259 1.00 0.00 H new ATOM 0 HB2 LYS A 103 111.113 -15.354 5.798 1.00 0.00 H new ATOM 0 HB3 LYS A 103 110.099 -16.750 6.106 1.00 0.00 H new ATOM 0 HG2 LYS A 103 110.587 -15.062 8.515 1.00 0.00 H new ATOM 0 HG3 LYS A 103 109.717 -14.236 7.237 1.00 0.00 H new ATOM 0 HD2 LYS A 103 108.031 -16.044 7.145 1.00 0.00 H new ATOM 0 HD3 LYS A 103 108.942 -17.003 8.295 1.00 0.00 H new ATOM 0 HE2 LYS A 103 107.588 -15.991 9.862 1.00 0.00 H new ATOM 0 HE3 LYS A 103 108.712 -14.655 9.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 106.428 -13.916 9.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 107.307 -13.701 7.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 106.217 -14.995 8.113 1.00 0.00 H new ATOM 1613 N TYR A 104 113.174 -17.757 5.445 1.00 0.00 N ATOM 1614 CA TYR A 104 113.616 -18.858 4.599 1.00 0.00 C ATOM 1615 C TYR A 104 114.794 -19.586 5.242 1.00 0.00 C ATOM 1616 O TYR A 104 115.271 -20.594 4.723 1.00 0.00 O ATOM 1617 CB TYR A 104 114.030 -18.328 3.225 1.00 0.00 C ATOM 1618 CG TYR A 104 112.798 -18.102 2.382 1.00 0.00 C ATOM 1619 CD1 TYR A 104 111.970 -19.180 2.049 1.00 0.00 C ATOM 1620 CD2 TYR A 104 112.485 -16.813 1.933 1.00 0.00 C ATOM 1621 CE1 TYR A 104 110.828 -18.971 1.267 1.00 0.00 C ATOM 1622 CE2 TYR A 104 111.342 -16.604 1.151 1.00 0.00 C ATOM 1623 CZ TYR A 104 110.514 -17.681 0.818 1.00 0.00 C ATOM 1624 OH TYR A 104 109.388 -17.474 0.047 1.00 0.00 O ATOM 0 H TYR A 104 113.574 -16.849 5.207 1.00 0.00 H new ATOM 0 HA TYR A 104 112.789 -19.558 4.483 1.00 0.00 H new ATOM 0 HB2 TYR A 104 114.585 -17.396 3.335 1.00 0.00 H new ATOM 0 HB3 TYR A 104 114.695 -19.039 2.734 1.00 0.00 H new ATOM 0 HD1 TYR A 104 112.212 -20.174 2.396 1.00 0.00 H new ATOM 0 HD2 TYR A 104 113.124 -15.981 2.189 1.00 0.00 H new ATOM 0 HE1 TYR A 104 110.189 -19.803 1.010 1.00 0.00 H new ATOM 0 HE2 TYR A 104 111.100 -15.610 0.805 1.00 0.00 H new ATOM 0 HH TYR A 104 109.316 -16.523 -0.179 1.00 0.00 H new ATOM 1634 N GLY A 105 115.255 -19.066 6.375 1.00 0.00 N ATOM 1635 CA GLY A 105 116.377 -19.675 7.082 1.00 0.00 C ATOM 1636 C GLY A 105 117.675 -19.496 6.303 1.00 0.00 C ATOM 1637 O GLY A 105 118.613 -20.278 6.455 1.00 0.00 O ATOM 0 H GLY A 105 114.873 -18.232 6.821 1.00 0.00 H new ATOM 0 HA2 GLY A 105 116.476 -19.225 8.070 1.00 0.00 H new ATOM 0 HA3 GLY A 105 116.183 -20.737 7.233 1.00 0.00 H new ATOM 1641 N ILE A 106 117.720 -18.466 5.465 1.00 0.00 N ATOM 1642 CA ILE A 106 118.907 -18.195 4.664 1.00 0.00 C ATOM 1643 C ILE A 106 120.011 -17.593 5.516 1.00 0.00 C ATOM 1644 O ILE A 106 119.778 -16.653 6.277 1.00 0.00 O ATOM 1645 CB ILE A 106 118.562 -17.223 3.553 1.00 0.00 C ATOM 1646 CG1 ILE A 106 117.340 -17.742 2.788 1.00 0.00 C ATOM 1647 CG2 ILE A 106 119.761 -17.091 2.615 1.00 0.00 C ATOM 1648 CD1 ILE A 106 117.777 -18.342 1.450 1.00 0.00 C ATOM 0 H ILE A 106 116.953 -17.809 5.323 1.00 0.00 H new ATOM 0 HA ILE A 106 119.256 -19.139 4.245 1.00 0.00 H new ATOM 0 HB ILE A 106 118.327 -16.244 3.970 1.00 0.00 H new ATOM 0 HG12 ILE A 106 116.822 -18.495 3.382 1.00 0.00 H new ATOM 0 HG13 ILE A 106 116.634 -16.929 2.618 1.00 0.00 H new ATOM 0 HG21 ILE A 106 119.520 -16.393 1.813 1.00 0.00 H new ATOM 0 HG22 ILE A 106 120.621 -16.720 3.173 1.00 0.00 H new ATOM 0 HG23 ILE A 106 119.999 -18.066 2.189 1.00 0.00 H new ATOM 0 HD11 ILE A 106 116.902 -18.709 0.913 1.00 0.00 H new ATOM 0 HD12 ILE A 106 118.275 -17.577 0.854 1.00 0.00 H new ATOM 0 HD13 ILE A 106 118.465 -19.168 1.629 1.00 0.00 H new ATOM 1660 N THR A 107 121.214 -18.137 5.383 1.00 0.00 N ATOM 1661 CA THR A 107 122.347 -17.647 6.152 1.00 0.00 C ATOM 1662 C THR A 107 123.660 -18.065 5.498 1.00 0.00 C ATOM 1663 O THR A 107 124.709 -18.085 6.143 1.00 0.00 O ATOM 1664 CB THR A 107 122.270 -18.206 7.572 1.00 0.00 C ATOM 1665 OG1 THR A 107 123.150 -19.314 7.692 1.00 0.00 O ATOM 1666 CG2 THR A 107 120.833 -18.653 7.853 1.00 0.00 C ATOM 0 H THR A 107 121.428 -18.911 4.755 1.00 0.00 H new ATOM 0 HA THR A 107 122.312 -16.558 6.183 1.00 0.00 H new ATOM 0 HB THR A 107 122.561 -17.439 8.290 1.00 0.00 H new ATOM 0 HG1 THR A 107 124.069 -19.023 7.513 1.00 0.00 H new ATOM 0 HG21 THR A 107 120.768 -19.054 8.865 1.00 0.00 H new ATOM 0 HG22 THR A 107 120.161 -17.800 7.757 1.00 0.00 H new ATOM 0 HG23 THR A 107 120.545 -19.424 7.138 1.00 0.00 H new ATOM 1674 N GLY A 108 123.593 -18.394 4.212 1.00 0.00 N ATOM 1675 CA GLY A 108 124.781 -18.809 3.474 1.00 0.00 C ATOM 1676 C GLY A 108 125.337 -17.652 2.651 1.00 0.00 C ATOM 1677 O GLY A 108 126.208 -17.842 1.803 1.00 0.00 O ATOM 0 H GLY A 108 122.734 -18.382 3.662 1.00 0.00 H new ATOM 0 HA2 GLY A 108 125.541 -19.165 4.169 1.00 0.00 H new ATOM 0 HA3 GLY A 108 124.534 -19.643 2.817 1.00 0.00 H new ATOM 1681 N ILE A 109 124.829 -16.451 2.912 1.00 0.00 N ATOM 1682 CA ILE A 109 125.279 -15.266 2.196 1.00 0.00 C ATOM 1683 C ILE A 109 126.798 -15.291 2.026 1.00 0.00 C ATOM 1684 O ILE A 109 127.526 -15.635 2.958 1.00 0.00 O ATOM 1685 CB ILE A 109 124.864 -14.022 2.981 1.00 0.00 C ATOM 1686 CG1 ILE A 109 123.989 -14.451 4.161 1.00 0.00 C ATOM 1687 CG2 ILE A 109 124.067 -13.079 2.077 1.00 0.00 C ATOM 1688 CD1 ILE A 109 122.724 -15.136 3.637 1.00 0.00 C ATOM 0 H ILE A 109 124.108 -16.275 3.612 1.00 0.00 H new ATOM 0 HA ILE A 109 124.822 -15.248 1.207 1.00 0.00 H new ATOM 0 HB ILE A 109 125.753 -13.505 3.342 1.00 0.00 H new ATOM 0 HG12 ILE A 109 124.542 -15.131 4.809 1.00 0.00 H new ATOM 0 HG13 ILE A 109 123.722 -13.583 4.764 1.00 0.00 H new ATOM 0 HG21 ILE A 109 123.774 -12.194 2.642 1.00 0.00 H new ATOM 0 HG22 ILE A 109 124.684 -12.780 1.229 1.00 0.00 H new ATOM 0 HG23 ILE A 109 123.175 -13.590 1.715 1.00 0.00 H new ATOM 0 HD11 ILE A 109 122.101 -15.442 4.478 1.00 0.00 H new ATOM 0 HD12 ILE A 109 122.168 -14.441 3.007 1.00 0.00 H new ATOM 0 HD13 ILE A 109 123.001 -16.014 3.053 1.00 0.00 H new ATOM 1700 N PRO A 110 127.291 -14.943 0.862 1.00 0.00 N ATOM 1701 CA PRO A 110 126.448 -14.518 -0.297 1.00 0.00 C ATOM 1702 C PRO A 110 125.658 -15.680 -0.894 1.00 0.00 C ATOM 1703 O PRO A 110 126.181 -16.782 -1.056 1.00 0.00 O ATOM 1704 CB PRO A 110 127.463 -13.978 -1.308 1.00 0.00 C ATOM 1705 CG PRO A 110 128.754 -14.647 -0.972 1.00 0.00 C ATOM 1706 CD PRO A 110 128.724 -14.920 0.532 1.00 0.00 C ATOM 0 HA PRO A 110 125.697 -13.784 -0.005 1.00 0.00 H new ATOM 0 HB2 PRO A 110 127.158 -14.204 -2.330 1.00 0.00 H new ATOM 0 HB3 PRO A 110 127.552 -12.894 -1.234 1.00 0.00 H new ATOM 0 HG2 PRO A 110 128.867 -15.575 -1.532 1.00 0.00 H new ATOM 0 HG3 PRO A 110 129.600 -14.011 -1.234 1.00 0.00 H new ATOM 0 HD2 PRO A 110 129.205 -15.868 0.775 1.00 0.00 H new ATOM 0 HD3 PRO A 110 129.249 -14.144 1.089 1.00 0.00 H new ATOM 1714 N ALA A 111 124.393 -15.424 -1.219 1.00 0.00 N ATOM 1715 CA ALA A 111 123.542 -16.461 -1.793 1.00 0.00 C ATOM 1716 C ALA A 111 122.447 -15.845 -2.659 1.00 0.00 C ATOM 1717 O ALA A 111 121.973 -14.742 -2.387 1.00 0.00 O ATOM 1718 CB ALA A 111 122.904 -17.291 -0.678 1.00 0.00 C ATOM 0 H ALA A 111 123.940 -14.519 -1.096 1.00 0.00 H new ATOM 0 HA ALA A 111 124.162 -17.104 -2.417 1.00 0.00 H new ATOM 0 HB1 ALA A 111 122.271 -18.063 -1.116 1.00 0.00 H new ATOM 0 HB2 ALA A 111 123.686 -17.759 -0.080 1.00 0.00 H new ATOM 0 HB3 ALA A 111 122.300 -16.643 -0.042 1.00 0.00 H new ATOM 1724 N LEU A 112 122.053 -16.565 -3.705 1.00 0.00 N ATOM 1725 CA LEU A 112 121.015 -16.082 -4.609 1.00 0.00 C ATOM 1726 C LEU A 112 119.779 -16.977 -4.524 1.00 0.00 C ATOM 1727 O LEU A 112 119.856 -18.171 -4.799 1.00 0.00 O ATOM 1728 CB LEU A 112 121.550 -16.078 -6.043 1.00 0.00 C ATOM 1729 CG LEU A 112 120.914 -14.937 -6.836 1.00 0.00 C ATOM 1730 CD1 LEU A 112 121.824 -14.564 -8.008 1.00 0.00 C ATOM 1731 CD2 LEU A 112 119.555 -15.389 -7.372 1.00 0.00 C ATOM 0 H LEU A 112 122.434 -17.480 -3.947 1.00 0.00 H new ATOM 0 HA LEU A 112 120.735 -15.069 -4.319 1.00 0.00 H new ATOM 0 HB2 LEU A 112 122.634 -15.966 -6.035 1.00 0.00 H new ATOM 0 HB3 LEU A 112 121.332 -17.032 -6.524 1.00 0.00 H new ATOM 0 HG LEU A 112 120.781 -14.071 -6.188 1.00 0.00 H new ATOM 0 HD11 LEU A 112 121.372 -13.750 -8.575 1.00 0.00 H new ATOM 0 HD12 LEU A 112 122.795 -14.246 -7.628 1.00 0.00 H new ATOM 0 HD13 LEU A 112 121.954 -15.430 -8.657 1.00 0.00 H new ATOM 0 HD21 LEU A 112 119.099 -14.577 -7.938 1.00 0.00 H new ATOM 0 HD22 LEU A 112 119.689 -16.254 -8.022 1.00 0.00 H new ATOM 0 HD23 LEU A 112 118.907 -15.659 -6.538 1.00 0.00 H new ATOM 1743 N VAL A 113 118.643 -16.398 -4.140 1.00 0.00 N ATOM 1744 CA VAL A 113 117.409 -17.169 -4.027 1.00 0.00 C ATOM 1745 C VAL A 113 116.493 -16.891 -5.214 1.00 0.00 C ATOM 1746 O VAL A 113 116.228 -15.735 -5.546 1.00 0.00 O ATOM 1747 CB VAL A 113 116.696 -16.808 -2.724 1.00 0.00 C ATOM 1748 CG1 VAL A 113 115.186 -17.010 -2.877 1.00 0.00 C ATOM 1749 CG2 VAL A 113 117.218 -17.701 -1.596 1.00 0.00 C ATOM 0 H VAL A 113 118.552 -15.410 -3.905 1.00 0.00 H new ATOM 0 HA VAL A 113 117.657 -18.230 -4.023 1.00 0.00 H new ATOM 0 HB VAL A 113 116.892 -15.762 -2.487 1.00 0.00 H new ATOM 0 HG11 VAL A 113 114.688 -16.750 -1.943 1.00 0.00 H new ATOM 0 HG12 VAL A 113 114.813 -16.371 -3.678 1.00 0.00 H new ATOM 0 HG13 VAL A 113 114.981 -18.053 -3.119 1.00 0.00 H new ATOM 0 HG21 VAL A 113 116.711 -17.446 -0.665 1.00 0.00 H new ATOM 0 HG22 VAL A 113 117.024 -18.746 -1.840 1.00 0.00 H new ATOM 0 HG23 VAL A 113 118.291 -17.549 -1.478 1.00 0.00 H new ATOM 1759 N ILE A 114 116.015 -17.955 -5.851 1.00 0.00 N ATOM 1760 CA ILE A 114 115.133 -17.803 -7.003 1.00 0.00 C ATOM 1761 C ILE A 114 113.803 -18.513 -6.779 1.00 0.00 C ATOM 1762 O ILE A 114 113.760 -19.722 -6.553 1.00 0.00 O ATOM 1763 CB ILE A 114 115.805 -18.360 -8.257 1.00 0.00 C ATOM 1764 CG1 ILE A 114 117.184 -17.722 -8.416 1.00 0.00 C ATOM 1765 CG2 ILE A 114 114.950 -18.033 -9.484 1.00 0.00 C ATOM 1766 CD1 ILE A 114 117.029 -16.206 -8.549 1.00 0.00 C ATOM 0 H ILE A 114 116.220 -18.920 -5.594 1.00 0.00 H new ATOM 0 HA ILE A 114 114.937 -16.739 -7.135 1.00 0.00 H new ATOM 0 HB ILE A 114 115.909 -19.441 -8.165 1.00 0.00 H new ATOM 0 HG12 ILE A 114 117.809 -17.961 -7.555 1.00 0.00 H new ATOM 0 HG13 ILE A 114 117.685 -18.126 -9.296 1.00 0.00 H new ATOM 0 HG21 ILE A 114 115.430 -18.431 -10.378 1.00 0.00 H new ATOM 0 HG22 ILE A 114 113.964 -18.483 -9.371 1.00 0.00 H new ATOM 0 HG23 ILE A 114 114.847 -16.952 -9.578 1.00 0.00 H new ATOM 0 HD11 ILE A 114 118.012 -15.748 -8.663 1.00 0.00 H new ATOM 0 HD12 ILE A 114 116.419 -15.978 -9.423 1.00 0.00 H new ATOM 0 HD13 ILE A 114 116.545 -15.810 -7.656 1.00 0.00 H new ATOM 1778 N VAL A 115 112.721 -17.744 -6.848 1.00 0.00 N ATOM 1779 CA VAL A 115 111.385 -18.296 -6.659 1.00 0.00 C ATOM 1780 C VAL A 115 110.462 -17.843 -7.784 1.00 0.00 C ATOM 1781 O VAL A 115 110.705 -16.820 -8.423 1.00 0.00 O ATOM 1782 CB VAL A 115 110.817 -17.843 -5.311 1.00 0.00 C ATOM 1783 CG1 VAL A 115 111.963 -17.610 -4.326 1.00 0.00 C ATOM 1784 CG2 VAL A 115 110.035 -16.540 -5.497 1.00 0.00 C ATOM 0 H VAL A 115 112.743 -16.741 -7.033 1.00 0.00 H new ATOM 0 HA VAL A 115 111.452 -19.384 -6.673 1.00 0.00 H new ATOM 0 HB VAL A 115 110.153 -18.614 -4.921 1.00 0.00 H new ATOM 0 HG11 VAL A 115 111.558 -17.288 -3.367 1.00 0.00 H new ATOM 0 HG12 VAL A 115 112.521 -18.537 -4.191 1.00 0.00 H new ATOM 0 HG13 VAL A 115 112.628 -16.840 -4.717 1.00 0.00 H new ATOM 0 HG21 VAL A 115 109.631 -16.218 -4.537 1.00 0.00 H new ATOM 0 HG22 VAL A 115 110.700 -15.769 -5.888 1.00 0.00 H new ATOM 0 HG23 VAL A 115 109.217 -16.704 -6.199 1.00 0.00 H new ATOM 1794 N LYS A 116 109.405 -18.611 -8.027 1.00 0.00 N ATOM 1795 CA LYS A 116 108.459 -18.276 -9.083 1.00 0.00 C ATOM 1796 C LYS A 116 107.491 -17.194 -8.614 1.00 0.00 C ATOM 1797 O LYS A 116 107.340 -16.958 -7.416 1.00 0.00 O ATOM 1798 CB LYS A 116 107.679 -19.525 -9.489 1.00 0.00 C ATOM 1799 CG LYS A 116 108.601 -20.461 -10.273 1.00 0.00 C ATOM 1800 CD LYS A 116 107.769 -21.521 -10.997 1.00 0.00 C ATOM 1801 CE LYS A 116 108.193 -21.589 -12.464 1.00 0.00 C ATOM 1802 NZ LYS A 116 107.491 -20.524 -13.235 1.00 0.00 N ATOM 0 H LYS A 116 109.184 -19.463 -7.511 1.00 0.00 H new ATOM 0 HA LYS A 116 109.014 -17.897 -9.941 1.00 0.00 H new ATOM 0 HB2 LYS A 116 107.294 -20.032 -8.604 1.00 0.00 H new ATOM 0 HB3 LYS A 116 106.818 -19.249 -10.098 1.00 0.00 H new ATOM 0 HG2 LYS A 116 109.186 -19.890 -10.994 1.00 0.00 H new ATOM 0 HG3 LYS A 116 109.308 -20.940 -9.596 1.00 0.00 H new ATOM 0 HD2 LYS A 116 107.906 -22.493 -10.523 1.00 0.00 H new ATOM 0 HD3 LYS A 116 106.709 -21.278 -10.925 1.00 0.00 H new ATOM 0 HE2 LYS A 116 109.272 -21.462 -12.548 1.00 0.00 H new ATOM 0 HE3 LYS A 116 107.955 -22.569 -12.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 107.780 -20.570 -14.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 106.463 -20.665 -13.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 107.740 -19.592 -12.846 1.00 0.00 H new ATOM 1816 N LYS A 117 106.838 -16.539 -9.569 1.00 0.00 N ATOM 1817 CA LYS A 117 105.888 -15.481 -9.245 1.00 0.00 C ATOM 1818 C LYS A 117 104.925 -15.939 -8.154 1.00 0.00 C ATOM 1819 O LYS A 117 104.723 -15.242 -7.160 1.00 0.00 O ATOM 1820 CB LYS A 117 105.097 -15.092 -10.495 1.00 0.00 C ATOM 1821 CG LYS A 117 103.850 -14.303 -10.091 1.00 0.00 C ATOM 1822 CD LYS A 117 104.262 -13.068 -9.288 1.00 0.00 C ATOM 1823 CE LYS A 117 103.033 -12.198 -9.023 1.00 0.00 C ATOM 1824 NZ LYS A 117 101.816 -12.885 -9.540 1.00 0.00 N ATOM 0 H LYS A 117 106.948 -16.721 -10.567 1.00 0.00 H new ATOM 0 HA LYS A 117 106.445 -14.617 -8.882 1.00 0.00 H new ATOM 0 HB2 LYS A 117 105.719 -14.492 -11.159 1.00 0.00 H new ATOM 0 HB3 LYS A 117 104.810 -15.986 -11.048 1.00 0.00 H new ATOM 0 HG2 LYS A 117 103.294 -14.003 -10.979 1.00 0.00 H new ATOM 0 HG3 LYS A 117 103.187 -14.931 -9.496 1.00 0.00 H new ATOM 0 HD2 LYS A 117 104.717 -13.370 -8.345 1.00 0.00 H new ATOM 0 HD3 LYS A 117 105.012 -12.498 -9.836 1.00 0.00 H new ATOM 0 HE2 LYS A 117 102.931 -12.010 -7.954 1.00 0.00 H new ATOM 0 HE3 LYS A 117 103.149 -11.228 -9.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 100.973 -12.325 -9.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 101.884 -12.982 -10.573 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 101.740 -13.828 -9.108 1.00 0.00 H new ATOM 1838 N ASP A 118 104.337 -17.115 -8.346 1.00 0.00 N ATOM 1839 CA ASP A 118 103.397 -17.655 -7.371 1.00 0.00 C ATOM 1840 C ASP A 118 104.129 -18.073 -6.101 1.00 0.00 C ATOM 1841 O ASP A 118 103.513 -18.534 -5.140 1.00 0.00 O ATOM 1842 CB ASP A 118 102.666 -18.861 -7.962 1.00 0.00 C ATOM 1843 CG ASP A 118 101.259 -18.955 -7.382 1.00 0.00 C ATOM 1844 OD1 ASP A 118 101.102 -19.604 -6.362 1.00 0.00 O ATOM 1845 OD2 ASP A 118 100.359 -18.375 -7.968 1.00 0.00 O ATOM 0 H ASP A 118 104.493 -17.708 -9.161 1.00 0.00 H new ATOM 0 HA ASP A 118 102.673 -16.879 -7.122 1.00 0.00 H new ATOM 0 HB2 ASP A 118 102.615 -18.770 -9.047 1.00 0.00 H new ATOM 0 HB3 ASP A 118 103.220 -19.774 -7.744 1.00 0.00 H new ATOM 1850 N GLY A 119 105.448 -17.914 -6.107 1.00 0.00 N ATOM 1851 CA GLY A 119 106.257 -18.282 -4.952 1.00 0.00 C ATOM 1852 C GLY A 119 106.757 -19.714 -5.083 1.00 0.00 C ATOM 1853 O GLY A 119 107.342 -20.268 -4.151 1.00 0.00 O ATOM 0 H GLY A 119 105.976 -17.535 -6.893 1.00 0.00 H new ATOM 0 HA2 GLY A 119 107.104 -17.602 -4.863 1.00 0.00 H new ATOM 0 HA3 GLY A 119 105.668 -18.179 -4.041 1.00 0.00 H new ATOM 1857 N THR A 120 106.520 -20.310 -6.247 1.00 0.00 N ATOM 1858 CA THR A 120 106.948 -21.680 -6.495 1.00 0.00 C ATOM 1859 C THR A 120 108.469 -21.778 -6.483 1.00 0.00 C ATOM 1860 O THR A 120 109.133 -21.382 -7.441 1.00 0.00 O ATOM 1861 CB THR A 120 106.421 -22.155 -7.849 1.00 0.00 C ATOM 1862 OG1 THR A 120 105.326 -21.338 -8.243 1.00 0.00 O ATOM 1863 CG2 THR A 120 105.964 -23.610 -7.742 1.00 0.00 C ATOM 0 H THR A 120 106.037 -19.868 -7.029 1.00 0.00 H new ATOM 0 HA THR A 120 106.546 -22.313 -5.704 1.00 0.00 H new ATOM 0 HB THR A 120 107.215 -22.082 -8.593 1.00 0.00 H new ATOM 0 HG1 THR A 120 104.988 -21.640 -9.112 1.00 0.00 H new ATOM 0 HG21 THR A 120 105.589 -23.946 -8.709 1.00 0.00 H new ATOM 0 HG22 THR A 120 106.806 -24.235 -7.443 1.00 0.00 H new ATOM 0 HG23 THR A 120 105.171 -23.689 -6.998 1.00 0.00 H new ATOM 1871 N LEU A 121 109.017 -22.311 -5.396 1.00 0.00 N ATOM 1872 CA LEU A 121 110.461 -22.458 -5.281 1.00 0.00 C ATOM 1873 C LEU A 121 111.007 -23.242 -6.466 1.00 0.00 C ATOM 1874 O LEU A 121 110.390 -24.203 -6.927 1.00 0.00 O ATOM 1875 CB LEU A 121 110.815 -23.176 -3.977 1.00 0.00 C ATOM 1876 CG LEU A 121 112.006 -22.480 -3.315 1.00 0.00 C ATOM 1877 CD1 LEU A 121 113.213 -22.531 -4.254 1.00 0.00 C ATOM 1878 CD2 LEU A 121 111.649 -21.022 -3.021 1.00 0.00 C ATOM 0 H LEU A 121 108.488 -22.645 -4.590 1.00 0.00 H new ATOM 0 HA LEU A 121 110.912 -21.466 -5.275 1.00 0.00 H new ATOM 0 HB2 LEU A 121 109.958 -23.172 -3.303 1.00 0.00 H new ATOM 0 HB3 LEU A 121 111.057 -24.220 -4.179 1.00 0.00 H new ATOM 0 HG LEU A 121 112.250 -22.988 -2.382 1.00 0.00 H new ATOM 0 HD11 LEU A 121 114.062 -22.035 -3.783 1.00 0.00 H new ATOM 0 HD12 LEU A 121 113.469 -23.570 -4.461 1.00 0.00 H new ATOM 0 HD13 LEU A 121 112.969 -22.024 -5.188 1.00 0.00 H new ATOM 0 HD21 LEU A 121 112.498 -20.527 -2.549 1.00 0.00 H new ATOM 0 HD22 LEU A 121 111.404 -20.512 -3.953 1.00 0.00 H new ATOM 0 HD23 LEU A 121 110.790 -20.986 -2.351 1.00 0.00 H new ATOM 1890 N ILE A 122 112.161 -22.819 -6.962 1.00 0.00 N ATOM 1891 CA ILE A 122 112.779 -23.478 -8.103 1.00 0.00 C ATOM 1892 C ILE A 122 114.254 -23.735 -7.839 1.00 0.00 C ATOM 1893 O ILE A 122 114.696 -24.881 -7.748 1.00 0.00 O ATOM 1894 CB ILE A 122 112.638 -22.584 -9.332 1.00 0.00 C ATOM 1895 CG1 ILE A 122 113.573 -23.073 -10.434 1.00 0.00 C ATOM 1896 CG2 ILE A 122 113.000 -21.143 -8.966 1.00 0.00 C ATOM 1897 CD1 ILE A 122 112.918 -22.825 -11.791 1.00 0.00 C ATOM 0 H ILE A 122 112.686 -22.026 -6.594 1.00 0.00 H new ATOM 0 HA ILE A 122 112.281 -24.433 -8.270 1.00 0.00 H new ATOM 0 HB ILE A 122 111.607 -22.623 -9.685 1.00 0.00 H new ATOM 0 HG12 ILE A 122 114.528 -22.551 -10.376 1.00 0.00 H new ATOM 0 HG13 ILE A 122 113.782 -24.135 -10.306 1.00 0.00 H new ATOM 0 HG21 ILE A 122 112.898 -20.508 -9.846 1.00 0.00 H new ATOM 0 HG22 ILE A 122 112.331 -20.788 -8.182 1.00 0.00 H new ATOM 0 HG23 ILE A 122 114.029 -21.106 -8.609 1.00 0.00 H new ATOM 0 HD11 ILE A 122 113.581 -23.172 -12.584 1.00 0.00 H new ATOM 0 HD12 ILE A 122 111.974 -23.367 -11.844 1.00 0.00 H new ATOM 0 HD13 ILE A 122 112.731 -21.758 -11.915 1.00 0.00 H new ATOM 1909 N SER A 123 115.004 -22.654 -7.714 1.00 0.00 N ATOM 1910 CA SER A 123 116.435 -22.747 -7.456 1.00 0.00 C ATOM 1911 C SER A 123 116.847 -21.746 -6.383 1.00 0.00 C ATOM 1912 O SER A 123 116.442 -20.584 -6.416 1.00 0.00 O ATOM 1913 CB SER A 123 117.217 -22.473 -8.740 1.00 0.00 C ATOM 1914 OG SER A 123 116.468 -21.591 -9.566 1.00 0.00 O ATOM 0 H SER A 123 114.648 -21.701 -7.787 1.00 0.00 H new ATOM 0 HA SER A 123 116.659 -23.754 -7.105 1.00 0.00 H new ATOM 0 HB2 SER A 123 118.186 -22.033 -8.503 1.00 0.00 H new ATOM 0 HB3 SER A 123 117.411 -23.407 -9.268 1.00 0.00 H new ATOM 0 HG SER A 123 116.984 -20.773 -9.723 1.00 0.00 H new ATOM 1920 N MET A 124 117.653 -22.201 -5.431 1.00 0.00 N ATOM 1921 CA MET A 124 118.109 -21.329 -4.355 1.00 0.00 C ATOM 1922 C MET A 124 119.523 -20.834 -4.632 1.00 0.00 C ATOM 1923 O MET A 124 119.745 -20.073 -5.572 1.00 0.00 O ATOM 1924 CB MET A 124 118.069 -22.077 -3.021 1.00 0.00 C ATOM 1925 CG MET A 124 116.702 -22.745 -2.852 1.00 0.00 C ATOM 1926 SD MET A 124 115.598 -21.643 -1.931 1.00 0.00 S ATOM 1927 CE MET A 124 115.198 -20.516 -3.292 1.00 0.00 C ATOM 0 H MET A 124 118.001 -23.158 -5.381 1.00 0.00 H new ATOM 0 HA MET A 124 117.443 -20.468 -4.301 1.00 0.00 H new ATOM 0 HB2 MET A 124 118.859 -22.827 -2.989 1.00 0.00 H new ATOM 0 HB3 MET A 124 118.252 -21.386 -2.198 1.00 0.00 H new ATOM 0 HG2 MET A 124 116.274 -22.973 -3.828 1.00 0.00 H new ATOM 0 HG3 MET A 124 116.811 -23.692 -2.323 1.00 0.00 H new ATOM 0 HE1 MET A 124 114.226 -20.058 -3.111 1.00 0.00 H new ATOM 0 HE2 MET A 124 115.959 -19.738 -3.356 1.00 0.00 H new ATOM 0 HE3 MET A 124 115.168 -21.073 -4.229 1.00 0.00 H new ATOM 1937 N ASN A 125 120.474 -21.272 -3.814 1.00 0.00 N ATOM 1938 CA ASN A 125 121.863 -20.866 -3.984 1.00 0.00 C ATOM 1939 C ASN A 125 122.370 -21.278 -5.361 1.00 0.00 C ATOM 1940 O ASN A 125 123.493 -21.764 -5.500 1.00 0.00 O ATOM 1941 CB ASN A 125 122.732 -21.514 -2.904 1.00 0.00 C ATOM 1942 CG ASN A 125 123.653 -20.471 -2.279 1.00 0.00 C ATOM 1943 OD1 ASN A 125 124.104 -20.641 -1.147 1.00 0.00 O ATOM 1944 ND2 ASN A 125 123.961 -19.398 -2.953 1.00 0.00 N ATOM 0 H ASN A 125 120.309 -21.905 -3.031 1.00 0.00 H new ATOM 0 HA ASN A 125 121.922 -19.781 -3.894 1.00 0.00 H new ATOM 0 HB2 ASN A 125 122.100 -21.960 -2.136 1.00 0.00 H new ATOM 0 HB3 ASN A 125 123.324 -22.320 -3.337 1.00 0.00 H new ATOM 0 HD21 ASN A 125 124.577 -18.697 -2.542 1.00 0.00 H new ATOM 0 HD22 ASN A 125 123.586 -19.260 -3.891 1.00 0.00 H new ATOM 1951 N GLY A 126 121.539 -21.075 -6.377 1.00 0.00 N ATOM 1952 CA GLY A 126 121.915 -21.426 -7.737 1.00 0.00 C ATOM 1953 C GLY A 126 122.858 -20.381 -8.311 1.00 0.00 C ATOM 1954 O GLY A 126 123.008 -20.269 -9.528 1.00 0.00 O ATOM 0 H GLY A 126 120.607 -20.672 -6.284 1.00 0.00 H new ATOM 0 HA2 GLY A 126 122.396 -22.404 -7.747 1.00 0.00 H new ATOM 0 HA3 GLY A 126 121.024 -21.502 -8.360 1.00 0.00 H new ATOM 1958 N ARG A 127 123.486 -19.609 -7.430 1.00 0.00 N ATOM 1959 CA ARG A 127 124.403 -18.568 -7.875 1.00 0.00 C ATOM 1960 C ARG A 127 125.280 -19.077 -9.008 1.00 0.00 C ATOM 1961 O ARG A 127 124.980 -18.845 -10.178 1.00 0.00 O ATOM 1962 CB ARG A 127 125.279 -18.101 -6.711 1.00 0.00 C ATOM 1963 CG ARG A 127 125.582 -19.287 -5.792 1.00 0.00 C ATOM 1964 CD ARG A 127 126.940 -19.077 -5.119 1.00 0.00 C ATOM 1965 NE ARG A 127 127.151 -20.081 -4.083 1.00 0.00 N ATOM 1966 CZ ARG A 127 127.828 -19.794 -2.977 1.00 0.00 C ATOM 1967 NH1 ARG A 127 128.318 -18.597 -2.803 1.00 0.00 N ATOM 1968 NH2 ARG A 127 128.004 -20.710 -2.063 1.00 0.00 N ATOM 0 H ARG A 127 123.379 -19.683 -6.418 1.00 0.00 H new ATOM 0 HA ARG A 127 123.814 -17.726 -8.239 1.00 0.00 H new ATOM 0 HB2 ARG A 127 126.208 -17.674 -7.089 1.00 0.00 H new ATOM 0 HB3 ARG A 127 124.771 -17.315 -6.152 1.00 0.00 H new ATOM 0 HG2 ARG A 127 124.801 -19.385 -5.037 1.00 0.00 H new ATOM 0 HG3 ARG A 127 125.588 -20.213 -6.366 1.00 0.00 H new ATOM 0 HD2 ARG A 127 127.735 -19.138 -5.862 1.00 0.00 H new ATOM 0 HD3 ARG A 127 126.987 -18.079 -4.683 1.00 0.00 H new ATOM 0 HE ARG A 127 126.772 -21.020 -4.210 1.00 0.00 H new ATOM 0 HH11 ARG A 127 128.181 -17.881 -3.517 1.00 0.00 H new ATOM 0 HH12 ARG A 127 128.838 -18.377 -1.953 1.00 0.00 H new ATOM 0 HH21 ARG A 127 127.622 -21.646 -2.199 1.00 0.00 H new ATOM 0 HH22 ARG A 127 128.524 -20.490 -1.214 1.00 0.00 H new ATOM 1982 N GLY A 128 126.358 -19.774 -8.672 1.00 0.00 N ATOM 1983 CA GLY A 128 127.245 -20.299 -9.699 1.00 0.00 C ATOM 1984 C GLY A 128 126.436 -20.912 -10.832 1.00 0.00 C ATOM 1985 O GLY A 128 126.857 -20.895 -11.988 1.00 0.00 O ATOM 0 H GLY A 128 126.635 -19.986 -7.713 1.00 0.00 H new ATOM 0 HA2 GLY A 128 127.878 -19.500 -10.086 1.00 0.00 H new ATOM 0 HA3 GLY A 128 127.907 -21.050 -9.268 1.00 0.00 H new ATOM 1989 N GLU A 129 125.265 -21.444 -10.493 1.00 0.00 N ATOM 1990 CA GLU A 129 124.400 -22.051 -11.494 1.00 0.00 C ATOM 1991 C GLU A 129 124.061 -21.034 -12.573 1.00 0.00 C ATOM 1992 O GLU A 129 124.290 -21.272 -13.758 1.00 0.00 O ATOM 1993 CB GLU A 129 123.114 -22.560 -10.841 1.00 0.00 C ATOM 1994 CG GLU A 129 122.888 -24.023 -11.226 1.00 0.00 C ATOM 1995 CD GLU A 129 121.431 -24.406 -10.992 1.00 0.00 C ATOM 1996 OE1 GLU A 129 121.117 -24.816 -9.887 1.00 0.00 O ATOM 1997 OE2 GLU A 129 120.650 -24.283 -11.922 1.00 0.00 O ATOM 0 H GLU A 129 124.898 -21.466 -9.542 1.00 0.00 H new ATOM 0 HA GLU A 129 124.925 -22.892 -11.947 1.00 0.00 H new ATOM 0 HB2 GLU A 129 123.182 -22.465 -9.757 1.00 0.00 H new ATOM 0 HB3 GLU A 129 122.267 -21.954 -11.162 1.00 0.00 H new ATOM 0 HG2 GLU A 129 123.149 -24.176 -12.273 1.00 0.00 H new ATOM 0 HG3 GLU A 129 123.541 -24.667 -10.637 1.00 0.00 H new ATOM 2004 N VAL A 130 123.530 -19.892 -12.153 1.00 0.00 N ATOM 2005 CA VAL A 130 123.184 -18.843 -13.098 1.00 0.00 C ATOM 2006 C VAL A 130 124.448 -18.321 -13.770 1.00 0.00 C ATOM 2007 O VAL A 130 124.532 -18.250 -14.995 1.00 0.00 O ATOM 2008 CB VAL A 130 122.451 -17.709 -12.375 1.00 0.00 C ATOM 2009 CG1 VAL A 130 123.417 -16.560 -12.070 1.00 0.00 C ATOM 2010 CG2 VAL A 130 121.314 -17.194 -13.257 1.00 0.00 C ATOM 0 H VAL A 130 123.332 -19.672 -11.177 1.00 0.00 H new ATOM 0 HA VAL A 130 122.522 -19.249 -13.863 1.00 0.00 H new ATOM 0 HB VAL A 130 122.048 -18.091 -11.437 1.00 0.00 H new ATOM 0 HG11 VAL A 130 122.882 -15.761 -11.556 1.00 0.00 H new ATOM 0 HG12 VAL A 130 124.225 -16.923 -11.435 1.00 0.00 H new ATOM 0 HG13 VAL A 130 123.833 -16.177 -13.002 1.00 0.00 H new ATOM 0 HG21 VAL A 130 120.792 -16.387 -12.743 1.00 0.00 H new ATOM 0 HG22 VAL A 130 121.722 -16.822 -14.197 1.00 0.00 H new ATOM 0 HG23 VAL A 130 120.616 -18.006 -13.461 1.00 0.00 H new ATOM 2020 N GLN A 131 125.430 -17.967 -12.952 1.00 0.00 N ATOM 2021 CA GLN A 131 126.695 -17.460 -13.464 1.00 0.00 C ATOM 2022 C GLN A 131 127.423 -18.548 -14.247 1.00 0.00 C ATOM 2023 O GLN A 131 128.335 -18.264 -15.023 1.00 0.00 O ATOM 2024 CB GLN A 131 127.577 -16.986 -12.306 1.00 0.00 C ATOM 2025 CG GLN A 131 127.027 -15.674 -11.743 1.00 0.00 C ATOM 2026 CD GLN A 131 126.234 -15.943 -10.469 1.00 0.00 C ATOM 2027 OE1 GLN A 131 126.441 -16.963 -9.811 1.00 0.00 O ATOM 2028 NE2 GLN A 131 125.332 -15.085 -10.078 1.00 0.00 N ATOM 0 H GLN A 131 125.375 -18.021 -11.935 1.00 0.00 H new ATOM 0 HA GLN A 131 126.489 -16.621 -14.128 1.00 0.00 H new ATOM 0 HB2 GLN A 131 127.606 -17.745 -11.524 1.00 0.00 H new ATOM 0 HB3 GLN A 131 128.601 -16.844 -12.651 1.00 0.00 H new ATOM 0 HG2 GLN A 131 127.847 -14.987 -11.532 1.00 0.00 H new ATOM 0 HG3 GLN A 131 126.389 -15.191 -12.483 1.00 0.00 H new ATOM 0 HE21 GLN A 131 125.161 -14.240 -10.624 1.00 0.00 H new ATOM 0 HE22 GLN A 131 124.798 -15.259 -9.227 1.00 0.00 H new ATOM 2037 N SER A 132 127.012 -19.796 -14.038 1.00 0.00 N ATOM 2038 CA SER A 132 127.633 -20.917 -14.732 1.00 0.00 C ATOM 2039 C SER A 132 127.126 -21.004 -16.168 1.00 0.00 C ATOM 2040 O SER A 132 127.911 -21.160 -17.104 1.00 0.00 O ATOM 2041 CB SER A 132 127.322 -22.224 -14.002 1.00 0.00 C ATOM 2042 OG SER A 132 128.206 -22.368 -12.898 1.00 0.00 O ATOM 0 H SER A 132 126.259 -20.054 -13.400 1.00 0.00 H new ATOM 0 HA SER A 132 128.711 -20.757 -14.746 1.00 0.00 H new ATOM 0 HB2 SER A 132 126.288 -22.224 -13.657 1.00 0.00 H new ATOM 0 HB3 SER A 132 127.431 -23.069 -14.682 1.00 0.00 H new ATOM 0 HG SER A 132 128.133 -21.583 -12.316 1.00 0.00 H new ATOM 2048 N LEU A 133 125.811 -20.906 -16.335 1.00 0.00 N ATOM 2049 CA LEU A 133 125.215 -20.980 -17.659 1.00 0.00 C ATOM 2050 C LEU A 133 125.027 -19.587 -18.250 1.00 0.00 C ATOM 2051 O LEU A 133 124.980 -19.423 -19.469 1.00 0.00 O ATOM 2052 CB LEU A 133 123.860 -21.680 -17.576 1.00 0.00 C ATOM 2053 CG LEU A 133 124.016 -23.141 -17.993 1.00 0.00 C ATOM 2054 CD1 LEU A 133 122.670 -23.853 -17.855 1.00 0.00 C ATOM 2055 CD2 LEU A 133 124.483 -23.204 -19.448 1.00 0.00 C ATOM 0 H LEU A 133 125.144 -20.776 -15.574 1.00 0.00 H new ATOM 0 HA LEU A 133 125.886 -21.546 -18.305 1.00 0.00 H new ATOM 0 HB2 LEU A 133 123.469 -21.620 -16.560 1.00 0.00 H new ATOM 0 HB3 LEU A 133 123.140 -21.180 -18.224 1.00 0.00 H new ATOM 0 HG LEU A 133 124.752 -23.630 -17.354 1.00 0.00 H new ATOM 0 HD11 LEU A 133 122.778 -24.896 -18.152 1.00 0.00 H new ATOM 0 HD12 LEU A 133 122.337 -23.803 -16.818 1.00 0.00 H new ATOM 0 HD13 LEU A 133 121.934 -23.368 -18.496 1.00 0.00 H new ATOM 0 HD21 LEU A 133 124.596 -24.245 -19.749 1.00 0.00 H new ATOM 0 HD22 LEU A 133 123.746 -22.719 -20.088 1.00 0.00 H new ATOM 0 HD23 LEU A 133 125.441 -22.693 -19.545 1.00 0.00 H new ATOM 2067 N GLY A 134 124.909 -18.587 -17.383 1.00 0.00 N ATOM 2068 CA GLY A 134 124.714 -17.219 -17.844 1.00 0.00 C ATOM 2069 C GLY A 134 123.226 -16.916 -17.993 1.00 0.00 C ATOM 2070 O GLY A 134 122.405 -17.421 -17.227 1.00 0.00 O ATOM 0 H GLY A 134 124.944 -18.696 -16.369 1.00 0.00 H new ATOM 0 HA2 GLY A 134 125.165 -16.522 -17.137 1.00 0.00 H new ATOM 0 HA3 GLY A 134 125.219 -17.075 -18.799 1.00 0.00 H new ATOM 2074 N PRO A 135 122.862 -16.108 -18.955 1.00 0.00 N ATOM 2075 CA PRO A 135 121.435 -15.743 -19.190 1.00 0.00 C ATOM 2076 C PRO A 135 120.609 -16.944 -19.642 1.00 0.00 C ATOM 2077 O PRO A 135 119.379 -16.919 -19.589 1.00 0.00 O ATOM 2078 CB PRO A 135 121.492 -14.675 -20.284 1.00 0.00 C ATOM 2079 CG PRO A 135 122.822 -14.833 -20.946 1.00 0.00 C ATOM 2080 CD PRO A 135 123.764 -15.460 -19.920 1.00 0.00 C ATOM 0 HA PRO A 135 120.952 -15.387 -18.280 1.00 0.00 H new ATOM 0 HB2 PRO A 135 120.681 -14.807 -21.001 1.00 0.00 H new ATOM 0 HB3 PRO A 135 121.383 -13.677 -19.860 1.00 0.00 H new ATOM 0 HG2 PRO A 135 122.739 -15.466 -21.830 1.00 0.00 H new ATOM 0 HG3 PRO A 135 123.203 -13.868 -21.279 1.00 0.00 H new ATOM 0 HD2 PRO A 135 124.436 -16.182 -20.384 1.00 0.00 H new ATOM 0 HD3 PRO A 135 124.388 -14.707 -19.439 1.00 0.00 H new ATOM 2088 N ARG A 136 121.293 -17.997 -20.077 1.00 0.00 N ATOM 2089 CA ARG A 136 120.612 -19.207 -20.524 1.00 0.00 C ATOM 2090 C ARG A 136 120.115 -19.996 -19.322 1.00 0.00 C ATOM 2091 O ARG A 136 119.391 -20.981 -19.464 1.00 0.00 O ATOM 2092 CB ARG A 136 121.564 -20.074 -21.351 1.00 0.00 C ATOM 2093 CG ARG A 136 122.739 -19.224 -21.834 1.00 0.00 C ATOM 2094 CD ARG A 136 123.317 -19.831 -23.114 1.00 0.00 C ATOM 2095 NE ARG A 136 124.201 -18.876 -23.772 1.00 0.00 N ATOM 2096 CZ ARG A 136 124.292 -18.823 -25.096 1.00 0.00 C ATOM 2097 NH1 ARG A 136 123.584 -19.637 -25.832 1.00 0.00 N ATOM 2098 NH2 ARG A 136 125.090 -17.960 -25.663 1.00 0.00 N ATOM 0 H ARG A 136 122.311 -18.038 -20.130 1.00 0.00 H new ATOM 0 HA ARG A 136 119.762 -18.922 -21.144 1.00 0.00 H new ATOM 0 HB2 ARG A 136 121.927 -20.908 -20.751 1.00 0.00 H new ATOM 0 HB3 ARG A 136 121.036 -20.501 -22.203 1.00 0.00 H new ATOM 0 HG2 ARG A 136 122.410 -18.202 -22.020 1.00 0.00 H new ATOM 0 HG3 ARG A 136 123.508 -19.176 -21.063 1.00 0.00 H new ATOM 0 HD2 ARG A 136 123.867 -20.742 -22.877 1.00 0.00 H new ATOM 0 HD3 ARG A 136 122.508 -20.113 -23.788 1.00 0.00 H new ATOM 0 HE ARG A 136 124.759 -18.237 -23.205 1.00 0.00 H new ATOM 0 HH11 ARG A 136 122.961 -20.313 -25.390 1.00 0.00 H new ATOM 0 HH12 ARG A 136 123.654 -19.596 -26.849 1.00 0.00 H new ATOM 0 HH21 ARG A 136 125.645 -17.325 -25.089 1.00 0.00 H new ATOM 0 HH22 ARG A 136 125.159 -17.921 -26.680 1.00 0.00 H new ATOM 2112 N ALA A 137 120.509 -19.546 -18.137 1.00 0.00 N ATOM 2113 CA ALA A 137 120.097 -20.205 -16.906 1.00 0.00 C ATOM 2114 C ALA A 137 118.597 -20.034 -16.695 1.00 0.00 C ATOM 2115 O ALA A 137 117.955 -20.853 -16.037 1.00 0.00 O ATOM 2116 CB ALA A 137 120.856 -19.614 -15.718 1.00 0.00 C ATOM 0 H ALA A 137 121.110 -18.732 -18.003 1.00 0.00 H new ATOM 0 HA ALA A 137 120.325 -21.268 -16.984 1.00 0.00 H new ATOM 0 HB1 ALA A 137 120.542 -20.113 -14.801 1.00 0.00 H new ATOM 0 HB2 ALA A 137 121.927 -19.759 -15.862 1.00 0.00 H new ATOM 0 HB3 ALA A 137 120.641 -18.548 -15.643 1.00 0.00 H new ATOM 2122 N PHE A 138 118.046 -18.966 -17.264 1.00 0.00 N ATOM 2123 CA PHE A 138 116.618 -18.704 -17.137 1.00 0.00 C ATOM 2124 C PHE A 138 115.847 -20.016 -17.183 1.00 0.00 C ATOM 2125 O PHE A 138 114.704 -20.096 -16.733 1.00 0.00 O ATOM 2126 CB PHE A 138 116.147 -17.790 -18.270 1.00 0.00 C ATOM 2127 CG PHE A 138 114.648 -17.893 -18.406 1.00 0.00 C ATOM 2128 CD1 PHE A 138 113.814 -17.201 -17.519 1.00 0.00 C ATOM 2129 CD2 PHE A 138 114.089 -18.681 -19.420 1.00 0.00 C ATOM 2130 CE1 PHE A 138 112.423 -17.297 -17.646 1.00 0.00 C ATOM 2131 CE2 PHE A 138 112.698 -18.777 -19.546 1.00 0.00 C ATOM 2132 CZ PHE A 138 111.866 -18.085 -18.659 1.00 0.00 C ATOM 0 H PHE A 138 118.560 -18.276 -17.811 1.00 0.00 H new ATOM 0 HA PHE A 138 116.434 -18.210 -16.183 1.00 0.00 H new ATOM 0 HB2 PHE A 138 116.435 -16.759 -18.064 1.00 0.00 H new ATOM 0 HB3 PHE A 138 116.629 -18.074 -19.206 1.00 0.00 H new ATOM 0 HD1 PHE A 138 114.244 -16.593 -16.737 1.00 0.00 H new ATOM 0 HD2 PHE A 138 114.731 -19.215 -20.105 1.00 0.00 H new ATOM 0 HE1 PHE A 138 111.780 -16.763 -16.962 1.00 0.00 H new ATOM 0 HE2 PHE A 138 112.267 -19.385 -20.328 1.00 0.00 H new ATOM 0 HZ PHE A 138 110.793 -18.159 -18.756 1.00 0.00 H new ATOM 2142 N GLN A 139 116.489 -21.046 -17.726 1.00 0.00 N ATOM 2143 CA GLN A 139 115.866 -22.359 -17.824 1.00 0.00 C ATOM 2144 C GLN A 139 115.828 -23.024 -16.454 1.00 0.00 C ATOM 2145 O GLN A 139 114.762 -23.388 -15.958 1.00 0.00 O ATOM 2146 CB GLN A 139 116.648 -23.237 -18.803 1.00 0.00 C ATOM 2147 CG GLN A 139 116.310 -22.829 -20.238 1.00 0.00 C ATOM 2148 CD GLN A 139 116.606 -23.982 -21.191 1.00 0.00 C ATOM 2149 OE1 GLN A 139 117.753 -24.175 -21.595 1.00 0.00 O ATOM 2150 NE2 GLN A 139 115.635 -24.763 -21.576 1.00 0.00 N ATOM 0 H GLN A 139 117.436 -20.996 -18.103 1.00 0.00 H new ATOM 0 HA GLN A 139 114.846 -22.237 -18.189 1.00 0.00 H new ATOM 0 HB2 GLN A 139 117.718 -23.132 -18.627 1.00 0.00 H new ATOM 0 HB3 GLN A 139 116.400 -24.287 -18.644 1.00 0.00 H new ATOM 0 HG2 GLN A 139 115.259 -22.550 -20.307 1.00 0.00 H new ATOM 0 HG3 GLN A 139 116.892 -21.953 -20.522 1.00 0.00 H new ATOM 0 HE21 GLN A 139 114.686 -24.601 -21.240 1.00 0.00 H new ATOM 0 HE22 GLN A 139 115.825 -25.536 -22.214 1.00 0.00 H new ATOM 2159 N ASN A 140 116.997 -23.166 -15.842 1.00 0.00 N ATOM 2160 CA ASN A 140 117.085 -23.774 -14.520 1.00 0.00 C ATOM 2161 C ASN A 140 116.423 -22.868 -13.491 1.00 0.00 C ATOM 2162 O ASN A 140 115.764 -23.337 -12.563 1.00 0.00 O ATOM 2163 CB ASN A 140 118.551 -24.000 -14.144 1.00 0.00 C ATOM 2164 CG ASN A 140 119.286 -24.680 -15.293 1.00 0.00 C ATOM 2165 OD1 ASN A 140 119.415 -25.905 -15.312 1.00 0.00 O ATOM 2166 ND2 ASN A 140 119.779 -23.954 -16.260 1.00 0.00 N ATOM 0 H ASN A 140 117.891 -22.871 -16.236 1.00 0.00 H new ATOM 0 HA ASN A 140 116.571 -24.735 -14.536 1.00 0.00 H new ATOM 0 HB2 ASN A 140 119.026 -23.047 -13.911 1.00 0.00 H new ATOM 0 HB3 ASN A 140 118.614 -24.615 -13.247 1.00 0.00 H new ATOM 0 HD21 ASN A 140 120.272 -24.401 -17.033 1.00 0.00 H new ATOM 0 HD22 ASN A 140 119.671 -22.940 -16.242 1.00 0.00 H new ATOM 2173 N TRP A 141 116.598 -21.564 -13.674 1.00 0.00 N ATOM 2174 CA TRP A 141 116.010 -20.580 -12.774 1.00 0.00 C ATOM 2175 C TRP A 141 114.498 -20.531 -12.969 1.00 0.00 C ATOM 2176 O TRP A 141 113.758 -20.138 -12.066 1.00 0.00 O ATOM 2177 CB TRP A 141 116.602 -19.199 -13.062 1.00 0.00 C ATOM 2178 CG TRP A 141 117.803 -18.963 -12.201 1.00 0.00 C ATOM 2179 CD1 TRP A 141 118.618 -19.925 -11.710 1.00 0.00 C ATOM 2180 CD2 TRP A 141 118.340 -17.695 -11.729 1.00 0.00 C ATOM 2181 NE1 TRP A 141 119.613 -19.327 -10.959 1.00 0.00 N ATOM 2182 CE2 TRP A 141 119.485 -17.954 -10.942 1.00 0.00 C ATOM 2183 CE3 TRP A 141 117.944 -16.355 -11.903 1.00 0.00 C ATOM 2184 CZ2 TRP A 141 120.215 -16.924 -10.349 1.00 0.00 C ATOM 2185 CZ3 TRP A 141 118.677 -15.316 -11.309 1.00 0.00 C ATOM 2186 CH2 TRP A 141 119.808 -15.600 -10.533 1.00 0.00 C ATOM 0 H TRP A 141 117.143 -21.164 -14.438 1.00 0.00 H new ATOM 0 HA TRP A 141 116.231 -20.866 -11.746 1.00 0.00 H new ATOM 0 HB2 TRP A 141 116.879 -19.126 -14.114 1.00 0.00 H new ATOM 0 HB3 TRP A 141 115.854 -18.428 -12.875 1.00 0.00 H new ATOM 0 HD1 TRP A 141 118.509 -20.986 -11.877 1.00 0.00 H new ATOM 0 HE1 TRP A 141 120.352 -19.839 -10.476 1.00 0.00 H new ATOM 0 HE3 TRP A 141 117.072 -16.126 -12.497 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 121.087 -17.148 -9.753 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 118.367 -14.291 -11.451 1.00 0.00 H new ATOM 0 HH2 TRP A 141 120.366 -14.795 -10.077 1.00 0.00 H new ATOM 2197 N ALA A 142 114.049 -20.929 -14.156 1.00 0.00 N ATOM 2198 CA ALA A 142 112.624 -20.923 -14.466 1.00 0.00 C ATOM 2199 C ALA A 142 112.135 -22.328 -14.777 1.00 0.00 C ATOM 2200 O ALA A 142 110.991 -22.529 -15.187 1.00 0.00 O ATOM 2201 CB ALA A 142 112.343 -19.999 -15.653 1.00 0.00 C ATOM 0 H ALA A 142 114.647 -21.258 -14.914 1.00 0.00 H new ATOM 0 HA ALA A 142 112.087 -20.553 -13.592 1.00 0.00 H new ATOM 0 HB1 ALA A 142 111.276 -20.004 -15.873 1.00 0.00 H new ATOM 0 HB2 ALA A 142 112.658 -18.985 -15.407 1.00 0.00 H new ATOM 0 HB3 ALA A 142 112.895 -20.349 -16.525 1.00 0.00 H new ATOM 2207 N ARG A 143 113.015 -23.287 -14.575 1.00 0.00 N ATOM 2208 CA ARG A 143 112.690 -24.686 -14.829 1.00 0.00 C ATOM 2209 C ARG A 143 111.188 -24.921 -14.700 1.00 0.00 C ATOM 2210 O ARG A 143 110.626 -25.539 -15.589 1.00 0.00 O ATOM 2211 CB ARG A 143 113.435 -25.583 -13.838 1.00 0.00 C ATOM 2212 CG ARG A 143 114.402 -26.495 -14.598 1.00 0.00 C ATOM 2213 CD ARG A 143 115.427 -27.077 -13.623 1.00 0.00 C ATOM 2214 NE ARG A 143 114.766 -27.941 -12.653 1.00 0.00 N ATOM 2215 CZ ARG A 143 115.465 -28.621 -11.750 1.00 0.00 C ATOM 2216 NH1 ARG A 143 116.766 -28.523 -11.724 1.00 0.00 N ATOM 2217 NH2 ARG A 143 114.850 -29.388 -10.891 1.00 0.00 N ATOM 2218 OXT ARG A 143 110.621 -24.478 -13.715 1.00 0.00 O ATOM 0 H ARG A 143 113.964 -23.129 -14.235 1.00 0.00 H new ATOM 0 HA ARG A 143 112.998 -24.932 -15.845 1.00 0.00 H new ATOM 0 HB2 ARG A 143 113.983 -24.973 -13.120 1.00 0.00 H new ATOM 0 HB3 ARG A 143 112.724 -26.183 -13.269 1.00 0.00 H new ATOM 0 HG2 ARG A 143 113.852 -27.299 -15.087 1.00 0.00 H new ATOM 0 HG3 ARG A 143 114.909 -25.933 -15.382 1.00 0.00 H new ATOM 0 HD2 ARG A 143 116.180 -27.643 -14.171 1.00 0.00 H new ATOM 0 HD3 ARG A 143 115.947 -26.270 -13.107 1.00 0.00 H new ATOM 0 HE ARG A 143 113.750 -28.025 -12.667 1.00 0.00 H new ATOM 0 HH11 ARG A 143 117.246 -27.925 -12.396 1.00 0.00 H new ATOM 0 HH12 ARG A 143 117.303 -29.045 -11.031 1.00 0.00 H new ATOM 0 HH21 ARG A 143 113.833 -29.465 -10.913 1.00 0.00 H new ATOM 0 HH22 ARG A 143 115.386 -29.910 -10.198 1.00 0.00 H new TER 2232 ARG A 143