USER MOD reduce.3.24.130724 H: found=0, std=0, add=1125, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1118 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 146 ASN : amide:sc= 0.859 K(o=2.2,f=-9!) USER MOD Set 1.2: A 149 LYS NZ :NH3+ 162:sc= 1.33 (180deg=0.483) USER MOD Set 2.1: A 74 CYS SG : rot 16:sc= 0.205 USER MOD Set 2.2: A 145 SER OG : rot -85:sc= 0.883 USER MOD Set 3.1: A 62 HIS : no HE2:sc= 0.362 K(o=1.4,f=-0.9) USER MOD Set 3.2: A 63 HIS : no HE2:sc= 0.896 K(o=1.4,f=-3.2!) USER MOD Set 3.3: A 65 MET CE :methyl -159:sc= -0.045 (180deg=-0.135) USER MOD Set 3.4: A 66 HIS : no HE2:sc= 0.193 K(o=1.4,f=-7.1!) USER MOD Set 4.1: A 60 HIS : no HE2:sc= 0.704 K(o=0.87,f=-2.6!) USER MOD Set 4.2: A 61 HIS : no HE2:sc= 0.163 K(o=0.87,f=-0.61) USER MOD Set 5.1: A 49 THR OG1 : rot -59:sc= 1.75 USER MOD Set 5.2: A 51 THR OG1 : rot 102:sc= 0.573 USER MOD Set 6.1: A 25 THR OG1 : rot 83:sc= 1.01 USER MOD Set 6.2: A 28 LYS NZ :NH3+ 163:sc= -0.63 (180deg=-0.833) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 168:sc= 1.15 (180deg=1.07) USER MOD Single : A 2 GLN : amide:sc= 0.355 K(o=0.35,f=-0.31) USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ 161:sc= 0.874 (180deg=0.588) USER MOD Single : A 8 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 10 LYS NZ :NH3+ 153:sc= 2.14 (180deg=1.02) USER MOD Single : A 11 THR OG1 : rot 178:sc= 1.18 USER MOD Single : A 13 LYS NZ :NH3+ -145:sc= 2.04 (180deg=0.139) USER MOD Single : A 16 THR OG1 : rot 142:sc= 0.00217 USER MOD Single : A 17 THR OG1 : rot -39:sc= 0.988 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 159:sc= 1.14 (180deg=0.792) USER MOD Single : A 32 GLN : amide:sc= -0.196 X(o=-0.2,f=-0.48) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= 1.88 K(o=1.9,f=0) USER MOD Single : A 37 ASN : amide:sc= 1.15 K(o=1.1,f=-2) USER MOD Single : A 44 THR OG1 : rot 64:sc= 1.14 USER MOD Single : A 45 TYR OH : rot 150:sc= -0.0287 USER MOD Single : A 50 LYS NZ :NH3+ -170:sc= 1.58 (180deg=1.36) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 126:sc= 1.22 USER MOD Single : A 58 SER OG : rot -111:sc= 0.996 USER MOD Single : A 59 HIS : no HE2:sc= 0.864 K(o=0.86,f=-2.6!) USER MOD Single : A 64 HIS : no HD1:sc= -0.0295 X(o=-0.029,f=-0.22) USER MOD Single : A 69 SER OG : rot -97:sc= 1.29 USER MOD Single : A 70 CYS SG : rot 25:sc= 0.453 USER MOD Single : A 75 LYS NZ :NH3+ -177:sc= 2.49 (180deg=2.41) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 1.15 K(o=1.2,f=-0.0047) USER MOD Single : A 83 ASN : amide:sc= 0.69 K(o=0.69,f=-1.2) USER MOD Single : A 84 ASN : amide:sc= 0.587 K(o=0.59,f=0) USER MOD Single : A 86 ASN : amide:sc= 0.689 K(o=0.69,f=-5!) USER MOD Single : A 87 LYS NZ :NH3+ 167:sc= 0.72 (180deg=0.494) USER MOD Single : A 88 THR OG1 : rot -51:sc= 1.03 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 TYR OH : rot 1:sc= 1.2 USER MOD Single : A 102 SER OG : rot 142:sc= 1.27 USER MOD Single : A 108 ASN : amide:sc= 0.881 K(o=0.88,f=0) USER MOD Single : A 134 THR OG1 : rot -85:sc= 0.804 USER MOD Single : A 136 CYS SG : rot -158:sc= 0.131 USER MOD Single : A 138 CYS SG : rot -170:sc= 0.824 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.011 -7.604 -11.541 1.00 0.00 N ATOM 2 CA MET A 1 9.908 -6.435 -11.353 1.00 0.00 C ATOM 3 C MET A 1 9.571 -5.328 -12.361 1.00 0.00 C ATOM 4 O MET A 1 9.943 -5.420 -13.529 1.00 0.00 O ATOM 5 CB MET A 1 11.402 -6.819 -11.464 1.00 0.00 C ATOM 6 CG MET A 1 11.898 -7.628 -10.257 1.00 0.00 C ATOM 7 SD MET A 1 13.628 -8.155 -10.379 1.00 0.00 S ATOM 8 CE MET A 1 13.791 -9.002 -8.782 1.00 0.00 C ATOM 0 H1 MET A 1 9.377 -8.413 -10.999 1.00 0.00 H new ATOM 0 H2 MET A 1 8.056 -7.366 -11.206 1.00 0.00 H new ATOM 0 H3 MET A 1 8.972 -7.853 -12.550 1.00 0.00 H new ATOM 0 HA MET A 1 9.739 -6.064 -10.342 1.00 0.00 H new ATOM 0 HB2 MET A 1 11.557 -7.399 -12.373 1.00 0.00 H new ATOM 0 HB3 MET A 1 12.000 -5.912 -11.559 1.00 0.00 H new ATOM 0 HG2 MET A 1 11.775 -7.028 -9.356 1.00 0.00 H new ATOM 0 HG3 MET A 1 11.268 -8.510 -10.141 1.00 0.00 H new ATOM 0 HE1 MET A 1 14.802 -9.396 -8.681 1.00 0.00 H new ATOM 0 HE2 MET A 1 13.593 -8.297 -7.974 1.00 0.00 H new ATOM 0 HE3 MET A 1 13.075 -9.823 -8.731 1.00 0.00 H new ATOM 20 N GLN A 2 8.871 -4.260 -11.974 1.00 0.00 N ATOM 21 CA GLN A 2 8.194 -4.022 -10.691 1.00 0.00 C ATOM 22 C GLN A 2 7.060 -3.013 -10.865 1.00 0.00 C ATOM 23 O GLN A 2 7.077 -2.203 -11.784 1.00 0.00 O ATOM 24 CB GLN A 2 9.165 -3.405 -9.670 1.00 0.00 C ATOM 25 CG GLN A 2 8.803 -3.716 -8.201 1.00 0.00 C ATOM 26 CD GLN A 2 8.939 -5.195 -7.846 1.00 0.00 C ATOM 27 OE1 GLN A 2 10.028 -5.739 -7.733 1.00 0.00 O ATOM 28 NE2 GLN A 2 7.843 -5.906 -7.694 1.00 0.00 N ATOM 0 H GLN A 2 8.751 -3.467 -12.604 1.00 0.00 H new ATOM 0 HA GLN A 2 7.820 -4.986 -10.345 1.00 0.00 H new ATOM 0 HB2 GLN A 2 10.172 -3.771 -9.872 1.00 0.00 H new ATOM 0 HB3 GLN A 2 9.185 -2.324 -9.809 1.00 0.00 H new ATOM 0 HG2 GLN A 2 9.446 -3.131 -7.544 1.00 0.00 H new ATOM 0 HG3 GLN A 2 7.778 -3.397 -8.011 1.00 0.00 H new ATOM 0 HE21 GLN A 2 6.930 -5.461 -7.786 1.00 0.00 H new ATOM 0 HE22 GLN A 2 7.906 -6.902 -7.484 1.00 0.00 H new ATOM 37 N TYR A 3 6.146 -2.979 -9.903 1.00 0.00 N ATOM 38 CA TYR A 3 5.258 -1.866 -9.663 1.00 0.00 C ATOM 39 C TYR A 3 5.257 -1.648 -8.149 1.00 0.00 C ATOM 40 O TYR A 3 4.795 -2.493 -7.374 1.00 0.00 O ATOM 41 CB TYR A 3 3.888 -2.149 -10.282 1.00 0.00 C ATOM 42 CG TYR A 3 3.937 -2.591 -11.743 1.00 0.00 C ATOM 43 CD1 TYR A 3 4.317 -3.910 -12.070 1.00 0.00 C ATOM 44 CD2 TYR A 3 3.676 -1.677 -12.778 1.00 0.00 C ATOM 45 CE1 TYR A 3 4.341 -4.347 -13.404 1.00 0.00 C ATOM 46 CE2 TYR A 3 3.717 -2.107 -14.121 1.00 0.00 C ATOM 47 CZ TYR A 3 4.023 -3.444 -14.440 1.00 0.00 C ATOM 48 OH TYR A 3 4.054 -3.837 -15.742 1.00 0.00 O ATOM 0 H TYR A 3 6.004 -3.752 -9.253 1.00 0.00 H new ATOM 0 HA TYR A 3 5.578 -0.940 -10.140 1.00 0.00 H new ATOM 0 HB2 TYR A 3 3.391 -2.923 -9.697 1.00 0.00 H new ATOM 0 HB3 TYR A 3 3.276 -1.250 -10.207 1.00 0.00 H new ATOM 0 HD1 TYR A 3 4.594 -4.594 -11.282 1.00 0.00 H new ATOM 0 HD2 TYR A 3 3.445 -0.648 -12.546 1.00 0.00 H new ATOM 0 HE1 TYR A 3 4.602 -5.369 -13.636 1.00 0.00 H new ATOM 0 HE2 TYR A 3 3.511 -1.403 -14.914 1.00 0.00 H new ATOM 0 HH TYR A 3 3.805 -3.084 -16.317 1.00 0.00 H new ATOM 58 N LYS A 4 5.872 -0.537 -7.743 1.00 0.00 N ATOM 59 CA LYS A 4 6.217 -0.170 -6.360 1.00 0.00 C ATOM 60 C LYS A 4 5.757 1.247 -6.092 1.00 0.00 C ATOM 61 O LYS A 4 6.068 2.106 -6.887 1.00 0.00 O ATOM 62 CB LYS A 4 7.752 -0.270 -6.192 1.00 0.00 C ATOM 63 CG LYS A 4 8.260 0.149 -4.794 1.00 0.00 C ATOM 64 CD LYS A 4 9.764 0.439 -4.747 1.00 0.00 C ATOM 65 CE LYS A 4 10.677 -0.750 -5.083 1.00 0.00 C ATOM 66 NZ LYS A 4 10.961 -1.581 -3.887 1.00 0.00 N ATOM 0 H LYS A 4 6.163 0.179 -8.409 1.00 0.00 H new ATOM 0 HA LYS A 4 5.727 -0.841 -5.654 1.00 0.00 H new ATOM 0 HB2 LYS A 4 8.062 -1.296 -6.387 1.00 0.00 H new ATOM 0 HB3 LYS A 4 8.231 0.357 -6.944 1.00 0.00 H new ATOM 0 HG2 LYS A 4 7.717 1.037 -4.471 1.00 0.00 H new ATOM 0 HG3 LYS A 4 8.029 -0.642 -4.081 1.00 0.00 H new ATOM 0 HD2 LYS A 4 9.982 1.250 -5.442 1.00 0.00 H new ATOM 0 HD3 LYS A 4 10.016 0.798 -3.749 1.00 0.00 H new ATOM 0 HE2 LYS A 4 10.206 -1.365 -5.850 1.00 0.00 H new ATOM 0 HE3 LYS A 4 11.614 -0.382 -5.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 11.293 -2.520 -4.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 11.695 -1.122 -3.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 10.094 -1.685 -3.323 1.00 0.00 H new ATOM 80 N LEU A 5 5.140 1.505 -4.946 1.00 0.00 N ATOM 81 CA LEU A 5 4.939 2.812 -4.354 1.00 0.00 C ATOM 82 C LEU A 5 5.726 2.882 -3.062 1.00 0.00 C ATOM 83 O LEU A 5 5.275 2.400 -2.029 1.00 0.00 O ATOM 84 CB LEU A 5 3.438 3.022 -4.130 1.00 0.00 C ATOM 85 CG LEU A 5 3.132 4.321 -3.366 1.00 0.00 C ATOM 86 CD1 LEU A 5 3.410 5.512 -4.265 1.00 0.00 C ATOM 87 CD2 LEU A 5 1.705 4.334 -2.833 1.00 0.00 C ATOM 0 H LEU A 5 4.744 0.759 -4.374 1.00 0.00 H new ATOM 0 HA LEU A 5 5.295 3.608 -5.008 1.00 0.00 H new ATOM 0 HB2 LEU A 5 2.930 3.043 -5.094 1.00 0.00 H new ATOM 0 HB3 LEU A 5 3.035 2.175 -3.575 1.00 0.00 H new ATOM 0 HG LEU A 5 3.785 4.382 -2.495 1.00 0.00 H new ATOM 0 HD11 LEU A 5 3.194 6.434 -3.725 1.00 0.00 H new ATOM 0 HD12 LEU A 5 4.458 5.505 -4.565 1.00 0.00 H new ATOM 0 HD13 LEU A 5 2.778 5.454 -5.151 1.00 0.00 H new ATOM 0 HD21 LEU A 5 1.525 5.267 -2.299 1.00 0.00 H new ATOM 0 HD22 LEU A 5 1.005 4.251 -3.665 1.00 0.00 H new ATOM 0 HD23 LEU A 5 1.563 3.494 -2.154 1.00 0.00 H new ATOM 99 N ILE A 6 6.897 3.491 -3.141 1.00 0.00 N ATOM 100 CA ILE A 6 7.627 4.072 -2.036 1.00 0.00 C ATOM 101 C ILE A 6 6.755 5.128 -1.376 1.00 0.00 C ATOM 102 O ILE A 6 6.291 6.084 -2.002 1.00 0.00 O ATOM 103 CB ILE A 6 8.968 4.681 -2.509 1.00 0.00 C ATOM 104 CG1 ILE A 6 9.731 3.664 -3.381 1.00 0.00 C ATOM 105 CG2 ILE A 6 9.805 5.135 -1.303 1.00 0.00 C ATOM 106 CD1 ILE A 6 11.189 4.009 -3.715 1.00 0.00 C ATOM 0 H ILE A 6 7.388 3.597 -4.029 1.00 0.00 H new ATOM 0 HA ILE A 6 7.867 3.292 -1.314 1.00 0.00 H new ATOM 0 HB ILE A 6 8.767 5.562 -3.119 1.00 0.00 H new ATOM 0 HG12 ILE A 6 9.716 2.700 -2.873 1.00 0.00 H new ATOM 0 HG13 ILE A 6 9.186 3.540 -4.317 1.00 0.00 H new ATOM 0 HG21 ILE A 6 10.745 5.561 -1.653 1.00 0.00 H new ATOM 0 HG22 ILE A 6 9.253 5.887 -0.739 1.00 0.00 H new ATOM 0 HG23 ILE A 6 10.011 4.279 -0.660 1.00 0.00 H new ATOM 0 HD11 ILE A 6 11.618 3.219 -4.332 1.00 0.00 H new ATOM 0 HD12 ILE A 6 11.224 4.953 -4.258 1.00 0.00 H new ATOM 0 HD13 ILE A 6 11.762 4.100 -2.792 1.00 0.00 H new ATOM 118 N LEU A 7 6.568 4.937 -0.087 1.00 0.00 N ATOM 119 CA LEU A 7 6.017 5.934 0.814 1.00 0.00 C ATOM 120 C LEU A 7 7.149 6.681 1.520 1.00 0.00 C ATOM 121 O LEU A 7 8.086 6.079 2.033 1.00 0.00 O ATOM 122 CB LEU A 7 5.073 5.262 1.833 1.00 0.00 C ATOM 123 CG LEU A 7 3.605 5.561 1.514 1.00 0.00 C ATOM 124 CD1 LEU A 7 3.175 4.927 0.196 1.00 0.00 C ATOM 125 CD2 LEU A 7 2.691 5.069 2.629 1.00 0.00 C ATOM 0 H LEU A 7 6.801 4.060 0.379 1.00 0.00 H new ATOM 0 HA LEU A 7 5.437 6.657 0.241 1.00 0.00 H new ATOM 0 HB2 LEU A 7 5.236 4.184 1.827 1.00 0.00 H new ATOM 0 HB3 LEU A 7 5.308 5.615 2.837 1.00 0.00 H new ATOM 0 HG LEU A 7 3.516 6.644 1.426 1.00 0.00 H new ATOM 0 HD11 LEU A 7 2.128 5.161 0.004 1.00 0.00 H new ATOM 0 HD12 LEU A 7 3.789 5.320 -0.614 1.00 0.00 H new ATOM 0 HD13 LEU A 7 3.300 3.846 0.254 1.00 0.00 H new ATOM 0 HD21 LEU A 7 1.655 5.294 2.376 1.00 0.00 H new ATOM 0 HD22 LEU A 7 2.810 3.992 2.748 1.00 0.00 H new ATOM 0 HD23 LEU A 7 2.954 5.568 3.562 1.00 0.00 H new ATOM 137 N ASN A 8 7.031 8.000 1.590 1.00 0.00 N ATOM 138 CA ASN A 8 7.924 8.865 2.353 1.00 0.00 C ATOM 139 C ASN A 8 7.114 10.032 2.938 1.00 0.00 C ATOM 140 O ASN A 8 7.418 11.203 2.695 1.00 0.00 O ATOM 141 CB ASN A 8 9.113 9.289 1.471 1.00 0.00 C ATOM 142 CG ASN A 8 10.284 8.323 1.529 1.00 0.00 C ATOM 143 OD1 ASN A 8 10.780 7.964 2.589 1.00 0.00 O ATOM 144 ND2 ASN A 8 10.798 7.904 0.396 1.00 0.00 N ATOM 0 H ASN A 8 6.293 8.512 1.106 1.00 0.00 H new ATOM 0 HA ASN A 8 8.360 8.340 3.203 1.00 0.00 H new ATOM 0 HB2 ASN A 8 8.776 9.378 0.438 1.00 0.00 H new ATOM 0 HB3 ASN A 8 9.452 10.277 1.782 1.00 0.00 H new ATOM 0 HD21 ASN A 8 11.607 7.282 0.402 1.00 0.00 H new ATOM 0 HD22 ASN A 8 10.389 8.200 -0.490 1.00 0.00 H new ATOM 151 N GLY A 9 6.028 9.717 3.653 1.00 0.00 N ATOM 152 CA GLY A 9 5.122 10.710 4.215 1.00 0.00 C ATOM 153 C GLY A 9 5.252 10.886 5.720 1.00 0.00 C ATOM 154 O GLY A 9 5.984 10.179 6.412 1.00 0.00 O ATOM 0 H GLY A 9 5.756 8.755 3.856 1.00 0.00 H new ATOM 0 HA2 GLY A 9 5.305 11.669 3.730 1.00 0.00 H new ATOM 0 HA3 GLY A 9 4.096 10.425 3.980 1.00 0.00 H new ATOM 158 N LYS A 10 4.489 11.853 6.221 1.00 0.00 N ATOM 159 CA LYS A 10 4.352 12.166 7.650 1.00 0.00 C ATOM 160 C LYS A 10 3.821 10.942 8.399 1.00 0.00 C ATOM 161 O LYS A 10 4.386 10.499 9.397 1.00 0.00 O ATOM 162 CB LYS A 10 3.357 13.325 7.799 1.00 0.00 C ATOM 163 CG LYS A 10 3.855 14.766 7.617 1.00 0.00 C ATOM 164 CD LYS A 10 4.978 15.004 6.598 1.00 0.00 C ATOM 165 CE LYS A 10 5.070 16.502 6.275 1.00 0.00 C ATOM 166 NZ LYS A 10 4.158 16.861 5.162 1.00 0.00 N ATOM 0 H LYS A 10 3.928 12.464 5.628 1.00 0.00 H new ATOM 0 HA LYS A 10 5.321 12.443 8.065 1.00 0.00 H new ATOM 0 HB2 LYS A 10 2.553 13.162 7.081 1.00 0.00 H new ATOM 0 HB3 LYS A 10 2.916 13.253 8.793 1.00 0.00 H new ATOM 0 HG2 LYS A 10 3.003 15.382 7.329 1.00 0.00 H new ATOM 0 HG3 LYS A 10 4.198 15.128 8.586 1.00 0.00 H new ATOM 0 HD2 LYS A 10 5.928 14.649 6.998 1.00 0.00 H new ATOM 0 HD3 LYS A 10 4.784 14.437 5.688 1.00 0.00 H new ATOM 0 HE2 LYS A 10 4.817 17.085 7.160 1.00 0.00 H new ATOM 0 HE3 LYS A 10 6.095 16.758 6.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 3.881 17.860 5.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 4.643 16.713 4.254 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 3.309 16.262 5.202 1.00 0.00 H new ATOM 180 N THR A 11 2.749 10.377 7.855 1.00 0.00 N ATOM 181 CA THR A 11 2.087 9.154 8.326 1.00 0.00 C ATOM 182 C THR A 11 3.030 7.943 8.405 1.00 0.00 C ATOM 183 O THR A 11 3.085 7.279 9.441 1.00 0.00 O ATOM 184 CB THR A 11 0.900 8.872 7.393 1.00 0.00 C ATOM 185 OG1 THR A 11 -0.124 9.800 7.666 1.00 0.00 O ATOM 186 CG2 THR A 11 0.331 7.466 7.531 1.00 0.00 C ATOM 0 H THR A 11 2.292 10.774 7.034 1.00 0.00 H new ATOM 0 HA THR A 11 1.747 9.316 9.349 1.00 0.00 H new ATOM 0 HB THR A 11 1.275 8.964 6.374 1.00 0.00 H new ATOM 0 HG1 THR A 11 -0.876 9.646 7.057 1.00 0.00 H new ATOM 0 HG21 THR A 11 -0.504 7.342 6.841 1.00 0.00 H new ATOM 0 HG22 THR A 11 1.106 6.735 7.299 1.00 0.00 H new ATOM 0 HG23 THR A 11 -0.017 7.313 8.553 1.00 0.00 H new ATOM 194 N LEU A 12 3.754 7.633 7.319 1.00 0.00 N ATOM 195 CA LEU A 12 4.542 6.401 7.168 1.00 0.00 C ATOM 196 C LEU A 12 5.614 6.573 6.079 1.00 0.00 C ATOM 197 O LEU A 12 5.357 7.183 5.036 1.00 0.00 O ATOM 198 CB LEU A 12 3.548 5.251 6.846 1.00 0.00 C ATOM 199 CG LEU A 12 4.042 3.787 6.817 1.00 0.00 C ATOM 200 CD1 LEU A 12 4.657 3.367 5.481 1.00 0.00 C ATOM 201 CD2 LEU A 12 5.003 3.449 7.956 1.00 0.00 C ATOM 0 H LEU A 12 3.809 8.245 6.505 1.00 0.00 H new ATOM 0 HA LEU A 12 5.082 6.164 8.085 1.00 0.00 H new ATOM 0 HB2 LEU A 12 2.741 5.306 7.577 1.00 0.00 H new ATOM 0 HB3 LEU A 12 3.110 5.465 5.871 1.00 0.00 H new ATOM 0 HG LEU A 12 3.129 3.208 6.957 1.00 0.00 H new ATOM 0 HD11 LEU A 12 4.980 2.327 5.540 1.00 0.00 H new ATOM 0 HD12 LEU A 12 3.915 3.473 4.690 1.00 0.00 H new ATOM 0 HD13 LEU A 12 5.516 4.001 5.260 1.00 0.00 H new ATOM 0 HD21 LEU A 12 5.310 2.406 7.875 1.00 0.00 H new ATOM 0 HD22 LEU A 12 5.881 4.092 7.894 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.504 3.607 8.912 1.00 0.00 H new ATOM 213 N LYS A 13 6.801 5.991 6.303 1.00 0.00 N ATOM 214 CA LYS A 13 7.903 5.892 5.335 1.00 0.00 C ATOM 215 C LYS A 13 8.360 4.437 5.199 1.00 0.00 C ATOM 216 O LYS A 13 8.411 3.692 6.180 1.00 0.00 O ATOM 217 CB LYS A 13 9.078 6.807 5.724 1.00 0.00 C ATOM 218 CG LYS A 13 8.713 8.307 5.756 1.00 0.00 C ATOM 219 CD LYS A 13 8.940 8.967 7.116 1.00 0.00 C ATOM 220 CE LYS A 13 8.073 8.344 8.219 1.00 0.00 C ATOM 221 NZ LYS A 13 8.544 8.766 9.557 1.00 0.00 N ATOM 0 H LYS A 13 7.029 5.559 7.199 1.00 0.00 H new ATOM 0 HA LYS A 13 7.535 6.232 4.367 1.00 0.00 H new ATOM 0 HB2 LYS A 13 9.448 6.511 6.706 1.00 0.00 H new ATOM 0 HB3 LYS A 13 9.894 6.656 5.017 1.00 0.00 H new ATOM 0 HG2 LYS A 13 9.304 8.831 5.005 1.00 0.00 H new ATOM 0 HG3 LYS A 13 7.666 8.423 5.476 1.00 0.00 H new ATOM 0 HD2 LYS A 13 9.991 8.878 7.390 1.00 0.00 H new ATOM 0 HD3 LYS A 13 8.719 10.032 7.042 1.00 0.00 H new ATOM 0 HE2 LYS A 13 7.034 8.643 8.083 1.00 0.00 H new ATOM 0 HE3 LYS A 13 8.105 7.257 8.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 8.417 7.985 10.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 9.551 9.019 9.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 7.995 9.591 9.874 1.00 0.00 H new ATOM 235 N GLY A 14 8.613 4.038 3.962 1.00 0.00 N ATOM 236 CA GLY A 14 8.606 2.650 3.503 1.00 0.00 C ATOM 237 C GLY A 14 8.121 2.577 2.062 1.00 0.00 C ATOM 238 O GLY A 14 8.565 3.332 1.202 1.00 0.00 O ATOM 0 H GLY A 14 8.839 4.697 3.217 1.00 0.00 H new ATOM 0 HA2 GLY A 14 9.608 2.229 3.579 1.00 0.00 H new ATOM 0 HA3 GLY A 14 7.959 2.051 4.143 1.00 0.00 H new ATOM 242 N GLU A 15 7.213 1.655 1.782 1.00 0.00 N ATOM 243 CA GLU A 15 6.633 1.384 0.461 1.00 0.00 C ATOM 244 C GLU A 15 5.336 0.566 0.628 1.00 0.00 C ATOM 245 O GLU A 15 4.877 0.330 1.751 1.00 0.00 O ATOM 246 CB GLU A 15 7.587 0.590 -0.466 1.00 0.00 C ATOM 247 CG GLU A 15 9.113 0.799 -0.408 1.00 0.00 C ATOM 248 CD GLU A 15 9.903 -0.252 -1.214 1.00 0.00 C ATOM 249 OE1 GLU A 15 9.343 -1.289 -1.644 1.00 0.00 O ATOM 250 OE2 GLU A 15 11.118 -0.047 -1.457 1.00 0.00 O ATOM 0 H GLU A 15 6.836 1.039 2.503 1.00 0.00 H new ATOM 0 HA GLU A 15 6.441 2.352 -0.001 1.00 0.00 H new ATOM 0 HB2 GLU A 15 7.403 -0.468 -0.281 1.00 0.00 H new ATOM 0 HB3 GLU A 15 7.277 0.793 -1.491 1.00 0.00 H new ATOM 0 HG2 GLU A 15 9.351 1.793 -0.788 1.00 0.00 H new ATOM 0 HG3 GLU A 15 9.438 0.769 0.632 1.00 0.00 H new ATOM 257 N THR A 16 4.802 0.041 -0.480 1.00 0.00 N ATOM 258 CA THR A 16 3.876 -1.100 -0.458 1.00 0.00 C ATOM 259 C THR A 16 4.143 -2.171 -1.521 1.00 0.00 C ATOM 260 O THR A 16 4.167 -3.360 -1.197 1.00 0.00 O ATOM 261 CB THR A 16 2.412 -0.609 -0.498 1.00 0.00 C ATOM 262 OG1 THR A 16 1.486 -1.670 -0.612 1.00 0.00 O ATOM 263 CG2 THR A 16 2.130 0.409 -1.612 1.00 0.00 C ATOM 0 H THR A 16 4.998 0.393 -1.417 1.00 0.00 H new ATOM 0 HA THR A 16 4.061 -1.609 0.488 1.00 0.00 H new ATOM 0 HB THR A 16 2.278 -0.110 0.462 1.00 0.00 H new ATOM 0 HG1 THR A 16 0.698 -1.477 -0.061 1.00 0.00 H new ATOM 0 HG21 THR A 16 1.082 0.707 -1.576 1.00 0.00 H new ATOM 0 HG22 THR A 16 2.761 1.286 -1.472 1.00 0.00 H new ATOM 0 HG23 THR A 16 2.346 -0.042 -2.580 1.00 0.00 H new ATOM 271 N THR A 17 4.390 -1.766 -2.773 1.00 0.00 N ATOM 272 CA THR A 17 4.237 -2.605 -3.995 1.00 0.00 C ATOM 273 C THR A 17 2.841 -3.216 -4.181 1.00 0.00 C ATOM 274 O THR A 17 2.014 -3.230 -3.266 1.00 0.00 O ATOM 275 CB THR A 17 5.321 -3.698 -4.172 1.00 0.00 C ATOM 276 OG1 THR A 17 5.076 -4.830 -3.370 1.00 0.00 O ATOM 277 CG2 THR A 17 6.760 -3.256 -3.919 1.00 0.00 C ATOM 0 H THR A 17 4.711 -0.821 -2.983 1.00 0.00 H new ATOM 0 HA THR A 17 4.382 -1.872 -4.788 1.00 0.00 H new ATOM 0 HB THR A 17 5.235 -3.937 -5.232 1.00 0.00 H new ATOM 0 HG1 THR A 17 4.730 -4.545 -2.499 1.00 0.00 H new ATOM 0 HG21 THR A 17 7.432 -4.100 -4.072 1.00 0.00 H new ATOM 0 HG22 THR A 17 7.021 -2.455 -4.610 1.00 0.00 H new ATOM 0 HG23 THR A 17 6.856 -2.897 -2.894 1.00 0.00 H new ATOM 285 N THR A 18 2.559 -3.697 -5.398 1.00 0.00 N ATOM 286 CA THR A 18 1.337 -4.475 -5.697 1.00 0.00 C ATOM 287 C THR A 18 1.453 -5.411 -6.908 1.00 0.00 C ATOM 288 O THR A 18 0.677 -6.363 -7.003 1.00 0.00 O ATOM 289 CB THR A 18 0.131 -3.526 -5.873 1.00 0.00 C ATOM 290 OG1 THR A 18 -1.092 -4.205 -5.680 1.00 0.00 O ATOM 291 CG2 THR A 18 0.069 -2.788 -7.215 1.00 0.00 C ATOM 0 H THR A 18 3.166 -3.561 -6.206 1.00 0.00 H new ATOM 0 HA THR A 18 1.188 -5.127 -4.836 1.00 0.00 H new ATOM 0 HB THR A 18 0.286 -2.770 -5.103 1.00 0.00 H new ATOM 0 HG1 THR A 18 -1.836 -3.578 -5.796 1.00 0.00 H new ATOM 0 HG21 THR A 18 -0.813 -2.148 -7.238 1.00 0.00 H new ATOM 0 HG22 THR A 18 0.963 -2.177 -7.336 1.00 0.00 H new ATOM 0 HG23 THR A 18 0.013 -3.513 -8.027 1.00 0.00 H new ATOM 299 N GLU A 19 2.425 -5.188 -7.803 1.00 0.00 N ATOM 300 CA GLU A 19 2.511 -5.673 -9.180 1.00 0.00 C ATOM 301 C GLU A 19 1.255 -5.438 -10.067 1.00 0.00 C ATOM 302 O GLU A 19 0.112 -5.514 -9.610 1.00 0.00 O ATOM 303 CB GLU A 19 2.992 -7.124 -9.149 1.00 0.00 C ATOM 304 CG GLU A 19 4.139 -7.367 -10.129 1.00 0.00 C ATOM 305 CD GLU A 19 5.469 -6.641 -9.839 1.00 0.00 C ATOM 306 OE1 GLU A 19 5.511 -5.652 -9.067 1.00 0.00 O ATOM 307 OE2 GLU A 19 6.493 -7.035 -10.447 1.00 0.00 O ATOM 0 H GLU A 19 3.235 -4.618 -7.559 1.00 0.00 H new ATOM 0 HA GLU A 19 3.243 -5.054 -9.699 1.00 0.00 H new ATOM 0 HB2 GLU A 19 3.317 -7.377 -8.140 1.00 0.00 H new ATOM 0 HB3 GLU A 19 2.161 -7.787 -9.391 1.00 0.00 H new ATOM 0 HG2 GLU A 19 4.337 -8.438 -10.161 1.00 0.00 H new ATOM 0 HG3 GLU A 19 3.803 -7.075 -11.124 1.00 0.00 H new ATOM 314 N ALA A 20 1.442 -5.132 -11.357 1.00 0.00 N ATOM 315 CA ALA A 20 0.363 -4.671 -12.243 1.00 0.00 C ATOM 316 C ALA A 20 0.533 -5.080 -13.716 1.00 0.00 C ATOM 317 O ALA A 20 1.513 -5.711 -14.121 1.00 0.00 O ATOM 318 CB ALA A 20 0.263 -3.141 -12.121 1.00 0.00 C ATOM 0 H ALA A 20 2.349 -5.197 -11.818 1.00 0.00 H new ATOM 0 HA ALA A 20 -0.555 -5.160 -11.918 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -0.532 -2.775 -12.771 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.041 -2.872 -11.088 1.00 0.00 H new ATOM 0 HB3 ALA A 20 1.210 -2.690 -12.418 1.00 0.00 H new ATOM 324 N VAL A 21 -0.468 -4.699 -14.511 1.00 0.00 N ATOM 325 CA VAL A 21 -0.555 -4.913 -15.961 1.00 0.00 C ATOM 326 C VAL A 21 0.289 -3.892 -16.741 1.00 0.00 C ATOM 327 O VAL A 21 0.878 -4.224 -17.771 1.00 0.00 O ATOM 328 CB VAL A 21 -2.025 -4.765 -16.429 1.00 0.00 C ATOM 329 CG1 VAL A 21 -2.256 -5.492 -17.757 1.00 0.00 C ATOM 330 CG2 VAL A 21 -3.063 -5.267 -15.416 1.00 0.00 C ATOM 0 H VAL A 21 -1.283 -4.207 -14.144 1.00 0.00 H new ATOM 0 HA VAL A 21 -0.178 -5.916 -16.158 1.00 0.00 H new ATOM 0 HB VAL A 21 -2.170 -3.691 -16.543 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -3.296 -5.372 -18.062 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -1.603 -5.070 -18.521 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -2.034 -6.552 -17.635 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -4.065 -5.127 -15.822 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -2.896 -6.326 -15.219 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -2.966 -4.705 -14.487 1.00 0.00 H new ATOM 340 N ASP A 22 0.288 -2.633 -16.284 1.00 0.00 N ATOM 341 CA ASP A 22 0.396 -1.471 -17.191 1.00 0.00 C ATOM 342 C ASP A 22 1.050 -0.187 -16.646 1.00 0.00 C ATOM 343 O ASP A 22 1.266 0.766 -17.398 1.00 0.00 O ATOM 344 CB ASP A 22 -1.029 -1.114 -17.628 1.00 0.00 C ATOM 345 CG ASP A 22 -1.965 -0.795 -16.454 1.00 0.00 C ATOM 346 OD1 ASP A 22 -1.510 -0.833 -15.288 1.00 0.00 O ATOM 347 OD2 ASP A 22 -3.157 -0.488 -16.673 1.00 0.00 O ATOM 0 H ASP A 22 0.214 -2.388 -15.297 1.00 0.00 H new ATOM 0 HA ASP A 22 1.069 -1.797 -17.984 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -0.991 -0.254 -18.297 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -1.445 -1.944 -18.199 1.00 0.00 H new ATOM 352 N ALA A 23 1.324 -0.157 -15.347 1.00 0.00 N ATOM 353 CA ALA A 23 1.729 1.024 -14.570 1.00 0.00 C ATOM 354 C ALA A 23 0.656 2.136 -14.510 1.00 0.00 C ATOM 355 O ALA A 23 0.975 3.312 -14.324 1.00 0.00 O ATOM 356 CB ALA A 23 3.101 1.532 -15.037 1.00 0.00 C ATOM 0 H ALA A 23 1.269 -0.997 -14.771 1.00 0.00 H new ATOM 0 HA ALA A 23 1.828 0.702 -13.533 1.00 0.00 H new ATOM 0 HB1 ALA A 23 3.384 2.406 -14.451 1.00 0.00 H new ATOM 0 HB2 ALA A 23 3.845 0.747 -14.901 1.00 0.00 H new ATOM 0 HB3 ALA A 23 3.049 1.804 -16.091 1.00 0.00 H new ATOM 362 N ALA A 24 -0.623 1.767 -14.632 1.00 0.00 N ATOM 363 CA ALA A 24 -1.763 2.683 -14.530 1.00 0.00 C ATOM 364 C ALA A 24 -2.898 2.061 -13.702 1.00 0.00 C ATOM 365 O ALA A 24 -3.478 2.720 -12.854 1.00 0.00 O ATOM 366 CB ALA A 24 -2.208 3.074 -15.946 1.00 0.00 C ATOM 0 H ALA A 24 -0.900 0.801 -14.808 1.00 0.00 H new ATOM 0 HA ALA A 24 -1.470 3.589 -14.000 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -3.056 3.756 -15.886 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -1.384 3.565 -16.464 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -2.500 2.179 -16.496 1.00 0.00 H new ATOM 372 N THR A 25 -3.149 0.761 -13.839 1.00 0.00 N ATOM 373 CA THR A 25 -3.785 -0.136 -12.852 1.00 0.00 C ATOM 374 C THR A 25 -2.942 -0.299 -11.579 1.00 0.00 C ATOM 375 O THR A 25 -3.455 -0.693 -10.534 1.00 0.00 O ATOM 376 CB THR A 25 -4.051 -1.493 -13.523 1.00 0.00 C ATOM 377 OG1 THR A 25 -4.914 -1.271 -14.621 1.00 0.00 O ATOM 378 CG2 THR A 25 -4.700 -2.563 -12.655 1.00 0.00 C ATOM 0 H THR A 25 -2.901 0.265 -14.695 1.00 0.00 H new ATOM 0 HA THR A 25 -4.726 0.310 -12.530 1.00 0.00 H new ATOM 0 HB THR A 25 -3.066 -1.878 -13.786 1.00 0.00 H new ATOM 0 HG1 THR A 25 -4.388 -0.988 -15.398 1.00 0.00 H new ATOM 0 HG21 THR A 25 -4.836 -3.473 -13.240 1.00 0.00 H new ATOM 0 HG22 THR A 25 -4.060 -2.774 -11.799 1.00 0.00 H new ATOM 0 HG23 THR A 25 -5.669 -2.209 -12.305 1.00 0.00 H new ATOM 386 N ALA A 26 -1.666 0.087 -11.639 1.00 0.00 N ATOM 387 CA ALA A 26 -0.833 0.286 -10.457 1.00 0.00 C ATOM 388 C ALA A 26 -1.119 1.641 -9.814 1.00 0.00 C ATOM 389 O ALA A 26 -1.427 1.697 -8.629 1.00 0.00 O ATOM 390 CB ALA A 26 0.645 0.264 -10.825 1.00 0.00 C ATOM 0 H ALA A 26 -1.180 0.271 -12.517 1.00 0.00 H new ATOM 0 HA ALA A 26 -1.066 -0.523 -9.765 1.00 0.00 H new ATOM 0 HB1 ALA A 26 1.246 0.414 -9.928 1.00 0.00 H new ATOM 0 HB2 ALA A 26 0.894 -0.698 -11.272 1.00 0.00 H new ATOM 0 HB3 ALA A 26 0.854 1.060 -11.539 1.00 0.00 H new ATOM 396 N GLU A 27 -1.054 2.733 -10.594 1.00 0.00 N ATOM 397 CA GLU A 27 -1.193 4.082 -10.080 1.00 0.00 C ATOM 398 C GLU A 27 -2.549 4.212 -9.469 1.00 0.00 C ATOM 399 O GLU A 27 -2.661 4.636 -8.331 1.00 0.00 O ATOM 400 CB GLU A 27 -1.098 5.116 -11.197 1.00 0.00 C ATOM 401 CG GLU A 27 -1.032 6.551 -10.658 1.00 0.00 C ATOM 402 CD GLU A 27 -0.657 7.576 -11.749 1.00 0.00 C ATOM 403 OE1 GLU A 27 -1.383 7.681 -12.766 1.00 0.00 O ATOM 404 OE2 GLU A 27 0.347 8.308 -11.582 1.00 0.00 O ATOM 0 H GLU A 27 -0.902 2.691 -11.602 1.00 0.00 H new ATOM 0 HA GLU A 27 -0.395 4.258 -9.359 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -0.212 4.916 -11.800 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.961 5.017 -11.855 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -1.997 6.819 -10.229 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -0.300 6.599 -9.852 1.00 0.00 H new ATOM 411 N LYS A 28 -3.572 3.756 -10.192 1.00 0.00 N ATOM 412 CA LYS A 28 -4.949 3.986 -9.796 1.00 0.00 C ATOM 413 C LYS A 28 -5.317 3.403 -8.416 1.00 0.00 C ATOM 414 O LYS A 28 -6.339 3.751 -7.827 1.00 0.00 O ATOM 415 CB LYS A 28 -5.880 3.538 -10.904 1.00 0.00 C ATOM 416 CG LYS A 28 -6.121 2.042 -10.905 1.00 0.00 C ATOM 417 CD LYS A 28 -7.219 1.687 -11.899 1.00 0.00 C ATOM 418 CE LYS A 28 -7.243 2.302 -13.312 1.00 0.00 C ATOM 419 NZ LYS A 28 -6.151 1.825 -14.197 1.00 0.00 N ATOM 0 H LYS A 28 -3.466 3.225 -11.056 1.00 0.00 H new ATOM 0 HA LYS A 28 -5.073 5.060 -9.654 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.834 4.054 -10.800 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -5.460 3.834 -11.866 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -5.201 1.518 -11.166 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -6.404 1.711 -9.906 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -7.199 0.604 -12.023 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -8.169 1.936 -11.427 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -8.201 2.075 -13.780 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -7.179 3.387 -13.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -6.386 2.043 -15.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -5.263 2.301 -13.939 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -6.038 0.797 -14.086 1.00 0.00 H new ATOM 433 N VAL A 29 -4.450 2.507 -7.937 1.00 0.00 N ATOM 434 CA VAL A 29 -4.538 1.806 -6.639 1.00 0.00 C ATOM 435 C VAL A 29 -3.513 2.356 -5.648 1.00 0.00 C ATOM 436 O VAL A 29 -3.874 2.653 -4.513 1.00 0.00 O ATOM 437 CB VAL A 29 -4.351 0.281 -6.812 1.00 0.00 C ATOM 438 CG1 VAL A 29 -4.459 -0.470 -5.476 1.00 0.00 C ATOM 439 CG2 VAL A 29 -5.408 -0.308 -7.751 1.00 0.00 C ATOM 0 H VAL A 29 -3.623 2.232 -8.466 1.00 0.00 H new ATOM 0 HA VAL A 29 -5.536 1.984 -6.238 1.00 0.00 H new ATOM 0 HB VAL A 29 -3.352 0.153 -7.229 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -4.321 -1.538 -5.647 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -3.690 -0.109 -4.793 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -5.443 -0.296 -5.039 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -5.248 -1.382 -7.851 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -6.401 -0.126 -7.341 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -5.328 0.164 -8.730 1.00 0.00 H new ATOM 449 N PHE A 30 -2.267 2.586 -6.072 1.00 0.00 N ATOM 450 CA PHE A 30 -1.253 3.311 -5.299 1.00 0.00 C ATOM 451 C PHE A 30 -1.734 4.689 -4.837 1.00 0.00 C ATOM 452 O PHE A 30 -1.588 5.031 -3.664 1.00 0.00 O ATOM 453 CB PHE A 30 0.012 3.414 -6.165 1.00 0.00 C ATOM 454 CG PHE A 30 0.797 2.130 -6.366 1.00 0.00 C ATOM 455 CD1 PHE A 30 0.750 1.076 -5.426 1.00 0.00 C ATOM 456 CD2 PHE A 30 1.670 2.040 -7.464 1.00 0.00 C ATOM 457 CE1 PHE A 30 1.549 -0.060 -5.603 1.00 0.00 C ATOM 458 CE2 PHE A 30 2.471 0.901 -7.637 1.00 0.00 C ATOM 459 CZ PHE A 30 2.400 -0.150 -6.709 1.00 0.00 C ATOM 0 H PHE A 30 -1.928 2.268 -6.980 1.00 0.00 H new ATOM 0 HA PHE A 30 -1.041 2.761 -4.382 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -0.274 3.797 -7.145 1.00 0.00 H new ATOM 0 HB3 PHE A 30 0.675 4.153 -5.715 1.00 0.00 H new ATOM 0 HD1 PHE A 30 0.096 1.147 -4.569 1.00 0.00 H new ATOM 0 HD2 PHE A 30 1.724 2.850 -8.176 1.00 0.00 H new ATOM 0 HE1 PHE A 30 1.508 -0.866 -4.886 1.00 0.00 H new ATOM 0 HE2 PHE A 30 3.140 0.833 -8.482 1.00 0.00 H new ATOM 0 HZ PHE A 30 3.006 -1.033 -6.850 1.00 0.00 H new ATOM 469 N LYS A 31 -2.401 5.434 -5.724 1.00 0.00 N ATOM 470 CA LYS A 31 -3.156 6.660 -5.450 1.00 0.00 C ATOM 471 C LYS A 31 -3.960 6.562 -4.160 1.00 0.00 C ATOM 472 O LYS A 31 -3.812 7.416 -3.288 1.00 0.00 O ATOM 473 CB LYS A 31 -4.054 6.960 -6.670 1.00 0.00 C ATOM 474 CG LYS A 31 -3.225 7.411 -7.891 1.00 0.00 C ATOM 475 CD LYS A 31 -3.176 8.940 -8.085 1.00 0.00 C ATOM 476 CE LYS A 31 -2.818 9.694 -6.796 1.00 0.00 C ATOM 477 NZ LYS A 31 -2.782 11.168 -6.975 1.00 0.00 N ATOM 0 H LYS A 31 -2.430 5.182 -6.712 1.00 0.00 H new ATOM 0 HA LYS A 31 -2.461 7.486 -5.298 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -4.627 6.069 -6.928 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -4.773 7.737 -6.411 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -2.207 7.036 -7.785 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -3.641 6.954 -8.789 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -2.444 9.180 -8.856 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -4.144 9.287 -8.446 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -3.545 9.445 -6.023 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -1.846 9.353 -6.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -2.892 11.633 -6.051 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -1.872 11.444 -7.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -3.557 11.460 -7.604 1.00 0.00 H new ATOM 491 N GLN A 32 -4.726 5.486 -3.983 1.00 0.00 N ATOM 492 CA GLN A 32 -5.608 5.329 -2.829 1.00 0.00 C ATOM 493 C GLN A 32 -5.032 4.546 -1.654 1.00 0.00 C ATOM 494 O GLN A 32 -5.443 4.799 -0.523 1.00 0.00 O ATOM 495 CB GLN A 32 -6.962 4.778 -3.255 1.00 0.00 C ATOM 496 CG GLN A 32 -8.060 5.664 -2.637 1.00 0.00 C ATOM 497 CD GLN A 32 -8.144 7.084 -3.209 1.00 0.00 C ATOM 498 OE1 GLN A 32 -7.689 7.393 -4.301 1.00 0.00 O ATOM 499 NE2 GLN A 32 -8.704 8.018 -2.469 1.00 0.00 N ATOM 0 H GLN A 32 -4.752 4.701 -4.634 1.00 0.00 H new ATOM 0 HA GLN A 32 -5.729 6.338 -2.436 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -7.045 4.773 -4.342 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -7.074 3.746 -2.922 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -9.023 5.174 -2.778 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -7.890 5.731 -1.562 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -9.090 7.781 -1.555 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -8.752 8.978 -2.810 1.00 0.00 H new ATOM 508 N TYR A 33 -4.013 3.714 -1.868 1.00 0.00 N ATOM 509 CA TYR A 33 -3.166 3.264 -0.766 1.00 0.00 C ATOM 510 C TYR A 33 -2.539 4.471 -0.057 1.00 0.00 C ATOM 511 O TYR A 33 -2.457 4.514 1.170 1.00 0.00 O ATOM 512 CB TYR A 33 -2.077 2.324 -1.293 1.00 0.00 C ATOM 513 CG TYR A 33 -1.230 1.740 -0.176 1.00 0.00 C ATOM 514 CD1 TYR A 33 -1.632 0.550 0.462 1.00 0.00 C ATOM 515 CD2 TYR A 33 -0.080 2.422 0.270 1.00 0.00 C ATOM 516 CE1 TYR A 33 -0.892 0.043 1.549 1.00 0.00 C ATOM 517 CE2 TYR A 33 0.662 1.919 1.355 1.00 0.00 C ATOM 518 CZ TYR A 33 0.254 0.733 2.002 1.00 0.00 C ATOM 519 OH TYR A 33 0.975 0.259 3.057 1.00 0.00 O ATOM 0 H TYR A 33 -3.757 3.342 -2.783 1.00 0.00 H new ATOM 0 HA TYR A 33 -3.777 2.719 -0.046 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -2.541 1.514 -1.856 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -1.435 2.868 -1.986 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -2.510 0.025 0.117 1.00 0.00 H new ATOM 0 HD2 TYR A 33 0.232 3.332 -0.221 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -1.201 -0.871 2.034 1.00 0.00 H new ATOM 0 HE2 TYR A 33 1.545 2.441 1.693 1.00 0.00 H new ATOM 0 HH TYR A 33 1.731 0.858 3.232 1.00 0.00 H new ATOM 529 N ALA A 34 -2.158 5.500 -0.819 1.00 0.00 N ATOM 530 CA ALA A 34 -1.553 6.694 -0.260 1.00 0.00 C ATOM 531 C ALA A 34 -2.632 7.624 0.299 1.00 0.00 C ATOM 532 O ALA A 34 -2.454 8.172 1.382 1.00 0.00 O ATOM 533 CB ALA A 34 -0.731 7.387 -1.340 1.00 0.00 C ATOM 0 H ALA A 34 -2.263 5.521 -1.833 1.00 0.00 H new ATOM 0 HA ALA A 34 -0.894 6.423 0.565 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -0.273 8.286 -0.928 1.00 0.00 H new ATOM 0 HB2 ALA A 34 0.048 6.712 -1.694 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -1.380 7.660 -2.172 1.00 0.00 H new ATOM 539 N ASN A 35 -3.785 7.763 -0.369 1.00 0.00 N ATOM 540 CA ASN A 35 -4.810 8.684 0.112 1.00 0.00 C ATOM 541 C ASN A 35 -5.509 8.143 1.383 1.00 0.00 C ATOM 542 O ASN A 35 -5.965 8.931 2.209 1.00 0.00 O ATOM 543 CB ASN A 35 -5.757 9.050 -1.040 1.00 0.00 C ATOM 544 CG ASN A 35 -5.287 10.264 -1.843 1.00 0.00 C ATOM 545 OD1 ASN A 35 -5.805 11.361 -1.691 1.00 0.00 O ATOM 546 ND2 ASN A 35 -4.318 10.124 -2.721 1.00 0.00 N ATOM 0 H ASN A 35 -4.024 7.260 -1.224 1.00 0.00 H new ATOM 0 HA ASN A 35 -4.350 9.617 0.437 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -5.853 8.195 -1.709 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -6.749 9.251 -0.636 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -4.005 10.926 -3.268 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -3.879 9.213 -2.855 1.00 0.00 H new ATOM 553 N ASP A 36 -5.490 6.822 1.613 1.00 0.00 N ATOM 554 CA ASP A 36 -5.819 6.185 2.901 1.00 0.00 C ATOM 555 C ASP A 36 -4.786 6.478 4.011 1.00 0.00 C ATOM 556 O ASP A 36 -5.161 6.690 5.167 1.00 0.00 O ATOM 557 CB ASP A 36 -5.952 4.671 2.691 1.00 0.00 C ATOM 558 CG ASP A 36 -6.392 3.949 3.977 1.00 0.00 C ATOM 559 OD1 ASP A 36 -7.589 4.035 4.338 1.00 0.00 O ATOM 560 OD2 ASP A 36 -5.546 3.282 4.621 1.00 0.00 O ATOM 0 H ASP A 36 -5.239 6.147 0.890 1.00 0.00 H new ATOM 0 HA ASP A 36 -6.762 6.612 3.243 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -6.676 4.477 1.900 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -4.997 4.266 2.356 1.00 0.00 H new ATOM 565 N ASN A 37 -3.490 6.557 3.669 1.00 0.00 N ATOM 566 CA ASN A 37 -2.440 7.087 4.555 1.00 0.00 C ATOM 567 C ASN A 37 -2.563 8.618 4.782 1.00 0.00 C ATOM 568 O ASN A 37 -1.954 9.151 5.709 1.00 0.00 O ATOM 569 CB ASN A 37 -1.047 6.705 4.006 1.00 0.00 C ATOM 570 CG ASN A 37 -0.632 5.278 4.332 1.00 0.00 C ATOM 571 OD1 ASN A 37 -0.066 4.996 5.378 1.00 0.00 O ATOM 572 ND2 ASN A 37 -0.855 4.336 3.449 1.00 0.00 N ATOM 0 H ASN A 37 -3.138 6.252 2.762 1.00 0.00 H new ATOM 0 HA ASN A 37 -2.572 6.629 5.535 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -1.044 6.837 2.924 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -0.305 7.392 4.413 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -0.557 3.379 3.638 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -1.327 4.560 2.573 1.00 0.00 H new ATOM 579 N GLY A 38 -3.334 9.339 3.961 1.00 0.00 N ATOM 580 CA GLY A 38 -3.573 10.787 4.061 1.00 0.00 C ATOM 581 C GLY A 38 -2.785 11.594 3.022 1.00 0.00 C ATOM 582 O GLY A 38 -2.637 12.809 3.159 1.00 0.00 O ATOM 0 H GLY A 38 -3.829 8.915 3.177 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -4.638 10.984 3.936 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -3.301 11.127 5.060 1.00 0.00 H new ATOM 586 N VAL A 39 -2.245 10.913 2.007 1.00 0.00 N ATOM 587 CA VAL A 39 -1.163 11.391 1.147 1.00 0.00 C ATOM 588 C VAL A 39 -1.628 11.636 -0.280 1.00 0.00 C ATOM 589 O VAL A 39 -2.029 10.713 -0.984 1.00 0.00 O ATOM 590 CB VAL A 39 0.001 10.384 1.108 1.00 0.00 C ATOM 591 CG1 VAL A 39 1.139 10.873 0.209 1.00 0.00 C ATOM 592 CG2 VAL A 39 0.591 10.175 2.489 1.00 0.00 C ATOM 0 H VAL A 39 -2.563 9.978 1.754 1.00 0.00 H new ATOM 0 HA VAL A 39 -0.830 12.334 1.579 1.00 0.00 H new ATOM 0 HB VAL A 39 -0.418 9.455 0.720 1.00 0.00 H new ATOM 0 HG11 VAL A 39 1.943 10.137 0.206 1.00 0.00 H new ATOM 0 HG12 VAL A 39 0.768 11.009 -0.807 1.00 0.00 H new ATOM 0 HG13 VAL A 39 1.518 11.823 0.586 1.00 0.00 H new ATOM 0 HG21 VAL A 39 1.411 9.459 2.430 1.00 0.00 H new ATOM 0 HG22 VAL A 39 0.965 11.124 2.872 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -0.178 9.791 3.159 1.00 0.00 H new ATOM 602 N ASP A 40 -1.401 12.863 -0.740 1.00 0.00 N ATOM 603 CA ASP A 40 -1.208 13.180 -2.163 1.00 0.00 C ATOM 604 C ASP A 40 0.118 13.938 -2.421 1.00 0.00 C ATOM 605 O ASP A 40 0.402 14.383 -3.529 1.00 0.00 O ATOM 606 CB ASP A 40 -2.454 13.867 -2.754 1.00 0.00 C ATOM 607 CG ASP A 40 -2.755 13.375 -4.179 1.00 0.00 C ATOM 608 OD1 ASP A 40 -3.099 12.178 -4.341 1.00 0.00 O ATOM 609 OD2 ASP A 40 -2.652 14.164 -5.146 1.00 0.00 O ATOM 0 H ASP A 40 -1.344 13.680 -0.132 1.00 0.00 H new ATOM 0 HA ASP A 40 -1.099 12.242 -2.707 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -3.314 13.673 -2.113 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -2.302 14.946 -2.766 1.00 0.00 H new ATOM 614 N GLY A 41 0.956 14.000 -1.381 1.00 0.00 N ATOM 615 CA GLY A 41 2.411 14.094 -1.400 1.00 0.00 C ATOM 616 C GLY A 41 3.106 14.906 -2.488 1.00 0.00 C ATOM 617 O GLY A 41 2.770 16.046 -2.802 1.00 0.00 O ATOM 0 H GLY A 41 0.599 13.984 -0.426 1.00 0.00 H new ATOM 0 HA2 GLY A 41 2.722 14.505 -0.440 1.00 0.00 H new ATOM 0 HA3 GLY A 41 2.801 13.078 -1.454 1.00 0.00 H new ATOM 621 N GLU A 42 4.146 14.264 -3.006 1.00 0.00 N ATOM 622 CA GLU A 42 5.052 14.725 -4.057 1.00 0.00 C ATOM 623 C GLU A 42 5.022 13.657 -5.166 1.00 0.00 C ATOM 624 O GLU A 42 6.048 13.100 -5.552 1.00 0.00 O ATOM 625 CB GLU A 42 6.429 14.965 -3.412 1.00 0.00 C ATOM 626 CG GLU A 42 7.484 15.604 -4.324 1.00 0.00 C ATOM 627 CD GLU A 42 8.727 16.012 -3.511 1.00 0.00 C ATOM 628 OE1 GLU A 42 8.727 17.121 -2.921 1.00 0.00 O ATOM 629 OE2 GLU A 42 9.706 15.228 -3.458 1.00 0.00 O ATOM 0 H GLU A 42 4.400 13.332 -2.677 1.00 0.00 H new ATOM 0 HA GLU A 42 4.769 15.670 -4.520 1.00 0.00 H new ATOM 0 HB2 GLU A 42 6.295 15.603 -2.538 1.00 0.00 H new ATOM 0 HB3 GLU A 42 6.814 14.010 -3.054 1.00 0.00 H new ATOM 0 HG2 GLU A 42 7.769 14.901 -5.107 1.00 0.00 H new ATOM 0 HG3 GLU A 42 7.063 16.479 -4.819 1.00 0.00 H new ATOM 636 N TRP A 43 3.799 13.272 -5.568 1.00 0.00 N ATOM 637 CA TRP A 43 3.494 12.171 -6.491 1.00 0.00 C ATOM 638 C TRP A 43 4.432 12.121 -7.704 1.00 0.00 C ATOM 639 O TRP A 43 4.318 12.910 -8.649 1.00 0.00 O ATOM 640 CB TRP A 43 2.007 12.190 -6.897 1.00 0.00 C ATOM 641 CG TRP A 43 1.125 11.326 -6.047 1.00 0.00 C ATOM 642 CD1 TRP A 43 0.133 11.728 -5.224 1.00 0.00 C ATOM 643 CD2 TRP A 43 1.148 9.875 -5.942 1.00 0.00 C ATOM 644 NE1 TRP A 43 -0.389 10.639 -4.547 1.00 0.00 N ATOM 645 CE2 TRP A 43 0.131 9.467 -5.032 1.00 0.00 C ATOM 646 CE3 TRP A 43 1.990 8.869 -6.447 1.00 0.00 C ATOM 647 CZ2 TRP A 43 -0.084 8.129 -4.709 1.00 0.00 C ATOM 648 CZ3 TRP A 43 1.703 7.510 -6.225 1.00 0.00 C ATOM 649 CH2 TRP A 43 0.672 7.142 -5.347 1.00 0.00 C ATOM 0 H TRP A 43 2.956 13.745 -5.241 1.00 0.00 H new ATOM 0 HA TRP A 43 3.679 11.243 -5.950 1.00 0.00 H new ATOM 0 HB2 TRP A 43 1.643 13.216 -6.852 1.00 0.00 H new ATOM 0 HB3 TRP A 43 1.921 11.867 -7.935 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -0.203 12.748 -5.111 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -1.069 10.700 -3.789 1.00 0.00 H new ATOM 0 HE3 TRP A 43 2.868 9.143 -7.013 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -0.827 7.858 -3.974 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 2.277 6.748 -6.731 1.00 0.00 H new ATOM 0 HH2 TRP A 43 0.463 6.098 -5.165 1.00 0.00 H new ATOM 660 N THR A 44 5.355 11.162 -7.654 1.00 0.00 N ATOM 661 CA THR A 44 6.407 10.917 -8.652 1.00 0.00 C ATOM 662 C THR A 44 6.335 9.467 -9.130 1.00 0.00 C ATOM 663 O THR A 44 5.811 8.580 -8.448 1.00 0.00 O ATOM 664 CB THR A 44 7.800 11.226 -8.063 1.00 0.00 C ATOM 665 OG1 THR A 44 7.855 12.555 -7.590 1.00 0.00 O ATOM 666 CG2 THR A 44 8.978 11.096 -9.036 1.00 0.00 C ATOM 0 H THR A 44 5.396 10.499 -6.880 1.00 0.00 H new ATOM 0 HA THR A 44 6.248 11.579 -9.503 1.00 0.00 H new ATOM 0 HB THR A 44 7.909 10.473 -7.282 1.00 0.00 H new ATOM 0 HG1 THR A 44 7.227 12.663 -6.845 1.00 0.00 H new ATOM 0 HG21 THR A 44 9.906 11.335 -8.517 1.00 0.00 H new ATOM 0 HG22 THR A 44 9.027 10.075 -9.414 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.840 11.785 -9.869 1.00 0.00 H new ATOM 674 N TYR A 45 6.878 9.225 -10.316 1.00 0.00 N ATOM 675 CA TYR A 45 6.876 7.937 -11.006 1.00 0.00 C ATOM 676 C TYR A 45 8.139 7.759 -11.860 1.00 0.00 C ATOM 677 O TYR A 45 8.773 8.727 -12.290 1.00 0.00 O ATOM 678 CB TYR A 45 5.578 7.816 -11.826 1.00 0.00 C ATOM 679 CG TYR A 45 5.572 6.703 -12.858 1.00 0.00 C ATOM 680 CD1 TYR A 45 5.307 5.392 -12.435 1.00 0.00 C ATOM 681 CD2 TYR A 45 5.912 6.947 -14.206 1.00 0.00 C ATOM 682 CE1 TYR A 45 5.331 4.323 -13.343 1.00 0.00 C ATOM 683 CE2 TYR A 45 5.965 5.875 -15.121 1.00 0.00 C ATOM 684 CZ TYR A 45 5.645 4.565 -14.696 1.00 0.00 C ATOM 685 OH TYR A 45 5.650 3.541 -15.591 1.00 0.00 O ATOM 0 H TYR A 45 7.354 9.953 -10.849 1.00 0.00 H new ATOM 0 HA TYR A 45 6.898 7.126 -10.278 1.00 0.00 H new ATOM 0 HB2 TYR A 45 4.746 7.659 -11.140 1.00 0.00 H new ATOM 0 HB3 TYR A 45 5.398 8.763 -12.334 1.00 0.00 H new ATOM 0 HD1 TYR A 45 5.081 5.203 -11.396 1.00 0.00 H new ATOM 0 HD2 TYR A 45 6.131 7.952 -14.536 1.00 0.00 H new ATOM 0 HE1 TYR A 45 5.110 3.320 -13.008 1.00 0.00 H new ATOM 0 HE2 TYR A 45 6.250 6.055 -16.147 1.00 0.00 H new ATOM 0 HH TYR A 45 5.415 3.882 -16.479 1.00 0.00 H new ATOM 695 N ASP A 46 8.480 6.499 -12.108 1.00 0.00 N ATOM 696 CA ASP A 46 9.602 6.055 -12.944 1.00 0.00 C ATOM 697 C ASP A 46 9.155 4.928 -13.876 1.00 0.00 C ATOM 698 O ASP A 46 8.605 3.945 -13.409 1.00 0.00 O ATOM 699 CB ASP A 46 10.741 5.512 -12.065 1.00 0.00 C ATOM 700 CG ASP A 46 11.848 4.901 -12.934 1.00 0.00 C ATOM 701 OD1 ASP A 46 12.385 5.614 -13.814 1.00 0.00 O ATOM 702 OD2 ASP A 46 12.132 3.690 -12.782 1.00 0.00 O ATOM 0 H ASP A 46 7.958 5.716 -11.714 1.00 0.00 H new ATOM 0 HA ASP A 46 9.946 6.912 -13.523 1.00 0.00 H new ATOM 0 HB2 ASP A 46 11.152 6.316 -11.455 1.00 0.00 H new ATOM 0 HB3 ASP A 46 10.352 4.759 -11.380 1.00 0.00 H new ATOM 707 N ASP A 47 9.445 5.019 -15.171 1.00 0.00 N ATOM 708 CA ASP A 47 9.000 4.054 -16.197 1.00 0.00 C ATOM 709 C ASP A 47 10.069 3.005 -16.543 1.00 0.00 C ATOM 710 O ASP A 47 9.772 1.938 -17.086 1.00 0.00 O ATOM 711 CB ASP A 47 8.629 4.861 -17.446 1.00 0.00 C ATOM 712 CG ASP A 47 7.411 4.351 -18.242 1.00 0.00 C ATOM 713 OD1 ASP A 47 7.285 3.126 -18.483 1.00 0.00 O ATOM 714 OD2 ASP A 47 6.605 5.198 -18.702 1.00 0.00 O ATOM 0 H ASP A 47 10.008 5.779 -15.554 1.00 0.00 H new ATOM 0 HA ASP A 47 8.150 3.494 -15.808 1.00 0.00 H new ATOM 0 HB2 ASP A 47 8.436 5.891 -17.145 1.00 0.00 H new ATOM 0 HB3 ASP A 47 9.492 4.880 -18.112 1.00 0.00 H new ATOM 719 N ALA A 48 11.325 3.293 -16.198 1.00 0.00 N ATOM 720 CA ALA A 48 12.474 2.431 -16.444 1.00 0.00 C ATOM 721 C ALA A 48 12.469 1.185 -15.537 1.00 0.00 C ATOM 722 O ALA A 48 12.941 0.118 -15.933 1.00 0.00 O ATOM 723 CB ALA A 48 13.719 3.292 -16.234 1.00 0.00 C ATOM 0 H ALA A 48 11.575 4.161 -15.725 1.00 0.00 H new ATOM 0 HA ALA A 48 12.448 2.038 -17.460 1.00 0.00 H new ATOM 0 HB1 ALA A 48 14.611 2.690 -16.407 1.00 0.00 H new ATOM 0 HB2 ALA A 48 13.705 4.129 -16.932 1.00 0.00 H new ATOM 0 HB3 ALA A 48 13.730 3.672 -15.212 1.00 0.00 H new ATOM 729 N THR A 49 11.851 1.309 -14.355 1.00 0.00 N ATOM 730 CA THR A 49 11.527 0.207 -13.441 1.00 0.00 C ATOM 731 C THR A 49 10.030 0.115 -13.113 1.00 0.00 C ATOM 732 O THR A 49 9.634 -0.813 -12.407 1.00 0.00 O ATOM 733 CB THR A 49 12.326 0.298 -12.127 1.00 0.00 C ATOM 734 OG1 THR A 49 11.882 1.391 -11.351 1.00 0.00 O ATOM 735 CG2 THR A 49 13.836 0.449 -12.317 1.00 0.00 C ATOM 0 H THR A 49 11.552 2.215 -13.996 1.00 0.00 H new ATOM 0 HA THR A 49 11.812 -0.698 -13.977 1.00 0.00 H new ATOM 0 HB THR A 49 12.146 -0.654 -11.627 1.00 0.00 H new ATOM 0 HG1 THR A 49 11.989 2.220 -11.862 1.00 0.00 H new ATOM 0 HG21 THR A 49 14.321 0.506 -11.343 1.00 0.00 H new ATOM 0 HG22 THR A 49 14.222 -0.411 -12.865 1.00 0.00 H new ATOM 0 HG23 THR A 49 14.043 1.360 -12.879 1.00 0.00 H new ATOM 743 N LYS A 50 9.193 1.044 -13.620 1.00 0.00 N ATOM 744 CA LYS A 50 7.742 1.155 -13.332 1.00 0.00 C ATOM 745 C LYS A 50 7.403 1.372 -11.835 1.00 0.00 C ATOM 746 O LYS A 50 6.275 1.146 -11.393 1.00 0.00 O ATOM 747 CB LYS A 50 6.934 0.114 -14.135 1.00 0.00 C ATOM 748 CG LYS A 50 7.348 0.179 -15.621 1.00 0.00 C ATOM 749 CD LYS A 50 6.377 -0.486 -16.604 1.00 0.00 C ATOM 750 CE LYS A 50 7.036 -0.749 -17.970 1.00 0.00 C ATOM 751 NZ LYS A 50 7.779 0.425 -18.510 1.00 0.00 N ATOM 0 H LYS A 50 9.518 1.765 -14.265 1.00 0.00 H new ATOM 0 HA LYS A 50 7.375 2.104 -13.723 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.113 -0.886 -13.739 1.00 0.00 H new ATOM 0 HB3 LYS A 50 5.866 0.310 -14.035 1.00 0.00 H new ATOM 0 HG2 LYS A 50 7.464 1.226 -15.903 1.00 0.00 H new ATOM 0 HG3 LYS A 50 8.326 -0.290 -15.729 1.00 0.00 H new ATOM 0 HD2 LYS A 50 6.023 -1.428 -16.184 1.00 0.00 H new ATOM 0 HD3 LYS A 50 5.503 0.151 -16.739 1.00 0.00 H new ATOM 0 HE2 LYS A 50 7.722 -1.591 -17.877 1.00 0.00 H new ATOM 0 HE3 LYS A 50 6.267 -1.042 -18.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 8.051 0.240 -19.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 7.171 1.268 -18.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 8.633 0.587 -17.940 1.00 0.00 H new ATOM 765 N THR A 51 8.382 1.866 -11.063 1.00 0.00 N ATOM 766 CA THR A 51 8.277 2.359 -9.672 1.00 0.00 C ATOM 767 C THR A 51 7.579 3.730 -9.560 1.00 0.00 C ATOM 768 O THR A 51 7.520 4.508 -10.500 1.00 0.00 O ATOM 769 CB THR A 51 9.698 2.443 -9.069 1.00 0.00 C ATOM 770 OG1 THR A 51 10.232 1.141 -8.966 1.00 0.00 O ATOM 771 CG2 THR A 51 9.816 3.056 -7.669 1.00 0.00 C ATOM 0 H THR A 51 9.337 1.939 -11.414 1.00 0.00 H new ATOM 0 HA THR A 51 7.655 1.654 -9.120 1.00 0.00 H new ATOM 0 HB THR A 51 10.230 3.105 -9.753 1.00 0.00 H new ATOM 0 HG1 THR A 51 10.865 0.988 -9.698 1.00 0.00 H new ATOM 0 HG21 THR A 51 10.861 3.058 -7.359 1.00 0.00 H new ATOM 0 HG22 THR A 51 9.441 4.079 -7.687 1.00 0.00 H new ATOM 0 HG23 THR A 51 9.230 2.467 -6.963 1.00 0.00 H new ATOM 779 N PHE A 52 7.083 4.051 -8.369 1.00 0.00 N ATOM 780 CA PHE A 52 6.415 5.267 -7.907 1.00 0.00 C ATOM 781 C PHE A 52 6.976 5.712 -6.558 1.00 0.00 C ATOM 782 O PHE A 52 7.488 4.908 -5.774 1.00 0.00 O ATOM 783 CB PHE A 52 4.925 4.981 -7.693 1.00 0.00 C ATOM 784 CG PHE A 52 4.135 4.678 -8.941 1.00 0.00 C ATOM 785 CD1 PHE A 52 4.236 3.412 -9.537 1.00 0.00 C ATOM 786 CD2 PHE A 52 3.303 5.651 -9.513 1.00 0.00 C ATOM 787 CE1 PHE A 52 3.394 3.054 -10.596 1.00 0.00 C ATOM 788 CE2 PHE A 52 2.478 5.312 -10.601 1.00 0.00 C ATOM 789 CZ PHE A 52 2.480 3.999 -11.109 1.00 0.00 C ATOM 0 H PHE A 52 7.148 3.378 -7.606 1.00 0.00 H new ATOM 0 HA PHE A 52 6.573 6.040 -8.659 1.00 0.00 H new ATOM 0 HB2 PHE A 52 4.830 4.137 -7.010 1.00 0.00 H new ATOM 0 HB3 PHE A 52 4.475 5.843 -7.200 1.00 0.00 H new ATOM 0 HD1 PHE A 52 4.970 2.707 -9.175 1.00 0.00 H new ATOM 0 HD2 PHE A 52 3.296 6.657 -9.120 1.00 0.00 H new ATOM 0 HE1 PHE A 52 3.443 2.061 -11.018 1.00 0.00 H new ATOM 0 HE2 PHE A 52 1.841 6.061 -11.048 1.00 0.00 H new ATOM 0 HZ PHE A 52 1.786 3.717 -11.887 1.00 0.00 H new ATOM 799 N THR A 53 6.804 6.993 -6.237 1.00 0.00 N ATOM 800 CA THR A 53 7.141 7.543 -4.919 1.00 0.00 C ATOM 801 C THR A 53 6.184 8.667 -4.535 1.00 0.00 C ATOM 802 O THR A 53 5.965 9.594 -5.317 1.00 0.00 O ATOM 803 CB THR A 53 8.588 8.074 -4.904 1.00 0.00 C ATOM 804 OG1 THR A 53 9.515 7.054 -5.212 1.00 0.00 O ATOM 805 CG2 THR A 53 9.010 8.644 -3.548 1.00 0.00 C ATOM 0 H THR A 53 6.425 7.684 -6.885 1.00 0.00 H new ATOM 0 HA THR A 53 7.048 6.736 -4.192 1.00 0.00 H new ATOM 0 HB THR A 53 8.596 8.865 -5.654 1.00 0.00 H new ATOM 0 HG1 THR A 53 10.423 7.422 -5.196 1.00 0.00 H new ATOM 0 HG21 THR A 53 10.039 9.000 -3.607 1.00 0.00 H new ATOM 0 HG22 THR A 53 8.354 9.473 -3.282 1.00 0.00 H new ATOM 0 HG23 THR A 53 8.939 7.866 -2.788 1.00 0.00 H new ATOM 813 N VAL A 54 5.686 8.632 -3.297 1.00 0.00 N ATOM 814 CA VAL A 54 5.129 9.828 -2.621 1.00 0.00 C ATOM 815 C VAL A 54 6.009 10.347 -1.480 1.00 0.00 C ATOM 816 O VAL A 54 5.929 9.892 -0.339 1.00 0.00 O ATOM 817 CB VAL A 54 3.668 9.691 -2.162 1.00 0.00 C ATOM 818 CG1 VAL A 54 2.690 9.882 -3.285 1.00 0.00 C ATOM 819 CG2 VAL A 54 3.285 8.465 -1.328 1.00 0.00 C ATOM 0 H VAL A 54 5.653 7.785 -2.730 1.00 0.00 H new ATOM 0 HA VAL A 54 5.129 10.578 -3.412 1.00 0.00 H new ATOM 0 HB VAL A 54 3.599 10.516 -1.453 1.00 0.00 H new ATOM 0 HG11 VAL A 54 1.674 9.775 -2.905 1.00 0.00 H new ATOM 0 HG12 VAL A 54 2.815 10.878 -3.711 1.00 0.00 H new ATOM 0 HG13 VAL A 54 2.870 9.133 -4.056 1.00 0.00 H new ATOM 0 HG21 VAL A 54 2.224 8.510 -1.081 1.00 0.00 H new ATOM 0 HG22 VAL A 54 3.487 7.559 -1.899 1.00 0.00 H new ATOM 0 HG23 VAL A 54 3.871 8.453 -0.409 1.00 0.00 H new ATOM 829 N THR A 55 6.832 11.355 -1.782 1.00 0.00 N ATOM 830 CA THR A 55 7.672 12.089 -0.812 1.00 0.00 C ATOM 831 C THR A 55 6.913 13.223 -0.115 1.00 0.00 C ATOM 832 O THR A 55 7.217 14.409 -0.229 1.00 0.00 O ATOM 833 CB THR A 55 9.021 12.539 -1.422 1.00 0.00 C ATOM 834 OG1 THR A 55 8.990 12.622 -2.830 1.00 0.00 O ATOM 835 CG2 THR A 55 10.082 11.508 -1.062 1.00 0.00 C ATOM 0 H THR A 55 6.941 11.699 -2.736 1.00 0.00 H new ATOM 0 HA THR A 55 7.926 11.381 -0.023 1.00 0.00 H new ATOM 0 HB THR A 55 9.236 13.530 -1.022 1.00 0.00 H new ATOM 0 HG1 THR A 55 9.281 13.514 -3.112 1.00 0.00 H new ATOM 0 HG21 THR A 55 11.040 11.810 -1.484 1.00 0.00 H new ATOM 0 HG22 THR A 55 10.169 11.439 0.022 1.00 0.00 H new ATOM 0 HG23 THR A 55 9.797 10.536 -1.466 1.00 0.00 H new ATOM 843 N GLU A 56 5.871 12.846 0.622 1.00 0.00 N ATOM 844 CA GLU A 56 4.966 13.783 1.313 1.00 0.00 C ATOM 845 C GLU A 56 5.628 14.517 2.494 1.00 0.00 C ATOM 846 O GLU A 56 5.208 15.618 2.854 1.00 0.00 O ATOM 847 CB GLU A 56 3.673 13.032 1.675 1.00 0.00 C ATOM 848 CG GLU A 56 2.536 13.882 2.275 1.00 0.00 C ATOM 849 CD GLU A 56 2.500 13.849 3.812 1.00 0.00 C ATOM 850 OE1 GLU A 56 2.570 12.744 4.397 1.00 0.00 O ATOM 851 OE2 GLU A 56 2.402 14.930 4.433 1.00 0.00 O ATOM 0 H GLU A 56 5.621 11.867 0.763 1.00 0.00 H new ATOM 0 HA GLU A 56 4.709 14.600 0.639 1.00 0.00 H new ATOM 0 HB2 GLU A 56 3.297 12.544 0.776 1.00 0.00 H new ATOM 0 HB3 GLU A 56 3.922 12.244 2.385 1.00 0.00 H new ATOM 0 HG2 GLU A 56 2.649 14.914 1.943 1.00 0.00 H new ATOM 0 HG3 GLU A 56 1.582 13.525 1.888 1.00 0.00 H new ATOM 858 N GLY A 57 6.726 13.981 3.038 1.00 0.00 N ATOM 859 CA GLY A 57 7.627 14.691 3.954 1.00 0.00 C ATOM 860 C GLY A 57 8.280 15.941 3.338 1.00 0.00 C ATOM 861 O GLY A 57 8.464 16.942 4.030 1.00 0.00 O ATOM 0 H GLY A 57 7.020 13.022 2.850 1.00 0.00 H new ATOM 0 HA2 GLY A 57 7.069 14.985 4.843 1.00 0.00 H new ATOM 0 HA3 GLY A 57 8.410 14.007 4.281 1.00 0.00 H new ATOM 865 N SER A 58 8.588 15.905 2.035 1.00 0.00 N ATOM 866 CA SER A 58 9.164 17.033 1.278 1.00 0.00 C ATOM 867 C SER A 58 8.109 18.065 0.849 1.00 0.00 C ATOM 868 O SER A 58 8.356 19.270 0.948 1.00 0.00 O ATOM 869 CB SER A 58 9.913 16.482 0.057 1.00 0.00 C ATOM 870 OG SER A 58 10.440 17.512 -0.758 1.00 0.00 O ATOM 0 H SER A 58 8.442 15.074 1.462 1.00 0.00 H new ATOM 0 HA SER A 58 9.853 17.562 1.936 1.00 0.00 H new ATOM 0 HB2 SER A 58 10.724 15.836 0.392 1.00 0.00 H new ATOM 0 HB3 SER A 58 9.236 15.864 -0.534 1.00 0.00 H new ATOM 0 HG SER A 58 9.951 17.540 -1.607 1.00 0.00 H new ATOM 876 N HIS A 59 6.906 17.626 0.447 1.00 0.00 N ATOM 877 CA HIS A 59 5.771 18.504 0.106 1.00 0.00 C ATOM 878 C HIS A 59 5.061 19.095 1.347 1.00 0.00 C ATOM 879 O HIS A 59 3.884 18.869 1.623 1.00 0.00 O ATOM 880 CB HIS A 59 4.845 17.844 -0.935 1.00 0.00 C ATOM 881 CG HIS A 59 5.063 18.403 -2.322 1.00 0.00 C ATOM 882 ND1 HIS A 59 6.260 18.496 -3.001 1.00 0.00 N ATOM 883 CD2 HIS A 59 4.112 18.993 -3.117 1.00 0.00 C ATOM 884 CE1 HIS A 59 6.036 19.118 -4.171 1.00 0.00 C ATOM 885 NE2 HIS A 59 4.736 19.441 -4.290 1.00 0.00 N ATOM 0 H HIS A 59 6.689 16.634 0.347 1.00 0.00 H new ATOM 0 HA HIS A 59 6.171 19.389 -0.388 1.00 0.00 H new ATOM 0 HB2 HIS A 59 5.021 16.768 -0.946 1.00 0.00 H new ATOM 0 HB3 HIS A 59 3.806 17.994 -0.643 1.00 0.00 H new ATOM 0 HD1 HIS A 59 7.162 18.151 -2.671 1.00 0.00 H new ATOM 0 HD2 HIS A 59 3.063 19.095 -2.880 1.00 0.00 H new ATOM 0 HE1 HIS A 59 6.793 19.329 -4.911 1.00 0.00 H new ATOM 893 N HIS A 60 5.823 19.893 2.096 1.00 0.00 N ATOM 894 CA HIS A 60 5.414 20.746 3.219 1.00 0.00 C ATOM 895 C HIS A 60 4.370 21.832 2.874 1.00 0.00 C ATOM 896 O HIS A 60 3.798 22.420 3.793 1.00 0.00 O ATOM 897 CB HIS A 60 6.686 21.424 3.758 1.00 0.00 C ATOM 898 CG HIS A 60 7.300 22.383 2.761 1.00 0.00 C ATOM 899 ND1 HIS A 60 8.137 22.056 1.714 1.00 0.00 N ATOM 900 CD2 HIS A 60 7.016 23.719 2.644 1.00 0.00 C ATOM 901 CE1 HIS A 60 8.351 23.164 0.986 1.00 0.00 C ATOM 902 NE2 HIS A 60 7.676 24.204 1.507 1.00 0.00 N ATOM 0 H HIS A 60 6.825 19.967 1.921 1.00 0.00 H new ATOM 0 HA HIS A 60 4.922 20.103 3.949 1.00 0.00 H new ATOM 0 HB2 HIS A 60 6.446 21.963 4.675 1.00 0.00 H new ATOM 0 HB3 HIS A 60 7.418 20.660 4.020 1.00 0.00 H new ATOM 0 HD1 HIS A 60 8.526 21.132 1.525 1.00 0.00 H new ATOM 0 HD2 HIS A 60 6.393 24.296 3.311 1.00 0.00 H new ATOM 0 HE1 HIS A 60 8.976 23.213 0.107 1.00 0.00 H new ATOM 910 N HIS A 61 4.149 22.132 1.584 1.00 0.00 N ATOM 911 CA HIS A 61 3.198 23.146 1.099 1.00 0.00 C ATOM 912 C HIS A 61 1.830 22.992 1.782 1.00 0.00 C ATOM 913 O HIS A 61 1.233 21.915 1.746 1.00 0.00 O ATOM 914 CB HIS A 61 3.054 23.041 -0.427 1.00 0.00 C ATOM 915 CG HIS A 61 4.263 23.444 -1.243 1.00 0.00 C ATOM 916 ND1 HIS A 61 5.484 23.898 -0.784 1.00 0.00 N ATOM 917 CD2 HIS A 61 4.320 23.470 -2.610 1.00 0.00 C ATOM 918 CE1 HIS A 61 6.251 24.188 -1.846 1.00 0.00 C ATOM 919 NE2 HIS A 61 5.585 23.942 -2.990 1.00 0.00 N ATOM 0 H HIS A 61 4.643 21.661 0.826 1.00 0.00 H new ATOM 0 HA HIS A 61 3.587 24.132 1.351 1.00 0.00 H new ATOM 0 HB2 HIS A 61 2.800 22.011 -0.677 1.00 0.00 H new ATOM 0 HB3 HIS A 61 2.211 23.660 -0.735 1.00 0.00 H new ATOM 0 HD1 HIS A 61 5.756 23.996 0.194 1.00 0.00 H new ATOM 0 HD2 HIS A 61 3.527 23.177 -3.282 1.00 0.00 H new ATOM 0 HE1 HIS A 61 7.261 24.566 -1.791 1.00 0.00 H new ATOM 927 N HIS A 62 1.364 24.041 2.467 1.00 0.00 N ATOM 928 CA HIS A 62 0.376 23.902 3.540 1.00 0.00 C ATOM 929 C HIS A 62 -1.020 23.467 3.049 1.00 0.00 C ATOM 930 O HIS A 62 -1.758 24.253 2.448 1.00 0.00 O ATOM 931 CB HIS A 62 0.349 25.190 4.385 1.00 0.00 C ATOM 932 CG HIS A 62 1.696 25.609 4.944 1.00 0.00 C ATOM 933 ND1 HIS A 62 2.786 24.796 5.184 1.00 0.00 N ATOM 934 CD2 HIS A 62 2.067 26.877 5.307 1.00 0.00 C ATOM 935 CE1 HIS A 62 3.783 25.549 5.673 1.00 0.00 C ATOM 936 NE2 HIS A 62 3.393 26.833 5.766 1.00 0.00 N ATOM 0 H HIS A 62 1.658 25.002 2.295 1.00 0.00 H new ATOM 0 HA HIS A 62 0.692 23.077 4.179 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -0.044 26.002 3.773 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -0.346 25.051 5.213 1.00 0.00 H new ATOM 0 HD1 HIS A 62 2.826 23.791 5.017 1.00 0.00 H new ATOM 0 HD2 HIS A 62 1.446 27.759 5.250 1.00 0.00 H new ATOM 0 HE1 HIS A 62 4.758 25.178 5.952 1.00 0.00 H new ATOM 944 N HIS A 63 -1.382 22.205 3.323 1.00 0.00 N ATOM 945 CA HIS A 63 -2.678 21.588 3.003 1.00 0.00 C ATOM 946 C HIS A 63 -3.109 20.545 4.060 1.00 0.00 C ATOM 947 O HIS A 63 -2.417 20.341 5.062 1.00 0.00 O ATOM 948 CB HIS A 63 -2.649 21.005 1.572 1.00 0.00 C ATOM 949 CG HIS A 63 -1.801 19.770 1.361 1.00 0.00 C ATOM 950 ND1 HIS A 63 -0.432 19.729 1.228 1.00 0.00 N ATOM 951 CD2 HIS A 63 -2.255 18.499 1.124 1.00 0.00 C ATOM 952 CE1 HIS A 63 -0.067 18.475 0.919 1.00 0.00 C ATOM 953 NE2 HIS A 63 -1.150 17.679 0.855 1.00 0.00 N ATOM 0 H HIS A 63 -0.751 21.557 3.795 1.00 0.00 H new ATOM 0 HA HIS A 63 -3.442 22.365 3.033 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -3.672 20.770 1.279 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -2.294 21.782 0.895 1.00 0.00 H new ATOM 0 HD1 HIS A 63 0.201 20.521 1.345 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -3.288 18.183 1.141 1.00 0.00 H new ATOM 0 HE1 HIS A 63 0.949 18.152 0.747 1.00 0.00 H new ATOM 961 N HIS A 64 -4.260 19.895 3.847 1.00 0.00 N ATOM 962 CA HIS A 64 -4.965 19.013 4.796 1.00 0.00 C ATOM 963 C HIS A 64 -4.139 17.888 5.453 1.00 0.00 C ATOM 964 O HIS A 64 -4.520 17.407 6.524 1.00 0.00 O ATOM 965 CB HIS A 64 -6.204 18.419 4.101 1.00 0.00 C ATOM 966 CG HIS A 64 -5.896 17.611 2.860 1.00 0.00 C ATOM 967 ND1 HIS A 64 -5.304 16.365 2.811 1.00 0.00 N ATOM 968 CD2 HIS A 64 -6.149 17.985 1.568 1.00 0.00 C ATOM 969 CE1 HIS A 64 -5.194 16.004 1.522 1.00 0.00 C ATOM 970 NE2 HIS A 64 -5.699 16.963 0.723 1.00 0.00 N ATOM 0 H HIS A 64 -4.755 19.972 2.959 1.00 0.00 H new ATOM 0 HA HIS A 64 -5.226 19.660 5.633 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -6.735 17.784 4.811 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -6.880 19.231 3.833 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -6.615 18.908 1.255 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -4.762 15.077 1.176 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -5.745 16.948 -0.296 1.00 0.00 H new ATOM 978 N MET A 65 -3.008 17.478 4.865 1.00 0.00 N ATOM 979 CA MET A 65 -2.062 16.538 5.487 1.00 0.00 C ATOM 980 C MET A 65 -1.559 16.989 6.872 1.00 0.00 C ATOM 981 O MET A 65 -1.225 16.138 7.696 1.00 0.00 O ATOM 982 CB MET A 65 -0.895 16.226 4.530 1.00 0.00 C ATOM 983 CG MET A 65 -0.055 17.429 4.072 1.00 0.00 C ATOM 984 SD MET A 65 1.082 18.177 5.269 1.00 0.00 S ATOM 985 CE MET A 65 1.644 19.581 4.273 1.00 0.00 C ATOM 0 H MET A 65 -2.720 17.790 3.938 1.00 0.00 H new ATOM 0 HA MET A 65 -2.618 15.618 5.670 1.00 0.00 H new ATOM 0 HB2 MET A 65 -0.233 15.511 5.018 1.00 0.00 H new ATOM 0 HB3 MET A 65 -1.299 15.733 3.646 1.00 0.00 H new ATOM 0 HG2 MET A 65 0.529 17.118 3.206 1.00 0.00 H new ATOM 0 HG3 MET A 65 -0.741 18.205 3.732 1.00 0.00 H new ATOM 0 HE1 MET A 65 2.595 19.945 4.661 1.00 0.00 H new ATOM 0 HE2 MET A 65 1.771 19.265 3.238 1.00 0.00 H new ATOM 0 HE3 MET A 65 0.904 20.380 4.320 1.00 0.00 H new ATOM 995 N HIS A 66 -1.543 18.297 7.159 1.00 0.00 N ATOM 996 CA HIS A 66 -0.987 18.851 8.397 1.00 0.00 C ATOM 997 C HIS A 66 -1.637 18.324 9.684 1.00 0.00 C ATOM 998 O HIS A 66 -0.916 17.940 10.604 1.00 0.00 O ATOM 999 CB HIS A 66 -1.067 20.387 8.357 1.00 0.00 C ATOM 1000 CG HIS A 66 0.126 21.016 7.694 1.00 0.00 C ATOM 1001 ND1 HIS A 66 1.425 20.881 8.117 1.00 0.00 N ATOM 1002 CD2 HIS A 66 0.133 21.875 6.633 1.00 0.00 C ATOM 1003 CE1 HIS A 66 2.210 21.629 7.329 1.00 0.00 C ATOM 1004 NE2 HIS A 66 1.464 22.256 6.404 1.00 0.00 N ATOM 0 H HIS A 66 -1.920 19.007 6.531 1.00 0.00 H new ATOM 0 HA HIS A 66 0.049 18.515 8.436 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -1.971 20.685 7.826 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -1.154 20.768 9.374 1.00 0.00 H new ATOM 0 HD1 HIS A 66 1.740 20.308 8.900 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -0.730 22.202 6.072 1.00 0.00 H new ATOM 0 HE1 HIS A 66 3.282 21.715 7.424 1.00 0.00 H new ATOM 1012 N ARG A 67 -2.975 18.288 9.768 1.00 0.00 N ATOM 1013 CA ARG A 67 -3.731 18.115 11.027 1.00 0.00 C ATOM 1014 C ARG A 67 -4.645 16.875 10.982 1.00 0.00 C ATOM 1015 O ARG A 67 -5.819 16.979 10.632 1.00 0.00 O ATOM 1016 CB ARG A 67 -4.509 19.406 11.360 1.00 0.00 C ATOM 1017 CG ARG A 67 -3.662 20.646 11.713 1.00 0.00 C ATOM 1018 CD ARG A 67 -3.056 20.656 13.132 1.00 0.00 C ATOM 1019 NE ARG A 67 -1.856 19.813 13.267 1.00 0.00 N ATOM 1020 CZ ARG A 67 -0.627 20.070 12.858 1.00 0.00 C ATOM 1021 NH1 ARG A 67 -0.254 21.200 12.328 1.00 0.00 N ATOM 1022 NH2 ARG A 67 0.274 19.152 12.960 1.00 0.00 N ATOM 0 H ARG A 67 -3.577 18.380 8.950 1.00 0.00 H new ATOM 0 HA ARG A 67 -3.020 17.935 11.834 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -5.139 19.655 10.506 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -5.175 19.197 12.198 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -2.850 20.728 10.990 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -4.283 21.534 11.596 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -2.802 21.681 13.402 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -3.810 20.317 13.842 1.00 0.00 H new ATOM 0 HE ARG A 67 -1.991 18.917 13.736 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -0.930 21.954 12.207 1.00 0.00 H new ATOM 0 HH12 ARG A 67 0.714 21.330 12.034 1.00 0.00 H new ATOM 0 HH21 ARG A 67 0.033 18.242 13.352 1.00 0.00 H new ATOM 0 HH22 ARG A 67 1.227 19.336 12.648 1.00 0.00 H new ATOM 1036 N ASP A 68 -4.161 15.666 11.279 1.00 0.00 N ATOM 1037 CA ASP A 68 -2.809 15.292 11.729 1.00 0.00 C ATOM 1038 C ASP A 68 -2.318 13.980 11.086 1.00 0.00 C ATOM 1039 O ASP A 68 -3.112 13.113 10.702 1.00 0.00 O ATOM 1040 CB ASP A 68 -2.771 15.181 13.266 1.00 0.00 C ATOM 1041 CG ASP A 68 -2.561 16.551 13.920 1.00 0.00 C ATOM 1042 OD1 ASP A 68 -1.430 17.082 13.851 1.00 0.00 O ATOM 1043 OD2 ASP A 68 -3.532 17.136 14.450 1.00 0.00 O ATOM 0 H ASP A 68 -4.759 14.843 11.205 1.00 0.00 H new ATOM 0 HA ASP A 68 -2.131 16.082 11.405 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -3.703 14.744 13.624 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -1.968 14.507 13.564 1.00 0.00 H new ATOM 1048 N SER A 69 -0.995 13.842 10.985 1.00 0.00 N ATOM 1049 CA SER A 69 -0.291 12.737 10.300 1.00 0.00 C ATOM 1050 C SER A 69 1.097 12.484 10.912 1.00 0.00 C ATOM 1051 O SER A 69 1.436 11.350 11.254 1.00 0.00 O ATOM 1052 CB SER A 69 -0.154 13.081 8.811 1.00 0.00 C ATOM 1053 OG SER A 69 0.513 14.322 8.651 1.00 0.00 O ATOM 0 H SER A 69 -0.351 14.520 11.392 1.00 0.00 H new ATOM 0 HA SER A 69 -0.874 11.824 10.423 1.00 0.00 H new ATOM 0 HB2 SER A 69 0.400 12.294 8.299 1.00 0.00 H new ATOM 0 HB3 SER A 69 -1.140 13.129 8.350 1.00 0.00 H new ATOM 0 HG SER A 69 -0.148 15.034 8.520 1.00 0.00 H new ATOM 1059 N CYS A 70 1.846 13.563 11.162 1.00 0.00 N ATOM 1060 CA CYS A 70 2.902 13.666 12.170 1.00 0.00 C ATOM 1061 C CYS A 70 2.449 14.601 13.299 1.00 0.00 C ATOM 1062 O CYS A 70 1.557 15.429 13.095 1.00 0.00 O ATOM 1063 CB CYS A 70 4.149 14.328 11.588 1.00 0.00 C ATOM 1064 SG CYS A 70 5.294 13.151 10.833 1.00 0.00 S ATOM 0 H CYS A 70 1.725 14.431 10.640 1.00 0.00 H new ATOM 0 HA CYS A 70 3.110 12.654 12.518 1.00 0.00 H new ATOM 0 HB2 CYS A 70 3.847 15.062 10.841 1.00 0.00 H new ATOM 0 HB3 CYS A 70 4.666 14.872 12.378 1.00 0.00 H new ATOM 0 HG CYS A 70 4.641 12.092 10.456 1.00 0.00 H new ATOM 1070 N PRO A 71 3.129 14.537 14.455 1.00 0.00 N ATOM 1071 CA PRO A 71 2.852 15.401 15.588 1.00 0.00 C ATOM 1072 C PRO A 71 3.195 16.887 15.369 1.00 0.00 C ATOM 1073 O PRO A 71 2.292 17.673 15.094 1.00 0.00 O ATOM 1074 CB PRO A 71 3.557 14.751 16.788 1.00 0.00 C ATOM 1075 CG PRO A 71 4.628 13.866 16.146 1.00 0.00 C ATOM 1076 CD PRO A 71 4.012 13.448 14.827 1.00 0.00 C ATOM 0 HA PRO A 71 1.778 15.467 15.762 1.00 0.00 H new ATOM 0 HB2 PRO A 71 3.998 15.499 17.446 1.00 0.00 H new ATOM 0 HB3 PRO A 71 2.863 14.166 17.391 1.00 0.00 H new ATOM 0 HG2 PRO A 71 5.560 14.411 15.997 1.00 0.00 H new ATOM 0 HG3 PRO A 71 4.860 13.003 16.770 1.00 0.00 H new ATOM 0 HD2 PRO A 71 4.778 13.286 14.069 1.00 0.00 H new ATOM 0 HD3 PRO A 71 3.462 12.513 14.929 1.00 0.00 H new ATOM 1084 N LEU A 72 4.461 17.312 15.467 1.00 0.00 N ATOM 1085 CA LEU A 72 4.852 18.739 15.362 1.00 0.00 C ATOM 1086 C LEU A 72 4.930 19.208 13.894 1.00 0.00 C ATOM 1087 O LEU A 72 5.859 19.904 13.495 1.00 0.00 O ATOM 1088 CB LEU A 72 6.164 18.983 16.140 1.00 0.00 C ATOM 1089 CG LEU A 72 6.182 20.326 16.888 1.00 0.00 C ATOM 1090 CD1 LEU A 72 7.461 20.420 17.707 1.00 0.00 C ATOM 1091 CD2 LEU A 72 6.117 21.582 16.017 1.00 0.00 C ATOM 0 H LEU A 72 5.249 16.683 15.621 1.00 0.00 H new ATOM 0 HA LEU A 72 4.075 19.350 15.822 1.00 0.00 H new ATOM 0 HB2 LEU A 72 6.311 18.174 16.855 1.00 0.00 H new ATOM 0 HB3 LEU A 72 7.003 18.950 15.445 1.00 0.00 H new ATOM 0 HG LEU A 72 5.272 20.315 17.487 1.00 0.00 H new ATOM 0 HD11 LEU A 72 7.482 21.370 18.241 1.00 0.00 H new ATOM 0 HD12 LEU A 72 7.495 19.600 18.424 1.00 0.00 H new ATOM 0 HD13 LEU A 72 8.323 20.358 17.043 1.00 0.00 H new ATOM 0 HD21 LEU A 72 6.136 22.467 16.653 1.00 0.00 H new ATOM 0 HD22 LEU A 72 6.973 21.601 15.342 1.00 0.00 H new ATOM 0 HD23 LEU A 72 5.196 21.574 15.435 1.00 0.00 H new ATOM 1103 N ASP A 73 4.068 18.651 13.040 1.00 0.00 N ATOM 1104 CA ASP A 73 4.252 18.492 11.583 1.00 0.00 C ATOM 1105 C ASP A 73 5.479 17.645 11.182 1.00 0.00 C ATOM 1106 O ASP A 73 5.479 17.051 10.104 1.00 0.00 O ATOM 1107 CB ASP A 73 4.174 19.848 10.863 1.00 0.00 C ATOM 1108 CG ASP A 73 2.796 20.468 11.091 1.00 0.00 C ATOM 1109 OD1 ASP A 73 1.806 19.831 10.676 1.00 0.00 O ATOM 1110 OD2 ASP A 73 2.652 21.553 11.699 1.00 0.00 O ATOM 0 H ASP A 73 3.173 18.277 13.356 1.00 0.00 H new ATOM 0 HA ASP A 73 3.411 17.893 11.232 1.00 0.00 H new ATOM 0 HB2 ASP A 73 4.951 20.515 11.236 1.00 0.00 H new ATOM 0 HB3 ASP A 73 4.353 19.716 9.796 1.00 0.00 H new ATOM 1115 N CYS A 74 6.430 17.473 12.107 1.00 0.00 N ATOM 1116 CA CYS A 74 7.361 16.358 12.196 1.00 0.00 C ATOM 1117 C CYS A 74 7.357 15.760 13.625 1.00 0.00 C ATOM 1118 O CYS A 74 6.663 14.770 13.798 1.00 0.00 O ATOM 1119 CB CYS A 74 8.739 16.795 11.688 1.00 0.00 C ATOM 1120 SG CYS A 74 8.753 17.012 9.885 1.00 0.00 S ATOM 0 H CYS A 74 6.573 18.152 12.854 1.00 0.00 H new ATOM 0 HA CYS A 74 7.046 15.542 11.546 1.00 0.00 H new ATOM 0 HB2 CYS A 74 9.024 17.730 12.169 1.00 0.00 H new ATOM 0 HB3 CYS A 74 9.484 16.051 11.971 1.00 0.00 H new ATOM 0 HG CYS A 74 7.531 17.087 9.447 1.00 0.00 H new ATOM 1126 N LYS A 75 8.050 16.317 14.649 1.00 0.00 N ATOM 1127 CA LYS A 75 8.129 15.882 16.085 1.00 0.00 C ATOM 1128 C LYS A 75 9.114 16.825 16.798 1.00 0.00 C ATOM 1129 O LYS A 75 9.133 17.984 16.400 1.00 0.00 O ATOM 1130 CB LYS A 75 8.444 14.381 16.254 1.00 0.00 C ATOM 1131 CG LYS A 75 7.812 13.668 17.465 1.00 0.00 C ATOM 1132 CD LYS A 75 7.564 12.189 17.097 1.00 0.00 C ATOM 1133 CE LYS A 75 6.660 11.470 18.104 1.00 0.00 C ATOM 1134 NZ LYS A 75 6.411 10.065 17.695 1.00 0.00 N ATOM 0 H LYS A 75 8.617 17.150 14.490 1.00 0.00 H new ATOM 0 HA LYS A 75 7.151 15.969 16.558 1.00 0.00 H new ATOM 0 HB2 LYS A 75 8.123 13.863 15.350 1.00 0.00 H new ATOM 0 HB3 LYS A 75 9.526 14.267 16.320 1.00 0.00 H new ATOM 0 HG2 LYS A 75 8.472 13.736 18.330 1.00 0.00 H new ATOM 0 HG3 LYS A 75 6.874 14.151 17.740 1.00 0.00 H new ATOM 0 HD2 LYS A 75 7.111 12.137 16.107 1.00 0.00 H new ATOM 0 HD3 LYS A 75 8.520 11.669 17.038 1.00 0.00 H new ATOM 0 HE2 LYS A 75 7.124 11.488 19.090 1.00 0.00 H new ATOM 0 HE3 LYS A 75 5.711 12.000 18.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 5.756 9.619 18.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 5.993 10.049 16.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 7.309 9.541 17.688 1.00 0.00 H new ATOM 1148 N VAL A 76 9.964 16.422 17.754 1.00 0.00 N ATOM 1149 CA VAL A 76 10.830 17.408 18.453 1.00 0.00 C ATOM 1150 C VAL A 76 12.295 16.989 18.706 1.00 0.00 C ATOM 1151 O VAL A 76 12.606 15.819 18.918 1.00 0.00 O ATOM 1152 CB VAL A 76 10.084 17.863 19.718 1.00 0.00 C ATOM 1153 CG1 VAL A 76 9.754 16.709 20.668 1.00 0.00 C ATOM 1154 CG2 VAL A 76 10.794 19.010 20.418 1.00 0.00 C ATOM 0 H VAL A 76 10.076 15.455 18.060 1.00 0.00 H new ATOM 0 HA VAL A 76 10.987 18.247 17.775 1.00 0.00 H new ATOM 0 HB VAL A 76 9.122 18.248 19.381 1.00 0.00 H new ATOM 0 HG11 VAL A 76 9.228 17.095 21.541 1.00 0.00 H new ATOM 0 HG12 VAL A 76 9.122 15.985 20.155 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.677 16.224 20.986 1.00 0.00 H new ATOM 0 HG21 VAL A 76 10.231 19.298 21.306 1.00 0.00 H new ATOM 0 HG22 VAL A 76 11.796 18.694 20.710 1.00 0.00 H new ATOM 0 HG23 VAL A 76 10.865 19.861 19.741 1.00 0.00 H new ATOM 1164 N TYR A 77 13.211 17.962 18.674 1.00 0.00 N ATOM 1165 CA TYR A 77 14.676 17.806 18.787 1.00 0.00 C ATOM 1166 C TYR A 77 15.309 18.929 19.639 1.00 0.00 C ATOM 1167 O TYR A 77 14.737 20.017 19.753 1.00 0.00 O ATOM 1168 CB TYR A 77 15.247 17.829 17.358 1.00 0.00 C ATOM 1169 CG TYR A 77 16.760 17.761 17.255 1.00 0.00 C ATOM 1170 CD1 TYR A 77 17.420 16.525 17.390 1.00 0.00 C ATOM 1171 CD2 TYR A 77 17.511 18.934 17.046 1.00 0.00 C ATOM 1172 CE1 TYR A 77 18.826 16.466 17.339 1.00 0.00 C ATOM 1173 CE2 TYR A 77 18.917 18.879 16.982 1.00 0.00 C ATOM 1174 CZ TYR A 77 19.580 17.642 17.135 1.00 0.00 C ATOM 1175 OH TYR A 77 20.939 17.586 17.071 1.00 0.00 O ATOM 0 H TYR A 77 12.940 18.939 18.562 1.00 0.00 H new ATOM 0 HA TYR A 77 14.910 16.867 19.290 1.00 0.00 H new ATOM 0 HB2 TYR A 77 14.825 16.991 16.804 1.00 0.00 H new ATOM 0 HB3 TYR A 77 14.908 18.740 16.865 1.00 0.00 H new ATOM 0 HD1 TYR A 77 16.847 15.621 17.533 1.00 0.00 H new ATOM 0 HD2 TYR A 77 17.006 19.882 16.934 1.00 0.00 H new ATOM 0 HE1 TYR A 77 19.329 15.518 17.456 1.00 0.00 H new ATOM 0 HE2 TYR A 77 19.487 19.781 16.816 1.00 0.00 H new ATOM 0 HH TYR A 77 21.297 18.487 16.925 1.00 0.00 H new ATOM 1185 N VAL A 78 16.497 18.708 20.226 1.00 0.00 N ATOM 1186 CA VAL A 78 17.149 19.694 21.123 1.00 0.00 C ATOM 1187 C VAL A 78 18.662 19.788 20.906 1.00 0.00 C ATOM 1188 O VAL A 78 19.306 18.837 20.465 1.00 0.00 O ATOM 1189 CB VAL A 78 16.906 19.379 22.624 1.00 0.00 C ATOM 1190 CG1 VAL A 78 16.752 20.656 23.450 1.00 0.00 C ATOM 1191 CG2 VAL A 78 15.677 18.508 22.917 1.00 0.00 C ATOM 0 H VAL A 78 17.034 17.850 20.098 1.00 0.00 H new ATOM 0 HA VAL A 78 16.686 20.646 20.863 1.00 0.00 H new ATOM 0 HB VAL A 78 17.796 18.817 22.905 1.00 0.00 H new ATOM 0 HG11 VAL A 78 16.583 20.395 24.495 1.00 0.00 H new ATOM 0 HG12 VAL A 78 17.659 21.255 23.367 1.00 0.00 H new ATOM 0 HG13 VAL A 78 15.903 21.230 23.078 1.00 0.00 H new ATOM 0 HG21 VAL A 78 15.594 18.345 23.992 1.00 0.00 H new ATOM 0 HG22 VAL A 78 14.780 19.011 22.556 1.00 0.00 H new ATOM 0 HG23 VAL A 78 15.782 17.548 22.412 1.00 0.00 H new ATOM 1201 N GLY A 79 19.268 20.905 21.308 1.00 0.00 N ATOM 1202 CA GLY A 79 20.725 21.027 21.354 1.00 0.00 C ATOM 1203 C GLY A 79 21.289 22.265 22.043 1.00 0.00 C ATOM 1204 O GLY A 79 20.593 22.990 22.751 1.00 0.00 O ATOM 0 H GLY A 79 18.769 21.743 21.608 1.00 0.00 H new ATOM 0 HA2 GLY A 79 21.124 20.146 21.857 1.00 0.00 H new ATOM 0 HA3 GLY A 79 21.100 21.007 20.331 1.00 0.00 H new ATOM 1208 N ASN A 80 22.590 22.485 21.845 1.00 0.00 N ATOM 1209 CA ASN A 80 23.383 23.544 22.479 1.00 0.00 C ATOM 1210 C ASN A 80 23.399 23.513 24.028 1.00 0.00 C ATOM 1211 O ASN A 80 23.701 24.523 24.667 1.00 0.00 O ATOM 1212 CB ASN A 80 22.972 24.914 21.889 1.00 0.00 C ATOM 1213 CG ASN A 80 24.186 25.731 21.474 1.00 0.00 C ATOM 1214 OD1 ASN A 80 24.920 25.374 20.560 1.00 0.00 O ATOM 1215 ND2 ASN A 80 24.449 26.841 22.121 1.00 0.00 N ATOM 0 H ASN A 80 23.144 21.907 21.213 1.00 0.00 H new ATOM 0 HA ASN A 80 24.428 23.355 22.234 1.00 0.00 H new ATOM 0 HB2 ASN A 80 22.324 24.760 21.026 1.00 0.00 H new ATOM 0 HB3 ASN A 80 22.393 25.470 22.627 1.00 0.00 H new ATOM 0 HD21 ASN A 80 25.261 27.402 21.862 1.00 0.00 H new ATOM 0 HD22 ASN A 80 23.842 27.143 22.883 1.00 0.00 H new ATOM 1222 N LEU A 81 23.092 22.367 24.653 1.00 0.00 N ATOM 1223 CA LEU A 81 23.089 22.166 26.113 1.00 0.00 C ATOM 1224 C LEU A 81 24.521 21.969 26.667 1.00 0.00 C ATOM 1225 O LEU A 81 24.823 20.998 27.364 1.00 0.00 O ATOM 1226 CB LEU A 81 22.103 21.023 26.470 1.00 0.00 C ATOM 1227 CG LEU A 81 21.318 21.197 27.792 1.00 0.00 C ATOM 1228 CD1 LEU A 81 22.181 21.577 28.999 1.00 0.00 C ATOM 1229 CD2 LEU A 81 20.226 22.258 27.655 1.00 0.00 C ATOM 0 H LEU A 81 22.830 21.525 24.140 1.00 0.00 H new ATOM 0 HA LEU A 81 22.729 23.066 26.611 1.00 0.00 H new ATOM 0 HB2 LEU A 81 21.386 20.920 25.655 1.00 0.00 H new ATOM 0 HB3 LEU A 81 22.663 20.089 26.522 1.00 0.00 H new ATOM 0 HG LEU A 81 20.894 20.210 27.978 1.00 0.00 H new ATOM 0 HD11 LEU A 81 21.549 21.678 29.881 1.00 0.00 H new ATOM 0 HD12 LEU A 81 22.925 20.800 29.173 1.00 0.00 H new ATOM 0 HD13 LEU A 81 22.684 22.524 28.803 1.00 0.00 H new ATOM 0 HD21 LEU A 81 19.693 22.356 28.601 1.00 0.00 H new ATOM 0 HD22 LEU A 81 20.679 23.214 27.393 1.00 0.00 H new ATOM 0 HD23 LEU A 81 19.526 21.961 26.874 1.00 0.00 H new ATOM 1241 N GLY A 82 25.425 22.891 26.316 1.00 0.00 N ATOM 1242 CA GLY A 82 26.871 22.840 26.580 1.00 0.00 C ATOM 1243 C GLY A 82 27.280 22.733 28.057 1.00 0.00 C ATOM 1244 O GLY A 82 28.402 22.320 28.352 1.00 0.00 O ATOM 0 H GLY A 82 25.156 23.737 25.814 1.00 0.00 H new ATOM 0 HA2 GLY A 82 27.289 21.987 26.045 1.00 0.00 H new ATOM 0 HA3 GLY A 82 27.329 23.735 26.160 1.00 0.00 H new ATOM 1248 N ASN A 83 26.381 23.051 28.994 1.00 0.00 N ATOM 1249 CA ASN A 83 26.618 22.886 30.430 1.00 0.00 C ATOM 1250 C ASN A 83 26.666 21.395 30.827 1.00 0.00 C ATOM 1251 O ASN A 83 27.662 20.927 31.385 1.00 0.00 O ATOM 1252 CB ASN A 83 25.512 23.622 31.221 1.00 0.00 C ATOM 1253 CG ASN A 83 25.537 25.143 31.112 1.00 0.00 C ATOM 1254 OD1 ASN A 83 25.986 25.739 30.143 1.00 0.00 O ATOM 1255 ND2 ASN A 83 25.021 25.828 32.103 1.00 0.00 N ATOM 0 H ASN A 83 25.461 23.433 28.774 1.00 0.00 H new ATOM 0 HA ASN A 83 27.589 23.319 30.673 1.00 0.00 H new ATOM 0 HB2 ASN A 83 24.542 23.265 30.875 1.00 0.00 H new ATOM 0 HB3 ASN A 83 25.596 23.348 32.273 1.00 0.00 H new ATOM 0 HD21 ASN A 83 24.997 26.847 32.061 1.00 0.00 H new ATOM 0 HD22 ASN A 83 24.643 25.342 32.917 1.00 0.00 H new ATOM 1262 N ASN A 84 25.613 20.634 30.503 1.00 0.00 N ATOM 1263 CA ASN A 84 25.301 19.361 31.176 1.00 0.00 C ATOM 1264 C ASN A 84 24.995 18.174 30.240 1.00 0.00 C ATOM 1265 O ASN A 84 25.105 17.031 30.685 1.00 0.00 O ATOM 1266 CB ASN A 84 24.037 19.553 32.022 1.00 0.00 C ATOM 1267 CG ASN A 84 23.988 20.688 33.021 1.00 0.00 C ATOM 1268 OD1 ASN A 84 24.964 21.069 33.653 1.00 0.00 O ATOM 1269 ND2 ASN A 84 22.811 21.239 33.202 1.00 0.00 N ATOM 0 H ASN A 84 24.951 20.881 29.767 1.00 0.00 H new ATOM 0 HA ASN A 84 26.200 19.118 31.743 1.00 0.00 H new ATOM 0 HB2 ASN A 84 23.199 19.681 31.337 1.00 0.00 H new ATOM 0 HB3 ASN A 84 23.863 18.626 32.568 1.00 0.00 H new ATOM 0 HD21 ASN A 84 22.700 21.996 33.877 1.00 0.00 H new ATOM 0 HD22 ASN A 84 22.007 20.911 32.668 1.00 0.00 H new ATOM 1276 N GLY A 85 24.583 18.446 28.994 1.00 0.00 N ATOM 1277 CA GLY A 85 24.036 17.524 27.983 1.00 0.00 C ATOM 1278 C GLY A 85 23.715 16.089 28.421 1.00 0.00 C ATOM 1279 O GLY A 85 24.447 15.168 28.059 1.00 0.00 O ATOM 0 H GLY A 85 24.627 19.399 28.634 1.00 0.00 H new ATOM 0 HA2 GLY A 85 23.121 17.966 27.587 1.00 0.00 H new ATOM 0 HA3 GLY A 85 24.747 17.471 27.159 1.00 0.00 H new ATOM 1283 N ASN A 86 22.633 15.882 29.176 1.00 0.00 N ATOM 1284 CA ASN A 86 22.228 14.552 29.660 1.00 0.00 C ATOM 1285 C ASN A 86 20.722 14.271 29.506 1.00 0.00 C ATOM 1286 O ASN A 86 19.902 15.171 29.326 1.00 0.00 O ATOM 1287 CB ASN A 86 22.701 14.368 31.114 1.00 0.00 C ATOM 1288 CG ASN A 86 21.971 15.268 32.092 1.00 0.00 C ATOM 1289 OD1 ASN A 86 20.863 14.990 32.532 1.00 0.00 O ATOM 1290 ND2 ASN A 86 22.578 16.369 32.461 1.00 0.00 N ATOM 0 H ASN A 86 22.009 16.632 29.472 1.00 0.00 H new ATOM 0 HA ASN A 86 22.715 13.812 29.026 1.00 0.00 H new ATOM 0 HB2 ASN A 86 22.557 13.328 31.408 1.00 0.00 H new ATOM 0 HB3 ASN A 86 23.771 14.570 31.171 1.00 0.00 H new ATOM 0 HD21 ASN A 86 22.127 17.003 33.121 1.00 0.00 H new ATOM 0 HD22 ASN A 86 23.501 16.592 32.089 1.00 0.00 H new ATOM 1297 N LYS A 87 20.359 12.986 29.587 1.00 0.00 N ATOM 1298 CA LYS A 87 18.986 12.474 29.455 1.00 0.00 C ATOM 1299 C LYS A 87 18.030 13.033 30.514 1.00 0.00 C ATOM 1300 O LYS A 87 16.914 13.418 30.181 1.00 0.00 O ATOM 1301 CB LYS A 87 19.085 10.938 29.501 1.00 0.00 C ATOM 1302 CG LYS A 87 17.733 10.228 29.383 1.00 0.00 C ATOM 1303 CD LYS A 87 17.905 8.700 29.406 1.00 0.00 C ATOM 1304 CE LYS A 87 16.609 7.994 29.829 1.00 0.00 C ATOM 1305 NZ LYS A 87 16.427 8.003 31.306 1.00 0.00 N ATOM 0 H LYS A 87 21.038 12.244 29.753 1.00 0.00 H new ATOM 0 HA LYS A 87 18.551 12.805 28.512 1.00 0.00 H new ATOM 0 HB2 LYS A 87 19.734 10.601 28.693 1.00 0.00 H new ATOM 0 HB3 LYS A 87 19.560 10.642 30.436 1.00 0.00 H new ATOM 0 HG2 LYS A 87 17.084 10.536 30.203 1.00 0.00 H new ATOM 0 HG3 LYS A 87 17.241 10.528 28.458 1.00 0.00 H new ATOM 0 HD2 LYS A 87 18.204 8.352 28.417 1.00 0.00 H new ATOM 0 HD3 LYS A 87 18.707 8.433 30.094 1.00 0.00 H new ATOM 0 HE2 LYS A 87 15.758 8.484 29.356 1.00 0.00 H new ATOM 0 HE3 LYS A 87 16.624 6.964 29.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 15.453 7.720 31.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 17.094 7.335 31.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 16.606 8.960 31.672 1.00 0.00 H new ATOM 1319 N THR A 88 18.444 13.100 31.779 1.00 0.00 N ATOM 1320 CA THR A 88 17.498 13.270 32.900 1.00 0.00 C ATOM 1321 C THR A 88 17.147 14.725 33.209 1.00 0.00 C ATOM 1322 O THR A 88 16.011 15.011 33.592 1.00 0.00 O ATOM 1323 CB THR A 88 17.991 12.514 34.143 1.00 0.00 C ATOM 1324 OG1 THR A 88 18.218 11.166 33.792 1.00 0.00 O ATOM 1325 CG2 THR A 88 16.979 12.498 35.290 1.00 0.00 C ATOM 0 H THR A 88 19.423 13.040 32.061 1.00 0.00 H new ATOM 0 HA THR A 88 16.557 12.827 32.576 1.00 0.00 H new ATOM 0 HB THR A 88 18.889 13.032 34.480 1.00 0.00 H new ATOM 0 HG1 THR A 88 17.426 10.808 33.340 1.00 0.00 H new ATOM 0 HG21 THR A 88 17.394 11.947 36.134 1.00 0.00 H new ATOM 0 HG22 THR A 88 16.760 13.521 35.597 1.00 0.00 H new ATOM 0 HG23 THR A 88 16.060 12.014 34.958 1.00 0.00 H new ATOM 1333 N GLU A 89 18.040 15.690 32.965 1.00 0.00 N ATOM 1334 CA GLU A 89 17.643 17.112 32.922 1.00 0.00 C ATOM 1335 C GLU A 89 16.535 17.362 31.888 1.00 0.00 C ATOM 1336 O GLU A 89 15.674 18.204 32.115 1.00 0.00 O ATOM 1337 CB GLU A 89 18.853 18.029 32.686 1.00 0.00 C ATOM 1338 CG GLU A 89 19.317 18.043 31.223 1.00 0.00 C ATOM 1339 CD GLU A 89 20.623 18.811 31.010 1.00 0.00 C ATOM 1340 OE1 GLU A 89 20.839 19.835 31.704 1.00 0.00 O ATOM 1341 OE2 GLU A 89 21.420 18.383 30.139 1.00 0.00 O ATOM 0 H GLU A 89 19.032 15.522 32.796 1.00 0.00 H new ATOM 0 HA GLU A 89 17.232 17.361 33.900 1.00 0.00 H new ATOM 0 HB2 GLU A 89 18.598 19.044 32.990 1.00 0.00 H new ATOM 0 HB3 GLU A 89 19.678 17.704 33.320 1.00 0.00 H new ATOM 0 HG2 GLU A 89 19.447 17.016 30.880 1.00 0.00 H new ATOM 0 HG3 GLU A 89 18.537 18.488 30.606 1.00 0.00 H new ATOM 1348 N LEU A 90 16.514 16.587 30.796 1.00 0.00 N ATOM 1349 CA LEU A 90 15.511 16.666 29.736 1.00 0.00 C ATOM 1350 C LEU A 90 14.299 15.756 29.986 1.00 0.00 C ATOM 1351 O LEU A 90 13.212 16.075 29.517 1.00 0.00 O ATOM 1352 CB LEU A 90 16.169 16.352 28.380 1.00 0.00 C ATOM 1353 CG LEU A 90 17.344 17.273 27.994 1.00 0.00 C ATOM 1354 CD1 LEU A 90 17.796 16.939 26.576 1.00 0.00 C ATOM 1355 CD2 LEU A 90 17.011 18.766 28.028 1.00 0.00 C ATOM 0 H LEU A 90 17.217 15.868 30.624 1.00 0.00 H new ATOM 0 HA LEU A 90 15.122 17.684 29.727 1.00 0.00 H new ATOM 0 HB2 LEU A 90 16.525 15.322 28.396 1.00 0.00 H new ATOM 0 HB3 LEU A 90 15.408 16.414 27.602 1.00 0.00 H new ATOM 0 HG LEU A 90 18.119 17.092 28.739 1.00 0.00 H new ATOM 0 HD11 LEU A 90 18.627 17.587 26.297 1.00 0.00 H new ATOM 0 HD12 LEU A 90 18.117 15.898 26.532 1.00 0.00 H new ATOM 0 HD13 LEU A 90 16.968 17.093 25.884 1.00 0.00 H new ATOM 0 HD21 LEU A 90 17.892 19.342 27.744 1.00 0.00 H new ATOM 0 HD22 LEU A 90 16.200 18.974 27.330 1.00 0.00 H new ATOM 0 HD23 LEU A 90 16.703 19.047 29.035 1.00 0.00 H new ATOM 1367 N GLU A 91 14.406 14.698 30.800 1.00 0.00 N ATOM 1368 CA GLU A 91 13.224 13.970 31.284 1.00 0.00 C ATOM 1369 C GLU A 91 12.344 14.917 32.097 1.00 0.00 C ATOM 1370 O GLU A 91 11.119 14.861 32.015 1.00 0.00 O ATOM 1371 CB GLU A 91 13.617 12.763 32.151 1.00 0.00 C ATOM 1372 CG GLU A 91 14.051 11.561 31.317 1.00 0.00 C ATOM 1373 CD GLU A 91 14.611 10.415 32.176 1.00 0.00 C ATOM 1374 OE1 GLU A 91 15.814 10.442 32.535 1.00 0.00 O ATOM 1375 OE2 GLU A 91 13.886 9.422 32.418 1.00 0.00 O ATOM 0 H GLU A 91 15.295 14.328 31.137 1.00 0.00 H new ATOM 0 HA GLU A 91 12.678 13.597 30.417 1.00 0.00 H new ATOM 0 HB2 GLU A 91 14.429 13.049 32.820 1.00 0.00 H new ATOM 0 HB3 GLU A 91 12.772 12.480 32.778 1.00 0.00 H new ATOM 0 HG2 GLU A 91 13.200 11.196 30.742 1.00 0.00 H new ATOM 0 HG3 GLU A 91 14.809 11.876 30.600 1.00 0.00 H new ATOM 1382 N ARG A 92 12.984 15.842 32.820 1.00 0.00 N ATOM 1383 CA ARG A 92 12.326 16.913 33.572 1.00 0.00 C ATOM 1384 C ARG A 92 11.929 18.072 32.653 1.00 0.00 C ATOM 1385 O ARG A 92 10.740 18.270 32.403 1.00 0.00 O ATOM 1386 CB ARG A 92 13.260 17.316 34.728 1.00 0.00 C ATOM 1387 CG ARG A 92 13.548 16.115 35.651 1.00 0.00 C ATOM 1388 CD ARG A 92 14.562 16.440 36.755 1.00 0.00 C ATOM 1389 NE ARG A 92 15.943 16.345 36.241 1.00 0.00 N ATOM 1390 CZ ARG A 92 17.053 16.663 36.888 1.00 0.00 C ATOM 1391 NH1 ARG A 92 17.036 17.177 38.085 1.00 0.00 N ATOM 1392 NH2 ARG A 92 18.223 16.464 36.344 1.00 0.00 N ATOM 0 H ARG A 92 14.001 15.866 32.900 1.00 0.00 H new ATOM 0 HA ARG A 92 11.383 16.573 34.001 1.00 0.00 H new ATOM 0 HB2 ARG A 92 14.196 17.703 34.326 1.00 0.00 H new ATOM 0 HB3 ARG A 92 12.804 18.121 35.304 1.00 0.00 H new ATOM 0 HG2 ARG A 92 12.616 15.782 36.107 1.00 0.00 H new ATOM 0 HG3 ARG A 92 13.924 15.285 35.052 1.00 0.00 H new ATOM 0 HD2 ARG A 92 14.380 17.444 37.139 1.00 0.00 H new ATOM 0 HD3 ARG A 92 14.431 15.751 37.590 1.00 0.00 H new ATOM 0 HE ARG A 92 16.053 15.998 35.288 1.00 0.00 H new ATOM 0 HH11 ARG A 92 16.147 17.347 38.554 1.00 0.00 H new ATOM 0 HH12 ARG A 92 17.912 17.409 38.553 1.00 0.00 H new ATOM 0 HH21 ARG A 92 18.289 16.059 35.410 1.00 0.00 H new ATOM 0 HH22 ARG A 92 19.071 16.713 36.853 1.00 0.00 H new ATOM 1406 N ALA A 93 12.907 18.760 32.059 1.00 0.00 N ATOM 1407 CA ALA A 93 12.721 19.941 31.207 1.00 0.00 C ATOM 1408 C ALA A 93 11.940 19.710 29.897 1.00 0.00 C ATOM 1409 O ALA A 93 11.671 20.684 29.198 1.00 0.00 O ATOM 1410 CB ALA A 93 14.085 20.568 30.904 1.00 0.00 C ATOM 0 H ALA A 93 13.888 18.501 32.161 1.00 0.00 H new ATOM 0 HA ALA A 93 12.089 20.615 31.785 1.00 0.00 H new ATOM 0 HB1 ALA A 93 13.950 21.445 30.271 1.00 0.00 H new ATOM 0 HB2 ALA A 93 14.565 20.864 31.837 1.00 0.00 H new ATOM 0 HB3 ALA A 93 14.713 19.842 30.388 1.00 0.00 H new ATOM 1416 N PHE A 94 11.559 18.470 29.567 1.00 0.00 N ATOM 1417 CA PHE A 94 10.606 18.166 28.491 1.00 0.00 C ATOM 1418 C PHE A 94 9.401 17.342 28.995 1.00 0.00 C ATOM 1419 O PHE A 94 8.287 17.565 28.523 1.00 0.00 O ATOM 1420 CB PHE A 94 11.296 17.540 27.265 1.00 0.00 C ATOM 1421 CG PHE A 94 12.070 18.506 26.381 1.00 0.00 C ATOM 1422 CD1 PHE A 94 13.270 19.095 26.828 1.00 0.00 C ATOM 1423 CD2 PHE A 94 11.578 18.824 25.101 1.00 0.00 C ATOM 1424 CE1 PHE A 94 13.929 20.046 26.026 1.00 0.00 C ATOM 1425 CE2 PHE A 94 12.244 19.761 24.294 1.00 0.00 C ATOM 1426 CZ PHE A 94 13.410 20.385 24.766 1.00 0.00 C ATOM 0 H PHE A 94 11.908 17.639 30.045 1.00 0.00 H new ATOM 0 HA PHE A 94 10.196 19.117 28.151 1.00 0.00 H new ATOM 0 HB2 PHE A 94 11.980 16.765 27.612 1.00 0.00 H new ATOM 0 HB3 PHE A 94 10.538 17.047 26.657 1.00 0.00 H new ATOM 0 HD1 PHE A 94 13.684 18.817 27.786 1.00 0.00 H new ATOM 0 HD2 PHE A 94 10.682 18.344 24.737 1.00 0.00 H new ATOM 0 HE1 PHE A 94 14.835 20.515 26.380 1.00 0.00 H new ATOM 0 HE2 PHE A 94 11.860 20.001 23.313 1.00 0.00 H new ATOM 0 HZ PHE A 94 13.908 21.127 24.159 1.00 0.00 H new ATOM 1436 N GLY A 95 9.549 16.488 30.020 1.00 0.00 N ATOM 1437 CA GLY A 95 8.432 15.825 30.712 1.00 0.00 C ATOM 1438 C GLY A 95 7.334 16.764 31.228 1.00 0.00 C ATOM 1439 O GLY A 95 6.172 16.365 31.307 1.00 0.00 O ATOM 0 H GLY A 95 10.462 16.235 30.397 1.00 0.00 H new ATOM 0 HA2 GLY A 95 7.980 15.104 30.031 1.00 0.00 H new ATOM 0 HA3 GLY A 95 8.831 15.261 31.555 1.00 0.00 H new ATOM 1443 N TYR A 96 7.672 18.020 31.540 1.00 0.00 N ATOM 1444 CA TYR A 96 6.689 19.043 31.920 1.00 0.00 C ATOM 1445 C TYR A 96 5.571 19.246 30.894 1.00 0.00 C ATOM 1446 O TYR A 96 4.417 19.472 31.274 1.00 0.00 O ATOM 1447 CB TYR A 96 7.379 20.395 32.093 1.00 0.00 C ATOM 1448 CG TYR A 96 8.502 20.482 33.106 1.00 0.00 C ATOM 1449 CD1 TYR A 96 8.574 19.605 34.207 1.00 0.00 C ATOM 1450 CD2 TYR A 96 9.502 21.451 32.911 1.00 0.00 C ATOM 1451 CE1 TYR A 96 9.673 19.665 35.084 1.00 0.00 C ATOM 1452 CE2 TYR A 96 10.589 21.538 33.803 1.00 0.00 C ATOM 1453 CZ TYR A 96 10.683 20.632 34.887 1.00 0.00 C ATOM 1454 OH TYR A 96 11.746 20.681 35.738 1.00 0.00 O ATOM 0 H TYR A 96 8.635 18.357 31.536 1.00 0.00 H new ATOM 0 HA TYR A 96 6.245 18.678 32.846 1.00 0.00 H new ATOM 0 HB2 TYR A 96 7.776 20.697 31.124 1.00 0.00 H new ATOM 0 HB3 TYR A 96 6.620 21.127 32.368 1.00 0.00 H new ATOM 0 HD1 TYR A 96 7.786 18.887 34.378 1.00 0.00 H new ATOM 0 HD2 TYR A 96 9.437 22.131 32.074 1.00 0.00 H new ATOM 0 HE1 TYR A 96 9.744 18.971 35.908 1.00 0.00 H new ATOM 0 HE2 TYR A 96 11.348 22.293 33.660 1.00 0.00 H new ATOM 0 HH TYR A 96 12.351 21.401 35.464 1.00 0.00 H new ATOM 1464 N TYR A 97 5.905 19.196 29.601 1.00 0.00 N ATOM 1465 CA TYR A 97 4.960 19.543 28.541 1.00 0.00 C ATOM 1466 C TYR A 97 3.983 18.404 28.223 1.00 0.00 C ATOM 1467 O TYR A 97 2.957 18.644 27.590 1.00 0.00 O ATOM 1468 CB TYR A 97 5.705 19.974 27.269 1.00 0.00 C ATOM 1469 CG TYR A 97 6.605 21.166 27.500 1.00 0.00 C ATOM 1470 CD1 TYR A 97 6.091 22.475 27.427 1.00 0.00 C ATOM 1471 CD2 TYR A 97 7.943 20.962 27.867 1.00 0.00 C ATOM 1472 CE1 TYR A 97 6.906 23.577 27.746 1.00 0.00 C ATOM 1473 CE2 TYR A 97 8.753 22.053 28.211 1.00 0.00 C ATOM 1474 CZ TYR A 97 8.240 23.361 28.172 1.00 0.00 C ATOM 1475 OH TYR A 97 9.063 24.362 28.579 1.00 0.00 O ATOM 0 H TYR A 97 6.827 18.917 29.265 1.00 0.00 H new ATOM 0 HA TYR A 97 4.368 20.380 28.912 1.00 0.00 H new ATOM 0 HB2 TYR A 97 6.301 19.139 26.901 1.00 0.00 H new ATOM 0 HB3 TYR A 97 4.980 20.216 26.492 1.00 0.00 H new ATOM 0 HD1 TYR A 97 5.066 22.634 27.125 1.00 0.00 H new ATOM 0 HD2 TYR A 97 8.350 19.962 27.885 1.00 0.00 H new ATOM 0 HE1 TYR A 97 6.517 24.581 27.667 1.00 0.00 H new ATOM 0 HE2 TYR A 97 9.778 21.887 28.508 1.00 0.00 H new ATOM 0 HH TYR A 97 8.585 25.216 28.537 1.00 0.00 H new ATOM 1485 N GLY A 98 4.293 17.173 28.647 1.00 0.00 N ATOM 1486 CA GLY A 98 3.514 15.968 28.322 1.00 0.00 C ATOM 1487 C GLY A 98 4.305 14.649 28.399 1.00 0.00 C ATOM 1488 O GLY A 98 5.448 14.637 28.866 1.00 0.00 O ATOM 0 H GLY A 98 5.104 16.981 29.235 1.00 0.00 H new ATOM 0 HA2 GLY A 98 2.665 15.907 29.003 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.109 16.074 27.316 1.00 0.00 H new ATOM 1492 N PRO A 99 3.720 13.524 27.936 1.00 0.00 N ATOM 1493 CA PRO A 99 4.355 12.208 27.941 1.00 0.00 C ATOM 1494 C PRO A 99 5.518 12.116 26.948 1.00 0.00 C ATOM 1495 O PRO A 99 5.335 11.959 25.738 1.00 0.00 O ATOM 1496 CB PRO A 99 3.231 11.204 27.645 1.00 0.00 C ATOM 1497 CG PRO A 99 2.248 12.019 26.805 1.00 0.00 C ATOM 1498 CD PRO A 99 2.377 13.426 27.385 1.00 0.00 C ATOM 0 HA PRO A 99 4.819 11.995 28.904 1.00 0.00 H new ATOM 0 HB2 PRO A 99 3.601 10.334 27.102 1.00 0.00 H new ATOM 0 HB3 PRO A 99 2.769 10.835 28.561 1.00 0.00 H new ATOM 0 HG2 PRO A 99 2.506 11.995 25.746 1.00 0.00 H new ATOM 0 HG3 PRO A 99 1.230 11.639 26.894 1.00 0.00 H new ATOM 0 HD2 PRO A 99 2.218 14.180 26.614 1.00 0.00 H new ATOM 0 HD3 PRO A 99 1.627 13.597 28.157 1.00 0.00 H new ATOM 1506 N LEU A 100 6.729 12.209 27.493 1.00 0.00 N ATOM 1507 CA LEU A 100 8.003 12.155 26.782 1.00 0.00 C ATOM 1508 C LEU A 100 8.367 10.721 26.372 1.00 0.00 C ATOM 1509 O LEU A 100 9.284 10.098 26.919 1.00 0.00 O ATOM 1510 CB LEU A 100 9.067 12.833 27.656 1.00 0.00 C ATOM 1511 CG LEU A 100 10.278 13.353 26.878 1.00 0.00 C ATOM 1512 CD1 LEU A 100 9.864 14.511 25.981 1.00 0.00 C ATOM 1513 CD2 LEU A 100 11.343 13.843 27.855 1.00 0.00 C ATOM 0 H LEU A 100 6.854 12.331 28.498 1.00 0.00 H new ATOM 0 HA LEU A 100 7.934 12.699 25.840 1.00 0.00 H new ATOM 0 HB2 LEU A 100 8.607 13.665 28.189 1.00 0.00 H new ATOM 0 HB3 LEU A 100 9.410 12.123 28.408 1.00 0.00 H new ATOM 0 HG LEU A 100 10.677 12.543 26.267 1.00 0.00 H new ATOM 0 HD11 LEU A 100 10.733 14.874 25.432 1.00 0.00 H new ATOM 0 HD12 LEU A 100 9.105 14.172 25.276 1.00 0.00 H new ATOM 0 HD13 LEU A 100 9.458 15.317 26.592 1.00 0.00 H new ATOM 0 HD21 LEU A 100 12.204 14.213 27.299 1.00 0.00 H new ATOM 0 HD22 LEU A 100 10.933 14.647 28.466 1.00 0.00 H new ATOM 0 HD23 LEU A 100 11.653 13.020 28.498 1.00 0.00 H new ATOM 1525 N ARG A 101 7.590 10.177 25.434 1.00 0.00 N ATOM 1526 CA ARG A 101 7.672 8.810 24.898 1.00 0.00 C ATOM 1527 C ARG A 101 9.054 8.434 24.323 1.00 0.00 C ATOM 1528 O ARG A 101 9.298 7.243 24.134 1.00 0.00 O ATOM 1529 CB ARG A 101 6.506 8.612 23.901 1.00 0.00 C ATOM 1530 CG ARG A 101 5.798 7.244 23.995 1.00 0.00 C ATOM 1531 CD ARG A 101 6.425 6.093 23.194 1.00 0.00 C ATOM 1532 NE ARG A 101 6.387 6.364 21.747 1.00 0.00 N ATOM 1533 CZ ARG A 101 7.367 6.755 20.959 1.00 0.00 C ATOM 1534 NH1 ARG A 101 8.606 6.836 21.338 1.00 0.00 N ATOM 1535 NH2 ARG A 101 7.093 7.119 19.744 1.00 0.00 N ATOM 0 H ARG A 101 6.838 10.710 24.998 1.00 0.00 H new ATOM 0 HA ARG A 101 7.563 8.105 25.722 1.00 0.00 H new ATOM 0 HB2 ARG A 101 5.769 9.398 24.065 1.00 0.00 H new ATOM 0 HB3 ARG A 101 6.888 8.739 22.888 1.00 0.00 H new ATOM 0 HG2 ARG A 101 5.761 6.950 25.044 1.00 0.00 H new ATOM 0 HG3 ARG A 101 4.767 7.369 23.663 1.00 0.00 H new ATOM 0 HD2 ARG A 101 7.457 5.946 23.512 1.00 0.00 H new ATOM 0 HD3 ARG A 101 5.892 5.167 23.407 1.00 0.00 H new ATOM 0 HE ARG A 101 5.482 6.231 21.295 1.00 0.00 H new ATOM 0 HH11 ARG A 101 8.864 6.589 22.293 1.00 0.00 H new ATOM 0 HH12 ARG A 101 9.321 7.146 20.680 1.00 0.00 H new ATOM 0 HH21 ARG A 101 6.129 7.100 19.411 1.00 0.00 H new ATOM 0 HH22 ARG A 101 7.842 7.424 19.122 1.00 0.00 H new ATOM 1549 N SER A 102 9.966 9.393 24.115 1.00 0.00 N ATOM 1550 CA SER A 102 11.411 9.111 23.965 1.00 0.00 C ATOM 1551 C SER A 102 12.244 10.284 24.455 1.00 0.00 C ATOM 1552 O SER A 102 11.830 11.434 24.319 1.00 0.00 O ATOM 1553 CB SER A 102 11.849 8.871 22.511 1.00 0.00 C ATOM 1554 OG SER A 102 11.424 7.621 22.017 1.00 0.00 O ATOM 0 H SER A 102 9.731 10.383 24.045 1.00 0.00 H new ATOM 0 HA SER A 102 11.572 8.206 24.551 1.00 0.00 H new ATOM 0 HB2 SER A 102 11.448 9.663 21.879 1.00 0.00 H new ATOM 0 HB3 SER A 102 12.935 8.932 22.448 1.00 0.00 H new ATOM 0 HG SER A 102 11.159 7.713 21.078 1.00 0.00 H new ATOM 1560 N VAL A 103 13.448 9.990 24.951 1.00 0.00 N ATOM 1561 CA VAL A 103 14.449 10.971 25.388 1.00 0.00 C ATOM 1562 C VAL A 103 15.845 10.332 25.401 1.00 0.00 C ATOM 1563 O VAL A 103 16.103 9.364 26.115 1.00 0.00 O ATOM 1564 CB VAL A 103 14.037 11.571 26.747 1.00 0.00 C ATOM 1565 CG1 VAL A 103 13.993 10.570 27.901 1.00 0.00 C ATOM 1566 CG2 VAL A 103 14.891 12.769 27.163 1.00 0.00 C ATOM 0 H VAL A 103 13.766 9.027 25.064 1.00 0.00 H new ATOM 0 HA VAL A 103 14.497 11.800 24.682 1.00 0.00 H new ATOM 0 HB VAL A 103 13.016 11.905 26.560 1.00 0.00 H new ATOM 0 HG11 VAL A 103 13.694 11.082 28.816 1.00 0.00 H new ATOM 0 HG12 VAL A 103 13.273 9.784 27.673 1.00 0.00 H new ATOM 0 HG13 VAL A 103 14.980 10.129 28.038 1.00 0.00 H new ATOM 0 HG21 VAL A 103 14.548 13.143 28.128 1.00 0.00 H new ATOM 0 HG22 VAL A 103 15.934 12.462 27.243 1.00 0.00 H new ATOM 0 HG23 VAL A 103 14.801 13.557 26.416 1.00 0.00 H new ATOM 1576 N TRP A 104 16.736 10.857 24.562 1.00 0.00 N ATOM 1577 CA TRP A 104 18.119 10.402 24.364 1.00 0.00 C ATOM 1578 C TRP A 104 19.004 11.606 24.048 1.00 0.00 C ATOM 1579 O TRP A 104 18.555 12.547 23.400 1.00 0.00 O ATOM 1580 CB TRP A 104 18.181 9.413 23.186 1.00 0.00 C ATOM 1581 CG TRP A 104 18.131 7.963 23.555 1.00 0.00 C ATOM 1582 CD1 TRP A 104 17.015 7.249 23.824 1.00 0.00 C ATOM 1583 CD2 TRP A 104 19.247 7.028 23.694 1.00 0.00 C ATOM 1584 NE1 TRP A 104 17.359 5.947 24.132 1.00 0.00 N ATOM 1585 CE2 TRP A 104 18.723 5.752 24.062 1.00 0.00 C ATOM 1586 CE3 TRP A 104 20.648 7.129 23.544 1.00 0.00 C ATOM 1587 CZ2 TRP A 104 19.545 4.635 24.272 1.00 0.00 C ATOM 1588 CZ3 TRP A 104 21.483 6.010 23.748 1.00 0.00 C ATOM 1589 CH2 TRP A 104 20.934 4.767 24.111 1.00 0.00 C ATOM 0 H TRP A 104 16.504 11.654 23.969 1.00 0.00 H new ATOM 0 HA TRP A 104 18.467 9.908 25.271 1.00 0.00 H new ATOM 0 HB2 TRP A 104 17.352 9.627 22.512 1.00 0.00 H new ATOM 0 HB3 TRP A 104 19.100 9.596 22.629 1.00 0.00 H new ATOM 0 HD1 TRP A 104 16.008 7.637 23.802 1.00 0.00 H new ATOM 0 HE1 TRP A 104 16.688 5.220 24.380 1.00 0.00 H new ATOM 0 HE3 TRP A 104 21.087 8.077 23.269 1.00 0.00 H new ATOM 0 HZ2 TRP A 104 19.115 3.685 24.554 1.00 0.00 H new ATOM 0 HZ3 TRP A 104 22.551 6.109 23.625 1.00 0.00 H new ATOM 0 HH2 TRP A 104 21.580 3.915 24.266 1.00 0.00 H new ATOM 1600 N VAL A 105 20.270 11.593 24.468 1.00 0.00 N ATOM 1601 CA VAL A 105 21.213 12.680 24.148 1.00 0.00 C ATOM 1602 C VAL A 105 22.657 12.195 24.080 1.00 0.00 C ATOM 1603 O VAL A 105 23.038 11.210 24.719 1.00 0.00 O ATOM 1604 CB VAL A 105 21.035 13.934 25.058 1.00 0.00 C ATOM 1605 CG1 VAL A 105 20.029 13.803 26.201 1.00 0.00 C ATOM 1606 CG2 VAL A 105 22.290 14.573 25.647 1.00 0.00 C ATOM 0 H VAL A 105 20.672 10.844 25.031 1.00 0.00 H new ATOM 0 HA VAL A 105 20.956 13.014 23.143 1.00 0.00 H new ATOM 0 HB VAL A 105 20.644 14.596 24.285 1.00 0.00 H new ATOM 0 HG11 VAL A 105 19.993 14.737 26.762 1.00 0.00 H new ATOM 0 HG12 VAL A 105 19.042 13.586 25.794 1.00 0.00 H new ATOM 0 HG13 VAL A 105 20.334 12.993 26.863 1.00 0.00 H new ATOM 0 HG21 VAL A 105 22.009 15.432 26.256 1.00 0.00 H new ATOM 0 HG22 VAL A 105 22.813 13.844 26.267 1.00 0.00 H new ATOM 0 HG23 VAL A 105 22.946 14.899 24.839 1.00 0.00 H new ATOM 1616 N ALA A 106 23.457 12.928 23.309 1.00 0.00 N ATOM 1617 CA ALA A 106 24.898 12.757 23.172 1.00 0.00 C ATOM 1618 C ALA A 106 25.673 13.994 23.665 1.00 0.00 C ATOM 1619 O ALA A 106 25.192 15.129 23.585 1.00 0.00 O ATOM 1620 CB ALA A 106 25.192 12.500 21.687 1.00 0.00 C ATOM 0 H ALA A 106 23.099 13.693 22.737 1.00 0.00 H new ATOM 0 HA ALA A 106 25.225 11.919 23.788 1.00 0.00 H new ATOM 0 HB1 ALA A 106 26.265 12.367 21.546 1.00 0.00 H new ATOM 0 HB2 ALA A 106 24.669 11.600 21.363 1.00 0.00 H new ATOM 0 HB3 ALA A 106 24.851 13.350 21.096 1.00 0.00 H new ATOM 1626 N ARG A 107 26.931 13.771 24.074 1.00 0.00 N ATOM 1627 CA ARG A 107 27.958 14.821 24.257 1.00 0.00 C ATOM 1628 C ARG A 107 29.092 14.699 23.222 1.00 0.00 C ATOM 1629 O ARG A 107 30.210 15.161 23.435 1.00 0.00 O ATOM 1630 CB ARG A 107 28.425 14.903 25.723 1.00 0.00 C ATOM 1631 CG ARG A 107 27.251 15.162 26.691 1.00 0.00 C ATOM 1632 CD ARG A 107 27.651 15.978 27.931 1.00 0.00 C ATOM 1633 NE ARG A 107 27.904 17.385 27.567 1.00 0.00 N ATOM 1634 CZ ARG A 107 28.147 18.410 28.357 1.00 0.00 C ATOM 1635 NH1 ARG A 107 28.199 18.320 29.656 1.00 0.00 N ATOM 1636 NH2 ARG A 107 28.340 19.566 27.803 1.00 0.00 N ATOM 0 H ARG A 107 27.276 12.836 24.293 1.00 0.00 H new ATOM 0 HA ARG A 107 27.503 15.790 24.052 1.00 0.00 H new ATOM 0 HB2 ARG A 107 28.922 13.973 25.997 1.00 0.00 H new ATOM 0 HB3 ARG A 107 29.161 15.700 25.825 1.00 0.00 H new ATOM 0 HG2 ARG A 107 26.460 15.689 26.158 1.00 0.00 H new ATOM 0 HG3 ARG A 107 26.837 14.206 27.012 1.00 0.00 H new ATOM 0 HD2 ARG A 107 26.859 15.927 28.678 1.00 0.00 H new ATOM 0 HD3 ARG A 107 28.544 15.548 28.384 1.00 0.00 H new ATOM 0 HE ARG A 107 27.889 17.592 26.568 1.00 0.00 H new ATOM 0 HH11 ARG A 107 28.047 17.420 30.111 1.00 0.00 H new ATOM 0 HH12 ARG A 107 28.392 19.150 30.217 1.00 0.00 H new ATOM 0 HH21 ARG A 107 28.301 19.658 26.788 1.00 0.00 H new ATOM 0 HH22 ARG A 107 28.531 20.384 28.382 1.00 0.00 H new ATOM 1650 N ASN A 108 28.777 14.094 22.075 1.00 0.00 N ATOM 1651 CA ASN A 108 29.518 14.113 20.810 1.00 0.00 C ATOM 1652 C ASN A 108 28.473 14.147 19.655 1.00 0.00 C ATOM 1653 O ASN A 108 27.998 13.079 19.251 1.00 0.00 O ATOM 1654 CB ASN A 108 30.462 12.884 20.751 1.00 0.00 C ATOM 1655 CG ASN A 108 31.938 13.223 20.916 1.00 0.00 C ATOM 1656 OD1 ASN A 108 32.771 12.876 20.090 1.00 0.00 O ATOM 1657 ND2 ASN A 108 32.323 13.907 21.970 1.00 0.00 N ATOM 0 H ASN A 108 27.929 13.533 22.000 1.00 0.00 H new ATOM 0 HA ASN A 108 30.155 14.993 20.716 1.00 0.00 H new ATOM 0 HB2 ASN A 108 30.173 12.180 21.531 1.00 0.00 H new ATOM 0 HB3 ASN A 108 30.321 12.377 19.796 1.00 0.00 H new ATOM 0 HD21 ASN A 108 33.308 14.143 22.093 1.00 0.00 H new ATOM 0 HD22 ASN A 108 31.637 14.202 22.665 1.00 0.00 H new ATOM 1664 N PRO A 109 28.041 15.331 19.161 1.00 0.00 N ATOM 1665 CA PRO A 109 28.512 16.682 19.507 1.00 0.00 C ATOM 1666 C PRO A 109 28.151 17.119 20.950 1.00 0.00 C ATOM 1667 O PRO A 109 27.240 16.534 21.535 1.00 0.00 O ATOM 1668 CB PRO A 109 27.884 17.607 18.452 1.00 0.00 C ATOM 1669 CG PRO A 109 26.604 16.885 18.047 1.00 0.00 C ATOM 1670 CD PRO A 109 26.996 15.413 18.145 1.00 0.00 C ATOM 0 HA PRO A 109 29.601 16.721 19.496 1.00 0.00 H new ATOM 0 HB2 PRO A 109 27.673 18.595 18.862 1.00 0.00 H new ATOM 0 HB3 PRO A 109 28.549 17.750 17.600 1.00 0.00 H new ATOM 0 HG2 PRO A 109 25.776 17.127 18.713 1.00 0.00 H new ATOM 0 HG3 PRO A 109 26.291 17.153 17.038 1.00 0.00 H new ATOM 0 HD2 PRO A 109 26.138 14.800 18.420 1.00 0.00 H new ATOM 0 HD3 PRO A 109 27.357 15.043 17.186 1.00 0.00 H new ATOM 1678 N PRO A 110 28.850 18.116 21.545 1.00 0.00 N ATOM 1679 CA PRO A 110 28.949 18.396 22.998 1.00 0.00 C ATOM 1680 C PRO A 110 27.703 18.564 23.903 1.00 0.00 C ATOM 1681 O PRO A 110 27.873 18.918 25.073 1.00 0.00 O ATOM 1682 CB PRO A 110 29.825 19.651 23.106 1.00 0.00 C ATOM 1683 CG PRO A 110 30.746 19.545 21.902 1.00 0.00 C ATOM 1684 CD PRO A 110 29.829 18.951 20.842 1.00 0.00 C ATOM 0 HA PRO A 110 29.329 17.461 23.410 1.00 0.00 H new ATOM 0 HB2 PRO A 110 29.227 20.562 23.075 1.00 0.00 H new ATOM 0 HB3 PRO A 110 30.386 19.670 24.040 1.00 0.00 H new ATOM 0 HG2 PRO A 110 31.137 20.517 21.603 1.00 0.00 H new ATOM 0 HG3 PRO A 110 31.605 18.904 22.102 1.00 0.00 H new ATOM 0 HD2 PRO A 110 29.330 19.739 20.278 1.00 0.00 H new ATOM 0 HD3 PRO A 110 30.399 18.358 20.126 1.00 0.00 H new ATOM 1692 N GLY A 111 26.468 18.337 23.448 1.00 0.00 N ATOM 1693 CA GLY A 111 25.251 18.592 24.239 1.00 0.00 C ATOM 1694 C GLY A 111 23.979 18.667 23.395 1.00 0.00 C ATOM 1695 O GLY A 111 23.316 19.707 23.370 1.00 0.00 O ATOM 0 H GLY A 111 26.278 17.969 22.516 1.00 0.00 H new ATOM 0 HA2 GLY A 111 25.138 17.803 24.982 1.00 0.00 H new ATOM 0 HA3 GLY A 111 25.371 19.528 24.784 1.00 0.00 H new ATOM 1699 N PHE A 112 23.667 17.594 22.664 1.00 0.00 N ATOM 1700 CA PHE A 112 22.589 17.546 21.666 1.00 0.00 C ATOM 1701 C PHE A 112 21.686 16.326 21.883 1.00 0.00 C ATOM 1702 O PHE A 112 22.175 15.226 22.150 1.00 0.00 O ATOM 1703 CB PHE A 112 23.195 17.576 20.256 1.00 0.00 C ATOM 1704 CG PHE A 112 23.748 18.936 19.854 1.00 0.00 C ATOM 1705 CD1 PHE A 112 25.015 19.358 20.301 1.00 0.00 C ATOM 1706 CD2 PHE A 112 22.981 19.799 19.049 1.00 0.00 C ATOM 1707 CE1 PHE A 112 25.495 20.641 19.982 1.00 0.00 C ATOM 1708 CE2 PHE A 112 23.459 21.082 18.724 1.00 0.00 C ATOM 1709 CZ PHE A 112 24.713 21.506 19.196 1.00 0.00 C ATOM 0 H PHE A 112 24.169 16.710 22.750 1.00 0.00 H new ATOM 0 HA PHE A 112 21.953 18.423 21.782 1.00 0.00 H new ATOM 0 HB2 PHE A 112 23.995 16.838 20.199 1.00 0.00 H new ATOM 0 HB3 PHE A 112 22.433 17.277 19.537 1.00 0.00 H new ATOM 0 HD1 PHE A 112 25.623 18.691 20.894 1.00 0.00 H new ATOM 0 HD2 PHE A 112 22.020 19.475 18.679 1.00 0.00 H new ATOM 0 HE1 PHE A 112 26.462 20.961 20.340 1.00 0.00 H new ATOM 0 HE2 PHE A 112 22.862 21.741 18.111 1.00 0.00 H new ATOM 0 HZ PHE A 112 25.075 22.495 18.955 1.00 0.00 H new ATOM 1719 N ALA A 113 20.367 16.517 21.786 1.00 0.00 N ATOM 1720 CA ALA A 113 19.361 15.555 22.213 1.00 0.00 C ATOM 1721 C ALA A 113 18.263 15.318 21.177 1.00 0.00 C ATOM 1722 O ALA A 113 17.905 16.183 20.382 1.00 0.00 O ATOM 1723 CB ALA A 113 18.712 16.056 23.511 1.00 0.00 C ATOM 0 H ALA A 113 19.964 17.370 21.397 1.00 0.00 H new ATOM 0 HA ALA A 113 19.875 14.605 22.357 1.00 0.00 H new ATOM 0 HB1 ALA A 113 17.957 15.342 23.839 1.00 0.00 H new ATOM 0 HB2 ALA A 113 19.475 16.158 24.283 1.00 0.00 H new ATOM 0 HB3 ALA A 113 18.243 17.024 23.333 1.00 0.00 H new ATOM 1729 N PHE A 114 17.643 14.154 21.299 1.00 0.00 N ATOM 1730 CA PHE A 114 16.487 13.727 20.522 1.00 0.00 C ATOM 1731 C PHE A 114 15.363 13.338 21.493 1.00 0.00 C ATOM 1732 O PHE A 114 15.603 12.649 22.489 1.00 0.00 O ATOM 1733 CB PHE A 114 16.883 12.514 19.661 1.00 0.00 C ATOM 1734 CG PHE A 114 17.987 12.732 18.637 1.00 0.00 C ATOM 1735 CD1 PHE A 114 19.341 12.669 19.023 1.00 0.00 C ATOM 1736 CD2 PHE A 114 17.663 12.934 17.280 1.00 0.00 C ATOM 1737 CE1 PHE A 114 20.361 12.818 18.065 1.00 0.00 C ATOM 1738 CE2 PHE A 114 18.682 13.076 16.319 1.00 0.00 C ATOM 1739 CZ PHE A 114 20.032 13.016 16.712 1.00 0.00 C ATOM 0 H PHE A 114 17.945 13.449 21.972 1.00 0.00 H new ATOM 0 HA PHE A 114 16.145 14.531 19.870 1.00 0.00 H new ATOM 0 HB2 PHE A 114 17.193 11.710 20.329 1.00 0.00 H new ATOM 0 HB3 PHE A 114 15.994 12.167 19.134 1.00 0.00 H new ATOM 0 HD1 PHE A 114 19.597 12.506 20.059 1.00 0.00 H new ATOM 0 HD2 PHE A 114 16.628 12.980 16.976 1.00 0.00 H new ATOM 0 HE1 PHE A 114 21.397 12.780 18.369 1.00 0.00 H new ATOM 0 HE2 PHE A 114 18.428 13.231 15.281 1.00 0.00 H new ATOM 0 HZ PHE A 114 20.815 13.122 15.975 1.00 0.00 H new ATOM 1749 N VAL A 115 14.128 13.750 21.201 1.00 0.00 N ATOM 1750 CA VAL A 115 12.951 13.480 22.043 1.00 0.00 C ATOM 1751 C VAL A 115 11.729 13.123 21.195 1.00 0.00 C ATOM 1752 O VAL A 115 11.696 13.331 19.984 1.00 0.00 O ATOM 1753 CB VAL A 115 12.632 14.647 23.017 1.00 0.00 C ATOM 1754 CG1 VAL A 115 13.392 14.507 24.337 1.00 0.00 C ATOM 1755 CG2 VAL A 115 12.976 16.046 22.499 1.00 0.00 C ATOM 0 H VAL A 115 13.910 14.288 20.363 1.00 0.00 H new ATOM 0 HA VAL A 115 13.203 12.616 22.658 1.00 0.00 H new ATOM 0 HB VAL A 115 11.552 14.564 23.136 1.00 0.00 H new ATOM 0 HG11 VAL A 115 13.142 15.342 24.991 1.00 0.00 H new ATOM 0 HG12 VAL A 115 13.112 13.571 24.821 1.00 0.00 H new ATOM 0 HG13 VAL A 115 14.464 14.508 24.141 1.00 0.00 H new ATOM 0 HG21 VAL A 115 12.715 16.788 23.254 1.00 0.00 H new ATOM 0 HG22 VAL A 115 14.044 16.103 22.288 1.00 0.00 H new ATOM 0 HG23 VAL A 115 12.415 16.244 21.586 1.00 0.00 H new ATOM 1765 N GLU A 116 10.705 12.566 21.828 1.00 0.00 N ATOM 1766 CA GLU A 116 9.393 12.348 21.220 1.00 0.00 C ATOM 1767 C GLU A 116 8.299 12.555 22.274 1.00 0.00 C ATOM 1768 O GLU A 116 8.427 12.084 23.408 1.00 0.00 O ATOM 1769 CB GLU A 116 9.253 10.898 20.705 1.00 0.00 C ATOM 1770 CG GLU A 116 10.134 10.500 19.512 1.00 0.00 C ATOM 1771 CD GLU A 116 9.796 9.065 19.073 1.00 0.00 C ATOM 1772 OE1 GLU A 116 8.833 8.858 18.294 1.00 0.00 O ATOM 1773 OE2 GLU A 116 10.410 8.101 19.578 1.00 0.00 O ATOM 0 H GLU A 116 10.761 12.246 22.795 1.00 0.00 H new ATOM 0 HA GLU A 116 9.293 13.051 20.393 1.00 0.00 H new ATOM 0 HB2 GLU A 116 9.473 10.221 21.531 1.00 0.00 H new ATOM 0 HB3 GLU A 116 8.212 10.735 20.428 1.00 0.00 H new ATOM 0 HG2 GLU A 116 9.975 11.191 18.684 1.00 0.00 H new ATOM 0 HG3 GLU A 116 11.187 10.568 19.786 1.00 0.00 H new ATOM 1780 N PHE A 117 7.184 13.150 21.841 1.00 0.00 N ATOM 1781 CA PHE A 117 5.866 13.039 22.470 1.00 0.00 C ATOM 1782 C PHE A 117 4.929 12.415 21.433 1.00 0.00 C ATOM 1783 O PHE A 117 5.000 12.767 20.254 1.00 0.00 O ATOM 1784 CB PHE A 117 5.316 14.414 22.875 1.00 0.00 C ATOM 1785 CG PHE A 117 6.188 15.261 23.779 1.00 0.00 C ATOM 1786 CD1 PHE A 117 7.235 16.025 23.231 1.00 0.00 C ATOM 1787 CD2 PHE A 117 5.914 15.343 25.157 1.00 0.00 C ATOM 1788 CE1 PHE A 117 8.002 16.868 24.050 1.00 0.00 C ATOM 1789 CE2 PHE A 117 6.675 16.196 25.975 1.00 0.00 C ATOM 1790 CZ PHE A 117 7.712 16.963 25.416 1.00 0.00 C ATOM 0 H PHE A 117 7.175 13.744 21.012 1.00 0.00 H new ATOM 0 HA PHE A 117 5.942 12.435 23.374 1.00 0.00 H new ATOM 0 HB2 PHE A 117 5.118 14.981 21.966 1.00 0.00 H new ATOM 0 HB3 PHE A 117 4.358 14.263 23.372 1.00 0.00 H new ATOM 0 HD1 PHE A 117 7.450 15.962 22.174 1.00 0.00 H new ATOM 0 HD2 PHE A 117 5.119 14.751 25.586 1.00 0.00 H new ATOM 0 HE1 PHE A 117 8.814 17.442 23.627 1.00 0.00 H new ATOM 0 HE2 PHE A 117 6.463 16.262 27.032 1.00 0.00 H new ATOM 0 HZ PHE A 117 8.287 17.628 26.043 1.00 0.00 H new ATOM 1800 N GLU A 118 4.031 11.518 21.833 1.00 0.00 N ATOM 1801 CA GLU A 118 3.107 10.843 20.902 1.00 0.00 C ATOM 1802 C GLU A 118 1.879 11.717 20.528 1.00 0.00 C ATOM 1803 O GLU A 118 0.783 11.214 20.274 1.00 0.00 O ATOM 1804 CB GLU A 118 2.733 9.459 21.472 1.00 0.00 C ATOM 1805 CG GLU A 118 2.500 8.409 20.371 1.00 0.00 C ATOM 1806 CD GLU A 118 3.827 7.833 19.840 1.00 0.00 C ATOM 1807 OE1 GLU A 118 4.612 8.553 19.179 1.00 0.00 O ATOM 1808 OE2 GLU A 118 4.136 6.649 20.111 1.00 0.00 O ATOM 0 H GLU A 118 3.917 11.234 22.806 1.00 0.00 H new ATOM 0 HA GLU A 118 3.616 10.689 19.951 1.00 0.00 H new ATOM 0 HB2 GLU A 118 3.528 9.116 22.134 1.00 0.00 H new ATOM 0 HB3 GLU A 118 1.832 9.551 22.078 1.00 0.00 H new ATOM 0 HG2 GLU A 118 1.884 7.600 20.764 1.00 0.00 H new ATOM 0 HG3 GLU A 118 1.945 8.861 19.549 1.00 0.00 H new ATOM 1815 N ASP A 119 2.047 13.046 20.537 1.00 0.00 N ATOM 1816 CA ASP A 119 0.987 14.053 20.395 1.00 0.00 C ATOM 1817 C ASP A 119 1.532 15.373 19.786 1.00 0.00 C ATOM 1818 O ASP A 119 2.611 15.824 20.195 1.00 0.00 O ATOM 1819 CB ASP A 119 0.402 14.328 21.788 1.00 0.00 C ATOM 1820 CG ASP A 119 -0.815 15.259 21.726 1.00 0.00 C ATOM 1821 OD1 ASP A 119 -0.631 16.458 21.414 1.00 0.00 O ATOM 1822 OD2 ASP A 119 -1.950 14.803 22.008 1.00 0.00 O ATOM 0 H ASP A 119 2.969 13.468 20.649 1.00 0.00 H new ATOM 0 HA ASP A 119 0.222 13.673 19.718 1.00 0.00 H new ATOM 0 HB2 ASP A 119 0.114 13.385 22.253 1.00 0.00 H new ATOM 0 HB3 ASP A 119 1.168 14.775 22.421 1.00 0.00 H new ATOM 1827 N PRO A 120 0.808 16.018 18.844 1.00 0.00 N ATOM 1828 CA PRO A 120 1.170 17.310 18.259 1.00 0.00 C ATOM 1829 C PRO A 120 1.576 18.428 19.226 1.00 0.00 C ATOM 1830 O PRO A 120 2.615 19.061 19.024 1.00 0.00 O ATOM 1831 CB PRO A 120 -0.047 17.743 17.430 1.00 0.00 C ATOM 1832 CG PRO A 120 -0.700 16.427 17.028 1.00 0.00 C ATOM 1833 CD PRO A 120 -0.408 15.512 18.213 1.00 0.00 C ATOM 0 HA PRO A 120 2.082 17.158 17.682 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -0.727 18.365 18.012 1.00 0.00 H new ATOM 0 HB3 PRO A 120 0.250 18.325 16.558 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -1.771 16.543 16.864 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -0.277 16.034 16.103 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -1.239 15.514 18.918 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -0.273 14.482 17.883 1.00 0.00 H new ATOM 1841 N ARG A 121 0.765 18.713 20.255 1.00 0.00 N ATOM 1842 CA ARG A 121 0.833 19.996 20.982 1.00 0.00 C ATOM 1843 C ARG A 121 1.663 19.964 22.259 1.00 0.00 C ATOM 1844 O ARG A 121 2.094 21.020 22.714 1.00 0.00 O ATOM 1845 CB ARG A 121 -0.554 20.653 21.124 1.00 0.00 C ATOM 1846 CG ARG A 121 -1.649 19.865 21.859 1.00 0.00 C ATOM 1847 CD ARG A 121 -1.585 19.913 23.400 1.00 0.00 C ATOM 1848 NE ARG A 121 -1.288 18.615 24.035 1.00 0.00 N ATOM 1849 CZ ARG A 121 -1.944 17.471 23.943 1.00 0.00 C ATOM 1850 NH1 ARG A 121 -3.025 17.307 23.237 1.00 0.00 N ATOM 1851 NH2 ARG A 121 -1.499 16.423 24.569 1.00 0.00 N ATOM 0 H ARG A 121 0.052 18.073 20.606 1.00 0.00 H new ATOM 0 HA ARG A 121 1.413 20.667 20.349 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -0.423 21.604 21.640 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -0.920 20.881 20.123 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -2.620 20.245 21.542 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -1.596 18.823 21.543 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -0.823 20.633 23.698 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -2.538 20.281 23.780 1.00 0.00 H new ATOM 0 HE ARG A 121 -0.459 18.598 24.629 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -3.415 18.090 22.711 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -3.483 16.396 23.209 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -0.648 16.486 25.128 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -2.001 15.538 24.502 1.00 0.00 H new ATOM 1865 N ASP A 122 1.997 18.782 22.771 1.00 0.00 N ATOM 1866 CA ASP A 122 3.040 18.651 23.801 1.00 0.00 C ATOM 1867 C ASP A 122 4.431 18.929 23.200 1.00 0.00 C ATOM 1868 O ASP A 122 5.201 19.723 23.746 1.00 0.00 O ATOM 1869 CB ASP A 122 2.991 17.253 24.433 1.00 0.00 C ATOM 1870 CG ASP A 122 1.626 16.923 25.055 1.00 0.00 C ATOM 1871 OD1 ASP A 122 0.898 17.824 25.527 1.00 0.00 O ATOM 1872 OD2 ASP A 122 1.216 15.745 25.018 1.00 0.00 O ATOM 0 H ASP A 122 1.566 17.900 22.495 1.00 0.00 H new ATOM 0 HA ASP A 122 2.853 19.389 24.581 1.00 0.00 H new ATOM 0 HB2 ASP A 122 3.227 16.508 23.673 1.00 0.00 H new ATOM 0 HB3 ASP A 122 3.761 17.180 25.201 1.00 0.00 H new ATOM 1877 N ALA A 123 4.712 18.354 22.023 1.00 0.00 N ATOM 1878 CA ALA A 123 5.927 18.612 21.250 1.00 0.00 C ATOM 1879 C ALA A 123 6.022 20.085 20.800 1.00 0.00 C ATOM 1880 O ALA A 123 7.044 20.742 21.013 1.00 0.00 O ATOM 1881 CB ALA A 123 5.936 17.640 20.059 1.00 0.00 C ATOM 0 H ALA A 123 4.087 17.684 21.576 1.00 0.00 H new ATOM 0 HA ALA A 123 6.807 18.444 21.871 1.00 0.00 H new ATOM 0 HB1 ALA A 123 6.832 17.806 19.460 1.00 0.00 H new ATOM 0 HB2 ALA A 123 5.931 16.614 20.427 1.00 0.00 H new ATOM 0 HB3 ALA A 123 5.052 17.810 19.444 1.00 0.00 H new ATOM 1887 N ALA A 124 4.942 20.626 20.221 1.00 0.00 N ATOM 1888 CA ALA A 124 4.850 22.007 19.793 1.00 0.00 C ATOM 1889 C ALA A 124 5.062 22.952 20.965 1.00 0.00 C ATOM 1890 O ALA A 124 5.739 23.951 20.768 1.00 0.00 O ATOM 1891 CB ALA A 124 3.509 22.275 19.104 1.00 0.00 C ATOM 0 H ALA A 124 4.092 20.092 20.038 1.00 0.00 H new ATOM 0 HA ALA A 124 5.642 22.191 19.067 1.00 0.00 H new ATOM 0 HB1 ALA A 124 3.463 23.318 18.791 1.00 0.00 H new ATOM 0 HB2 ALA A 124 3.413 21.630 18.231 1.00 0.00 H new ATOM 0 HB3 ALA A 124 2.695 22.068 19.799 1.00 0.00 H new ATOM 1897 N ASP A 125 4.566 22.652 22.178 1.00 0.00 N ATOM 1898 CA ASP A 125 4.773 23.580 23.286 1.00 0.00 C ATOM 1899 C ASP A 125 6.209 23.558 23.833 1.00 0.00 C ATOM 1900 O ASP A 125 6.808 24.603 24.061 1.00 0.00 O ATOM 1901 CB ASP A 125 3.764 23.423 24.421 1.00 0.00 C ATOM 1902 CG ASP A 125 3.584 24.755 25.169 1.00 0.00 C ATOM 1903 OD1 ASP A 125 3.143 25.746 24.546 1.00 0.00 O ATOM 1904 OD2 ASP A 125 3.884 24.848 26.379 1.00 0.00 O ATOM 0 H ASP A 125 4.040 21.808 22.405 1.00 0.00 H new ATOM 0 HA ASP A 125 4.601 24.561 22.842 1.00 0.00 H new ATOM 0 HB2 ASP A 125 2.806 23.091 24.021 1.00 0.00 H new ATOM 0 HB3 ASP A 125 4.104 22.653 25.114 1.00 0.00 H new ATOM 1909 N ALA A 126 6.795 22.366 23.947 1.00 0.00 N ATOM 1910 CA ALA A 126 8.216 22.138 24.177 1.00 0.00 C ATOM 1911 C ALA A 126 9.135 22.757 23.100 1.00 0.00 C ATOM 1912 O ALA A 126 10.327 22.895 23.349 1.00 0.00 O ATOM 1913 CB ALA A 126 8.451 20.631 24.314 1.00 0.00 C ATOM 0 H ALA A 126 6.266 21.497 23.878 1.00 0.00 H new ATOM 0 HA ALA A 126 8.489 22.652 25.098 1.00 0.00 H new ATOM 0 HB1 ALA A 126 9.511 20.442 24.487 1.00 0.00 H new ATOM 0 HB2 ALA A 126 7.872 20.247 25.154 1.00 0.00 H new ATOM 0 HB3 ALA A 126 8.138 20.129 23.399 1.00 0.00 H new ATOM 1919 N VAL A 127 8.619 23.177 21.935 1.00 0.00 N ATOM 1920 CA VAL A 127 9.316 24.116 21.035 1.00 0.00 C ATOM 1921 C VAL A 127 8.899 25.574 21.300 1.00 0.00 C ATOM 1922 O VAL A 127 9.770 26.418 21.491 1.00 0.00 O ATOM 1923 CB VAL A 127 9.118 23.711 19.561 1.00 0.00 C ATOM 1924 CG1 VAL A 127 9.782 24.684 18.581 1.00 0.00 C ATOM 1925 CG2 VAL A 127 9.752 22.339 19.305 1.00 0.00 C ATOM 0 H VAL A 127 7.708 22.877 21.588 1.00 0.00 H new ATOM 0 HA VAL A 127 10.383 24.057 21.248 1.00 0.00 H new ATOM 0 HB VAL A 127 8.041 23.708 19.396 1.00 0.00 H new ATOM 0 HG11 VAL A 127 9.608 24.346 17.559 1.00 0.00 H new ATOM 0 HG12 VAL A 127 9.357 25.679 18.712 1.00 0.00 H new ATOM 0 HG13 VAL A 127 10.854 24.720 18.774 1.00 0.00 H new ATOM 0 HG21 VAL A 127 9.607 22.060 18.261 1.00 0.00 H new ATOM 0 HG22 VAL A 127 10.819 22.385 19.524 1.00 0.00 H new ATOM 0 HG23 VAL A 127 9.281 21.595 19.948 1.00 0.00 H new ATOM 1935 N ARG A 128 7.600 25.887 21.404 1.00 0.00 N ATOM 1936 CA ARG A 128 7.024 27.238 21.612 1.00 0.00 C ATOM 1937 C ARG A 128 7.610 27.956 22.827 1.00 0.00 C ATOM 1938 O ARG A 128 7.818 29.167 22.798 1.00 0.00 O ATOM 1939 CB ARG A 128 5.498 27.059 21.748 1.00 0.00 C ATOM 1940 CG ARG A 128 4.581 28.298 21.743 1.00 0.00 C ATOM 1941 CD ARG A 128 4.521 29.130 23.036 1.00 0.00 C ATOM 1942 NE ARG A 128 4.258 28.314 24.240 1.00 0.00 N ATOM 1943 CZ ARG A 128 4.723 28.524 25.456 1.00 0.00 C ATOM 1944 NH1 ARG A 128 5.448 29.557 25.771 1.00 0.00 N ATOM 1945 NH2 ARG A 128 4.502 27.675 26.411 1.00 0.00 N ATOM 0 H ARG A 128 6.877 25.170 21.343 1.00 0.00 H new ATOM 0 HA ARG A 128 7.273 27.875 20.763 1.00 0.00 H new ATOM 0 HB2 ARG A 128 5.172 26.410 20.935 1.00 0.00 H new ATOM 0 HB3 ARG A 128 5.315 26.522 22.678 1.00 0.00 H new ATOM 0 HG2 ARG A 128 4.902 28.953 20.933 1.00 0.00 H new ATOM 0 HG3 ARG A 128 3.569 27.969 21.505 1.00 0.00 H new ATOM 0 HD2 ARG A 128 5.465 29.661 23.163 1.00 0.00 H new ATOM 0 HD3 ARG A 128 3.741 29.885 22.939 1.00 0.00 H new ATOM 0 HE ARG A 128 3.653 27.502 24.117 1.00 0.00 H new ATOM 0 HH11 ARG A 128 5.681 30.252 25.062 1.00 0.00 H new ATOM 0 HH12 ARG A 128 5.783 29.672 26.727 1.00 0.00 H new ATOM 0 HH21 ARG A 128 3.961 26.830 26.227 1.00 0.00 H new ATOM 0 HH22 ARG A 128 4.869 27.852 27.346 1.00 0.00 H new ATOM 1959 N ASP A 129 7.896 27.203 23.884 1.00 0.00 N ATOM 1960 CA ASP A 129 8.336 27.710 25.178 1.00 0.00 C ATOM 1961 C ASP A 129 9.860 27.848 25.267 1.00 0.00 C ATOM 1962 O ASP A 129 10.369 28.446 26.214 1.00 0.00 O ATOM 1963 CB ASP A 129 7.791 26.743 26.245 1.00 0.00 C ATOM 1964 CG ASP A 129 7.744 27.390 27.640 1.00 0.00 C ATOM 1965 OD1 ASP A 129 6.958 28.353 27.823 1.00 0.00 O ATOM 1966 OD2 ASP A 129 8.442 26.912 28.562 1.00 0.00 O ATOM 0 H ASP A 129 7.825 26.186 23.862 1.00 0.00 H new ATOM 0 HA ASP A 129 7.951 28.718 25.333 1.00 0.00 H new ATOM 0 HB2 ASP A 129 6.790 26.418 25.962 1.00 0.00 H new ATOM 0 HB3 ASP A 129 8.417 25.852 26.280 1.00 0.00 H new ATOM 1971 N LEU A 130 10.590 27.285 24.296 1.00 0.00 N ATOM 1972 CA LEU A 130 11.934 26.741 24.539 1.00 0.00 C ATOM 1973 C LEU A 130 12.932 26.982 23.394 1.00 0.00 C ATOM 1974 O LEU A 130 14.130 27.109 23.646 1.00 0.00 O ATOM 1975 CB LEU A 130 11.733 25.235 24.809 1.00 0.00 C ATOM 1976 CG LEU A 130 12.449 24.610 26.019 1.00 0.00 C ATOM 1977 CD1 LEU A 130 12.285 25.416 27.308 1.00 0.00 C ATOM 1978 CD2 LEU A 130 11.827 23.235 26.259 1.00 0.00 C ATOM 0 H LEU A 130 10.272 27.194 23.331 1.00 0.00 H new ATOM 0 HA LEU A 130 12.389 27.258 25.384 1.00 0.00 H new ATOM 0 HB2 LEU A 130 10.664 25.058 24.927 1.00 0.00 H new ATOM 0 HB3 LEU A 130 12.049 24.692 23.918 1.00 0.00 H new ATOM 0 HG LEU A 130 13.513 24.574 25.787 1.00 0.00 H new ATOM 0 HD11 LEU A 130 12.815 24.917 28.119 1.00 0.00 H new ATOM 0 HD12 LEU A 130 12.696 26.416 27.167 1.00 0.00 H new ATOM 0 HD13 LEU A 130 11.227 25.491 27.558 1.00 0.00 H new ATOM 0 HD21 LEU A 130 12.311 22.760 27.112 1.00 0.00 H new ATOM 0 HD22 LEU A 130 10.762 23.348 26.463 1.00 0.00 H new ATOM 0 HD23 LEU A 130 11.963 22.614 25.373 1.00 0.00 H new ATOM 1990 N ASP A 131 12.446 27.100 22.156 1.00 0.00 N ATOM 1991 CA ASP A 131 13.157 27.517 20.940 1.00 0.00 C ATOM 1992 C ASP A 131 14.041 28.754 21.181 1.00 0.00 C ATOM 1993 O ASP A 131 13.565 29.889 21.259 1.00 0.00 O ATOM 1994 CB ASP A 131 12.114 27.715 19.828 1.00 0.00 C ATOM 1995 CG ASP A 131 12.550 28.599 18.643 1.00 0.00 C ATOM 1996 OD1 ASP A 131 13.729 28.530 18.220 1.00 0.00 O ATOM 1997 OD2 ASP A 131 11.700 29.351 18.111 1.00 0.00 O ATOM 0 H ASP A 131 11.467 26.890 21.960 1.00 0.00 H new ATOM 0 HA ASP A 131 13.859 26.743 20.629 1.00 0.00 H new ATOM 0 HB2 ASP A 131 11.834 26.735 19.441 1.00 0.00 H new ATOM 0 HB3 ASP A 131 11.218 28.151 20.271 1.00 0.00 H new ATOM 2002 N GLY A 132 15.347 28.509 21.326 1.00 0.00 N ATOM 2003 CA GLY A 132 16.352 29.550 21.555 1.00 0.00 C ATOM 2004 C GLY A 132 16.287 30.205 22.939 1.00 0.00 C ATOM 2005 O GLY A 132 16.734 31.345 23.084 1.00 0.00 O ATOM 0 H GLY A 132 15.740 27.569 21.287 1.00 0.00 H new ATOM 0 HA2 GLY A 132 17.343 29.117 21.419 1.00 0.00 H new ATOM 0 HA3 GLY A 132 16.235 30.323 20.796 1.00 0.00 H new ATOM 2009 N ARG A 133 15.787 29.498 23.960 1.00 0.00 N ATOM 2010 CA ARG A 133 15.723 29.973 25.358 1.00 0.00 C ATOM 2011 C ARG A 133 16.913 29.445 26.189 1.00 0.00 C ATOM 2012 O ARG A 133 18.052 29.421 25.712 1.00 0.00 O ATOM 2013 CB ARG A 133 14.321 29.661 25.941 1.00 0.00 C ATOM 2014 CG ARG A 133 13.955 30.637 27.081 1.00 0.00 C ATOM 2015 CD ARG A 133 12.753 30.185 27.918 1.00 0.00 C ATOM 2016 NE ARG A 133 13.043 29.018 28.787 1.00 0.00 N ATOM 2017 CZ ARG A 133 12.145 28.185 29.286 1.00 0.00 C ATOM 2018 NH1 ARG A 133 10.900 28.231 28.926 1.00 0.00 N ATOM 2019 NH2 ARG A 133 12.500 27.283 30.153 1.00 0.00 N ATOM 0 H ARG A 133 15.406 28.559 23.840 1.00 0.00 H new ATOM 0 HA ARG A 133 15.837 31.056 25.398 1.00 0.00 H new ATOM 0 HB2 ARG A 133 13.574 29.726 25.150 1.00 0.00 H new ATOM 0 HB3 ARG A 133 14.300 28.638 26.315 1.00 0.00 H new ATOM 0 HG2 ARG A 133 14.818 30.756 27.736 1.00 0.00 H new ATOM 0 HG3 ARG A 133 13.741 31.617 26.654 1.00 0.00 H new ATOM 0 HD2 ARG A 133 12.419 31.016 28.539 1.00 0.00 H new ATOM 0 HD3 ARG A 133 11.929 29.935 27.250 1.00 0.00 H new ATOM 0 HE ARG A 133 14.020 28.843 29.020 1.00 0.00 H new ATOM 0 HH11 ARG A 133 10.592 28.922 28.242 1.00 0.00 H new ATOM 0 HH12 ARG A 133 10.229 27.576 29.327 1.00 0.00 H new ATOM 0 HH21 ARG A 133 13.473 27.216 30.450 1.00 0.00 H new ATOM 0 HH22 ARG A 133 11.805 26.642 30.536 1.00 0.00 H new ATOM 2033 N THR A 134 16.643 29.031 27.425 1.00 0.00 N ATOM 2034 CA THR A 134 17.576 28.596 28.471 1.00 0.00 C ATOM 2035 C THR A 134 16.841 27.620 29.398 1.00 0.00 C ATOM 2036 O THR A 134 15.652 27.817 29.684 1.00 0.00 O ATOM 2037 CB THR A 134 18.039 29.819 29.293 1.00 0.00 C ATOM 2038 OG1 THR A 134 18.786 30.709 28.492 1.00 0.00 O ATOM 2039 CG2 THR A 134 18.913 29.456 30.495 1.00 0.00 C ATOM 0 H THR A 134 15.678 28.986 27.753 1.00 0.00 H new ATOM 0 HA THR A 134 18.444 28.115 28.020 1.00 0.00 H new ATOM 0 HB THR A 134 17.118 30.277 29.654 1.00 0.00 H new ATOM 0 HG1 THR A 134 19.722 30.421 28.468 1.00 0.00 H new ATOM 0 HG21 THR A 134 19.200 30.365 31.024 1.00 0.00 H new ATOM 0 HG22 THR A 134 18.354 28.805 31.168 1.00 0.00 H new ATOM 0 HG23 THR A 134 19.809 28.939 30.151 1.00 0.00 H new ATOM 2047 N LEU A 135 17.541 26.589 29.882 1.00 0.00 N ATOM 2048 CA LEU A 135 17.022 25.581 30.824 1.00 0.00 C ATOM 2049 C LEU A 135 17.826 25.538 32.140 1.00 0.00 C ATOM 2050 O LEU A 135 17.244 25.423 33.220 1.00 0.00 O ATOM 2051 CB LEU A 135 17.116 24.179 30.187 1.00 0.00 C ATOM 2052 CG LEU A 135 16.054 23.743 29.165 1.00 0.00 C ATOM 2053 CD1 LEU A 135 15.976 24.625 27.919 1.00 0.00 C ATOM 2054 CD2 LEU A 135 16.419 22.320 28.727 1.00 0.00 C ATOM 0 H LEU A 135 18.514 26.424 29.624 1.00 0.00 H new ATOM 0 HA LEU A 135 15.991 25.860 31.043 1.00 0.00 H new ATOM 0 HB2 LEU A 135 18.088 24.105 29.700 1.00 0.00 H new ATOM 0 HB3 LEU A 135 17.109 23.450 30.997 1.00 0.00 H new ATOM 0 HG LEU A 135 15.080 23.818 29.649 1.00 0.00 H new ATOM 0 HD11 LEU A 135 15.202 24.245 27.252 1.00 0.00 H new ATOM 0 HD12 LEU A 135 15.734 25.647 28.211 1.00 0.00 H new ATOM 0 HD13 LEU A 135 16.936 24.612 27.404 1.00 0.00 H new ATOM 0 HD21 LEU A 135 15.690 21.966 27.998 1.00 0.00 H new ATOM 0 HD22 LEU A 135 17.412 22.321 28.277 1.00 0.00 H new ATOM 0 HD23 LEU A 135 16.415 21.660 29.594 1.00 0.00 H new ATOM 2066 N CYS A 136 19.158 25.613 32.040 1.00 0.00 N ATOM 2067 CA CYS A 136 20.100 25.101 33.049 1.00 0.00 C ATOM 2068 C CYS A 136 21.273 26.073 33.320 1.00 0.00 C ATOM 2069 O CYS A 136 22.391 25.645 33.615 1.00 0.00 O ATOM 2070 CB CYS A 136 20.596 23.726 32.557 1.00 0.00 C ATOM 2071 SG CYS A 136 19.258 22.493 32.554 1.00 0.00 S ATOM 0 H CYS A 136 19.624 26.040 31.239 1.00 0.00 H new ATOM 0 HA CYS A 136 19.591 25.003 34.008 1.00 0.00 H new ATOM 0 HB2 CYS A 136 21.003 23.824 31.551 1.00 0.00 H new ATOM 0 HB3 CYS A 136 21.408 23.381 33.197 1.00 0.00 H new ATOM 0 HG CYS A 136 19.769 21.298 32.594 1.00 0.00 H new ATOM 2077 N GLY A 137 21.048 27.384 33.160 1.00 0.00 N ATOM 2078 CA GLY A 137 22.107 28.407 33.189 1.00 0.00 C ATOM 2079 C GLY A 137 22.941 28.423 31.900 1.00 0.00 C ATOM 2080 O GLY A 137 24.163 28.581 31.940 1.00 0.00 O ATOM 0 H GLY A 137 20.117 27.770 33.005 1.00 0.00 H new ATOM 0 HA2 GLY A 137 21.657 29.388 33.339 1.00 0.00 H new ATOM 0 HA3 GLY A 137 22.762 28.223 34.040 1.00 0.00 H new ATOM 2084 N CYS A 138 22.282 28.179 30.765 1.00 0.00 N ATOM 2085 CA CYS A 138 22.860 27.869 29.455 1.00 0.00 C ATOM 2086 C CYS A 138 22.281 28.759 28.333 1.00 0.00 C ATOM 2087 O CYS A 138 21.467 29.653 28.579 1.00 0.00 O ATOM 2088 CB CYS A 138 22.607 26.370 29.186 1.00 0.00 C ATOM 2089 SG CYS A 138 20.822 26.021 29.057 1.00 0.00 S ATOM 0 H CYS A 138 21.263 28.194 30.735 1.00 0.00 H new ATOM 0 HA CYS A 138 23.930 28.079 29.462 1.00 0.00 H new ATOM 0 HB2 CYS A 138 23.107 26.073 28.264 1.00 0.00 H new ATOM 0 HB3 CYS A 138 23.040 25.775 29.990 1.00 0.00 H new ATOM 0 HG CYS A 138 20.631 24.735 29.041 1.00 0.00 H new ATOM 2095 N ARG A 139 22.668 28.483 27.080 1.00 0.00 N ATOM 2096 CA ARG A 139 22.143 29.127 25.863 1.00 0.00 C ATOM 2097 C ARG A 139 21.753 28.034 24.871 1.00 0.00 C ATOM 2098 O ARG A 139 22.589 27.561 24.107 1.00 0.00 O ATOM 2099 CB ARG A 139 23.194 30.128 25.327 1.00 0.00 C ATOM 2100 CG ARG A 139 22.624 31.178 24.360 1.00 0.00 C ATOM 2101 CD ARG A 139 22.342 30.709 22.919 1.00 0.00 C ATOM 2102 NE ARG A 139 21.325 31.577 22.291 1.00 0.00 N ATOM 2103 CZ ARG A 139 20.036 31.545 22.578 1.00 0.00 C ATOM 2104 NH1 ARG A 139 19.487 30.526 23.169 1.00 0.00 N ATOM 2105 NH2 ARG A 139 19.253 32.544 22.304 1.00 0.00 N ATOM 0 H ARG A 139 23.380 27.781 26.876 1.00 0.00 H new ATOM 0 HA ARG A 139 21.243 29.710 26.059 1.00 0.00 H new ATOM 0 HB2 ARG A 139 23.656 30.640 26.171 1.00 0.00 H new ATOM 0 HB3 ARG A 139 23.983 29.573 24.820 1.00 0.00 H new ATOM 0 HG2 ARG A 139 21.694 31.560 24.782 1.00 0.00 H new ATOM 0 HG3 ARG A 139 23.322 32.014 24.316 1.00 0.00 H new ATOM 0 HD2 ARG A 139 23.262 30.732 22.334 1.00 0.00 H new ATOM 0 HD3 ARG A 139 21.995 29.676 22.926 1.00 0.00 H new ATOM 0 HE ARG A 139 21.639 32.246 21.588 1.00 0.00 H new ATOM 0 HH11 ARG A 139 20.055 29.718 23.426 1.00 0.00 H new ATOM 0 HH12 ARG A 139 18.488 30.534 23.376 1.00 0.00 H new ATOM 0 HH21 ARG A 139 19.630 33.379 21.856 1.00 0.00 H new ATOM 0 HH22 ARG A 139 18.261 32.493 22.536 1.00 0.00 H new ATOM 2119 N VAL A 140 20.505 27.576 24.938 1.00 0.00 N ATOM 2120 CA VAL A 140 20.028 26.368 24.234 1.00 0.00 C ATOM 2121 C VAL A 140 19.745 26.621 22.742 1.00 0.00 C ATOM 2122 O VAL A 140 19.670 27.771 22.298 1.00 0.00 O ATOM 2123 CB VAL A 140 18.785 25.817 24.974 1.00 0.00 C ATOM 2124 CG1 VAL A 140 17.462 26.375 24.443 1.00 0.00 C ATOM 2125 CG2 VAL A 140 18.687 24.293 24.947 1.00 0.00 C ATOM 0 H VAL A 140 19.779 28.034 25.489 1.00 0.00 H new ATOM 0 HA VAL A 140 20.821 25.620 24.251 1.00 0.00 H new ATOM 0 HB VAL A 140 18.938 26.154 25.999 1.00 0.00 H new ATOM 0 HG11 VAL A 140 16.634 25.946 25.007 1.00 0.00 H new ATOM 0 HG12 VAL A 140 17.454 27.459 24.554 1.00 0.00 H new ATOM 0 HG13 VAL A 140 17.355 26.117 23.389 1.00 0.00 H new ATOM 0 HG21 VAL A 140 17.793 23.976 25.484 1.00 0.00 H new ATOM 0 HG22 VAL A 140 18.630 23.950 23.914 1.00 0.00 H new ATOM 0 HG23 VAL A 140 19.568 23.863 25.424 1.00 0.00 H new ATOM 2135 N ARG A 141 19.462 25.543 22.004 1.00 0.00 N ATOM 2136 CA ARG A 141 18.622 25.527 20.795 1.00 0.00 C ATOM 2137 C ARG A 141 17.567 24.428 20.938 1.00 0.00 C ATOM 2138 O ARG A 141 17.870 23.349 21.441 1.00 0.00 O ATOM 2139 CB ARG A 141 19.483 25.250 19.545 1.00 0.00 C ATOM 2140 CG ARG A 141 20.163 26.478 18.916 1.00 0.00 C ATOM 2141 CD ARG A 141 19.202 27.619 18.532 1.00 0.00 C ATOM 2142 NE ARG A 141 18.025 27.142 17.774 1.00 0.00 N ATOM 2143 CZ ARG A 141 16.826 27.686 17.734 1.00 0.00 C ATOM 2144 NH1 ARG A 141 16.533 28.825 18.285 1.00 0.00 N ATOM 2145 NH2 ARG A 141 15.840 27.084 17.158 1.00 0.00 N ATOM 0 H ARG A 141 19.825 24.619 22.239 1.00 0.00 H new ATOM 0 HA ARG A 141 18.141 26.498 20.681 1.00 0.00 H new ATOM 0 HB2 ARG A 141 20.254 24.527 19.811 1.00 0.00 H new ATOM 0 HB3 ARG A 141 18.853 24.780 18.790 1.00 0.00 H new ATOM 0 HG2 ARG A 141 20.903 26.865 19.616 1.00 0.00 H new ATOM 0 HG3 ARG A 141 20.703 26.160 18.024 1.00 0.00 H new ATOM 0 HD2 ARG A 141 18.866 28.125 19.437 1.00 0.00 H new ATOM 0 HD3 ARG A 141 19.739 28.356 17.935 1.00 0.00 H new ATOM 0 HE ARG A 141 18.157 26.296 17.219 1.00 0.00 H new ATOM 0 HH11 ARG A 141 17.251 29.350 18.783 1.00 0.00 H new ATOM 0 HH12 ARG A 141 15.584 29.194 18.219 1.00 0.00 H new ATOM 0 HH21 ARG A 141 15.983 26.172 16.724 1.00 0.00 H new ATOM 0 HH22 ARG A 141 14.918 27.520 17.137 1.00 0.00 H new ATOM 2159 N VAL A 142 16.344 24.674 20.472 1.00 0.00 N ATOM 2160 CA VAL A 142 15.283 23.652 20.428 1.00 0.00 C ATOM 2161 C VAL A 142 14.576 23.763 19.088 1.00 0.00 C ATOM 2162 O VAL A 142 14.258 24.865 18.642 1.00 0.00 O ATOM 2163 CB VAL A 142 14.259 23.795 21.575 1.00 0.00 C ATOM 2164 CG1 VAL A 142 13.385 22.545 21.660 1.00 0.00 C ATOM 2165 CG2 VAL A 142 14.930 24.001 22.936 1.00 0.00 C ATOM 0 H VAL A 142 16.054 25.584 20.113 1.00 0.00 H new ATOM 0 HA VAL A 142 15.748 22.674 20.553 1.00 0.00 H new ATOM 0 HB VAL A 142 13.659 24.676 21.346 1.00 0.00 H new ATOM 0 HG11 VAL A 142 12.667 22.658 22.472 1.00 0.00 H new ATOM 0 HG12 VAL A 142 12.851 22.410 20.720 1.00 0.00 H new ATOM 0 HG13 VAL A 142 14.013 21.674 21.849 1.00 0.00 H new ATOM 0 HG21 VAL A 142 14.166 24.096 23.708 1.00 0.00 H new ATOM 0 HG22 VAL A 142 15.568 23.146 23.160 1.00 0.00 H new ATOM 0 HG23 VAL A 142 15.534 24.908 22.910 1.00 0.00 H new ATOM 2175 N GLU A 143 14.337 22.628 18.440 1.00 0.00 N ATOM 2176 CA GLU A 143 13.826 22.555 17.074 1.00 0.00 C ATOM 2177 C GLU A 143 12.640 21.596 17.023 1.00 0.00 C ATOM 2178 O GLU A 143 12.617 20.577 17.721 1.00 0.00 O ATOM 2179 CB GLU A 143 14.909 22.026 16.106 1.00 0.00 C ATOM 2180 CG GLU A 143 16.340 22.568 16.274 1.00 0.00 C ATOM 2181 CD GLU A 143 16.485 24.089 16.088 1.00 0.00 C ATOM 2182 OE1 GLU A 143 15.609 24.753 15.486 1.00 0.00 O ATOM 2183 OE2 GLU A 143 17.490 24.662 16.565 1.00 0.00 O ATOM 0 H GLU A 143 14.497 21.712 18.859 1.00 0.00 H new ATOM 0 HA GLU A 143 13.528 23.559 16.773 1.00 0.00 H new ATOM 0 HB2 GLU A 143 14.947 20.941 16.204 1.00 0.00 H new ATOM 0 HB3 GLU A 143 14.585 22.243 15.088 1.00 0.00 H new ATOM 0 HG2 GLU A 143 16.698 22.303 17.269 1.00 0.00 H new ATOM 0 HG3 GLU A 143 16.989 22.066 15.557 1.00 0.00 H new ATOM 2190 N LEU A 144 11.687 21.834 16.127 1.00 0.00 N ATOM 2191 CA LEU A 144 10.906 20.720 15.609 1.00 0.00 C ATOM 2192 C LEU A 144 11.793 19.739 14.821 1.00 0.00 C ATOM 2193 O LEU A 144 12.751 20.141 14.161 1.00 0.00 O ATOM 2194 CB LEU A 144 9.713 21.240 14.780 1.00 0.00 C ATOM 2195 CG LEU A 144 9.986 21.777 13.357 1.00 0.00 C ATOM 2196 CD1 LEU A 144 8.656 22.163 12.708 1.00 0.00 C ATOM 2197 CD2 LEU A 144 10.890 23.011 13.317 1.00 0.00 C ATOM 0 H LEU A 144 11.444 22.753 15.757 1.00 0.00 H new ATOM 0 HA LEU A 144 10.495 20.158 16.448 1.00 0.00 H new ATOM 0 HB2 LEU A 144 8.989 20.430 14.696 1.00 0.00 H new ATOM 0 HB3 LEU A 144 9.235 22.037 15.350 1.00 0.00 H new ATOM 0 HG LEU A 144 10.500 20.975 12.827 1.00 0.00 H new ATOM 0 HD11 LEU A 144 8.838 22.543 11.703 1.00 0.00 H new ATOM 0 HD12 LEU A 144 8.010 21.287 12.653 1.00 0.00 H new ATOM 0 HD13 LEU A 144 8.170 22.935 13.305 1.00 0.00 H new ATOM 0 HD21 LEU A 144 11.032 23.325 12.283 1.00 0.00 H new ATOM 0 HD22 LEU A 144 10.426 23.820 13.881 1.00 0.00 H new ATOM 0 HD23 LEU A 144 11.857 22.768 13.759 1.00 0.00 H new ATOM 2209 N SER A 145 11.405 18.463 14.871 1.00 0.00 N ATOM 2210 CA SER A 145 11.489 17.440 13.813 1.00 0.00 C ATOM 2211 C SER A 145 12.189 16.140 14.231 1.00 0.00 C ATOM 2212 O SER A 145 13.415 16.053 14.303 1.00 0.00 O ATOM 2213 CB SER A 145 11.938 18.011 12.467 1.00 0.00 C ATOM 2214 OG SER A 145 11.770 17.084 11.418 1.00 0.00 O ATOM 0 H SER A 145 10.989 18.082 15.721 1.00 0.00 H new ATOM 0 HA SER A 145 10.462 17.114 13.650 1.00 0.00 H new ATOM 0 HB2 SER A 145 11.368 18.914 12.248 1.00 0.00 H new ATOM 0 HB3 SER A 145 12.986 18.303 12.529 1.00 0.00 H new ATOM 0 HG SER A 145 12.550 16.492 11.376 1.00 0.00 H new ATOM 2220 N ASN A 146 11.367 15.119 14.522 1.00 0.00 N ATOM 2221 CA ASN A 146 11.792 13.754 14.876 1.00 0.00 C ATOM 2222 C ASN A 146 10.806 12.642 14.445 1.00 0.00 C ATOM 2223 O ASN A 146 10.984 11.480 14.807 1.00 0.00 O ATOM 2224 CB ASN A 146 12.091 13.704 16.392 1.00 0.00 C ATOM 2225 CG ASN A 146 13.376 12.972 16.733 1.00 0.00 C ATOM 2226 OD1 ASN A 146 14.287 12.839 15.927 1.00 0.00 O ATOM 2227 ND2 ASN A 146 13.500 12.489 17.943 1.00 0.00 N ATOM 0 H ASN A 146 10.352 15.224 14.517 1.00 0.00 H new ATOM 0 HA ASN A 146 12.696 13.537 14.306 1.00 0.00 H new ATOM 0 HB2 ASN A 146 12.150 14.722 16.776 1.00 0.00 H new ATOM 0 HB3 ASN A 146 11.259 13.218 16.902 1.00 0.00 H new ATOM 0 HD21 ASN A 146 14.355 12.003 18.213 1.00 0.00 H new ATOM 0 HD22 ASN A 146 12.742 12.599 18.616 1.00 0.00 H new ATOM 2234 N GLY A 147 9.753 12.993 13.692 1.00 0.00 N ATOM 2235 CA GLY A 147 8.705 12.087 13.191 1.00 0.00 C ATOM 2236 C GLY A 147 8.964 11.649 11.740 1.00 0.00 C ATOM 2237 O GLY A 147 8.096 11.089 11.075 1.00 0.00 O ATOM 0 H GLY A 147 9.601 13.959 13.402 1.00 0.00 H new ATOM 0 HA2 GLY A 147 8.652 11.206 13.831 1.00 0.00 H new ATOM 0 HA3 GLY A 147 7.737 12.584 13.252 1.00 0.00 H new ATOM 2241 N GLU A 148 10.181 11.894 11.243 1.00 0.00 N ATOM 2242 CA GLU A 148 10.665 11.576 9.896 1.00 0.00 C ATOM 2243 C GLU A 148 11.640 10.397 9.942 1.00 0.00 C ATOM 2244 O GLU A 148 11.418 9.377 9.292 1.00 0.00 O ATOM 2245 CB GLU A 148 11.294 12.809 9.194 1.00 0.00 C ATOM 2246 CG GLU A 148 11.468 14.112 10.000 1.00 0.00 C ATOM 2247 CD GLU A 148 12.597 14.054 11.045 1.00 0.00 C ATOM 2248 OE1 GLU A 148 12.607 13.134 11.897 1.00 0.00 O ATOM 2249 OE2 GLU A 148 13.472 14.948 11.062 1.00 0.00 O ATOM 0 H GLU A 148 10.899 12.348 11.807 1.00 0.00 H new ATOM 0 HA GLU A 148 9.803 11.284 9.295 1.00 0.00 H new ATOM 0 HB2 GLU A 148 12.277 12.514 8.826 1.00 0.00 H new ATOM 0 HB3 GLU A 148 10.683 13.040 8.321 1.00 0.00 H new ATOM 0 HG2 GLU A 148 11.668 14.931 9.309 1.00 0.00 H new ATOM 0 HG3 GLU A 148 10.530 14.343 10.505 1.00 0.00 H new ATOM 2256 N LYS A 149 12.660 10.501 10.790 1.00 0.00 N ATOM 2257 CA LYS A 149 13.758 9.525 10.934 1.00 0.00 C ATOM 2258 C LYS A 149 13.397 8.224 11.682 1.00 0.00 C ATOM 2259 O LYS A 149 14.276 7.379 11.886 1.00 0.00 O ATOM 2260 CB LYS A 149 15.000 10.240 11.500 1.00 0.00 C ATOM 2261 CG LYS A 149 14.893 10.638 12.984 1.00 0.00 C ATOM 2262 CD LYS A 149 16.105 11.471 13.442 1.00 0.00 C ATOM 2263 CE LYS A 149 16.175 12.888 12.844 1.00 0.00 C ATOM 2264 NZ LYS A 149 15.026 13.724 13.260 1.00 0.00 N ATOM 0 H LYS A 149 12.756 11.294 11.424 1.00 0.00 H new ATOM 0 HA LYS A 149 13.985 9.151 9.936 1.00 0.00 H new ATOM 0 HB2 LYS A 149 15.866 9.590 11.374 1.00 0.00 H new ATOM 0 HB3 LYS A 149 15.186 11.137 10.910 1.00 0.00 H new ATOM 0 HG2 LYS A 149 13.979 11.210 13.142 1.00 0.00 H new ATOM 0 HG3 LYS A 149 14.817 9.740 13.597 1.00 0.00 H new ATOM 0 HD2 LYS A 149 16.084 11.551 14.529 1.00 0.00 H new ATOM 0 HD3 LYS A 149 17.017 10.935 13.179 1.00 0.00 H new ATOM 0 HE2 LYS A 149 17.103 13.367 13.155 1.00 0.00 H new ATOM 0 HE3 LYS A 149 16.200 12.821 11.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 15.251 14.727 13.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 14.188 13.466 12.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 14.830 13.567 14.269 1.00 0.00 H new ATOM 2278 N ARG A 150 12.127 8.042 12.065 1.00 0.00 N ATOM 2279 CA ARG A 150 11.553 6.816 12.664 1.00 0.00 C ATOM 2280 C ARG A 150 10.104 6.552 12.241 1.00 0.00 C ATOM 2281 O ARG A 150 9.623 5.410 12.413 1.00 0.00 O ATOM 2282 CB ARG A 150 11.742 6.821 14.201 1.00 0.00 C ATOM 2283 CG ARG A 150 11.304 8.054 15.031 1.00 0.00 C ATOM 2284 CD ARG A 150 9.846 8.544 14.927 1.00 0.00 C ATOM 2285 NE ARG A 150 8.875 7.461 14.713 1.00 0.00 N ATOM 2286 CZ ARG A 150 8.622 6.439 15.500 1.00 0.00 C ATOM 2287 NH1 ARG A 150 8.778 6.489 16.790 1.00 0.00 N ATOM 2288 NH2 ARG A 150 8.233 5.328 14.957 1.00 0.00 N ATOM 2289 OXT ARG A 150 9.409 7.507 11.824 1.00 0.00 O ATOM 0 H ARG A 150 11.431 8.780 11.963 1.00 0.00 H new ATOM 0 HA ARG A 150 12.112 5.970 12.264 1.00 0.00 H new ATOM 0 HB2 ARG A 150 11.207 5.957 14.596 1.00 0.00 H new ATOM 0 HB3 ARG A 150 12.801 6.657 14.398 1.00 0.00 H new ATOM 0 HG2 ARG A 150 11.503 7.833 16.080 1.00 0.00 H new ATOM 0 HG3 ARG A 150 11.951 8.885 14.752 1.00 0.00 H new ATOM 0 HD2 ARG A 150 9.585 9.079 15.840 1.00 0.00 H new ATOM 0 HD3 ARG A 150 9.769 9.257 14.106 1.00 0.00 H new ATOM 0 HE ARG A 150 8.333 7.508 13.850 1.00 0.00 H new ATOM 0 HH11 ARG A 150 9.109 7.347 17.231 1.00 0.00 H new ATOM 0 HH12 ARG A 150 8.569 5.670 17.361 1.00 0.00 H new ATOM 0 HH21 ARG A 150 8.131 5.264 13.944 1.00 0.00 H new ATOM 0 HH22 ARG A 150 8.029 4.518 15.543 1.00 0.00 H new TER 2303 ARG A 150