USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 896 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 103 THR OG1 : rot -106:sc= 0.618 USER MOD Set 1.2: A 127 CYS SG : rot 129:sc= -3.89! USER MOD Set 2.1: A 105 THR OG1 : rot -88:sc= 1.41 USER MOD Set 2.2: A 108 THR OG1 : rot -120:sc= -0.553 USER MOD Set 3.1: A 24 TYR OH : rot 180:sc= -0.344 USER MOD Set 3.2: A 104 LYS NZ :NH3+ -151:sc= -0.0157 (180deg=-0.218) USER MOD Set 4.1: A 6 TYR OH : rot 180:sc= -3.34 USER MOD Set 4.2: A 133 HIS : no HD1:sc= -8.74! C(o=-12!,f=-12!) USER MOD Single : A 4 ASN : amide:sc= -0.102 X(o=-0.1,f=-0.1) USER MOD Single : A 9 ASN : amide:sc= -4.93! C(o=-4.9!,f=-4.6!) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 15 THR OG1 : rot 19:sc= 0.0107 USER MOD Single : A 16 CYS SG : rot 70:sc= -6.74! USER MOD Single : A 17 GLN : amide:sc= -2.86 K(o=-2.9,f=-3.6) USER MOD Single : A 25 LYS NZ :NH3+ -135:sc= -0.0165 (180deg=-1.74!) USER MOD Single : A 27 SER OG : rot 35:sc= 0.263 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot 19:sc= 1.22 USER MOD Single : A 41 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 THR OG1 : rot 180:sc= -1.58 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -6! C(o=-6!,f=-9.9!) USER MOD Single : A 64 THR OG1 : rot -138:sc= -2.78 USER MOD Single : A 68 GLN :FLIP amide:sc= -10.2! C(o=-12!,f=-10!) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 CYS SG : rot 12:sc= -10.4! USER MOD Single : A 71 SER OG : rot 53:sc= -1.29 USER MOD Single : A 76 SER OG : rot 130:sc= -2.02 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 85 MET CE :methyl -135:sc= -1.87 (180deg=-7.18!) USER MOD Single : A 89 THR OG1 : rot -13:sc= 0.938 USER MOD Single : A 90 LYS NZ :NH3+ -164:sc= -1.27 (180deg=-1.82) USER MOD Single : A 99 ASN : amide:sc= -0.959 X(o=-0.96,f=-1.2!) USER MOD Single : A 101 THR OG1 : rot -61:sc= 0.538 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 LYS NZ :NH3+ -132:sc= -1.03 (180deg=-2.45) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 MET CE :methyl -169:sc= -7.79! (180deg=-9.72!) USER MOD Single : A 132 SER OG : rot -28:sc= -0.0183 USER MOD Single : A 137 SER OG : rot -52:sc= 0.283 USER MOD Single : A 138 GLN : amide:sc= -0.114 X(o=-0.11,f=-0.14) USER MOD Single : A 139 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N TRP A 3 -17.614 14.074 0.692 1.00 0.00 N ATOM 21 CA TRP A 3 -17.201 12.925 -0.202 1.00 0.00 C ATOM 22 C TRP A 3 -17.636 13.169 -1.669 1.00 0.00 C ATOM 23 O TRP A 3 -16.878 12.920 -2.604 1.00 0.00 O ATOM 24 CB TRP A 3 -17.873 11.677 0.288 1.00 0.00 C ATOM 25 CG TRP A 3 -17.032 10.930 1.312 1.00 0.00 C ATOM 26 CD1 TRP A 3 -17.404 9.751 1.813 1.00 0.00 C ATOM 27 CD2 TRP A 3 -15.727 11.251 1.958 1.00 0.00 C ATOM 28 NE1 TRP A 3 -16.455 9.306 2.717 1.00 0.00 N ATOM 29 CE2 TRP A 3 -15.407 10.185 2.839 1.00 0.00 C ATOM 30 CE3 TRP A 3 -14.801 12.327 1.880 1.00 0.00 C ATOM 31 CZ2 TRP A 3 -14.237 10.177 3.596 1.00 0.00 C ATOM 32 CZ3 TRP A 3 -13.623 12.310 2.650 1.00 0.00 C ATOM 33 CH2 TRP A 3 -13.346 11.238 3.503 1.00 0.00 C ATOM 0 HA TRP A 3 -16.115 12.833 -0.170 1.00 0.00 H new ATOM 0 HB2 TRP A 3 -18.835 11.935 0.731 1.00 0.00 H new ATOM 0 HB3 TRP A 3 -18.077 11.021 -0.558 1.00 0.00 H new ATOM 0 HD1 TRP A 3 -18.309 9.223 1.552 1.00 0.00 H new ATOM 0 HE1 TRP A 3 -16.526 8.428 3.232 1.00 0.00 H new ATOM 0 HE3 TRP A 3 -15.003 13.162 1.226 1.00 0.00 H new ATOM 0 HZ2 TRP A 3 -14.024 9.347 4.254 1.00 0.00 H new ATOM 0 HZ3 TRP A 3 -12.927 13.133 2.581 1.00 0.00 H new ATOM 0 HH2 TRP A 3 -12.439 11.235 4.090 1.00 0.00 H new ATOM 44 N ASN A 4 -18.876 13.611 -1.870 1.00 0.00 N ATOM 45 CA ASN A 4 -19.414 13.823 -3.274 1.00 0.00 C ATOM 46 C ASN A 4 -18.656 14.932 -4.019 1.00 0.00 C ATOM 47 O ASN A 4 -18.703 14.994 -5.229 1.00 0.00 O ATOM 48 CB ASN A 4 -20.902 14.183 -3.215 1.00 0.00 C ATOM 49 CG ASN A 4 -21.635 13.206 -2.294 1.00 0.00 C ATOM 50 OD1 ASN A 4 -21.825 12.056 -2.635 1.00 0.00 O ATOM 51 ND2 ASN A 4 -22.052 13.620 -1.132 1.00 0.00 N ATOM 0 H ASN A 4 -19.535 13.833 -1.123 1.00 0.00 H new ATOM 0 HA ASN A 4 -19.273 12.890 -3.820 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -21.025 15.203 -2.850 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -21.334 14.148 -4.215 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -22.539 12.978 -0.507 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -21.892 14.586 -0.847 1.00 0.00 H new ATOM 58 N ALA A 5 -17.975 15.794 -3.300 1.00 0.00 N ATOM 59 CA ALA A 5 -17.178 16.925 -3.947 1.00 0.00 C ATOM 60 C ALA A 5 -15.826 16.361 -4.396 1.00 0.00 C ATOM 61 O ALA A 5 -15.322 16.686 -5.473 1.00 0.00 O ATOM 62 CB ALA A 5 -16.962 18.057 -2.932 1.00 0.00 C ATOM 0 H ALA A 5 -17.928 15.774 -2.281 1.00 0.00 H new ATOM 0 HA ALA A 5 -17.720 17.327 -4.803 1.00 0.00 H new ATOM 0 HB1 ALA A 5 -16.393 18.861 -3.399 1.00 0.00 H new ATOM 0 HB2 ALA A 5 -17.928 18.440 -2.603 1.00 0.00 H new ATOM 0 HB3 ALA A 5 -16.411 17.675 -2.072 1.00 0.00 H new ATOM 68 N TYR A 6 -15.254 15.453 -3.615 1.00 0.00 N ATOM 69 CA TYR A 6 -13.964 14.805 -4.051 1.00 0.00 C ATOM 70 C TYR A 6 -14.317 13.822 -5.172 1.00 0.00 C ATOM 71 O TYR A 6 -13.471 13.388 -5.912 1.00 0.00 O ATOM 72 CB TYR A 6 -13.267 14.159 -2.851 1.00 0.00 C ATOM 73 CG TYR A 6 -13.485 15.066 -1.669 1.00 0.00 C ATOM 74 CD1 TYR A 6 -13.085 16.401 -1.734 1.00 0.00 C ATOM 75 CD2 TYR A 6 -14.140 14.593 -0.571 1.00 0.00 C ATOM 76 CE1 TYR A 6 -13.360 17.262 -0.679 1.00 0.00 C ATOM 77 CE2 TYR A 6 -14.409 15.448 0.510 1.00 0.00 C ATOM 78 CZ TYR A 6 -14.023 16.780 0.450 1.00 0.00 C ATOM 79 OH TYR A 6 -14.312 17.629 1.494 1.00 0.00 O ATOM 0 H TYR A 6 -15.619 15.141 -2.715 1.00 0.00 H new ATOM 0 HA TYR A 6 -13.246 15.527 -4.440 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -13.676 13.168 -2.656 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -12.202 14.031 -3.047 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -12.561 16.765 -2.605 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -14.452 13.560 -0.532 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -13.062 18.299 -0.732 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -14.915 15.070 1.386 1.00 0.00 H new ATOM 0 HH TYR A 6 -14.776 17.133 2.200 1.00 0.00 H new ATOM 89 N ILE A 7 -15.615 13.567 -5.338 1.00 0.00 N ATOM 90 CA ILE A 7 -16.126 12.749 -6.473 1.00 0.00 C ATOM 91 C ILE A 7 -16.394 13.787 -7.630 1.00 0.00 C ATOM 92 O ILE A 7 -16.183 13.529 -8.858 1.00 0.00 O ATOM 93 CB ILE A 7 -17.429 12.045 -6.039 1.00 0.00 C ATOM 94 CG1 ILE A 7 -17.067 10.849 -5.152 1.00 0.00 C ATOM 95 CG2 ILE A 7 -18.238 11.569 -7.254 1.00 0.00 C ATOM 96 CD1 ILE A 7 -16.421 9.733 -5.972 1.00 0.00 C ATOM 0 H ILE A 7 -16.342 13.908 -4.710 1.00 0.00 H new ATOM 0 HA ILE A 7 -15.432 11.972 -6.793 1.00 0.00 H new ATOM 0 HB ILE A 7 -18.047 12.753 -5.488 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -16.384 11.169 -4.365 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -17.964 10.472 -4.661 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -19.150 11.077 -6.914 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -18.498 12.425 -7.876 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -17.642 10.866 -7.835 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -16.174 8.897 -5.318 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -17.116 9.398 -6.742 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -15.511 10.107 -6.442 1.00 0.00 H new ATOM 108 N ASP A 8 -16.796 15.016 -7.227 1.00 0.00 N ATOM 109 CA ASP A 8 -17.020 16.110 -8.206 1.00 0.00 C ATOM 110 C ASP A 8 -15.752 16.256 -9.039 1.00 0.00 C ATOM 111 O ASP A 8 -15.800 16.645 -10.165 1.00 0.00 O ATOM 112 CB ASP A 8 -17.389 17.410 -7.472 1.00 0.00 C ATOM 113 CG ASP A 8 -18.924 17.518 -7.290 1.00 0.00 C ATOM 114 OD1 ASP A 8 -19.657 16.925 -8.077 1.00 0.00 O ATOM 115 OD2 ASP A 8 -19.336 18.198 -6.364 1.00 0.00 O ATOM 0 H ASP A 8 -16.969 15.273 -6.255 1.00 0.00 H new ATOM 0 HA ASP A 8 -17.854 15.880 -8.869 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -16.899 17.436 -6.498 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -17.023 18.268 -8.035 1.00 0.00 H new ATOM 120 N ASN A 9 -14.615 15.843 -8.465 1.00 0.00 N ATOM 121 CA ASN A 9 -13.305 15.815 -9.169 1.00 0.00 C ATOM 122 C ASN A 9 -13.501 15.150 -10.507 1.00 0.00 C ATOM 123 O ASN A 9 -13.323 15.713 -11.527 1.00 0.00 O ATOM 124 CB ASN A 9 -12.371 14.946 -8.240 1.00 0.00 C ATOM 125 CG ASN A 9 -11.484 13.849 -9.014 1.00 0.00 C ATOM 126 OD1 ASN A 9 -10.592 14.199 -9.760 1.00 0.00 O ATOM 127 ND2 ASN A 9 -11.737 12.505 -8.836 1.00 0.00 N ATOM 0 H ASN A 9 -14.566 15.517 -7.500 1.00 0.00 H new ATOM 0 HA ASN A 9 -12.880 16.803 -9.346 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -11.704 15.613 -7.693 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -12.989 14.437 -7.501 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -11.176 11.811 -9.330 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -12.485 12.205 -8.211 1.00 0.00 H new ATOM 134 N LEU A 10 -13.891 13.955 -10.441 1.00 0.00 N ATOM 135 CA LEU A 10 -14.165 13.103 -11.659 1.00 0.00 C ATOM 136 C LEU A 10 -14.927 13.826 -12.684 1.00 0.00 C ATOM 137 O LEU A 10 -14.845 13.563 -13.884 1.00 0.00 O ATOM 138 CB LEU A 10 -15.076 12.051 -11.260 1.00 0.00 C ATOM 139 CG LEU A 10 -14.449 11.223 -10.241 1.00 0.00 C ATOM 140 CD1 LEU A 10 -15.554 10.726 -9.299 1.00 0.00 C ATOM 141 CD2 LEU A 10 -13.679 10.118 -10.961 1.00 0.00 C ATOM 0 H LEU A 10 -14.052 13.470 -9.558 1.00 0.00 H new ATOM 0 HA LEU A 10 -13.199 12.774 -12.042 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -16.000 12.483 -10.874 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -15.345 11.442 -12.123 1.00 0.00 H new ATOM 0 HG LEU A 10 -13.729 11.756 -9.620 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -15.115 10.101 -8.522 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -16.052 11.580 -8.840 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -16.281 10.144 -9.866 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -13.194 9.475 -10.227 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -14.369 9.526 -11.562 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -12.924 10.563 -11.609 1.00 0.00 H new ATOM 153 N MET A 11 -15.776 14.614 -12.206 1.00 0.00 N ATOM 154 CA MET A 11 -16.708 15.293 -13.066 1.00 0.00 C ATOM 155 C MET A 11 -16.066 16.619 -13.618 1.00 0.00 C ATOM 156 O MET A 11 -16.359 17.049 -14.720 1.00 0.00 O ATOM 157 CB MET A 11 -17.991 15.460 -12.204 1.00 0.00 C ATOM 158 CG MET A 11 -18.251 14.085 -11.333 1.00 0.00 C ATOM 159 SD MET A 11 -19.917 13.468 -11.664 1.00 0.00 S ATOM 160 CE MET A 11 -19.472 12.365 -13.038 1.00 0.00 C ATOM 0 H MET A 11 -15.871 14.829 -11.213 1.00 0.00 H new ATOM 0 HA MET A 11 -16.970 14.751 -13.975 1.00 0.00 H new ATOM 0 HB2 MET A 11 -17.883 16.313 -11.534 1.00 0.00 H new ATOM 0 HB3 MET A 11 -18.849 15.665 -12.845 1.00 0.00 H new ATOM 0 HG2 MET A 11 -17.512 13.329 -11.598 1.00 0.00 H new ATOM 0 HG3 MET A 11 -18.132 14.288 -10.269 1.00 0.00 H new ATOM 0 HE1 MET A 11 -20.367 11.866 -13.409 1.00 0.00 H new ATOM 0 HE2 MET A 11 -19.022 12.948 -13.842 1.00 0.00 H new ATOM 0 HE3 MET A 11 -18.759 11.618 -12.689 1.00 0.00 H new ATOM 170 N ALA A 12 -15.177 17.221 -12.851 1.00 0.00 N ATOM 171 CA ALA A 12 -14.447 18.490 -13.261 1.00 0.00 C ATOM 172 C ALA A 12 -13.196 18.251 -14.181 1.00 0.00 C ATOM 173 O ALA A 12 -12.815 19.122 -14.946 1.00 0.00 O ATOM 174 CB ALA A 12 -13.981 19.207 -11.984 1.00 0.00 C ATOM 0 H ALA A 12 -14.915 16.878 -11.927 1.00 0.00 H new ATOM 0 HA ALA A 12 -15.151 19.081 -13.846 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -13.453 20.122 -12.253 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -14.846 19.454 -11.369 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -13.312 18.554 -11.423 1.00 0.00 H new ATOM 180 N ASP A 13 -12.521 17.132 -14.019 1.00 0.00 N ATOM 181 CA ASP A 13 -11.221 16.848 -14.773 1.00 0.00 C ATOM 182 C ASP A 13 -11.238 16.019 -16.102 1.00 0.00 C ATOM 183 O ASP A 13 -10.187 15.643 -16.558 1.00 0.00 O ATOM 184 CB ASP A 13 -10.107 16.397 -13.784 1.00 0.00 C ATOM 185 CG ASP A 13 -10.610 15.793 -12.479 1.00 0.00 C ATOM 186 OD1 ASP A 13 -11.220 16.525 -11.741 1.00 0.00 O ATOM 187 OD2 ASP A 13 -10.290 14.655 -12.196 1.00 0.00 O ATOM 0 H ASP A 13 -12.810 16.384 -13.389 1.00 0.00 H new ATOM 0 HA ASP A 13 -10.997 17.824 -15.204 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -9.472 15.666 -14.284 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -9.479 17.257 -13.551 1.00 0.00 H new ATOM 192 N GLY A 14 -12.384 15.853 -16.764 1.00 0.00 N ATOM 193 CA GLY A 14 -12.468 15.136 -18.178 1.00 0.00 C ATOM 194 C GLY A 14 -11.225 14.214 -18.545 1.00 0.00 C ATOM 195 O GLY A 14 -10.780 14.160 -19.679 1.00 0.00 O ATOM 0 H GLY A 14 -13.286 16.173 -16.411 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -13.372 14.528 -18.206 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -12.574 15.899 -18.949 1.00 0.00 H new ATOM 199 N THR A 15 -10.743 13.521 -17.592 1.00 0.00 N ATOM 200 CA THR A 15 -9.567 12.545 -17.709 1.00 0.00 C ATOM 201 C THR A 15 -9.963 11.436 -16.736 1.00 0.00 C ATOM 202 O THR A 15 -10.051 10.262 -17.058 1.00 0.00 O ATOM 203 CB THR A 15 -8.285 13.256 -17.264 1.00 0.00 C ATOM 204 OG1 THR A 15 -7.827 14.114 -18.305 1.00 0.00 O ATOM 205 CG2 THR A 15 -7.243 12.227 -16.967 1.00 0.00 C ATOM 0 H THR A 15 -11.120 13.568 -16.646 1.00 0.00 H new ATOM 0 HA THR A 15 -9.377 12.169 -18.714 1.00 0.00 H new ATOM 0 HB THR A 15 -8.482 13.852 -16.373 1.00 0.00 H new ATOM 0 HG1 THR A 15 -8.563 14.296 -18.927 1.00 0.00 H new ATOM 0 HG21 THR A 15 -6.325 12.720 -16.649 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.596 11.570 -16.172 1.00 0.00 H new ATOM 0 HG23 THR A 15 -7.047 11.638 -17.863 1.00 0.00 H new ATOM 213 N CYS A 16 -10.299 11.891 -15.592 1.00 0.00 N ATOM 214 CA CYS A 16 -10.835 11.076 -14.497 1.00 0.00 C ATOM 215 C CYS A 16 -12.244 10.590 -14.972 1.00 0.00 C ATOM 216 O CYS A 16 -12.851 11.210 -15.847 1.00 0.00 O ATOM 217 CB CYS A 16 -11.028 12.075 -13.331 1.00 0.00 C ATOM 218 SG CYS A 16 -12.050 13.469 -13.978 1.00 0.00 S ATOM 0 H CYS A 16 -10.217 12.879 -15.351 1.00 0.00 H new ATOM 0 HA CYS A 16 -10.208 10.230 -14.215 1.00 0.00 H new ATOM 0 HB2 CYS A 16 -11.523 11.593 -12.488 1.00 0.00 H new ATOM 0 HB3 CYS A 16 -10.065 12.438 -12.970 1.00 0.00 H new ATOM 0 HG CYS A 16 -13.266 13.057 -14.181 1.00 0.00 H new ATOM 224 N GLN A 17 -12.752 9.505 -14.424 1.00 0.00 N ATOM 225 CA GLN A 17 -14.084 8.980 -14.853 1.00 0.00 C ATOM 226 C GLN A 17 -14.800 8.235 -13.699 1.00 0.00 C ATOM 227 O GLN A 17 -16.022 8.177 -13.665 1.00 0.00 O ATOM 228 CB GLN A 17 -13.900 8.025 -16.015 1.00 0.00 C ATOM 229 CG GLN A 17 -15.203 7.949 -16.818 1.00 0.00 C ATOM 230 CD GLN A 17 -16.184 7.008 -16.118 1.00 0.00 C ATOM 231 OE1 GLN A 17 -15.873 5.858 -15.875 1.00 0.00 O ATOM 232 NE2 GLN A 17 -17.365 7.452 -15.777 1.00 0.00 N ATOM 0 H GLN A 17 -12.293 8.961 -13.693 1.00 0.00 H new ATOM 0 HA GLN A 17 -14.699 9.830 -15.149 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -13.085 8.364 -16.654 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -13.627 7.036 -15.648 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -15.642 8.942 -16.913 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -14.999 7.592 -17.828 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -17.626 8.417 -15.981 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -18.026 6.834 -15.307 1.00 0.00 H new ATOM 241 N ASP A 18 -14.048 7.660 -12.751 1.00 0.00 N ATOM 242 CA ASP A 18 -14.707 6.900 -11.591 1.00 0.00 C ATOM 243 C ASP A 18 -13.796 6.957 -10.358 1.00 0.00 C ATOM 244 O ASP A 18 -12.891 6.174 -10.197 1.00 0.00 O ATOM 245 CB ASP A 18 -14.973 5.436 -11.984 1.00 0.00 C ATOM 246 CG ASP A 18 -15.753 4.743 -10.861 1.00 0.00 C ATOM 247 OD1 ASP A 18 -16.932 5.019 -10.728 1.00 0.00 O ATOM 248 OD2 ASP A 18 -15.157 3.951 -10.155 1.00 0.00 O ATOM 0 H ASP A 18 -13.028 7.682 -12.728 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.662 7.371 -11.358 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -15.539 5.394 -12.915 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -14.030 4.918 -12.161 1.00 0.00 H new ATOM 253 N ALA A 19 -14.077 7.888 -9.498 1.00 0.00 N ATOM 254 CA ALA A 19 -13.295 8.102 -8.259 1.00 0.00 C ATOM 255 C ALA A 19 -13.935 7.288 -7.219 1.00 0.00 C ATOM 256 O ALA A 19 -15.102 7.528 -6.874 1.00 0.00 O ATOM 257 CB ALA A 19 -13.329 9.604 -7.808 1.00 0.00 C ATOM 0 H ALA A 19 -14.854 8.539 -9.612 1.00 0.00 H new ATOM 0 HA ALA A 19 -12.253 7.829 -8.427 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -12.745 9.723 -6.896 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -12.906 10.230 -8.594 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -14.360 9.904 -7.620 1.00 0.00 H new ATOM 263 N ALA A 20 -13.239 6.305 -6.719 1.00 0.00 N ATOM 264 CA ALA A 20 -13.871 5.445 -5.661 1.00 0.00 C ATOM 265 C ALA A 20 -13.195 5.588 -4.329 1.00 0.00 C ATOM 266 O ALA A 20 -12.179 4.953 -4.047 1.00 0.00 O ATOM 267 CB ALA A 20 -13.874 3.997 -6.043 1.00 0.00 C ATOM 0 H ALA A 20 -12.285 6.058 -6.983 1.00 0.00 H new ATOM 0 HA ALA A 20 -14.898 5.799 -5.577 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -14.340 3.412 -5.250 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -14.435 3.866 -6.968 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -12.849 3.657 -6.190 1.00 0.00 H new ATOM 273 N ILE A 21 -13.816 6.332 -3.468 1.00 0.00 N ATOM 274 CA ILE A 21 -13.320 6.453 -2.085 1.00 0.00 C ATOM 275 C ILE A 21 -13.855 5.184 -1.432 1.00 0.00 C ATOM 276 O ILE A 21 -15.027 4.870 -1.604 1.00 0.00 O ATOM 277 CB ILE A 21 -13.881 7.716 -1.423 1.00 0.00 C ATOM 278 CG1 ILE A 21 -13.573 8.922 -2.371 1.00 0.00 C ATOM 279 CG2 ILE A 21 -13.220 7.888 -0.028 1.00 0.00 C ATOM 280 CD1 ILE A 21 -13.645 10.267 -1.638 1.00 0.00 C ATOM 0 H ILE A 21 -14.659 6.869 -3.670 1.00 0.00 H new ATOM 0 HA ILE A 21 -12.237 6.546 -2.005 1.00 0.00 H new ATOM 0 HB ILE A 21 -14.958 7.654 -1.271 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -12.580 8.798 -2.803 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -14.283 8.922 -3.198 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -13.612 8.784 0.452 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -13.443 7.018 0.590 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -12.141 7.982 -0.146 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -13.424 11.074 -2.336 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -14.646 10.405 -1.229 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -12.916 10.279 -0.827 1.00 0.00 H new ATOM 292 N VAL A 22 -13.028 4.399 -0.772 1.00 0.00 N ATOM 293 CA VAL A 22 -13.534 3.102 -0.228 1.00 0.00 C ATOM 294 C VAL A 22 -13.131 2.907 1.246 1.00 0.00 C ATOM 295 O VAL A 22 -11.971 2.687 1.522 1.00 0.00 O ATOM 296 CB VAL A 22 -12.888 1.955 -1.055 1.00 0.00 C ATOM 297 CG1 VAL A 22 -13.455 0.597 -0.617 1.00 0.00 C ATOM 298 CG2 VAL A 22 -13.158 2.167 -2.552 1.00 0.00 C ATOM 0 H VAL A 22 -12.044 4.599 -0.592 1.00 0.00 H new ATOM 0 HA VAL A 22 -14.622 3.098 -0.293 1.00 0.00 H new ATOM 0 HB VAL A 22 -11.812 1.965 -0.879 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -12.994 -0.197 -1.205 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -13.241 0.437 0.440 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.533 0.585 -0.775 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -12.701 1.358 -3.122 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -14.233 2.174 -2.730 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -12.731 3.119 -2.867 1.00 0.00 H new ATOM 308 N GLY A 23 -14.089 2.931 2.191 1.00 0.00 N ATOM 309 CA GLY A 23 -13.734 2.672 3.645 1.00 0.00 C ATOM 310 C GLY A 23 -13.263 1.204 3.734 1.00 0.00 C ATOM 311 O GLY A 23 -14.049 0.304 3.940 1.00 0.00 O ATOM 0 H GLY A 23 -15.076 3.115 2.013 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -12.949 3.351 3.978 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -14.596 2.841 4.290 1.00 0.00 H new ATOM 315 N TYR A 24 -11.987 0.991 3.509 1.00 0.00 N ATOM 316 CA TYR A 24 -11.375 -0.386 3.480 1.00 0.00 C ATOM 317 C TYR A 24 -10.949 -0.880 4.905 1.00 0.00 C ATOM 318 O TYR A 24 -9.983 -1.631 5.029 1.00 0.00 O ATOM 319 CB TYR A 24 -10.135 -0.309 2.526 1.00 0.00 C ATOM 320 CG TYR A 24 -8.891 0.128 3.284 1.00 0.00 C ATOM 321 CD1 TYR A 24 -8.924 1.226 4.156 1.00 0.00 C ATOM 322 CD2 TYR A 24 -7.733 -0.611 3.146 1.00 0.00 C ATOM 323 CE1 TYR A 24 -7.786 1.571 4.879 1.00 0.00 C ATOM 324 CE2 TYR A 24 -6.596 -0.269 3.854 1.00 0.00 C ATOM 325 CZ TYR A 24 -6.615 0.823 4.728 1.00 0.00 C ATOM 326 OH TYR A 24 -5.484 1.154 5.442 1.00 0.00 O ATOM 0 H TYR A 24 -11.317 1.741 3.338 1.00 0.00 H new ATOM 0 HA TYR A 24 -12.109 -1.109 3.123 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -9.963 -1.283 2.068 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -10.337 0.392 1.717 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -9.831 1.803 4.266 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -7.715 -1.462 2.481 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -7.808 2.414 5.554 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -5.691 -0.846 3.732 1.00 0.00 H new ATOM 0 HH TYR A 24 -4.762 0.531 5.218 1.00 0.00 H new ATOM 336 N LYS A 25 -11.650 -0.483 5.957 1.00 0.00 N ATOM 337 CA LYS A 25 -11.279 -0.939 7.331 1.00 0.00 C ATOM 338 C LYS A 25 -11.468 -2.456 7.398 1.00 0.00 C ATOM 339 O LYS A 25 -11.428 -3.125 6.376 1.00 0.00 O ATOM 340 CB LYS A 25 -12.157 -0.217 8.341 1.00 0.00 C ATOM 341 CG LYS A 25 -11.644 1.214 8.513 1.00 0.00 C ATOM 342 CD LYS A 25 -12.054 2.035 7.318 1.00 0.00 C ATOM 343 CE LYS A 25 -12.135 3.502 7.720 1.00 0.00 C ATOM 344 NZ LYS A 25 -13.112 3.666 8.841 1.00 0.00 N ATOM 0 H LYS A 25 -12.460 0.136 5.913 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.239 -0.707 7.563 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.193 -0.207 8.001 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -12.140 -0.741 9.297 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -12.049 1.651 9.426 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.559 1.214 8.614 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.334 1.907 6.510 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -13.019 1.695 6.942 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -11.152 3.860 8.027 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -12.442 4.106 6.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -13.726 4.484 8.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -13.694 2.808 8.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.597 3.821 9.731 1.00 0.00 H new ATOM 358 N ASP A 26 -11.674 -3.005 8.583 1.00 0.00 N ATOM 359 CA ASP A 26 -11.890 -4.526 8.750 1.00 0.00 C ATOM 360 C ASP A 26 -12.786 -5.029 7.615 1.00 0.00 C ATOM 361 O ASP A 26 -12.390 -5.866 6.812 1.00 0.00 O ATOM 362 CB ASP A 26 -12.567 -4.843 10.096 1.00 0.00 C ATOM 363 CG ASP A 26 -13.487 -3.691 10.556 1.00 0.00 C ATOM 364 OD1 ASP A 26 -12.978 -2.743 11.132 1.00 0.00 O ATOM 365 OD2 ASP A 26 -14.684 -3.787 10.333 1.00 0.00 O ATOM 0 H ASP A 26 -11.705 -2.478 9.456 1.00 0.00 H new ATOM 0 HA ASP A 26 -10.919 -5.020 8.723 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -13.150 -5.760 10.004 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -11.804 -5.025 10.853 1.00 0.00 H new ATOM 370 N SER A 27 -13.958 -4.460 7.527 1.00 0.00 N ATOM 371 CA SER A 27 -14.898 -4.780 6.456 1.00 0.00 C ATOM 372 C SER A 27 -14.887 -3.562 5.516 1.00 0.00 C ATOM 373 O SER A 27 -15.129 -2.456 5.974 1.00 0.00 O ATOM 374 CB SER A 27 -16.278 -4.980 7.046 1.00 0.00 C ATOM 375 OG SER A 27 -16.539 -3.967 8.012 1.00 0.00 O ATOM 0 H SER A 27 -14.299 -3.762 8.188 1.00 0.00 H new ATOM 0 HA SER A 27 -14.627 -5.692 5.924 1.00 0.00 H new ATOM 0 HB2 SER A 27 -17.030 -4.946 6.257 1.00 0.00 H new ATOM 0 HB3 SER A 27 -16.347 -5.964 7.509 1.00 0.00 H new ATOM 0 HG SER A 27 -16.119 -3.128 7.728 1.00 0.00 H new ATOM 381 N PRO A 28 -14.545 -3.771 4.237 1.00 0.00 N ATOM 382 CA PRO A 28 -14.436 -2.680 3.283 1.00 0.00 C ATOM 383 C PRO A 28 -15.799 -2.230 2.786 1.00 0.00 C ATOM 384 O PRO A 28 -16.792 -2.938 2.919 1.00 0.00 O ATOM 385 CB PRO A 28 -13.584 -3.254 2.162 1.00 0.00 C ATOM 386 CG PRO A 28 -13.698 -4.790 2.281 1.00 0.00 C ATOM 387 CD PRO A 28 -14.263 -5.092 3.656 1.00 0.00 C ATOM 0 HA PRO A 28 -13.993 -1.786 3.722 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -13.937 -2.911 1.189 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -12.547 -2.932 2.256 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -14.347 -5.189 1.502 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -12.722 -5.259 2.154 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -15.167 -5.697 3.589 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -13.550 -5.649 4.264 1.00 0.00 H new ATOM 395 N SER A 29 -15.846 -1.040 2.215 1.00 0.00 N ATOM 396 CA SER A 29 -17.105 -0.485 1.698 1.00 0.00 C ATOM 397 C SER A 29 -16.791 0.714 0.835 1.00 0.00 C ATOM 398 O SER A 29 -15.700 1.271 0.892 1.00 0.00 O ATOM 399 CB SER A 29 -18.005 -0.066 2.861 1.00 0.00 C ATOM 400 OG SER A 29 -17.260 0.743 3.766 1.00 0.00 O ATOM 0 H SER A 29 -15.035 -0.433 2.093 1.00 0.00 H new ATOM 0 HA SER A 29 -17.625 -1.239 1.107 1.00 0.00 H new ATOM 0 HB2 SER A 29 -18.868 0.486 2.488 1.00 0.00 H new ATOM 0 HB3 SER A 29 -18.389 -0.947 3.375 1.00 0.00 H new ATOM 0 HG SER A 29 -17.835 1.014 4.512 1.00 0.00 H new ATOM 406 N VAL A 30 -17.731 1.102 0.028 1.00 0.00 N ATOM 407 CA VAL A 30 -17.546 2.238 -0.868 1.00 0.00 C ATOM 408 C VAL A 30 -18.066 3.498 -0.189 1.00 0.00 C ATOM 409 O VAL A 30 -19.266 3.731 -0.111 1.00 0.00 O ATOM 410 CB VAL A 30 -18.287 1.919 -2.138 1.00 0.00 C ATOM 411 CG1 VAL A 30 -18.334 3.136 -3.064 1.00 0.00 C ATOM 412 CG2 VAL A 30 -17.533 0.778 -2.807 1.00 0.00 C ATOM 0 H VAL A 30 -18.645 0.655 -0.040 1.00 0.00 H new ATOM 0 HA VAL A 30 -16.497 2.416 -1.104 1.00 0.00 H new ATOM 0 HB VAL A 30 -19.319 1.641 -1.922 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -18.875 2.879 -3.975 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -18.842 3.958 -2.559 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -17.318 3.439 -3.318 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -18.033 0.508 -3.737 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -16.512 1.093 -3.022 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -17.514 -0.085 -2.141 1.00 0.00 H new ATOM 422 N TRP A 31 -17.150 4.292 0.313 1.00 0.00 N ATOM 423 CA TRP A 31 -17.506 5.546 1.013 1.00 0.00 C ATOM 424 C TRP A 31 -18.051 6.565 0.019 1.00 0.00 C ATOM 425 O TRP A 31 -18.862 7.411 0.374 1.00 0.00 O ATOM 426 CB TRP A 31 -16.246 6.077 1.718 1.00 0.00 C ATOM 427 CG TRP A 31 -16.137 5.463 3.105 1.00 0.00 C ATOM 428 CD1 TRP A 31 -16.881 4.414 3.561 1.00 0.00 C ATOM 429 CD2 TRP A 31 -15.251 5.827 4.207 1.00 0.00 C ATOM 430 NE1 TRP A 31 -16.531 4.141 4.844 1.00 0.00 N ATOM 431 CE2 TRP A 31 -15.532 4.977 5.300 1.00 0.00 C ATOM 432 CE3 TRP A 31 -14.248 6.806 4.372 1.00 0.00 C ATOM 433 CZ2 TRP A 31 -14.854 5.091 6.508 1.00 0.00 C ATOM 434 CZ3 TRP A 31 -13.563 6.919 5.595 1.00 0.00 C ATOM 435 CH2 TRP A 31 -13.869 6.067 6.658 1.00 0.00 C ATOM 0 H TRP A 31 -16.148 4.109 0.260 1.00 0.00 H new ATOM 0 HA TRP A 31 -18.285 5.362 1.753 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -15.360 5.834 1.132 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -16.290 7.163 1.793 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -17.630 3.884 2.991 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -16.957 3.404 5.406 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -14.006 7.471 3.556 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -15.089 4.427 7.327 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -12.795 7.670 5.713 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -13.343 6.164 7.596 1.00 0.00 H new ATOM 446 N ALA A 32 -17.627 6.476 -1.228 1.00 0.00 N ATOM 447 CA ALA A 32 -18.135 7.433 -2.282 1.00 0.00 C ATOM 448 C ALA A 32 -17.512 7.123 -3.648 1.00 0.00 C ATOM 449 O ALA A 32 -16.558 7.769 -4.081 1.00 0.00 O ATOM 450 CB ALA A 32 -17.807 8.888 -1.876 1.00 0.00 C ATOM 0 H ALA A 32 -16.954 5.786 -1.562 1.00 0.00 H new ATOM 0 HA ALA A 32 -19.216 7.313 -2.360 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -18.176 9.571 -2.641 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -18.285 9.117 -0.924 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -16.728 9.004 -1.777 1.00 0.00 H new ATOM 456 N ALA A 33 -18.074 6.157 -4.347 1.00 0.00 N ATOM 457 CA ALA A 33 -17.572 5.804 -5.699 1.00 0.00 C ATOM 458 C ALA A 33 -18.660 6.100 -6.691 1.00 0.00 C ATOM 459 O ALA A 33 -19.806 5.716 -6.491 1.00 0.00 O ATOM 460 CB ALA A 33 -17.220 4.323 -5.780 1.00 0.00 C ATOM 0 H ALA A 33 -18.866 5.600 -4.026 1.00 0.00 H new ATOM 0 HA ALA A 33 -16.674 6.384 -5.912 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -16.855 4.090 -6.780 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -16.446 4.092 -5.048 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -18.107 3.726 -5.570 1.00 0.00 H new ATOM 466 N VAL A 34 -18.321 6.780 -7.769 1.00 0.00 N ATOM 467 CA VAL A 34 -19.366 7.118 -8.830 1.00 0.00 C ATOM 468 C VAL A 34 -20.144 5.807 -9.192 1.00 0.00 C ATOM 469 O VAL A 34 -19.539 4.862 -9.672 1.00 0.00 O ATOM 470 CB VAL A 34 -18.676 7.705 -10.070 1.00 0.00 C ATOM 471 CG1 VAL A 34 -19.723 8.114 -11.115 1.00 0.00 C ATOM 472 CG2 VAL A 34 -17.894 8.939 -9.656 1.00 0.00 C ATOM 0 H VAL A 34 -17.379 7.117 -7.969 1.00 0.00 H new ATOM 0 HA VAL A 34 -20.067 7.862 -8.452 1.00 0.00 H new ATOM 0 HB VAL A 34 -18.012 6.955 -10.500 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -19.222 8.529 -11.989 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -20.303 7.240 -11.410 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -20.389 8.864 -10.689 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -17.399 9.366 -10.528 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -18.575 9.675 -9.229 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -17.146 8.663 -8.913 1.00 0.00 H new ATOM 482 N PRO A 35 -21.467 5.764 -8.888 1.00 0.00 N ATOM 483 CA PRO A 35 -22.287 4.553 -9.112 1.00 0.00 C ATOM 484 C PRO A 35 -22.578 4.311 -10.594 1.00 0.00 C ATOM 485 O PRO A 35 -22.761 5.242 -11.367 1.00 0.00 O ATOM 486 CB PRO A 35 -23.587 4.832 -8.341 1.00 0.00 C ATOM 487 CG PRO A 35 -23.680 6.375 -8.192 1.00 0.00 C ATOM 488 CD PRO A 35 -22.236 6.906 -8.320 1.00 0.00 C ATOM 0 HA PRO A 35 -21.772 3.654 -8.774 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -24.450 4.440 -8.879 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -23.572 4.347 -7.365 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -24.322 6.803 -8.962 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -24.112 6.648 -7.229 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -22.190 7.778 -8.972 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -21.838 7.210 -7.352 1.00 0.00 H new ATOM 496 N GLY A 36 -22.632 3.040 -10.984 1.00 0.00 N ATOM 497 CA GLY A 36 -22.922 2.672 -12.409 1.00 0.00 C ATOM 498 C GLY A 36 -21.637 2.220 -13.117 1.00 0.00 C ATOM 499 O GLY A 36 -21.698 1.599 -14.173 1.00 0.00 O ATOM 0 H GLY A 36 -22.485 2.245 -10.363 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -23.663 1.873 -12.441 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -23.352 3.527 -12.932 1.00 0.00 H new ATOM 503 N LYS A 37 -20.467 2.550 -12.562 1.00 0.00 N ATOM 504 CA LYS A 37 -19.174 2.167 -13.223 1.00 0.00 C ATOM 505 C LYS A 37 -18.724 0.749 -12.800 1.00 0.00 C ATOM 506 O LYS A 37 -19.045 -0.221 -13.478 1.00 0.00 O ATOM 507 CB LYS A 37 -18.101 3.197 -12.868 1.00 0.00 C ATOM 508 CG LYS A 37 -18.261 4.425 -13.773 1.00 0.00 C ATOM 509 CD LYS A 37 -19.398 5.313 -13.246 1.00 0.00 C ATOM 510 CE LYS A 37 -20.716 4.968 -13.963 1.00 0.00 C ATOM 511 NZ LYS A 37 -21.184 6.147 -14.743 1.00 0.00 N ATOM 0 H LYS A 37 -20.367 3.064 -11.687 1.00 0.00 H new ATOM 0 HA LYS A 37 -19.324 2.154 -14.303 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -18.191 3.488 -11.821 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -17.109 2.764 -12.994 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -17.329 4.990 -13.803 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -18.476 4.110 -14.794 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -19.512 5.171 -12.171 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -19.153 6.363 -13.405 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -20.569 4.116 -14.626 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -21.473 4.678 -13.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -22.074 5.912 -15.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -21.341 6.949 -14.100 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -20.464 6.404 -15.448 1.00 0.00 H new ATOM 525 N THR A 38 -17.954 0.617 -11.707 1.00 0.00 N ATOM 526 CA THR A 38 -17.465 -0.750 -11.291 1.00 0.00 C ATOM 527 C THR A 38 -16.846 -0.707 -9.865 1.00 0.00 C ATOM 528 O THR A 38 -17.009 -1.637 -9.091 1.00 0.00 O ATOM 529 CB THR A 38 -16.422 -1.209 -12.360 1.00 0.00 C ATOM 530 OG1 THR A 38 -17.098 -1.916 -13.390 1.00 0.00 O ATOM 531 CG2 THR A 38 -15.314 -2.122 -11.772 1.00 0.00 C ATOM 0 H THR A 38 -17.657 1.386 -11.107 1.00 0.00 H new ATOM 0 HA THR A 38 -18.290 -1.461 -11.244 1.00 0.00 H new ATOM 0 HB THR A 38 -15.936 -0.312 -12.743 1.00 0.00 H new ATOM 0 HG1 THR A 38 -18.054 -1.701 -13.361 1.00 0.00 H new ATOM 0 HG21 THR A 38 -14.620 -2.408 -12.563 1.00 0.00 H new ATOM 0 HG22 THR A 38 -14.774 -1.584 -10.993 1.00 0.00 H new ATOM 0 HG23 THR A 38 -15.768 -3.017 -11.347 1.00 0.00 H new ATOM 539 N PHE A 39 -16.120 0.346 -9.546 1.00 0.00 N ATOM 540 CA PHE A 39 -15.442 0.452 -8.192 1.00 0.00 C ATOM 541 C PHE A 39 -16.441 0.414 -7.053 1.00 0.00 C ATOM 542 O PHE A 39 -16.193 -0.186 -6.036 1.00 0.00 O ATOM 543 CB PHE A 39 -14.710 1.767 -8.103 1.00 0.00 C ATOM 544 CG PHE A 39 -13.566 1.871 -9.134 1.00 0.00 C ATOM 545 CD1 PHE A 39 -13.283 0.808 -10.032 1.00 0.00 C ATOM 546 CD2 PHE A 39 -12.777 3.041 -9.182 1.00 0.00 C ATOM 547 CE1 PHE A 39 -12.246 0.925 -10.952 1.00 0.00 C ATOM 548 CE2 PHE A 39 -11.740 3.138 -10.106 1.00 0.00 C ATOM 549 CZ PHE A 39 -11.478 2.084 -10.992 1.00 0.00 C ATOM 0 H PHE A 39 -15.964 1.143 -10.163 1.00 0.00 H new ATOM 0 HA PHE A 39 -14.764 -0.397 -8.103 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -15.414 2.584 -8.261 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -14.303 1.887 -7.099 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -13.875 -0.095 -10.001 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -12.977 3.858 -8.504 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -12.037 0.115 -11.636 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -11.134 4.031 -10.140 1.00 0.00 H new ATOM 0 HZ PHE A 39 -10.676 2.172 -11.709 1.00 0.00 H new ATOM 559 N VAL A 40 -17.548 1.085 -7.216 1.00 0.00 N ATOM 560 CA VAL A 40 -18.607 1.146 -6.152 1.00 0.00 C ATOM 561 C VAL A 40 -19.057 -0.291 -5.792 1.00 0.00 C ATOM 562 O VAL A 40 -19.580 -0.535 -4.707 1.00 0.00 O ATOM 563 CB VAL A 40 -19.797 1.986 -6.664 1.00 0.00 C ATOM 564 CG1 VAL A 40 -20.159 1.542 -8.077 1.00 0.00 C ATOM 565 CG2 VAL A 40 -21.006 1.819 -5.724 1.00 0.00 C ATOM 0 H VAL A 40 -17.774 1.609 -8.062 1.00 0.00 H new ATOM 0 HA VAL A 40 -18.210 1.619 -5.254 1.00 0.00 H new ATOM 0 HB VAL A 40 -19.516 3.039 -6.681 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -20.999 2.134 -8.440 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -19.302 1.687 -8.735 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -20.435 0.488 -8.068 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -21.840 2.416 -6.094 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -21.298 0.769 -5.690 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -20.737 2.154 -4.722 1.00 0.00 H new ATOM 575 N ASN A 41 -18.831 -1.237 -6.679 1.00 0.00 N ATOM 576 CA ASN A 41 -19.197 -2.637 -6.403 1.00 0.00 C ATOM 577 C ASN A 41 -17.981 -3.337 -5.761 1.00 0.00 C ATOM 578 O ASN A 41 -17.794 -4.542 -5.909 1.00 0.00 O ATOM 579 CB ASN A 41 -19.566 -3.311 -7.716 1.00 0.00 C ATOM 580 CG ASN A 41 -21.023 -2.987 -8.065 1.00 0.00 C ATOM 581 OD1 ASN A 41 -21.933 -3.609 -7.555 1.00 0.00 O ATOM 582 ND2 ASN A 41 -21.282 -2.030 -8.916 1.00 0.00 N ATOM 0 H ASN A 41 -18.402 -1.080 -7.591 1.00 0.00 H new ATOM 0 HA ASN A 41 -20.047 -2.694 -5.724 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -18.905 -2.967 -8.512 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -19.432 -4.390 -7.634 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -22.249 -1.805 -9.152 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -20.518 -1.508 -9.344 1.00 0.00 H new ATOM 589 N ILE A 42 -17.128 -2.568 -5.048 1.00 0.00 N ATOM 590 CA ILE A 42 -15.928 -3.151 -4.422 1.00 0.00 C ATOM 591 C ILE A 42 -16.324 -4.025 -3.183 1.00 0.00 C ATOM 592 O ILE A 42 -17.402 -3.927 -2.622 1.00 0.00 O ATOM 593 CB ILE A 42 -14.936 -1.986 -4.050 1.00 0.00 C ATOM 594 CG1 ILE A 42 -14.008 -1.739 -5.256 1.00 0.00 C ATOM 595 CG2 ILE A 42 -14.068 -2.333 -2.814 1.00 0.00 C ATOM 596 CD1 ILE A 42 -13.572 -0.267 -5.302 1.00 0.00 C ATOM 0 H ILE A 42 -17.246 -1.566 -4.896 1.00 0.00 H new ATOM 0 HA ILE A 42 -15.422 -3.820 -5.119 1.00 0.00 H new ATOM 0 HB ILE A 42 -15.523 -1.100 -3.806 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -13.131 -2.383 -5.186 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -14.524 -2.001 -6.180 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -13.399 -1.501 -2.594 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -14.714 -2.516 -1.955 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -13.479 -3.227 -3.022 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -12.917 -0.108 -6.159 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -14.451 0.370 -5.394 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -13.037 -0.017 -4.386 1.00 0.00 H new ATOM 608 N THR A 43 -15.416 -4.871 -2.825 1.00 0.00 N ATOM 609 CA THR A 43 -15.549 -5.849 -1.687 1.00 0.00 C ATOM 610 C THR A 43 -14.114 -6.042 -1.088 1.00 0.00 C ATOM 611 O THR A 43 -13.184 -5.459 -1.610 1.00 0.00 O ATOM 612 CB THR A 43 -16.045 -7.177 -2.310 1.00 0.00 C ATOM 613 OG1 THR A 43 -15.311 -7.447 -3.496 1.00 0.00 O ATOM 614 CG2 THR A 43 -17.525 -7.059 -2.653 1.00 0.00 C ATOM 0 H THR A 43 -14.517 -4.939 -3.302 1.00 0.00 H new ATOM 0 HA THR A 43 -16.235 -5.516 -0.908 1.00 0.00 H new ATOM 0 HB THR A 43 -15.899 -7.987 -1.595 1.00 0.00 H new ATOM 0 HG1 THR A 43 -15.624 -8.288 -3.890 1.00 0.00 H new ATOM 0 HG21 THR A 43 -17.873 -7.994 -3.091 1.00 0.00 H new ATOM 0 HG22 THR A 43 -18.093 -6.850 -1.747 1.00 0.00 H new ATOM 0 HG23 THR A 43 -17.670 -6.248 -3.367 1.00 0.00 H new ATOM 622 N PRO A 44 -13.941 -6.880 -0.029 1.00 0.00 N ATOM 623 CA PRO A 44 -12.590 -7.127 0.543 1.00 0.00 C ATOM 624 C PRO A 44 -11.728 -8.008 -0.372 1.00 0.00 C ATOM 625 O PRO A 44 -10.579 -8.306 -0.062 1.00 0.00 O ATOM 626 CB PRO A 44 -12.857 -7.796 1.864 1.00 0.00 C ATOM 627 CG PRO A 44 -14.290 -8.391 1.789 1.00 0.00 C ATOM 628 CD PRO A 44 -15.024 -7.622 0.662 1.00 0.00 C ATOM 0 HA PRO A 44 -12.022 -6.203 0.654 1.00 0.00 H new ATOM 0 HB2 PRO A 44 -12.123 -8.579 2.055 1.00 0.00 H new ATOM 0 HB3 PRO A 44 -12.779 -7.080 2.682 1.00 0.00 H new ATOM 0 HG2 PRO A 44 -14.256 -9.459 1.573 1.00 0.00 H new ATOM 0 HG3 PRO A 44 -14.809 -8.275 2.740 1.00 0.00 H new ATOM 0 HD2 PRO A 44 -15.538 -8.303 -0.017 1.00 0.00 H new ATOM 0 HD3 PRO A 44 -15.777 -6.945 1.065 1.00 0.00 H new ATOM 636 N ALA A 45 -12.264 -8.384 -1.500 1.00 0.00 N ATOM 637 CA ALA A 45 -11.515 -9.202 -2.492 1.00 0.00 C ATOM 638 C ALA A 45 -10.703 -8.244 -3.348 1.00 0.00 C ATOM 639 O ALA A 45 -9.462 -8.231 -3.325 1.00 0.00 O ATOM 640 CB ALA A 45 -12.521 -9.952 -3.361 1.00 0.00 C ATOM 0 H ALA A 45 -13.216 -8.151 -1.782 1.00 0.00 H new ATOM 0 HA ALA A 45 -10.858 -9.922 -2.005 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -11.988 -10.557 -4.094 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -13.133 -10.599 -2.733 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -13.161 -9.236 -3.877 1.00 0.00 H new ATOM 646 N GLU A 46 -11.406 -7.414 -4.072 1.00 0.00 N ATOM 647 CA GLU A 46 -10.727 -6.372 -4.943 1.00 0.00 C ATOM 648 C GLU A 46 -9.886 -5.454 -4.045 1.00 0.00 C ATOM 649 O GLU A 46 -8.797 -5.031 -4.413 1.00 0.00 O ATOM 650 CB GLU A 46 -11.749 -5.533 -5.759 1.00 0.00 C ATOM 651 CG GLU A 46 -13.081 -5.402 -5.055 1.00 0.00 C ATOM 652 CD GLU A 46 -14.094 -6.372 -5.680 1.00 0.00 C ATOM 653 OE1 GLU A 46 -13.791 -7.552 -5.753 1.00 0.00 O ATOM 654 OE2 GLU A 46 -15.155 -5.916 -6.070 1.00 0.00 O ATOM 0 H GLU A 46 -12.425 -7.402 -4.107 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.092 -6.887 -5.665 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -11.338 -4.540 -5.940 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -11.900 -5.997 -6.733 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -12.965 -5.617 -3.993 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -13.446 -4.378 -5.135 1.00 0.00 H new ATOM 661 N VAL A 47 -10.365 -5.211 -2.841 1.00 0.00 N ATOM 662 CA VAL A 47 -9.611 -4.405 -1.839 1.00 0.00 C ATOM 663 C VAL A 47 -8.584 -5.302 -1.127 1.00 0.00 C ATOM 664 O VAL A 47 -7.579 -4.821 -0.633 1.00 0.00 O ATOM 665 CB VAL A 47 -10.633 -3.693 -0.900 1.00 0.00 C ATOM 666 CG1 VAL A 47 -10.156 -3.578 0.503 1.00 0.00 C ATOM 667 CG2 VAL A 47 -10.755 -2.238 -1.352 1.00 0.00 C ATOM 0 H VAL A 47 -11.269 -5.549 -2.512 1.00 0.00 H new ATOM 0 HA VAL A 47 -9.025 -3.613 -2.305 1.00 0.00 H new ATOM 0 HB VAL A 47 -11.551 -4.279 -0.947 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -10.912 -3.074 1.104 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -9.974 -4.573 0.908 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -9.231 -3.002 0.527 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -11.465 -1.716 -0.711 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -9.781 -1.753 -1.285 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -11.106 -2.206 -2.383 1.00 0.00 H new ATOM 677 N GLY A 48 -8.815 -6.601 -1.122 1.00 0.00 N ATOM 678 CA GLY A 48 -7.845 -7.557 -0.502 1.00 0.00 C ATOM 679 C GLY A 48 -6.492 -7.428 -1.214 1.00 0.00 C ATOM 680 O GLY A 48 -5.455 -7.690 -0.641 1.00 0.00 O ATOM 0 H GLY A 48 -9.643 -7.038 -1.526 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -7.733 -7.343 0.561 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -8.218 -8.578 -0.584 1.00 0.00 H new ATOM 684 N VAL A 49 -6.519 -7.034 -2.471 1.00 0.00 N ATOM 685 CA VAL A 49 -5.234 -6.872 -3.273 1.00 0.00 C ATOM 686 C VAL A 49 -4.783 -5.403 -3.255 1.00 0.00 C ATOM 687 O VAL A 49 -3.596 -5.111 -3.155 1.00 0.00 O ATOM 688 CB VAL A 49 -5.434 -7.355 -4.728 1.00 0.00 C ATOM 689 CG1 VAL A 49 -6.504 -6.520 -5.429 1.00 0.00 C ATOM 690 CG2 VAL A 49 -4.110 -7.227 -5.493 1.00 0.00 C ATOM 0 H VAL A 49 -7.372 -6.815 -2.985 1.00 0.00 H new ATOM 0 HA VAL A 49 -4.459 -7.485 -2.813 1.00 0.00 H new ATOM 0 HB VAL A 49 -5.756 -8.396 -4.710 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -6.630 -6.875 -6.452 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -7.448 -6.614 -4.893 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -6.198 -5.474 -5.443 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -4.248 -7.567 -6.519 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -3.791 -6.185 -5.496 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -3.349 -7.838 -5.008 1.00 0.00 H new ATOM 700 N LEU A 50 -5.722 -4.498 -3.303 1.00 0.00 N ATOM 701 CA LEU A 50 -5.412 -3.040 -3.240 1.00 0.00 C ATOM 702 C LEU A 50 -4.895 -2.659 -1.856 1.00 0.00 C ATOM 703 O LEU A 50 -4.470 -1.527 -1.643 1.00 0.00 O ATOM 704 CB LEU A 50 -6.715 -2.275 -3.470 1.00 0.00 C ATOM 705 CG LEU A 50 -6.962 -1.896 -4.922 1.00 0.00 C ATOM 706 CD1 LEU A 50 -8.485 -1.838 -5.164 1.00 0.00 C ATOM 707 CD2 LEU A 50 -6.390 -0.496 -5.162 1.00 0.00 C ATOM 0 H LEU A 50 -6.716 -4.713 -3.385 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.656 -2.802 -3.988 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -7.548 -2.883 -3.117 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -6.703 -1.368 -2.865 1.00 0.00 H new ATOM 0 HG LEU A 50 -6.495 -2.624 -5.586 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -8.678 -1.567 -6.202 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -8.924 -2.814 -4.956 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -8.930 -1.092 -4.505 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.558 -0.207 -6.199 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.884 0.217 -4.502 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.320 -0.500 -4.955 1.00 0.00 H new ATOM 719 N VAL A 51 -5.030 -3.553 -0.884 1.00 0.00 N ATOM 720 CA VAL A 51 -4.658 -3.189 0.534 1.00 0.00 C ATOM 721 C VAL A 51 -4.107 -4.405 1.338 1.00 0.00 C ATOM 722 O VAL A 51 -3.385 -4.228 2.312 1.00 0.00 O ATOM 723 CB VAL A 51 -5.976 -2.593 1.218 1.00 0.00 C ATOM 724 CG1 VAL A 51 -6.816 -1.793 0.186 1.00 0.00 C ATOM 725 CG2 VAL A 51 -6.869 -3.728 1.780 1.00 0.00 C ATOM 0 H VAL A 51 -5.377 -4.504 -1.012 1.00 0.00 H new ATOM 0 HA VAL A 51 -3.850 -2.457 0.529 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.650 -1.939 2.027 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.708 -1.396 0.672 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -6.220 -0.969 -0.208 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -7.111 -2.451 -0.632 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -7.758 -3.297 2.240 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.166 -4.393 0.969 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -6.312 -4.293 2.527 1.00 0.00 H new ATOM 735 N GLY A 52 -4.460 -5.609 0.945 1.00 0.00 N ATOM 736 CA GLY A 52 -3.990 -6.842 1.683 1.00 0.00 C ATOM 737 C GLY A 52 -2.480 -6.987 1.546 1.00 0.00 C ATOM 738 O GLY A 52 -1.958 -7.205 0.459 1.00 0.00 O ATOM 0 H GLY A 52 -5.057 -5.797 0.140 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -4.263 -6.772 2.736 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -4.486 -7.726 1.283 1.00 0.00 H new ATOM 822 N PHE A 58 0.464 -8.939 -7.027 1.00 0.00 N ATOM 823 CA PHE A 58 -0.222 -7.708 -7.695 1.00 0.00 C ATOM 824 C PHE A 58 0.752 -6.592 -8.074 1.00 0.00 C ATOM 825 O PHE A 58 0.472 -5.812 -8.972 1.00 0.00 O ATOM 826 CB PHE A 58 -1.399 -7.137 -6.841 1.00 0.00 C ATOM 827 CG PHE A 58 -0.952 -6.240 -5.674 1.00 0.00 C ATOM 828 CD1 PHE A 58 -0.323 -4.994 -5.892 1.00 0.00 C ATOM 829 CD2 PHE A 58 -1.211 -6.654 -4.379 1.00 0.00 C ATOM 830 CE1 PHE A 58 0.041 -4.197 -4.808 1.00 0.00 C ATOM 831 CE2 PHE A 58 -0.848 -5.853 -3.294 1.00 0.00 C ATOM 832 CZ PHE A 58 -0.222 -4.628 -3.509 1.00 0.00 C ATOM 0 HA PHE A 58 -0.636 -8.099 -8.625 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -2.061 -6.565 -7.491 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.982 -7.968 -6.444 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -0.124 -4.659 -6.899 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -1.697 -7.603 -4.206 1.00 0.00 H new ATOM 0 HE1 PHE A 58 0.526 -3.247 -4.974 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -1.053 -6.184 -2.287 1.00 0.00 H new ATOM 0 HZ PHE A 58 0.060 -4.011 -2.668 1.00 0.00 H new ATOM 842 N TYR A 59 1.858 -6.458 -7.367 1.00 0.00 N ATOM 843 CA TYR A 59 2.818 -5.329 -7.658 1.00 0.00 C ATOM 844 C TYR A 59 3.330 -5.331 -9.092 1.00 0.00 C ATOM 845 O TYR A 59 3.986 -4.384 -9.516 1.00 0.00 O ATOM 846 CB TYR A 59 3.990 -5.397 -6.701 1.00 0.00 C ATOM 847 CG TYR A 59 3.529 -5.067 -5.303 1.00 0.00 C ATOM 848 CD1 TYR A 59 3.540 -3.747 -4.872 1.00 0.00 C ATOM 849 CD2 TYR A 59 3.117 -6.085 -4.437 1.00 0.00 C ATOM 850 CE1 TYR A 59 3.141 -3.431 -3.564 1.00 0.00 C ATOM 851 CE2 TYR A 59 2.711 -5.775 -3.134 1.00 0.00 C ATOM 852 CZ TYR A 59 2.725 -4.446 -2.695 1.00 0.00 C ATOM 853 OH TYR A 59 2.338 -4.135 -1.404 1.00 0.00 O ATOM 0 H TYR A 59 2.137 -7.077 -6.606 1.00 0.00 H new ATOM 0 HA TYR A 59 2.263 -4.401 -7.521 1.00 0.00 H new ATOM 0 HB2 TYR A 59 4.431 -6.393 -6.722 1.00 0.00 H new ATOM 0 HB3 TYR A 59 4.766 -4.698 -7.012 1.00 0.00 H new ATOM 0 HD1 TYR A 59 3.856 -2.963 -5.544 1.00 0.00 H new ATOM 0 HD2 TYR A 59 3.112 -7.111 -4.774 1.00 0.00 H new ATOM 0 HE1 TYR A 59 3.155 -2.405 -3.228 1.00 0.00 H new ATOM 0 HE2 TYR A 59 2.387 -6.561 -2.468 1.00 0.00 H new ATOM 0 HH TYR A 59 2.078 -4.955 -0.934 1.00 0.00 H new ATOM 863 N VAL A 60 3.068 -6.366 -9.820 1.00 0.00 N ATOM 864 CA VAL A 60 3.542 -6.474 -11.211 1.00 0.00 C ATOM 865 C VAL A 60 2.407 -6.895 -12.146 1.00 0.00 C ATOM 866 O VAL A 60 2.423 -6.556 -13.326 1.00 0.00 O ATOM 867 CB VAL A 60 4.641 -7.523 -11.272 1.00 0.00 C ATOM 868 CG1 VAL A 60 5.976 -6.879 -10.912 1.00 0.00 C ATOM 869 CG2 VAL A 60 4.350 -8.681 -10.293 1.00 0.00 C ATOM 0 H VAL A 60 2.527 -7.168 -9.496 1.00 0.00 H new ATOM 0 HA VAL A 60 3.914 -5.501 -11.530 1.00 0.00 H new ATOM 0 HB VAL A 60 4.681 -7.926 -12.284 1.00 0.00 H new ATOM 0 HG11 VAL A 60 6.765 -7.629 -10.955 1.00 0.00 H new ATOM 0 HG12 VAL A 60 6.197 -6.079 -11.619 1.00 0.00 H new ATOM 0 HG13 VAL A 60 5.921 -6.467 -9.904 1.00 0.00 H new ATOM 0 HG21 VAL A 60 5.150 -9.419 -10.354 1.00 0.00 H new ATOM 0 HG22 VAL A 60 4.292 -8.292 -9.276 1.00 0.00 H new ATOM 0 HG23 VAL A 60 3.402 -9.150 -10.556 1.00 0.00 H new ATOM 879 N ASN A 61 1.433 -7.652 -11.643 1.00 0.00 N ATOM 880 CA ASN A 61 0.328 -8.116 -12.504 1.00 0.00 C ATOM 881 C ASN A 61 -0.802 -7.092 -12.535 1.00 0.00 C ATOM 882 O ASN A 61 -1.366 -6.832 -13.593 1.00 0.00 O ATOM 883 CB ASN A 61 -0.176 -9.479 -12.024 1.00 0.00 C ATOM 884 CG ASN A 61 -0.796 -9.403 -10.639 1.00 0.00 C ATOM 885 OD1 ASN A 61 -1.800 -8.753 -10.436 1.00 0.00 O ATOM 886 ND2 ASN A 61 -0.247 -10.076 -9.666 1.00 0.00 N ATOM 0 H ASN A 61 1.378 -7.955 -10.671 1.00 0.00 H new ATOM 0 HA ASN A 61 0.701 -8.227 -13.522 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -0.913 -9.862 -12.730 1.00 0.00 H new ATOM 0 HB3 ASN A 61 0.652 -10.188 -12.012 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -0.662 -10.056 -8.734 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.597 -10.623 -9.837 1.00 0.00 H new ATOM 893 N GLY A 62 -1.140 -6.494 -11.395 1.00 0.00 N ATOM 894 CA GLY A 62 -2.212 -5.493 -11.372 1.00 0.00 C ATOM 895 C GLY A 62 -3.177 -5.766 -10.218 1.00 0.00 C ATOM 896 O GLY A 62 -3.249 -6.869 -9.697 1.00 0.00 O ATOM 0 H GLY A 62 -0.701 -6.677 -10.493 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -1.784 -4.496 -11.267 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -2.753 -5.510 -12.318 1.00 0.00 H new ATOM 900 N LEU A 63 -3.916 -4.748 -9.827 1.00 0.00 N ATOM 901 CA LEU A 63 -4.919 -4.892 -8.682 1.00 0.00 C ATOM 902 C LEU A 63 -6.282 -5.300 -9.239 1.00 0.00 C ATOM 903 O LEU A 63 -6.368 -5.864 -10.313 1.00 0.00 O ATOM 904 CB LEU A 63 -5.084 -3.552 -7.885 1.00 0.00 C ATOM 905 CG LEU A 63 -3.772 -2.821 -7.702 1.00 0.00 C ATOM 906 CD1 LEU A 63 -4.034 -1.637 -6.778 1.00 0.00 C ATOM 907 CD2 LEU A 63 -2.752 -3.747 -7.063 1.00 0.00 C ATOM 0 H LEU A 63 -3.877 -3.818 -10.244 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.537 -5.656 -8.004 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -5.786 -2.905 -8.410 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -5.517 -3.765 -6.908 1.00 0.00 H new ATOM 0 HG LEU A 63 -3.382 -2.485 -8.663 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -3.107 -1.085 -6.623 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.777 -0.980 -7.230 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -4.406 -1.999 -5.819 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -1.809 -3.216 -6.933 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -3.119 -4.077 -6.091 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -2.595 -4.614 -7.705 1.00 0.00 H new ATOM 919 N THR A 64 -7.353 -4.998 -8.498 1.00 0.00 N ATOM 920 CA THR A 64 -8.707 -5.336 -8.921 1.00 0.00 C ATOM 921 C THR A 64 -9.636 -4.487 -8.137 1.00 0.00 C ATOM 922 O THR A 64 -9.548 -4.432 -6.926 1.00 0.00 O ATOM 923 CB THR A 64 -9.021 -6.787 -8.617 1.00 0.00 C ATOM 924 OG1 THR A 64 -8.628 -7.082 -7.284 1.00 0.00 O ATOM 925 CG2 THR A 64 -8.259 -7.672 -9.573 1.00 0.00 C ATOM 0 H THR A 64 -7.303 -4.518 -7.599 1.00 0.00 H new ATOM 0 HA THR A 64 -8.807 -5.175 -9.994 1.00 0.00 H new ATOM 0 HB THR A 64 -10.091 -6.964 -8.730 1.00 0.00 H new ATOM 0 HG1 THR A 64 -8.195 -7.961 -7.257 1.00 0.00 H new ATOM 0 HG21 THR A 64 -8.482 -8.717 -9.358 1.00 0.00 H new ATOM 0 HG22 THR A 64 -8.554 -7.441 -10.597 1.00 0.00 H new ATOM 0 HG23 THR A 64 -7.189 -7.498 -9.456 1.00 0.00 H new ATOM 933 N LEU A 65 -10.501 -3.827 -8.811 1.00 0.00 N ATOM 934 CA LEU A 65 -11.492 -2.953 -8.151 1.00 0.00 C ATOM 935 C LEU A 65 -12.791 -3.052 -8.895 1.00 0.00 C ATOM 936 O LEU A 65 -12.920 -2.609 -10.027 1.00 0.00 O ATOM 937 CB LEU A 65 -10.998 -1.513 -8.025 1.00 0.00 C ATOM 938 CG LEU A 65 -10.028 -1.122 -9.143 1.00 0.00 C ATOM 939 CD1 LEU A 65 -9.877 0.400 -9.160 1.00 0.00 C ATOM 940 CD2 LEU A 65 -8.653 -1.757 -8.861 1.00 0.00 C ATOM 0 H LEU A 65 -10.572 -3.852 -9.828 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.645 -3.292 -7.127 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -11.853 -0.837 -8.038 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.506 -1.385 -7.061 1.00 0.00 H new ATOM 0 HG LEU A 65 -10.409 -1.470 -10.103 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -9.188 0.688 -9.953 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -10.849 0.860 -9.339 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -9.487 0.738 -8.200 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -7.956 -1.483 -9.653 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -8.275 -1.396 -7.904 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -8.754 -2.842 -8.825 1.00 0.00 H new ATOM 952 N GLY A 66 -13.745 -3.708 -8.266 1.00 0.00 N ATOM 953 CA GLY A 66 -15.065 -3.943 -8.887 1.00 0.00 C ATOM 954 C GLY A 66 -14.931 -5.120 -9.847 1.00 0.00 C ATOM 955 O GLY A 66 -15.653 -5.208 -10.833 1.00 0.00 O ATOM 0 H GLY A 66 -13.647 -4.093 -7.327 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -15.813 -4.157 -8.123 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -15.399 -3.053 -9.420 1.00 0.00 H new ATOM 959 N GLY A 67 -13.973 -6.026 -9.581 1.00 0.00 N ATOM 960 CA GLY A 67 -13.755 -7.184 -10.485 1.00 0.00 C ATOM 961 C GLY A 67 -13.034 -6.704 -11.744 1.00 0.00 C ATOM 962 O GLY A 67 -12.987 -7.418 -12.741 1.00 0.00 O ATOM 0 H GLY A 67 -13.351 -5.988 -8.774 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -13.164 -7.949 -9.981 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -14.709 -7.641 -10.749 1.00 0.00 H new ATOM 966 N GLN A 68 -12.448 -5.488 -11.713 1.00 0.00 N ATOM 967 CA GLN A 68 -11.719 -4.983 -12.916 1.00 0.00 C ATOM 968 C GLN A 68 -10.239 -4.963 -12.610 1.00 0.00 C ATOM 969 O GLN A 68 -9.773 -4.130 -11.844 1.00 0.00 O ATOM 970 CB GLN A 68 -12.193 -3.608 -13.262 1.00 0.00 C ATOM 971 CG GLN A 68 -11.580 -3.176 -14.590 1.00 0.00 C ATOM 972 CD GLN A 68 -10.209 -2.557 -14.335 1.00 0.00 C ATOM 973 OE1 GLN A 68 -9.195 -2.918 -15.070 1.00 0.00 O flip ATOM 974 NE2 GLN A 68 -10.057 -1.732 -13.455 1.00 0.00 N flip ATOM 0 H GLN A 68 -12.457 -4.856 -10.912 1.00 0.00 H new ATOM 0 HA GLN A 68 -11.910 -5.636 -13.768 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -13.281 -3.594 -13.330 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -11.913 -2.907 -12.475 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -11.486 -4.033 -15.256 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -12.230 -2.456 -15.087 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -10.850 -1.449 -12.879 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.137 -1.323 -13.293 1.00 0.00 H new ATOM 983 N LYS A 69 -9.490 -5.887 -13.186 1.00 0.00 N ATOM 984 CA LYS A 69 -8.059 -5.958 -12.925 1.00 0.00 C ATOM 985 C LYS A 69 -7.336 -4.795 -13.627 1.00 0.00 C ATOM 986 O LYS A 69 -7.232 -4.750 -14.846 1.00 0.00 O ATOM 987 CB LYS A 69 -7.592 -7.358 -13.408 1.00 0.00 C ATOM 988 CG LYS A 69 -6.126 -7.395 -13.863 1.00 0.00 C ATOM 989 CD LYS A 69 -5.921 -8.649 -14.705 1.00 0.00 C ATOM 990 CE LYS A 69 -4.859 -9.558 -14.054 1.00 0.00 C ATOM 991 NZ LYS A 69 -4.568 -10.705 -14.959 1.00 0.00 N ATOM 0 H LYS A 69 -9.842 -6.593 -13.832 1.00 0.00 H new ATOM 0 HA LYS A 69 -7.822 -5.849 -11.867 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -7.731 -8.077 -12.600 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -8.228 -7.679 -14.233 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -5.885 -6.504 -14.443 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -5.460 -7.403 -13.000 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -6.863 -9.189 -14.802 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -5.607 -8.373 -15.712 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -3.948 -8.992 -13.862 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -5.217 -9.922 -13.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -3.852 -11.319 -14.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -5.439 -11.250 -15.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -4.209 -10.348 -15.868 1.00 0.00 H new ATOM 1005 N CYS A 70 -6.777 -3.906 -12.835 1.00 0.00 N ATOM 1006 CA CYS A 70 -5.967 -2.766 -13.379 1.00 0.00 C ATOM 1007 C CYS A 70 -4.512 -3.188 -13.222 1.00 0.00 C ATOM 1008 O CYS A 70 -4.240 -4.271 -12.735 1.00 0.00 O ATOM 1009 CB CYS A 70 -6.242 -1.496 -12.591 1.00 0.00 C ATOM 1010 SG CYS A 70 -6.198 -1.831 -10.814 1.00 0.00 S ATOM 0 H CYS A 70 -6.850 -3.924 -11.818 1.00 0.00 H new ATOM 0 HA CYS A 70 -6.215 -2.553 -14.419 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -5.501 -0.737 -12.842 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -7.217 -1.093 -12.867 1.00 0.00 H new ATOM 0 HG CYS A 70 -5.698 -3.013 -10.607 1.00 0.00 H new ATOM 1016 N SER A 71 -3.592 -2.375 -13.630 1.00 0.00 N ATOM 1017 CA SER A 71 -2.136 -2.763 -13.535 1.00 0.00 C ATOM 1018 C SER A 71 -1.290 -1.665 -12.986 1.00 0.00 C ATOM 1019 O SER A 71 -1.004 -0.685 -13.656 1.00 0.00 O ATOM 1020 CB SER A 71 -1.634 -3.133 -14.893 1.00 0.00 C ATOM 1021 OG SER A 71 -1.710 -1.999 -15.751 1.00 0.00 O ATOM 0 H SER A 71 -3.768 -1.453 -14.029 1.00 0.00 H new ATOM 0 HA SER A 71 -2.067 -3.609 -12.851 1.00 0.00 H new ATOM 0 HB2 SER A 71 -0.605 -3.486 -14.829 1.00 0.00 H new ATOM 0 HB3 SER A 71 -2.226 -3.952 -15.301 1.00 0.00 H new ATOM 0 HG SER A 71 -1.258 -1.239 -15.329 1.00 0.00 H new ATOM 1027 N VAL A 72 -0.852 -1.846 -11.769 1.00 0.00 N ATOM 1028 CA VAL A 72 0.023 -0.848 -11.088 1.00 0.00 C ATOM 1029 C VAL A 72 1.128 -0.391 -11.995 1.00 0.00 C ATOM 1030 O VAL A 72 1.924 -1.181 -12.495 1.00 0.00 O ATOM 1031 CB VAL A 72 0.661 -1.456 -9.858 1.00 0.00 C ATOM 1032 CG1 VAL A 72 1.281 -0.347 -9.003 1.00 0.00 C ATOM 1033 CG2 VAL A 72 -0.381 -2.228 -9.039 1.00 0.00 C ATOM 0 H VAL A 72 -1.071 -2.666 -11.204 1.00 0.00 H new ATOM 0 HA VAL A 72 -0.608 -0.002 -10.814 1.00 0.00 H new ATOM 0 HB VAL A 72 1.439 -2.152 -10.170 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.741 -0.785 -8.117 1.00 0.00 H new ATOM 0 HG12 VAL A 72 2.039 0.179 -9.583 1.00 0.00 H new ATOM 0 HG13 VAL A 72 0.505 0.356 -8.700 1.00 0.00 H new ATOM 0 HG21 VAL A 72 0.095 -2.659 -8.158 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -1.175 -1.549 -8.727 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -0.805 -3.026 -9.649 1.00 0.00 H new ATOM 1043 N ILE A 73 1.195 0.885 -12.164 1.00 0.00 N ATOM 1044 CA ILE A 73 2.232 1.499 -12.972 1.00 0.00 C ATOM 1045 C ILE A 73 2.835 2.634 -12.119 1.00 0.00 C ATOM 1046 O ILE A 73 2.594 3.786 -12.307 1.00 0.00 O ATOM 1047 CB ILE A 73 1.663 1.991 -14.298 1.00 0.00 C ATOM 1048 CG1 ILE A 73 1.200 0.762 -15.135 1.00 0.00 C ATOM 1049 CG2 ILE A 73 2.732 2.762 -15.080 1.00 0.00 C ATOM 1050 CD1 ILE A 73 -0.052 1.103 -15.989 1.00 0.00 C ATOM 0 H ILE A 73 0.538 1.547 -11.751 1.00 0.00 H new ATOM 0 HA ILE A 73 3.013 0.787 -13.241 1.00 0.00 H new ATOM 0 HB ILE A 73 0.820 2.654 -14.104 1.00 0.00 H new ATOM 0 HG12 ILE A 73 2.011 0.437 -15.787 1.00 0.00 H new ATOM 0 HG13 ILE A 73 0.973 -0.070 -14.469 1.00 0.00 H new ATOM 0 HG21 ILE A 73 2.313 3.108 -16.025 1.00 0.00 H new ATOM 0 HG22 ILE A 73 3.063 3.620 -14.494 1.00 0.00 H new ATOM 0 HG23 ILE A 73 3.581 2.108 -15.278 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -0.351 0.226 -16.562 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -0.869 1.404 -15.333 1.00 0.00 H new ATOM 0 HD13 ILE A 73 0.185 1.919 -16.672 1.00 0.00 H new ATOM 1062 N ARG A 74 3.572 2.218 -11.137 1.00 0.00 N ATOM 1063 CA ARG A 74 4.277 3.107 -10.110 1.00 0.00 C ATOM 1064 C ARG A 74 3.598 2.895 -8.757 1.00 0.00 C ATOM 1065 O ARG A 74 2.821 3.730 -8.295 1.00 0.00 O ATOM 1066 CB ARG A 74 4.260 4.607 -10.488 1.00 0.00 C ATOM 1067 CG ARG A 74 5.340 5.339 -9.692 1.00 0.00 C ATOM 1068 CD ARG A 74 5.377 6.808 -10.110 1.00 0.00 C ATOM 1069 NE ARG A 74 6.226 6.954 -11.324 1.00 0.00 N ATOM 1070 CZ ARG A 74 7.195 7.826 -11.341 1.00 0.00 C ATOM 1071 NH1 ARG A 74 8.112 7.797 -10.412 1.00 0.00 N ATOM 1072 NH2 ARG A 74 7.249 8.725 -12.284 1.00 0.00 N ATOM 0 H ARG A 74 3.740 1.225 -10.974 1.00 0.00 H new ATOM 0 HA ARG A 74 5.328 2.820 -10.075 1.00 0.00 H new ATOM 0 HB2 ARG A 74 4.436 4.727 -11.557 1.00 0.00 H new ATOM 0 HB3 ARG A 74 3.281 5.037 -10.276 1.00 0.00 H new ATOM 0 HG2 ARG A 74 5.136 5.259 -8.624 1.00 0.00 H new ATOM 0 HG3 ARG A 74 6.311 4.876 -9.866 1.00 0.00 H new ATOM 0 HD2 ARG A 74 4.368 7.165 -10.313 1.00 0.00 H new ATOM 0 HD3 ARG A 74 5.774 7.419 -9.299 1.00 0.00 H new ATOM 0 HE ARG A 74 6.050 6.372 -12.143 1.00 0.00 H new ATOM 0 HH11 ARG A 74 8.069 7.093 -9.675 1.00 0.00 H new ATOM 0 HH12 ARG A 74 8.871 8.478 -10.423 1.00 0.00 H new ATOM 0 HH21 ARG A 74 6.532 8.747 -13.010 1.00 0.00 H new ATOM 0 HH22 ARG A 74 8.008 9.407 -12.296 1.00 0.00 H new ATOM 1086 N ASP A 75 3.870 1.755 -8.115 1.00 0.00 N ATOM 1087 CA ASP A 75 3.226 1.471 -6.805 1.00 0.00 C ATOM 1088 C ASP A 75 3.807 2.350 -5.710 1.00 0.00 C ATOM 1089 O ASP A 75 4.894 2.117 -5.204 1.00 0.00 O ATOM 1090 CB ASP A 75 3.300 -0.067 -6.455 1.00 0.00 C ATOM 1091 CG ASP A 75 3.378 -0.328 -4.925 1.00 0.00 C ATOM 1092 OD1 ASP A 75 4.449 -0.158 -4.369 1.00 0.00 O ATOM 1093 OD2 ASP A 75 2.371 -0.695 -4.351 1.00 0.00 O ATOM 0 H ASP A 75 4.504 1.032 -8.454 1.00 0.00 H new ATOM 0 HA ASP A 75 2.168 1.722 -6.880 1.00 0.00 H new ATOM 0 HB2 ASP A 75 2.423 -0.571 -6.862 1.00 0.00 H new ATOM 0 HB3 ASP A 75 4.173 -0.505 -6.940 1.00 0.00 H new ATOM 1098 N SER A 76 3.037 3.342 -5.324 1.00 0.00 N ATOM 1099 CA SER A 76 3.449 4.261 -4.215 1.00 0.00 C ATOM 1100 C SER A 76 2.288 4.362 -3.173 1.00 0.00 C ATOM 1101 O SER A 76 2.413 5.018 -2.166 1.00 0.00 O ATOM 1102 CB SER A 76 3.793 5.657 -4.763 1.00 0.00 C ATOM 1103 OG SER A 76 5.002 6.095 -4.170 1.00 0.00 O ATOM 0 H SER A 76 2.129 3.556 -5.737 1.00 0.00 H new ATOM 0 HA SER A 76 4.340 3.859 -3.733 1.00 0.00 H new ATOM 0 HB2 SER A 76 3.896 5.622 -5.848 1.00 0.00 H new ATOM 0 HB3 SER A 76 2.988 6.358 -4.542 1.00 0.00 H new ATOM 0 HG SER A 76 5.616 6.404 -4.869 1.00 0.00 H new ATOM 1109 N LEU A 77 1.157 3.679 -3.439 1.00 0.00 N ATOM 1110 CA LEU A 77 -0.063 3.662 -2.519 1.00 0.00 C ATOM 1111 C LEU A 77 0.324 3.618 -1.075 1.00 0.00 C ATOM 1112 O LEU A 77 -0.419 4.123 -0.231 1.00 0.00 O ATOM 1113 CB LEU A 77 -0.839 2.402 -2.884 1.00 0.00 C ATOM 1114 CG LEU A 77 -2.256 2.422 -2.361 1.00 0.00 C ATOM 1115 CD1 LEU A 77 -3.118 1.590 -3.316 1.00 0.00 C ATOM 1116 CD2 LEU A 77 -2.293 1.791 -0.970 1.00 0.00 C ATOM 0 H LEU A 77 1.035 3.119 -4.283 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.652 4.570 -2.652 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -0.857 2.292 -3.968 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -0.320 1.531 -2.484 1.00 0.00 H new ATOM 0 HG LEU A 77 -2.627 3.445 -2.299 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -4.150 1.585 -2.964 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -3.077 2.024 -4.315 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -2.741 0.568 -3.349 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -3.315 1.805 -0.591 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -1.941 0.761 -1.028 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -1.649 2.357 -0.297 1.00 0.00 H new ATOM 1128 N LEU A 78 1.467 3.064 -0.752 1.00 0.00 N ATOM 1129 CA LEU A 78 1.876 3.044 0.649 1.00 0.00 C ATOM 1130 C LEU A 78 2.851 4.192 0.898 1.00 0.00 C ATOM 1131 O LEU A 78 3.763 4.406 0.149 1.00 0.00 O ATOM 1132 CB LEU A 78 2.413 1.700 0.999 1.00 0.00 C ATOM 1133 CG LEU A 78 1.221 0.712 1.060 1.00 0.00 C ATOM 1134 CD1 LEU A 78 1.701 -0.733 0.942 1.00 0.00 C ATOM 1135 CD2 LEU A 78 0.479 0.886 2.385 1.00 0.00 C ATOM 0 H LEU A 78 2.118 2.632 -1.408 1.00 0.00 H new ATOM 0 HA LEU A 78 1.026 3.206 1.313 1.00 0.00 H new ATOM 0 HB2 LEU A 78 3.141 1.374 0.256 1.00 0.00 H new ATOM 0 HB3 LEU A 78 2.930 1.734 1.958 1.00 0.00 H new ATOM 0 HG LEU A 78 0.555 0.929 0.225 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.845 -1.406 0.988 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.218 -0.868 -0.008 1.00 0.00 H new ATOM 0 HD13 LEU A 78 2.383 -0.958 1.762 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.359 0.190 2.427 1.00 0.00 H new ATOM 0 HD22 LEU A 78 1.159 0.684 3.212 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.107 1.908 2.462 1.00 0.00 H new ATOM 1183 N GLU A 82 4.272 9.287 -0.825 1.00 0.00 N ATOM 1184 CA GLU A 82 3.470 9.334 -2.061 1.00 0.00 C ATOM 1185 C GLU A 82 2.005 8.833 -1.916 1.00 0.00 C ATOM 1186 O GLU A 82 1.079 9.504 -2.341 1.00 0.00 O ATOM 1187 CB GLU A 82 4.142 8.409 -3.048 1.00 0.00 C ATOM 1188 CG GLU A 82 5.176 9.142 -3.901 1.00 0.00 C ATOM 1189 CD GLU A 82 6.554 9.100 -3.214 1.00 0.00 C ATOM 1190 OE1 GLU A 82 6.922 8.044 -2.716 1.00 0.00 O ATOM 1191 OE2 GLU A 82 7.218 10.121 -3.201 1.00 0.00 O ATOM 0 HA GLU A 82 3.419 10.380 -2.362 1.00 0.00 H new ATOM 0 HB2 GLU A 82 4.627 7.594 -2.510 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.389 7.960 -3.696 1.00 0.00 H new ATOM 0 HG2 GLU A 82 5.238 8.681 -4.887 1.00 0.00 H new ATOM 0 HG3 GLU A 82 4.867 10.176 -4.052 1.00 0.00 H new ATOM 1198 N PHE A 83 1.821 7.598 -1.439 1.00 0.00 N ATOM 1199 CA PHE A 83 0.438 6.943 -1.409 1.00 0.00 C ATOM 1200 C PHE A 83 -0.308 7.223 -2.752 1.00 0.00 C ATOM 1201 O PHE A 83 -1.403 7.774 -2.778 1.00 0.00 O ATOM 1202 CB PHE A 83 -0.444 7.342 -0.242 1.00 0.00 C ATOM 1203 CG PHE A 83 -0.062 8.664 0.349 1.00 0.00 C ATOM 1204 CD1 PHE A 83 -0.639 9.839 -0.144 1.00 0.00 C ATOM 1205 CD2 PHE A 83 0.855 8.713 1.387 1.00 0.00 C ATOM 1206 CE1 PHE A 83 -0.288 11.073 0.413 1.00 0.00 C ATOM 1207 CE2 PHE A 83 1.212 9.945 1.950 1.00 0.00 C ATOM 1208 CZ PHE A 83 0.640 11.126 1.460 1.00 0.00 C ATOM 0 H PHE A 83 2.571 7.014 -1.068 1.00 0.00 H new ATOM 0 HA PHE A 83 0.629 5.878 -1.274 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -1.481 7.384 -0.574 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -0.387 6.574 0.530 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -1.354 9.793 -0.953 1.00 0.00 H new ATOM 0 HD2 PHE A 83 1.295 7.801 1.762 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -0.732 11.983 0.036 1.00 0.00 H new ATOM 0 HE2 PHE A 83 1.926 9.984 2.759 1.00 0.00 H new ATOM 0 HZ PHE A 83 0.915 12.078 1.890 1.00 0.00 H new ATOM 1218 N SER A 84 0.311 6.834 -3.851 1.00 0.00 N ATOM 1219 CA SER A 84 -0.276 7.020 -5.218 1.00 0.00 C ATOM 1220 C SER A 84 0.200 5.859 -6.067 1.00 0.00 C ATOM 1221 O SER A 84 1.364 5.497 -6.029 1.00 0.00 O ATOM 1222 CB SER A 84 0.195 8.335 -5.812 1.00 0.00 C ATOM 1223 OG SER A 84 1.615 8.400 -5.747 1.00 0.00 O ATOM 0 H SER A 84 1.226 6.382 -3.851 1.00 0.00 H new ATOM 0 HA SER A 84 -1.365 7.046 -5.175 1.00 0.00 H new ATOM 0 HB2 SER A 84 -0.137 8.419 -6.847 1.00 0.00 H new ATOM 0 HB3 SER A 84 -0.244 9.171 -5.267 1.00 0.00 H new ATOM 0 HG SER A 84 1.922 9.248 -6.132 1.00 0.00 H new ATOM 1229 N MET A 85 -0.704 5.237 -6.781 1.00 0.00 N ATOM 1230 CA MET A 85 -0.353 4.027 -7.596 1.00 0.00 C ATOM 1231 C MET A 85 -1.029 4.127 -8.961 1.00 0.00 C ATOM 1232 O MET A 85 -2.214 4.221 -9.023 1.00 0.00 O ATOM 1233 CB MET A 85 -0.930 2.872 -6.825 1.00 0.00 C ATOM 1234 CG MET A 85 -0.262 1.562 -7.166 1.00 0.00 C ATOM 1235 SD MET A 85 0.270 0.766 -5.640 1.00 0.00 S ATOM 1236 CE MET A 85 -0.398 -0.856 -5.969 1.00 0.00 C ATOM 0 H MET A 85 -1.683 5.517 -6.836 1.00 0.00 H new ATOM 0 HA MET A 85 0.720 3.922 -7.759 1.00 0.00 H new ATOM 0 HB2 MET A 85 -0.825 3.063 -5.757 1.00 0.00 H new ATOM 0 HB3 MET A 85 -1.997 2.797 -7.032 1.00 0.00 H new ATOM 0 HG2 MET A 85 -0.953 0.916 -7.707 1.00 0.00 H new ATOM 0 HG3 MET A 85 0.593 1.733 -7.820 1.00 0.00 H new ATOM 0 HE1 MET A 85 -0.905 -1.228 -5.079 1.00 0.00 H new ATOM 0 HE2 MET A 85 -1.109 -0.796 -6.793 1.00 0.00 H new ATOM 0 HE3 MET A 85 0.411 -1.535 -6.236 1.00 0.00 H new ATOM 1246 N ASP A 86 -0.291 4.107 -10.060 1.00 0.00 N ATOM 1247 CA ASP A 86 -0.966 4.227 -11.398 1.00 0.00 C ATOM 1248 C ASP A 86 -1.419 2.855 -11.900 1.00 0.00 C ATOM 1249 O ASP A 86 -0.855 2.312 -12.851 1.00 0.00 O ATOM 1250 CB ASP A 86 0.011 4.825 -12.351 1.00 0.00 C ATOM 1251 CG ASP A 86 -0.110 6.350 -12.353 1.00 0.00 C ATOM 1252 OD1 ASP A 86 -1.216 6.834 -12.528 1.00 0.00 O ATOM 1253 OD2 ASP A 86 0.903 7.007 -12.178 1.00 0.00 O ATOM 0 H ASP A 86 0.725 4.015 -10.085 1.00 0.00 H new ATOM 0 HA ASP A 86 -1.851 4.857 -11.313 1.00 0.00 H new ATOM 0 HB2 ASP A 86 1.024 4.535 -12.073 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -0.167 4.438 -13.354 1.00 0.00 H new ATOM 1258 N LEU A 87 -2.472 2.292 -11.326 1.00 0.00 N ATOM 1259 CA LEU A 87 -2.927 0.977 -11.826 1.00 0.00 C ATOM 1260 C LEU A 87 -4.001 1.202 -12.831 1.00 0.00 C ATOM 1261 O LEU A 87 -5.007 1.826 -12.568 1.00 0.00 O ATOM 1262 CB LEU A 87 -3.321 -0.043 -10.726 1.00 0.00 C ATOM 1263 CG LEU A 87 -4.021 0.545 -9.490 1.00 0.00 C ATOM 1264 CD1 LEU A 87 -3.087 1.438 -8.699 1.00 0.00 C ATOM 1265 CD2 LEU A 87 -5.260 1.304 -9.909 1.00 0.00 C ATOM 0 H LEU A 87 -3.011 2.687 -10.555 1.00 0.00 H new ATOM 0 HA LEU A 87 -2.075 0.489 -12.300 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -3.977 -0.792 -11.170 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -2.420 -0.562 -10.398 1.00 0.00 H new ATOM 0 HG LEU A 87 -4.315 -0.279 -8.840 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -3.613 1.837 -7.832 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.226 0.859 -8.366 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.750 2.261 -9.329 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -5.749 1.717 -9.027 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.980 2.115 -10.582 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.945 0.628 -10.421 1.00 0.00 H new ATOM 1277 N ARG A 88 -3.733 0.774 -14.037 1.00 0.00 N ATOM 1278 CA ARG A 88 -4.681 1.036 -15.169 1.00 0.00 C ATOM 1279 C ARG A 88 -5.392 -0.227 -15.683 1.00 0.00 C ATOM 1280 O ARG A 88 -4.835 -1.310 -15.725 1.00 0.00 O ATOM 1281 CB ARG A 88 -3.856 1.681 -16.360 1.00 0.00 C ATOM 1282 CG ARG A 88 -3.291 0.602 -17.341 1.00 0.00 C ATOM 1283 CD ARG A 88 -2.818 1.245 -18.604 1.00 0.00 C ATOM 1284 NE ARG A 88 -1.346 1.079 -18.754 1.00 0.00 N ATOM 1285 CZ ARG A 88 -0.672 1.911 -19.499 1.00 0.00 C ATOM 1286 NH1 ARG A 88 -0.380 3.100 -19.051 1.00 0.00 N ATOM 1287 NH2 ARG A 88 -0.284 1.549 -20.691 1.00 0.00 N ATOM 0 H ARG A 88 -2.895 0.251 -14.291 1.00 0.00 H new ATOM 0 HA ARG A 88 -5.460 1.701 -14.796 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.496 2.371 -16.911 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -3.032 2.267 -15.953 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -2.468 0.066 -16.868 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -4.063 -0.134 -17.567 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -3.329 0.801 -19.458 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -3.071 2.305 -18.596 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.866 0.317 -18.276 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -0.679 3.381 -18.117 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.147 3.750 -19.635 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -0.508 0.617 -21.039 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.243 2.198 -21.275 1.00 0.00 H new ATOM 1301 N THR A 89 -6.557 -0.021 -16.240 1.00 0.00 N ATOM 1302 CA THR A 89 -7.262 -1.112 -16.936 1.00 0.00 C ATOM 1303 C THR A 89 -6.559 -1.101 -18.295 1.00 0.00 C ATOM 1304 O THR A 89 -6.742 -0.200 -19.074 1.00 0.00 O ATOM 1305 CB THR A 89 -8.794 -0.824 -17.059 1.00 0.00 C ATOM 1306 OG1 THR A 89 -9.082 0.007 -18.171 1.00 0.00 O ATOM 1307 CG2 THR A 89 -9.322 -0.157 -15.784 1.00 0.00 C ATOM 0 H THR A 89 -7.048 0.873 -16.236 1.00 0.00 H new ATOM 0 HA THR A 89 -7.219 -2.074 -16.425 1.00 0.00 H new ATOM 0 HB THR A 89 -9.290 -1.784 -17.204 1.00 0.00 H new ATOM 0 HG1 THR A 89 -8.250 0.398 -18.512 1.00 0.00 H new ATOM 0 HG21 THR A 89 -10.390 0.035 -15.889 1.00 0.00 H new ATOM 0 HG22 THR A 89 -9.154 -0.816 -14.932 1.00 0.00 H new ATOM 0 HG23 THR A 89 -8.798 0.785 -15.622 1.00 0.00 H new ATOM 1315 N LYS A 90 -5.655 -1.999 -18.493 1.00 0.00 N ATOM 1316 CA LYS A 90 -4.798 -1.970 -19.703 1.00 0.00 C ATOM 1317 C LYS A 90 -5.517 -2.587 -20.896 1.00 0.00 C ATOM 1318 O LYS A 90 -6.594 -3.155 -20.783 1.00 0.00 O ATOM 1319 CB LYS A 90 -3.481 -2.752 -19.438 1.00 0.00 C ATOM 1320 CG LYS A 90 -3.100 -2.732 -17.943 1.00 0.00 C ATOM 1321 CD LYS A 90 -3.621 -3.987 -17.310 1.00 0.00 C ATOM 1322 CE LYS A 90 -2.576 -5.103 -17.383 1.00 0.00 C ATOM 1323 NZ LYS A 90 -2.451 -5.585 -18.792 1.00 0.00 N ATOM 0 H LYS A 90 -5.465 -2.772 -17.855 1.00 0.00 H new ATOM 0 HA LYS A 90 -4.571 -0.929 -19.931 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -3.596 -3.783 -19.771 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.673 -2.316 -20.026 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.018 -2.669 -17.827 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -3.525 -1.855 -17.454 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -3.882 -3.794 -16.270 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -4.534 -4.303 -17.815 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -1.613 -4.737 -17.027 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -2.864 -5.927 -16.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -1.960 -6.502 -18.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -3.398 -5.695 -19.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -1.908 -4.894 -19.348 1.00 0.00 H new ATOM 1434 N ASN A 99 -7.010 4.278 -17.239 1.00 0.00 N ATOM 1435 CA ASN A 99 -5.918 4.380 -16.198 1.00 0.00 C ATOM 1436 C ASN A 99 -6.423 4.980 -14.904 1.00 0.00 C ATOM 1437 O ASN A 99 -7.123 5.974 -14.876 1.00 0.00 O ATOM 1438 CB ASN A 99 -4.672 5.140 -16.751 1.00 0.00 C ATOM 1439 CG ASN A 99 -4.523 4.944 -18.284 1.00 0.00 C ATOM 1440 OD1 ASN A 99 -5.044 3.998 -18.854 1.00 0.00 O ATOM 1441 ND2 ASN A 99 -3.809 5.798 -18.969 1.00 0.00 N ATOM 0 HA ASN A 99 -5.598 3.365 -15.965 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -4.763 6.203 -16.526 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -3.773 4.783 -16.248 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -3.689 5.672 -19.974 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -3.371 6.590 -18.498 1.00 0.00 H new ATOM 1448 N VAL A 100 -6.066 4.312 -13.817 1.00 0.00 N ATOM 1449 CA VAL A 100 -6.498 4.712 -12.454 1.00 0.00 C ATOM 1450 C VAL A 100 -5.296 5.025 -11.589 1.00 0.00 C ATOM 1451 O VAL A 100 -4.293 4.319 -11.622 1.00 0.00 O ATOM 1452 CB VAL A 100 -7.235 3.517 -11.761 1.00 0.00 C ATOM 1453 CG1 VAL A 100 -8.053 4.023 -10.582 1.00 0.00 C ATOM 1454 CG2 VAL A 100 -8.165 2.802 -12.753 1.00 0.00 C ATOM 0 H VAL A 100 -5.474 3.482 -13.837 1.00 0.00 H new ATOM 0 HA VAL A 100 -7.146 5.583 -12.555 1.00 0.00 H new ATOM 0 HB VAL A 100 -6.482 2.811 -11.410 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -8.562 3.185 -10.106 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -7.392 4.503 -9.860 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -8.791 4.744 -10.934 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.667 1.975 -12.250 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -8.909 3.506 -13.126 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -7.580 2.417 -13.588 1.00 0.00 H new ATOM 1464 N THR A 101 -5.437 6.012 -10.745 1.00 0.00 N ATOM 1465 CA THR A 101 -4.405 6.341 -9.777 1.00 0.00 C ATOM 1466 C THR A 101 -5.074 6.085 -8.455 1.00 0.00 C ATOM 1467 O THR A 101 -6.144 6.598 -8.205 1.00 0.00 O ATOM 1468 CB THR A 101 -3.973 7.797 -9.878 1.00 0.00 C ATOM 1469 OG1 THR A 101 -3.475 8.054 -11.186 1.00 0.00 O ATOM 1470 CG2 THR A 101 -2.872 8.067 -8.838 1.00 0.00 C ATOM 0 H THR A 101 -6.261 6.611 -10.702 1.00 0.00 H new ATOM 0 HA THR A 101 -3.497 5.758 -9.930 1.00 0.00 H new ATOM 0 HB THR A 101 -4.824 8.451 -9.686 1.00 0.00 H new ATOM 0 HG1 THR A 101 -2.696 7.484 -11.357 1.00 0.00 H new ATOM 0 HG21 THR A 101 -2.557 9.108 -8.904 1.00 0.00 H new ATOM 0 HG22 THR A 101 -3.259 7.867 -7.839 1.00 0.00 H new ATOM 0 HG23 THR A 101 -2.019 7.417 -9.034 1.00 0.00 H new ATOM 1478 N VAL A 102 -4.499 5.259 -7.646 1.00 0.00 N ATOM 1479 CA VAL A 102 -5.119 4.893 -6.362 1.00 0.00 C ATOM 1480 C VAL A 102 -4.273 5.451 -5.238 1.00 0.00 C ATOM 1481 O VAL A 102 -3.100 5.129 -5.109 1.00 0.00 O ATOM 1482 CB VAL A 102 -5.229 3.351 -6.351 1.00 0.00 C ATOM 1483 CG1 VAL A 102 -5.350 2.778 -4.924 1.00 0.00 C ATOM 1484 CG2 VAL A 102 -6.457 2.978 -7.130 1.00 0.00 C ATOM 0 H VAL A 102 -3.601 4.811 -7.827 1.00 0.00 H new ATOM 0 HA VAL A 102 -6.117 5.310 -6.228 1.00 0.00 H new ATOM 0 HB VAL A 102 -4.322 2.936 -6.790 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -5.424 1.692 -4.973 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -4.469 3.056 -4.345 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -6.242 3.181 -4.444 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -6.565 1.893 -7.142 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -7.334 3.425 -6.662 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -6.365 3.345 -8.152 1.00 0.00 H new ATOM 1494 N THR A 103 -4.874 6.296 -4.424 1.00 0.00 N ATOM 1495 CA THR A 103 -4.127 6.911 -3.292 1.00 0.00 C ATOM 1496 C THR A 103 -4.531 6.269 -1.981 1.00 0.00 C ATOM 1497 O THR A 103 -5.426 5.418 -1.923 1.00 0.00 O ATOM 1498 CB THR A 103 -4.362 8.417 -3.215 1.00 0.00 C ATOM 1499 OG1 THR A 103 -5.720 8.702 -3.449 1.00 0.00 O ATOM 1500 CG2 THR A 103 -3.495 9.122 -4.251 1.00 0.00 C ATOM 0 H THR A 103 -5.850 6.581 -4.502 1.00 0.00 H new ATOM 0 HA THR A 103 -3.066 6.738 -3.471 1.00 0.00 H new ATOM 0 HB THR A 103 -4.093 8.774 -2.221 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.823 9.091 -4.343 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.663 10.197 -4.195 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.445 8.908 -4.053 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.756 8.765 -5.247 1.00 0.00 H new ATOM 1508 N LYS A 104 -3.855 6.657 -0.931 1.00 0.00 N ATOM 1509 CA LYS A 104 -4.120 6.074 0.420 1.00 0.00 C ATOM 1510 C LYS A 104 -4.001 7.140 1.520 1.00 0.00 C ATOM 1511 O LYS A 104 -3.147 8.015 1.468 1.00 0.00 O ATOM 1512 CB LYS A 104 -3.064 4.990 0.676 1.00 0.00 C ATOM 1513 CG LYS A 104 -3.351 4.271 1.989 1.00 0.00 C ATOM 1514 CD LYS A 104 -4.371 3.185 1.733 1.00 0.00 C ATOM 1515 CE LYS A 104 -4.522 2.309 2.966 1.00 0.00 C ATOM 1516 NZ LYS A 104 -3.329 1.427 3.117 1.00 0.00 N ATOM 0 H LYS A 104 -3.120 7.363 -0.952 1.00 0.00 H new ATOM 0 HA LYS A 104 -5.132 5.669 0.442 1.00 0.00 H new ATOM 0 HB2 LYS A 104 -3.062 4.274 -0.146 1.00 0.00 H new ATOM 0 HB3 LYS A 104 -2.072 5.440 0.709 1.00 0.00 H new ATOM 0 HG2 LYS A 104 -2.434 3.841 2.393 1.00 0.00 H new ATOM 0 HG3 LYS A 104 -3.727 4.975 2.731 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -5.331 3.631 1.474 1.00 0.00 H new ATOM 0 HD3 LYS A 104 -4.062 2.578 0.882 1.00 0.00 H new ATOM 0 HE2 LYS A 104 -4.638 2.932 3.853 1.00 0.00 H new ATOM 0 HE3 LYS A 104 -5.424 1.703 2.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 -3.606 0.547 3.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 -2.943 1.201 2.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 -2.605 1.916 3.681 1.00 0.00 H new ATOM 1530 N THR A 105 -4.828 7.014 2.541 1.00 0.00 N ATOM 1531 CA THR A 105 -4.780 7.938 3.717 1.00 0.00 C ATOM 1532 C THR A 105 -4.401 7.068 4.937 1.00 0.00 C ATOM 1533 O THR A 105 -3.555 6.185 4.812 1.00 0.00 O ATOM 1534 CB THR A 105 -6.158 8.618 3.906 1.00 0.00 C ATOM 1535 OG1 THR A 105 -7.108 7.648 4.300 1.00 0.00 O ATOM 1536 CG2 THR A 105 -6.596 9.285 2.590 1.00 0.00 C ATOM 0 H THR A 105 -5.546 6.293 2.604 1.00 0.00 H new ATOM 0 HA THR A 105 -4.051 8.737 3.582 1.00 0.00 H new ATOM 0 HB THR A 105 -6.084 9.383 4.679 1.00 0.00 H new ATOM 0 HG1 THR A 105 -7.509 7.241 3.504 1.00 0.00 H new ATOM 0 HG21 THR A 105 -7.566 9.762 2.729 1.00 0.00 H new ATOM 0 HG22 THR A 105 -5.861 10.036 2.300 1.00 0.00 H new ATOM 0 HG23 THR A 105 -6.672 8.530 1.807 1.00 0.00 H new ATOM 1544 N ASP A 106 -5.008 7.282 6.101 1.00 0.00 N ATOM 1545 CA ASP A 106 -4.668 6.433 7.299 1.00 0.00 C ATOM 1546 C ASP A 106 -5.733 5.341 7.480 1.00 0.00 C ATOM 1547 O ASP A 106 -5.462 4.304 8.075 1.00 0.00 O ATOM 1548 CB ASP A 106 -4.604 7.293 8.554 1.00 0.00 C ATOM 1549 CG ASP A 106 -3.991 6.478 9.695 1.00 0.00 C ATOM 1550 OD1 ASP A 106 -2.896 5.972 9.512 1.00 0.00 O ATOM 1551 OD2 ASP A 106 -4.625 6.375 10.732 1.00 0.00 O ATOM 0 H ASP A 106 -5.714 8.000 6.265 1.00 0.00 H new ATOM 0 HA ASP A 106 -3.695 5.970 7.136 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -4.006 8.185 8.367 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -5.603 7.630 8.829 1.00 0.00 H new ATOM 1556 N LYS A 107 -6.952 5.563 6.972 1.00 0.00 N ATOM 1557 CA LYS A 107 -8.046 4.519 7.124 1.00 0.00 C ATOM 1558 C LYS A 107 -9.020 4.557 5.923 1.00 0.00 C ATOM 1559 O LYS A 107 -10.109 4.008 5.996 1.00 0.00 O ATOM 1560 CB LYS A 107 -8.854 4.767 8.418 1.00 0.00 C ATOM 1561 CG LYS A 107 -7.946 5.270 9.549 1.00 0.00 C ATOM 1562 CD LYS A 107 -8.808 5.591 10.772 1.00 0.00 C ATOM 1563 CE LYS A 107 -7.917 5.911 11.972 1.00 0.00 C ATOM 1564 NZ LYS A 107 -8.772 6.229 13.152 1.00 0.00 N ATOM 0 H LYS A 107 -7.226 6.407 6.469 1.00 0.00 H new ATOM 0 HA LYS A 107 -7.562 3.543 7.168 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -9.639 5.498 8.226 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -9.346 3.844 8.726 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -7.203 4.513 9.800 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -7.401 6.158 9.228 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -9.459 6.438 10.556 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -9.454 4.744 11.004 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -7.270 5.062 12.196 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -7.267 6.755 11.742 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -8.168 6.447 13.970 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -9.371 7.051 12.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -9.374 5.411 13.375 1.00 0.00 H new ATOM 1578 N THR A 108 -8.635 5.180 4.821 1.00 0.00 N ATOM 1579 CA THR A 108 -9.524 5.244 3.620 1.00 0.00 C ATOM 1580 C THR A 108 -8.693 4.805 2.409 1.00 0.00 C ATOM 1581 O THR A 108 -7.474 4.948 2.396 1.00 0.00 O ATOM 1582 CB THR A 108 -10.076 6.672 3.439 1.00 0.00 C ATOM 1583 OG1 THR A 108 -9.082 7.519 2.906 1.00 0.00 O ATOM 1584 CG2 THR A 108 -10.534 7.211 4.797 1.00 0.00 C ATOM 0 H THR A 108 -7.735 5.647 4.710 1.00 0.00 H new ATOM 0 HA THR A 108 -10.384 4.584 3.735 1.00 0.00 H new ATOM 0 HB THR A 108 -10.918 6.643 2.748 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.911 8.255 3.530 1.00 0.00 H new ATOM 0 HG21 THR A 108 -10.925 8.221 4.674 1.00 0.00 H new ATOM 0 HG22 THR A 108 -11.315 6.566 5.200 1.00 0.00 H new ATOM 0 HG23 THR A 108 -9.689 7.231 5.485 1.00 0.00 H new ATOM 1592 N LEU A 109 -9.338 4.238 1.434 1.00 0.00 N ATOM 1593 CA LEU A 109 -8.624 3.715 0.216 1.00 0.00 C ATOM 1594 C LEU A 109 -9.218 4.482 -0.990 1.00 0.00 C ATOM 1595 O LEU A 109 -10.267 4.113 -1.480 1.00 0.00 O ATOM 1596 CB LEU A 109 -8.998 2.204 0.141 1.00 0.00 C ATOM 1597 CG LEU A 109 -7.887 1.249 -0.423 1.00 0.00 C ATOM 1598 CD1 LEU A 109 -8.290 0.674 -1.764 1.00 0.00 C ATOM 1599 CD2 LEU A 109 -6.528 1.914 -0.535 1.00 0.00 C ATOM 0 H LEU A 109 -10.349 4.107 1.419 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.541 3.840 0.234 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -9.266 1.866 1.142 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -9.888 2.100 -0.480 1.00 0.00 H new ATOM 0 HG LEU A 109 -7.792 0.442 0.304 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -7.501 0.017 -2.130 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -9.214 0.106 -1.654 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -8.446 1.485 -2.476 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -5.805 1.201 -0.931 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -6.596 2.771 -1.205 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -6.205 2.249 0.451 1.00 0.00 H new ATOM 1611 N VAL A 110 -8.583 5.574 -1.461 1.00 0.00 N ATOM 1612 CA VAL A 110 -9.195 6.357 -2.583 1.00 0.00 C ATOM 1613 C VAL A 110 -8.753 5.788 -3.922 1.00 0.00 C ATOM 1614 O VAL A 110 -7.622 5.359 -4.090 1.00 0.00 O ATOM 1615 CB VAL A 110 -8.787 7.871 -2.444 1.00 0.00 C ATOM 1616 CG1 VAL A 110 -8.701 8.576 -3.814 1.00 0.00 C ATOM 1617 CG2 VAL A 110 -9.844 8.605 -1.607 1.00 0.00 C ATOM 0 H VAL A 110 -7.693 5.930 -1.113 1.00 0.00 H new ATOM 0 HA VAL A 110 -10.281 6.283 -2.533 1.00 0.00 H new ATOM 0 HB VAL A 110 -7.806 7.900 -1.970 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -8.417 9.618 -3.670 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -7.954 8.079 -4.433 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -9.671 8.530 -4.308 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -9.566 9.654 -1.508 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -10.813 8.532 -2.100 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.905 8.151 -0.618 1.00 0.00 H new ATOM 1627 N LEU A 111 -9.642 5.847 -4.878 1.00 0.00 N ATOM 1628 CA LEU A 111 -9.328 5.402 -6.242 1.00 0.00 C ATOM 1629 C LEU A 111 -9.668 6.563 -7.165 1.00 0.00 C ATOM 1630 O LEU A 111 -10.591 7.325 -6.911 1.00 0.00 O ATOM 1631 CB LEU A 111 -10.158 4.153 -6.649 1.00 0.00 C ATOM 1632 CG LEU A 111 -10.219 3.147 -5.495 1.00 0.00 C ATOM 1633 CD1 LEU A 111 -11.276 2.071 -5.783 1.00 0.00 C ATOM 1634 CD2 LEU A 111 -8.877 2.482 -5.320 1.00 0.00 C ATOM 0 H LEU A 111 -10.593 6.196 -4.754 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.278 5.118 -6.307 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -11.167 4.456 -6.929 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -9.712 3.683 -7.525 1.00 0.00 H new ATOM 0 HG LEU A 111 -10.486 3.683 -4.584 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -11.309 1.363 -4.955 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -12.253 2.542 -5.897 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -11.018 1.544 -6.701 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -8.929 1.768 -4.498 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -8.608 1.959 -6.238 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -8.123 3.237 -5.098 1.00 0.00 H new ATOM 1646 N LEU A 112 -8.935 6.701 -8.209 1.00 0.00 N ATOM 1647 CA LEU A 112 -9.170 7.777 -9.196 1.00 0.00 C ATOM 1648 C LEU A 112 -9.215 7.079 -10.527 1.00 0.00 C ATOM 1649 O LEU A 112 -8.204 6.691 -11.033 1.00 0.00 O ATOM 1650 CB LEU A 112 -7.993 8.756 -9.174 1.00 0.00 C ATOM 1651 CG LEU A 112 -8.389 10.184 -9.602 1.00 0.00 C ATOM 1652 CD1 LEU A 112 -9.355 10.184 -10.816 1.00 0.00 C ATOM 1653 CD2 LEU A 112 -9.032 10.869 -8.409 1.00 0.00 C ATOM 0 H LEU A 112 -8.149 6.091 -8.434 1.00 0.00 H new ATOM 0 HA LEU A 112 -10.082 8.338 -8.989 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.572 8.787 -8.169 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -7.209 8.388 -9.836 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.495 10.721 -9.920 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.606 11.211 -11.081 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -8.873 9.697 -11.664 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -10.265 9.643 -10.557 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -9.322 11.883 -8.684 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.915 10.310 -8.101 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -8.320 10.907 -7.584 1.00 0.00 H new ATOM 1665 N MET A 113 -10.353 6.892 -11.086 1.00 0.00 N ATOM 1666 CA MET A 113 -10.405 6.151 -12.411 1.00 0.00 C ATOM 1667 C MET A 113 -10.262 7.130 -13.498 1.00 0.00 C ATOM 1668 O MET A 113 -10.671 8.247 -13.372 1.00 0.00 O ATOM 1669 CB MET A 113 -11.699 5.368 -12.596 1.00 0.00 C ATOM 1670 CG MET A 113 -11.504 4.261 -13.640 1.00 0.00 C ATOM 1671 SD MET A 113 -12.879 4.301 -14.820 1.00 0.00 S ATOM 1672 CE MET A 113 -13.681 2.761 -14.305 1.00 0.00 C ATOM 0 H MET A 113 -11.251 7.202 -10.716 1.00 0.00 H new ATOM 0 HA MET A 113 -9.592 5.426 -12.424 1.00 0.00 H new ATOM 0 HB2 MET A 113 -12.008 4.932 -11.646 1.00 0.00 H new ATOM 0 HB3 MET A 113 -12.497 6.040 -12.912 1.00 0.00 H new ATOM 0 HG2 MET A 113 -10.557 4.401 -14.162 1.00 0.00 H new ATOM 0 HG3 MET A 113 -11.458 3.288 -13.151 1.00 0.00 H new ATOM 0 HE1 MET A 113 -14.568 2.591 -14.915 1.00 0.00 H new ATOM 0 HE2 MET A 113 -12.988 1.930 -14.432 1.00 0.00 H new ATOM 0 HE3 MET A 113 -13.971 2.834 -13.257 1.00 0.00 H new ATOM 1682 N GLY A 114 -9.635 6.714 -14.558 1.00 0.00 N ATOM 1683 CA GLY A 114 -9.388 7.596 -15.700 1.00 0.00 C ATOM 1684 C GLY A 114 -9.791 6.919 -16.986 1.00 0.00 C ATOM 1685 O GLY A 114 -9.200 5.913 -17.389 1.00 0.00 O ATOM 0 H GLY A 114 -9.276 5.766 -14.672 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -9.948 8.523 -15.579 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -8.332 7.864 -15.738 1.00 0.00 H new ATOM 1773 N GLY A 121 -1.444 10.456 -15.458 1.00 0.00 N ATOM 1774 CA GLY A 121 -0.440 11.311 -14.709 1.00 0.00 C ATOM 1775 C GLY A 121 -1.180 12.477 -14.046 1.00 0.00 C ATOM 1776 O GLY A 121 -0.990 12.761 -12.871 1.00 0.00 O ATOM 0 HA2 GLY A 121 0.076 10.715 -13.956 1.00 0.00 H new ATOM 0 HA3 GLY A 121 0.320 11.687 -15.394 1.00 0.00 H new ATOM 1780 N LEU A 122 -2.060 13.121 -14.797 1.00 0.00 N ATOM 1781 CA LEU A 122 -2.886 14.246 -14.253 1.00 0.00 C ATOM 1782 C LEU A 122 -3.802 13.641 -13.236 1.00 0.00 C ATOM 1783 O LEU A 122 -4.113 14.256 -12.260 1.00 0.00 O ATOM 1784 CB LEU A 122 -3.752 14.927 -15.361 1.00 0.00 C ATOM 1785 CG LEU A 122 -2.976 15.214 -16.692 1.00 0.00 C ATOM 1786 CD1 LEU A 122 -1.492 15.574 -16.444 1.00 0.00 C ATOM 1787 CD2 LEU A 122 -3.080 13.992 -17.618 1.00 0.00 C ATOM 0 H LEU A 122 -2.237 12.905 -15.778 1.00 0.00 H new ATOM 0 HA LEU A 122 -2.232 15.011 -13.835 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -4.608 14.289 -15.582 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -4.147 15.866 -14.973 1.00 0.00 H new ATOM 0 HG LEU A 122 -3.437 16.081 -17.165 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -0.999 15.764 -17.398 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -1.433 16.467 -15.821 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -0.996 14.746 -15.938 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -2.541 14.190 -18.544 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -2.645 13.123 -17.124 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -4.128 13.795 -17.844 1.00 0.00 H new ATOM 1799 N ILE A 123 -4.209 12.391 -13.464 1.00 0.00 N ATOM 1800 CA ILE A 123 -5.074 11.666 -12.500 1.00 0.00 C ATOM 1801 C ILE A 123 -4.262 11.467 -11.251 1.00 0.00 C ATOM 1802 O ILE A 123 -4.770 11.553 -10.180 1.00 0.00 O ATOM 1803 CB ILE A 123 -5.423 10.329 -13.087 1.00 0.00 C ATOM 1804 CG1 ILE A 123 -6.212 10.554 -14.386 1.00 0.00 C ATOM 1805 CG2 ILE A 123 -6.264 9.485 -12.086 1.00 0.00 C ATOM 1806 CD1 ILE A 123 -6.473 9.239 -15.049 1.00 0.00 C ATOM 0 H ILE A 123 -3.963 11.854 -14.296 1.00 0.00 H new ATOM 0 HA ILE A 123 -5.990 12.216 -12.285 1.00 0.00 H new ATOM 0 HB ILE A 123 -4.507 9.777 -13.298 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -7.155 11.056 -14.168 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -5.651 11.205 -15.056 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -6.504 8.521 -12.535 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -5.691 9.327 -11.172 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -7.187 10.015 -11.849 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -7.033 9.401 -15.970 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -5.525 8.754 -15.281 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -7.052 8.603 -14.380 1.00 0.00 H new ATOM 1818 N ASN A 124 -2.964 11.221 -11.410 1.00 0.00 N ATOM 1819 CA ASN A 124 -2.061 11.059 -10.234 1.00 0.00 C ATOM 1820 C ASN A 124 -2.111 12.366 -9.441 1.00 0.00 C ATOM 1821 O ASN A 124 -2.015 12.379 -8.217 1.00 0.00 O ATOM 1822 CB ASN A 124 -0.641 10.782 -10.721 1.00 0.00 C ATOM 1823 CG ASN A 124 0.183 10.152 -9.599 1.00 0.00 C ATOM 1824 OD1 ASN A 124 0.686 10.845 -8.737 1.00 0.00 O ATOM 1825 ND2 ASN A 124 0.348 8.855 -9.576 1.00 0.00 N ATOM 0 H ASN A 124 -2.504 11.128 -12.316 1.00 0.00 H new ATOM 0 HA ASN A 124 -2.373 10.225 -9.605 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -0.667 10.115 -11.583 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -0.173 11.710 -11.050 1.00 0.00 H new ATOM 0 HD21 ASN A 124 0.899 8.424 -8.834 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -0.075 8.274 -10.300 1.00 0.00 H new ATOM 1832 N LYS A 125 -2.310 13.472 -10.151 1.00 0.00 N ATOM 1833 CA LYS A 125 -2.420 14.824 -9.473 1.00 0.00 C ATOM 1834 C LYS A 125 -3.879 15.017 -8.962 1.00 0.00 C ATOM 1835 O LYS A 125 -4.129 15.730 -7.992 1.00 0.00 O ATOM 1836 CB LYS A 125 -2.084 15.914 -10.502 1.00 0.00 C ATOM 1837 CG LYS A 125 -0.563 16.158 -10.531 1.00 0.00 C ATOM 1838 CD LYS A 125 -0.240 17.504 -9.867 1.00 0.00 C ATOM 1839 CE LYS A 125 -0.665 18.656 -10.790 1.00 0.00 C ATOM 1840 NZ LYS A 125 0.511 19.531 -11.058 1.00 0.00 N ATOM 0 H LYS A 125 -2.400 13.495 -11.167 1.00 0.00 H new ATOM 0 HA LYS A 125 -1.731 14.886 -8.631 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -2.432 15.613 -11.490 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -2.604 16.838 -10.249 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -0.046 15.352 -10.010 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -0.204 16.154 -11.560 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -0.758 17.582 -8.911 1.00 0.00 H new ATOM 0 HD3 LYS A 125 0.828 17.569 -9.657 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -1.060 18.261 -11.726 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -1.464 19.234 -10.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 0.227 20.312 -11.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 0.868 19.917 -10.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 1.260 18.975 -11.518 1.00 0.00 H new ATOM 1854 N LYS A 126 -4.832 14.367 -9.618 1.00 0.00 N ATOM 1855 CA LYS A 126 -6.284 14.475 -9.222 1.00 0.00 C ATOM 1856 C LYS A 126 -6.638 13.391 -8.176 1.00 0.00 C ATOM 1857 O LYS A 126 -7.664 13.461 -7.522 1.00 0.00 O ATOM 1858 CB LYS A 126 -7.119 14.354 -10.479 1.00 0.00 C ATOM 1859 CG LYS A 126 -6.748 15.549 -11.365 1.00 0.00 C ATOM 1860 CD LYS A 126 -7.396 15.436 -12.736 1.00 0.00 C ATOM 1861 CE LYS A 126 -6.349 15.075 -13.787 1.00 0.00 C ATOM 1862 NZ LYS A 126 -6.788 15.577 -15.127 1.00 0.00 N ATOM 0 H LYS A 126 -4.659 13.760 -10.420 1.00 0.00 H new ATOM 0 HA LYS A 126 -6.489 15.437 -8.752 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -6.915 13.414 -10.991 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -8.183 14.363 -10.241 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -7.065 16.474 -10.884 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -5.665 15.602 -11.475 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -8.178 14.677 -12.715 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -7.875 16.379 -12.999 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -5.387 15.512 -13.521 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -6.210 13.994 -13.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -6.686 14.819 -15.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -7.784 15.872 -15.078 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -6.199 16.389 -15.404 1.00 0.00 H new ATOM 1876 N CYS A 127 -5.731 12.454 -7.965 1.00 0.00 N ATOM 1877 CA CYS A 127 -5.883 11.409 -6.911 1.00 0.00 C ATOM 1878 C CYS A 127 -5.235 11.993 -5.679 1.00 0.00 C ATOM 1879 O CYS A 127 -5.645 11.749 -4.575 1.00 0.00 O ATOM 1880 CB CYS A 127 -5.149 10.135 -7.302 1.00 0.00 C ATOM 1881 SG CYS A 127 -5.799 8.760 -6.337 1.00 0.00 S ATOM 0 H CYS A 127 -4.868 12.377 -8.503 1.00 0.00 H new ATOM 0 HA CYS A 127 -6.931 11.151 -6.759 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -5.276 9.940 -8.367 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -4.080 10.247 -7.123 1.00 0.00 H new ATOM 0 HG CYS A 127 -6.125 7.786 -7.134 1.00 0.00 H new ATOM 1887 N TYR A 128 -4.223 12.816 -5.906 1.00 0.00 N ATOM 1888 CA TYR A 128 -3.525 13.521 -4.827 1.00 0.00 C ATOM 1889 C TYR A 128 -4.546 14.502 -4.218 1.00 0.00 C ATOM 1890 O TYR A 128 -4.554 14.734 -3.029 1.00 0.00 O ATOM 1891 CB TYR A 128 -2.365 14.284 -5.501 1.00 0.00 C ATOM 1892 CG TYR A 128 -1.187 14.558 -4.591 1.00 0.00 C ATOM 1893 CD1 TYR A 128 -0.883 13.746 -3.480 1.00 0.00 C ATOM 1894 CD2 TYR A 128 -0.374 15.648 -4.900 1.00 0.00 C ATOM 1895 CE1 TYR A 128 0.236 14.043 -2.689 1.00 0.00 C ATOM 1896 CE2 TYR A 128 0.739 15.947 -4.110 1.00 0.00 C ATOM 1897 CZ TYR A 128 1.048 15.148 -3.004 1.00 0.00 C ATOM 1898 OH TYR A 128 2.158 15.444 -2.227 1.00 0.00 O ATOM 0 H TYR A 128 -3.859 13.018 -6.837 1.00 0.00 H new ATOM 0 HA TYR A 128 -3.136 12.868 -4.046 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -2.019 13.710 -6.361 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -2.743 15.233 -5.882 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -1.509 12.899 -3.239 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -0.606 16.265 -5.755 1.00 0.00 H new ATOM 0 HE1 TYR A 128 0.475 13.423 -1.837 1.00 0.00 H new ATOM 0 HE2 TYR A 128 1.361 16.796 -4.353 1.00 0.00 H new ATOM 0 HH TYR A 128 2.606 16.238 -2.586 1.00 0.00 H new ATOM 1908 N GLU A 129 -5.435 15.064 -5.069 1.00 0.00 N ATOM 1909 CA GLU A 129 -6.504 16.030 -4.581 1.00 0.00 C ATOM 1910 C GLU A 129 -7.711 15.240 -3.989 1.00 0.00 C ATOM 1911 O GLU A 129 -8.298 15.633 -2.989 1.00 0.00 O ATOM 1912 CB GLU A 129 -6.984 16.894 -5.755 1.00 0.00 C ATOM 1913 CG GLU A 129 -5.775 17.572 -6.433 1.00 0.00 C ATOM 1914 CD GLU A 129 -5.807 19.081 -6.172 1.00 0.00 C ATOM 1915 OE1 GLU A 129 -5.740 19.465 -5.016 1.00 0.00 O ATOM 1916 OE2 GLU A 129 -5.895 19.827 -7.134 1.00 0.00 O ATOM 0 H GLU A 129 -5.454 14.886 -6.073 1.00 0.00 H new ATOM 0 HA GLU A 129 -6.081 16.667 -3.804 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -7.519 16.278 -6.477 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -7.685 17.650 -5.400 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -4.847 17.148 -6.049 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -5.794 17.380 -7.506 1.00 0.00 H new ATOM 1923 N MET A 130 -8.047 14.109 -4.589 1.00 0.00 N ATOM 1924 CA MET A 130 -9.178 13.233 -4.071 1.00 0.00 C ATOM 1925 C MET A 130 -8.780 12.860 -2.577 1.00 0.00 C ATOM 1926 O MET A 130 -9.563 12.985 -1.599 1.00 0.00 O ATOM 1927 CB MET A 130 -9.202 11.957 -5.034 1.00 0.00 C ATOM 1928 CG MET A 130 -10.635 11.280 -5.260 1.00 0.00 C ATOM 1929 SD MET A 130 -11.766 11.610 -3.908 1.00 0.00 S ATOM 1930 CE MET A 130 -13.248 10.931 -4.723 1.00 0.00 C ATOM 0 H MET A 130 -7.584 13.749 -5.423 1.00 0.00 H new ATOM 0 HA MET A 130 -10.166 13.694 -4.068 1.00 0.00 H new ATOM 0 HB2 MET A 130 -8.803 12.251 -6.005 1.00 0.00 H new ATOM 0 HB3 MET A 130 -8.526 11.205 -4.626 1.00 0.00 H new ATOM 0 HG2 MET A 130 -11.066 11.650 -6.190 1.00 0.00 H new ATOM 0 HG3 MET A 130 -10.512 10.203 -5.373 1.00 0.00 H new ATOM 0 HE1 MET A 130 -14.134 11.199 -4.148 1.00 0.00 H new ATOM 0 HE2 MET A 130 -13.330 11.342 -5.729 1.00 0.00 H new ATOM 0 HE3 MET A 130 -13.167 9.845 -4.780 1.00 0.00 H new ATOM 1940 N ALA A 131 -7.530 12.481 -2.417 1.00 0.00 N ATOM 1941 CA ALA A 131 -6.965 12.135 -1.073 1.00 0.00 C ATOM 1942 C ALA A 131 -6.479 13.388 -0.362 1.00 0.00 C ATOM 1943 O ALA A 131 -6.242 13.349 0.832 1.00 0.00 O ATOM 1944 CB ALA A 131 -5.783 11.195 -1.252 1.00 0.00 C ATOM 0 H ALA A 131 -6.863 12.396 -3.184 1.00 0.00 H new ATOM 0 HA ALA A 131 -7.746 11.661 -0.479 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.369 10.941 -0.276 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -6.114 10.286 -1.754 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -5.017 11.684 -1.855 1.00 0.00 H new ATOM 1950 N SER A 132 -6.330 14.519 -1.071 1.00 0.00 N ATOM 1951 CA SER A 132 -5.873 15.774 -0.379 1.00 0.00 C ATOM 1952 C SER A 132 -6.931 16.125 0.638 1.00 0.00 C ATOM 1953 O SER A 132 -6.617 16.619 1.716 1.00 0.00 O ATOM 1954 CB SER A 132 -5.688 16.948 -1.361 1.00 0.00 C ATOM 1955 OG SER A 132 -6.947 17.337 -1.895 1.00 0.00 O ATOM 0 H SER A 132 -6.504 14.610 -2.072 1.00 0.00 H new ATOM 0 HA SER A 132 -4.902 15.599 0.085 1.00 0.00 H new ATOM 0 HB2 SER A 132 -5.224 17.791 -0.849 1.00 0.00 H new ATOM 0 HB3 SER A 132 -5.016 16.656 -2.168 1.00 0.00 H new ATOM 0 HG SER A 132 -7.550 16.565 -1.907 1.00 0.00 H new ATOM 1961 N HIS A 133 -8.216 15.838 0.320 1.00 0.00 N ATOM 1962 CA HIS A 133 -9.276 16.129 1.313 1.00 0.00 C ATOM 1963 C HIS A 133 -9.316 15.003 2.306 1.00 0.00 C ATOM 1964 O HIS A 133 -9.501 15.249 3.481 1.00 0.00 O ATOM 1965 CB HIS A 133 -10.649 16.326 0.703 1.00 0.00 C ATOM 1966 CG HIS A 133 -11.405 17.245 1.624 1.00 0.00 C ATOM 1967 ND1 HIS A 133 -11.539 18.600 1.376 1.00 0.00 N ATOM 1968 CD2 HIS A 133 -12.032 17.020 2.825 1.00 0.00 C ATOM 1969 CE1 HIS A 133 -12.219 19.135 2.408 1.00 0.00 C ATOM 1970 NE2 HIS A 133 -12.543 18.213 3.318 1.00 0.00 N ATOM 0 H HIS A 133 -8.531 15.430 -0.560 1.00 0.00 H new ATOM 0 HA HIS A 133 -9.024 17.076 1.791 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -10.571 16.757 -0.295 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -11.166 15.372 0.598 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -12.115 16.060 3.312 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -12.471 20.182 2.490 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -13.056 18.355 4.188 1.00 0.00 H new ATOM 1978 N LEU A 134 -9.115 13.736 1.865 1.00 0.00 N ATOM 1979 CA LEU A 134 -9.111 12.610 2.883 1.00 0.00 C ATOM 1980 C LEU A 134 -7.895 12.732 3.813 1.00 0.00 C ATOM 1981 O LEU A 134 -7.841 12.098 4.861 1.00 0.00 O ATOM 1982 CB LEU A 134 -9.114 11.271 2.184 1.00 0.00 C ATOM 1983 CG LEU A 134 -10.531 10.983 1.675 1.00 0.00 C ATOM 1984 CD1 LEU A 134 -10.591 11.160 0.157 1.00 0.00 C ATOM 1985 CD2 LEU A 134 -10.925 9.549 2.045 1.00 0.00 C ATOM 0 H LEU A 134 -8.963 13.461 0.894 1.00 0.00 H new ATOM 0 HA LEU A 134 -10.014 12.685 3.489 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -8.409 11.277 1.353 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -8.792 10.487 2.869 1.00 0.00 H new ATOM 0 HG LEU A 134 -11.226 11.683 2.139 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -11.602 10.953 -0.194 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -10.320 12.184 -0.101 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -9.894 10.470 -0.318 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -11.933 9.344 1.683 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -10.225 8.850 1.587 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -10.898 9.432 3.128 1.00 0.00 H new ATOM 1997 N ARG A 135 -6.957 13.587 3.470 1.00 0.00 N ATOM 1998 CA ARG A 135 -5.769 13.831 4.348 1.00 0.00 C ATOM 1999 C ARG A 135 -6.174 14.929 5.292 1.00 0.00 C ATOM 2000 O ARG A 135 -5.947 14.859 6.493 1.00 0.00 O ATOM 2001 CB ARG A 135 -4.573 14.280 3.512 1.00 0.00 C ATOM 2002 CG ARG A 135 -3.770 13.059 3.072 1.00 0.00 C ATOM 2003 CD ARG A 135 -2.846 12.617 4.210 1.00 0.00 C ATOM 2004 NE ARG A 135 -1.774 13.633 4.406 1.00 0.00 N ATOM 2005 CZ ARG A 135 -0.968 13.538 5.427 1.00 0.00 C ATOM 2006 NH1 ARG A 135 -1.350 13.957 6.599 1.00 0.00 N ATOM 2007 NH2 ARG A 135 0.219 13.020 5.276 1.00 0.00 N ATOM 0 H ARG A 135 -6.966 14.132 2.608 1.00 0.00 H new ATOM 0 HA ARG A 135 -5.475 12.926 4.880 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -4.915 14.837 2.640 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -3.942 14.953 4.093 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -4.444 12.246 2.800 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -3.183 13.297 2.185 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -3.418 12.495 5.130 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -2.405 11.648 3.978 1.00 0.00 H new ATOM 0 HE ARG A 135 -1.671 14.401 3.743 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -2.280 14.359 6.719 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -0.720 13.883 7.398 1.00 0.00 H new ATOM 0 HH21 ARG A 135 0.518 12.689 4.359 1.00 0.00 H new ATOM 0 HH22 ARG A 135 0.849 12.946 6.075 1.00 0.00 H new ATOM 2021 N ARG A 136 -6.852 15.928 4.746 1.00 0.00 N ATOM 2022 CA ARG A 136 -7.380 17.038 5.575 1.00 0.00 C ATOM 2023 C ARG A 136 -8.631 16.542 6.328 1.00 0.00 C ATOM 2024 O ARG A 136 -9.175 17.242 7.170 1.00 0.00 O ATOM 2025 CB ARG A 136 -7.752 18.217 4.673 1.00 0.00 C ATOM 2026 CG ARG A 136 -6.490 19.019 4.324 1.00 0.00 C ATOM 2027 CD ARG A 136 -6.791 20.516 4.410 1.00 0.00 C ATOM 2028 NE ARG A 136 -6.358 21.026 5.737 1.00 0.00 N ATOM 2029 CZ ARG A 136 -5.366 21.864 5.822 1.00 0.00 C ATOM 2030 NH1 ARG A 136 -4.145 21.455 5.615 1.00 0.00 N ATOM 2031 NH2 ARG A 136 -5.596 23.112 6.107 1.00 0.00 N ATOM 0 H ARG A 136 -7.055 16.007 3.750 1.00 0.00 H new ATOM 0 HA ARG A 136 -6.624 17.363 6.290 1.00 0.00 H new ATOM 0 HB2 ARG A 136 -8.228 17.854 3.762 1.00 0.00 H new ATOM 0 HB3 ARG A 136 -8.475 18.859 5.177 1.00 0.00 H new ATOM 0 HG2 ARG A 136 -5.682 18.761 5.009 1.00 0.00 H new ATOM 0 HG3 ARG A 136 -6.151 18.763 3.320 1.00 0.00 H new ATOM 0 HD2 ARG A 136 -6.271 21.050 3.615 1.00 0.00 H new ATOM 0 HD3 ARG A 136 -7.857 20.693 4.269 1.00 0.00 H new ATOM 0 HE ARG A 136 -6.839 20.719 6.582 1.00 0.00 H new ATOM 0 HH11 ARG A 136 -3.967 20.477 5.386 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -3.368 22.113 5.682 1.00 0.00 H new ATOM 0 HH21 ARG A 136 -6.552 23.432 6.263 1.00 0.00 H new ATOM 0 HH22 ARG A 136 -4.820 23.771 6.174 1.00 0.00 H new ATOM 2045 N SER A 137 -9.072 15.314 6.031 1.00 0.00 N ATOM 2046 CA SER A 137 -10.246 14.730 6.704 1.00 0.00 C ATOM 2047 C SER A 137 -9.810 14.218 8.091 1.00 0.00 C ATOM 2048 O SER A 137 -10.629 14.056 8.984 1.00 0.00 O ATOM 2049 CB SER A 137 -10.783 13.569 5.826 1.00 0.00 C ATOM 2050 OG SER A 137 -9.999 12.391 6.025 1.00 0.00 O ATOM 0 H SER A 137 -8.640 14.707 5.335 1.00 0.00 H new ATOM 0 HA SER A 137 -11.037 15.468 6.836 1.00 0.00 H new ATOM 0 HB2 SER A 137 -11.825 13.367 6.076 1.00 0.00 H new ATOM 0 HB3 SER A 137 -10.758 13.857 4.775 1.00 0.00 H new ATOM 0 HG SER A 137 -9.051 12.604 5.901 1.00 0.00 H new ATOM 2056 N GLN A 138 -8.499 13.956 8.267 1.00 0.00 N ATOM 2057 CA GLN A 138 -7.976 13.445 9.588 1.00 0.00 C ATOM 2058 C GLN A 138 -8.383 11.975 9.754 1.00 0.00 C ATOM 2059 O GLN A 138 -8.543 11.481 10.868 1.00 0.00 O ATOM 2060 CB GLN A 138 -8.546 14.284 10.751 1.00 0.00 C ATOM 2061 CG GLN A 138 -7.492 14.412 11.848 1.00 0.00 C ATOM 2062 CD GLN A 138 -6.435 15.428 11.419 1.00 0.00 C ATOM 2063 OE1 GLN A 138 -5.326 15.064 11.084 1.00 0.00 O ATOM 2064 NE2 GLN A 138 -6.736 16.698 11.414 1.00 0.00 N ATOM 0 H GLN A 138 -7.788 14.079 7.546 1.00 0.00 H new ATOM 0 HA GLN A 138 -6.889 13.529 9.602 1.00 0.00 H new ATOM 0 HB2 GLN A 138 -8.836 15.272 10.393 1.00 0.00 H new ATOM 0 HB3 GLN A 138 -9.445 13.812 11.148 1.00 0.00 H new ATOM 0 HG2 GLN A 138 -7.959 14.728 12.781 1.00 0.00 H new ATOM 0 HG3 GLN A 138 -7.027 13.444 12.036 1.00 0.00 H new ATOM 0 HE21 GLN A 138 -7.668 17.002 11.696 1.00 0.00 H new ATOM 0 HE22 GLN A 138 -6.039 17.386 11.128 1.00 0.00 H new ATOM 2073 N TYR A 139 -8.544 11.270 8.642 1.00 0.00 N ATOM 2074 CA TYR A 139 -8.932 9.829 8.699 1.00 0.00 C ATOM 2075 C TYR A 139 -7.671 8.976 8.732 1.00 0.00 C ATOM 2076 O TYR A 139 -6.947 8.987 7.750 1.00 0.00 O ATOM 2077 CB TYR A 139 -9.771 9.474 7.462 1.00 0.00 C ATOM 2078 CG TYR A 139 -11.233 9.416 7.843 1.00 0.00 C ATOM 2079 CD1 TYR A 139 -11.650 8.583 8.890 1.00 0.00 C ATOM 2080 CD2 TYR A 139 -12.168 10.198 7.157 1.00 0.00 C ATOM 2081 CE1 TYR A 139 -13.002 8.537 9.250 1.00 0.00 C ATOM 2082 CE2 TYR A 139 -13.518 10.150 7.517 1.00 0.00 C ATOM 2083 CZ TYR A 139 -13.935 9.321 8.563 1.00 0.00 C ATOM 2084 OH TYR A 139 -15.269 9.277 8.917 1.00 0.00 O ATOM 2085 OXT TYR A 139 -7.448 8.332 9.742 1.00 0.00 O ATOM 0 H TYR A 139 -8.420 11.643 7.701 1.00 0.00 H new ATOM 0 HA TYR A 139 -9.523 9.640 9.595 1.00 0.00 H new ATOM 0 HB2 TYR A 139 -9.617 10.218 6.680 1.00 0.00 H new ATOM 0 HB3 TYR A 139 -9.452 8.514 7.056 1.00 0.00 H new ATOM 0 HD1 TYR A 139 -10.929 7.977 9.419 1.00 0.00 H new ATOM 0 HD2 TYR A 139 -11.847 10.839 6.349 1.00 0.00 H new ATOM 0 HE1 TYR A 139 -13.325 7.897 10.058 1.00 0.00 H new ATOM 0 HE2 TYR A 139 -14.240 10.754 6.987 1.00 0.00 H new ATOM 0 HH TYR A 139 -15.781 9.882 8.341 1.00 0.00 H new